matter.farm

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

These compounds may interact with:

Macrophage colony-stimulating factor 1 receptor

Potentially involved in: cancer; immune system cancer; brain cancer; hematologic cancer; carcinoma; pigmented villonodular synovitis; congenital myasthenic syndrome 4c; atherosclerosis; pre-eclampsia; osteopetrosis; coronary artery disease; malignant histiocytosis; congenital myasthenic syndrome 6; arthritis; neurodegenerative disease; brain disease; pertussis; apraxias; depressive disorder; gliosis

Disease data sourced from Pharos.

Antagonist

FORMULA:C18H14N4O3

SMILES: COC1=C2C(Nc3ccccc3C#N)=CN=C[C@@]2(C#N)C(O)(O)C=C1

BIRTHDAY: 2018-12-01T14:10:18.504761
ATC: N03A
- NERVOUS SYSTEM
- ANTIEPILEPTICS
- ANTIEPILEPTICS
Synthesis Plan
FORMULA:C28H57NO3

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

BIRTHDAY: 2018-12-01T14:10:18.512746
ATC: V08C
- VARIOUS
- CONTRAST MEDIA
- MAGNETIC RESONANCE IMAGING CONTRAST MEDIA
Synthesis Plan
FORMULA:C26H53NO2

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

BIRTHDAY: 2018-12-01T14:10:18.519857
ATC: N05A
- NERVOUS SYSTEM
- PSYCHOLEPTICS
- ANTIPSYCHOTICS
Synthesis Plan
FORMULA:C26H42N4O5

SMILES: CCCCCCCCc1cc2c(O)c(c1CO)[C@H](CO)NCCn1nnc(c1CO)CCCCO2

BIRTHDAY: 2018-12-01T14:10:18.530264
ATC: V08A
- VARIOUS
- CONTRAST MEDIA
- X-RAY CONTRAST MEDIA, IODINATED
Synthesis Plan
FORMULA:C19H16N4O2

SMILES: COC1(OC)C=CC=C2C=CC(C#N)=N[C@@]21Nc1ccccc1C#N

BIRTHDAY: 2018-12-01T14:10:18.539219
ATC: C07A
- CARDIOVASCULAR SYSTEM
- BETA BLOCKING AGENTS
- BETA BLOCKING AGENTS
Synthesis Plan
FORMULA:C26H53NO3

SMILES: CCCCCCCCCCCCCCCCCCCCCCC(=O)NC(CO)CO

BIRTHDAY: 2018-12-01T14:10:18.546468
ATC: J05A
- ANTIINFECTIVES FOR SYSTEMIC USE
- ANTIVIRALS FOR SYSTEMIC USE
- DIRECT ACTING ANTIVIRALS
Synthesis Plan
FORMULA:C23H24N6O4

SMILES: COc1cc(CNc2c(Nc3ccccc3C#N)ncnc2C(=O)N[C@@H](C)O)cc(OC)c1

BIRTHDAY: 2018-12-01T14:10:18.557483
ATC: L01C
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- PLANT ALKALOIDS AND OTHER NATURAL PRODUCTS
Synthesis Plan
FORMULA:C27H55NO3

SMILES: CC(C)(C)C(C)(C)C(C)(C)C(C)(C)C(C)(C)C(C)(C)C(C)(C)CC(=O)NC(CO)CO

BIRTHDAY: 2018-12-01T14:10:18.565044
ATC: D08A
- DERMATOLOGICALS
- ANTISEPTICS AND DISINFECTANTS
- ANTISEPTICS AND DISINFECTANTS
Synthesis Plan
FORMULA:C23H24N6O4

SMILES: COc1cc(CNc2c(Nc3ccccc3C#N)ncnc2C(=O)N[C@H](C)O)cc(OC)c1

BIRTHDAY: 2018-12-01T14:10:18.575986
ATC: L01C
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- PLANT ALKALOIDS AND OTHER NATURAL PRODUCTS
Synthesis Plan
FORMULA:C17H22N2O3

SMILES: CO[C@@H]1N[C@@H]2OC=C[C@H](C2=O)N1c1ccccc1C(C)(C)C

BIRTHDAY: 2018-12-01T14:10:18.584131
ATC: R07A
- RESPIRATORY SYSTEM
- OTHER RESPIRATORY SYSTEM PRODUCTS
- OTHER RESPIRATORY SYSTEM PRODUCTS
Synthesis Plan
FORMULA:C29H50N6O

SMILES: CN(C)C(C)(C)C(C)(C)C(C)(C)C(C)(C)C(C)(C)C(C)(C)CNC(=O)c1nc2c([nH]1)C=CN[C@@H]2C#N

BIRTHDAY: 2018-12-01T14:10:18.593945
ATC: C07A
- CARDIOVASCULAR SYSTEM
- BETA BLOCKING AGENTS
- BETA BLOCKING AGENTS
Synthesis Plan
FORMULA:C23H22N6O4

SMILES: COc1c(NC(=O)c2ccccc2CNC(=O)c2nc3c([nH]2)NCC=C3)cccc1C(N)=O

BIRTHDAY: 2018-12-01T14:10:18.605313
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C17H16N4O2

SMILES: COC1(OC)C=CC=C2C=NC(Nc3ccc(C#N)cc3)=N[C@H]21

BIRTHDAY: 2018-12-01T14:10:18.613738
ATC: D07A
- DERMATOLOGICALS
- CORTICOSTEROIDS, DERMATOLOGICAL PREPARATIONS
- CORTICOSTEROIDS, PLAIN
Synthesis Plan
FORMULA:C25H29N7O2

SMILES: COc1cccc(CNc2c(Nc3ccccc3C#N)ncnc2C(=O)NC(C)(C)N(C)C)c1

BIRTHDAY: 2018-12-01T14:10:18.624337
ATC: N03A
- NERVOUS SYSTEM
- ANTIEPILEPTICS
- ANTIEPILEPTICS
Synthesis Plan
FORMULA:C26H20F2N4O3

SMILES: COc1cc2ncc(C#N)c(Nc3cc(C(=O)Nc4ccc(F)cc4F)ccc3C)c2cc1OC

BIRTHDAY: 2018-12-01T14:10:18.635156
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C24H27N7O3

SMILES: COc1cccc(CNc2nc(Nc3cccc(C#N)c3)ncc2C(=O)NCCCN)c1OC

BIRTHDAY: 2018-12-25T02:02:20.656151
ATC: C08D
- CARDIOVASCULAR SYSTEM
- CALCIUM CHANNEL BLOCKERS
- SELECTIVE CALCIUM CHANNEL BLOCKERS WITH DIRECT CARDIAC EFFECTS
Synthesis Plan
FORMULA:C23H29N5O3

SMILES: CN(C)C(C)(C)c1cccc(N[C@]23C=CC=C[C@]2(C(N)=O)COCC(=O)CN3)c1C#N

BIRTHDAY: 2018-12-25T02:02:20.666187
ATC: N05A
- NERVOUS SYSTEM
- PSYCHOLEPTICS
- ANTIPSYCHOTICS
Synthesis Plan
FORMULA:C19H15N7O3

SMILES: O=C(Nc1nnc(-c2ccncc2)o1)c1ccc(NCc2cccc[n+]2[O-])cn1

BIRTHDAY: 2018-12-25T02:02:20.676277
ATC: C09A
- CARDIOVASCULAR SYSTEM
- AGENTS ACTING ON THE RENIN-ANGIOTENSIN SYSTEM
- ACE INHIBITORS, PLAIN
Synthesis Plan
FORMULA:C19H14ClN5O2

SMILES: N#Cc1nc[nH]c1C(=O)NCc1cccc(C(=O)Nc2ccccc2Cl)c1

BIRTHDAY: 2018-12-25T02:02:20.685712
ATC: D10A
- DERMATOLOGICALS
- ANTI-ACNE PREPARATIONS
- ANTI-ACNE PREPARATIONS FOR TOPICAL USE
Synthesis Plan
FORMULA:C18H17FN4O4S

SMILES: CCC1=CN(c2ccc(F)c(NC(=O)c3cccc(C(N)=O)c3)c2)S(=O)(=O)N1

BIRTHDAY: 2018-12-25T02:02:20.695826
ATC: C01B
- CARDIOVASCULAR SYSTEM
- CARDIAC THERAPY
- ANTIARRHYTHMICS, CLASS I AND III
Synthesis Plan
FORMULA:C25H21N5O3

SMILES: COc1cc2ncnc(Nc3cccc(CNC(=O)c4cccc(C#N)c4)c3)c2cc1OC

BIRTHDAY: 2018-12-25T02:02:20.705973
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C15H12N4O4

SMILES: N#Cc1ccccc1Nc1ncc2c(n1)C(O)(O)C(O)(O)C=C2

BIRTHDAY: 2018-12-25T02:02:20.714948
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C36H49N5O3

SMILES: CCCCCCCCCCCCCCCc1nc2cccc3c2nc1-c1ccc(O)c2c(O)n(nc12)CCN1CC[C@@H](C1)O3

BIRTHDAY: 2018-12-25T02:02:20.727113
ATC: N06A
- NERVOUS SYSTEM
- PSYCHOANALEPTICS
- ANTIDEPRESSANTS
Synthesis Plan
FORMULA:C24H25F3N4O3

SMILES: NC(=O)c1ccccc1NC(=O)c1ccc(N2C[C@H]3C[C@@H]4C[C@@H](O)[C@@H]3N(C4)C2)c(C(F)(F)F)c1

BIRTHDAY: 2018-12-25T02:02:20.738572
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C21H20N6O2S

SMILES: COc1ccccc1CNc1cncnc1C(=O)Nc1cccc2c1N=CS[C@@H]2N

BIRTHDAY: 2018-12-25T02:02:20.749272
ATC: J01F
- ANTIINFECTIVES FOR SYSTEMIC USE
- ANTIBACTERIALS FOR SYSTEMIC USE
- MACROLIDES, LINCOSAMIDES AND STREPTOGRAMINS
Synthesis Plan
FORMULA:C25H51NO2

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

BIRTHDAY: 2018-12-25T02:02:20.756355
ATC: A07B
- ALIMENTARY TRACT AND METABOLISM
- ANTIDIARRHEALS, INTESTINAL ANTIINFLAMMATORY/ANTIINFECTIVE AGENTS
- INTESTINAL ADSORBENTS
Synthesis Plan
FORMULA:C28H57NO3

SMILES: CCCCCCCCCCCCCCCCCCCCCCCCC(=O)NC(CO)CO

BIRTHDAY: 2018-12-25T02:02:20.763987
ATC: J05A
- ANTIINFECTIVES FOR SYSTEMIC USE
- ANTIVIRALS FOR SYSTEMIC USE
- DIRECT ACTING ANTIVIRALS
Synthesis Plan
FORMULA:C27H55NO3

SMILES: CCCCCCCCCCCCCCCCCCCCCCCC(=O)NC(CO)CO

BIRTHDAY: 2018-12-25T02:02:20.771499
ATC: J05A
- ANTIINFECTIVES FOR SYSTEMIC USE
- ANTIVIRALS FOR SYSTEMIC USE
- DIRECT ACTING ANTIVIRALS
Synthesis Plan
FORMULA:C25H23N5O3

SMILES: COC1(OC)C=CC=C2N=C(Nc3ccccc3CNC(=O)c3ccccc3C#N)N=C[C@H]21

BIRTHDAY: 2018-12-25T02:02:20.781824
ATC: A05B
- ALIMENTARY TRACT AND METABOLISM
- BILE AND LIVER THERAPY
- LIVER THERAPY, LIPOTROPICS
Synthesis Plan
FORMULA:C46H67N3O7S

SMILES: CCCCCC1=CCC[C@@H]2CCC[C@H](CCN(C(=O)[C@@H]3NC(=O)Sc4ccccc43)CCOCCCCC=CCCCCCCC=CC(C(=O)NCC(=O)O)=C1)O2

BIRTHDAY: 2018-12-25T02:02:20.797233
ATC: M03A
- MUSCULO-SKELETAL SYSTEM
- MUSCLE RELAXANTS
- MUSCLE RELAXANTS, PERIPHERALLY ACTING AGENTS
Synthesis Plan
FORMULA:C29H59NO3

SMILES: CCCCCCCCCCCCCCCCCCCCCCCCCC(=O)NC(CO)CO

BIRTHDAY: 2018-12-25T02:02:20.805020
ATC: J05A
- ANTIINFECTIVES FOR SYSTEMIC USE
- ANTIVIRALS FOR SYSTEMIC USE
- DIRECT ACTING ANTIVIRALS
Synthesis Plan
FORMULA:C26H22ClFN4O3

SMILES: COC1=CC=C[C@@H]2C(C#N)=NC=C(Nc3cc(C)cc(C(=O)Nc4cc(F)cc(Cl)c4)c3)[C@]12OC

BIRTHDAY: 2018-12-25T02:02:20.816869
ATC: L01D
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- CYTOTOXIC ANTIBIOTICS AND RELATED SUBSTANCES
Synthesis Plan
FORMULA:C19H31N2O5P

SMILES: CC(C)(C)C(C)(C)C1(c2ccccc2NC(=O)[C@@H](N)COP(=O)(O)O)CC1

BIRTHDAY: 2018-12-25T02:02:20.825853
ATC: M04A
- MUSCULO-SKELETAL SYSTEM
- ANTIGOUT PREPARATIONS
- ANTIGOUT PREPARATIONS
Synthesis Plan
FORMULA:C24H31N5O3

SMILES: COC1(OC)CC=Cc2nc(N[C@H](C)c3ccccc3)nc(N3CCN(C(C)=O)CC3)c21

BIRTHDAY: 2018-12-03T02:38:24.944483
ATC: P01B
- ANTIPARASITIC PRODUCTS, INSECTICIDES AND REPELLENTS
- ANTIPROTOZOALS
- ANTIMALARIALS
Synthesis Plan
FORMULA:C17H26N2O2Se

SMILES: CN(C)C(C)(C)Cc1ccccc1NC(=O)[C@]1(O)CC[Se]C1

BIRTHDAY: 2018-12-03T02:38:24.952161
ATC: C03B
- CARDIOVASCULAR SYSTEM
- DIURETICS
- LOW-CEILING DIURETICS, EXCL. THIAZIDES
Synthesis Plan
FORMULA:C30H61NO2

SMILES: CCCCCCCCCCCCCCCCCCCCCCC[C@H](C)CCC(=O)NCCO

BIRTHDAY: 2018-12-03T02:38:24.959812
ATC: D06B
- DERMATOLOGICALS
- ANTIBIOTICS AND CHEMOTHERAPEUTICS FOR DERMATOLOGICAL USE
- CHEMOTHERAPEUTICS FOR TOPICAL USE
Synthesis Plan
FORMULA:C27H55NO2

SMILES: CCCCCCCCCCCCCCCCCCCCCCCCC(=O)NCCO

BIRTHDAY: 2018-12-03T02:38:24.966562
ATC: S01A
- SENSORY ORGANS
- OPHTHALMOLOGICALS
- ANTIINFECTIVES
Synthesis Plan
FORMULA:C27H55NO2

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

BIRTHDAY: 2018-12-03T02:38:24.973864
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:C27H44N2O6Si

SMILES: CCCCCCCCCCC[C@@H]1[SiH2][C@H](OC(=O)c2cccc(C(N)=O)c2)CN(C(=O)COC)[C@H]1CO

BIRTHDAY: 2018-12-03T02:38:24.984142
ATC: C09A
- CARDIOVASCULAR SYSTEM
- AGENTS ACTING ON THE RENIN-ANGIOTENSIN SYSTEM
- ACE INHIBITORS, PLAIN
Synthesis Plan
FORMULA:C24H21N5O4

SMILES: COC1=C2C=NC(Nc3ccccc3CNC(=O)c3ccccc3C#N)=N[C@@H]2C(O)(O)C=C1

BIRTHDAY: 2018-12-03T02:38:24.994317
ATC: N02C
- NERVOUS SYSTEM
- ANALGESICS
- ANTIMIGRAINE PREPARATIONS
Synthesis Plan
FORMULA:C30H59N3O5

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

BIRTHDAY: 2018-12-03T02:38:25.003972
ATC: L02B
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ENDOCRINE THERAPY
- HORMONE ANTAGONISTS AND RELATED AGENTS
Synthesis Plan
FORMULA:C20H17F3N6O2S

SMILES: CS(=O)(=O)Nc1ccc(CNc2c(Nc3ccccc3C#N)ncnc2C(F)(F)F)cc1

BIRTHDAY: 2018-12-03T02:38:25.014717
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C21H21N3OS

SMILES: CN(C)CCCc1ccc(NC(=O)c2cc3ccccc3s2)c(C#N)c1

BIRTHDAY: 2018-12-03T02:38:25.022537
ATC: N02C
- NERVOUS SYSTEM
- ANALGESICS
- ANTIMIGRAINE PREPARATIONS
Synthesis Plan
FORMULA:C26H53NO3

SMILES: CC(C)(C)C(C)(C)C(C)(C)C(C)(C)C(C)(C)C(C)(C)C(C)(C)C(=O)NC(CO)CO

BIRTHDAY: 2018-12-03T02:38:25.036759
ATC: C10A
- CARDIOVASCULAR SYSTEM
- LIPID MODIFYING AGENTS
- LIPID MODIFYING AGENTS, PLAIN
Synthesis Plan
FORMULA:C21H22FN5O

SMILES: CN(C)CCCCc1ccc(NC(=O)c2cnc3ccc(C#N)cn23)c(F)c1

BIRTHDAY: 2018-12-03T02:38:25.045531
ATC: C01B
- CARDIOVASCULAR SYSTEM
- CARDIAC THERAPY
- ANTIARRHYTHMICS, CLASS I AND III
Synthesis Plan
FORMULA:C18H14N4O3

SMILES: CO[C@@]12C=C(Nc3ccccc3C#N)C(C#N)=NC1=CC=CC2(O)O

BIRTHDAY: 2018-12-03T02:38:25.054898
ATC: N05A
- NERVOUS SYSTEM
- PSYCHOLEPTICS
- ANTIPSYCHOTICS
Synthesis Plan
FORMULA:C18H14N4O3

SMILES: COC1=CCC(O)(O)c2c(Nc3ccccc3C#N)cnc(C#N)c21

BIRTHDAY: 2018-12-03T02:38:25.063413
ATC: J05A
- ANTIINFECTIVES FOR SYSTEMIC USE
- ANTIVIRALS FOR SYSTEMIC USE
- DIRECT ACTING ANTIVIRALS
Synthesis Plan
FORMULA:C27H36N2O

SMILES: CCCCC[C@@H]1c2cccc(c2)CCN(c2ccc(OC)cc2)CCCC[C@@H]1C#N

BIRTHDAY: 2018-12-03T02:38:25.071169
ATC: N07B
- NERVOUS SYSTEM
- OTHER NERVOUS SYSTEM DRUGS
- DRUGS USED IN ADDICTIVE DISORDERS
Synthesis Plan
FORMULA:C25H23F3N6O

SMILES: N#C[C@]1(Nc2c(N3CCNC[C@@H]3N)cccc2C(F)(F)F)CN=Cc2cccc(-c3ccoc3)c21

BIRTHDAY: 2018-12-03T02:38:25.086294
ATC: N06A
- NERVOUS SYSTEM
- PSYCHOANALEPTICS
- ANTIDEPRESSANTS
Synthesis Plan
FORMULA:C37H71N3O4

SMILES: C[C@H](C(=O)N[C@H]([C@H]1C=NC1)[C@@H]1COCCOCCNCCO1)C(C)(C)C(C)(C)C(C)(C)C(C)(C)C(C)(C)C(C)(C)C(C)(C)C

BIRTHDAY: 2018-12-03T02:38:25.097919
ATC: A02B
- ALIMENTARY TRACT AND METABOLISM
- DRUGS FOR ACID RELATED DISORDERS
- DRUGS FOR PEPTIC ULCER AND GASTRO-OESOPHAGEAL REFLUX DISEASE (GORD)
Synthesis Plan
FORMULA:C27H55NO2

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

BIRTHDAY: 2018-12-03T02:38:25.105563
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:C30H61NO3

SMILES: CCCCCCCCCCCCCCCCCCCCCCCCCCC(=O)NC(CO)CO

BIRTHDAY: 2018-11-30T03:40:21.217581
ATC: J05A
- ANTIINFECTIVES FOR SYSTEMIC USE
- ANTIVIRALS FOR SYSTEMIC USE
- DIRECT ACTING ANTIVIRALS
Synthesis Plan
FORMULA:C18H21N3O2

SMILES: COC1(OC)C=CC=C2N=C(N[C@@H](C)c3ccccc3)N=C[C@@H]21

BIRTHDAY: 2018-11-30T03:40:21.240674
ATC: V08A
- VARIOUS
- CONTRAST MEDIA
- X-RAY CONTRAST MEDIA, IODINATED
Synthesis Plan
FORMULA:C22H32N4O6

SMILES: CC(C)[C@@]1(C(=O)N[C@H](C#N)C(N)=O)CCCCCCCCC=CC(=O)[C@@]2(NCC(=O)O2)O1

BIRTHDAY: 2018-11-30T03:40:21.251986
ATC: P03B
- ANTIPARASITIC PRODUCTS, INSECTICIDES AND REPELLENTS
- ECTOPARASITICIDES, INCL. SCABICIDES, INSECTICIDES AND REPELLENTS
- INSECTICIDES AND REPELLENTS
Synthesis Plan
FORMULA:C21H21N5O4

SMILES: COc1ccc(CNc2ncncc2C(=O)Nc2cccc(C(N)=O)c2)cc1OC

BIRTHDAY: 2018-11-30T03:40:21.262455
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C25H29N7O2

SMILES: COc1ccccc1CNc1nc(Nc2cccc(C#N)c2)ncc1C(=O)NCCCN(C)C

BIRTHDAY: 2018-11-30T03:40:21.272749
ATC: A10B
- ALIMENTARY TRACT AND METABOLISM
- DRUGS USED IN DIABETES
- BLOOD GLUCOSE LOWERING DRUGS, EXCL. INSULINS
Synthesis Plan
FORMULA:C27H48N2S

SMILES: CC(C)(C)C(C)(C)C(C)(C)C(C)(C)C(C)(C)C(C)(C)[C@]12C=CC=CC1=N[C@@H](N)CS2

BIRTHDAY: 2018-11-30T03:40:21.281097
ATC: J05A
- ANTIINFECTIVES FOR SYSTEMIC USE
- ANTIVIRALS FOR SYSTEMIC USE
- DIRECT ACTING ANTIVIRALS
Synthesis Plan
FORMULA:C42H57N5O2S

SMILES: CN(C)CCCCc1ccc(NC(=O)c2cc3ccccc3s2)c(C(=O)Nc2ccc([C@H]3CCCCCCCCNCCNCCC3)cc2)c1

BIRTHDAY: 2018-11-30T03:40:21.294213
ATC: H02A
- SYSTEMIC HORMONAL PREPARATIONS, EXCL. SEX HORMONES AND INSULINS
- CORTICOSTEROIDS FOR SYSTEMIC USE
- CORTICOSTEROIDS FOR SYSTEMIC USE, PLAIN
Synthesis Plan
FORMULA:C37H61N3O3

SMILES: C[C@H](C(C)(C)C(C)(C)C(C)(C)C(C)(C)C(C)(C)C)[C@@]1(NC(=O)c2cccc(OCC(N)=O)c2)[C@H]2CCN3[C@@H](CCC[C@H]31)C2

BIRTHDAY: 2018-11-30T03:40:21.305571
ATC: J05A
- ANTIINFECTIVES FOR SYSTEMIC USE
- ANTIVIRALS FOR SYSTEMIC USE
- DIRECT ACTING ANTIVIRALS
Synthesis Plan
FORMULA:C28H41N3O

SMILES: CCCCCCCCCCCC[C@]12CC[C@@H](N1)[C@@H]1CC[C@H]2N1C(=O)c1ccc(C#N)cc1

BIRTHDAY: 2018-11-30T03:40:21.314406
ATC: D03A
- DERMATOLOGICALS
- PREPARATIONS FOR TREATMENT OF WOUNDS AND ULCERS
- CICATRIZANTS
Synthesis Plan
FORMULA:C41H69N5O5

SMILES: CC(C)(C)NC(=O)[C@]12N=CN[C@H]1N[C@@](CO)(C(N)=O)CCC(=O)CCOc1ccc2cc1C(C)(C)C(C)(C)C(C)(C)C(C)(C)C(C)(C)C(C)(C)C

BIRTHDAY: 2018-11-30T03:40:21.337762
ATC: V08C
- VARIOUS
- CONTRAST MEDIA
- MAGNETIC RESONANCE IMAGING CONTRAST MEDIA
Synthesis Plan
FORMULA:C34H40N4O2S

SMILES: CN(C)C(C)(C)Cc1c(NC(=O)[C@@]23C=CC=CC2=CSC3)cccc1C(=O)Nc1ccc2c(c1)[C@H]1CCC[C@@H](C2)N1

BIRTHDAY: 2018-11-30T03:40:21.354273
ATC: R05D
- RESPIRATORY SYSTEM
- COUGH AND COLD PREPARATIONS
- COUGH SUPPRESSANTS, EXCL. COMBINATIONS WITH EXPECTORANTS
Synthesis Plan
FORMULA:C30H50O3

SMILES: C[C@H](C1=C[C@H](C23CCC(C(=O)O)(CC2)O3)C=C1)C(C)(C)C(C)(C)C(C)(C)C(C)(C)C(C)(C)C

BIRTHDAY: 2018-11-30T03:40:21.362812
ATC: M04A
- MUSCULO-SKELETAL SYSTEM
- ANTIGOUT PREPARATIONS
- ANTIGOUT PREPARATIONS
Synthesis Plan
FORMULA:C24H21N7O2S

SMILES: CS(=O)(=O)Nc1ccc(CNc2cc(Nc3ccc(C#N)cc3)nc(-c3ccncc3)n2)cc1

BIRTHDAY: 2018-11-30T03:40:21.373940
ATC: N07B
- NERVOUS SYSTEM
- OTHER NERVOUS SYSTEM DRUGS
- DRUGS USED IN ADDICTIVE DISORDERS
Synthesis Plan
FORMULA:C28H29N9O2

SMILES: COc1ccc(C(=O)Nc2ccc(CNc3cnc(-c4n[nH]cc4N)nc3-n3nc(C)c(C)c3C)cc2)cc1

BIRTHDAY: 2018-11-19T08:17:11.331200
ATC: C03C
- CARDIOVASCULAR SYSTEM
- DIURETICS
- HIGH-CEILING DIURETICS
Synthesis Plan
FORMULA:C30H48O2

SMILES: C[C@H](C(=O)O)C1=CC2=C(C=CC=CC2)[C@@]1(C)C(C)(C)C(C)(C)C(C)(C)C(C)(C)C(C)(C)C

BIRTHDAY: 2018-11-19T08:17:11.339600
ATC: L01D
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- CYTOTOXIC ANTIBIOTICS AND RELATED SUBSTANCES
Synthesis Plan
FORMULA:C19H18N4O4

SMILES: COC1=Cc2c(C#N)ncc(Nc3c(C)cccc3C(N)=O)c2C(O)(O)C1

BIRTHDAY: 2018-11-19T08:17:11.349254
ATC: M01A
- MUSCULO-SKELETAL SYSTEM
- ANTIINFLAMMATORY AND ANTIRHEUMATIC PRODUCTS
- ANTIINFLAMMATORY AND ANTIRHEUMATIC PRODUCTS, NON-STEROIDS
Synthesis Plan
FORMULA:C28H44O2

SMILES: C[C@H](C(=O)O)C1([C@H](C)C(C)(C)C(C)(C)C(C)(C)C(C)(C)C)C=C2C=CCC=CC2=C1

BIRTHDAY: 2018-11-19T08:17:11.357228
ATC: C08C
- CARDIOVASCULAR SYSTEM
- CALCIUM CHANNEL BLOCKERS
- SELECTIVE CALCIUM CHANNEL BLOCKERS WITH MAINLY VASCULAR EFFECTS
Synthesis Plan
FORMULA:C32H57NO5S

SMILES: CCCCCCCCCCCCCCCCCCCCCCC[C@H]1O[C@H]2SC[C@@](C(=O)OC)(C1=O)[C@@H]2C(N)=O

BIRTHDAY: 2018-11-19T08:17:11.368253
ATC: B01A
- BLOOD AND BLOOD FORMING ORGANS
- ANTITHROMBOTIC AGENTS
- ANTITHROMBOTIC AGENTS
Synthesis Plan
FORMULA:C24H21N7O2S

SMILES: CS(=O)(=O)Nc1ccc(CNc2c(Nc3ccccc3C#N)ncnc2-c2ccccn2)cc1

BIRTHDAY: 2018-11-19T08:17:11.379315
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C40H71NO5

SMILES: CCCCCCCCCCCCCCCCCCCCCCCCCCCCCC(=O)Nc1cc(OC)c(OC(C)=O)c(OC)c1

BIRTHDAY: 2018-11-19T08:17:11.389902
ATC: N02B
- NERVOUS SYSTEM
- ANALGESICS
- OTHER ANALGESICS AND ANTIPYRETICS
Synthesis Plan
FORMULA:C28H44O2

SMILES: C[C@H](C1=C2CC=CC=C[C@]2([C@@H](C)C(=O)O)C=C1)C(C)(C)C(C)(C)C(C)(C)C(C)(C)C

BIRTHDAY: 2018-11-19T08:17:11.412143
ATC: C10A
- CARDIOVASCULAR SYSTEM
- LIPID MODIFYING AGENTS
- LIPID MODIFYING AGENTS, PLAIN
Synthesis Plan
FORMULA:C33H52O4

SMILES: CC(C)(C)C(C)(C)C(C)(C)C(C)(C)C(C)(C)C(C)(C)C(C)(C)C1=COC(C(=O)c2ccccc2O)=CO1

BIRTHDAY: 2018-11-19T08:17:11.420904
ATC: D01A
- DERMATOLOGICALS
- ANTIFUNGALS FOR DERMATOLOGICAL USE
- ANTIFUNGALS FOR TOPICAL USE
Synthesis Plan
FORMULA:C24H21N5O4

SMILES: COC1=Cc2ncnc(Nc3cccc(CNC(=O)c4cccc(C#N)c4)c3)c2CC1(O)O

BIRTHDAY: 2018-11-19T08:17:11.438806
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C18H35NO6

SMILES: CCCCCCCCCCCC[C@H]1OO[C@@H](C(=O)NC(CO)CO)O1

BIRTHDAY: 2018-11-19T08:17:11.446941
ATC: R05C
- RESPIRATORY SYSTEM
- COUGH AND COLD PREPARATIONS
- EXPECTORANTS, EXCL. COMBINATIONS WITH COUGH SUPPRESSANTS
Synthesis Plan
FORMULA:C19H15N7O3

SMILES: O=C(Nc1nnc(-c2ccccn2)o1)c1ccc(NCc2cccc[n+]2[O-])cn1

BIRTHDAY: 2018-11-19T08:17:11.464704
ATC: M01A
- MUSCULO-SKELETAL SYSTEM
- ANTIINFLAMMATORY AND ANTIRHEUMATIC PRODUCTS
- ANTIINFLAMMATORY AND ANTIRHEUMATIC PRODUCTS, NON-STEROIDS
Synthesis Plan
FORMULA:C29H29N3O4S

SMILES: CN(C)CCCCc1ccc(NC(=O)c2cc3ccccc3s2)c(C(=O)Nc2ccccc2C(=O)O)c1

BIRTHDAY: 2018-11-19T08:17:11.476016
ATC: H02A
- SYSTEMIC HORMONAL PREPARATIONS, EXCL. SEX HORMONES AND INSULINS
- CORTICOSTEROIDS FOR SYSTEMIC USE
- CORTICOSTEROIDS FOR SYSTEMIC USE, PLAIN
Synthesis Plan
FORMULA:C30H30FN5

SMILES: CC1(C)C=CCCNc2cccc(c2)-c2ccnc(n2)Nc2cc(ccc2-c2cccc(F)c2)CN1

BIRTHDAY: 2018-11-19T08:17:11.523619
ATC: N01A
- NERVOUS SYSTEM
- ANESTHETICS
- ANESTHETICS, GENERAL
Synthesis Plan
FORMULA:C37H41N5O4

SMILES: CC(C)(C)C(C)(C)c1c2cccc1-c1ccnc(n1)Nc1cccc(c1)[C@H](C(=O)Nc1ccccc1C(N)=O)OCC=CCCO2

BIRTHDAY: 2018-11-19T08:17:11.537594
ATC: G01A
- GENITO URINARY SYSTEM AND SEX HORMONES
- GYNECOLOGICAL ANTIINFECTIVES AND ANTISEPTICS
- ANTIINFECTIVES AND ANTISEPTICS, EXCL. COMBINATIONS WITH CORTICOSTEROIDS
Synthesis Plan
FORMULA:C28H57NO2

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

BIRTHDAY: 2018-11-19T08:17:11.545033
ATC: A07B
- ALIMENTARY TRACT AND METABOLISM
- ANTIDIARRHEALS, INTESTINAL ANTIINFLAMMATORY/ANTIINFECTIVE AGENTS
- INTESTINAL ADSORBENTS
Synthesis Plan
FORMULA:C27H25N7O3

SMILES: COc1cccc(-c2c[nH]nc2-c2noc(-c3ccccn3)n2)c1NC(=O)c1ccccc1CN(C)C

BIRTHDAY: 2018-11-19T08:17:11.556700
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C25H51NO3

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

BIRTHDAY: 2018-11-19T08:17:11.571872
ATC: V08C
- VARIOUS
- CONTRAST MEDIA
- MAGNETIC RESONANCE IMAGING CONTRAST MEDIA
Synthesis Plan
FORMULA:C26H31N7O3

SMILES: COc1cc(CNc2c(Nc3ccccc3C#N)ncnc2C(=O)NC(C)(C)N(C)C)cc(OC)c1

BIRTHDAY: 2018-11-19T08:17:11.583176
ATC: L01C
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- PLANT ALKALOIDS AND OTHER NATURAL PRODUCTS
Synthesis Plan
FORMULA:C19H16N4O2

SMILES: COC1(OC)C=CC=C2C=CC(Nc3ccccc3C#N)=N[C@]21C#N

BIRTHDAY: 2018-11-19T08:17:11.592041
ATC: N06A
- NERVOUS SYSTEM
- PSYCHOANALEPTICS
- ANTIDEPRESSANTS
Synthesis Plan
FORMULA:C29H59NO3

SMILES: CC(C)(C)C(C)(C)C(C)(C)C(C)(C)C(C)(C)C(C)(C)C(C)(C)C(C)(C)C(=O)NC(CO)CO

BIRTHDAY: 2018-11-19T08:17:11.599860
ATC: C10A
- CARDIOVASCULAR SYSTEM
- LIPID MODIFYING AGENTS
- LIPID MODIFYING AGENTS, PLAIN
Synthesis Plan
FORMULA:C26H31N5O2

SMILES: CC(C)Nc1cccc(C(=O)Nc2cc(-c3ccc(CCN(C)C)cc3)ccc2C(N)=O)n1

BIRTHDAY: 2018-11-19T08:17:11.609759
ATC: L01A
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- ALKYLATING AGENTS
Synthesis Plan
FORMULA:C25H51NO3

SMILES: CCCCCCCCCCCCCCCCCCCCCC(=O)NC(CO)CO

BIRTHDAY: 2018-11-19T08:17:11.617017
ATC: J05A
- ANTIINFECTIVES FOR SYSTEMIC USE
- ANTIVIRALS FOR SYSTEMIC USE
- DIRECT ACTING ANTIVIRALS
Synthesis Plan
FORMULA:C43H77NO5

SMILES: CCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCC(=O)Nc1cc(OC)c(OC(C)=O)c(OC)c1

BIRTHDAY: 2018-11-19T08:17:11.635651
ATC: N02B
- NERVOUS SYSTEM
- ANALGESICS
- OTHER ANALGESICS AND ANTIPYRETICS
Synthesis Plan
FORMULA:C28H57NO2

SMILES: CCCCCCCCCCCCCCCCCCCCCCCCCC(=O)NCCO

BIRTHDAY: 2018-11-19T08:17:11.642796
ATC: S01A
- SENSORY ORGANS
- OPHTHALMOLOGICALS
- ANTIINFECTIVES
Synthesis Plan
FORMULA:C30H24N4O4S

SMILES: COc1ccc(NC(=O)c2cccc(CNC(=O)c3cc4ccccc4s3)c2)c(C(=O)Nc2ccncc2)c1

BIRTHDAY: 2018-11-19T08:17:11.655045
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C39H60N2O3

SMILES: CN(C)C(C)(C)C(C)(C)C(C)(C)C(C)(C)C(C)(C)C(C)(C)Oc1ccc(C(=O)c2cccc([C@@H]3C[C@H]4COC[C@H]3N4)c2)cc1

BIRTHDAY: 2018-11-19T08:17:11.666148
ATC: G03A
- GENITO URINARY SYSTEM AND SEX HORMONES
- SEX HORMONES AND MODULATORS OF THE GENITAL SYSTEM
- HORMONAL CONTRACEPTIVES FOR SYSTEMIC USE
Synthesis Plan
FORMULA:C25H30N4O4

SMILES: CC(C)c1c(NC(=O)c2ccccc2C(=N)N)cccc1C(=O)N1CCCC[C@]1(C)C(=O)O

BIRTHDAY: 2018-11-19T08:17:11.676321
ATC: C01D
- CARDIOVASCULAR SYSTEM
- CARDIAC THERAPY
- VASODILATORS USED IN CARDIAC DISEASES
Synthesis Plan
FORMULA:C16H14ClNS

SMILES: CN(C)C1=Cc2ccccc2Sc2ccc(Cl)cc21

BIRTHDAY: 2018-11-19T08:17:11.683371
ATC: C08E
- CARDIOVASCULAR SYSTEM
- CALCIUM CHANNEL BLOCKERS
- NON-SELECTIVE CALCIUM CHANNEL BLOCKERS
Synthesis Plan
FORMULA:C28H57NO3

SMILES: CC(C)(C)C(C)(C)C(C)(C)C(C)(C)C(C)(C)C(C)(C)C(C)(C)CCC(=O)NC(CO)CO

BIRTHDAY: 2018-11-19T08:17:11.691033
ATC: J05A
- ANTIINFECTIVES FOR SYSTEMIC USE
- ANTIVIRALS FOR SYSTEMIC USE
- DIRECT ACTING ANTIVIRALS
Synthesis Plan
FORMULA:C25H29FN4O

SMILES: CN(C)C(C)(C)Cc1ccccc1NC(=O)c1ccnc(NCc2ccc(F)cc2)c1

BIRTHDAY: 2018-11-19T08:17:11.700053
ATC: V08A
- VARIOUS
- CONTRAST MEDIA
- X-RAY CONTRAST MEDIA, IODINATED
Synthesis Plan
FORMULA:C24H21N5O4

SMILES: COC1=Cc2ncnc(Nc3ccc(CNC(=O)c4cccc(C#N)c4)cc3)c2CC1(O)O

BIRTHDAY: 2018-11-19T08:17:11.710377
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C27H49N3O2

SMILES: CC(C)(C)C(C)(C)C(C)(C)C(C)(C)C(C)(C)[C@@]1(C)C[C@@H]2N[C@H]1[C@@H]1C[C@H](C(=O)C(N)=O)[C@H]2N1

BIRTHDAY: 2018-11-19T08:17:11.719301
ATC: L01D
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- CYTOTOXIC ANTIBIOTICS AND RELATED SUBSTANCES
Synthesis Plan
FORMULA:C21H23N3O2S

SMILES: COc1ccc2cc(C3=CCc4[nH]nc(C(C)(C)C)c4S3)cnc2c1OC

BIRTHDAY: 2018-11-19T08:17:11.728010
ATC: M01A
- MUSCULO-SKELETAL SYSTEM
- ANTIINFLAMMATORY AND ANTIRHEUMATIC PRODUCTS
- ANTIINFLAMMATORY AND ANTIRHEUMATIC PRODUCTS, NON-STEROIDS
Synthesis Plan
FORMULA:C22H17F3N6O3

SMILES: COc1ccc(CNc2nc(C#N)ncc2C(=O)Nc2cccc(C(N)=O)c2)cc1C(F)(F)F

BIRTHDAY: 2018-11-19T08:17:11.739761
ATC: L01C
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- PLANT ALKALOIDS AND OTHER NATURAL PRODUCTS
Synthesis Plan
FORMULA:C22H19F3N6O2

SMILES: CNC(=O)c1cnc(Nc2cccc(C#N)c2)nc1NCc1ccc(OC)c(C(F)(F)F)c1

BIRTHDAY: 2018-11-19T08:17:11.751048
ATC: G04B
- GENITO URINARY SYSTEM AND SEX HORMONES
- UROLOGICALS
- UROLOGICALS
Synthesis Plan
FORMULA:C23H24ClN7O2

SMILES: COc1ccc(CNc2cnc(Nc3ccccc3C#N)nc2C(=O)NC(C)(C)N)cc1Cl

BIRTHDAY: 2018-11-19T08:17:11.761772
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C21H38N2O2S

SMILES: CC(C)(C)C(C)(C)C(C)(C)C(C)(C)[C@@]12C=CC=C[C@H]1NS(=O)(=O)[C@@H](N)C2

BIRTHDAY: 2018-11-19T08:17:11.780447
ATC: D03A
- DERMATOLOGICALS
- PREPARATIONS FOR TREATMENT OF WOUNDS AND ULCERS
- CICATRIZANTS
Synthesis Plan
FORMULA:C34H53N3O2

SMILES: CN(C)CCCCCCCCCCCCCCCCCCOc1ccc(C(=O)c2ccc(C(=N)N)cc2)cc1

BIRTHDAY: 2018-11-19T08:17:11.789830
ATC: S01A
- SENSORY ORGANS
- OPHTHALMOLOGICALS
- ANTIINFECTIVES
Synthesis Plan
FORMULA:C18H14N4O3

SMILES: COC1=Cc2ncc(C#N)c(Nc3cccc(C#N)c3)c2CC1(O)O

BIRTHDAY: 2018-11-19T08:17:11.798747
ATC: A03C
- ALIMENTARY TRACT AND METABOLISM
- DRUGS FOR FUNCTIONAL GASTROINTESTINAL DISORDERS
- ANTISPASMODICS IN COMBINATION WITH PSYCHOLEPTICS
Synthesis Plan
FORMULA:C40H68N4O2

SMILES: CCCCCCCCCCCCCCCCCCCCCCC[C@@H]1Oc2cccc(c2)C(=O)NCCn2cc(nn2)CC[C@H]1CC

BIRTHDAY: 2018-11-19T08:17:11.809955
ATC: D11A
- DERMATOLOGICALS
- OTHER DERMATOLOGICAL PREPARATIONS
- OTHER DERMATOLOGICAL PREPARATIONS
Synthesis Plan
FORMULA:C24H21N5O4

SMILES: COC1=c2nc(Nc3ccccc3CNC(=O)c3cccc(C#N)c3)ncc2=CCC1(O)O

BIRTHDAY: 2018-11-19T08:17:11.820381
ATC: C10A
- CARDIOVASCULAR SYSTEM
- LIPID MODIFYING AGENTS
- LIPID MODIFYING AGENTS, PLAIN
Synthesis Plan
FORMULA:C30H46O2

SMILES: CCCCCCCCCCCCCCCCCc1c(CCC(=O)O)cc2cccccc1-2

BIRTHDAY: 2018-11-19T08:17:11.827911
ATC: B01A
- BLOOD AND BLOOD FORMING ORGANS
- ANTITHROMBOTIC AGENTS
- ANTITHROMBOTIC AGENTS
Synthesis Plan
FORMULA:C21H16ClN3O3

SMILES: NC(=O)c1ccc(NC(=O)c2ccccc2C(=O)Nc2ccccc2Cl)cc1

BIRTHDAY: 2018-11-19T08:17:11.837527
ATC: N02B
- NERVOUS SYSTEM
- ANALGESICS
- OTHER ANALGESICS AND ANTIPYRETICS
Synthesis Plan
FORMULA:C25H30N4O4

SMILES: CC(C)c1c(NC(=O)c2ccccc2C(=N)N)cccc1C(=O)N1CCCC[C@@]1(C)C(=O)O

BIRTHDAY: 2018-11-19T08:17:11.847673
ATC: C01D
- CARDIOVASCULAR SYSTEM
- CARDIAC THERAPY
- VASODILATORS USED IN CARDIAC DISEASES
Synthesis Plan
FORMULA:C35H45NO6S

SMILES: CCCCCC[C@@H]1c2cc(OC)c(OC)cc2SC[C@@H]1C[C@H]1Oc2ccc(OC)cc2-c2cc(OC)c(OC)cc2N1C

BIRTHDAY: 2018-11-19T08:17:11.859784
ATC: A03F
- ALIMENTARY TRACT AND METABOLISM
- DRUGS FOR FUNCTIONAL GASTROINTESTINAL DISORDERS
- PROPULSIVES
Synthesis Plan
FORMULA:C26H27N5O2

SMILES: CC(C)c1ccccc1C(=O)Nc1ccc(CN[C@@]23C=CC=C[C@@]2(C(N)=O)C=NC=N3)cc1

BIRTHDAY: 2018-11-19T08:17:11.869684
ATC: A02B
- ALIMENTARY TRACT AND METABOLISM
- DRUGS FOR ACID RELATED DISORDERS
- DRUGS FOR PEPTIC ULCER AND GASTRO-OESOPHAGEAL REFLUX DISEASE (GORD)
Synthesis Plan
FORMULA:C27H21N5O4

SMILES: NC(=O)c1ccccc1C(=O)Nc1ccccc1C(=O)Nc1ccc(C(=O)Nc2ccncc2)cc1

BIRTHDAY: 2018-11-19T08:17:11.890924
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C18H25N7O

SMILES: Cc1n[nH]c(C)c1NC(=O)c1ccccc1C1=C([C@H](C)N(C)C)NNN1

BIRTHDAY: 2018-11-19T08:17:11.900338
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C18H21N3O2

SMILES: COC1(OC)C=CC=C2N=C(N[C@@H](C)c3ccccc3)N=C[C@H]21

BIRTHDAY: 2018-11-19T08:17:11.908404
ATC: V08A
- VARIOUS
- CONTRAST MEDIA
- X-RAY CONTRAST MEDIA, IODINATED
Synthesis Plan
FORMULA:C19H15N7O3

SMILES: O=C(Nc1nnc(-c2cccnc2)o1)c1ccc(NCc2cc[n+]([O-])cc2)nc1

BIRTHDAY: 2018-11-19T08:17:11.918474
ATC: M04A
- MUSCULO-SKELETAL SYSTEM
- ANTIGOUT PREPARATIONS
- ANTIGOUT PREPARATIONS
Synthesis Plan
FORMULA:C34H69NO3

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

BIRTHDAY: 2018-11-19T08:17:11.927264
ATC: V08C
- VARIOUS
- CONTRAST MEDIA
- MAGNETIC RESONANCE IMAGING CONTRAST MEDIA
Synthesis Plan
FORMULA:C18H18FN3O2

SMILES: COc1cc2ncnc(N[C@@H](C)c3cccc(F)c3)c2cc1OC

BIRTHDAY: 2018-11-19T08:17:11.935664
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C24H27N7O3

SMILES: COc1cccc(OC)c1CNc1ncc(Nc2ccccc2C#N)c(C(=O)NCCCN)n1

BIRTHDAY: 2018-11-19T08:17:11.946718
ATC: A02B
- ALIMENTARY TRACT AND METABOLISM
- DRUGS FOR ACID RELATED DISORDERS
- DRUGS FOR PEPTIC ULCER AND GASTRO-OESOPHAGEAL REFLUX DISEASE (GORD)
Synthesis Plan
FORMULA:C28H48N6O

SMILES: CN(C)C(C)(C)C(C)(C)C(C)(C)C(C)(C)C(C)(C)C(C)(C)NC(=O)c1nc2c([nH]1)C=CN[C@@H]2C#N

BIRTHDAY: 2018-11-19T08:17:11.956356
ATC: P03A
- ANTIPARASITIC PRODUCTS, INSECTICIDES AND REPELLENTS
- ECTOPARASITICIDES, INCL. SCABICIDES, INSECTICIDES AND REPELLENTS
- ECTOPARASITICIDES, INCL. SCABICIDES
Synthesis Plan
FORMULA:C20H21N3O3

SMILES: COC1=Cc2ncc(C#N)c(Nc3c(C)cc(C)cc3C)c2CC1(O)O

BIRTHDAY: 2018-11-19T08:17:11.976669
ATC: J05A
- ANTIINFECTIVES FOR SYSTEMIC USE
- ANTIVIRALS FOR SYSTEMIC USE
- DIRECT ACTING ANTIVIRALS
Synthesis Plan
FORMULA:C26H53NO2

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

BIRTHDAY: 2018-11-19T08:17:11.983844
ATC: N05A
- NERVOUS SYSTEM
- PSYCHOLEPTICS
- ANTIPSYCHOTICS
Synthesis Plan
FORMULA:C32H56N6O

SMILES: CN(C)C(C)(C)C(C)(C)C(C)(C)C(C)(C)C(C)(C)C(C)(C)CNC(=O)c1nc2c([nH]1)CNC1=C2[C@H]2CN[C@H]1C2

BIRTHDAY: 2018-11-19T08:17:11.994469
ATC: D01A
- DERMATOLOGICALS
- ANTIFUNGALS FOR DERMATOLOGICAL USE
- ANTIFUNGALS FOR TOPICAL USE
Synthesis Plan
FORMULA:C35H55NO3

SMILES: CN(C)CCCCCCCCCCCCCCCCCCCCOc1ccc(C(=O)c2ccc(O)cc2)cc1

BIRTHDAY: 2018-11-19T08:17:12.011576
ATC: B05A
- BLOOD AND BLOOD FORMING ORGANS
- BLOOD SUBSTITUTES AND PERFUSION SOLUTIONS
- BLOOD AND RELATED PRODUCTS
Synthesis Plan
FORMULA:C21H32N2O2S2

SMILES: C[C@@H](C1(C(=O)Nc2ccccc2C(N)=O)SCCCS1)C(C)(C)C(C)(C)C

BIRTHDAY: 2018-11-19T08:17:12.020800
ATC: P02C
- ANTIPARASITIC PRODUCTS, INSECTICIDES AND REPELLENTS
- ANTHELMINTICS
- ANTINEMATODAL AGENTS
Synthesis Plan
FORMULA:C32H65NO2

SMILES: CCCCCCCCCCCCCCCCCCCCCCCCCCCCCC(=O)NCCO

BIRTHDAY: 2018-11-19T08:17:12.035805
ATC: S01A
- SENSORY ORGANS
- OPHTHALMOLOGICALS
- ANTIINFECTIVES
Synthesis Plan
FORMULA:C29H31N3O4S

SMILES: CN(C)C(C)(C)Cc1c(NC(=O)[C@]23C=CC=CC2=CSC3)cccc1C(=O)Nc1ccc(C(=O)O)cc1

BIRTHDAY: 2018-11-19T08:17:12.048679
ATC: C02K
- CARDIOVASCULAR SYSTEM
- ANTIHYPERTENSIVES
- OTHER ANTIHYPERTENSIVES
Synthesis Plan
FORMULA:C35H55N5O3

SMILES: CN(C)C(C)(C)C(C)(C)C(C)(C)C(C)(C)C(C)(C)C(C)(C)Oc1c(NC(=O)c2ccccc2C(=N)N)cccc1C(N)=O

BIRTHDAY: 2018-11-30T17:22:42.724762
ATC: D01A
- DERMATOLOGICALS
- ANTIFUNGALS FOR DERMATOLOGICAL USE
- ANTIFUNGALS FOR TOPICAL USE
Synthesis Plan
FORMULA:C20H26N3O2P

SMILES: C[C@H](C(C)(C)C)[C@]12C=C(C3=CN=NCN3)C=C[C@@]13C=CC=C[C@@H]3OPO2

BIRTHDAY: 2018-11-30T17:22:42.733608
ATC: L01B
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- ANTIMETABOLITES
Synthesis Plan
FORMULA:C27H28N6O5

SMILES: COC1=c2c3nc(nc2=CCC1(O)O)Nc1cccc(c1)CNCC=CCCOc1cc-3c(C(N)=O)cn1

BIRTHDAY: 2018-11-30T17:22:42.745737
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:C19H29N3O3

SMILES: COc1cccc(OC)c1N1C=N[C@@](C)(C(C)(C)C(C)(C)C)NC1=O

BIRTHDAY: 2018-11-30T17:22:42.754054
ATC: R07A
- RESPIRATORY SYSTEM
- OTHER RESPIRATORY SYSTEM PRODUCTS
- OTHER RESPIRATORY SYSTEM PRODUCTS
Synthesis Plan
FORMULA:C18H14N4O3

SMILES: COC1=CC=C2C=C(C#N)C=N[C@@]2(Nc2ccccc2C#N)C1(O)O

BIRTHDAY: 2018-11-30T17:22:42.772749
ATC: G03B
- GENITO URINARY SYSTEM AND SEX HORMONES
- SEX HORMONES AND MODULATORS OF THE GENITAL SYSTEM
- ANDROGENS
Synthesis Plan
FORMULA:C17H16N4O2

SMILES: COC1(OC)C=CC=C2C=NC(Nc3ccccc3C#N)=N[C@H]21

BIRTHDAY: 2018-11-30T17:22:42.780952
ATC: C02D
- CARDIOVASCULAR SYSTEM
- ANTIHYPERTENSIVES
- ARTERIOLAR SMOOTH MUSCLE, AGENTS ACTING ON
Synthesis Plan
FORMULA:C21H26N2OS

SMILES: CN(C)C(C)(C)Cc1ccccc1NC(=O)[C@]12C=CC=CC1=CSC2

BIRTHDAY: 2018-11-30T17:22:42.788933
ATC: M03B
- MUSCULO-SKELETAL SYSTEM
- MUSCLE RELAXANTS
- MUSCLE RELAXANTS, CENTRALLY ACTING AGENTS
Synthesis Plan
FORMULA:C23H23F3N2O3

SMILES: CCCCC1=C(Nc2cc(C(N)=O)ccc2OCc2ccc(C(F)(F)F)cc2)CC1=O

BIRTHDAY: 2018-11-30T17:22:42.798622
ATC: D11A
- DERMATOLOGICALS
- OTHER DERMATOLOGICAL PREPARATIONS
- OTHER DERMATOLOGICAL PREPARATIONS
Synthesis Plan
FORMULA:C15H28N2O2

SMILES: CCCCCCCCCCCc1n[o+][n-]c1CCO

BIRTHDAY: 2018-11-30T17:22:42.805019
ATC: L01D
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- CYTOTOXIC ANTIBIOTICS AND RELATED SUBSTANCES
Synthesis Plan
FORMULA:C16H17N3O3S

SMILES: COC1=c2c(C#N)c(N3C[C@H]4C[C@H]3CS4)cnc2=CC(O)(O)C1

BIRTHDAY: 2018-11-30T17:22:42.827724
ATC: J05A
- ANTIINFECTIVES FOR SYSTEMIC USE
- ANTIVIRALS FOR SYSTEMIC USE
- DIRECT ACTING ANTIVIRALS
Synthesis Plan
FORMULA:C23H22N6O4

SMILES: COc1cc(NC(=O)c2ccccc2CNC(=O)c2nc3c([nH]2)C=CNC3)ccc1C(N)=O

BIRTHDAY: 2018-11-30T17:22:42.838463
ATC: A03F
- ALIMENTARY TRACT AND METABOLISM
- DRUGS FOR FUNCTIONAL GASTROINTESTINAL DISORDERS
- PROPULSIVES
Synthesis Plan
FORMULA:C25H30N4O4

SMILES: CCCc1ccc(NC(=O)c2ccc(C(=N)N)cc2)c(C(=O)N2CCC(CC(=O)O)CC2)c1

BIRTHDAY: 2018-11-30T17:22:42.848312
ATC: C01C
- CARDIOVASCULAR SYSTEM
- CARDIAC THERAPY
- CARDIAC STIMULANTS EXCL. CARDIAC GLYCOSIDES
Synthesis Plan
FORMULA:C15H16FN3O3S

SMILES: COC1=CC(OC)=C2[C@@H](C1)N(c1cccc(F)c1)SN2C(N)=O

BIRTHDAY: 2018-11-30T17:22:42.857246
ATC: A12A
- ALIMENTARY TRACT AND METABOLISM
- MINERAL SUPPLEMENTS
- CALCIUM
Synthesis Plan
FORMULA:C21H23N3OS

SMILES: CN(C)C(C)(C)c1c(C#N)cccc1NC(=O)[C@]12C=CC=CC1=CSC2

BIRTHDAY: 2018-11-30T17:22:42.875468
ATC: M02A
- MUSCULO-SKELETAL SYSTEM
- TOPICAL PRODUCTS FOR JOINT AND MUSCULAR PAIN
- TOPICAL PRODUCTS FOR JOINT AND MUSCULAR PAIN
Synthesis Plan
FORMULA:C19H16N4O2

SMILES: COC1=C[C@H](OC)[C@@]2(Nc3ccccc3C#N)N=C(C#N)C=CC2=C1

BIRTHDAY: 2018-11-30T17:22:42.884069
ATC: N06A
- NERVOUS SYSTEM
- PSYCHOANALEPTICS
- ANTIDEPRESSANTS
Synthesis Plan
FORMULA:C28H35N5O5

SMILES: C[C@@H](N)CNC(=O)c1cc2nc(n1)Nc1cccc(c1)COCC(OC(C)(C)C)=CCOCc1ccc-2o1

BIRTHDAY: 2018-11-30T17:22:42.895307
ATC: C09A
- CARDIOVASCULAR SYSTEM
- AGENTS ACTING ON THE RENIN-ANGIOTENSIN SYSTEM
- ACE INHIBITORS, PLAIN
Synthesis Plan
FORMULA:C24H21N5O4

SMILES: COc1cc(C(N)=O)ccc1NC(=O)c1cccc(CNC(=O)c2cn3ccccc3n2)c1

BIRTHDAY: 2018-12-02T16:05:51.258202
ATC: A02B
- ALIMENTARY TRACT AND METABOLISM
- DRUGS FOR ACID RELATED DISORDERS
- DRUGS FOR PEPTIC ULCER AND GASTRO-OESOPHAGEAL REFLUX DISEASE (GORD)
Synthesis Plan
FORMULA:C22H26N4O3

SMILES: COc1cc2ncnc(Nc3ccc(CNC(=O)C(C)(C)C)cc3)c2cc1OC

BIRTHDAY: 2018-12-02T16:05:51.282701
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C26H53NO3

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

BIRTHDAY: 2018-12-02T16:05:51.298208
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C22H22N6O

SMILES: CC(C)c1ccccc1CNc1c(Nc2ccccc2C#N)ncnc1C(N)=O

BIRTHDAY: 2018-12-02T16:05:51.315483
ATC: N03A
- NERVOUS SYSTEM
- ANTIEPILEPTICS
- ANTIEPILEPTICS
Synthesis Plan
FORMULA:C20H23FN6O

SMILES: CN(C)C(C)(C)Cc1cccc(F)c1NC(=O)c1nc2c([nH]1)C=CN[C@@H]2C#N

BIRTHDAY: 2018-12-02T16:05:51.325080
ATC: C03B
- CARDIOVASCULAR SYSTEM
- DIURETICS
- LOW-CEILING DIURETICS, EXCL. THIAZIDES
Synthesis Plan
FORMULA:C24H21N5O4

SMILES: COC1=c2cnc(Nc3ccccc3CNC(=O)c3ccccc3C#N)nc2=CCC1(O)O

BIRTHDAY: 2018-12-02T16:05:51.342912
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C21H23N3OS

SMILES: CN(C)C(C)(C)c1c(C#N)cccc1NC(=O)[C@@]12C=CC=CC1=CSC2

BIRTHDAY: 2018-12-02T16:05:51.359724
ATC: M02A
- MUSCULO-SKELETAL SYSTEM
- TOPICAL PRODUCTS FOR JOINT AND MUSCULAR PAIN
- TOPICAL PRODUCTS FOR JOINT AND MUSCULAR PAIN
Synthesis Plan
FORMULA:C24H21N5O4

SMILES: CO[C@]12N=C(Nc3ccccc3CNC(=O)c3ccccc3C#N)N=CC1=CC=CC2(O)O

BIRTHDAY: 2018-12-02T16:05:51.370395
ATC: L01C
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- PLANT ALKALOIDS AND OTHER NATURAL PRODUCTS
Synthesis Plan
FORMULA:C35H55N5O3

SMILES: CN(C)CCCCCCCCCCCCCCCCCCOc1ccc(C(N)=O)c(NC(=O)c2ccc(C(=N)N)cc2)c1

BIRTHDAY: 2018-12-02T16:05:51.381389
ATC: G01A
- GENITO URINARY SYSTEM AND SEX HORMONES
- GYNECOLOGICAL ANTIINFECTIVES AND ANTISEPTICS
- ANTIINFECTIVES AND ANTISEPTICS, EXCL. COMBINATIONS WITH CORTICOSTEROIDS
Synthesis Plan
FORMULA:C19H17N5O5

SMILES: COC1(OC)C=CC=C2C=NC(NC(=O)Nc3ccc4cnc(=O)oc4c3)=N[C@@H]21

BIRTHDAY: 2018-12-02T16:05:51.417728
ATC: B03B
- BLOOD AND BLOOD FORMING ORGANS
- ANTIANEMIC PREPARATIONS
- VITAMIN B12 AND FOLIC ACID
Synthesis Plan
FORMULA:C26H27N5O2

SMILES: CC(C)c1ccccc1C(=O)Nc1ccc(CN[C@]23C=CC=C[C@]2(C(N)=O)C=NC=N3)cc1

BIRTHDAY: 2018-12-03T10:42:13.052677
ATC: A02B
- ALIMENTARY TRACT AND METABOLISM
- DRUGS FOR ACID RELATED DISORDERS
- DRUGS FOR PEPTIC ULCER AND GASTRO-OESOPHAGEAL REFLUX DISEASE (GORD)
Synthesis Plan
FORMULA:C33H29N7O3

SMILES: COc1cc2ncnc(Nc3ccc4cc3COCC=CCn3ccc5ccc(cc53)-c3ccnc(n3)N4)c2cc1OC

BIRTHDAY: 2018-12-03T10:42:13.065438
ATC: B06A
- BLOOD AND BLOOD FORMING ORGANS
- OTHER HEMATOLOGICAL AGENTS
- OTHER HEMATOLOGICAL AGENTS
Synthesis Plan
FORMULA:C32H55NOS

SMILES: CCCCCCCCCCCCCCCCCCCCCCC[C@@H]1Sc2ccccc2[C@H]1C(N)=O

BIRTHDAY: 2018-12-03T10:42:13.073583
ATC: H01A
- SYSTEMIC HORMONAL PREPARATIONS, EXCL. SEX HORMONES AND INSULINS
- PITUITARY AND HYPOTHALAMIC HORMONES AND ANALOGUES
- ANTERIOR PITUITARY LOBE HORMONES AND ANALOGUES
Synthesis Plan
FORMULA:C16H14N4O3

SMILES: COC1=Cc2c(ncnc2Nc2ccc(C#N)cc2)CC1(O)O

BIRTHDAY: 2018-12-03T10:42:13.082063
ATC: D11A
- DERMATOLOGICALS
- OTHER DERMATOLOGICAL PREPARATIONS
- OTHER DERMATOLOGICAL PREPARATIONS
Synthesis Plan
FORMULA:C17H12N4O4

SMILES: N#Cc1ccccc1Nc1cnc(C#N)c2c1C(O)(O)C(O)(O)C=C2

BIRTHDAY: 2018-12-03T10:42:13.091770
ATC: N05A
- NERVOUS SYSTEM
- PSYCHOLEPTICS
- ANTIPSYCHOTICS
Synthesis Plan
FORMULA:C29H55NO3

SMILES: CC(C)(C)C(C)(C)C(C)(C)C(C)(C)[C@]1(C(=O)NC(CO)CO)CCCC=CCCCCCC1

BIRTHDAY: 2018-12-03T10:42:13.101030
ATC: A02B
- ALIMENTARY TRACT AND METABOLISM
- DRUGS FOR ACID RELATED DISORDERS
- DRUGS FOR PEPTIC ULCER AND GASTRO-OESOPHAGEAL REFLUX DISEASE (GORD)
Synthesis Plan
FORMULA:C44H45N9O3

SMILES: COc1ccc(CNc2ncc(C(=O)NCc3c4ccc5cccc(c35)CNCCCNCCNCc3cccc(c3)O4)c(Nc3ccc(C#N)cc3)n2)cc1

BIRTHDAY: 2018-12-03T10:42:13.116963
ATC: D11A
- DERMATOLOGICALS
- OTHER DERMATOLOGICAL PREPARATIONS
- OTHER DERMATOLOGICAL PREPARATIONS
Synthesis Plan
FORMULA:C23H23N7O

SMILES: COc1ccccc1CNc1nc(Nc2ccccc2C#N)c2c(ncn2C(C)C)n1

BIRTHDAY: 2018-12-03T10:42:13.127068
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:C23H24N6O4

SMILES: COc1cccc(CNc2nc(Nc3cccc(C#N)c3)ncc2C(=O)NCCO)c1OC

BIRTHDAY: 2018-12-03T10:42:13.165994
ATC: C08D
- CARDIOVASCULAR SYSTEM
- CALCIUM CHANNEL BLOCKERS
- SELECTIVE CALCIUM CHANNEL BLOCKERS WITH DIRECT CARDIAC EFFECTS
Synthesis Plan
FORMULA:C24H21N5O4

SMILES: COC1=CC(O)(O)Cc2nc(Nc3ccccc3CNC(=O)c3ccccc3C#N)ncc21

BIRTHDAY: 2018-12-03T10:42:13.209965
ATC: A10B
- ALIMENTARY TRACT AND METABOLISM
- DRUGS USED IN DIABETES
- BLOOD GLUCOSE LOWERING DRUGS, EXCL. INSULINS
Synthesis Plan
FORMULA:C20H27N5

SMILES: CN(C)[C@H]1NCCCC=C[C@H](Nc2ccc(C#N)cc2)CC[C@@H]1C#N

BIRTHDAY: 2018-12-03T10:42:13.217931
ATC: C09A
- CARDIOVASCULAR SYSTEM
- AGENTS ACTING ON THE RENIN-ANGIOTENSIN SYSTEM
- ACE INHIBITORS, PLAIN
Synthesis Plan
FORMULA:C38H56BN3O2S

SMILES: C[C@H](CCCCCCCCCC1=CBO[C@@]12CSc1ccccc1C(C(=O)Nc1cccc(C(C)(C)C)c1)=N2)CCCN(C)C

BIRTHDAY: 2018-12-03T19:10:38.629886
ATC: A10A
- ALIMENTARY TRACT AND METABOLISM
- DRUGS USED IN DIABETES
- INSULINS AND ANALOGUES
Synthesis Plan
FORMULA:C34H64N4O3S2

SMILES: C[C@H](C(C)(C)C(C)(C)C(C)(C)C(C)(C)C(C)(C)C)[C@]12C=CCC(=O)SSC[C@H](CNCCNCCO1)NCCNCC2=O

BIRTHDAY: 2018-12-03T19:10:38.659213
ATC: A10A
- ALIMENTARY TRACT AND METABOLISM
- DRUGS USED IN DIABETES
- INSULINS AND ANALOGUES
Synthesis Plan
FORMULA:C32H28N4O5

SMILES: O=C(Nc1cccc(C(=O)Nc2ccccc2C(=O)Nc2ccccc2C(=O)N2CCOCC2)c1)c1ccccc1

BIRTHDAY: 2018-12-03T19:10:38.671737
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C23H25N7O2S

SMILES: CNC(=O)c1c(CNc2c(N[C@]34CC[C@H](C3)N=N4)ncnc2-c2ccsc2)cccc1OC

BIRTHDAY: 2018-12-03T19:10:38.703994
ATC: C02A
- CARDIOVASCULAR SYSTEM
- ANTIHYPERTENSIVES
- ANTIADRENERGIC AGENTS, CENTRALLY ACTING
Synthesis Plan
FORMULA:C16H14N2O3

SMILES: COc1cc2c(c3cccnc13)[C@@]1(C(N)=O)C=C[C@H](C2)O1

BIRTHDAY: 2018-12-03T19:10:38.719839
ATC: J01F
- ANTIINFECTIVES FOR SYSTEMIC USE
- ANTIBACTERIALS FOR SYSTEMIC USE
- MACROLIDES, LINCOSAMIDES AND STREPTOGRAMINS
Synthesis Plan
FORMULA:C38H72N2O4

SMILES: CC(C)N1CC[C@H](O)[C@@H]2C(=O)[C@]1(NC(=O)C(C)(C)C(C)(C)C(C)(C)C(C)(C)C(C)(C)C(C)(C)C(C)(C)C(C)(C)C)CC[C@@H]2O

BIRTHDAY: 2018-12-03T19:10:38.730443
ATC: B03A
- BLOOD AND BLOOD FORMING ORGANS
- ANTIANEMIC PREPARATIONS
- IRON PREPARATIONS
Synthesis Plan
FORMULA:C16H14N4O3

SMILES: COC1=Cc2ncnc(Nc3cccc(C#N)c3)c2CC1(O)O

BIRTHDAY: 2018-12-03T19:10:38.738923
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C31H63NO2

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

BIRTHDAY: 2018-12-03T19:10:38.746674
ATC: A07B
- ALIMENTARY TRACT AND METABOLISM
- ANTIDIARRHEALS, INTESTINAL ANTIINFLAMMATORY/ANTIINFECTIVE AGENTS
- INTESTINAL ADSORBENTS
Synthesis Plan
FORMULA:C22H26N6O2

SMILES: CN(C)CCCCCNC(=O)c1cnc2ccc(-c3ccc4oc(N)nc4c3)cn12

BIRTHDAY: 2018-12-03T19:10:38.756250
ATC: N06A
- NERVOUS SYSTEM
- PSYCHOANALEPTICS
- ANTIDEPRESSANTS
Synthesis Plan
FORMULA:C25H26N4OS

SMILES: C[C@@H]1CN(C)Cc2cccc(c2)-c2ncnc(c2C#N)Sc2cccc(c2)OC[C@@H]1C

BIRTHDAY: 2018-12-03T19:10:38.784589
ATC: P02C
- ANTIPARASITIC PRODUCTS, INSECTICIDES AND REPELLENTS
- ANTHELMINTICS
- ANTINEMATODAL AGENTS
Synthesis Plan
FORMULA:C27H22N6O3

SMILES: N=C(N)c1ccc(C(=O)Nc2ccc(C(=O)Nc3ccccc3C(=O)Nc3ccccn3)cc2)cc1

BIRTHDAY: 2018-12-03T19:10:38.795880
ATC: A02A
- ALIMENTARY TRACT AND METABOLISM
- DRUGS FOR ACID RELATED DISORDERS
- ANTACIDS
Synthesis Plan
FORMULA:C18H17N5O3

SMILES: COC1=CC=C[C@]2(OC)N=C(NC(=O)Nc3ccccc3C#N)N=C[C@@H]12

BIRTHDAY: 2018-12-01T22:29:43.124032
ATC: G03B
- GENITO URINARY SYSTEM AND SEX HORMONES
- SEX HORMONES AND MODULATORS OF THE GENITAL SYSTEM
- ANDROGENS
Synthesis Plan
FORMULA:C33H65N

SMILES: CCCCCCCCCCCCCCCCCCCCCCCC1C[C@@H]2CCCC[C@H](C1)N2C

BIRTHDAY: 2018-12-01T22:29:43.138532
ATC: C10A
- CARDIOVASCULAR SYSTEM
- LIPID MODIFYING AGENTS
- LIPID MODIFYING AGENTS, PLAIN
Synthesis Plan
FORMULA:C18H18N6O4

SMILES: CC1=N[C@](N)(c2ccccc2Nc2ncc3c(n2)=CC(O)(O)C(O)(O)C=3)N=C1

BIRTHDAY: 2018-12-01T22:29:43.159796
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C28H55N3O4

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

BIRTHDAY: 2018-12-01T22:29:43.177101
ATC: N05C
- NERVOUS SYSTEM
- PSYCHOLEPTICS
- HYPNOTICS AND SEDATIVES
Synthesis Plan
FORMULA:C32H28N4O5

SMILES: O=C(Nc1ccc(C(=O)Nc2cccc(C(=O)Nc3ccc(C(=O)N4CCOCC4)cc3)c2)cc1)c1ccccc1

BIRTHDAY: 2018-12-01T22:29:43.188724
ATC: N02B
- NERVOUS SYSTEM
- ANALGESICS
- OTHER ANALGESICS AND ANTIPYRETICS
Synthesis Plan
FORMULA:C24H49NO3

SMILES: CC(C)(C)C(C)(C)C(C)(C)C(C)(C)C(C)(C)C(C)(C)CC(=O)NC(CO)CO

BIRTHDAY: 2018-12-01T22:29:43.214568
ATC: D08A
- DERMATOLOGICALS
- ANTISEPTICS AND DISINFECTANTS
- ANTISEPTICS AND DISINFECTANTS
Synthesis Plan
FORMULA:C29H31N3O4S

SMILES: CN(C)C(C)(C)Cc1c(NC(=O)[C@@]23C=CC=CC2=CSC3)cccc1C(=O)Nc1ccc(C(=O)O)cc1

BIRTHDAY: 2018-12-01T22:29:43.243157
ATC: C02K
- CARDIOVASCULAR SYSTEM
- ANTIHYPERTENSIVES
- OTHER ANTIHYPERTENSIVES
Synthesis Plan
FORMULA:C26H25N5O2

SMILES: CCCc1ccc(C(=O)Nc2cccc(CNc3ncnc4ccc(C(N)=O)cc34)c2)cc1

BIRTHDAY: 2018-12-01T22:29:43.253036
ATC: D11A
- DERMATOLOGICALS
- OTHER DERMATOLOGICAL PREPARATIONS
- OTHER DERMATOLOGICAL PREPARATIONS
Synthesis Plan