matter.farm

Computer-generated molecule database for public drug discovery. About this project.

These compounds may interact with:

Cathepsin L1

Potentially involved in: carcinoma; fascioliasis; gelatinous drop-like corneal dystrophy; atopic dermatitis; atypical teratoid / rhabdoid tumor; breast cancer; intraductal papillary-mucinous neoplasm (ipmn); lung adenocarcinoma; lung cancer; malignant mesothelioma; non-small cell lung cancer; osteosarcoma; pituitary cancer; psoriasis; spina bifida; ulcerative colitis; chronic hepatitis c

Disease data sourced from Pharos.

Inhibitor

FORMULA:C28H53N5O5

SMILES: CC(C)C[C@H](NC(=O)[C@H](CC(C)C)NC(=O)C(C)(C)C)C(=O)N[C@H](CC(C)C)C(=O)N[C@H](C(N)=O)C(C)C

BIRTHDAY: 2018-12-01T14:10:57.248108
ATC: S01A
- SENSORY ORGANS
- OPHTHALMOLOGICALS
- ANTIINFECTIVES
Synthesis Plan
FORMULA:C24H20Cl2N2O5

SMILES: COc1cccc(C(=O)N[C@H](Cc2ccccc2NC(=O)c2cc(Cl)cc(Cl)c2)C(=O)O)c1

BIRTHDAY: 2018-12-01T14:10:57.259168
ATC: A02B
- ALIMENTARY TRACT AND METABOLISM
- DRUGS FOR ACID RELATED DISORDERS
- DRUGS FOR PEPTIC ULCER AND GASTRO-OESOPHAGEAL REFLUX DISEASE (GORD)
Synthesis Plan
FORMULA:C22H25N7O3

SMILES: CN(C)Cc1nc(C#N)c2nc1OCCCCOCCNC(=O)N2c1ccc(C#N)cc1

BIRTHDAY: 2018-12-01T14:10:57.269748
ATC: N05A
- NERVOUS SYSTEM
- PSYCHOLEPTICS
- ANTIPSYCHOTICS
Synthesis Plan
FORMULA:C30H31ClN4O

SMILES: COc1cccc(-c2cc3cc(c2)[C@@](N)(c2ccccc2)N[C@@H](c2cccc(Cl)c2)CNCCN3)c1

BIRTHDAY: 2018-12-01T14:10:57.280506
ATC: N06A
- NERVOUS SYSTEM
- PSYCHOANALEPTICS
- ANTIDEPRESSANTS
Synthesis Plan
FORMULA:C19H16N4O2

SMILES: N#CCNC(=O)[C@H](Cc1ccccc1)NC(=O)c1cccc(C#N)c1

BIRTHDAY: 2018-12-01T14:10:57.289365
ATC: A02B
- ALIMENTARY TRACT AND METABOLISM
- DRUGS FOR ACID RELATED DISORDERS
- DRUGS FOR PEPTIC ULCER AND GASTRO-OESOPHAGEAL REFLUX DISEASE (GORD)
Synthesis Plan
FORMULA:C19H19N3O2

SMILES: CC(C)(CNC(=O)c1ccccc1)NC(=O)c1ccccc1C#N

BIRTHDAY: 2018-12-01T14:10:57.297089
ATC: A02B
- ALIMENTARY TRACT AND METABOLISM
- DRUGS FOR ACID RELATED DISORDERS
- DRUGS FOR PEPTIC ULCER AND GASTRO-OESOPHAGEAL REFLUX DISEASE (GORD)
Synthesis Plan
FORMULA:C25H24F3N3O7

SMILES: COc1cccc(C(=O)N[C@H](Cc2ccccc2)C(=O)N[C@H](C(=O)C(=O)C(=O)C(F)(F)F)[C@H](C)C(N)=O)c1

BIRTHDAY: 2018-12-01T14:10:57.312043
ATC: S01E
- SENSORY ORGANS
- OPHTHALMOLOGICALS
- ANTIGLAUCOMA PREPARATIONS AND MIOTICS
Synthesis Plan
FORMULA:C43H53N5O6S

SMILES: CC(C)C[C@H](NC(=O)OCc1ccccc1)C(=O)N[C@H](CC(C)C)C(=O)N[C@H](c1nc2cc(n1)-c1cccc(c1)OCCCOc1cccc(c1)S2)C(C)C

BIRTHDAY: 2018-12-01T14:10:57.329341
ATC: D11A
- DERMATOLOGICALS
- OTHER DERMATOLOGICAL PREPARATIONS
- OTHER DERMATOLOGICAL PREPARATIONS
Synthesis Plan
FORMULA:C27H27F3N2O2

SMILES: CC(C)(NC(=O)c1cccc(NC(=O)c2cccc(C(F)(F)F)c2)c1)C(C)(C)c1ccccc1

BIRTHDAY: 2018-12-01T14:10:57.339108
ATC: C10A
- CARDIOVASCULAR SYSTEM
- LIPID MODIFYING AGENTS
- LIPID MODIFYING AGENTS, PLAIN
Synthesis Plan
FORMULA:C30H58N4O4

SMILES: CNC(=O)[C@@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](CC(C)C)NC(=O)[C@H](CC(C)(C)C)C(C)(C)C

BIRTHDAY: 2018-12-01T14:10:57.350963
ATC: C02K
- CARDIOVASCULAR SYSTEM
- ANTIHYPERTENSIVES
- OTHER ANTIHYPERTENSIVES
Synthesis Plan
FORMULA:C28H46N4O5

SMILES: CC(C)C[C@H](NC(=O)OCc1ccccc1)C(=O)N[C@H](CC(C)C)C(=O)N[C@H](CC(C)C)C(=O)N(C)C

BIRTHDAY: 2018-12-01T14:10:57.362192
ATC: G03X
- GENITO URINARY SYSTEM AND SEX HORMONES
- SEX HORMONES AND MODULATORS OF THE GENITAL SYSTEM
- OTHER SEX HORMONES AND MODULATORS OF THE GENITAL SYSTEM
Synthesis Plan
FORMULA:C25H29N5O6

SMILES: CC(C)[C@H](NC(=O)[C@@H](Cc1ccccc1)NC(=O)OCc1ccccc1)C(=O)NCc1nc(=O)o[nH]1

BIRTHDAY: 2018-12-01T14:10:57.373618
ATC: D11A
- DERMATOLOGICALS
- OTHER DERMATOLOGICAL PREPARATIONS
- OTHER DERMATOLOGICAL PREPARATIONS
Synthesis Plan
FORMULA:C23H35N3O3S

SMILES: CC(C)C[C@H](NC(=O)[C@H](C[C@@]12CCC(=O)[C@H](CC1)S2)C(C)C)C(=O)NC1(C#N)CC1

BIRTHDAY: 2018-12-01T14:10:57.382930
ATC: P03A
- ANTIPARASITIC PRODUCTS, INSECTICIDES AND REPELLENTS
- ECTOPARASITICIDES, INCL. SCABICIDES, INSECTICIDES AND REPELLENTS
- ECTOPARASITICIDES, INCL. SCABICIDES
Synthesis Plan
FORMULA:C24H27F3N6O8

SMILES: CC(C)[C@H](NC(=O)c1ccc(C(N)=O)cc1)C(=O)N[C@H](CCCN=C(N)N)C(=O)C(=O)C(=O)C(=O)C(=O)C(F)(F)F

BIRTHDAY: 2018-12-01T14:10:57.396522
ATC: B03B
- BLOOD AND BLOOD FORMING ORGANS
- ANTIANEMIC PREPARATIONS
- VITAMIN B12 AND FOLIC ACID
Synthesis Plan
FORMULA:C26H49N3O3

SMILES: CC(C)C[C@@H](NC(=O)[C@@H](CC(C)(C)C)C(C)C)C(=O)N[C@H](CC(C)C)C(=O)N1CCCC1

BIRTHDAY: 2018-12-01T14:10:57.417429
ATC: N02A
- NERVOUS SYSTEM
- ANALGESICS
- OPIOIDS
Synthesis Plan
FORMULA:C25H25NO5

SMILES: COc1cccc(C(=O)N[C@@H](Cc2ccc(OCCc3ccccc3)cc2)C(=O)O)c1

BIRTHDAY: 2018-12-01T14:10:57.426510
ATC: A02B
- ALIMENTARY TRACT AND METABOLISM
- DRUGS FOR ACID RELATED DISORDERS
- DRUGS FOR PEPTIC ULCER AND GASTRO-OESOPHAGEAL REFLUX DISEASE (GORD)
Synthesis Plan
FORMULA:C22H35N5O3

SMILES: CC(C)[C@H](NC(=O)c1ccc(C(C)(C)C)cc1)C(=O)N[C@@H](C=O)CCCNC(=N)N

BIRTHDAY: 2018-12-25T02:03:00.347239
ATC: N05A
- NERVOUS SYSTEM
- PSYCHOLEPTICS
- ANTIPSYCHOTICS
Synthesis Plan
FORMULA:C10H21N3

SMILES: CC(C)CC1=C(C(C)(C)C)NNN1

BIRTHDAY: 2018-12-25T02:03:00.353082
ATC: S01X
- SENSORY ORGANS
- OPHTHALMOLOGICALS
- OTHER OPHTHALMOLOGICALS
Synthesis Plan
FORMULA:C15H18N2O

SMILES: CC1(NC(=O)c2ccccc2C#N)CCCCC1

BIRTHDAY: 2018-12-25T02:03:00.359773
ATC: A10B
- ALIMENTARY TRACT AND METABOLISM
- DRUGS USED IN DIABETES
- BLOOD GLUCOSE LOWERING DRUGS, EXCL. INSULINS
Synthesis Plan
FORMULA:C25H26N2O3

SMILES: COc1cccc(C(=O)Nc2ccc(C(=O)Nc3ccccc3C(C)(C)C)cc2)c1

BIRTHDAY: 2018-12-25T02:03:00.368659
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C28H27FN4O3

SMILES: N#C[C@@H](CCCNC(=O)c1ccccc1)NC(=O)[C@@H](Cc1ccccc1)NC(=O)c1ccc(F)cc1

BIRTHDAY: 2018-12-25T02:03:00.379903
ATC: V04C
- VARIOUS
- DIAGNOSTIC AGENTS
- OTHER DIAGNOSTIC AGENTS
Synthesis Plan
FORMULA:C19H27N3O3

SMILES: COc1cccc(C(=O)NC(C)(C)CC(=O)N[C@H](C#N)C(C)(C)C)c1

BIRTHDAY: 2018-12-25T02:03:00.387958
ATC: C10B
- CARDIOVASCULAR SYSTEM
- LIPID MODIFYING AGENTS
- LIPID MODIFYING AGENTS, COMBINATIONS
Synthesis Plan
FORMULA:C28H46N4O5

SMILES: CC(C)C[C@H](NC(=O)OCc1ccccc1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N(C)C

BIRTHDAY: 2018-12-25T02:03:00.399499
ATC: G03X
- GENITO URINARY SYSTEM AND SEX HORMONES
- SEX HORMONES AND MODULATORS OF THE GENITAL SYSTEM
- OTHER SEX HORMONES AND MODULATORS OF THE GENITAL SYSTEM
Synthesis Plan
FORMULA:C21H30N2O5

SMILES: CC(C)C[C@H](NC(=O)c1ccccc1C(C)(C)C)C(=O)N[C@]1(O)OCCC1=O

BIRTHDAY: 2018-12-25T02:03:00.408722
ATC: C02K
- CARDIOVASCULAR SYSTEM
- ANTIHYPERTENSIVES
- OTHER ANTIHYPERTENSIVES
Synthesis Plan
FORMULA:C30H49N5O5

SMILES: CC(C)=NN(C)C(=O)[C@@H](CC(C)C)NC(=O)[C@@H](CC(C)C)NC(=O)[C@@H](CC(C)C)NC(=O)OCc1ccccc1

BIRTHDAY: 2018-12-25T02:03:00.420759
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C30H58N4O4

SMILES: CNC(=O)[C@@H](CC(C)C)NC(=O)[C@@H](CC(C)C)NC(=O)[C@@H](CC(C)C)NC(=O)[C@@H](CC(C)(C)C)C(C)(C)C

BIRTHDAY: 2018-12-25T02:03:00.432794
ATC: C02K
- CARDIOVASCULAR SYSTEM
- ANTIHYPERTENSIVES
- OTHER ANTIHYPERTENSIVES
Synthesis Plan
FORMULA:C23H26N4O3

SMILES: CNC(=O)[C@@H](Cc1ccccc1)NC(=O)[C@@H](NC(=O)c1cccc(C#N)c1)C(C)C

BIRTHDAY: 2018-12-25T02:03:00.442381
ATC: V06D
- VARIOUS
- GENERAL NUTRIENTS
- OTHER NUTRIENTS
Synthesis Plan
FORMULA:C22H33N3O4

SMILES: CC(C)CC(CC(C)C)C(=O)N[C@H](CC(C)C)C(=O)c1nnc(-c2ccoc2)o1

BIRTHDAY: 2018-12-25T02:03:00.452178
ATC: C03C
- CARDIOVASCULAR SYSTEM
- DIURETICS
- HIGH-CEILING DIURETICS
Synthesis Plan
FORMULA:C22H30N4O3S

SMILES: CC(C)C[C@H](NC(=O)c1ccccc1)C(=O)N[C@@H](CC(C)C)C(=O)N1C=CC=NS1

BIRTHDAY: 2018-12-25T02:03:00.462447
ATC: C10A
- CARDIOVASCULAR SYSTEM
- LIPID MODIFYING AGENTS
- LIPID MODIFYING AGENTS, PLAIN
Synthesis Plan
FORMULA:C14H11BrFN3S

SMILES: NC(=S)N/N=C(\c1cccc(F)c1)c1ccccc1Br

BIRTHDAY: 2018-12-25T02:03:00.470375
ATC: R05D
- RESPIRATORY SYSTEM
- COUGH AND COLD PREPARATIONS
- COUGH SUPPRESSANTS, EXCL. COMBINATIONS WITH EXPECTORANTS
Synthesis Plan
FORMULA:C18H21N3O4

SMILES: CC(C)C[C@@H](NC(=O)c1ccccc1C#N)C(=O)N[C@H]1CC(=O)CO1

BIRTHDAY: 2018-12-25T02:03:00.479152
ATC: G03B
- GENITO URINARY SYSTEM AND SEX HORMONES
- SEX HORMONES AND MODULATORS OF THE GENITAL SYSTEM
- ANDROGENS
Synthesis Plan
FORMULA:C25H24F3N3O7

SMILES: COc1ccc(C(=O)N[C@@H](Cc2ccccc2)C(=O)N[C@@H](CCC(N)=O)C(=O)C(=O)C(=O)C(F)(F)F)cc1

BIRTHDAY: 2018-12-25T02:03:00.491636
ATC: V04C
- VARIOUS
- DIAGNOSTIC AGENTS
- OTHER DIAGNOSTIC AGENTS
Synthesis Plan
FORMULA:C28H52N4O3

SMILES: CC(C)C[C@H](C#N)NC(=O)[C@@H](CC(C)C)NC(=O)[C@H](NC(=O)[C@@H](CC(C)(C)C)C(C)(C)C)C(C)C

BIRTHDAY: 2018-12-25T02:03:00.502046
ATC: C02K
- CARDIOVASCULAR SYSTEM
- ANTIHYPERTENSIVES
- OTHER ANTIHYPERTENSIVES
Synthesis Plan
FORMULA:C24H28N4O4

SMILES: CC(C)[C@@H](NC(=O)[C@@H](Cc1ccccc1)NC(=O)OCc1ccccc1)C(=O)NCC#N

BIRTHDAY: 2018-12-25T02:03:00.512112
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C31H43N5O5

SMILES: CC(C)C[C@H](NC(=O)c1ccccc1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C(=O)NCc1ccccc1)[C@H](C)C(N)=O

BIRTHDAY: 2018-12-25T02:03:00.524314
ATC: A07D
- ALIMENTARY TRACT AND METABOLISM
- ANTIDIARRHEALS, INTESTINAL ANTIINFLAMMATORY/ANTIINFECTIVE AGENTS
- ANTIPROPULSIVES
Synthesis Plan
FORMULA:C26H42N4O6

SMILES: CC(C)C[C@H](NC(=O)OCc1ccccc1)C(=O)N[C@H](CC(C)C)C(=O)N[C@H](CC(C)C)C(=O)NO

BIRTHDAY: 2018-12-25T02:03:00.535458
ATC: G03X
- GENITO URINARY SYSTEM AND SEX HORMONES
- SEX HORMONES AND MODULATORS OF THE GENITAL SYSTEM
- OTHER SEX HORMONES AND MODULATORS OF THE GENITAL SYSTEM
Synthesis Plan
FORMULA:C22H33N3O4

SMILES: CC(C)CC(CC(C)C)C(=O)N[C@H](CC(C)C)C(=O)c1nnc(-c2ccco2)o1

BIRTHDAY: 2018-12-03T02:39:04.085586
ATC: C03C
- CARDIOVASCULAR SYSTEM
- DIURETICS
- HIGH-CEILING DIURETICS
Synthesis Plan
FORMULA:C24H28N4O4

SMILES: CC(C)[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)OCc1ccccc1)C(=O)NCC#N

BIRTHDAY: 2018-12-03T02:39:04.095665
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C30H49N5O5

SMILES: CC(C)=NN(C)C(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)OCc1ccccc1

BIRTHDAY: 2018-12-03T02:39:04.107696
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C28H46N4O5

SMILES: CC(C)C[C@@H](NC(=O)OCc1ccccc1)C(=O)N[C@H](CC(C)C)C(=O)N[C@H](CC(C)C)C(=O)N(C)C

BIRTHDAY: 2018-12-03T02:39:04.119052
ATC: G03X
- GENITO URINARY SYSTEM AND SEX HORMONES
- SEX HORMONES AND MODULATORS OF THE GENITAL SYSTEM
- OTHER SEX HORMONES AND MODULATORS OF THE GENITAL SYSTEM
Synthesis Plan
FORMULA:C25H44N4O7

SMILES: CC(C)C[C@@H](CC(=O)NO)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C(=O)N1CCC[C@@H]1C(=O)C(C)(C)O

BIRTHDAY: 2018-12-03T02:39:04.131351
ATC: B03X
- BLOOD AND BLOOD FORMING ORGANS
- ANTIANEMIC PREPARATIONS
- OTHER ANTIANEMIC PREPARATIONS
Synthesis Plan
FORMULA:C23H31N7O6S

SMILES: CC(C)[C@H](NC(=O)c1ccccc1C#N)C(=O)N[C@H](C(=O)N[C@H](CC(=O)O)C(N)=O)C(C)(C)NC(N)=S

BIRTHDAY: 2018-12-03T02:39:04.144638
ATC: G02A
- GENITO URINARY SYSTEM AND SEX HORMONES
- OTHER GYNECOLOGICALS
- UTEROTONICS
Synthesis Plan
FORMULA:C25H25NO5

SMILES: COc1ccc(C(=O)N[C@H](Cc2ccc(O[C@@H](C)c3ccccc3)cc2)C(=O)O)cc1

BIRTHDAY: 2018-12-03T02:39:04.154311
ATC: A03A
- ALIMENTARY TRACT AND METABOLISM
- DRUGS FOR FUNCTIONAL GASTROINTESTINAL DISORDERS
- DRUGS FOR FUNCTIONAL GASTROINTESTINAL DISORDERS
Synthesis Plan
FORMULA:C25H41N3O3

SMILES: Cc1cccc(C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C(C)C)c1

BIRTHDAY: 2018-12-03T02:39:04.163424
ATC: B03X
- BLOOD AND BLOOD FORMING ORGANS
- ANTIANEMIC PREPARATIONS
- OTHER ANTIANEMIC PREPARATIONS
Synthesis Plan
FORMULA:C27H32N4O5

SMILES: COc1cccc(C(=O)N[C@H](Cc2ccccc2)C(=O)N[C@H](C(=O)C(=O)NCC#N)[C@H](C)C(C)C)c1

BIRTHDAY: 2018-12-03T02:39:04.176524
ATC: J01M
- ANTIINFECTIVES FOR SYSTEMIC USE
- ANTIBACTERIALS FOR SYSTEMIC USE
- QUINOLONE ANTIBACTERIALS
Synthesis Plan
FORMULA:C26H40N4O5

SMILES: CC(C)C[C@@H](NC(=O)[C@@H]1CCCC=C(C(=O)NCCCCCCC(=O)O)C1)C(=O)NC1(C#N)CC1

BIRTHDAY: 2018-12-03T02:39:04.186933
ATC: L02A
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ENDOCRINE THERAPY
- HORMONES AND RELATED AGENTS
Synthesis Plan
FORMULA:C28H37N3O3

SMILES: CC(C)C[C@H](NC(=O)C1C=CC=CC=C1)C(=O)N[C@H](C[C@H]1NC=C2C=CC=C[C@@H]21)C(=O)C(C)C

BIRTHDAY: 2018-12-03T02:39:04.197338
ATC: V03A
- VARIOUS
- ALL OTHER THERAPEUTIC PRODUCTS
- ALL OTHER THERAPEUTIC PRODUCTS
Synthesis Plan
FORMULA:C22H25N5O2S

SMILES: CC(C)(NC(=S)Nc1cccc(C(=O)Nc2ccccc2C#N)c1)N1CCOCC1

BIRTHDAY: 2018-12-03T02:39:04.206902
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C31H52N4O4

SMILES: CC(C)CC(CC(C)C)C(=O)N[C@H](CC(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@H](Cc1ccccc1)C(N)=O

BIRTHDAY: 2018-12-03T02:39:04.218999
ATC: V08C
- VARIOUS
- CONTRAST MEDIA
- MAGNETIC RESONANCE IMAGING CONTRAST MEDIA
Synthesis Plan
FORMULA:C14H10BrF2N3S

SMILES: NC(=S)N/N=C(/c1ccccc1Br)c1c(F)cccc1F

BIRTHDAY: 2018-12-03T02:39:04.227575
ATC: P02C
- ANTIPARASITIC PRODUCTS, INSECTICIDES AND REPELLENTS
- ANTHELMINTICS
- ANTINEMATODAL AGENTS
Synthesis Plan
FORMULA:C27H46N3O5Sb

SMILES: CC(C)C[C@H](NC(=O)OCc1ccccc1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@H](C[C@@H](C)[SbH2])C(C)(C)O

BIRTHDAY: 2018-12-03T02:39:04.238396
ATC: A11D
- ALIMENTARY TRACT AND METABOLISM
- VITAMINS
- VITAMIN B1, PLAIN AND IN COMBINATION WITH VITAMIN B6 AND B12
Synthesis Plan
FORMULA:C26H42N4O6

SMILES: CC(C)C[C@@H](NC(=O)OCc1ccccc1)C(=O)N[C@H](CC(C)C)C(=O)N[C@H](CC(C)C)C(=O)NO

BIRTHDAY: 2018-12-03T02:39:04.249381
ATC: G03X
- GENITO URINARY SYSTEM AND SEX HORMONES
- SEX HORMONES AND MODULATORS OF THE GENITAL SYSTEM
- OTHER SEX HORMONES AND MODULATORS OF THE GENITAL SYSTEM
Synthesis Plan
FORMULA:C15H15NO2S2

SMILES: CC(C)[C@@]1(C(=O)OCc2ccccc2)SC=C(C#N)S1

BIRTHDAY: 2018-12-03T02:39:04.256727
ATC: N05B
- NERVOUS SYSTEM
- PSYCHOLEPTICS
- ANXIOLYTICS
Synthesis Plan
FORMULA:C27H35N3O3

SMILES: CC(C)C[C@@H](C#N)NC(=O)[C@H](CC(C)(C)C)NC(=O)c1ccc(OCc2ccccc2)cc1

BIRTHDAY: 2018-12-03T02:39:04.265887
ATC: H02C
- SYSTEMIC HORMONAL PREPARATIONS, EXCL. SEX HORMONES AND INSULINS
- CORTICOSTEROIDS FOR SYSTEMIC USE
- ANTIADRENAL PREPARATIONS
Synthesis Plan
FORMULA:C24H28N4O4

SMILES: CC(C)[C@H](NC(=O)[C@@H](Cc1ccccc1)NC(=O)OCc1ccccc1)C(=O)NCC#N

BIRTHDAY: 2018-12-03T02:39:04.275860
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C25H25NO5

SMILES: COc1ccccc1C(=O)N[C@@H](Cc1ccccc1O[C@H](C)c1ccccc1)C(=O)O

BIRTHDAY: 2018-11-30T03:41:01.221763
ATC: P01A
- ANTIPARASITIC PRODUCTS, INSECTICIDES AND REPELLENTS
- ANTIPROTOZOALS
- AGENTS AGAINST AMOEBIASIS AND OTHER PROTOZOAL DISEASES
Synthesis Plan
FORMULA:C27H43N3O6

SMILES: CC(C)C[C@H](CC(=O)OCc1ccccc1)C(=O)N[C@H](CC(C)C)C(=O)N[C@H](CC(C)C)C(=O)NO

BIRTHDAY: 2018-11-30T03:41:01.244564
ATC: G03X
- GENITO URINARY SYSTEM AND SEX HORMONES
- SEX HORMONES AND MODULATORS OF THE GENITAL SYSTEM
- OTHER SEX HORMONES AND MODULATORS OF THE GENITAL SYSTEM
Synthesis Plan
FORMULA:C44H63N7O3

SMILES: CC(C)C[C@H](NC(=O)[C@@H](CC(C)(C)C)C(C)(C)C)C(=O)N[C@@H](CC(C)C)[C@H]1CC=CC(=O)NCc2cccc(c2)Nc2nccc(n2)-c2cccc(c2)N1

BIRTHDAY: 2018-11-30T03:41:01.263412
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C36H50N8O4

SMILES: COc1cccc(C(=O)N[C@@H](Cc2ccccc2)C(=O)N[C@@H](C)[C@@]2(C)[C@H]3NCCNCCNCC[C@@H]4CC[C@@H]([C@H]5NC=N[C@H]5C3=O)N42)c1

BIRTHDAY: 2018-11-30T03:41:01.282677
ATC: J01M
- ANTIINFECTIVES FOR SYSTEMIC USE
- ANTIBACTERIALS FOR SYSTEMIC USE
- QUINOLONE ANTIBACTERIALS
Synthesis Plan
FORMULA:C22H25N3O3

SMILES: COc1ccccc1C(=O)NC(C)(C)[C@@H](C)C(=O)N[C@@H](C#N)c1ccccc1

BIRTHDAY: 2018-11-30T03:41:01.291479
ATC: G03X
- GENITO URINARY SYSTEM AND SEX HORMONES
- SEX HORMONES AND MODULATORS OF THE GENITAL SYSTEM
- OTHER SEX HORMONES AND MODULATORS OF THE GENITAL SYSTEM
Synthesis Plan
FORMULA:C24H27F3N4O4S

SMILES: COc1ccc(C(=O)N[C@H](Cc2ccccc2)C(=O)N[C@H](CCCNC(N)=S)C(=O)C(F)(F)F)cc1

BIRTHDAY: 2018-11-30T03:41:01.303085
ATC: P03A
- ANTIPARASITIC PRODUCTS, INSECTICIDES AND REPELLENTS
- ECTOPARASITICIDES, INCL. SCABICIDES, INSECTICIDES AND REPELLENTS
- ECTOPARASITICIDES, INCL. SCABICIDES
Synthesis Plan
FORMULA:C22H33N3O4

SMILES: CC(C)CC(CC(C)C)C(=O)N[C@@H](CC(C)C)C(=O)c1nnc(-c2ccoc2)o1

BIRTHDAY: 2018-11-30T03:41:01.312887
ATC: C03C
- CARDIOVASCULAR SYSTEM
- DIURETICS
- HIGH-CEILING DIURETICS
Synthesis Plan
FORMULA:C26H33N3O5

SMILES: CNC(=O)C(=O)[C@@H](CCC(C)C)NC(=O)[C@@H](Cc1ccccc1)NC(=O)c1ccc(OC)cc1

BIRTHDAY: 2018-11-30T03:41:01.323346
ATC: A06A
- ALIMENTARY TRACT AND METABOLISM
- DRUGS FOR CONSTIPATION
- DRUGS FOR CONSTIPATION
Synthesis Plan
FORMULA:C26H40N4O6

SMILES: CC(C)C[C@H](NC(=O)OCc1ccccc1)C(=O)N[C@H](CC(C)C)C(=O)NCC(=O)N1CCOCC1

BIRTHDAY: 2018-11-30T03:41:01.334401
ATC: D11A
- DERMATOLOGICALS
- OTHER DERMATOLOGICAL PREPARATIONS
- OTHER DERMATOLOGICAL PREPARATIONS
Synthesis Plan
FORMULA:C21H30N2O5

SMILES: CC(C)C[C@@H](NC(=O)c1ccccc1C(C)(C)C)C(=O)N[C@]1(O)OCCC1=O

BIRTHDAY: 2018-11-30T03:41:01.365840
ATC: C02K
- CARDIOVASCULAR SYSTEM
- ANTIHYPERTENSIVES
- OTHER ANTIHYPERTENSIVES
Synthesis Plan
FORMULA:C25H25NO5

SMILES: COc1ccc(C(=O)N[C@H](Cc2ccc(OCCc3ccccc3)cc2)C(=O)O)cc1

BIRTHDAY: 2018-11-30T03:41:01.374811
ATC: V08C
- VARIOUS
- CONTRAST MEDIA
- MAGNETIC RESONANCE IMAGING CONTRAST MEDIA
Synthesis Plan
FORMULA:C26H39N3O4

SMILES: CC(C)[C@@H](NC(=O)[C@@H](Cc1ccccc1)NC1CC1)C(=O)N[C@H](CC1CCCCC1)C(=O)O

BIRTHDAY: 2018-11-30T03:41:01.384701
ATC: A05A
- ALIMENTARY TRACT AND METABOLISM
- BILE AND LIVER THERAPY
- BILE THERAPY
Synthesis Plan
FORMULA:C23H43N3O6

SMILES: CC(C)C[C@H](CC(=O)NO)C(=O)N[C@@]1(CC(C)C)CCCCOC(=O)CNCCOCC1

BIRTHDAY: 2018-11-30T03:41:01.394806
ATC: C09C
- CARDIOVASCULAR SYSTEM
- AGENTS ACTING ON THE RENIN-ANGIOTENSIN SYSTEM
- ANGIOTENSIN II ANTAGONISTS, PLAIN
Synthesis Plan
FORMULA:C25H25NO5

SMILES: COc1cccc(C(=O)N[C@H](Cc2ccc(OCCc3ccccc3)cc2)C(=O)O)c1

BIRTHDAY: 2018-11-30T03:41:01.403872
ATC: A02B
- ALIMENTARY TRACT AND METABOLISM
- DRUGS FOR ACID RELATED DISORDERS
- DRUGS FOR PEPTIC ULCER AND GASTRO-OESOPHAGEAL REFLUX DISEASE (GORD)
Synthesis Plan
FORMULA:C22H25N3O3

SMILES: COc1ccc(C(=O)NCCCCCC(=O)N[C@@H](C#N)c2ccccc2)cc1

BIRTHDAY: 2018-11-30T03:41:01.412278
ATC: H05B
- SYSTEMIC HORMONAL PREPARATIONS, EXCL. SEX HORMONES AND INSULINS
- CALCIUM HOMEOSTASIS
- ANTI-PARATHYROID AGENTS
Synthesis Plan
FORMULA:C31H52N4O4

SMILES: CC(C)CC(CC(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@H](Cc1ccccc1)C(N)=O

BIRTHDAY: 2018-11-19T08:16:57.869069
ATC: V08C
- VARIOUS
- CONTRAST MEDIA
- MAGNETIC RESONANCE IMAGING CONTRAST MEDIA
Synthesis Plan
FORMULA:C22H37N5O5

SMILES: CC(C)C[C@@H](CC(=O)NO)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C(=O)N1CC[C@@H](C#N)C1

BIRTHDAY: 2018-11-19T08:16:57.880152
ATC: G03X
- GENITO URINARY SYSTEM AND SEX HORMONES
- SEX HORMONES AND MODULATORS OF THE GENITAL SYSTEM
- OTHER SEX HORMONES AND MODULATORS OF THE GENITAL SYSTEM
Synthesis Plan
FORMULA:C25H26N2O3

SMILES: COc1ccccc1C(=O)Nc1ccccc1C(=O)Nc1ccc(C(C)(C)C)cc1

BIRTHDAY: 2018-11-19T08:16:57.889039
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C24H27F3N4O4S

SMILES: COc1cccc(C(=O)N[C@@H](Cc2ccccc2)C(=O)N[C@@H](C(=O)C(F)(F)F)C(C)(C)NC(N)=S)c1

BIRTHDAY: 2018-11-19T08:16:57.902666
ATC: A02B
- ALIMENTARY TRACT AND METABOLISM
- DRUGS FOR ACID RELATED DISORDERS
- DRUGS FOR PEPTIC ULCER AND GASTRO-OESOPHAGEAL REFLUX DISEASE (GORD)
Synthesis Plan
FORMULA:C25H25NO5

SMILES: COc1ccccc1C(=O)N[C@H](Cc1ccc(OCCc2ccccc2)cc1)C(=O)O

BIRTHDAY: 2018-11-19T08:16:57.911909
ATC: V08C
- VARIOUS
- CONTRAST MEDIA
- MAGNETIC RESONANCE IMAGING CONTRAST MEDIA
Synthesis Plan
FORMULA:C28H37N3O4

SMILES: CC(C)C[C@@H](NC(=O)[C@@H](C)Cc1ccc(OCc2ccccc2)cc1)C(=O)N1CCC[C@H]1C(N)=O

BIRTHDAY: 2018-11-19T08:16:57.922629
ATC: G03D
- GENITO URINARY SYSTEM AND SEX HORMONES
- SEX HORMONES AND MODULATORS OF THE GENITAL SYSTEM
- PROGESTOGENS
Synthesis Plan
FORMULA:C23H19F3N2O2

SMILES: C[C@@H](NC(=O)c1cccc(NC(=O)c2cccc(C(F)(F)F)c2)c1)c1ccccc1

BIRTHDAY: 2018-11-19T08:16:57.932014
ATC: M03B
- MUSCULO-SKELETAL SYSTEM
- MUSCLE RELAXANTS
- MUSCLE RELAXANTS, CENTRALLY ACTING AGENTS
Synthesis Plan
FORMULA:C21H23N3O3

SMILES: COc1cccc(C(=O)NCCCCCC(=O)Nc2cccc(C#N)c2)c1

BIRTHDAY: 2018-11-19T08:16:57.940263
ATC: G03D
- GENITO URINARY SYSTEM AND SEX HORMONES
- SEX HORMONES AND MODULATORS OF THE GENITAL SYSTEM
- PROGESTOGENS
Synthesis Plan
FORMULA:C25H27N3O8

SMILES: COc1ccc(C(=O)N[C@@H](Cc2ccccc2)C(=O)N[C@@H](CCC(N)=O)C(=O)C(=O)C(=O)CO)cc1

BIRTHDAY: 2018-11-19T08:16:57.951801
ATC: V04C
- VARIOUS
- DIAGNOSTIC AGENTS
- OTHER DIAGNOSTIC AGENTS
Synthesis Plan
FORMULA:C29H42N6O4

SMILES: CC(C)C[C@@H](NC(=O)c1cc2cc(c1)NCCOCCNCCCN2)C(=O)N[C@@H](Cc1ccccc1)C(N)=O

BIRTHDAY: 2018-11-19T08:16:57.963444
ATC: C02B
- CARDIOVASCULAR SYSTEM
- ANTIHYPERTENSIVES
- ANTIADRENERGIC AGENTS, GANGLION-BLOCKING
Synthesis Plan
FORMULA:C16H16N2O2

SMILES: N#C[C@H]1C[C@@]2(NC(=O)c3ccccc3)C=CCC[C@@H]1O2

BIRTHDAY: 2018-11-19T08:16:57.971194
ATC: J04A
- ANTIINFECTIVES FOR SYSTEMIC USE
- ANTIMYCOBACTERIALS
- DRUGS FOR TREATMENT OF TUBERCULOSIS
Synthesis Plan
FORMULA:C14H22N2

SMILES: CC(C)[C@]12CCC[C@H]3C=CC=N[C@@]3(CC1)N2

BIRTHDAY: 2018-11-19T08:16:57.977501
ATC: N07B
- NERVOUS SYSTEM
- OTHER NERVOUS SYSTEM DRUGS
- DRUGS USED IN ADDICTIVE DISORDERS
Synthesis Plan
FORMULA:C23H40N2O4

SMILES: CC(C)C[C@H](CC(C)(C)C)C(=O)N[C@H](CC(C)C)C(=O)N1CC[C@@H]2OCC(=O)[C@H]21

BIRTHDAY: 2018-11-19T08:16:57.986474
ATC: N07B
- NERVOUS SYSTEM
- OTHER NERVOUS SYSTEM DRUGS
- DRUGS USED IN ADDICTIVE DISORDERS
Synthesis Plan
FORMULA:C30H46N8O4

SMILES: Cc1ccccc1C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C(=O)NC1(C#N)CC1)C(C)(C)NC(=N)N

BIRTHDAY: 2018-11-19T08:16:58.002212
ATC: L01C
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- PLANT ALKALOIDS AND OTHER NATURAL PRODUCTS
Synthesis Plan
FORMULA:C22H37N5O5

SMILES: CC(C)C[C@H](NC(=O)[C@@H](CC(=O)NO)CC(C)C)C(=O)N[C@@H](C)C(=O)N1CCC[C@H]1C#N

BIRTHDAY: 2018-11-19T08:16:58.044961
ATC: G03D
- GENITO URINARY SYSTEM AND SEX HORMONES
- SEX HORMONES AND MODULATORS OF THE GENITAL SYSTEM
- PROGESTOGENS
Synthesis Plan
FORMULA:C26H38N4O7

SMILES: CC(C)C[C@H](NC(=O)OCc1ccccc1)C(=O)N[C@H](C(=O)C(=O)NCC(=O)N1CCOCC1)C(C)C

BIRTHDAY: 2018-11-19T08:16:58.061162
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C24H20Cl2N2O5

SMILES: COc1ccccc1C(=O)N[C@@H](Cc1cccc(NC(=O)c2c(Cl)cccc2Cl)c1)C(=O)O

BIRTHDAY: 2018-11-19T08:16:58.075837
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C26H33N3O5

SMILES: CNC(=O)C(=O)[C@H](CCC(C)C)NC(=O)[C@H](Cc1ccccc1)NC(=O)c1ccc(OC)cc1

BIRTHDAY: 2018-11-19T08:16:58.089255
ATC: A06A
- ALIMENTARY TRACT AND METABOLISM
- DRUGS FOR CONSTIPATION
- DRUGS FOR CONSTIPATION
Synthesis Plan
FORMULA:C24H33N5O6

SMILES: CC(C)C[C@H](NC(=O)OCc1ccccc1)C(=O)N[C@H](CC(C)C)C(=O)NC1=NC(=O)NC(=O)C1

BIRTHDAY: 2018-11-19T08:16:58.100669
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C26H22F3N3O3

SMILES: O=C(Nc1cccc(C(=O)N2CCN(C(=O)c3ccccc3)CC2)c1)c1ccc(C(F)(F)F)cc1

BIRTHDAY: 2018-11-19T08:16:58.111113
ATC: N06A
- NERVOUS SYSTEM
- PSYCHOANALEPTICS
- ANTIDEPRESSANTS
Synthesis Plan
FORMULA:C31H43N5O5

SMILES: CC(C)C[C@H](NC(=O)c1ccccc1)C(=O)N[C@H](CC(C)C)C(=O)N[C@H](CCC(N)=O)C(=O)NCc1ccccc1

BIRTHDAY: 2018-11-19T08:16:58.123381
ATC: H05A
- SYSTEMIC HORMONAL PREPARATIONS, EXCL. SEX HORMONES AND INSULINS
- CALCIUM HOMEOSTASIS
- PARATHYROID HORMONES AND ANALOGUES
Synthesis Plan
FORMULA:C24H36N4O5

SMILES: CC(C)C[C@H](NC(=O)c1ccccc1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@H](C=O)[C@@H](C)C(N)=O

BIRTHDAY: 2018-11-19T08:16:58.133801
ATC: C02C
- CARDIOVASCULAR SYSTEM
- ANTIHYPERTENSIVES
- ANTIADRENERGIC AGENTS, PERIPHERALLY ACTING
Synthesis Plan
FORMULA:C25H44N4O7

SMILES: CC(C)C[C@@H](CC(=O)NO)C(=O)N[C@@H](CC(C)C)C(=O)N[C@H](C)C(=O)N1CCC[C@@H]1C(=O)C(C)(C)O

BIRTHDAY: 2018-11-19T08:16:58.155840
ATC: B03X
- BLOOD AND BLOOD FORMING ORGANS
- ANTIANEMIC PREPARATIONS
- OTHER ANTIANEMIC PREPARATIONS
Synthesis Plan
FORMULA:C21H23N3O3

SMILES: COc1ccccc1C(=O)NC(C)(C)[C@H](C)NC(=O)c1ccccc1C#N

BIRTHDAY: 2018-11-19T08:16:58.164386
ATC: R05D
- RESPIRATORY SYSTEM
- COUGH AND COLD PREPARATIONS
- COUGH SUPPRESSANTS, EXCL. COMBINATIONS WITH EXPECTORANTS
Synthesis Plan
FORMULA:C30H49N5O5

SMILES: CC(C)=NN(C)C(=O)[C@H](CC(C)C)NC(=O)[C@@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)OCc1ccccc1

BIRTHDAY: 2018-11-19T08:16:58.176447
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C25H24F3N3O7

SMILES: COc1ccccc1C(=O)N[C@H](Cc1ccccc1)C(=O)N[C@@H](C(=O)C(=O)C(=O)C(F)(F)F)[C@@H](C)C(N)=O

BIRTHDAY: 2018-11-19T08:16:58.191679
ATC: P01B
- ANTIPARASITIC PRODUCTS, INSECTICIDES AND REPELLENTS
- ANTIPROTOZOALS
- ANTIMALARIALS
Synthesis Plan
FORMULA:C33H43N5O2

SMILES: CC(C)C[C@@H](C#N)NC(=O)[C@@H](CC(C)(C)C)N[C@]12[C@H]3C(=O)[C@@H]4[C@H]1[C@]15CCC[C@]16[C@@H]4[C@@H]3[C@H]([C@H]52)N6Cc1ccncc1

BIRTHDAY: 2018-11-19T08:16:58.203562
ATC: N06A
- NERVOUS SYSTEM
- PSYCHOANALEPTICS
- ANTIDEPRESSANTS
Synthesis Plan
FORMULA:C28H46N4O5

SMILES: CC(C)C[C@H](NC(=O)[C@@H](CC(C)C)NC(=O)[C@@H](CC(C)C)NC(=O)OCc1ccccc1)C(=O)N(C)C

BIRTHDAY: 2018-11-19T08:16:58.224182
ATC: G03X
- GENITO URINARY SYSTEM AND SEX HORMONES
- SEX HORMONES AND MODULATORS OF THE GENITAL SYSTEM
- OTHER SEX HORMONES AND MODULATORS OF THE GENITAL SYSTEM
Synthesis Plan
FORMULA:C24H42N2O4

SMILES: CC(C)C[C@@H](CC(C)(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N1CCC[C@]12OCCC2=O

BIRTHDAY: 2018-11-19T08:16:58.233201
ATC: C09D
- CARDIOVASCULAR SYSTEM
- AGENTS ACTING ON THE RENIN-ANGIOTENSIN SYSTEM
- ANGIOTENSIN II ANTAGONISTS, COMBINATIONS
Synthesis Plan
FORMULA:C24H29N3O5

SMILES: CNC(=O)C(=O)[C@H](NC(=O)[C@@H](Cc1ccccc1)NC(=O)OCc1ccccc1)C(C)C

BIRTHDAY: 2018-11-19T08:16:58.243276
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C22H37N5O5

SMILES: CC(C)C[C@H](NC(=O)[C@@H](CC(=O)NO)CC(C)C)C(=O)N[C@H](C)C(=O)N1CCC[C@@H]1C#N

BIRTHDAY: 2018-11-19T08:16:58.263900
ATC: G03D
- GENITO URINARY SYSTEM AND SEX HORMONES
- SEX HORMONES AND MODULATORS OF THE GENITAL SYSTEM
- PROGESTOGENS
Synthesis Plan
FORMULA:C28H36N4O4

SMILES: COc1ccc(C(=O)N[C@H](Cc2ccccc2)C(=O)N[C@H](CCC(C)C)C(=O)N2C=CNCC2)cc1

BIRTHDAY: 2018-11-19T08:16:58.292373
ATC: V04C
- VARIOUS
- DIAGNOSTIC AGENTS
- OTHER DIAGNOSTIC AGENTS
Synthesis Plan
FORMULA:C14H10BrF2N3S

SMILES: NC(=S)N/N=C(\c1cccc(Br)c1)c1ccc(F)c(F)c1

BIRTHDAY: 2018-11-19T08:16:58.300928
ATC: C02C
- CARDIOVASCULAR SYSTEM
- ANTIHYPERTENSIVES
- ANTIADRENERGIC AGENTS, PERIPHERALLY ACTING
Synthesis Plan
FORMULA:C28H29N3O3

SMILES: COc1cccc(C(=O)N[C@]2(c3ccccc3)C(=O)[C@](N)(c3ccccc3)[C@H]3CCC[C@@H]2N3)c1

BIRTHDAY: 2018-11-19T08:16:58.323051
ATC: M01A
- MUSCULO-SKELETAL SYSTEM
- ANTIINFLAMMATORY AND ANTIRHEUMATIC PRODUCTS
- ANTIINFLAMMATORY AND ANTIRHEUMATIC PRODUCTS, NON-STEROIDS
Synthesis Plan
FORMULA:C25H31N3O5

SMILES: CCNC(=O)C(=O)[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)OCc1ccccc1)C(C)C

BIRTHDAY: 2018-11-19T08:16:58.333080
ATC: C05B
- CARDIOVASCULAR SYSTEM
- VASOPROTECTIVES
- ANTIVARICOSE THERAPY
Synthesis Plan
FORMULA:C23H26N4O3

SMILES: N#Cc1cccc(NC(=O)c2ccc(C(=O)NCCCCN3CCOCC3)cc2)c1

BIRTHDAY: 2018-11-19T08:16:58.342150
ATC: N06A
- NERVOUS SYSTEM
- PSYCHOANALEPTICS
- ANTIDEPRESSANTS
Synthesis Plan
FORMULA:C25H23N3O2

SMILES: C[C@@H](NC(=O)[C@@H](Cc1ccccc1)NC(=O)c1ccccc1C#N)c1ccccc1

BIRTHDAY: 2018-11-19T08:16:58.351545
ATC: G04B
- GENITO URINARY SYSTEM AND SEX HORMONES
- UROLOGICALS
- UROLOGICALS
Synthesis Plan
FORMULA:C22H37N5O5

SMILES: CC(C)C[C@@H](CC(=O)NO)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C(=O)N1CCC[C@H]1C#N

BIRTHDAY: 2018-11-19T08:16:58.362493
ATC: G03D
- GENITO URINARY SYSTEM AND SEX HORMONES
- SEX HORMONES AND MODULATORS OF THE GENITAL SYSTEM
- PROGESTOGENS
Synthesis Plan
FORMULA:C22H37N5O5

SMILES: CC(C)C[C@H](NC(=O)[C@@H](CC(=O)NO)CC(C)C)C(=O)N[C@H](C)C(=O)N1CC[C@H](C#N)C1

BIRTHDAY: 2018-11-19T08:16:58.373500
ATC: G03X
- GENITO URINARY SYSTEM AND SEX HORMONES
- SEX HORMONES AND MODULATORS OF THE GENITAL SYSTEM
- OTHER SEX HORMONES AND MODULATORS OF THE GENITAL SYSTEM
Synthesis Plan
FORMULA:C25H26N2O3

SMILES: COc1ccccc1CNC(=O)[C@H](Cc1ccccc1)NC(=O)c1cccc(C)c1

BIRTHDAY: 2018-11-19T08:16:58.382718
ATC: D03A
- DERMATOLOGICALS
- PREPARATIONS FOR TREATMENT OF WOUNDS AND ULCERS
- CICATRIZANTS
Synthesis Plan
FORMULA:C22H33N3O4

SMILES: CC(C)CC(CC(C)C)C(=O)N[C@@H](CC(C)C)C(=O)c1nnc(-c2ccco2)o1

BIRTHDAY: 2018-11-19T08:16:58.392428
ATC: C03C
- CARDIOVASCULAR SYSTEM
- DIURETICS
- HIGH-CEILING DIURETICS
Synthesis Plan
FORMULA:C25H25NO5

SMILES: COc1ccc(C(=O)N[C@@H](Cc2ccc(OCCc3ccccc3)cc2)C(=O)O)cc1

BIRTHDAY: 2018-11-19T08:16:58.401423
ATC: V08C
- VARIOUS
- CONTRAST MEDIA
- MAGNETIC RESONANCE IMAGING CONTRAST MEDIA
Synthesis Plan
FORMULA:C16H14ClN3O2S

SMILES: Oc1ccc2c(c1)OCC/C2=N\NC(=S)Nc1ccc(Cl)cc1

BIRTHDAY: 2018-11-19T08:16:58.409736
ATC: A14A
- ALIMENTARY TRACT AND METABOLISM
- ANABOLIC AGENTS FOR SYSTEMIC USE
- ANABOLIC STEROIDS
Synthesis Plan
FORMULA:C26H33N3O3

SMILES: CC(C)C[C@H](C#N)NC(=O)[C@@H](CC(C)C)NC(=O)c1ccccc1OCc1ccccc1

BIRTHDAY: 2018-11-19T08:16:58.431350
ATC: G03X
- GENITO URINARY SYSTEM AND SEX HORMONES
- SEX HORMONES AND MODULATORS OF THE GENITAL SYSTEM
- OTHER SEX HORMONES AND MODULATORS OF THE GENITAL SYSTEM
Synthesis Plan
FORMULA:C22H28N2O5

SMILES: COc1ccc(C(=O)NCCCCCC(=O)N[C@H](CO)c2ccc(O)cc2)cc1

BIRTHDAY: 2018-11-19T08:16:58.463068
ATC: L04A
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- IMMUNOSUPPRESSANTS
- IMMUNOSUPPRESSANTS
Synthesis Plan
FORMULA:C21H30N2O5

SMILES: CC(C)C[C@@H](NC(=O)c1ccc(C(C)(C)C)cc1)C(=O)N[C@@H]1CC(=O)O[C@@H]1O

BIRTHDAY: 2018-11-19T08:16:58.472011
ATC: N03A
- NERVOUS SYSTEM
- ANTIEPILEPTICS
- ANTIEPILEPTICS
Synthesis Plan
FORMULA:C26H33N3O5

SMILES: CNC(=O)C(=O)[C@@H](NC(=O)[C@@H](Cc1ccccc1)NC(=O)c1ccccc1OC)[C@@H](C)C(C)C

BIRTHDAY: 2018-11-19T08:16:58.482337
ATC: A07B
- ALIMENTARY TRACT AND METABOLISM
- ANTIDIARRHEALS, INTESTINAL ANTIINFLAMMATORY/ANTIINFECTIVE AGENTS
- INTESTINAL ADSORBENTS
Synthesis Plan
FORMULA:C32H28N4O6

SMILES: O=C(Nc1cccc(C(=O)Nc2ccc([C@H](C(=O)N3CCOCC3)c3ccccc3)cc2)c1)c1ccc([N+](=O)[O-])cc1

BIRTHDAY: 2018-11-19T08:16:58.494637
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C23H46N6O2

SMILES: CC(C)C[C@@H](NC(=O)[C@]1(CC(C)C)C[C@@H]2CNCCNCCNCCN[C@@H]1C2)C(N)=O

BIRTHDAY: 2018-11-19T08:16:58.504518
ATC: N06D
- NERVOUS SYSTEM
- PSYCHOANALEPTICS
- ANTI-DEMENTIA DRUGS
Synthesis Plan
FORMULA:C21H34N4O2S

SMILES: CC(C)C[C@H](N[C@@H]1CCC=CS1)C(=O)N[C@H](C(=O)N1CC[C@H](C#N)C1)C(C)C

BIRTHDAY: 2018-11-19T08:16:58.513888
ATC: P03A
- ANTIPARASITIC PRODUCTS, INSECTICIDES AND REPELLENTS
- ECTOPARASITICIDES, INCL. SCABICIDES, INSECTICIDES AND REPELLENTS
- ECTOPARASITICIDES, INCL. SCABICIDES
Synthesis Plan
FORMULA:C30H58N4O4

SMILES: CNC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)(C)C)C(C)(C)C

BIRTHDAY: 2018-11-19T08:16:58.525826
ATC: C02K
- CARDIOVASCULAR SYSTEM
- ANTIHYPERTENSIVES
- OTHER ANTIHYPERTENSIVES
Synthesis Plan
FORMULA:C25H24F3N3O7

SMILES: COc1ccc(C(=O)N[C@H](Cc2ccccc2)C(=O)N[C@@H](CCC(N)=O)C(=O)C(=O)C(=O)C(F)(F)F)cc1

BIRTHDAY: 2018-11-19T08:16:58.538208
ATC: V04C
- VARIOUS
- DIAGNOSTIC AGENTS
- OTHER DIAGNOSTIC AGENTS
Synthesis Plan
FORMULA:C22H27FN2O4

SMILES: COc1cccc(C(=O)NC(C)(C)[C@@H](C)C(=O)N[C@H](CO)c2ccccc2F)c1

BIRTHDAY: 2018-11-19T08:16:58.547254
ATC: V09X
- VARIOUS
- DIAGNOSTIC RADIOPHARMACEUTICALS
- OTHER DIAGNOSTIC RADIOPHARMACEUTICALS
Synthesis Plan
FORMULA:C25H24F3N3O7

SMILES: COc1ccc(C(=O)N[C@H](Cc2ccccc2)C(=O)N[C@H](CCC(N)=O)C(=O)C(=O)C(=O)C(F)(F)F)cc1

BIRTHDAY: 2018-11-19T08:16:58.569564
ATC: V04C
- VARIOUS
- DIAGNOSTIC AGENTS
- OTHER DIAGNOSTIC AGENTS
Synthesis Plan
FORMULA:C21H30N4O3

SMILES: CNC(=O)[C@@H](CC(C)C)NC(=O)[C@@H](CC(C)C)NC(=O)c1cccc(C#N)c1

BIRTHDAY: 2018-11-19T08:16:58.578548
ATC: A12B
- ALIMENTARY TRACT AND METABOLISM
- MINERAL SUPPLEMENTS
- POTASSIUM
Synthesis Plan
FORMULA:C26H42N4O6

SMILES: CC(C)C[C@H](NC(=O)OCc1ccccc1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(C)C)C(=O)NO

BIRTHDAY: 2018-11-19T08:16:58.589616
ATC: G03X
- GENITO URINARY SYSTEM AND SEX HORMONES
- SEX HORMONES AND MODULATORS OF THE GENITAL SYSTEM
- OTHER SEX HORMONES AND MODULATORS OF THE GENITAL SYSTEM
Synthesis Plan
FORMULA:C30H49N5O5

SMILES: CC(C)=NN(C)C(=O)[C@H](CC(C)C)NC(=O)[C@@H](CC(C)C)NC(=O)[C@@H](CC(C)C)NC(=O)OCc1ccccc1

BIRTHDAY: 2018-11-19T08:16:58.601611
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C24H41N3O2S

SMILES: CC(C)(C)CSCCNC(=O)[C@H]1CC[C@@H]2CC[C@H]3N[C@@H](C#N)C(C)(C)COC[C@@]13C2

BIRTHDAY: 2018-11-19T08:16:58.611325
ATC: A02B
- ALIMENTARY TRACT AND METABOLISM
- DRUGS FOR ACID RELATED DISORDERS
- DRUGS FOR PEPTIC ULCER AND GASTRO-OESOPHAGEAL REFLUX DISEASE (GORD)
Synthesis Plan
FORMULA:C24H27F3N4O4S

SMILES: COc1ccccc1C(=O)N[C@H](Cc1ccccc1)C(=O)N[C@@H](C(=O)C(F)(F)F)C(C)(C)NC(N)=S

BIRTHDAY: 2018-11-19T08:16:58.624904
ATC: A02B
- ALIMENTARY TRACT AND METABOLISM
- DRUGS FOR ACID RELATED DISORDERS
- DRUGS FOR PEPTIC ULCER AND GASTRO-OESOPHAGEAL REFLUX DISEASE (GORD)
Synthesis Plan
FORMULA:C13H17N3OS

SMILES: CC(C)CC1=NS[C@@]23C=CC=C[C@]12CC(=O)NN3

BIRTHDAY: 2018-11-19T08:16:58.632343
ATC: V03A
- VARIOUS
- ALL OTHER THERAPEUTIC PRODUCTS
- ALL OTHER THERAPEUTIC PRODUCTS
Synthesis Plan
FORMULA:C14H11BrFN3S

SMILES: NC(=S)N/N=C(/c1ccccc1F)c1ccccc1Br

BIRTHDAY: 2018-11-19T08:16:58.640449
ATC: N05C
- NERVOUS SYSTEM
- PSYCHOLEPTICS
- HYPNOTICS AND SEDATIVES
Synthesis Plan
FORMULA:C27H44N4O5

SMILES: CNC(=O)[C@@H](CC(C)C)NC(=O)[C@@H](CC(C)C)NC(=O)[C@@H](CC(C)C)NC(=O)OCc1ccccc1

BIRTHDAY: 2018-11-19T08:16:58.651203
ATC: D11A
- DERMATOLOGICALS
- OTHER DERMATOLOGICAL PREPARATIONS
- OTHER DERMATOLOGICAL PREPARATIONS
Synthesis Plan
FORMULA:C28H39NO7

SMILES: COc1ccc(C(=O)N[C@H](Cc2ccccc2)[C@H]2COCCOCCOCCOCC(C)(C)O2)cc1

BIRTHDAY: 2018-11-19T08:16:58.680626
ATC: J04A
- ANTIINFECTIVES FOR SYSTEMIC USE
- ANTIMYCOBACTERIALS
- DRUGS FOR TREATMENT OF TUBERCULOSIS
Synthesis Plan
FORMULA:C27H52N4O5S

SMILES: CC(C)CNC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)N[C@@H]1CCCCS1(=O)=O

BIRTHDAY: 2018-11-30T17:23:23.117390
ATC: S01A
- SENSORY ORGANS
- OPHTHALMOLOGICALS
- ANTIINFECTIVES
Synthesis Plan
FORMULA:C28H49N3O5

SMILES: CC(C)C[C@H](NC(=O)[C@@H](CC(C)(C)C)C(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N1CC[C@H]2OC(=O)C[C@@H]21

BIRTHDAY: 2018-11-30T17:23:23.128723
ATC: A14A
- ALIMENTARY TRACT AND METABOLISM
- ANABOLIC AGENTS FOR SYSTEMIC USE
- ANABOLIC STEROIDS
Synthesis Plan
FORMULA:C21H30N2O5

SMILES: CC(C)C[C@H](NC(=O)c1ccccc1C(C)(C)C)C(=O)N[C@@]1(O)CC(=O)CO1

BIRTHDAY: 2018-11-30T17:23:23.137782
ATC: C08C
- CARDIOVASCULAR SYSTEM
- CALCIUM CHANNEL BLOCKERS
- SELECTIVE CALCIUM CHANNEL BLOCKERS WITH MAINLY VASCULAR EFFECTS
Synthesis Plan
FORMULA:C21H24N2O3

SMILES: COc1ccc(C(=O)NCCCCN2C(=O)CCc3ccccc32)cc1

BIRTHDAY: 2018-11-30T17:23:23.145788
ATC: N06A
- NERVOUS SYSTEM
- PSYCHOANALEPTICS
- ANTIDEPRESSANTS
Synthesis Plan
FORMULA:C48H65N5O3

SMILES: CC(C)C[C@H](NC(=O)[C@H](C[C@H]1c2cccc(c2)CCCCc2ccc3cc(ccc3c2)N2CCCN1CC2)NCc1ccccc1)C(=O)N[C@H](CO)C(C)(C)C

BIRTHDAY: 2018-11-30T17:23:23.160238
ATC: H05B
- SYSTEMIC HORMONAL PREPARATIONS, EXCL. SEX HORMONES AND INSULINS
- CALCIUM HOMEOSTASIS
- ANTI-PARATHYROID AGENTS
Synthesis Plan
FORMULA:C22H41N7O2

SMILES: CN(C)[C@H]1NN=C(C[C@H](C#N)C(=O)NC(C(C)(C)C)C(C)(C)C)N=C1NCC(C)(C)O

BIRTHDAY: 2018-11-30T17:23:23.170268
ATC: R07A
- RESPIRATORY SYSTEM
- OTHER RESPIRATORY SYSTEM PRODUCTS
- OTHER RESPIRATORY SYSTEM PRODUCTS
Synthesis Plan
FORMULA:C24H29N3O5

SMILES: CNC(=O)C(=O)[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)OCc1ccccc1)C(C)C

BIRTHDAY: 2018-11-30T17:23:23.180243
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C26H40N4O6

SMILES: CC(C)C[C@@H](NC(=O)OCc1ccccc1)C(=O)N[C@H](CC(C)C)C(=O)NCC(=O)N1CCOCC1

BIRTHDAY: 2018-11-30T17:23:23.231834
ATC: D11A
- DERMATOLOGICALS
- OTHER DERMATOLOGICAL PREPARATIONS
- OTHER DERMATOLOGICAL PREPARATIONS
Synthesis Plan
FORMULA:C24H28N4O3

SMILES: CNC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CC(C)C)NC(=O)c1cccc(C#N)c1

BIRTHDAY: 2018-11-30T17:23:23.241773
ATC: A12B
- ALIMENTARY TRACT AND METABOLISM
- MINERAL SUPPLEMENTS
- POTASSIUM
Synthesis Plan
FORMULA:C25H27N3O8

SMILES: COc1cccc(C(=O)N[C@@H](Cc2ccccc2)C(=O)N[C@@H](C(=O)C(=O)C(=O)CO)[C@H](C)C(N)=O)c1

BIRTHDAY: 2018-11-30T17:23:23.255667
ATC: A10B
- ALIMENTARY TRACT AND METABOLISM
- DRUGS USED IN DIABETES
- BLOOD GLUCOSE LOWERING DRUGS, EXCL. INSULINS
Synthesis Plan
FORMULA:C27H27F3N2O2

SMILES: O=C(Nc1ccccc1C(=O)NCCCCCCc1ccccc1)c1ccc(C(F)(F)F)cc1

BIRTHDAY: 2018-11-30T17:23:23.277922
ATC: C01C
- CARDIOVASCULAR SYSTEM
- CARDIAC THERAPY
- CARDIAC STIMULANTS EXCL. CARDIAC GLYCOSIDES
Synthesis Plan
FORMULA:C17H20FN3S

SMILES: C=[S@@]1[C@@H](Nc2cccc(F)c2)NC(C)(C)N1c1ccccc1

BIRTHDAY: 2018-12-02T16:06:31.253615
ATC: N05A
- NERVOUS SYSTEM
- PSYCHOLEPTICS
- ANTIPSYCHOTICS
Synthesis Plan
FORMULA:C22H25N3O3

SMILES: COc1ccc(C(=O)NCCCCCC(=O)N[C@H](C#N)c2ccccc2)cc1

BIRTHDAY: 2018-12-02T16:06:31.262106
ATC: H05B
- SYSTEMIC HORMONAL PREPARATIONS, EXCL. SEX HORMONES AND INSULINS
- CALCIUM HOMEOSTASIS
- ANTI-PARATHYROID AGENTS
Synthesis Plan
FORMULA:C21H23N3O3

SMILES: COc1ccccc1C(=O)NC(C)(C)[C@@H](C)C(=O)Nc1ccccc1C#N

BIRTHDAY: 2018-12-02T16:06:31.270659
ATC: G03X
- GENITO URINARY SYSTEM AND SEX HORMONES
- SEX HORMONES AND MODULATORS OF THE GENITAL SYSTEM
- OTHER SEX HORMONES AND MODULATORS OF THE GENITAL SYSTEM
Synthesis Plan
FORMULA:C47H56N6O5

SMILES: CC(C)[C@H](C)NC(=O)[C@H](Cc1cccc(O)c1)NC(=O)C1([C@@H]2Oc3ccccc3Nc3c4[nH]c(c3O2)C2=NC(=Cc3ccc([nH]3)CCCCCCCCC4)C=C2)CC1

BIRTHDAY: 2018-12-02T16:06:31.295638
ATC: J01X
- ANTIINFECTIVES FOR SYSTEMIC USE
- ANTIBACTERIALS FOR SYSTEMIC USE
- OTHER ANTIBACTERIALS
Synthesis Plan
FORMULA:C27H44N4O5

SMILES: CNC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)OCc1ccccc1

BIRTHDAY: 2018-12-02T16:06:31.316209
ATC: D11A
- DERMATOLOGICALS
- OTHER DERMATOLOGICAL PREPARATIONS
- OTHER DERMATOLOGICAL PREPARATIONS
Synthesis Plan
FORMULA:C20H23N3O6

SMILES: CO[C@H]1Oc2ccc([C@@H]3C(=O)O[C@@H]4COCCNC[C@H]4N(C)C=C3C#N)cc2O1

BIRTHDAY: 2018-12-02T16:06:31.326126
ATC: C03D
- CARDIOVASCULAR SYSTEM
- DIURETICS
- POTASSIUM-SPARING AGENTS
Synthesis Plan
FORMULA:C27H35N3O3

SMILES: CC(C)C[C@H](C#N)NC(=O)[C@@H](CC(C)(C)C)NC(=O)c1cccc(OCc2ccccc2)c1

BIRTHDAY: 2018-12-02T16:06:31.355424
ATC: C09D
- CARDIOVASCULAR SYSTEM
- AGENTS ACTING ON THE RENIN-ANGIOTENSIN SYSTEM
- ANGIOTENSIN II ANTAGONISTS, COMBINATIONS
Synthesis Plan
FORMULA:C27H44N4O5

SMILES: CNC(=O)[C@@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](CC(C)C)NC(=O)OCc1ccccc1

BIRTHDAY: 2018-12-02T16:06:31.366222
ATC: D11A
- DERMATOLOGICALS
- OTHER DERMATOLOGICAL PREPARATIONS
- OTHER DERMATOLOGICAL PREPARATIONS
Synthesis Plan
FORMULA:C24H27F3N4O4S

SMILES: COc1ccccc1C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](C(=O)C(F)(F)F)C(C)(C)NC(N)=S

BIRTHDAY: 2018-12-02T16:06:31.379841
ATC: A02B
- ALIMENTARY TRACT AND METABOLISM
- DRUGS FOR ACID RELATED DISORDERS
- DRUGS FOR PEPTIC ULCER AND GASTRO-OESOPHAGEAL REFLUX DISEASE (GORD)
Synthesis Plan
FORMULA:C18H25N5O3S

SMILES: COc1ccc(C(=O)NCCCCCC(=O)N[C@@H](C#N)[C@H]2NNCS2)cc1

BIRTHDAY: 2018-12-02T16:06:31.389528
ATC: G03X
- GENITO URINARY SYSTEM AND SEX HORMONES
- SEX HORMONES AND MODULATORS OF THE GENITAL SYSTEM
- OTHER SEX HORMONES AND MODULATORS OF THE GENITAL SYSTEM
Synthesis Plan
FORMULA:C22H38N2O4

SMILES: CC(C)CC(CC(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N1CC[C@H]2OC(=O)C[C@@H]21

BIRTHDAY: 2018-12-02T16:06:31.399381
ATC: N02A
- NERVOUS SYSTEM
- ANALGESICS
- OPIOIDS
Synthesis Plan
FORMULA:C24H29F3N2O3

SMILES: CC(C)(C)c1ccc(C(=O)NCCCCNC(=O)c2ccc(OCC(F)(F)F)cc2)cc1

BIRTHDAY: 2018-12-02T16:06:31.408803
ATC: G03X
- GENITO URINARY SYSTEM AND SEX HORMONES
- SEX HORMONES AND MODULATORS OF THE GENITAL SYSTEM
- OTHER SEX HORMONES AND MODULATORS OF THE GENITAL SYSTEM
Synthesis Plan
FORMULA:C32H54N6O3

SMILES: CC(C)C[C@H](NC(=O)c1ccccc1)C(=O)N[C@H](CC(C)C)C(=O)N[C@@H](CC(C)C)[C@]1(C)CN[C@H]2CC[C@H]1N[C@@H]2N

BIRTHDAY: 2018-12-02T16:06:31.428602
ATC: G03D
- GENITO URINARY SYSTEM AND SEX HORMONES
- SEX HORMONES AND MODULATORS OF THE GENITAL SYSTEM
- PROGESTOGENS
Synthesis Plan
FORMULA:C29H33N3O4

SMILES: COc1ccc(CNC(=O)CCC(=O)Nc2ccc(C(=O)Nc3ccc(C(C)(C)C)cc3)cc2)cc1

BIRTHDAY: 2018-12-03T10:42:53.067456
ATC: R06A
- RESPIRATORY SYSTEM
- ANTIHISTAMINES FOR SYSTEMIC USE
- ANTIHISTAMINES FOR SYSTEMIC USE
Synthesis Plan
FORMULA:C28H36N4O5

SMILES: CC(C)C[C@@H](NC(=O)OCc1ccccc1)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](C#N)C(C)C

BIRTHDAY: 2018-12-03T10:42:53.088256
ATC: D11A
- DERMATOLOGICALS
- OTHER DERMATOLOGICAL PREPARATIONS
- OTHER DERMATOLOGICAL PREPARATIONS
Synthesis Plan
FORMULA:C25H25NO5

SMILES: COc1cccc(C(=O)N[C@@H](Cc2ccccc2O[C@H](C)c2ccccc2)C(=O)O)c1

BIRTHDAY: 2018-12-03T10:42:53.097897
ATC: M01A
- MUSCULO-SKELETAL SYSTEM
- ANTIINFLAMMATORY AND ANTIRHEUMATIC PRODUCTS
- ANTIINFLAMMATORY AND ANTIRHEUMATIC PRODUCTS, NON-STEROIDS
Synthesis Plan
FORMULA:C45H58N8O5

SMILES: CC(C)C[C@H](NC(=O)OCc1ccccc1)C(=O)N[C@H](CC(C)C)C(=O)N[C@H](CC(C)C)C(=O)N1Cc2cc3[nH]c2[C@H](CC=CCNc2cnc4cccc-3c4n2)C1

BIRTHDAY: 2018-12-03T10:42:53.129428
ATC: A11D
- ALIMENTARY TRACT AND METABOLISM
- VITAMINS
- VITAMIN B1, PLAIN AND IN COMBINATION WITH VITAMIN B6 AND B12
Synthesis Plan
FORMULA:C22H25N5O3

SMILES: CC(C)(NC(=O)c1ccccc1C(=O)Nc1ccccc1C#N)[C@@]1(N)COCCN1

BIRTHDAY: 2018-12-03T10:42:53.139422
ATC: G03X
- GENITO URINARY SYSTEM AND SEX HORMONES
- SEX HORMONES AND MODULATORS OF THE GENITAL SYSTEM
- OTHER SEX HORMONES AND MODULATORS OF THE GENITAL SYSTEM
Synthesis Plan
FORMULA:C25H22F3NO5

SMILES: O=C(N[C@@H](Cc1ccc(OCCc2ccccc2)cc1)C(=O)O)c1ccc(OC(F)(F)F)cc1

BIRTHDAY: 2018-12-03T10:42:53.159678
ATC: M04A
- MUSCULO-SKELETAL SYSTEM
- ANTIGOUT PREPARATIONS
- ANTIGOUT PREPARATIONS
Synthesis Plan
FORMULA:C25H33N5O2

SMILES: C[C@H]1Cc2ccc(OCCN3CCCCC3)cc2NC(C(=O)NCc2ccccn2)=CN1

BIRTHDAY: 2018-12-03T10:42:53.169712
ATC: V08C
- VARIOUS
- CONTRAST MEDIA
- MAGNETIC RESONANCE IMAGING CONTRAST MEDIA
Synthesis Plan
FORMULA:C22H21N5O3

SMILES: COc1ccccc1C(=O)N[C@@H](Cc1ccccc1-n1ccnc1)C(=O)NCC#N

BIRTHDAY: 2018-12-03T10:42:53.189660
ATC: G04C
- GENITO URINARY SYSTEM AND SEX HORMONES
- UROLOGICALS
- DRUGS USED IN BENIGN PROSTATIC HYPERTROPHY
Synthesis Plan
FORMULA:C22H39N5O6

SMILES: CC(C)C[C@H](NC(=O)[C@@H](CC(=O)NO)CC(C)C)C(=O)N[C@H](C)C(=O)N1CCC[C@@H]1C(N)=O

BIRTHDAY: 2018-12-03T10:42:53.201091
ATC: H05B
- SYSTEMIC HORMONAL PREPARATIONS, EXCL. SEX HORMONES AND INSULINS
- CALCIUM HOMEOSTASIS
- ANTI-PARATHYROID AGENTS
Synthesis Plan
FORMULA:C26H34N2O4

SMILES: COc1ccccc1C(=O)NC(C)(C)CC(=O)N[C@H](Cc1ccccc1)C(=O)C(C)(C)C

BIRTHDAY: 2018-12-03T10:42:53.210226
ATC: H03A
- SYSTEMIC HORMONAL PREPARATIONS, EXCL. SEX HORMONES AND INSULINS
- THYROID THERAPY
- THYROID PREPARATIONS
Synthesis Plan
FORMULA:C25H24F3N3O7

SMILES: COc1ccccc1C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](C(=O)C(=O)C(=O)C(F)(F)F)[C@@H](C)C(N)=O

BIRTHDAY: 2018-12-03T10:42:53.235063
ATC: P01B
- ANTIPARASITIC PRODUCTS, INSECTICIDES AND REPELLENTS
- ANTIPROTOZOALS
- ANTIMALARIALS
Synthesis Plan
FORMULA:C23H40N2O4

SMILES: CC(C)C[C@@H](CC(C)(C)C)C(=O)N[C@H](CC(C)C)C(=O)N1CC[C@H]2OCC(=O)[C@H]21

BIRTHDAY: 2018-12-03T10:42:53.273168
ATC: N07B
- NERVOUS SYSTEM
- OTHER NERVOUS SYSTEM DRUGS
- DRUGS USED IN ADDICTIVE DISORDERS
Synthesis Plan
FORMULA:C10H7NO5S

SMILES: O=C1NSOC(O)=C1C(=O)c1ccccc1O

BIRTHDAY: 2018-12-03T19:11:18.086531
ATC: N02B
- NERVOUS SYSTEM
- ANALGESICS
- OTHER ANALGESICS AND ANTIPYRETICS
Synthesis Plan
FORMULA:C28H46N4O5

SMILES: CC(C)C[C@H](NC(=O)OCc1ccccc1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@H](CC(C)C)C(=O)N(C)C

BIRTHDAY: 2018-12-03T19:11:18.097885
ATC: G03X
- GENITO URINARY SYSTEM AND SEX HORMONES
- SEX HORMONES AND MODULATORS OF THE GENITAL SYSTEM
- OTHER SEX HORMONES AND MODULATORS OF THE GENITAL SYSTEM
Synthesis Plan
FORMULA:C26H28N2O3

SMILES: CC(C)(NC(=O)c1cccc(NC(=O)c2cccc(O)c2)c1)C(C)(C)c1ccccc1

BIRTHDAY: 2018-12-03T19:11:18.106656
ATC: C10A
- CARDIOVASCULAR SYSTEM
- LIPID MODIFYING AGENTS
- LIPID MODIFYING AGENTS, PLAIN
Synthesis Plan
FORMULA:C26H38N6O5

SMILES: CC(C)C[C@@H](NC(=O)OCc1ccccc1)C(=O)N[C@H](CC(C)C)C(=O)N[C@H](C=O)CC1=CNCN=N1

BIRTHDAY: 2018-12-03T19:11:18.118294
ATC: N05A
- NERVOUS SYSTEM
- PSYCHOLEPTICS
- ANTIPSYCHOTICS
Synthesis Plan
FORMULA:C21H22F6N2O

SMILES: CN(C)CCCNC(=O)c1ccc([C@@](C)(c2ccc(F)c(F)c2)C(F)(F)F)cc1F

BIRTHDAY: 2018-12-03T19:11:18.128990
ATC: N06A
- NERVOUS SYSTEM
- PSYCHOANALEPTICS
- ANTIDEPRESSANTS
Synthesis Plan
FORMULA:C28H44N4O5

SMILES: CC(C)C[C@H](NC(=O)c1ccccc1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(N)=O)C(=O)C(C)(C)C

BIRTHDAY: 2018-12-03T19:11:18.161540
ATC: A07D
- ALIMENTARY TRACT AND METABOLISM
- ANTIDIARRHEALS, INTESTINAL ANTIINFLAMMATORY/ANTIINFECTIVE AGENTS
- ANTIPROPULSIVES
Synthesis Plan
FORMULA:C25H24F3N3O7

SMILES: COc1ccccc1C(=O)N[C@H](Cc1ccccc1)C(=O)N[C@H](C(=O)C(=O)C(=O)C(F)(F)F)[C@H](C)C(N)=O

BIRTHDAY: 2018-12-03T19:11:18.176579
ATC: P01B
- ANTIPARASITIC PRODUCTS, INSECTICIDES AND REPELLENTS
- ANTIPROTOZOALS
- ANTIMALARIALS
Synthesis Plan
FORMULA:C32H44N8O7

SMILES: CC(C)C[C@@H](NC(=O)c1ccc(C(N)=O)cc1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CO)C(=O)N[C@@H](C=O)Cc1ccccc1

BIRTHDAY: 2018-12-03T19:11:18.200637
ATC: L02B
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ENDOCRINE THERAPY
- HORMONE ANTAGONISTS AND RELATED AGENTS
Synthesis Plan
FORMULA:C14H12BrN3OS

SMILES: NC(=S)N/N=C(\c1ccc(O)cc1)c1cccc(Br)c1

BIRTHDAY: 2018-12-03T19:11:18.209026
ATC: J05A
- ANTIINFECTIVES FOR SYSTEMIC USE
- ANTIVIRALS FOR SYSTEMIC USE
- DIRECT ACTING ANTIVIRALS
Synthesis Plan
FORMULA:C21H30N2O5

SMILES: CC(C)C[C@@H](NC(=O)c1ccc(C(C)(C)C)cc1)C(=O)N[C@H]1CC(=O)O[C@H]1O

BIRTHDAY: 2018-12-03T19:11:18.217905
ATC: N03A
- NERVOUS SYSTEM
- ANTIEPILEPTICS
- ANTIEPILEPTICS
Synthesis Plan
FORMULA:C27H27F3N2O2

SMILES: O=C(NCCCCCCc1ccccc1)c1ccc(NC(=O)c2ccc(C(F)(F)F)cc2)cc1

BIRTHDAY: 2018-12-03T19:11:18.236127
ATC: N06A
- NERVOUS SYSTEM
- PSYCHOANALEPTICS
- ANTIDEPRESSANTS
Synthesis Plan
FORMULA:C21H30N2O5

SMILES: CC(C)C[C@@H](NC(=O)c1ccccc1C(C)(C)C)C(=O)N[C@]1(O)CC(=O)CO1

BIRTHDAY: 2018-12-03T19:11:18.245160
ATC: C08C
- CARDIOVASCULAR SYSTEM
- CALCIUM CHANNEL BLOCKERS
- SELECTIVE CALCIUM CHANNEL BLOCKERS WITH MAINLY VASCULAR EFFECTS
Synthesis Plan
FORMULA:C17H26N2O2

SMILES: COc1ccccc1C1=NON(CC(C)C)[C@H]1C(C)(C)C

BIRTHDAY: 2018-12-01T22:30:22.962943
ATC: N04B
- NERVOUS SYSTEM
- ANTI-PARKINSON DRUGS
- DOPAMINERGIC AGENTS
Synthesis Plan
FORMULA:C26H37N5O5

SMILES: CC(C)C[C@H](NC(=O)c1ccc(C#N)cc1)C(=O)N[C@@H](CC(C)C)C(=O)NCC(=O)N1CCOCC1

BIRTHDAY: 2018-12-01T22:30:22.974158
ATC: N06A
- NERVOUS SYSTEM
- PSYCHOANALEPTICS
- ANTIDEPRESSANTS
Synthesis Plan
FORMULA:C34H49N7O

SMILES: CC(C)C[C@@H](C)N[C@]12C=CCN(C[C@@H]1N1c3cccc(c3)CNCC=CCOC[C@H]3CCCN(C3)c3ccnc1n3)C2

BIRTHDAY: 2018-12-01T22:30:22.997500
ATC: C02K
- CARDIOVASCULAR SYSTEM
- ANTIHYPERTENSIVES
- OTHER ANTIHYPERTENSIVES
Synthesis Plan
FORMULA:C28H40N4O2

SMILES: O=C1CN([C@H](Cc2ccccc2)C(=O)NCCc2ccccc2)CCCCNCCCCCN1

BIRTHDAY: 2018-12-01T22:30:23.007267
ATC: L01C
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- PLANT ALKALOIDS AND OTHER NATURAL PRODUCTS
Synthesis Plan
FORMULA:C21H30N2O5

SMILES: CC(C)C[C@@H](NC(=O)c1ccccc1C(C)(C)C)C(=O)N[C@@]1(O)OCCC1=O

BIRTHDAY: 2018-12-01T22:30:23.027061
ATC: C02K
- CARDIOVASCULAR SYSTEM
- ANTIHYPERTENSIVES
- OTHER ANTIHYPERTENSIVES
Synthesis Plan
FORMULA:C19H17F3N2O3

SMILES: O=C(Nc1ccc(C(=O)N2CCOCC2)cc1)c1ccc(C(F)(F)F)cc1

BIRTHDAY: 2018-12-01T22:30:23.060744
ATC: N06A
- NERVOUS SYSTEM
- PSYCHOANALEPTICS
- ANTIDEPRESSANTS
Synthesis Plan
FORMULA:C42H59N5O5

SMILES: CC(C)C[C@H](NC(=O)[C@@H](NC(=O)[C@@H](CC(C)C)NC(=O)OCc1ccccc1)C(C)C)c1c2cccc1NCOCCc1ccc(cc1)CCNC2

BIRTHDAY: 2018-12-01T22:30:23.076816
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C23H40N2O4

SMILES: CC(C)C[C@H](CC(C)(C)C)C(=O)N[C@H](CC(C)C)C(=O)N1CC[C@@H]2OCC(=O)[C@@H]21

BIRTHDAY: 2018-12-01T22:30:23.086100
ATC: N07B
- NERVOUS SYSTEM
- OTHER NERVOUS SYSTEM DRUGS
- DRUGS USED IN ADDICTIVE DISORDERS
Synthesis Plan
FORMULA:C21H23N3O3

SMILES: COc1cccc(C(=O)NC(C)(C)[C@@H](C)C(=O)Nc2ccccc2C#N)c1

BIRTHDAY: 2018-12-01T22:30:23.115881
ATC: L02B
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ENDOCRINE THERAPY
- HORMONE ANTAGONISTS AND RELATED AGENTS
Synthesis Plan
FORMULA:C25H23N3O4

SMILES: O=C(Nc1ccc(C(=O)N2CCN(C(=O)c3ccccc3)CC2)cc1)c1ccccc1O

BIRTHDAY: 2018-12-01T22:30:23.125575
ATC: N06A
- NERVOUS SYSTEM
- PSYCHOANALEPTICS
- ANTIDEPRESSANTS
Synthesis Plan
FORMULA:C21H23N3O3

SMILES: COc1ccccc1C(=O)NC(C)(C)[C@H](C)C(=O)Nc1ccccc1C#N

BIRTHDAY: 2018-12-01T22:30:23.134140
ATC: G03X
- GENITO URINARY SYSTEM AND SEX HORMONES
- SEX HORMONES AND MODULATORS OF THE GENITAL SYSTEM
- OTHER SEX HORMONES AND MODULATORS OF THE GENITAL SYSTEM
Synthesis Plan
FORMULA:C26H42N4O6

SMILES: CC(C)C[C@H](NC(=O)[C@@H](CC(C)C)NC(=O)[C@@H](CC(C)C)NC(=O)OCc1ccccc1)C(=O)NO

BIRTHDAY: 2018-12-01T22:30:23.145218
ATC: G03X
- GENITO URINARY SYSTEM AND SEX HORMONES
- SEX HORMONES AND MODULATORS OF THE GENITAL SYSTEM
- OTHER SEX HORMONES AND MODULATORS OF THE GENITAL SYSTEM
Synthesis Plan