matter.farm

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

These compounds may interact with:

Geranylgeranyl transferase type-1 subunit beta

Potentially involved in: adult high grade glioma; astrocytoma; astrocytoma, pilocytic; breast cancer; colon cancer; ependymoma; glioblastoma; intraductal papillary-mucinous neoplasm (ipmn); lung cancer; oligodendroglioma; osteosarcoma; ovarian cancer; subependymal giant cell astrocytoma; lung neoplasms

Disease data sourced from Pharos.

Unknown Action

FORMULA:C20H29N3O7

SMILES: CCOc1cccc(CNC(=O)[C@H](NC(=O)[C@H](CC(=O)O)CC(=O)NO)C(C)C)c1

BIRTHDAY: 2018-12-01T14:11:41.090829
ATC: J05A
- ANTIINFECTIVES FOR SYSTEMIC USE
- ANTIVIRALS FOR SYSTEMIC USE
- DIRECT ACTING ANTIVIRALS
Synthesis Plan
FORMULA:C27H30N4O2

SMILES: N=C(N)c1ccc(C(=O)Nc2ccc(C(=O)NCCCCCCc3ccccc3)cc2)cc1

BIRTHDAY: 2018-12-01T14:11:41.099955
ATC: A10B
- ALIMENTARY TRACT AND METABOLISM
- DRUGS USED IN DIABETES
- BLOOD GLUCOSE LOWERING DRUGS, EXCL. INSULINS
Synthesis Plan
FORMULA:C19H22N4O

SMILES: CC1(NC(=O)c2c(C#N)cccc2Cn2ccnc2)CCCCC1

BIRTHDAY: 2018-12-01T14:11:41.108499
ATC: J05A
- ANTIINFECTIVES FOR SYSTEMIC USE
- ANTIVIRALS FOR SYSTEMIC USE
- DIRECT ACTING ANTIVIRALS
Synthesis Plan
FORMULA:C22H24N2O6

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

BIRTHDAY: 2018-12-01T14:11:41.118423
ATC: V09C
- VARIOUS
- DIAGNOSTIC RADIOPHARMACEUTICALS
- RENAL SYSTEM
Synthesis Plan
FORMULA:C15H16Cl2N2O3S

SMILES: CO[C@@]1(C(=O)N[C@@H](C#N)c2cc(Cl)ccc2Cl)CCCC[S@+]1[O-]

BIRTHDAY: 2018-12-01T14:11:41.127299
ATC: L01C
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- PLANT ALKALOIDS AND OTHER NATURAL PRODUCTS
Synthesis Plan
FORMULA:C25H32N4O5

SMILES: CC(C)C[C@H](NC(=O)c1ccc(C(N)=O)cc1)C(=O)N[C@H](CCCNc1ccccc1)C(=O)O

BIRTHDAY: 2018-12-01T14:11:41.137561
ATC: P03B
- ANTIPARASITIC PRODUCTS, INSECTICIDES AND REPELLENTS
- ECTOPARASITICIDES, INCL. SCABICIDES, INSECTICIDES AND REPELLENTS
- INSECTICIDES AND REPELLENTS
Synthesis Plan
FORMULA:C29H33NO4

SMILES: COC(=O)c1ccc([C@H](C(=O)NCCCCCCc2ccccc2)c2ccc(OC)cc2)cc1

BIRTHDAY: 2018-12-01T14:11:41.146727
ATC: B01A
- BLOOD AND BLOOD FORMING ORGANS
- ANTITHROMBOTIC AGENTS
- ANTITHROMBOTIC AGENTS
Synthesis Plan
FORMULA:C22H29NO2

SMILES: COC(=O)c1ccc([C@H](CN(C)C)c2ccc(C(C)(C)C)cc2)cc1

BIRTHDAY: 2018-12-01T14:11:41.154130
ATC: C02K
- CARDIOVASCULAR SYSTEM
- ANTIHYPERTENSIVES
- OTHER ANTIHYPERTENSIVES
Synthesis Plan
FORMULA:C33H35NO2

SMILES: COc1ccc([C@H](C(=O)NCC(c2ccccc2)c2ccccc2)c2ccc(C(C)(C)C)cc2)cc1

BIRTHDAY: 2018-12-01T14:11:41.163284
ATC: R06A
- RESPIRATORY SYSTEM
- ANTIHISTAMINES FOR SYSTEMIC USE
- ANTIHISTAMINES FOR SYSTEMIC USE
Synthesis Plan
FORMULA:C27H35N9O5

SMILES: CC(C)[C@H](NC(=O)c1ccccc1C#N)C(=O)N1CCC[C@H]1C(=O)N[C@H](CCCNC(N)=O)C(=O)NC1=NCC=N1

BIRTHDAY: 2018-12-01T14:11:41.176428
ATC: N02C
- NERVOUS SYSTEM
- ANALGESICS
- ANTIMIGRAINE PREPARATIONS
Synthesis Plan
FORMULA:C35H47NO5S

SMILES: COc1ccccc1[C@H](O)C(C)(C)C(C)(C)C(C)(C)C(C)(C)C(C)(C)C(=O)Nc1ccccc1-c1cscc1C(=O)O

BIRTHDAY: 2018-12-01T14:11:41.187763
ATC: D11A
- DERMATOLOGICALS
- OTHER DERMATOLOGICAL PREPARATIONS
- OTHER DERMATOLOGICAL PREPARATIONS
Synthesis Plan
FORMULA:C22H29NO2

SMILES: COC(=O)c1ccccc1[C@@H](CN(C)C)c1ccccc1C(C)(C)C

BIRTHDAY: 2018-12-01T14:11:41.195699
ATC: C03C
- CARDIOVASCULAR SYSTEM
- DIURETICS
- HIGH-CEILING DIURETICS
Synthesis Plan
FORMULA:C24H16F2N6O2

SMILES: N#Cc1ccccc1[C@@H](OCc1c[nH]c(=O)c(-c2ccc(F)cc2F)c1C#N)c1nc(N)c[nH]1

BIRTHDAY: 2018-12-01T14:11:41.208528
ATC: A07B
- ALIMENTARY TRACT AND METABOLISM
- ANTIDIARRHEALS, INTESTINAL ANTIINFLAMMATORY/ANTIINFECTIVE AGENTS
- INTESTINAL ADSORBENTS
Synthesis Plan
FORMULA:C24H16F2N6O2

SMILES: N#Cc1ccccc1[C@H](OCc1[nH]c(=O)cc(C#N)c1-c1cccc(F)c1F)c1ncc(N)[nH]1

BIRTHDAY: 2018-12-01T14:11:41.220011
ATC: N07B
- NERVOUS SYSTEM
- OTHER NERVOUS SYSTEM DRUGS
- DRUGS USED IN ADDICTIVE DISORDERS
Synthesis Plan
FORMULA:C24H16F2N6O2

SMILES: N#Cc1cc(CO[C@@H](c2ncc(N)[nH]2)c2ccccc2C#N)c(-c2cccc(F)c2F)c(=O)[nH]1

BIRTHDAY: 2018-12-01T14:11:41.231812
ATC: N06D
- NERVOUS SYSTEM
- PSYCHOANALEPTICS
- ANTI-DEMENTIA DRUGS
Synthesis Plan
FORMULA:C24H16F3N7O2

SMILES: N#Cc1cccc(F)c1[C@H](OCc1c(C#N)c(N)c(-c2cc(F)ccc2F)[nH]c1=O)c1ncc(N)[nH]1

BIRTHDAY: 2018-12-01T14:11:41.244238
ATC: L04A
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- IMMUNOSUPPRESSANTS
- IMMUNOSUPPRESSANTS
Synthesis Plan
FORMULA:C35H34N8O5

SMILES: CC(C)[C@@H](NC(=O)c1ccc(C(N)=O)cc1)C(=O)N[C@@H](C#N)CCc1cnc2nc1NC(=O)c1cccc(c1)OCc1cccc(c1)N2

BIRTHDAY: 2018-12-01T14:11:42.010249
ATC: C08D
- CARDIOVASCULAR SYSTEM
- CALCIUM CHANNEL BLOCKERS
- SELECTIVE CALCIUM CHANNEL BLOCKERS WITH DIRECT CARDIAC EFFECTS
Synthesis Plan
FORMULA:C22H24N2O6

SMILES: CC(C)[C@H](NC(=O)[C@H](CC(=O)O)NC(=O)c1ccc(-c2ccccc2)cc1)C(=O)O

BIRTHDAY: 2018-12-01T14:11:42.023689
ATC: S01B
- SENSORY ORGANS
- OPHTHALMOLOGICALS
- ANTIINFLAMMATORY AGENTS
Synthesis Plan
FORMULA:C22H35N3O4S2

SMILES: CSCCCC[C@@H](NC(=O)[C@@H](CCCNC(=O)[C@@H](N)CS)Cc1ccccc1)C(=O)O

BIRTHDAY: 2018-12-01T14:11:42.037614
ATC: J01F
- ANTIINFECTIVES FOR SYSTEMIC USE
- ANTIBACTERIALS FOR SYSTEMIC USE
- MACROLIDES, LINCOSAMIDES AND STREPTOGRAMINS
Synthesis Plan
FORMULA:C27H30N4O2

SMILES: CC(C)(NC(=O)c1cccc(NC(=O)c2ccccc2C(=N)N)c1)C(C)(C)c1ccccc1

BIRTHDAY: 2018-12-03T02:39:49.642227
ATC: C10A
- CARDIOVASCULAR SYSTEM
- LIPID MODIFYING AGENTS
- LIPID MODIFYING AGENTS, PLAIN
Synthesis Plan
FORMULA:C25H17ClFN5O2

SMILES: Cn1cncc1[C@@H](OCc1cc(-c2cccc(F)c2Cl)c(C#N)c(=O)[nH]1)c1ccc(C#N)cc1

BIRTHDAY: 2018-12-03T02:39:49.653115
ATC: V08A
- VARIOUS
- CONTRAST MEDIA
- X-RAY CONTRAST MEDIA, IODINATED
Synthesis Plan
FORMULA:C22H25N3O5

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

BIRTHDAY: 2018-12-03T02:39:49.663185
ATC: D11A
- DERMATOLOGICALS
- OTHER DERMATOLOGICAL PREPARATIONS
- OTHER DERMATOLOGICAL PREPARATIONS
Synthesis Plan
FORMULA:C25H17F2N5O2

SMILES: Cn1cncc1[C@H](OCc1cc(-c2cc(F)cc(F)c2)c(C#N)c(=O)[nH]1)c1ccc(C#N)cc1

BIRTHDAY: 2018-12-03T02:39:49.673968
ATC: D01A
- DERMATOLOGICALS
- ANTIFUNGALS FOR DERMATOLOGICAL USE
- ANTIFUNGALS FOR TOPICAL USE
Synthesis Plan
FORMULA:C29H50N2O2

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

BIRTHDAY: 2018-12-03T02:39:49.682573
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C34H38N6O5

SMILES: CC(C)(C)[C@@H](C#N)NC(=O)[C@@H](CC(=O)O)CC(=O)N1c2cccc(c2)CNCC=CCCOc2cccc(c2)-c2ccnc1n2

BIRTHDAY: 2018-12-03T02:39:49.695731
ATC: A10B
- ALIMENTARY TRACT AND METABOLISM
- DRUGS USED IN DIABETES
- BLOOD GLUCOSE LOWERING DRUGS, EXCL. INSULINS
Synthesis Plan
FORMULA:C22H25N3O5

SMILES: CC(C)[C@@H](NC(=O)[C@H](CC(=O)O)NC(=O)c1ccc(-c2ccccc2)cc1)C(N)=O

BIRTHDAY: 2018-12-03T02:39:49.705331
ATC: S01B
- SENSORY ORGANS
- OPHTHALMOLOGICALS
- ANTIINFLAMMATORY AGENTS
Synthesis Plan
FORMULA:C29H31F2N3

SMILES: CC(C)(C(c1cccc(F)c1)c1cccc(F)c1)[C@@]1(N)CCC[C@@](C)(c2ccccc2C#N)N1

BIRTHDAY: 2018-12-03T02:39:49.715051
ATC: A03A
- ALIMENTARY TRACT AND METABOLISM
- DRUGS FOR FUNCTIONAL GASTROINTESTINAL DISORDERS
- DRUGS FOR FUNCTIONAL GASTROINTESTINAL DISORDERS
Synthesis Plan
FORMULA:C27H30N4O2

SMILES: N=C(N)c1cccc(C(=O)Nc2ccc(C(=O)NCCCCCCc3ccccc3)cc2)c1

BIRTHDAY: 2018-12-03T02:39:49.724283
ATC: A10B
- ALIMENTARY TRACT AND METABOLISM
- DRUGS USED IN DIABETES
- BLOOD GLUCOSE LOWERING DRUGS, EXCL. INSULINS
Synthesis Plan
FORMULA:C24H16ClFN6O2

SMILES: N#Cc1cc(CO[C@H](c2ncc(N)[nH]2)c2ccccc2C#N)c(-c2cccc(Cl)c2F)c(=O)[nH]1

BIRTHDAY: 2018-12-03T02:39:49.735883
ATC: N04A
- NERVOUS SYSTEM
- ANTI-PARKINSON DRUGS
- ANTICHOLINERGIC AGENTS
Synthesis Plan
FORMULA:C28H33NO3

SMILES: COc1ccc(C(C(=O)NCCCCCCc2ccccc2)c2ccc(OC)cc2)cc1

BIRTHDAY: 2018-12-03T02:39:49.756267
ATC: B01A
- BLOOD AND BLOOD FORMING ORGANS
- ANTITHROMBOTIC AGENTS
- ANTITHROMBOTIC AGENTS
Synthesis Plan
FORMULA:C31H30N6O2

SMILES: COc1ccc([C@H](C#N)Cc2ccc3cc2Nc2nccc(n2)-c2ccnc(c2)OCCC=CCNC3)cc1

BIRTHDAY: 2018-12-03T02:39:49.768478
ATC: L01C
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- PLANT ALKALOIDS AND OTHER NATURAL PRODUCTS
Synthesis Plan
FORMULA:C27H30N4O2

SMILES: N=C(N)c1ccc(C(=O)Nc2ccccc2C(=O)NCCCCCCc2ccccc2)cc1

BIRTHDAY: 2018-12-03T02:39:49.778959
ATC: C01C
- CARDIOVASCULAR SYSTEM
- CARDIAC THERAPY
- CARDIAC STIMULANTS EXCL. CARDIAC GLYCOSIDES
Synthesis Plan
FORMULA:C28H41N5O2S

SMILES: CC1(NC(=O)C(C)(C)C(C)(C)CC(=O)N[C@@H](Cc2ncc[nH]2)[C@]23C=CC=C[C@H]2SC=N3)CCCCC1

BIRTHDAY: 2018-12-03T02:39:49.792919
ATC: A07A
- ALIMENTARY TRACT AND METABOLISM
- ANTIDIARRHEALS, INTESTINAL ANTIINFLAMMATORY/ANTIINFECTIVE AGENTS
- INTESTINAL ANTIINFECTIVES
Synthesis Plan
FORMULA:C36H29F2N5O2

SMILES: N#CC(C#N)N1CCCCn2c(C(c3ccc(F)cc3)c3ccc(F)cc3)nc3ccc(cc3c2=O)Oc2cccc(c2)CC1

BIRTHDAY: 2018-12-03T02:39:49.805795
ATC: P03B
- ANTIPARASITIC PRODUCTS, INSECTICIDES AND REPELLENTS
- ECTOPARASITICIDES, INCL. SCABICIDES, INSECTICIDES AND REPELLENTS
- INSECTICIDES AND REPELLENTS
Synthesis Plan
FORMULA:C22H24N6O2

SMILES: N#C[C@H]1CCOc2ccc(cn2)CCNCc2ccc(-c3nc[nH]c3N)c(c2)OC1

BIRTHDAY: 2018-12-03T02:39:49.816080
ATC: D11A
- DERMATOLOGICALS
- OTHER DERMATOLOGICAL PREPARATIONS
- OTHER DERMATOLOGICAL PREPARATIONS
Synthesis Plan
FORMULA:C20H22N4O4

SMILES: CC(C)[C@@H](NC(=O)c1ccc(/C(N)=N/c2ccc(C(N)=O)cc2)cc1)C(=O)O

BIRTHDAY: 2018-12-03T02:39:49.825192
ATC: L01D
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- CYTOTOXIC ANTIBIOTICS AND RELATED SUBSTANCES
Synthesis Plan
FORMULA:C20H22F3N3O7

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

BIRTHDAY: 2018-12-03T02:39:49.836950
ATC: J05A
- ANTIINFECTIVES FOR SYSTEMIC USE
- ANTIVIRALS FOR SYSTEMIC USE
- DIRECT ACTING ANTIVIRALS
Synthesis Plan
FORMULA:C29H34N2O4S

SMILES: COc1ccc([C@](O)(c2ccc(OC[C@H](O)CSC)cc2)[C@H](CN(C)C)c2ccc(C#N)cc2)cc1

BIRTHDAY: 2018-11-30T03:41:45.367105
ATC: N07B
- NERVOUS SYSTEM
- OTHER NERVOUS SYSTEM DRUGS
- DRUGS USED IN ADDICTIVE DISORDERS
Synthesis plan pending
FORMULA:C25H18F4N4O2

SMILES: Cn1cncc1[C@@H](OCc1c(-c2ccc(F)c(F)c2)cn(C)c(=O)c1C#N)c1ccc(F)c(F)c1

BIRTHDAY: 2018-11-30T03:41:45.378419
ATC: M03A
- MUSCULO-SKELETAL SYSTEM
- MUSCLE RELAXANTS
- MUSCLE RELAXANTS, PERIPHERALLY ACTING AGENTS
Synthesis plan pending
FORMULA:C20H15Cl2N3OSe

SMILES: Cn1ccnc1[C@@H](Oc1cc(-c2cccc(Cl)c2)n[se]1)c1ccc(Cl)cc1

BIRTHDAY: 2018-11-30T03:41:45.398463
ATC: M04A
- MUSCULO-SKELETAL SYSTEM
- ANTIGOUT PREPARATIONS
- ANTIGOUT PREPARATIONS
Synthesis plan pending
FORMULA:C27H30N4O2

SMILES: CC(C)(NC(=O)c1ccccc1NC(=O)c1ccccc1C(=N)N)C(C)(C)c1ccccc1

BIRTHDAY: 2018-11-30T03:41:45.417933
ATC: M03A
- MUSCULO-SKELETAL SYSTEM
- MUSCLE RELAXANTS
- MUSCLE RELAXANTS, PERIPHERALLY ACTING AGENTS
Synthesis plan pending
FORMULA:C26H37N7O5

SMILES: CNC(=O)[C@H](CCCNC(N)=O)NC(=O)[C@@H]1CCCN1C(=O)[C@@H](NC(=O)c1ccccc1C#N)C(C)(C)C

BIRTHDAY: 2018-11-30T03:41:45.450174
ATC: N05A
- NERVOUS SYSTEM
- PSYCHOLEPTICS
- ANTIPSYCHOTICS
Synthesis plan pending
FORMULA:C23H33N3O6

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

BIRTHDAY: 2018-11-30T03:41:45.460001
ATC: N06A
- NERVOUS SYSTEM
- PSYCHOANALEPTICS
- ANTIDEPRESSANTS
Synthesis plan pending
FORMULA:C23H16F4N6O2

SMILES: N#Cc1[nH]c(=O)c(CO[C@@H](c2cccc(F)c2F)c2nc[nH]c2N)c(-c2c(F)cccc2F)c1N

BIRTHDAY: 2018-11-30T03:41:45.473008
ATC: N07B
- NERVOUS SYSTEM
- OTHER NERVOUS SYSTEM DRUGS
- DRUGS USED IN ADDICTIVE DISORDERS
Synthesis plan pending
FORMULA:C25H17F2N5O2

SMILES: Cn1cncc1[C@@H](OCc1cc(-c2cc(F)cc(F)c2)c(C#N)c(=O)[nH]1)c1ccc(C#N)cc1

BIRTHDAY: 2018-11-30T03:41:45.483643
ATC: D01A
- DERMATOLOGICALS
- ANTIFUNGALS FOR DERMATOLOGICAL USE
- ANTIFUNGALS FOR TOPICAL USE
Synthesis plan pending
FORMULA:C20H36N2O4S

SMILES: CCCCCCCCCCCCCCC1=C[C@H]2[C@H]([NH2+][O-])[C@H]([N+](=O)[O-])[C@@H]1[S@@+]2[O-]

BIRTHDAY: 2018-11-30T03:41:45.492074
ATC: A10B
- ALIMENTARY TRACT AND METABOLISM
- DRUGS USED IN DIABETES
- BLOOD GLUCOSE LOWERING DRUGS, EXCL. INSULINS
Synthesis plan pending
FORMULA:C28H31NO3

SMILES: O=C(O)C[C@H](c1ccccc1)c1ccc(C(=O)NCCCCCCc2ccccc2)cc1

BIRTHDAY: 2018-11-30T03:41:45.500588
ATC: C08C
- CARDIOVASCULAR SYSTEM
- CALCIUM CHANNEL BLOCKERS
- SELECTIVE CALCIUM CHANNEL BLOCKERS WITH MAINLY VASCULAR EFFECTS
Synthesis plan pending
FORMULA:C25H19ClF2N4O2

SMILES: Cn1cncc1[C@H](OCc1c(-c2ccc(Cl)c(F)c2)cc(C#N)c(=O)n1C)c1ccc(F)cc1

BIRTHDAY: 2018-11-30T03:41:45.511475
ATC: C03B
- CARDIOVASCULAR SYSTEM
- DIURETICS
- LOW-CEILING DIURETICS, EXCL. THIAZIDES
Synthesis plan pending
FORMULA:C24H16F2N6O2

SMILES: N#Cc1ccccc1[C@@H](OCc1c(C#N)c(-c2cccc(F)c2F)c[nH]c1=O)c1ncc(N)[nH]1

BIRTHDAY: 2018-11-30T03:41:45.522766
ATC: N06D
- NERVOUS SYSTEM
- PSYCHOANALEPTICS
- ANTI-DEMENTIA DRUGS
Synthesis plan pending
FORMULA:C23H16F4N6O2

SMILES: N#Cc1c(-c2cc(F)ccc2F)c(CO[C@@H](c2ncc(N)[nH]2)c2cc(F)ccc2F)[nH]c(=O)c1N

BIRTHDAY: 2018-11-30T03:41:45.534636
ATC: A03C
- ALIMENTARY TRACT AND METABOLISM
- DRUGS FOR FUNCTIONAL GASTROINTESTINAL DISORDERS
- ANTISPASMODICS IN COMBINATION WITH PSYCHOLEPTICS
Synthesis plan pending
FORMULA:C19H23N3O6

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

BIRTHDAY: 2018-11-30T03:41:45.544177
ATC: L02B
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ENDOCRINE THERAPY
- HORMONE ANTAGONISTS AND RELATED AGENTS
Synthesis plan pending
FORMULA:C13H21N3O8

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

BIRTHDAY: 2018-11-30T03:41:45.554227
ATC: C03C
- CARDIOVASCULAR SYSTEM
- DIURETICS
- HIGH-CEILING DIURETICS
Synthesis plan pending
FORMULA:C25H19ClF2N4O2

SMILES: Cn1cncc1[C@H](OCc1c(-c2ccc(F)c(Cl)c2)cc(C#N)c(=O)n1C)c1ccc(F)cc1

BIRTHDAY: 2018-11-19T08:12:27.556107
ATC: L02B
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ENDOCRINE THERAPY
- HORMONE ANTAGONISTS AND RELATED AGENTS
Synthesis plan pending
FORMULA:C26H33N7O6

SMILES: CC(C)[C@H](NC(=O)c1ccc(/C(N)=N/c2ccc(C(=O)O)cc2)cc1)C(=O)N[C@H](CCCNC(=N)N)C(=O)O

BIRTHDAY: 2018-11-19T08:12:27.568282
ATC: A10B
- ALIMENTARY TRACT AND METABOLISM
- DRUGS USED IN DIABETES
- BLOOD GLUCOSE LOWERING DRUGS, EXCL. INSULINS
Synthesis plan pending
FORMULA:C27H30N2O4

SMILES: CC(C)(NC(=O)c1ccccc1[C@H](CC(=O)O)c1ccc[nH]c1=O)C(C)(C)c1ccccc1

BIRTHDAY: 2018-11-19T08:12:27.578174
ATC: P02C
- ANTIPARASITIC PRODUCTS, INSECTICIDES AND REPELLENTS
- ANTHELMINTICS
- ANTINEMATODAL AGENTS
Synthesis plan pending
FORMULA:C19H26N4O3

SMILES: COC(=O)c1ccc([C@H](CN(C)C)[C@H](N)C(=O)N2CCC[C@H]2C#N)cc1

BIRTHDAY: 2018-11-19T08:12:27.587578
ATC: H05B
- SYSTEMIC HORMONAL PREPARATIONS, EXCL. SEX HORMONES AND INSULINS
- CALCIUM HOMEOSTASIS
- ANTI-PARATHYROID AGENTS
Synthesis plan pending
FORMULA:C33H59N5O

SMILES: CCCCCCCCCCCCCCCCCCCCCC(=O)Nc1ccc([C@]2(C)C[C@@H](N)N(C)N=N2)cc1

BIRTHDAY: 2018-11-19T08:12:27.597367
ATC: N05A
- NERVOUS SYSTEM
- PSYCHOLEPTICS
- ANTIPSYCHOTICS
Synthesis plan pending
FORMULA:C23H34N4S

SMILES: CSc1nc2c(c(-c3ccccc3C(C)(C)C)n1)CCN[C@@](N)(CC(C)C)C2

BIRTHDAY: 2018-11-19T08:12:27.605986
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 pending
FORMULA:C25H17F2N5O2

SMILES: Cn1ccnc1[C@@H](OCc1c(C#N)cc(-c2c(F)cccc2F)[nH]c1=O)c1ccc(C#N)cc1

BIRTHDAY: 2018-11-19T08:12:27.627656
ATC: R06A
- RESPIRATORY SYSTEM
- ANTIHISTAMINES FOR SYSTEMIC USE
- ANTIHISTAMINES FOR SYSTEMIC USE
Synthesis plan pending
FORMULA:C26H33N7O6

SMILES: CC(C)[C@@H](NC(=O)c1ccccc1/C(N)=N\c1ccccc1C(=O)O)C(=O)N[C@@H](C(=O)O)C(C)(C)NC(=N)N

BIRTHDAY: 2018-11-19T08:12:27.640197
ATC: G02A
- GENITO URINARY SYSTEM AND SEX HORMONES
- OTHER GYNECOLOGICALS
- UTEROTONICS
Synthesis plan pending
FORMULA:C18H18N6S

SMILES: CC1=N[C@@]2(C#N)S[C@H](n3ccnc3)C[C@H]([C@@H]1C#N)[C@]21C2[C@H]3CN1C[C@@H]23

BIRTHDAY: 2018-11-19T08:12:27.649974
ATC: D01A
- DERMATOLOGICALS
- ANTIFUNGALS FOR DERMATOLOGICAL USE
- ANTIFUNGALS FOR TOPICAL USE
Synthesis plan pending
FORMULA:C23H38N2O3

SMILES: COc1ccccc1[C@@H](C(=O)NCC(=O)NC[C@@H](C(C)C)C(C)(C)C)C(C)C

BIRTHDAY: 2018-11-19T08:12:27.658048
ATC: A03A
- ALIMENTARY TRACT AND METABOLISM
- DRUGS FOR FUNCTIONAL GASTROINTESTINAL DISORDERS
- DRUGS FOR FUNCTIONAL GASTROINTESTINAL DISORDERS
Synthesis plan pending
FORMULA:C26H36N8O6

SMILES: CC(C)[C@@H](NC(=O)c1cccc(C#N)c1)C(=O)N1CC[C@@H](C(=O)N[C@@H](C(=O)NCC(N)=O)C(C)(C)NC(N)=O)C1

BIRTHDAY: 2018-11-19T08:12:27.670813
ATC: L02A
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ENDOCRINE THERAPY
- HORMONES AND RELATED AGENTS
Synthesis plan pending
FORMULA:C41H37F2N7O3S

SMILES: Cn1cncc1[C@H](OCc1[nH]c(=O)c(C#N)cc1-c1ccc(F)c(F)c1)c1ccc(-c2ccc3c4c2CN(CCCCCOC=C2CNCC3=N2)S4)cc1

BIRTHDAY: 2018-11-19T08:12:27.687830
ATC: R06A
- RESPIRATORY SYSTEM
- ANTIHISTAMINES FOR SYSTEMIC USE
- ANTIHISTAMINES FOR SYSTEMIC USE
Synthesis plan pending
FORMULA:C21H33N3O4S3

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

BIRTHDAY: 2018-11-19T08:12:27.698189
ATC: H01A
- SYSTEMIC HORMONAL PREPARATIONS, EXCL. SEX HORMONES AND INSULINS
- PITUITARY AND HYPOTHALAMIC HORMONES AND ANALOGUES
- ANTERIOR PITUITARY LOBE HORMONES AND ANALOGUES
Synthesis plan pending
FORMULA:C34H36N6O4

SMILES: CC(C)C[C@H](NC(=O)c1ccc(C(N)=O)cc1)c1ccc2cc1Nc1nccc(n1)-c1ccnc(c1)OCCC=CCOC2

BIRTHDAY: 2018-11-19T08:12:27.721291
ATC: V09X
- VARIOUS
- DIAGNOSTIC RADIOPHARMACEUTICALS
- OTHER DIAGNOSTIC RADIOPHARMACEUTICALS
Synthesis plan pending
FORMULA:C34H37N5O5

SMILES: CC(C)[C@@H](NC(=O)c1cccc(C#N)c1)C(=O)N1CC[C@@H](C(=O)N[C@H](C(=O)O)[C@H](C)c2cccc(Nc3ccccc3)c2)C1

BIRTHDAY: 2018-11-19T08:12:27.734269
ATC: A03A
- ALIMENTARY TRACT AND METABOLISM
- DRUGS FOR FUNCTIONAL GASTROINTESTINAL DISORDERS
- DRUGS FOR FUNCTIONAL GASTROINTESTINAL DISORDERS
Synthesis plan pending
FORMULA:C28H32N2O4

SMILES: O=C(O)C[C@@H](c1ccc(C(=O)NCCCCCCCc2ccccc2)cc1)c1ccc(=O)[nH]c1

BIRTHDAY: 2018-11-19T08:12:27.743823
ATC: C07A
- CARDIOVASCULAR SYSTEM
- BETA BLOCKING AGENTS
- BETA BLOCKING AGENTS
Synthesis plan pending
FORMULA:C25H35N7O5

SMILES: CNC(=O)[C@@H](CCCNC(N)=O)NC(=O)[C@H]1CCCN1C(=O)[C@H](NC(=O)c1ccccc1C#N)C(C)C

BIRTHDAY: 2018-11-19T08:12:27.755734
ATC: N02C
- NERVOUS SYSTEM
- ANALGESICS
- ANTIMIGRAINE PREPARATIONS
Synthesis plan pending
FORMULA:C20H22N4O4

SMILES: CC(C)[C@@H](NC(=O)c1ccccc1/C(N)=N\c1ccccc1C(N)=O)C(=O)O

BIRTHDAY: 2018-11-19T08:12:27.765181
ATC: A02B
- ALIMENTARY TRACT AND METABOLISM
- DRUGS FOR ACID RELATED DISORDERS
- DRUGS FOR PEPTIC ULCER AND GASTRO-OESOPHAGEAL REFLUX DISEASE (GORD)
Synthesis plan pending
FORMULA:C23H17ClF2N6O2

SMILES: N#Cc1[nH]c(=O)c(-c2cc(Cl)ccc2F)c(N)c1CO[C@@H](c1cccc(F)c1)c1ncc(N)[nH]1

BIRTHDAY: 2018-11-19T08:12:27.776476
ATC: M03A
- MUSCULO-SKELETAL SYSTEM
- MUSCLE RELAXANTS
- MUSCLE RELAXANTS, PERIPHERALLY ACTING AGENTS
Synthesis plan pending
FORMULA:C24H32O4

SMILES: COc1ccc([C@@H](O)CCCCCCCCCC(=O)c2ccc(O)cc2)cc1

BIRTHDAY: 2018-11-19T08:12:27.784174
ATC: C01C
- CARDIOVASCULAR SYSTEM
- CARDIAC THERAPY
- CARDIAC STIMULANTS EXCL. CARDIAC GLYCOSIDES
Synthesis plan pending
FORMULA:C24H16F2N6O2

SMILES: N#Cc1ccccc1[C@@H](OCc1cc(-c2cccc(F)c2F)c(=O)[nH]c1C#N)c1nc(N)c[nH]1

BIRTHDAY: 2018-11-19T08:12:27.795448
ATC: B03B
- BLOOD AND BLOOD FORMING ORGANS
- ANTIANEMIC PREPARATIONS
- VITAMIN B12 AND FOLIC ACID
Synthesis plan pending
FORMULA:C19H27N3O6

SMILES: CC(C)[C@@H](NC(=O)[C@H](CC(=O)O)CC(=O)NO)C(=O)NCCc1ccccc1

BIRTHDAY: 2018-11-19T08:12:27.805047
ATC: N05C
- NERVOUS SYSTEM
- PSYCHOLEPTICS
- HYPNOTICS AND SEDATIVES
Synthesis plan pending
FORMULA:C30H52N2O3

SMILES: CCCCCCCCCCCCCCCCCCCCC(=O)Nc1ccc([C@H](N)CC(=O)O)cc1

BIRTHDAY: 2018-11-19T08:12:27.813841
ATC: N07X
- NERVOUS SYSTEM
- OTHER NERVOUS SYSTEM DRUGS
- OTHER NERVOUS SYSTEM DRUGS
Synthesis plan pending
FORMULA:C24H20N6O2S

SMILES: Cc1csc(-c2cc(C#N)c(=O)n(C)c2CO[C@@H](c2ccc(C#N)cc2)c2cncn2C)n1

BIRTHDAY: 2018-11-19T08:12:27.824550
ATC: L01D
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- CYTOTOXIC ANTIBIOTICS AND RELATED SUBSTANCES
Synthesis plan pending
FORMULA:C25H27NO

SMILES: CC(C)(NC(=O)c1cccc(-c2ccccc2)c1)C(C)(C)c1ccccc1

BIRTHDAY: 2018-11-19T08:12:27.831909
ATC: C10A
- CARDIOVASCULAR SYSTEM
- LIPID MODIFYING AGENTS
- LIPID MODIFYING AGENTS, PLAIN
Synthesis plan pending
FORMULA:C24H16F2N6O2

SMILES: N#Cc1ccccc1[C@@H](OCc1c[nH]c(=O)c(-c2cccc(F)c2F)c1C#N)c1ncc(N)[nH]1

BIRTHDAY: 2018-11-19T08:12:27.843226
ATC: N06D
- NERVOUS SYSTEM
- PSYCHOANALEPTICS
- ANTI-DEMENTIA DRUGS
Synthesis plan pending
FORMULA:C25H27N3O2

SMILES: CC(C)c1c2cccc1-c1ccnc(n1)Nc1cccc(c1)COCC=CCCO2

BIRTHDAY: 2018-11-19T08:12:27.852519
ATC: P01A
- ANTIPARASITIC PRODUCTS, INSECTICIDES AND REPELLENTS
- ANTIPROTOZOALS
- AGENTS AGAINST AMOEBIASIS AND OTHER PROTOZOAL DISEASES
Synthesis plan pending
FORMULA:C20H22N4O4

SMILES: CC(C)[C@H](NC(=O)c1ccccc1/C(N)=N/c1ccccc1C(N)=O)C(=O)O

BIRTHDAY: 2018-11-19T08:12:27.873233
ATC: A02B
- ALIMENTARY TRACT AND METABOLISM
- DRUGS FOR ACID RELATED DISORDERS
- DRUGS FOR PEPTIC ULCER AND GASTRO-OESOPHAGEAL REFLUX DISEASE (GORD)
Synthesis plan pending
FORMULA:C18H22N2O9

SMILES: CC(C)[C@@H](NC(=O)[C@@H](CC(=O)O)NC(=O)[C@@]1(c2ccccc2)OCOO1)C(=O)O

BIRTHDAY: 2018-11-19T08:12:27.883872
ATC: B03B
- BLOOD AND BLOOD FORMING ORGANS
- ANTIANEMIC PREPARATIONS
- VITAMIN B12 AND FOLIC ACID
Synthesis plan pending
FORMULA:C25H35N7O5

SMILES: CNC(=O)[C@H](NC(=O)[C@@H]1CCN(C(=O)[C@H](NC(=O)c2cccc(C#N)c2)C(C)C)C1)C(C)(C)NC(N)=O

BIRTHDAY: 2018-11-19T08:12:27.895597
ATC: L02A
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ENDOCRINE THERAPY
- HORMONES AND RELATED AGENTS
Synthesis plan pending
FORMULA:C18H16Cl2N2O2S2

SMILES: C[C@@]1(NC(=O)c2ccccc2NC(=O)c2cc(Cl)cc(Cl)c2)CSCS1

BIRTHDAY: 2018-11-19T08:12:27.905061
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis plan pending
FORMULA:C19H23N3O8

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

BIRTHDAY: 2018-11-19T08:12:27.915340
ATC: C08D
- CARDIOVASCULAR SYSTEM
- CALCIUM CHANNEL BLOCKERS
- SELECTIVE CALCIUM CHANNEL BLOCKERS WITH DIRECT CARDIAC EFFECTS
Synthesis plan pending
FORMULA:C36H35N7O6

SMILES: CC(C)[C@H](NC(=O)c1ccccc1[C@H]1OCC=CCCOc2cc(ccn2)-c2ccnc(n2)Nc2cccc1c2)C(=O)N[C@H](C#N)C(=O)O

BIRTHDAY: 2018-11-19T08:12:27.933033
ATC: A02B
- ALIMENTARY TRACT AND METABOLISM
- DRUGS FOR ACID RELATED DISORDERS
- DRUGS FOR PEPTIC ULCER AND GASTRO-OESOPHAGEAL REFLUX DISEASE (GORD)
Synthesis plan pending
FORMULA:C27H35N5O7

SMILES: CC(C)C[C@H](NC(=O)c1ccc(C(N)=O)cc1)C(=O)N[C@@H](CCCNc1ccc(OCC(N)=O)cc1)C(=O)O

BIRTHDAY: 2018-11-19T08:12:27.955977
ATC: N07C
- NERVOUS SYSTEM
- OTHER NERVOUS SYSTEM DRUGS
- ANTIVERTIGO PREPARATIONS
Synthesis plan pending
FORMULA:C32H57NO3

SMILES: CC1=C[C@@H]2C[C@H]1N(C(=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(=O)O)C2

BIRTHDAY: 2018-11-19T08:12:27.964983
ATC: G01A
- GENITO URINARY SYSTEM AND SEX HORMONES
- GYNECOLOGICAL ANTIINFECTIVES AND ANTISEPTICS
- ANTIINFECTIVES AND ANTISEPTICS, EXCL. COMBINATIONS WITH CORTICOSTEROIDS
Synthesis plan pending
FORMULA:C40H49N5O4

SMILES: CC(C)(C)COc1cccc([C@]23CCN(C2)[C@@]2(C(=O)N[C@H](C#N)C(C)(C)C)C(=O)Cc4ccc(cc42)Oc2cccc(c2)CNCCN3)c1

BIRTHDAY: 2018-11-19T08:12:27.980086
ATC: S01B
- SENSORY ORGANS
- OPHTHALMOLOGICALS
- ANTIINFLAMMATORY AGENTS
Synthesis plan pending
FORMULA:C27H35N5O7

SMILES: CC(C)C[C@@H](NC(=O)c1cccc(C(N)=O)c1)C(=O)N[C@H](C(=O)O)C(C)(C)Nc1ccccc1OCC(N)=O

BIRTHDAY: 2018-11-19T08:12:27.992038
ATC: H01B
- SYSTEMIC HORMONAL PREPARATIONS, EXCL. SEX HORMONES AND INSULINS
- PITUITARY AND HYPOTHALAMIC HORMONES AND ANALOGUES
- POSTERIOR PITUITARY LOBE HORMONES
Synthesis plan pending
FORMULA:C34H37N5O5

SMILES: CC(C)[C@H](NC(=O)c1ccccc1C#N)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CCc1ccc(Nc2ccccc2)cc1)C(=O)O

BIRTHDAY: 2018-11-19T08:12:28.004552
ATC: C02A
- CARDIOVASCULAR SYSTEM
- ANTIHYPERTENSIVES
- ANTIADRENERGIC AGENTS, CENTRALLY ACTING
Synthesis plan pending
FORMULA:C22H36O3

SMILES: COc1ccc(C(C)(C)C)c([C@H](CC(=O)O)CC(C)C)c1C(C)(C)C

BIRTHDAY: 2018-11-19T08:12:28.013054
ATC: C03C
- CARDIOVASCULAR SYSTEM
- DIURETICS
- HIGH-CEILING DIURETICS
Synthesis plan pending
FORMULA:C23H17F3N6O2

SMILES: N#Cc1c(N)c(-c2cc(F)ccc2F)[nH]c(=O)c1CO[C@@H](c1cccc(F)c1)c1ncc(N)[nH]1

BIRTHDAY: 2018-11-19T08:12:28.024199
ATC: M03A
- MUSCULO-SKELETAL SYSTEM
- MUSCLE RELAXANTS
- MUSCLE RELAXANTS, PERIPHERALLY ACTING AGENTS
Synthesis plan pending
FORMULA:C22H25N3O5

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

BIRTHDAY: 2018-11-19T08:12:28.033834
ATC: D11A
- DERMATOLOGICALS
- OTHER DERMATOLOGICAL PREPARATIONS
- OTHER DERMATOLOGICAL PREPARATIONS
Synthesis plan pending
FORMULA:C24H31N3O3

SMILES: CC(C)C[C@@H](NC(=O)c1ccc(/C(N)=N/c2ccc(C(C)(C)C)cc2)cc1)C(=O)O

BIRTHDAY: 2018-11-19T08:12:28.050909
ATC: R06A
- RESPIRATORY SYSTEM
- ANTIHISTAMINES FOR SYSTEMIC USE
- ANTIHISTAMINES FOR SYSTEMIC USE
Synthesis plan pending
FORMULA:C26H27N3O2S

SMILES: COc1cccc([C@H](C(=O)N2C=CCN[C@@H]3C=CC=C[C@]32C)[C@@]23C=CC=C[C@H]2SC=N3)c1

BIRTHDAY: 2018-11-19T08:12:28.060997
ATC: N05C
- NERVOUS SYSTEM
- PSYCHOLEPTICS
- HYPNOTICS AND SEDATIVES
Synthesis plan pending
FORMULA:C27H38N4O4S2

SMILES: Cc1[n-]c(C[C@H](O)c2ccsc2)c([C@@]2([C@@H]3CCCCN3)N(C3CCCCCCC3)C=CC(=O)S2(=O)=O)[nH+]1

BIRTHDAY: 2018-11-19T08:12:28.074012
ATC: N06B
- NERVOUS SYSTEM
- PSYCHOANALEPTICS
- PSYCHOSTIMULANTS, AGENTS USED FOR ADHD AND NOOTROPICS
Synthesis plan pending
FORMULA:C25H32N4O5

SMILES: CC(C)C[C@H](NC(=O)c1ccccc1C(N)=O)C(=O)N[C@H](CCCNc1ccccc1)C(=O)O

BIRTHDAY: 2018-11-19T08:12:28.084109
ATC: C09C
- CARDIOVASCULAR SYSTEM
- AGENTS ACTING ON THE RENIN-ANGIOTENSIN SYSTEM
- ANGIOTENSIN II ANTAGONISTS, PLAIN
Synthesis plan pending
FORMULA:C29H50N2O2

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

BIRTHDAY: 2018-11-19T08:12:28.092348
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis plan pending
FORMULA:C18H13F3N4O

SMILES: Cn1cncc1[C@](C)(O)C#Cc1cc(C#N)cc([C@@H](C#N)C(F)(F)F)c1

BIRTHDAY: 2018-11-19T08:12:28.101235
ATC: M05B
- MUSCULO-SKELETAL SYSTEM
- DRUGS FOR TREATMENT OF BONE DISEASES
- DRUGS AFFECTING BONE STRUCTURE AND MINERALIZATION
Synthesis plan pending
FORMULA:C22H25N5O3

SMILES: CC(C)[C@@H](NC(=O)c1cccc(C#N)c1)C(=O)N1CC[C@H](C(=O)Nc2c[nH+]c[cH-]2)C1

BIRTHDAY: 2018-11-19T08:12:28.110972
ATC: H01C
- SYSTEMIC HORMONAL PREPARATIONS, EXCL. SEX HORMONES AND INSULINS
- PITUITARY AND HYPOTHALAMIC HORMONES AND ANALOGUES
- HYPOTHALAMIC HORMONES
Synthesis plan pending
FORMULA:C21H32N6O6

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

BIRTHDAY: 2018-11-19T08:12:28.121705
ATC: V09A
- VARIOUS
- DIAGNOSTIC RADIOPHARMACEUTICALS
- CENTRAL NERVOUS SYSTEM
Synthesis plan pending
FORMULA:C28H31NO3

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

BIRTHDAY: 2018-11-19T08:12:28.130458
ATC: M04A
- MUSCULO-SKELETAL SYSTEM
- ANTIGOUT PREPARATIONS
- ANTIGOUT PREPARATIONS
Synthesis plan pending
FORMULA:C25H27NO

SMILES: O=C(NCCCCCCc1ccccc1)c1ccc(-c2ccccc2)cc1

BIRTHDAY: 2018-11-19T08:12:28.137409
ATC: A10B
- ALIMENTARY TRACT AND METABOLISM
- DRUGS USED IN DIABETES
- BLOOD GLUCOSE LOWERING DRUGS, EXCL. INSULINS
Synthesis plan pending
FORMULA:C29H32N2O2

SMILES: COC(=O)c1ccccc1[C@](CN(C)C)(c1ccccc1C#N)c1ccccc1C(C)(C)C

BIRTHDAY: 2018-11-19T08:12:28.147964
ATC: A03A
- ALIMENTARY TRACT AND METABOLISM
- DRUGS FOR FUNCTIONAL GASTROINTESTINAL DISORDERS
- DRUGS FOR FUNCTIONAL GASTROINTESTINAL DISORDERS
Synthesis plan pending
FORMULA:C26H36N8O6

SMILES: CC(C)[C@H](NC(=O)c1cccc(C#N)c1)C(=O)N1CC[C@H](C(=O)N[C@H](C(=O)NCC(N)=O)C(C)(C)NC(N)=O)C1

BIRTHDAY: 2018-11-19T08:12:28.182843
ATC: L02A
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ENDOCRINE THERAPY
- HORMONES AND RELATED AGENTS
Synthesis plan pending
FORMULA:C20H22N4O4

SMILES: CC(C)[C@H](NC(=O)c1ccc(/C(N)=N/c2ccc(C(N)=O)cc2)cc1)C(=O)O

BIRTHDAY: 2018-11-19T08:12:28.219789
ATC: L01D
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- CYTOTOXIC ANTIBIOTICS AND RELATED SUBSTANCES
Synthesis plan pending
FORMULA:C18H26N4O2

SMILES: COc1ccccc1[C@@H](CN(C)C)[C@@H](N)C(=O)N1CC[C@@H](C#N)C1

BIRTHDAY: 2018-11-19T08:12:28.228071
ATC: P03B
- ANTIPARASITIC PRODUCTS, INSECTICIDES AND REPELLENTS
- ECTOPARASITICIDES, INCL. SCABICIDES, INSECTICIDES AND REPELLENTS
- INSECTICIDES AND REPELLENTS
Synthesis plan pending
FORMULA:C25H19ClF2N4O2

SMILES: Cn1cncc1[C@@H](OCc1c(-c2ccc(Cl)c(F)c2)cn(C)c(=O)c1C#N)c1ccc(F)cc1

BIRTHDAY: 2018-11-19T08:12:28.238709
ATC: D01A
- DERMATOLOGICALS
- ANTIFUNGALS FOR DERMATOLOGICAL USE
- ANTIFUNGALS FOR TOPICAL USE
Synthesis plan pending
FORMULA:C27H31N5O4

SMILES: CC(C)(C(=O)N1CCC(CC(=O)O)CC1)[C@@H](NC(=O)c1ccc(C(=N)N)cc1)c1ccc(C#N)cc1

BIRTHDAY: 2018-11-19T08:12:28.249165
ATC: J05A
- ANTIINFECTIVES FOR SYSTEMIC USE
- ANTIVIRALS FOR SYSTEMIC USE
- DIRECT ACTING ANTIVIRALS
Synthesis plan pending
FORMULA:C24H27N5O3

SMILES: CC(C)(NC(=O)c1ccccc1)C(=O)N1CCCC[C@H]1c1[nH]nnc1Oc1ccccc1

BIRTHDAY: 2018-11-19T08:12:28.259059
ATC: N05C
- NERVOUS SYSTEM
- PSYCHOLEPTICS
- HYPNOTICS AND SEDATIVES
Synthesis plan pending
FORMULA:C23H16F4N6O2

SMILES: Cn1nc(CO[C@@H](c2ncc(N)[nH]2)c2cccc(F)c2F)c(C#N)c(-c2cc(F)ccc2F)c1=O

BIRTHDAY: 2018-11-19T08:12:28.270577
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis plan pending
FORMULA:C22H25N3O5

SMILES: CC(C)[C@H](NC(=O)[C@@H](CC(=O)O)NC(=O)c1ccc(-c2ccccc2)cc1)C(N)=O

BIRTHDAY: 2018-11-19T08:12:28.279807
ATC: S01B
- SENSORY ORGANS
- OPHTHALMOLOGICALS
- ANTIINFLAMMATORY AGENTS
Synthesis plan pending
FORMULA:C22H33N3O7

SMILES: CC(C)[C@@H](NC(=O)[C@H](CC(=O)O)CC(=O)NO)C(=O)NCc1cccc(OC(C)(C)C)c1

BIRTHDAY: 2018-11-19T08:12:28.289883
ATC: N05C
- NERVOUS SYSTEM
- PSYCHOLEPTICS
- HYPNOTICS AND SEDATIVES
Synthesis plan pending
FORMULA:C24H16F2N6O2

SMILES: N#Cc1ccccc1[C@H](OCc1c[nH]c(=O)c(-c2cccc(F)c2F)c1C#N)c1ncc(N)[nH]1

BIRTHDAY: 2018-11-19T08:12:28.300743
ATC: N06D
- NERVOUS SYSTEM
- PSYCHOANALEPTICS
- ANTI-DEMENTIA DRUGS
Synthesis plan pending
FORMULA:C22H23F4NO5

SMILES: CC(C)(C(=O)N[C@@H](CC(=O)O)c1cccc(F)c1)[C@@H](O)c1ccccc1OCC(F)(F)F

BIRTHDAY: 2018-11-19T08:12:28.311362
ATC: A03A
- ALIMENTARY TRACT AND METABOLISM
- DRUGS FOR FUNCTIONAL GASTROINTESTINAL DISORDERS
- DRUGS FOR FUNCTIONAL GASTROINTESTINAL DISORDERS
Synthesis plan pending
FORMULA:C37H46N6O4

SMILES: CC(C)[C@@H](NC(=O)c1ccccc1C#N)C(=O)N1CC[C@@H](C(=O)N[C@@H](C#N)[C@]2(C)CCNCC(=O)CCCCCc3cccc2c3)C1

BIRTHDAY: 2018-11-19T08:12:28.324186
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis plan pending
FORMULA:C24H15N7O

SMILES: Cc1c(C#C[C@](O)(c2ccccc2C#N)c2nc[nH]c2N)cccc1C(C#N)(C#N)C#N

BIRTHDAY: 2018-11-19T08:12:28.334197
ATC: N02B
- NERVOUS SYSTEM
- ANALGESICS
- OTHER ANALGESICS AND ANTIPYRETICS
Synthesis plan pending
FORMULA:C22H30N2O7

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

BIRTHDAY: 2018-11-19T08:12:28.343877
ATC: M03B
- MUSCULO-SKELETAL SYSTEM
- MUSCLE RELAXANTS
- MUSCLE RELAXANTS, CENTRALLY ACTING AGENTS
Synthesis plan pending
FORMULA:C27H30N2O4

SMILES: CC(C)(NC(=O)c1ccccc1[C@H](CC(=O)O)c1ccc(=O)[nH]c1)C(C)(C)c1ccccc1

BIRTHDAY: 2018-11-30T17:24:07.020764
ATC: C07A
- CARDIOVASCULAR SYSTEM
- BETA BLOCKING AGENTS
- BETA BLOCKING AGENTS
Synthesis Plan
FORMULA:C23H29N3O3

SMILES: CC(C)[C@H](NC(=O)c1ccccc1/C(N)=N/c1ccccc1C(C)(C)C)C(=O)O

BIRTHDAY: 2018-11-30T17:24:07.029622
ATC: A03A
- ALIMENTARY TRACT AND METABOLISM
- DRUGS FOR FUNCTIONAL GASTROINTESTINAL DISORDERS
- DRUGS FOR FUNCTIONAL GASTROINTESTINAL DISORDERS
Synthesis Plan
FORMULA:C40H41N5O5

SMILES: C[C@@H]([C@H]1C[C@@]2(NCc3cccc(C#N)c3)CC[C@@H]1CO2)[C@@]1(N)Oc2cccc([N+](=O)[O-])c2-c2ccc(cc2)CCNc2ccc(cc2)CC1=O

BIRTHDAY: 2018-11-30T17:24:07.053387
ATC: L01C
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- PLANT ALKALOIDS AND OTHER NATURAL PRODUCTS
Synthesis Plan
FORMULA:C21H21N3O6

SMILES: CC(C)[C@@H](NC(=O)c1ccc(/C(N)=N\c2ccc(C(=O)O)cc2)cc1)C(=O)C(=O)O

BIRTHDAY: 2018-11-30T17:24:07.063377
ATC: M01A
- MUSCULO-SKELETAL SYSTEM
- ANTIINFLAMMATORY AND ANTIRHEUMATIC PRODUCTS
- ANTIINFLAMMATORY AND ANTIRHEUMATIC PRODUCTS, NON-STEROIDS
Synthesis Plan
FORMULA:C30H44N6O5

SMILES: CC(C)[C@H](NC(=O)c1cccc(C#N)c1)C(=O)N1CC[C@H](C(=O)N[C@H](C(=O)O)[C@@H](C)[C@]2(N)CCCCCCCN2)C1

BIRTHDAY: 2018-11-30T17:24:07.085630
ATC: J01D
- ANTIINFECTIVES FOR SYSTEMIC USE
- ANTIBACTERIALS FOR SYSTEMIC USE
- OTHER BETA-LACTAM ANTIBACTERIALS
Synthesis Plan
FORMULA:C27H37NO5

SMILES: COC(=O)c1ccccc1[C@@H](C(=O)NC(C)(C)C(C)(C)c1cccc(OC)c1OC)C(C)C

BIRTHDAY: 2018-11-30T17:24:07.096473
ATC: C08C
- CARDIOVASCULAR SYSTEM
- CALCIUM CHANNEL BLOCKERS
- SELECTIVE CALCIUM CHANNEL BLOCKERS WITH MAINLY VASCULAR EFFECTS
Synthesis Plan
FORMULA:C19H24N2O5

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

BIRTHDAY: 2018-11-30T17:24:07.104690
ATC: N03A
- NERVOUS SYSTEM
- ANTIEPILEPTICS
- ANTIEPILEPTICS
Synthesis Plan
FORMULA:C24H25N5O3

SMILES: N#Cc1ccc(C(=O)NCCCC(=O)N2CCC(n3c(=O)[nH]c4ccccc43)CC2)cc1

BIRTHDAY: 2018-11-30T17:24:07.114337
ATC: A10B
- ALIMENTARY TRACT AND METABOLISM
- DRUGS USED IN DIABETES
- BLOOD GLUCOSE LOWERING DRUGS, EXCL. INSULINS
Synthesis Plan
FORMULA:C27H29N5O4

SMILES: COc1cccc([C@@H](O)[C@@]23C=CC=C[C@H]2N(C(C)(C)CC(=O)Nc2ccccc2C#N)NC(=O)N3)c1

BIRTHDAY: 2018-11-30T17:24:07.125114
ATC: J01E
- ANTIINFECTIVES FOR SYSTEMIC USE
- ANTIBACTERIALS FOR SYSTEMIC USE
- SULFONAMIDES AND TRIMETHOPRIM
Synthesis Plan
FORMULA:C19H27N3O6

SMILES: CC(C)[C@H](NC(=O)[C@@H](CC(=O)O)CC(=O)NO)C(=O)NCCc1ccccc1

BIRTHDAY: 2018-11-30T17:24:07.134576
ATC: N05C
- NERVOUS SYSTEM
- PSYCHOLEPTICS
- HYPNOTICS AND SEDATIVES
Synthesis Plan
FORMULA:C25H27N5O2

SMILES: Cn1cc[n+]([O-])c1-c1cccc(C(=O)NCCCN2CC[C@@H](c3cccc(C#N)c3)C2)c1

BIRTHDAY: 2018-11-30T17:24:07.154170
ATC: A03F
- ALIMENTARY TRACT AND METABOLISM
- DRUGS FOR FUNCTIONAL GASTROINTESTINAL DISORDERS
- PROPULSIVES
Synthesis Plan
FORMULA:C20H22N4O4

SMILES: CC(C)[C@@H](NC(=O)c1ccc(/C(N)=N\c2ccc(C(N)=O)cc2)cc1)C(=O)O

BIRTHDAY: 2018-11-30T17:24:07.163786
ATC: L01D
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- CYTOTOXIC ANTIBIOTICS AND RELATED SUBSTANCES
Synthesis Plan
FORMULA:C29H33NO4

SMILES: COC(=O)c1ccccc1[C@@H](C(=O)NC(C)(C)C(C)(C)c1ccccc1)c1ccccc1OC

BIRTHDAY: 2018-11-30T17:24:07.186131
ATC: M04A
- MUSCULO-SKELETAL SYSTEM
- ANTIGOUT PREPARATIONS
- ANTIGOUT PREPARATIONS
Synthesis Plan
FORMULA:C30H52N2O2

SMILES: CCCCCCCCCCCCCCCCCCCCCCC(=O)Nc1ccc(C(N)=O)cc1

BIRTHDAY: 2018-11-30T17:24:07.194143
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C29H29N3O2S

SMILES: O=C(CCCCCCC(=O)Nc1nc(-c2ccccc2)cs1)Nc1ccc(-c2ccccc2)cc1

BIRTHDAY: 2018-12-02T16:07:15.489891
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C42H74N4O4

SMILES: CCCCCCCCCCCCCCCCCCCCCCC1C[C@@H]2CCC[C@H](C1)N2[C@H](Cc1cc(=O)[nH]c(=O)[nH]1)C(=O)N1CCC[C@@H]1CO

BIRTHDAY: 2018-12-02T16:07:15.503013
ATC: C10A
- CARDIOVASCULAR SYSTEM
- LIPID MODIFYING AGENTS
- LIPID MODIFYING AGENTS, PLAIN
Synthesis Plan
FORMULA:C20H22F3N3O7

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

BIRTHDAY: 2018-12-02T16:07:15.523853
ATC: J05A
- ANTIINFECTIVES FOR SYSTEMIC USE
- ANTIVIRALS FOR SYSTEMIC USE
- DIRECT ACTING ANTIVIRALS
Synthesis Plan
FORMULA:C25H19ClF2N4O2

SMILES: Cn1cncc1[C@H](OCc1c(C#N)cn(C)c(=O)c1-c1cc(F)ccc1Cl)c1cccc(F)c1

BIRTHDAY: 2018-12-02T16:07:15.545313
ATC: L02B
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ENDOCRINE THERAPY
- HORMONE ANTAGONISTS AND RELATED AGENTS
Synthesis Plan
FORMULA:C33H34N2O2

SMILES: O=C(NCCC[C@H](Cc1ccccc1)C(=O)NCC(c1ccccc1)c1ccccc1)c1ccccc1

BIRTHDAY: 2018-12-02T16:07:15.554873
ATC: N02B
- NERVOUS SYSTEM
- ANALGESICS
- OTHER ANALGESICS AND ANTIPYRETICS
Synthesis Plan
FORMULA:C29H33NO4

SMILES: COC(=O)c1ccccc1[C@@H](C(=O)NC(C)(C)C(C)(C)c1ccccc1)c1cccc(OC)c1

BIRTHDAY: 2018-12-02T16:07:15.574802
ATC: M04A
- MUSCULO-SKELETAL SYSTEM
- ANTIGOUT PREPARATIONS
- ANTIGOUT PREPARATIONS
Synthesis Plan
FORMULA:C23H17ClF2N6O2

SMILES: N#Cc1c(-c2cc(Cl)ccc2F)c(CO[C@H](c2cccc(F)c2)c2ncc(N)[nH]2)[nH]c(=O)c1N

BIRTHDAY: 2018-12-02T16:07:15.586110
ATC: M03A
- MUSCULO-SKELETAL SYSTEM
- MUSCLE RELAXANTS
- MUSCLE RELAXANTS, PERIPHERALLY ACTING AGENTS
Synthesis Plan
FORMULA:C27H30N2O4

SMILES: O=C(O)C[C@H](c1ccc(C(=O)NCCCCCCc2ccccc2)cc1)c1ccc(=O)[nH]c1

BIRTHDAY: 2018-12-02T16:07:15.595483
ATC: C07A
- CARDIOVASCULAR SYSTEM
- BETA BLOCKING AGENTS
- BETA BLOCKING AGENTS
Synthesis Plan
FORMULA:C14H23N3O8

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

BIRTHDAY: 2018-12-02T16:07:15.605416
ATC: A11D
- ALIMENTARY TRACT AND METABOLISM
- VITAMINS
- VITAMIN B1, PLAIN AND IN COMBINATION WITH VITAMIN B6 AND B12
Synthesis Plan
FORMULA:C30H34FNO4

SMILES: CC(C)(NC(=O)C[C@H](CC(=O)O)c1ccccc1OCc1cccc(F)c1)C(C)(C)c1ccccc1

BIRTHDAY: 2018-12-02T16:07:15.615773
ATC: M01A
- MUSCULO-SKELETAL SYSTEM
- ANTIINFLAMMATORY AND ANTIRHEUMATIC PRODUCTS
- ANTIINFLAMMATORY AND ANTIRHEUMATIC PRODUCTS, NON-STEROIDS
Synthesis Plan
FORMULA:C23H27NO3S

SMILES: CSCC[C@H]1CCCCC=CCOC(=O)CC(c2ccccc2)=C(C#N)C1=O

BIRTHDAY: 2018-12-02T16:07:15.624406
ATC: L02B
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ENDOCRINE THERAPY
- HORMONE ANTAGONISTS AND RELATED AGENTS
Synthesis Plan
FORMULA:C26H37N3S

SMILES: CSc1nc2c(c(-c3ccc(C(C)(C)C)cc3)n1)CN(C1CCCCCCC1)CC2

BIRTHDAY: 2018-12-02T16:07:15.665171
ATC: R06A
- RESPIRATORY SYSTEM
- ANTIHISTAMINES FOR SYSTEMIC USE
- ANTIHISTAMINES FOR SYSTEMIC USE
Synthesis Plan
FORMULA:C25H19ClF2N4O2

SMILES: Cn1cncc1[C@@H](OCc1c(-c2ccc(Cl)c(F)c2)cc(C#N)c(=O)n1C)c1ccc(F)cc1

BIRTHDAY: 2018-12-02T16:07:15.676124
ATC: C03B
- CARDIOVASCULAR SYSTEM
- DIURETICS
- LOW-CEILING DIURETICS, EXCL. THIAZIDES
Synthesis Plan
FORMULA:C23H17ClF2N6O2

SMILES: N#Cc1[nH]c(=O)c(-c2cc(Cl)ccc2F)c(CO[C@@H](c2cccc(F)c2)c2ncc(N)[nH]2)c1N

BIRTHDAY: 2018-12-03T10:43:37.045088
ATC: A14A
- ALIMENTARY TRACT AND METABOLISM
- ANABOLIC AGENTS FOR SYSTEMIC USE
- ANABOLIC STEROIDS
Synthesis Plan
FORMULA:C25H17F2N5O2

SMILES: Cn1cncc1[C@H](OCc1[nH]c(=O)cc(-c2cc(F)cc(F)c2)c1C#N)c1ccccc1C#N

BIRTHDAY: 2018-12-03T10:43:37.056111
ATC: D01A
- DERMATOLOGICALS
- ANTIFUNGALS FOR DERMATOLOGICAL USE
- ANTIFUNGALS FOR TOPICAL USE
Synthesis Plan
FORMULA:C24H29N3O7

SMILES: CC(C)[C@H](NC(=O)[C@H](CC(=O)O)CC(=O)NO)C(=O)NCc1ccc(Oc2ccccc2)cc1

BIRTHDAY: 2018-12-03T10:43:37.067010
ATC: C03C
- CARDIOVASCULAR SYSTEM
- DIURETICS
- HIGH-CEILING DIURETICS
Synthesis Plan
FORMULA:C19H27N3O7

SMILES: COc1cccc(CNC(=O)[C@@H](NC(=O)[C@H](CC(=O)O)CC(=O)NO)C(C)C)c1

BIRTHDAY: 2018-12-03T10:43:37.087375
ATC: N05C
- NERVOUS SYSTEM
- PSYCHOLEPTICS
- HYPNOTICS AND SEDATIVES
Synthesis Plan
FORMULA:C36H75N3O2

SMILES: CC(C)C(C)(C)C(C)(C)C(C)(C)C(C)(C)C(C)(C)C(C)(C)[C@H](O)C(C)(C)[C@@]1(NC(C(C)(C)C)C(C)(C)C)CONN1

BIRTHDAY: 2018-12-03T10:43:37.099530
ATC: C02K
- CARDIOVASCULAR SYSTEM
- ANTIHYPERTENSIVES
- OTHER ANTIHYPERTENSIVES
Synthesis Plan
FORMULA:C15H20ClN3O5S

SMILES: CC(C)[C@H](NC(=O)c1ccc(Cl)s1)C(=O)N[C@H](CCC(N)=O)C(=O)O

BIRTHDAY: 2018-12-03T10:43:37.108873
ATC: J05A
- ANTIINFECTIVES FOR SYSTEMIC USE
- ANTIVIRALS FOR SYSTEMIC USE
- DIRECT ACTING ANTIVIRALS
Synthesis Plan
FORMULA:C27H37NO5

SMILES: COC(=O)c1ccc([C@H](C(=O)NCCCCCCc2ccc(OC)c(OC)c2)C(C)C)cc1

BIRTHDAY: 2018-12-03T10:43:37.117941
ATC: C03D
- CARDIOVASCULAR SYSTEM
- DIURETICS
- POTASSIUM-SPARING AGENTS
Synthesis Plan
FORMULA:C19H23N3O8

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

BIRTHDAY: 2018-12-03T10:43:37.139176
ATC: D01A
- DERMATOLOGICALS
- ANTIFUNGALS FOR DERMATOLOGICAL USE
- ANTIFUNGALS FOR TOPICAL USE
Synthesis Plan
FORMULA:C21H19FN6O3

SMILES: N#Cc1[nH]c(=O)c2c(c1CO[C@@H](c1cccc(F)c1)c1[nH]cnc1N)[C@@H]1C[C@@H]2OCN1

BIRTHDAY: 2018-12-03T10:43:37.150068
ATC: N01A
- NERVOUS SYSTEM
- ANESTHETICS
- ANESTHETICS, GENERAL
Synthesis Plan
FORMULA:C29H33NO4

SMILES: COC(=O)c1ccccc1[C@H](C(=O)NC(C)(C)C(C)(C)c1ccccc1)c1ccccc1OC

BIRTHDAY: 2018-12-03T10:43:37.161562
ATC: M04A
- MUSCULO-SKELETAL SYSTEM
- ANTIGOUT PREPARATIONS
- ANTIGOUT PREPARATIONS
Synthesis Plan
FORMULA:C25H17F2N5O2

SMILES: Cn1cnc([C@H](OCc2c[nH]c(=O)c(-c3ccc(F)cc3F)c2C#N)c2cccc(C#N)c2)c1

BIRTHDAY: 2018-12-03T10:43:37.172465
ATC: S01X
- SENSORY ORGANS
- OPHTHALMOLOGICALS
- OTHER OPHTHALMOLOGICALS
Synthesis Plan
FORMULA:C24H37NO4

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

BIRTHDAY: 2018-12-03T10:43:37.181045
ATC: V03A
- VARIOUS
- ALL OTHER THERAPEUTIC PRODUCTS
- ALL OTHER THERAPEUTIC PRODUCTS
Synthesis Plan
FORMULA:C27H30N2O4

SMILES: O=C(O)C[C@@H](c1ccc(C(=O)NCCCCCCc2ccccc2)cc1)c1ccc(=O)[nH]c1

BIRTHDAY: 2018-12-03T10:43:37.190438
ATC: C07A
- CARDIOVASCULAR SYSTEM
- BETA BLOCKING AGENTS
- BETA BLOCKING AGENTS
Synthesis Plan
FORMULA:C24H17F4N5O2

SMILES: Cn1cncc1[C@H](OCc1c(C#N)c(N)[nH]c(=O)c1-c1ccc(F)c(F)c1)c1ccc(F)c(F)c1

BIRTHDAY: 2018-12-03T19:12:01.756200
ATC: P01B
- ANTIPARASITIC PRODUCTS, INSECTICIDES AND REPELLENTS
- ANTIPROTOZOALS
- ANTIMALARIALS
Synthesis Plan
FORMULA:C19H26N4O6S

SMILES: CC(C)[C@H](NC(=O)[C@H](CC(=O)O)CC(=O)NO)C(=O)NCC1=C2C=CC=C[C@H]2SN1

BIRTHDAY: 2018-12-03T19:12:01.776185
ATC: C03C
- CARDIOVASCULAR SYSTEM
- DIURETICS
- HIGH-CEILING DIURETICS
Synthesis Plan
FORMULA:C25H35N7O5

SMILES: CNC(=O)[C@@H](CCCNC(N)=O)NC(=O)[C@H]1CCCN1C(=O)[C@@H](NC(=O)c1ccccc1C#N)C(C)C

BIRTHDAY: 2018-12-03T19:12:01.800269
ATC: N02C
- NERVOUS SYSTEM
- ANALGESICS
- ANTIMIGRAINE PREPARATIONS
Synthesis Plan
FORMULA:C25H32N4O7

SMILES: CC(C)[C@@H](NC(=O)[C@H](CCCNC(=O)c1ccc(C#N)cc1)CC(=O)O)C(=O)N1CCC[C@H]1C(=O)O

BIRTHDAY: 2018-12-03T19:12:01.811843
ATC: C09A
- CARDIOVASCULAR SYSTEM
- AGENTS ACTING ON THE RENIN-ANGIOTENSIN SYSTEM
- ACE INHIBITORS, PLAIN
Synthesis Plan
FORMULA:C18H12F3N3O2S

SMILES: O=C(Nc1ccccc1C(=O)Nc1nccs1)c1ccc(C(F)(F)F)cc1

BIRTHDAY: 2018-12-03T19:12:01.821751
ATC: D11A
- DERMATOLOGICALS
- OTHER DERMATOLOGICAL PREPARATIONS
- OTHER DERMATOLOGICAL PREPARATIONS
Synthesis Plan
FORMULA:C26H36N8O6

SMILES: CC(C)[C@@H](NC(=O)c1ccc(C#N)cc1)C(=O)N1CCC[C@@H]1C(=O)N[C@@H](CCCNC(N)=O)C(=O)NCC(N)=O

BIRTHDAY: 2018-12-03T19:12:01.834802
ATC: G02C
- GENITO URINARY SYSTEM AND SEX HORMONES
- OTHER GYNECOLOGICALS
- OTHER GYNECOLOGICALS
Synthesis Plan
FORMULA:C29H33NO4

SMILES: COC(=O)c1ccc([C@@H](C(=O)NCCCCCCc2ccccc2)c2ccc(OC)cc2)cc1

BIRTHDAY: 2018-12-03T19:12:01.844015
ATC: B01A
- BLOOD AND BLOOD FORMING ORGANS
- ANTITHROMBOTIC AGENTS
- ANTITHROMBOTIC AGENTS
Synthesis Plan
FORMULA:C22H16F3N3O3

SMILES: N#Cc1ccccc1[C@H]1C=C[C@H]2CC[C@@H]1N2C(=O)c1cccc([N+](=O)[O-])c1C(F)(F)F

BIRTHDAY: 2018-12-03T19:12:01.854814
ATC: N02C
- NERVOUS SYSTEM
- ANALGESICS
- ANTIMIGRAINE PREPARATIONS
Synthesis Plan
FORMULA:C26H23N3O7S

SMILES: C[C@H](NC(=O)c1ccc(NC(=O)c2cccc([C@H](C(=O)O)[C@H]3CSC(=O)n4cccc43)c2)cc1)C(=O)O

BIRTHDAY: 2018-12-03T19:12:01.866701
ATC: D01A
- DERMATOLOGICALS
- ANTIFUNGALS FOR DERMATOLOGICAL USE
- ANTIFUNGALS FOR TOPICAL USE
Synthesis Plan
FORMULA:C26H30ClN7O3

SMILES: CC(C)[C@@]1(c2ccc(Cl)cc2)CNCC(=O)c2c(CO[C@@H](C)c3ncc(N)[nH]3)[nH]c(=O)c(C#N)c2CN1

BIRTHDAY: 2018-12-03T19:12:01.880045
ATC: P02C
- ANTIPARASITIC PRODUCTS, INSECTICIDES AND REPELLENTS
- ANTHELMINTICS
- ANTINEMATODAL AGENTS
Synthesis Plan
FORMULA:C31H32ClFN10O6S

SMILES: C[C@H]1NCc2nc(cs2)C(=O)NCCNC(=O)COC(=O)[C@]1(C)[C@H](OCc1c(N)c(C#N)[nH]c(=O)c1-c1cccc(F)c1Cl)c1[nH]cnc1N

BIRTHDAY: 2018-12-03T19:12:01.906655
ATC: N02A
- NERVOUS SYSTEM
- ANALGESICS
- OPIOIDS
Synthesis Plan
FORMULA:C17H17IN2O7P

SMILES: Cn1cnc([C@H](O[C@]2(c3ccccc3)OPOI[C@@]23COC=CO3)C(=O)O)c1

BIRTHDAY: 2018-12-03T19:12:01.917903
ATC: L01B
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- ANTIMETABOLITES
Synthesis Plan
FORMULA:C28H33NO3

SMILES: COc1ccccc1C(C(=O)NC(C)(C)C(C)(C)c1ccccc1)c1ccccc1OC

BIRTHDAY: 2018-12-03T19:12:01.926641
ATC: N03A
- NERVOUS SYSTEM
- ANTIEPILEPTICS
- ANTIEPILEPTICS
Synthesis Plan
FORMULA:C39H61NO5S

SMILES: CC(C)(C)C(C)(C)C(C)(C)C(C)(C)C(C)(C)C(C)(C)C(C)(C)CC(=O)Nc1ccccc1[C@]1(C(=O)O)CO[C@]2(O)C=CC=C[C@@H]2S1

BIRTHDAY: 2018-12-01T22:31:07.868442
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C25H26N6O3

SMILES: N#Cc1ccc(C(=O)NCCCC(=O)N2CCC[C@@H](c3nn[nH]c3Oc3ccccc3)C2)cc1

BIRTHDAY: 2018-12-01T22:31:07.878936
ATC: G03D
- GENITO URINARY SYSTEM AND SEX HORMONES
- SEX HORMONES AND MODULATORS OF THE GENITAL SYSTEM
- PROGESTOGENS
Synthesis Plan
FORMULA:C30H52N2O2

SMILES: CC(C)(C)C(C)(C)C(C)(C)C(C)(C)C(C)(C)C(C)(C)C(C)(C)C(=O)Nc1ccccc1C(N)=O

BIRTHDAY: 2018-12-01T22:31:07.887246
ATC: R03D
- RESPIRATORY SYSTEM
- DRUGS FOR OBSTRUCTIVE AIRWAY DISEASES
- OTHER SYSTEMIC DRUGS FOR OBSTRUCTIVE AIRWAY DISEASES
Synthesis Plan
FORMULA:C28H48N2O2

SMILES: CC(C)(C)C(C)(C)C(C)(C)C(C)(C)C(C)(C)C(C)(C)CC(=O)Nc1ccccc1C(N)=O

BIRTHDAY: 2018-12-01T22:31:07.931366
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C18H29N5

SMILES: Nc1cnc([C@@]23C=CC=C[C@]2(N)NCCCCCCCCC3)[nH]1

BIRTHDAY: 2018-12-01T22:31:07.958510
ATC: C03C
- CARDIOVASCULAR SYSTEM
- DIURETICS
- HIGH-CEILING DIURETICS
Synthesis Plan
FORMULA:C24H16F2N6O2

SMILES: N#Cc1ccccc1[C@H](OCc1c(C#N)c(-c2cccc(F)c2F)c[nH]c1=O)c1ncc(N)[nH]1

BIRTHDAY: 2018-12-01T22:31:07.969864
ATC: N06D
- NERVOUS SYSTEM
- PSYCHOANALEPTICS
- ANTI-DEMENTIA DRUGS
Synthesis Plan
FORMULA:C34H37N5O5

SMILES: CC(C)[C@@H](NC(=O)c1ccccc1C#N)C(=O)N1CCC[C@@H]1C(=O)N[C@@H](CCc1ccc(Nc2ccccc2)cc1)C(=O)O

BIRTHDAY: 2018-12-01T22:31:07.982510
ATC: C02A
- CARDIOVASCULAR SYSTEM
- ANTIHYPERTENSIVES
- ANTIADRENERGIC AGENTS, CENTRALLY ACTING
Synthesis Plan
FORMULA:C20H29N3O7

SMILES: CCOc1ccc(CNC(=O)[C@H](NC(=O)[C@@H](CC(=O)O)CC(=O)NO)C(C)C)cc1

BIRTHDAY: 2018-12-01T22:31:07.992653
ATC: N05C
- NERVOUS SYSTEM
- PSYCHOLEPTICS
- HYPNOTICS AND SEDATIVES
Synthesis Plan
FORMULA:C29H41N3O7

SMILES: CC(C)[C@@H](N[C@H]1COC[C@@H]2CCC[C@H](CCOC[C@H]1C#N)O2)C(=O)N[C@@H](CCC(=O)O)C(=O)c1ccccc1

BIRTHDAY: 2018-12-01T22:31:08.005074
ATC: A10B
- ALIMENTARY TRACT AND METABOLISM
- DRUGS USED IN DIABETES
- BLOOD GLUCOSE LOWERING DRUGS, EXCL. INSULINS
Synthesis Plan
FORMULA:C19H23N3O6

SMILES: CC(C)[C@@H](NC(=O)[C@H](CC(=O)O)NC(=O)CCc1ccc(C#N)cc1)C(=O)O

BIRTHDAY: 2018-12-01T22:31:08.014728
ATC: D07A
- DERMATOLOGICALS
- CORTICOSTEROIDS, DERMATOLOGICAL PREPARATIONS
- CORTICOSTEROIDS, PLAIN
Synthesis Plan
FORMULA:C22H25N3O5

SMILES: CC(C)[C@@H](NC(=O)[C@@H](CC(=O)O)NC(=O)c1cccc(-c2ccccc2)c1)C(N)=O

BIRTHDAY: 2018-12-01T22:31:08.024103
ATC: J05A
- ANTIINFECTIVES FOR SYSTEMIC USE
- ANTIVIRALS FOR SYSTEMIC USE
- DIRECT ACTING ANTIVIRALS
Synthesis Plan
FORMULA:C23H26N4O2S

SMILES: O=C1[C@H]2CC3C[C@H]1CN(C2)[C@@H]3NC(=O)[C@@H](Cc1ncc[nH]1)[C@]12C=CC=C[C@@H]1SC=C2

BIRTHDAY: 2018-12-01T22:31:08.034170
ATC: A12A
- ALIMENTARY TRACT AND METABOLISM
- MINERAL SUPPLEMENTS
- CALCIUM
Synthesis Plan