matter.farm

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

These compounds may interact with:

Sphingosine 1-phosphate receptor 4

Potentially involved in: carcinoma; multiple sclerosis; diabetes mellitus, experimental; lung adenocarcinoma; psoriasis; relapsing remitting multiple sclerosis

Disease data sourced from Pharos.

Modulator

FORMULA:C29H50N2O3

SMILES: COc1cccc(C(N)=O)c1NC(=O)CC(C)(C)C(C)(C)C(C)(C)C(C)(C)C(C)(C)C(C)(C)C

BIRTHDAY: 2018-12-01T14:11:09.070348
ATC: N02B
- NERVOUS SYSTEM
- ANALGESICS
- OTHER ANALGESICS AND ANTIPYRETICS
Synthesis Plan
FORMULA:C14H16F6N2O

SMILES: CC(C)C[C@@H](N)C(=O)Nc1cc(C(F)(F)F)cc(C(F)(F)F)c1

BIRTHDAY: 2018-12-01T14:11:09.079221
ATC: N03A
- NERVOUS SYSTEM
- ANTIEPILEPTICS
- ANTIEPILEPTICS
Synthesis Plan
FORMULA:C31H43F3N2O2

SMILES: CC(C)CCCCCCCCCCCCCC(=O)Nc1cc(-c2cccc(C(F)(F)F)c2)ccc1C(N)=O

BIRTHDAY: 2018-12-01T14:11:09.089191
ATC: V08C
- VARIOUS
- CONTRAST MEDIA
- MAGNETIC RESONANCE IMAGING CONTRAST MEDIA
Synthesis Plan
FORMULA:C29H50N2O3

SMILES: CCCCCCCCCCCCCCCCCCCCC(=O)Nc1ccc(C(N)=O)cc1OC

BIRTHDAY: 2018-12-01T14:11:09.097570
ATC: N05A
- NERVOUS SYSTEM
- PSYCHOLEPTICS
- ANTIPSYCHOTICS
Synthesis Plan
FORMULA:C25H20F3N3O3

SMILES: COc1cccc(C(=O)NCCc2ccc(-c3noc(-c4ccc(C(F)(F)F)cc4)n3)cc2)c1

BIRTHDAY: 2018-12-01T14:11:09.107837
ATC: A08A
- ALIMENTARY TRACT AND METABOLISM
- ANTIOBESITY PREPARATIONS, EXCL. DIET PRODUCTS
- ANTIOBESITY PREPARATIONS, EXCL. DIET PRODUCTS
Synthesis Plan
FORMULA:C24H18F3N3O3

SMILES: COc1ccc(C(=O)NCc2ccccc2-c2noc(-c3ccccc3C(F)(F)F)n2)cc1

BIRTHDAY: 2018-12-01T14:11:09.118249
ATC: S01E
- SENSORY ORGANS
- OPHTHALMOLOGICALS
- ANTIGLAUCOMA PREPARATIONS AND MIOTICS
Synthesis Plan
FORMULA:C25H20N4O3

SMILES: COc1cccc(C(=O)N[C@@H](C)c2ccccc2-c2nc(-c3ccccc3C#N)no2)c1

BIRTHDAY: 2018-12-01T14:11:09.128229
ATC: D07A
- DERMATOLOGICALS
- CORTICOSTEROIDS, DERMATOLOGICAL PREPARATIONS
- CORTICOSTEROIDS, PLAIN
Synthesis Plan
FORMULA:C28H48N2O3

SMILES: CCCCCCCCCCCCCCCCCCCC(=O)Nc1ccc(C(N)=O)cc1OC

BIRTHDAY: 2018-12-01T14:11:09.136483
ATC: N05A
- NERVOUS SYSTEM
- PSYCHOLEPTICS
- ANTIPSYCHOTICS
Synthesis Plan
FORMULA:C25H23N3O3

SMILES: COc1cccc(C(=O)NC(C)(C)c2ccccc2C(=O)Nc2ccccc2C#N)c1

BIRTHDAY: 2018-12-01T14:11:09.145926
ATC: C02A
- CARDIOVASCULAR SYSTEM
- ANTIHYPERTENSIVES
- ANTIADRENERGIC AGENTS, CENTRALLY ACTING
Synthesis Plan
FORMULA:C13H17N3S

SMILES: Cc1ccccc1-n1nc(C(C)(C)C)[nH]c1=S

BIRTHDAY: 2018-12-01T14:11:09.152766
ATC: J04A
- ANTIINFECTIVES FOR SYSTEMIC USE
- ANTIMYCOBACTERIALS
- DRUGS FOR TREATMENT OF TUBERCULOSIS
Synthesis Plan
FORMULA:C27H37F3N2O4

SMILES: CC(C)C[C@H](Cc1cccc(C(F)(F)F)c1)C(=O)N[C@H](CC(C)C)C(=O)N1CCC[C@]12OCCC2=O

BIRTHDAY: 2018-12-01T14:11:09.165323
ATC: A10B
- ALIMENTARY TRACT AND METABOLISM
- DRUGS USED IN DIABETES
- BLOOD GLUCOSE LOWERING DRUGS, EXCL. INSULINS
Synthesis Plan
FORMULA:C25H17F3N4O3

SMILES: C[C@@H](NC(=O)c1cccc(OC(F)(F)F)c1)c1ccccc1-c1nc(-c2ccccc2C#N)no1

BIRTHDAY: 2018-12-01T14:11:09.176796
ATC: D07A
- DERMATOLOGICALS
- CORTICOSTEROIDS, DERMATOLOGICAL PREPARATIONS
- CORTICOSTEROIDS, PLAIN
Synthesis Plan
FORMULA:C27H46N2O3

SMILES: COc1cccc(C(N)=O)c1NC(=O)[C@H](C)C(C)(C)C(C)(C)C(C)(C)C(C)(C)C(C)(C)C

BIRTHDAY: 2018-12-01T14:11:09.193689
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:C19H30ClN2PS

SMILES: CCCCCCCCC[C@H]1C=C[S@H](P)N/C1=N/c1ccc(Cl)cc1

BIRTHDAY: 2018-12-01T14:11:09.210018
ATC: A12A
- ALIMENTARY TRACT AND METABOLISM
- MINERAL SUPPLEMENTS
- CALCIUM
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)Nc1cccc(C(N)=O)c1

BIRTHDAY: 2018-12-01T14:11:09.217944
ATC: A02B
- ALIMENTARY TRACT AND METABOLISM
- DRUGS FOR ACID RELATED DISORDERS
- DRUGS FOR PEPTIC ULCER AND GASTRO-OESOPHAGEAL REFLUX DISEASE (GORD)
Synthesis Plan
FORMULA:C21H33NO3

SMILES: CCCCCCC[C@@H]1OCCCCCCOc2ccccc2NC1=O

BIRTHDAY: 2018-12-01T14:11:09.225546
ATC: H01B
- SYSTEMIC HORMONAL PREPARATIONS, EXCL. SEX HORMONES AND INSULINS
- PITUITARY AND HYPOTHALAMIC HORMONES AND ANALOGUES
- POSTERIOR PITUITARY LOBE HORMONES
Synthesis Plan
FORMULA:C36H36N6O5

SMILES: CC(C)CC(=O)NC/C=C\c1ccc(-c2noc(-c3ccc4cc3COCC=CCOCc3cc(co3)-c3ccnc(n3)N4)n2)cc1

BIRTHDAY: 2018-12-01T14:11:09.239085
ATC: A16A
- ALIMENTARY TRACT AND METABOLISM
- OTHER ALIMENTARY TRACT AND METABOLISM PRODUCTS
- OTHER ALIMENTARY TRACT AND METABOLISM PRODUCTS
Synthesis Plan
FORMULA:C17H21NO3

SMILES: CC(C)C1(C)[C@H]2C[C@H]1C2C(=O)Nc1cccc(C(=O)O)c1

BIRTHDAY: 2018-12-25T02:03:12.441097
ATC: V09X
- VARIOUS
- DIAGNOSTIC RADIOPHARMACEUTICALS
- OTHER DIAGNOSTIC RADIOPHARMACEUTICALS
Synthesis Plan
FORMULA:C23H33N3O2

SMILES: C[C@H]1[C@H]2C[C@](C)(C(C)(C)C(C)(C)C)[C@@H](O2)[C@]12N=NC=C1C=CC=C[C@]12C(N)=O

BIRTHDAY: 2018-12-25T02:03:12.459253
ATC: G01A
- GENITO URINARY SYSTEM AND SEX HORMONES
- GYNECOLOGICAL ANTIINFECTIVES AND ANTISEPTICS
- ANTIINFECTIVES AND ANTISEPTICS, EXCL. COMBINATIONS WITH CORTICOSTEROIDS
Synthesis Plan
FORMULA:C25H17F6N3O3

SMILES: O=C(NCCc1ccc(-c2noc(-c3ccc(C(F)(F)F)cc3)n2)cc1)c1cccc(OC(F)(F)F)c1

BIRTHDAY: 2018-12-25T02:03:12.470962
ATC: A08A
- ALIMENTARY TRACT AND METABOLISM
- ANTIOBESITY PREPARATIONS, EXCL. DIET PRODUCTS
- ANTIOBESITY PREPARATIONS, EXCL. DIET PRODUCTS
Synthesis Plan
FORMULA:C28H48N2O2

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

BIRTHDAY: 2018-12-25T02:03:12.478924
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C24H33ClN2O2

SMILES: COc1ccc2c(c1)COCNCCCC[C@H](C)N[C@@H](c1ccc(Cl)cc1)CC2

BIRTHDAY: 2018-12-25T02:03:12.487753
ATC: R05D
- RESPIRATORY SYSTEM
- COUGH AND COLD PREPARATIONS
- COUGH SUPPRESSANTS, EXCL. COMBINATIONS WITH EXPECTORANTS
Synthesis Plan
FORMULA:C27H44N2O4

SMILES: CCCCCCCCCCCCCCCCCCC(=O)Nc1ccc(C(=O)O)c(C(N)=O)c1

BIRTHDAY: 2018-12-25T02:03:12.496497
ATC: A07A
- ALIMENTARY TRACT AND METABOLISM
- ANTIDIARRHEALS, INTESTINAL ANTIINFLAMMATORY/ANTIINFECTIVE AGENTS
- INTESTINAL ANTIINFECTIVES
Synthesis Plan
FORMULA:C18H35N3O3

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

BIRTHDAY: 2018-12-25T02:03:12.513016
ATC: S01A
- SENSORY ORGANS
- OPHTHALMOLOGICALS
- ANTIINFECTIVES
Synthesis Plan
FORMULA:C28H48N2O3

SMILES: COc1cccc(C(N)=O)c1NC(=O)C(C)(C)C(C)(C)C(C)(C)C(C)(C)C(C)(C)C(C)(C)C

BIRTHDAY: 2018-12-25T02:03:12.530550
ATC: M03A
- MUSCULO-SKELETAL SYSTEM
- MUSCLE RELAXANTS
- MUSCLE RELAXANTS, PERIPHERALLY ACTING AGENTS
Synthesis Plan
FORMULA:C22H30F3NO3

SMILES: C[C@@H](C(C)(C)C)[C@]12CNC[C@@H](CO[C@@H]1C(=O)OCc1ccccc1C(F)(F)F)C2

BIRTHDAY: 2018-12-25T02:03:12.540057
ATC: M01A
- MUSCULO-SKELETAL SYSTEM
- ANTIINFLAMMATORY AND ANTIRHEUMATIC PRODUCTS
- ANTIINFLAMMATORY AND ANTIRHEUMATIC PRODUCTS, NON-STEROIDS
Synthesis Plan
FORMULA:C21H23F3N2O3

SMILES: COc1ccc(C(=O)NCCCCCC(=O)Nc2ccc(C(F)(F)F)cc2)cc1

BIRTHDAY: 2018-12-25T02:03:12.549092
ATC: N06A
- NERVOUS SYSTEM
- PSYCHOANALEPTICS
- ANTIDEPRESSANTS
Synthesis Plan
FORMULA:C28H38N2O

SMILES: CC(C)(C(=O)Nc1ccccc1-c1ccccc1)C(C)(C)[C@H]1CC2CCC(CC2)CN1

BIRTHDAY: 2018-12-25T02:03:12.565837
ATC: C04A
- CARDIOVASCULAR SYSTEM
- PERIPHERAL VASODILATORS
- PERIPHERAL VASODILATORS
Synthesis Plan
FORMULA:C29H48N2O4

SMILES: CCCCCCCCCCCCCCCCCCCCC(=O)Nc1ccc(C(=O)O)c(C(N)=O)c1

BIRTHDAY: 2018-12-25T02:03:12.574867
ATC: A07A
- ALIMENTARY TRACT AND METABOLISM
- ANTIDIARRHEALS, INTESTINAL ANTIINFLAMMATORY/ANTIINFECTIVE AGENTS
- INTESTINAL ANTIINFECTIVES
Synthesis Plan
FORMULA:C34H34N6O5

SMILES: CN(C)CCCNC(=O)c1ccccc1NC(=O)c1ccccc1NC(=O)c1ccc(NC(=O)c2ccc(C(N)=O)cc2)cc1

BIRTHDAY: 2018-12-25T02:03:12.587817
ATC: N02B
- NERVOUS SYSTEM
- ANALGESICS
- OTHER ANALGESICS AND ANTIPYRETICS
Synthesis Plan
FORMULA:C18H35N3O3

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

BIRTHDAY: 2018-12-03T02:39:16.228046
ATC: S01A
- SENSORY ORGANS
- OPHTHALMOLOGICALS
- ANTIINFECTIVES
Synthesis Plan
FORMULA:C25H20F3N3O3

SMILES: COc1ccccc1C(=O)NCCc1ccc(-c2noc(-c3ccc(C(F)(F)F)cc3)n2)cc1

BIRTHDAY: 2018-12-03T02:39:16.238462
ATC: N06A
- NERVOUS SYSTEM
- PSYCHOANALEPTICS
- ANTIDEPRESSANTS
Synthesis Plan
FORMULA:C20H28N2O2

SMILES: O=c1cc([C@H]2CCN[C@@H](CCCCCCc3ccccc3)C2)o[nH]1

BIRTHDAY: 2018-12-03T02:39:16.245911
ATC: L04A
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- IMMUNOSUPPRESSANTS
- IMMUNOSUPPRESSANTS
Synthesis Plan
FORMULA:C24H18F3N3O3

SMILES: COc1ccc(C(=O)NCc2ccccc2-c2nc(-c3ccccc3C(F)(F)F)no2)cc1

BIRTHDAY: 2018-12-03T02:39:16.256535
ATC: S01E
- SENSORY ORGANS
- OPHTHALMOLOGICALS
- ANTIGLAUCOMA PREPARATIONS AND MIOTICS
Synthesis Plan
FORMULA:C27H46N2O3

SMILES: CCCCCCCCCCCCCCCCCCC(=O)Nc1ccc(C(N)=O)cc1OC

BIRTHDAY: 2018-12-03T02:39:16.264696
ATC: N05A
- NERVOUS SYSTEM
- PSYCHOLEPTICS
- ANTIPSYCHOTICS
Synthesis Plan
FORMULA:C27H46N2O2

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

BIRTHDAY: 2018-12-03T02:39:16.272418
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C29H50N2O3

SMILES: CCCCCCCCCCCCCCCCCCCCC(=O)Nc1cc(C(N)=O)ccc1OC

BIRTHDAY: 2018-12-03T02:39:16.297903
ATC: D11A
- DERMATOLOGICALS
- OTHER DERMATOLOGICAL PREPARATIONS
- OTHER DERMATOLOGICAL PREPARATIONS
Synthesis Plan
FORMULA:C26H41F3N2O2

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

BIRTHDAY: 2018-12-03T02:39:16.307873
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:C36H64N2O4

SMILES: CC(C)(C)C(C)(C)C(C)(C)C(C)(C)C(C)(C)C(C)(C)CC(=O)N[C@]1(C)CCCO[C@@H]2C=CC=C[C@@H]2NCC(=O)OCC1

BIRTHDAY: 2018-12-03T02:39:16.318810
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C24H33NO2

SMILES: C=C(C(=O)[C@H]1[C@H]2CCN3[C@@H]1[C@](C)(C(C)(C)C)CC[C@@H]3C2)c1ccccc1O

BIRTHDAY: 2018-12-03T02:39:16.327320
ATC: N05A
- NERVOUS SYSTEM
- PSYCHOLEPTICS
- ANTIPSYCHOTICS
Synthesis Plan
FORMULA:C26H41F3N2O2

SMILES: CC(C)C(C)(C)C(C)(C)C(C)(C)C(C)(C)[C@H](C)C(=O)Nc1c(C(N)=O)cccc1C(F)(F)F

BIRTHDAY: 2018-12-03T02:39:16.339503
ATC: J01F
- ANTIINFECTIVES FOR SYSTEMIC USE
- ANTIBACTERIALS FOR SYSTEMIC USE
- MACROLIDES, LINCOSAMIDES AND STREPTOGRAMINS
Synthesis Plan
FORMULA:C18H19N3O2S

SMILES: COc1ccccc1C(=O)NCc1cccc(C)c1[C@H]1C=NSN1

BIRTHDAY: 2018-11-30T03:41:13.161013
ATC: V03A
- VARIOUS
- ALL OTHER THERAPEUTIC PRODUCTS
- ALL OTHER THERAPEUTIC PRODUCTS
Synthesis plan pending
FORMULA:C34H67NO4

SMILES: CCCCCCCCCCCCCCCCCCCCCC(=O)N1[C@H](CO)CCCCCC[C@@H](O)C[C@@H]1CO

BIRTHDAY: 2018-11-30T03:41:13.170482
ATC: R06A
- RESPIRATORY SYSTEM
- ANTIHISTAMINES FOR SYSTEMIC USE
- ANTIHISTAMINES FOR SYSTEMIC USE
Synthesis plan pending
FORMULA:C28H48N2O3

SMILES: CCCCCCCCCCCCCCCCCCCC(=O)Nc1cc(C(N)=O)ccc1OC

BIRTHDAY: 2018-11-30T03:41:13.187541
ATC: D11A
- DERMATOLOGICALS
- OTHER DERMATOLOGICAL PREPARATIONS
- OTHER DERMATOLOGICAL PREPARATIONS
Synthesis plan pending
FORMULA:C26H42O3

SMILES: C[C@@H](C1=CCC=C[C@](C)([C@@H](C)O)C(=O)C=CCC1=O)C(C)(C)C(C)(C)C(C)(C)C

BIRTHDAY: 2018-11-30T03:41:13.195400
ATC: J05A
- ANTIINFECTIVES FOR SYSTEMIC USE
- ANTIVIRALS FOR SYSTEMIC USE
- DIRECT ACTING ANTIVIRALS
Synthesis plan pending
FORMULA:C29H43ClN4

SMILES: CCCCCCCCCCCCCCCCCCc1cn2cc(-c3ccccc3Cl)nc2nn1

BIRTHDAY: 2018-11-30T03:41:13.204289
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis plan pending
FORMULA:C15H24N2O

SMILES: Cc1cc(C)c(C)c(NC(=O)[C@@H](N)CC(C)C)c1

BIRTHDAY: 2018-11-30T03:41:13.228981
ATC: J01D
- ANTIINFECTIVES FOR SYSTEMIC USE
- ANTIBACTERIALS FOR SYSTEMIC USE
- OTHER BETA-LACTAM ANTIBACTERIALS
Synthesis plan pending
FORMULA:C18H35N3O3

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

BIRTHDAY: 2018-11-30T03:41:13.237114
ATC: S01A
- SENSORY ORGANS
- OPHTHALMOLOGICALS
- ANTIINFECTIVES
Synthesis plan pending
FORMULA:C17H17ClN2OS

SMILES: CC(C)CC1=N[N-][CH+][C@H](c2ccc(-c3ccc(Cl)cc3)o2)S1

BIRTHDAY: 2018-11-30T03:41:13.245212
ATC: A03F
- ALIMENTARY TRACT AND METABOLISM
- DRUGS FOR FUNCTIONAL GASTROINTESTINAL DISORDERS
- PROPULSIVES
Synthesis plan pending
FORMULA:C25H20F3N3O3

SMILES: COc1cccc(C(=O)N[C@H](C)c2ccccc2-c2nc(-c3ccccc3C(F)(F)F)no2)c1

BIRTHDAY: 2018-11-30T03:41:13.263975
ATC: H02A
- SYSTEMIC HORMONAL PREPARATIONS, EXCL. SEX HORMONES AND INSULINS
- CORTICOSTEROIDS FOR SYSTEMIC USE
- CORTICOSTEROIDS FOR SYSTEMIC USE, PLAIN
Synthesis plan pending
FORMULA:C30H52N2O3

SMILES: COc1cccc(C(N)=O)c1NC(=O)[C@@H](C)C(C)(C)C(C)(C)C(C)(C)C(C)(C)C(C)(C)C(C)(C)C

BIRTHDAY: 2018-11-30T03:41:13.300528
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:C25H20F3N3O3

SMILES: COc1ccc(C(=O)N[C@@H](C)c2ccccc2-c2nc(-c3ccccc3C(F)(F)F)no2)cc1

BIRTHDAY: 2018-11-30T03:41:13.311283
ATC: N06A
- NERVOUS SYSTEM
- PSYCHOANALEPTICS
- ANTIDEPRESSANTS
Synthesis plan pending
FORMULA:C25H17F6N3O3

SMILES: C[C@H](NC(=O)c1ccccc1OC(F)(F)F)c1ccccc1-c1nc(-c2ccccc2C(F)(F)F)no1

BIRTHDAY: 2018-11-30T03:41:13.323437
ATC: N05C
- NERVOUS SYSTEM
- PSYCHOLEPTICS
- HYPNOTICS AND SEDATIVES
Synthesis plan pending
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: 2018-11-30T03:41:13.331440
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis plan pending
FORMULA:C21H20F6N2O3

SMILES: C[C@@H](C(=O)Nc1ccccc1C(F)(F)F)C(C)(C)NC(=O)c1ccccc1OC(F)(F)F

BIRTHDAY: 2018-11-19T08:19:41.434059
ATC: P03A
- ANTIPARASITIC PRODUCTS, INSECTICIDES AND REPELLENTS
- ECTOPARASITICIDES, INCL. SCABICIDES, INSECTICIDES AND REPELLENTS
- ECTOPARASITICIDES, INCL. SCABICIDES
Synthesis plan pending
FORMULA:C30H52N2O3

SMILES: CCCCCCCCCCCCCCCCCCCCCC(=O)Nc1ccc(C(N)=O)cc1OC

BIRTHDAY: 2018-11-19T08:19:41.442671
ATC: N05A
- NERVOUS SYSTEM
- PSYCHOLEPTICS
- ANTIPSYCHOTICS
Synthesis plan pending
FORMULA:C22H35N3O5

SMILES: COc1ccc(CNC(=O)[C@@H](CC(C)C)NC(=O)[C@H](CC(=O)NO)CC(C)C)cc1

BIRTHDAY: 2018-11-19T08:19:41.461141
ATC: L01C
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- PLANT ALKALOIDS AND OTHER NATURAL PRODUCTS
Synthesis plan pending
FORMULA:C28H46N2O4

SMILES: CC(C)(C)C(C)(C)C(C)(C)C(C)(C)C(C)(C)C(C)(C)C(=O)Nc1c(C(N)=O)cccc1C(=O)O

BIRTHDAY: 2018-11-19T08:19:41.472014
ATC: R03D
- RESPIRATORY SYSTEM
- DRUGS FOR OBSTRUCTIVE AIRWAY DISEASES
- OTHER SYSTEMIC DRUGS FOR OBSTRUCTIVE AIRWAY DISEASES
Synthesis plan pending
FORMULA:C27H36F2N4O4

SMILES: C[C@H](O)ONC(=O)C(C)(C)C(C)(C)O[C@]1(C(C)(C)C)C=CC=C2C=NC=N[C@]21Nc1cc(F)cc(F)c1

BIRTHDAY: 2018-11-19T08:19:41.484010
ATC: L01D
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- CYTOTOXIC ANTIBIOTICS AND RELATED SUBSTANCES
Synthesis plan pending
FORMULA:C25H39F3N2O2

SMILES: CC(C)C(C)(C)C(C)(C)C(C)(C)C(C)(C)CC(=O)Nc1c(C(N)=O)cccc1C(F)(F)F

BIRTHDAY: 2018-11-19T08:19:41.494678
ATC: J01F
- ANTIINFECTIVES FOR SYSTEMIC USE
- ANTIBACTERIALS FOR SYSTEMIC USE
- MACROLIDES, LINCOSAMIDES AND STREPTOGRAMINS
Synthesis plan pending
FORMULA:C23H26N4O4

SMILES: COc1ccc(C(=O)NCCCCCC(=O)Nc2ccc(-c3noc(C)n3)cc2)cc1

BIRTHDAY: 2018-11-19T08:19:41.504292
ATC: A10B
- ALIMENTARY TRACT AND METABOLISM
- DRUGS USED IN DIABETES
- BLOOD GLUCOSE LOWERING DRUGS, EXCL. INSULINS
Synthesis plan pending
FORMULA:C28H36N2O6

SMILES: Cc1ccc(OC(C)(C)C(=O)N[C@H](CC(C)C)C(=O)N[C@H](CC(=O)O)C(=O)c2ccccc2)c(C)c1

BIRTHDAY: 2018-11-19T08:19:41.515291
ATC: A03F
- ALIMENTARY TRACT AND METABOLISM
- DRUGS FOR FUNCTIONAL GASTROINTESTINAL DISORDERS
- PROPULSIVES
Synthesis plan pending
FORMULA:C25H42O3

SMILES: CC(C)[C@@H]1C=CCCCC=C(C(C)(C)C(C)(C)C(C)(C)C)COC(=O)CC1=O

BIRTHDAY: 2018-11-19T08:19:41.523103
ATC: R03D
- RESPIRATORY SYSTEM
- DRUGS FOR OBSTRUCTIVE AIRWAY DISEASES
- OTHER SYSTEMIC DRUGS FOR OBSTRUCTIVE AIRWAY DISEASES
Synthesis plan pending
FORMULA:C27H24N2O4

SMILES: COc1ccccc1C(=O)NCCc1ccc(C(=O)Nc2ccc(-c3ccco3)cc2)cc1

BIRTHDAY: 2018-11-19T08:19:41.533071
ATC: N05C
- NERVOUS SYSTEM
- PSYCHOLEPTICS
- HYPNOTICS AND SEDATIVES
Synthesis plan pending
FORMULA:C22H30F3N3O6

SMILES: CC(C)C[C@@H](NC(=O)C(C)(C)Oc1ccc(C(F)(F)F)cc1)C(=O)N[C@H](CCC(N)=O)C(=O)O

BIRTHDAY: 2018-11-19T08:19:41.544093
ATC: C10A
- CARDIOVASCULAR SYSTEM
- LIPID MODIFYING AGENTS
- LIPID MODIFYING AGENTS, PLAIN
Synthesis plan pending
FORMULA:C27H46N2O2

SMILES: CCCCCCCCCCCCCCCCCCCC(=O)Nc1ccccc1C(N)=O

BIRTHDAY: 2018-11-19T08:19:41.551851
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis plan pending
FORMULA:C19H25N5O2

SMILES: CC1=NC=N[C@]2(N)OC=C[C@@]12c1ccccc1NC(=O)[C@@H](N)CC(C)C

BIRTHDAY: 2018-11-19T08:19:41.561400
ATC: J01D
- ANTIINFECTIVES FOR SYSTEMIC USE
- ANTIBACTERIALS FOR SYSTEMIC USE
- OTHER BETA-LACTAM ANTIBACTERIALS
Synthesis plan pending
FORMULA:C28H48N2O3

SMILES: COc1cc(NC(=O)C(C)(C)C(C)(C)C(C)(C)C(C)(C)C(C)(C)C(C)(C)C)cc(C(N)=O)c1

BIRTHDAY: 2018-11-19T08:19:41.569880
ATC: M04A
- MUSCULO-SKELETAL SYSTEM
- ANTIGOUT PREPARATIONS
- ANTIGOUT PREPARATIONS
Synthesis plan pending
FORMULA:C28H48N2O3

SMILES: CCCCCCCCCCCCCCCCCCCC(=O)Nc1ccc(C(N)=O)c(OC)c1

BIRTHDAY: 2018-11-19T08:19:41.578193
ATC: C10A
- CARDIOVASCULAR SYSTEM
- LIPID MODIFYING AGENTS
- LIPID MODIFYING AGENTS, PLAIN
Synthesis plan pending
FORMULA:C19H16F3N3O3

SMILES: COc1ccccc1-c1nc([C@@H](C)C(=O)Nc2ccccc2C(F)(F)F)no1

BIRTHDAY: 2018-11-19T08:19:41.588141
ATC: M02A
- MUSCULO-SKELETAL SYSTEM
- TOPICAL PRODUCTS FOR JOINT AND MUSCULAR PAIN
- TOPICAL PRODUCTS FOR JOINT AND MUSCULAR PAIN
Synthesis plan pending
FORMULA:C29H50N2O3

SMILES: CCCC(C)(C)CCCCCCC(C)(C)C(C)(C)[C@@H](C)C(=O)Nc1cc(C(N)=O)ccc1OC

BIRTHDAY: 2018-11-19T08:19:41.596831
ATC: L01A
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- ALKYLATING AGENTS
Synthesis plan pending
FORMULA:C25H46N2O2S

SMILES: CC(C)(C)C(C)(C)C(C)(C)C(C)(C)C(C)(C)[C@]1(C)CS(=O)(=O)N[C@H]2C=CC=C[C@@]21N

BIRTHDAY: 2018-11-19T08:19:41.605463
ATC: S01X
- SENSORY ORGANS
- OPHTHALMOLOGICALS
- OTHER OPHTHALMOLOGICALS
Synthesis plan pending
FORMULA:C27H46N2O3

SMILES: CCCCCCCCCCCCCCCCCCC(=O)Nc1cc(C(N)=O)ccc1OC

BIRTHDAY: 2018-11-19T08:19:41.613792
ATC: D11A
- DERMATOLOGICALS
- OTHER DERMATOLOGICAL PREPARATIONS
- OTHER DERMATOLOGICAL PREPARATIONS
Synthesis plan pending
FORMULA:C26H42N2O4

SMILES: CC(C)C(C)(C)C(C)(C)C(C)(C)C(C)(C)[C@@H](C)C(=O)Nc1c(C(N)=O)cccc1C(=O)O

BIRTHDAY: 2018-11-19T08:19:41.624466
ATC: J01F
- ANTIINFECTIVES FOR SYSTEMIC USE
- ANTIBACTERIALS FOR SYSTEMIC USE
- MACROLIDES, LINCOSAMIDES AND STREPTOGRAMINS
Synthesis plan pending
FORMULA:C25H33N3

SMILES: CCCc1cc2[nH]c1CCCCCCCCCc1ccc([nH]1)C=C1C=CC2=N1

BIRTHDAY: 2018-11-19T08:19:41.632566
ATC: C09A
- CARDIOVASCULAR SYSTEM
- AGENTS ACTING ON THE RENIN-ANGIOTENSIN SYSTEM
- ACE INHIBITORS, PLAIN
Synthesis plan pending
FORMULA:C23H33NO6S

SMILES: CC(C)[C@@H]1SN[C@H](CCCCCC(=O)O)[C@@H](C(=O)OCCCc2ccccc2)OC1=O

BIRTHDAY: 2018-11-19T08:19:41.642283
ATC: A16A
- ALIMENTARY TRACT AND METABOLISM
- OTHER ALIMENTARY TRACT AND METABOLISM PRODUCTS
- OTHER ALIMENTARY TRACT AND METABOLISM PRODUCTS
Synthesis plan pending
FORMULA:C27H24N2O4

SMILES: COc1ccccc1C(=O)N[C@H](C)c1ccc(C(=O)Nc2ccc(-c3ccco3)cc2)cc1

BIRTHDAY: 2018-11-19T08:19:41.660311
ATC: N05C
- NERVOUS SYSTEM
- PSYCHOLEPTICS
- HYPNOTICS AND SEDATIVES
Synthesis plan pending
FORMULA:C27H46N2O3

SMILES: COc1cccc(C(N)=O)c1NC(=O)[C@@H](C)C(C)(C)C(C)(C)C(C)(C)C(C)(C)C(C)(C)C

BIRTHDAY: 2018-11-19T08:19:41.669101
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:C32H56N6O3

SMILES: CC(C)C(C)(C)C(C)(C)C(C)(C)C(C)(C)CC(=O)Nc1ccccc1[C@]1(N)NCCNCC(=O)CNCCNC1=O

BIRTHDAY: 2018-11-19T08:19:41.681061
ATC: H01B
- SYSTEMIC HORMONAL PREPARATIONS, EXCL. SEX HORMONES AND INSULINS
- PITUITARY AND HYPOTHALAMIC HORMONES AND ANALOGUES
- POSTERIOR PITUITARY LOBE HORMONES
Synthesis plan pending
FORMULA:C35H53N3O3

SMILES: CC(C)(C)C(C)(C)C(C)(C)C(C)(C)c1c2cccc1O[C@@H](C(=O)NC1CC1)CCCOc1ccc(cn1)CCNC2

BIRTHDAY: 2018-11-19T08:19:41.692747
ATC: L01C
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- PLANT ALKALOIDS AND OTHER NATURAL PRODUCTS
Synthesis plan pending
FORMULA:C20H31ClN2O3

SMILES: CC(C)CNC(=O)[C@@H](CC(C)C)NC(=O)C(C)(C)Oc1ccc(Cl)cc1

BIRTHDAY: 2018-11-19T08:19:41.709932
ATC: C10A
- CARDIOVASCULAR SYSTEM
- LIPID MODIFYING AGENTS
- LIPID MODIFYING AGENTS, PLAIN
Synthesis plan pending
FORMULA:C27H46N2O3

SMILES: COc1cc(NC(=O)[C@@H](C)C(C)(C)C(C)(C)C(C)(C)C(C)(C)C(C)(C)C)cc(C(N)=O)c1

BIRTHDAY: 2018-11-19T08:19:41.718640
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:C19H17F3N2O4

SMILES: N#Cc1ccccc1OC[C@H](CO)CNC(=O)c1ccc(OC(F)(F)F)cc1

BIRTHDAY: 2018-11-19T08:19:41.728109
ATC: A03F
- ALIMENTARY TRACT AND METABOLISM
- DRUGS FOR FUNCTIONAL GASTROINTESTINAL DISORDERS
- PROPULSIVES
Synthesis plan pending
FORMULA:C24H47NO5

SMILES: CCCCCCCCCCCCCCCCC1COC(C(=O)NC(CO)CO)OC1

BIRTHDAY: 2018-11-19T08:19:41.736232
ATC: A10B
- ALIMENTARY TRACT AND METABOLISM
- DRUGS USED IN DIABETES
- BLOOD GLUCOSE LOWERING DRUGS, EXCL. INSULINS
Synthesis plan pending
FORMULA:C27H46N2O3

SMILES: CCCCCCCCCCCCCCCCCCC(=O)Nc1ccc(C(N)=O)c(OC)c1

BIRTHDAY: 2018-11-19T08:19:41.744445
ATC: C10A
- CARDIOVASCULAR SYSTEM
- LIPID MODIFYING AGENTS
- LIPID MODIFYING AGENTS, PLAIN
Synthesis plan pending
FORMULA:C23H22F3N3O2

SMILES: CC(C)CC(=O)NC/C=C/c1ccc(-c2noc(-c3ccc(C(F)(F)F)cc3)n2)cc1

BIRTHDAY: 2018-11-19T08:19:41.762270
ATC: J01M
- ANTIINFECTIVES FOR SYSTEMIC USE
- ANTIBACTERIALS FOR SYSTEMIC USE
- QUINOLONE ANTIBACTERIALS
Synthesis plan pending
FORMULA:C21H25N3O4

SMILES: Cc1c(NC(=O)[C@@H](N)CC(C)C)cccc1C(=O)Nc1ccc(C(=O)O)cc1

BIRTHDAY: 2018-11-19T08:19:41.771115
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis plan pending
FORMULA:C27H46N2O2

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

BIRTHDAY: 2018-11-19T08:19:41.779067
ATC: R03D
- RESPIRATORY SYSTEM
- DRUGS FOR OBSTRUCTIVE AIRWAY DISEASES
- OTHER SYSTEMIC DRUGS FOR OBSTRUCTIVE AIRWAY DISEASES
Synthesis plan pending
FORMULA:C28H48N2O3

SMILES: CCCCCCCCCCCCCCCCCCCC(=O)Nc1cc(OC)ccc1C(N)=O

BIRTHDAY: 2018-11-19T08:19:41.787478
ATC: C02D
- CARDIOVASCULAR SYSTEM
- ANTIHYPERTENSIVES
- ARTERIOLAR SMOOTH MUSCLE, AGENTS ACTING ON
Synthesis plan pending
FORMULA:C19H25ClN2S2

SMILES: CC(C)[C@@]12CCCC[C@H](CC[C@@]13N=C(c1ccccc1Cl)SS3)N2

BIRTHDAY: 2018-11-19T08:19:41.795757
ATC: A10A
- ALIMENTARY TRACT AND METABOLISM
- DRUGS USED IN DIABETES
- INSULINS AND ANALOGUES
Synthesis plan pending
FORMULA:C14H16F6N2O

SMILES: CC(C)C[C@H](N)C(=O)Nc1cccc(C(F)(F)F)c1C(F)(F)F

BIRTHDAY: 2018-11-19T08:19:41.804773
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:C24H23F3N2O6S2

SMILES: CC(C)[C@@]1(C(F)(F)F)C[C@H]2C=C[C@@]1(S(=O)(=O)Nc1ccc(C(=O)Nc3cccc(C(=O)O)c3)cc1)[S@@+]2[O-]

BIRTHDAY: 2018-11-19T08:19:41.818246
ATC: P01B
- ANTIPARASITIC PRODUCTS, INSECTICIDES AND REPELLENTS
- ANTIPROTOZOALS
- ANTIMALARIALS
Synthesis plan pending
FORMULA:C30H46N4O6

SMILES: CCCCCCCCCCCCCCC[C@@H]1C(=O)O[C@@H](C(=O)Oc2cnnnc2)O[C@]23CC[C@@H]4O[C@@H](CN2)[C@@H]3[C@H]41

BIRTHDAY: 2018-11-19T08:19:41.830219
ATC: D01A
- DERMATOLOGICALS
- ANTIFUNGALS FOR DERMATOLOGICAL USE
- ANTIFUNGALS FOR TOPICAL USE
Synthesis plan pending
FORMULA:C29H39N3O4

SMILES: CC(C)C[C@H](Cc1ccccc1C(C)(C)C)C(=O)N[C@H](CC(C)C)C(=O)c1nnc(-c2ccoc2)o1

BIRTHDAY: 2018-11-19T08:19:41.841170
ATC: C03C
- CARDIOVASCULAR SYSTEM
- DIURETICS
- HIGH-CEILING DIURETICS
Synthesis plan pending
FORMULA:C16H15N3O4S3

SMILES: CCC1=C(C(=O)OCC(=O)Nc2ccc(-c3noc(C)n3)cc2)SSS1

BIRTHDAY: 2018-11-19T08:19:41.858343
ATC: N05A
- NERVOUS SYSTEM
- PSYCHOLEPTICS
- ANTIPSYCHOTICS
Synthesis plan pending
FORMULA:C32H45F3N2O2

SMILES: CC(C)C(C)(C)C(C)(C)C(C)(C)C(C)(C)[C@@H](C)C(=O)Nc1c(C(N)=O)cccc1-c1ccccc1C(F)(F)F

BIRTHDAY: 2018-11-19T08:19:41.871620
ATC: J01F
- ANTIINFECTIVES FOR SYSTEMIC USE
- ANTIBACTERIALS FOR SYSTEMIC USE
- MACROLIDES, LINCOSAMIDES AND STREPTOGRAMINS
Synthesis plan pending
FORMULA:C31H43F3N2O2

SMILES: CC(C)C(C)(C)C(C)(C)C(C)(C)C(C)(C)CC(=O)Nc1c(C(N)=O)cccc1-c1ccccc1C(F)(F)F

BIRTHDAY: 2018-11-19T08:19:41.902991
ATC: C02D
- CARDIOVASCULAR SYSTEM
- ANTIHYPERTENSIVES
- ARTERIOLAR SMOOTH MUSCLE, AGENTS ACTING ON
Synthesis plan pending
FORMULA:C19H19BFNO3S3

SMILES: COc1ccc([C@]2(C(=O)Nc3ccccc3F)OBC[C@@H]2[SH]2SC=CS2)cc1

BIRTHDAY: 2018-11-19T08:19:41.922456
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:C38H63N5O6

SMILES: CC[C@H]1[C@H](O)C[C@@H](CCCCC2C[C@H]3CCC[C@H](C2)N3C(=O)C(C)(C)C)[C@H]1C[C@@]1(O)CCCOc2cncc(n2)NC(=O)NCCOCC1

BIRTHDAY: 2018-11-19T08:19:41.936761
ATC: N03A
- NERVOUS SYSTEM
- ANTIEPILEPTICS
- ANTIEPILEPTICS
Synthesis plan pending
FORMULA:C14H16F6N2O

SMILES: CC(C)C[C@@H](N)C(=O)Nc1cccc(C(F)(F)F)c1C(F)(F)F

BIRTHDAY: 2018-11-19T08:19:41.945755
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:C14H16F6N2O

SMILES: CC(C)C[C@@H](N)C(=O)Nc1ccc(C(F)(F)F)cc1C(F)(F)F

BIRTHDAY: 2018-11-19T08:19:41.954501
ATC: N03A
- NERVOUS SYSTEM
- ANTIEPILEPTICS
- ANTIEPILEPTICS
Synthesis plan pending
FORMULA:C30H31FN4O4

SMILES: Cc1cccc(-c2noc(-c3ccccc3CNC(=O)c3ccccc3O[C@]3(F)CCNCCCO3)n2)c1C

BIRTHDAY: 2018-11-19T08:19:41.975752
ATC: D07A
- DERMATOLOGICALS
- CORTICOSTEROIDS, DERMATOLOGICAL PREPARATIONS
- CORTICOSTEROIDS, PLAIN
Synthesis plan pending
FORMULA:C25H36F3N3O3

SMILES: CC(C)C[C@H](NC(=O)[C@@H](Cc1ccccc1C(F)(F)F)CC(C)C)C(=O)N1CC[C@H](C(N)=O)C1

BIRTHDAY: 2018-11-19T08:19:41.986861
ATC: N01A
- NERVOUS SYSTEM
- ANESTHETICS
- ANESTHETICS, GENERAL
Synthesis plan pending
FORMULA:C21H20F3N3O2

SMILES: CC(C)CC(=O)NCc1cccc(-c2nc(-c3ccccc3C(F)(F)F)no2)c1

BIRTHDAY: 2018-11-19T08:19:41.996147
ATC: N03A
- NERVOUS SYSTEM
- ANTIEPILEPTICS
- ANTIEPILEPTICS
Synthesis plan pending
FORMULA:C28H44N4O2S

SMILES: C[C@H](O)NC(=O)[C@]12C=CC=CC1=CC=N[C@]21NN=C[C@](C)(C(C)(C)C(C)(C)C(C)(C)C(C)(C)C)S1

BIRTHDAY: 2018-11-19T08:19:42.007188
ATC: C09C
- CARDIOVASCULAR SYSTEM
- AGENTS ACTING ON THE RENIN-ANGIOTENSIN SYSTEM
- ANGIOTENSIN II ANTAGONISTS, PLAIN
Synthesis plan pending
FORMULA:C16H20N4O

SMILES: CC(C)CC(=O)NC/C=C/c1ccc2nc(N)ncc2c1

BIRTHDAY: 2018-11-19T08:19:42.014512
ATC: D10A
- DERMATOLOGICALS
- ANTI-ACNE PREPARATIONS
- ANTI-ACNE PREPARATIONS FOR TOPICAL USE
Synthesis plan pending
FORMULA:C39H67NO4

SMILES: CC1(C)CN(C(=O)C(C)(C)C(C)(C)C(C)(C)C(C)(C)C(C)(C)C(C)(C)C)CO[C@](C)(OC(=O)c2ccccc2C(C)(C)C)C1

BIRTHDAY: 2018-11-19T08:19:42.024891
ATC: C03A
- CARDIOVASCULAR SYSTEM
- DIURETICS
- LOW-CEILING DIURETICS, THIAZIDES
Synthesis plan pending
FORMULA:C25H20F3N3O3

SMILES: Cc1cccc(-c2noc(-c3ccccc3CNC(=O)c3ccc(OC(F)(F)F)cc3)n2)c1C

BIRTHDAY: 2018-11-19T08:19:42.035399
ATC: C08C
- CARDIOVASCULAR SYSTEM
- CALCIUM CHANNEL BLOCKERS
- SELECTIVE CALCIUM CHANNEL BLOCKERS WITH MAINLY VASCULAR EFFECTS
Synthesis plan pending
FORMULA:C25H20F3N3O3

SMILES: COc1ccc(C(=O)NCc2cccc(-c3nc(-c4cc(C)cc(C(F)(F)F)c4)no3)c2)cc1

BIRTHDAY: 2018-11-19T08:19:42.045896
ATC: N03A
- NERVOUS SYSTEM
- ANTIEPILEPTICS
- ANTIEPILEPTICS
Synthesis plan pending
FORMULA:C25H20F3N3O3

SMILES: Cc1cccc(-c2noc(-c3ccccc3CNC(=O)c3ccccc3OC(F)(F)F)n2)c1C

BIRTHDAY: 2018-11-19T08:19:42.056572
ATC: L02B
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ENDOCRINE THERAPY
- HORMONE ANTAGONISTS AND RELATED AGENTS
Synthesis plan pending
FORMULA:C29H48N2O4

SMILES: CC(C)(C)C(C)(C)C(C)(C)C(C)(C)C(C)(C)C(C)(C)CC(=O)Nc1c(C(N)=O)cccc1C(=O)O

BIRTHDAY: 2018-11-19T08:19:42.067647
ATC: G01A
- GENITO URINARY SYSTEM AND SEX HORMONES
- GYNECOLOGICAL ANTIINFECTIVES AND ANTISEPTICS
- ANTIINFECTIVES AND ANTISEPTICS, EXCL. COMBINATIONS WITH CORTICOSTEROIDS
Synthesis plan pending
FORMULA:C37H59N3O5S

SMILES: CCCCCCCCCCCCCC[C@H]1CNCCC=CC=CCCN[C@@H]1C(=O)N[C@@H](C(=O)O)[C@H]1CSc2ccc(OC)cc2O1

BIRTHDAY: 2018-11-30T17:23:35.110758
ATC: C02C
- CARDIOVASCULAR SYSTEM
- ANTIHYPERTENSIVES
- ANTIADRENERGIC AGENTS, PERIPHERALLY ACTING
Synthesis Plan
FORMULA:C22H22N4O4

SMILES: COc1ccc(C(=O)N2CCCCN=C2c2noc(-c3ccc(OC)cc3)n2)cc1

BIRTHDAY: 2018-11-30T17:23:35.154371
ATC: C05C
- CARDIOVASCULAR SYSTEM
- VASOPROTECTIVES
- CAPILLARY STABILIZING AGENTS
Synthesis Plan
FORMULA:C25H34N2O3

SMILES: Cc1ccc(C)c(NC(=O)CCCCCNC(=O)c2ccc(OC(C)(C)C)cc2)c1

BIRTHDAY: 2018-11-30T17:23:35.195873
ATC: H05B
- SYSTEMIC HORMONAL PREPARATIONS, EXCL. SEX HORMONES AND INSULINS
- CALCIUM HOMEOSTASIS
- ANTI-PARATHYROID AGENTS
Synthesis Plan
FORMULA:C19H27ClN2O3

SMILES: CC1(C)CCCOC[C@@H]2N[C@H](CO1)CC(=O)[C@@]2(N)c1cccc(Cl)c1

BIRTHDAY: 2018-11-30T17:23:35.212881
ATC: N03A
- NERVOUS SYSTEM
- ANTIEPILEPTICS
- ANTIEPILEPTICS
Synthesis Plan
FORMULA:C37H50N4O5

SMILES: CCCCCCCCCC[C@@]1(C)O[C@H](C(=O)NC[C@@H]2CCCO2)C=CCOCc2cccc(c2)Nc2nccc(n2)-c2ccc1o2

BIRTHDAY: 2018-11-30T17:23:35.249955
ATC: B02B
- BLOOD AND BLOOD FORMING ORGANS
- ANTIHEMORRHAGICS
- VITAMIN K AND OTHER HEMOSTATICS
Synthesis Plan
FORMULA:C25H20F3N3O3

SMILES: COc1ccc(C(=O)NCCc2ccc(-c3noc(-c4ccc(C(F)(F)F)cc4)n3)cc2)cc1

BIRTHDAY: 2018-11-30T17:23:35.260163
ATC: A08A
- ALIMENTARY TRACT AND METABOLISM
- ANTIOBESITY PREPARATIONS, EXCL. DIET PRODUCTS
- ANTIOBESITY PREPARATIONS, EXCL. DIET PRODUCTS
Synthesis Plan
FORMULA:C21H25N3O4

SMILES: Cc1cc(C(=O)Nc2cccc(C(=O)O)c2)ccc1NC(=O)[C@@H](N)CC(C)C

BIRTHDAY: 2018-12-02T16:06:42.986345
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C22H42N2O2S

SMILES: CC(C)(O)COc1nsnc1C(C)(C)C(C)(C)C(C)(C)C(C)(C)C(C)(C)C

BIRTHDAY: 2018-12-02T16:06:42.994085
ATC: A03A
- ALIMENTARY TRACT AND METABOLISM
- DRUGS FOR FUNCTIONAL GASTROINTESTINAL DISORDERS
- DRUGS FOR FUNCTIONAL GASTROINTESTINAL DISORDERS
Synthesis Plan
FORMULA:C34H41N3O6

SMILES: CC(C)C[C@H](NC(=O)C(C)(C)Oc1ccc(-c2cc3cc(c2)CNC(=O)Cc2cccc(c2)OCCNC3)cc1)C(=O)O

BIRTHDAY: 2018-12-02T16:06:43.022886
ATC: C09C
- CARDIOVASCULAR SYSTEM
- AGENTS ACTING ON THE RENIN-ANGIOTENSIN SYSTEM
- ANGIOTENSIN II ANTAGONISTS, PLAIN
Synthesis Plan
FORMULA:C21H18F3N3O3S

SMILES: COc1ccc(C(=O)NCCc2ccc(C(=O)Nc3ncc(C(F)(F)F)s3)cc2)cc1

BIRTHDAY: 2018-12-02T16:06:43.049379
ATC: V10A
- VARIOUS
- THERAPEUTIC RADIOPHARMACEUTICALS
- ANTIINFLAMMATORY AGENTS
Synthesis Plan
FORMULA:C22H22F3N3O3

SMILES: COc1cccc(C(=O)NCC(C)(C)C)c1-c1nc(-c2ccccc2C(F)(F)F)no1

BIRTHDAY: 2018-12-02T16:06:43.067649
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C18H35N3O3

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

BIRTHDAY: 2018-12-02T16:06:43.100743
ATC: S01A
- SENSORY ORGANS
- OPHTHALMOLOGICALS
- ANTIINFECTIVES
Synthesis Plan
FORMULA:C24H24F3N3O3S

SMILES: COc1ccc(C(=O)NCCCCCC(=O)Nc2nc(-c3ccc(C(F)(F)F)cc3)cs2)cc1

BIRTHDAY: 2018-12-02T16:06:43.110840
ATC: H05B
- SYSTEMIC HORMONAL PREPARATIONS, EXCL. SEX HORMONES AND INSULINS
- CALCIUM HOMEOSTASIS
- ANTI-PARATHYROID AGENTS
Synthesis Plan
FORMULA:C15H20F3N5O

SMILES: CC(C)C[C@H](N)C(=O)Nc1c([C@@H]2N=CNN2)cccc1C(F)(F)F

BIRTHDAY: 2018-12-03T10:43:05.063727
ATC: N05C
- NERVOUS SYSTEM
- PSYCHOLEPTICS
- HYPNOTICS AND SEDATIVES
Synthesis Plan
FORMULA:C26H31F3N4O2

SMILES: CC(C)(C)N1[C@@H]2CC[C@]13c1nnc(=O)[nH]c1C=C(c1ccc(C(F)(F)F)cc1)[C@]3(C(C)(C)C)OC2

BIRTHDAY: 2018-12-03T10:43:05.076222
ATC: S01E
- SENSORY ORGANS
- OPHTHALMOLOGICALS
- ANTIGLAUCOMA PREPARATIONS AND MIOTICS
Synthesis Plan
FORMULA:C25H20F3N3O3

SMILES: COc1cccc(C(=O)N[C@@H](C)c2ccccc2-c2nc(-c3ccccc3C(F)(F)F)no2)c1

BIRTHDAY: 2018-12-03T10:43:05.094987
ATC: H02A
- SYSTEMIC HORMONAL PREPARATIONS, EXCL. SEX HORMONES AND INSULINS
- CORTICOSTEROIDS FOR SYSTEMIC USE
- CORTICOSTEROIDS FOR SYSTEMIC USE, PLAIN
Synthesis Plan
FORMULA:C43H56O

SMILES: C[C@@H](C(C)(C)C(C)(C)C(C)(C)C(C)(C)C)[C@@]12C=CC=C[C@@H]1c1ccc(cc1)CCc1cccc(c1)Oc1ccc(cc1)CC2

BIRTHDAY: 2018-12-03T10:43:05.137815
ATC: C02K
- CARDIOVASCULAR SYSTEM
- ANTIHYPERTENSIVES
- OTHER ANTIHYPERTENSIVES
Synthesis Plan
FORMULA:C19H17ClN2O2S

SMILES: COc1ccc(C(=O)NC2=C(c3ccc(Cl)cc3)SC=CNC2)cc1

BIRTHDAY: 2018-12-03T10:43:05.146608
ATC: N05C
- NERVOUS SYSTEM
- PSYCHOLEPTICS
- HYPNOTICS AND SEDATIVES
Synthesis Plan
FORMULA:C17H22O3S2

SMILES: CC(C)CCC[C@@H]1SC(=O)C=C[C@@H](c2ccc(O)c(O)c2)S1

BIRTHDAY: 2018-12-03T10:43:05.154930
ATC: S01E
- SENSORY ORGANS
- OPHTHALMOLOGICALS
- ANTIGLAUCOMA PREPARATIONS AND MIOTICS
Synthesis Plan
FORMULA:C26H44N2O2

SMILES: Cc1cc(C(N)=O)ccc1NC(=O)CCCCCCCCCCCCCCC(C)C

BIRTHDAY: 2018-12-03T10:43:05.183272
ATC: N06A
- NERVOUS SYSTEM
- PSYCHOANALEPTICS
- ANTIDEPRESSANTS
Synthesis Plan
FORMULA:C19H16F3N3O3

SMILES: COc1ccccc1-c1nc([C@H](C)C(=O)Nc2ccccc2C(F)(F)F)no1

BIRTHDAY: 2018-12-03T10:43:05.201779
ATC: M02A
- MUSCULO-SKELETAL SYSTEM
- TOPICAL PRODUCTS FOR JOINT AND MUSCULAR PAIN
- TOPICAL PRODUCTS FOR JOINT AND MUSCULAR PAIN
Synthesis Plan
FORMULA:C24H36N6O2

SMILES: CC(C)C[C@H](N)C(=O)Nc1cc(C(N)=O)ccc1-c1[nH]c2nc1CCNCCCCCC2

BIRTHDAY: 2018-12-03T10:43:05.212400
ATC: A10X
- ALIMENTARY TRACT AND METABOLISM
- DRUGS USED IN DIABETES
- OTHER DRUGS USED IN DIABETES
Synthesis Plan
FORMULA:C21H33N3O4

SMILES: CC(C)C[C@H](NC(=O)[C@@H](CC(=O)NO)CC(C)C)C(=O)NCc1ccccc1

BIRTHDAY: 2018-12-03T10:43:05.230718
ATC: L01C
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- PLANT ALKALOIDS AND OTHER NATURAL PRODUCTS
Synthesis Plan
FORMULA:C38H69N3O

SMILES: CC(C)(C)C(C)(C)C(C)(C)C(C)(C)C(C)(C)C(C)(C)C(=O)Nc1ccccc1[C@H]1CNCCCCCCCCCCN1

BIRTHDAY: 2018-12-03T19:11:29.897641
ATC: C04A
- CARDIOVASCULAR SYSTEM
- PERIPHERAL VASODILATORS
- PERIPHERAL VASODILATORS
Synthesis Plan
FORMULA:C36H37NO4

SMILES: COC(=O)[C@H](CC(C)C)NC(=O)c1cc2ccc1CCc1ccccc1-c1ccc(cc1)Oc1cccc(c1)CC2

BIRTHDAY: 2018-12-03T19:11:29.909884
ATC: D11A
- DERMATOLOGICALS
- OTHER DERMATOLOGICAL PREPARATIONS
- OTHER DERMATOLOGICAL PREPARATIONS
Synthesis Plan
FORMULA:C21H24F3N3O2

SMILES: Cc1ccc(C(=O)Nc2cccc(C(F)(F)F)c2)cc1NC(=O)[C@@H](N)CC(C)C

BIRTHDAY: 2018-12-03T19:11:29.939537
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:C19H16F3N3O3

SMILES: COc1cccc(-c2nc([C@H](C)C(=O)Nc3ccccc3C(F)(F)F)no2)c1

BIRTHDAY: 2018-12-03T19:11:29.957547
ATC: N03A
- NERVOUS SYSTEM
- ANTIEPILEPTICS
- ANTIEPILEPTICS
Synthesis Plan
FORMULA:C29H39N3O4

SMILES: CC(C)C[C@H](NC(=O)[C@@H](Cc1ccc(C(C)(C)C)cc1)CC(C)C)C(=O)c1nnc(-c2ccco2)o1

BIRTHDAY: 2018-12-03T19:11:29.977435
ATC: C03C
- CARDIOVASCULAR SYSTEM
- DIURETICS
- HIGH-CEILING DIURETICS
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)Nc1ccc(C(N)=O)cc1

BIRTHDAY: 2018-12-03T19:11:29.994143
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C25H42N2O4

SMILES: CCCCCCCCC[C@@H]1OCCOCCNCCOCCN(c2ccccc2)C1=O

BIRTHDAY: 2018-12-03T19:11:30.010940
ATC: N02B
- NERVOUS SYSTEM
- ANALGESICS
- OTHER ANALGESICS AND ANTIPYRETICS
Synthesis Plan
FORMULA:C21H24F3N3O2

SMILES: Cc1c(NC(=O)[C@H](N)CC(C)C)cccc1C(=O)Nc1ccccc1C(F)(F)F

BIRTHDAY: 2018-12-03T19:11:30.020164
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C21H24F3N3O2

SMILES: Cc1c(NC(=O)[C@@H](N)CC(C)C)cccc1C(=O)Nc1ccccc1C(F)(F)F

BIRTHDAY: 2018-12-01T22:30:35.523930
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C14H16F6N2O

SMILES: CC(C)C[C@@H](N)C(=O)Nc1c(C(F)(F)F)cccc1C(F)(F)F

BIRTHDAY: 2018-12-01T22:30:35.560486
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:C41H59N3O2S

SMILES: CCCCCCCCCCCCCCCCCCCCc1c2nc(C)nc1-c1cccc(c1)CNC(=O)CCOc1cccc(c1)S2

BIRTHDAY: 2018-12-01T22:30:35.572062
ATC: J01F
- ANTIINFECTIVES FOR SYSTEMIC USE
- ANTIBACTERIALS FOR SYSTEMIC USE
- MACROLIDES, LINCOSAMIDES AND STREPTOGRAMINS
Synthesis Plan
FORMULA:C20H43NOSi

SMILES: CC(C)(C)C(C)(C)C(C)(C)C(C)(C)C(C)(C)C(C)(C)C(=O)N[SiH3]

BIRTHDAY: 2018-12-01T22:30:35.589207
ATC: C04A
- CARDIOVASCULAR SYSTEM
- PERIPHERAL VASODILATORS
- PERIPHERAL VASODILATORS
Synthesis Plan
FORMULA:C22H35N3O4

SMILES: CC(C)C[C@H](CC(=O)NO)C(=O)N[C@H](CC(C)C)C(=O)N[C@H](C)c1ccccc1

BIRTHDAY: 2018-12-01T22:30:35.607117
ATC: L01C
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- PLANT ALKALOIDS AND OTHER NATURAL PRODUCTS
Synthesis Plan
FORMULA:C23H34N2O5S

SMILES: CC(C)C[C@@H](NC(=O)C(C)(C)C)C(=O)N[C@@H](CC(=O)O)C(=O)CSCc1ccccc1

BIRTHDAY: 2018-12-01T22:30:35.637035
ATC: J05A
- ANTIINFECTIVES FOR SYSTEMIC USE
- ANTIVIRALS FOR SYSTEMIC USE
- DIRECT ACTING ANTIVIRALS
Synthesis Plan
FORMULA:C24H18F3N3O3

SMILES: C[C@H](NC(=O)c1ccccc1OC(F)(F)F)c1ccccc1C(=O)Nc1ccccc1C#N

BIRTHDAY: 2018-12-01T22:30:35.657550
ATC: N01A
- NERVOUS SYSTEM
- ANESTHETICS
- ANESTHETICS, GENERAL
Synthesis Plan