matter.farm

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

These compounds may interact with:

Alkaline phosphatase, tissue-nonspecific isozyme

Potentially involved in: hypophosphatasia; disease of metabolism; carcinoma; rheumatoid arthritis; osteomalacia; rickets; saldino-noonan syndrome; craniosynostosis; chondrocalcinosis; calcinosis; hyperphosphatemia; ankylosis; hypercalcemia; alveolar bone loss; anemia; anorexia; apnea; constipation; dental caries; epilepsy

Disease data sourced from Pharos.

Antagonist

FORMULA:C27H47NO3

SMILES: COc1cccc(NC(=O)[C@@H](C)C(C)(C)C(C)(C)C(C)(C)C(C)(C)C(C)(C)C)c1OC

BIRTHDAY: 2018-12-01T14:10:28.392992
ATC: A02B
- ALIMENTARY TRACT AND METABOLISM
- DRUGS FOR ACID RELATED DISORDERS
- DRUGS FOR PEPTIC ULCER AND GASTRO-OESOPHAGEAL REFLUX DISEASE (GORD)
Synthesis Plan
FORMULA:C24H24N2O3

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

BIRTHDAY: 2018-12-01T14:10:28.401661
ATC: A07A
- ALIMENTARY TRACT AND METABOLISM
- ANTIDIARRHEALS, INTESTINAL ANTIINFLAMMATORY/ANTIINFECTIVE AGENTS
- INTESTINAL ANTIINFECTIVES
Synthesis Plan
FORMULA:C24H24N2O3

SMILES: COc1ccc(C(=O)Nc2ccccc2C(=O)Nc2ccc(C(C)C)cc2)cc1

BIRTHDAY: 2018-12-01T14:10:28.410654
ATC: D11A
- DERMATOLOGICALS
- OTHER DERMATOLOGICAL PREPARATIONS
- OTHER DERMATOLOGICAL PREPARATIONS
Synthesis Plan
FORMULA:C29H27N5O

SMILES: COc1ccc2c(c1)CNCc1cccc(c1)Nc1nccc(n1)-c1ccc3ccn(c3c1)CC2

BIRTHDAY: 2018-12-01T14:10:28.421116
ATC: N02B
- NERVOUS SYSTEM
- ANALGESICS
- OTHER ANALGESICS AND ANTIPYRETICS
Synthesis Plan
FORMULA:C25H28N4O5S

SMILES: Cc1ccc(NC(=O)c2nn(-c3cc(C)c(C(=O)N[C@@H](CC(C)C)C(=O)O)c(C)c3)c(=O)s2)cc1

BIRTHDAY: 2018-12-01T14:10:28.431973
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C22H17F3N2O3

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

BIRTHDAY: 2018-12-01T14:10:28.441687
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C21H30N2O4

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

BIRTHDAY: 2018-12-01T14:10:28.450280
ATC: C09D
- CARDIOVASCULAR SYSTEM
- AGENTS ACTING ON THE RENIN-ANGIOTENSIN SYSTEM
- ANGIOTENSIN II ANTAGONISTS, COMBINATIONS
Synthesis Plan
FORMULA:C29H33ClN2O7

SMILES: CC(C)C[C@H](NC(=O)c1ccccc1C(C)(C)C)[C@]12CC(=O)[C@]3(N=CO[C@@]4(O)C=CC(Cl)=C[C@@H]43)[C@@H](O1)C(=O)O2

BIRTHDAY: 2018-12-01T14:10:28.463007
ATC: N06D
- NERVOUS SYSTEM
- PSYCHOANALEPTICS
- ANTI-DEMENTIA DRUGS
Synthesis Plan
FORMULA:C20H24N2O2

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

BIRTHDAY: 2018-12-01T14:10:28.470324
ATC: M01A
- MUSCULO-SKELETAL SYSTEM
- ANTIINFLAMMATORY AND ANTIRHEUMATIC PRODUCTS
- ANTIINFLAMMATORY AND ANTIRHEUMATIC PRODUCTS, NON-STEROIDS
Synthesis Plan
FORMULA:C27H27N5O

SMILES: COc1ccccc1[C@@]12CC=CCNc3cnc4cc(C)cc(c4n3)-c3cc(c1[nH]3)CNC2

BIRTHDAY: 2018-12-01T14:10:28.480576
ATC: N05B
- NERVOUS SYSTEM
- PSYCHOLEPTICS
- ANXIOLYTICS
Synthesis Plan
FORMULA:C20H24N2O2

SMILES: Cc1cc(C)cc(NC(=O)c2ccccc2NC(=O)CC(C)C)c1

BIRTHDAY: 2018-12-01T14:10:28.488414
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C20H24N2O2

SMILES: Cc1cccc(C)c1NC(=O)c1ccccc1NC(=O)CC(C)C

BIRTHDAY: 2018-12-01T14:10:28.503397
ATC: M01A
- MUSCULO-SKELETAL SYSTEM
- ANTIINFLAMMATORY AND ANTIRHEUMATIC PRODUCTS
- ANTIINFLAMMATORY AND ANTIRHEUMATIC PRODUCTS, NON-STEROIDS
Synthesis Plan
FORMULA:C28H47NO2

SMILES: CCCCCCCCCCCCCCCCCC(=O)Nc1ccc(C(=O)C(C)C)cc1

BIRTHDAY: 2018-12-01T14:10:28.510794
ATC: D01A
- DERMATOLOGICALS
- ANTIFUNGALS FOR DERMATOLOGICAL USE
- ANTIFUNGALS FOR TOPICAL USE
Synthesis Plan
FORMULA:C17H16O6

SMILES: COc1cc(C(=O)CCC(=O)c2ccc(O)c(O)c2)ccc1O

BIRTHDAY: 2018-12-01T14:10:28.518675
ATC: R05C
- RESPIRATORY SYSTEM
- COUGH AND COLD PREPARATIONS
- EXPECTORANTS, EXCL. COMBINATIONS WITH COUGH SUPPRESSANTS
Synthesis Plan
FORMULA:C24H24N2O3

SMILES: COc1cccc(C(=O)Nc2ccccc2C(=O)Nc2ccccc2C(C)C)c1

BIRTHDAY: 2018-12-25T02:02:30.911624
ATC: C10A
- CARDIOVASCULAR SYSTEM
- LIPID MODIFYING AGENTS
- LIPID MODIFYING AGENTS, PLAIN
Synthesis Plan
FORMULA:C20H25NO3

SMILES: COc1cccc(OC)c1CNC(=O)c1ccccc1C(C)(C)C

BIRTHDAY: 2018-12-25T02:02:30.927131
ATC: P03B
- ANTIPARASITIC PRODUCTS, INSECTICIDES AND REPELLENTS
- ECTOPARASITICIDES, INCL. SCABICIDES, INSECTICIDES AND REPELLENTS
- INSECTICIDES AND REPELLENTS
Synthesis Plan
FORMULA:C27H30FNO2

SMILES: COc1ccc([C@H]2Cc3cccc(F)c3CCCCNCCc3ccc(cc3)O2)cc1

BIRTHDAY: 2018-12-25T02:02:30.936313
ATC: M01A
- MUSCULO-SKELETAL SYSTEM
- ANTIINFLAMMATORY AND ANTIRHEUMATIC PRODUCTS
- ANTIINFLAMMATORY AND ANTIRHEUMATIC PRODUCTS, NON-STEROIDS
Synthesis Plan
FORMULA:C29H44N4O3

SMILES: CC(C)C[C@@H](N[C@@]12C=CCCN3C[C@]4(C=CC=C[C@@H]4C[C@H]31)C2=O)C(=O)N[C@H](CC(C)C)C(=O)N(C)C

BIRTHDAY: 2018-12-25T02:02:30.955150
ATC: A11D
- ALIMENTARY TRACT AND METABOLISM
- VITAMINS
- VITAMIN B1, PLAIN AND IN COMBINATION WITH VITAMIN B6 AND B12
Synthesis Plan
FORMULA:C27H47NO3

SMILES: COc1cccc(NC(=O)[C@H](C)C(C)(C)C(C)(C)C(C)(C)C(C)(C)C(C)(C)C)c1OC

BIRTHDAY: 2018-12-25T02:02:30.963453
ATC: A02B
- ALIMENTARY TRACT AND METABOLISM
- DRUGS FOR ACID RELATED DISORDERS
- DRUGS FOR PEPTIC ULCER AND GASTRO-OESOPHAGEAL REFLUX DISEASE (GORD)
Synthesis Plan
FORMULA:C22H17F3N2O3

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

BIRTHDAY: 2018-12-25T02:02:30.973492
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:C24H30N2O4

SMILES: Cc1cccc(C(=O)Nc2ccc(C(=O)N[C@H](CC(C)C)C(=O)O)c(C)c2C)c1C

BIRTHDAY: 2018-12-25T02:02:30.990221
ATC: C09C
- CARDIOVASCULAR SYSTEM
- AGENTS ACTING ON THE RENIN-ANGIOTENSIN SYSTEM
- ANGIOTENSIN II ANTAGONISTS, PLAIN
Synthesis Plan
FORMULA:C29H34N2O3

SMILES: COc1cccc(C(=O)Nc2ccc(C(=O)Nc3ccccc3C(C)(C)C)cc2)c1C(C)(C)C

BIRTHDAY: 2018-12-25T02:02:31.000014
ATC: C02K
- CARDIOVASCULAR SYSTEM
- ANTIHYPERTENSIVES
- OTHER ANTIHYPERTENSIVES
Synthesis Plan
FORMULA:C20H24N2O2

SMILES: Cc1cc(C)cc(NC(=O)c2cccc(NC(=O)CC(C)C)c2)c1

BIRTHDAY: 2018-12-25T02:02:31.007941
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C30H46N2O

SMILES: Cc1cccc(-c2ccc(NC(=O)CCCCCCCCCCCCCCN(C)C)cc2)c1

BIRTHDAY: 2018-12-25T02:02:31.016238
ATC: N06A
- NERVOUS SYSTEM
- PSYCHOANALEPTICS
- ANTIDEPRESSANTS
Synthesis Plan
FORMULA:C25H43N5O3

SMILES: Cc1cc(C(=O)N[C@H](CC(C)C)C(=O)O)c2c(c1C)NCCNCCCNCCNC2(C)C

BIRTHDAY: 2018-12-25T02:02:31.027613
ATC: N06A
- NERVOUS SYSTEM
- PSYCHOANALEPTICS
- ANTIDEPRESSANTS
Synthesis Plan
FORMULA:C23H26O4

SMILES: CC1=CCCC[C@H]2CCC(c3ccc(O)cc3)=C(C(=O)CC(C)=C1)C(=O)O2

BIRTHDAY: 2018-12-25T02:02:31.036073
ATC: C02D
- CARDIOVASCULAR SYSTEM
- ANTIHYPERTENSIVES
- ARTERIOLAR SMOOTH MUSCLE, AGENTS ACTING ON
Synthesis Plan
FORMULA:C25H26N2O3

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

BIRTHDAY: 2018-12-25T02:02:31.045287
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C22H19NO7

SMILES: COc1ccc(CNC(=O)c2cc(C(=O)c3c(O)cccc3O)c(O)cc2O)cc1

BIRTHDAY: 2018-12-25T02:02:31.055986
ATC: A06A
- ALIMENTARY TRACT AND METABOLISM
- DRUGS FOR CONSTIPATION
- DRUGS FOR CONSTIPATION
Synthesis Plan
FORMULA:C26H26N2O3

SMILES: O=C(Nc1ccccc1OCc1ccccc1)[C@H]1CCCCN1C(=O)c1ccccc1

BIRTHDAY: 2018-12-25T02:02:31.065801
ATC: D10A
- DERMATOLOGICALS
- ANTI-ACNE PREPARATIONS
- ANTI-ACNE PREPARATIONS FOR TOPICAL USE
Synthesis Plan
FORMULA:C20H24N2O5

SMILES: COc1ccc(CNC(=O)CCC(=O)Nc2ccc(OC)c(OC)c2)cc1

BIRTHDAY: 2018-12-03T02:38:34.894670
ATC: N01A
- NERVOUS SYSTEM
- ANESTHETICS
- ANESTHETICS, GENERAL
Synthesis Plan
FORMULA:C25H26N2O3

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

BIRTHDAY: 2018-12-03T02:38:34.903847
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C24H24N2O3

SMILES: COc1ccc(C(=O)Nc2ccccc2C(=O)Nc2cccc(C(C)C)c2)cc1

BIRTHDAY: 2018-12-03T02:38:34.912851
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C28H31N3O4

SMILES: COc1ccccc1CNC(=O)[C@@H](C)C(=O)Nc1cccc(C(=O)Nc2cccc(C(C)C)c2)c1

BIRTHDAY: 2018-12-03T02:38:34.922782
ATC: S01E
- SENSORY ORGANS
- OPHTHALMOLOGICALS
- ANTIGLAUCOMA PREPARATIONS AND MIOTICS
Synthesis Plan
FORMULA:C15H26N6O3S

SMILES: N#C[C@]1(O)CSC(=O)C(=O)NCCN[C@]2(CCCCN2)CNCCN1

BIRTHDAY: 2018-12-03T02:38:34.932208
ATC: P03A
- ANTIPARASITIC PRODUCTS, INSECTICIDES AND REPELLENTS
- ECTOPARASITICIDES, INCL. SCABICIDES, INSECTICIDES AND REPELLENTS
- ECTOPARASITICIDES, INCL. SCABICIDES
Synthesis Plan
FORMULA:C29H34N2O3

SMILES: COc1cc(C(C)(C)C)ccc1C(=O)Nc1ccccc1C(=O)Nc1ccc(C(C)(C)C)cc1

BIRTHDAY: 2018-12-03T02:38:34.941992
ATC: C10B
- CARDIOVASCULAR SYSTEM
- LIPID MODIFYING AGENTS
- LIPID MODIFYING AGENTS, COMBINATIONS
Synthesis Plan
FORMULA:C28H33N3O5S

SMILES: CC(C)C[C@H]1CSC2=C(N1)[C@@H]1C[C@](C)(C(=O)Nc3ccccc3CNC(=O)c3c(O)cccc3O)[C@@H]2O1

BIRTHDAY: 2018-12-03T02:38:34.962959
ATC: C03D
- CARDIOVASCULAR SYSTEM
- DIURETICS
- POTASSIUM-SPARING AGENTS
Synthesis Plan
FORMULA:C24H21F3N2O2

SMILES: CC(C)c1ccccc1NC(=O)c1ccc(NC(=O)c2cccc(C(F)(F)F)c2)cc1

BIRTHDAY: 2018-12-03T02:38:34.972134
ATC: C10A
- CARDIOVASCULAR SYSTEM
- LIPID MODIFYING AGENTS
- LIPID MODIFYING AGENTS, PLAIN
Synthesis Plan
FORMULA:C26H45NO3

SMILES: CCCCCCCCCCCCCCCCCC(=O)Nc1ccc(OC)cc1OC

BIRTHDAY: 2018-12-03T02:38:34.979662
ATC: A08A
- ALIMENTARY TRACT AND METABOLISM
- ANTIOBESITY PREPARATIONS, EXCL. DIET PRODUCTS
- ANTIOBESITY PREPARATIONS, EXCL. DIET PRODUCTS
Synthesis Plan
FORMULA:C21H26N2O4

SMILES: COc1cccc(OC)c1CNC(=O)[C@@H](C)C(=O)Nc1cc(C)cc(C)c1

BIRTHDAY: 2018-12-03T02:38:34.988590
ATC: N01A
- NERVOUS SYSTEM
- ANESTHETICS
- ANESTHETICS, GENERAL
Synthesis Plan
FORMULA:C21H30N2O4

SMILES: CC(C)C[C@H](NC(=O)c1ccc(C(C)(C)C)cc1)C(=O)N[C@H]1COCC1=O

BIRTHDAY: 2018-12-03T02:38:34.997413
ATC: R06A
- RESPIRATORY SYSTEM
- ANTIHISTAMINES FOR SYSTEMIC USE
- ANTIHISTAMINES FOR SYSTEMIC USE
Synthesis Plan
FORMULA:C17H15Cl2N3O5

SMILES: COc1ccc(O)c(O)c1[C@]1(C)NC(=O)NC(=O)N1c1cc(Cl)cc(Cl)c1

BIRTHDAY: 2018-12-03T02:38:35.007574
ATC: N03A
- NERVOUS SYSTEM
- ANTIEPILEPTICS
- ANTIEPILEPTICS
Synthesis Plan
FORMULA:C25H31NO3

SMILES: COc1cccc(C(=O)Nc2ccc3c(c2)CCCCC=CCCCC3)c1OC

BIRTHDAY: 2018-12-03T02:38:35.015580
ATC: A11H
- ALIMENTARY TRACT AND METABOLISM
- VITAMINS
- OTHER PLAIN VITAMIN PREPARATIONS
Synthesis Plan
FORMULA:C23H19F3N2O2

SMILES: Cc1cccc(C)c1C(=O)Nc1ccccc1C(=O)Nc1cccc(C(F)(F)F)c1

BIRTHDAY: 2018-12-03T02:38:35.025313
ATC: M04A
- MUSCULO-SKELETAL SYSTEM
- ANTIGOUT PREPARATIONS
- ANTIGOUT PREPARATIONS
Synthesis Plan
FORMULA:C24H30N2O5

SMILES: Cc1cccc(C(=O)N[C@@H](CC(C)C)C(=O)C(=O)O)c1OC(C)(C)Nc1ccccc1

BIRTHDAY: 2018-12-03T02:38:35.034950
ATC: H02C
- SYSTEMIC HORMONAL PREPARATIONS, EXCL. SEX HORMONES AND INSULINS
- CORTICOSTEROIDS FOR SYSTEMIC USE
- ANTIADRENAL PREPARATIONS
Synthesis Plan
FORMULA:C30H49NO3

SMILES: CCCCCCCCCCCCCCCCCCC(=O)Nc1ccc(C(=O)C(=O)C(C)C)cc1

BIRTHDAY: 2018-12-03T02:38:35.042988
ATC: A07A
- ALIMENTARY TRACT AND METABOLISM
- ANTIDIARRHEALS, INTESTINAL ANTIINFLAMMATORY/ANTIINFECTIVE AGENTS
- INTESTINAL ANTIINFECTIVES
Synthesis Plan
FORMULA:C25H31N3O5

SMILES: Cc1cc(NC(=O)c2cccc(C)c2C)cc(C(=O)N[C@@H](CC(C)C)C(=O)NCC(=O)O)c1

BIRTHDAY: 2018-12-03T02:38:35.052754
ATC: A07B
- ALIMENTARY TRACT AND METABOLISM
- ANTIDIARRHEALS, INTESTINAL ANTIINFLAMMATORY/ANTIINFECTIVE AGENTS
- INTESTINAL ADSORBENTS
Synthesis Plan
FORMULA:C16H28N2O3

SMILES: CC(C)C[C@H]1COCCN2CCC(CC2)NC(=O)C=CO1

BIRTHDAY: 2018-12-03T02:38:35.060340
ATC: C03C
- CARDIOVASCULAR SYSTEM
- DIURETICS
- HIGH-CEILING DIURETICS
Synthesis Plan
FORMULA:C23H19F3N2O2

SMILES: Cc1ccc(C(=O)Nc2ccccc2C(=O)Nc2cccc(C(F)(F)F)c2)c(C)c1

BIRTHDAY: 2018-11-30T03:40:31.320450
ATC: B01A
- BLOOD AND BLOOD FORMING ORGANS
- ANTITHROMBOTIC AGENTS
- ANTITHROMBOTIC AGENTS
Synthesis Plan
FORMULA:C24H24N2O3

SMILES: COc1ccccc1C(=O)Nc1ccc(C(=O)Nc2ccc(C(C)C)cc2)cc1

BIRTHDAY: 2018-11-30T03:40:31.336069
ATC: L04A
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- IMMUNOSUPPRESSANTS
- IMMUNOSUPPRESSANTS
Synthesis Plan
FORMULA:C26H33N3O5

SMILES: Cc1cc(NC(=O)c2c(C)cccc2C)c(C(=O)N[C@@H](CC(C)C)C(=O)NCC(=O)O)cc1C

BIRTHDAY: 2018-11-30T03:40:31.346125
ATC: C01A
- CARDIOVASCULAR SYSTEM
- CARDIAC THERAPY
- CARDIAC GLYCOSIDES
Synthesis Plan
FORMULA:C21H26N2O4

SMILES: COc1ccc(CNC(=O)CCC(=O)Nc2c(C)cccc2C)cc1OC

BIRTHDAY: 2018-11-30T03:40:31.354385
ATC: N01B
- NERVOUS SYSTEM
- ANESTHETICS
- ANESTHETICS, LOCAL
Synthesis Plan
FORMULA:C21H30N2O5

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

BIRTHDAY: 2018-11-30T03:40:31.363253
ATC: N03A
- NERVOUS SYSTEM
- ANTIEPILEPTICS
- ANTIEPILEPTICS
Synthesis Plan
FORMULA:C22H27N7O4S

SMILES: CC(C)C[C@@H](NC(=O)c1ccc2c(N)nnc(C(=O)Nc3nccs3)c2c1)C(=O)N[C@@H](C)CO

BIRTHDAY: 2018-11-30T03:40:31.374805
ATC: C08C
- CARDIOVASCULAR SYSTEM
- CALCIUM CHANNEL BLOCKERS
- SELECTIVE CALCIUM CHANNEL BLOCKERS WITH MAINLY VASCULAR EFFECTS
Synthesis Plan
FORMULA:C21H30N2O5

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

BIRTHDAY: 2018-11-30T03:40:31.383970
ATC: C02K
- CARDIOVASCULAR SYSTEM
- ANTIHYPERTENSIVES
- OTHER ANTIHYPERTENSIVES
Synthesis Plan
FORMULA:C28H47NO2

SMILES: CC(C)C(=O)c1ccccc1NC(=O)CC(C)(C)C(C)(C)C(C)(C)C(C)(C)C(C)(C)C

BIRTHDAY: 2018-11-30T03:40:31.391507
ATC: C05B
- CARDIOVASCULAR SYSTEM
- VASOPROTECTIVES
- ANTIVARICOSE THERAPY
Synthesis Plan
FORMULA:C21H30N2O5

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

BIRTHDAY: 2018-11-30T03:40:31.400390
ATC: N03A
- NERVOUS SYSTEM
- ANTIEPILEPTICS
- ANTIEPILEPTICS
Synthesis Plan
FORMULA:C21H30F3N5O3S

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

BIRTHDAY: 2018-11-30T03:40:31.428159
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:C23H34N6O7

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

BIRTHDAY: 2018-11-30T03:40:31.440000
ATC: G03D
- GENITO URINARY SYSTEM AND SEX HORMONES
- SEX HORMONES AND MODULATORS OF THE GENITAL SYSTEM
- PROGESTOGENS
Synthesis Plan
FORMULA:C24H33N3O2

SMILES: Cc1cccc(CNC(=O)[C@@H](CC(C)C)NC(=O)c2ccc(N)c(C)c2C)c1C

BIRTHDAY: 2018-11-30T03:40:31.448911
ATC: M01A
- MUSCULO-SKELETAL SYSTEM
- ANTIINFLAMMATORY AND ANTIRHEUMATIC PRODUCTS
- ANTIINFLAMMATORY AND ANTIRHEUMATIC PRODUCTS, NON-STEROIDS
Synthesis Plan
FORMULA:C24H24N2O3

SMILES: COc1ccc(C(=O)Nc2cccc(C(=O)Nc3ccccc3C(C)C)c2)cc1

BIRTHDAY: 2018-11-30T03:40:31.457584
ATC: C10A
- CARDIOVASCULAR SYSTEM
- LIPID MODIFYING AGENTS
- LIPID MODIFYING AGENTS, PLAIN
Synthesis Plan
FORMULA:C26H33N3O5

SMILES: Cc1cccc(C(=O)Nc2ccc(C(=O)N[C@H](CC(C)C)C(=O)NCC(=O)O)c(C)c2C)c1C

BIRTHDAY: 2018-11-30T03:40:31.467452
ATC: C03X
- CARDIOVASCULAR SYSTEM
- DIURETICS
- OTHER DIURETICS
Synthesis Plan
FORMULA:C23H30N2O4

SMILES: Cc1cc(OCCCNc2ccccc2)ccc1C(=O)N[C@@H](CC(C)C)C(=O)O

BIRTHDAY: 2018-11-30T03:40:31.476021
ATC: M04A
- MUSCULO-SKELETAL SYSTEM
- ANTIGOUT PREPARATIONS
- ANTIGOUT PREPARATIONS
Synthesis Plan
FORMULA:C21H30N2O5

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

BIRTHDAY: 2018-11-30T03:40:31.485121
ATC: C02K
- CARDIOVASCULAR SYSTEM
- ANTIHYPERTENSIVES
- OTHER ANTIHYPERTENSIVES
Synthesis Plan
FORMULA:C21H30N2O5

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

BIRTHDAY: 2018-11-30T03:40:31.494142
ATC: C08C
- CARDIOVASCULAR SYSTEM
- CALCIUM CHANNEL BLOCKERS
- SELECTIVE CALCIUM CHANNEL BLOCKERS WITH MAINLY VASCULAR EFFECTS
Synthesis Plan
FORMULA:C28H49NO4

SMILES: COc1ccc(OC)c(OC)c1NC(=O)[C@@H](C)C(C)(C)C(C)(C)C(C)(C)C(C)(C)C(C)(C)C

BIRTHDAY: 2018-11-19T08:16:04.861820
ATC: J01D
- ANTIINFECTIVES FOR SYSTEMIC USE
- ANTIBACTERIALS FOR SYSTEMIC USE
- OTHER BETA-LACTAM ANTIBACTERIALS
Synthesis Plan
FORMULA:C28H54N2

SMILES: CCCCCCCCCCCCCCCCCC[C@H]1CN2C[C@H]3CN1C[C@@](C)(C3)C2

BIRTHDAY: 2018-11-19T08:16:04.869435
ATC: C01B
- CARDIOVASCULAR SYSTEM
- CARDIAC THERAPY
- ANTIARRHYTHMICS, CLASS I AND III
Synthesis Plan
FORMULA:C21H30N2O5

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

BIRTHDAY: 2018-11-19T08:16:04.878760
ATC: C02K
- CARDIOVASCULAR SYSTEM
- ANTIHYPERTENSIVES
- OTHER ANTIHYPERTENSIVES
Synthesis Plan
FORMULA:C27H47NO3

SMILES: CCCCCCCCCCCCCCCCCCC(=O)Nc1ccc(OC)cc1OC

BIRTHDAY: 2018-11-19T08:16:04.903998
ATC: A08A
- ALIMENTARY TRACT AND METABOLISM
- ANTIOBESITY PREPARATIONS, EXCL. DIET PRODUCTS
- ANTIOBESITY PREPARATIONS, EXCL. DIET PRODUCTS
Synthesis Plan
FORMULA:C10H16O4

SMILES: CC(C)[C@@]12CO[C@@H](OC(=O)C1(C)C)O2

BIRTHDAY: 2018-11-19T08:16:04.910842
ATC: D01A
- DERMATOLOGICALS
- ANTIFUNGALS FOR DERMATOLOGICAL USE
- ANTIFUNGALS FOR TOPICAL USE
Synthesis Plan
FORMULA:C21H30N2O4

SMILES: CC(C)C[C@@H](NC(=O)c1ccc(C(C)(C)C)cc1)C(=O)N[C@@H]1COCC1=O

BIRTHDAY: 2018-11-19T08:16:04.919848
ATC: R06A
- RESPIRATORY SYSTEM
- ANTIHISTAMINES FOR SYSTEMIC USE
- ANTIHISTAMINES FOR SYSTEMIC USE
Synthesis Plan
FORMULA:C22H20N2O4

SMILES: O=C(CNC(=O)c1cccc(O)c1)Nc1cccc(OCc2ccccc2)c1

BIRTHDAY: 2018-11-19T08:16:04.937919
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C35H39N5O2

SMILES: CC(C)C[C@@H](C)NC1=NN2C[C@H](C)N[C@@H]3C(=O)N(Cc4cccc(c4)Oc4cccc(c4)C2=CC=C1)c1ccccc13

BIRTHDAY: 2018-11-19T08:16:04.950174
ATC: N03A
- NERVOUS SYSTEM
- ANTIEPILEPTICS
- ANTIEPILEPTICS
Synthesis Plan
FORMULA:C26H35N3O4

SMILES: CC(C)CC(=O)NC1=CO[C@@]2(C)C=CC=C[C@@]12Oc1ccccc1C(=O)NC(C)(C)N(C)C

BIRTHDAY: 2018-11-19T08:16:04.977798
ATC: V08C
- VARIOUS
- CONTRAST MEDIA
- MAGNETIC RESONANCE IMAGING CONTRAST MEDIA
Synthesis Plan
FORMULA:C26H33N3O5

SMILES: Cc1cccc(C(=O)Nc2ccc(C(=O)N[C@@H](CC(C)C)C(=O)NCC(=O)O)c(C)c2C)c1C

BIRTHDAY: 2018-11-19T08:16:04.987851
ATC: C03X
- CARDIOVASCULAR SYSTEM
- DIURETICS
- OTHER DIURETICS
Synthesis Plan
FORMULA:C14H12F2NO4P

SMILES: O=C(Nc1cccc(-c2ccccc2)c1)C(F)(F)P(=O)(O)O

BIRTHDAY: 2018-11-19T08:16:04.996878
ATC: C07A
- CARDIOVASCULAR SYSTEM
- BETA BLOCKING AGENTS
- BETA BLOCKING AGENTS
Synthesis Plan
FORMULA:C21H14F3N3O4

SMILES: O=C(Nc1ccccc1C(F)(F)F)c1ccc(NC(=O)c2ccccc2[N+](=O)[O-])cc1

BIRTHDAY: 2018-11-19T08:16:05.007431
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C26H36N6O3

SMILES: Cc1cc(NC(=O)c2ccc(NC(=O)CC(C)C)cc2)cc2c1C(=O)NCCNCCNCCN2

BIRTHDAY: 2018-11-19T08:16:05.018509
ATC: C10A
- CARDIOVASCULAR SYSTEM
- LIPID MODIFYING AGENTS
- LIPID MODIFYING AGENTS, PLAIN
Synthesis Plan
FORMULA:C25H26N2O3

SMILES: COc1cccc(C(=O)Nc2cccc(C(=O)Nc3ccccc3C(C)(C)C)c2)c1

BIRTHDAY: 2018-11-19T08:16:05.037158
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C18H22N2O6S

SMILES: CCOC(=O)c1nsc(C)c1C(=O)NCc1c(OC)ccc(OC)c1OC

BIRTHDAY: 2018-11-19T08:16:05.047143
ATC: A16A
- ALIMENTARY TRACT AND METABOLISM
- OTHER ALIMENTARY TRACT AND METABOLISM PRODUCTS
- OTHER ALIMENTARY TRACT AND METABOLISM PRODUCTS
Synthesis Plan
FORMULA:C30H49NO3

SMILES: CC(C)C(=O)C(=O)c1ccccc1NC(=O)[C@H](C)C(C)(C)C(C)(C)C(C)(C)C(C)(C)C(C)(C)C

BIRTHDAY: 2018-11-19T08:16:05.056206
ATC: J01D
- ANTIINFECTIVES FOR SYSTEMIC USE
- ANTIBACTERIALS FOR SYSTEMIC USE
- OTHER BETA-LACTAM ANTIBACTERIALS
Synthesis Plan
FORMULA:C26H26N4O4

SMILES: COc1ccc(C(=O)Nc2ccc(C(=O)Nc3ccc(C45CNC(NC4)[C@@H]5O)cc3)cc2)cc1

BIRTHDAY: 2018-11-19T08:16:05.066590
ATC: D11A
- DERMATOLOGICALS
- OTHER DERMATOLOGICAL PREPARATIONS
- OTHER DERMATOLOGICAL PREPARATIONS
Synthesis Plan
FORMULA:C27H22N2O3

SMILES: O=C(Nc1ccccc1)c1ccccc1C(=O)Nc1ccccc1OCc1ccccc1

BIRTHDAY: 2018-11-19T08:16:05.076184
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C22H24F3N3O3

SMILES: CC(C)C[C@@H](NC(=O)c1ccc(C(F)(F)F)cc1)C(=O)NCC(=O)Nc1ccccc1

BIRTHDAY: 2018-11-19T08:16:05.086083
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:C23H19F3N2O2

SMILES: Cc1cc(C)cc(C(=O)Nc2ccc(C(=O)Nc3ccccc3C(F)(F)F)cc2)c1

BIRTHDAY: 2018-11-19T08:16:05.095539
ATC: N02B
- NERVOUS SYSTEM
- ANALGESICS
- OTHER ANALGESICS AND ANTIPYRETICS
Synthesis Plan
FORMULA:C27H38N6O3

SMILES: Cc1cccc(C(=O)N[C@H](CC(C)C)C(=O)N[C@H](C(=O)Nc2ccccc2)C(C)(C)NC(=N)N)c1C

BIRTHDAY: 2018-11-19T08:16:05.106525
ATC: N05A
- NERVOUS SYSTEM
- PSYCHOLEPTICS
- ANTIPSYCHOTICS
Synthesis Plan
FORMULA:C25H31N3O5

SMILES: Cc1cccc(C(=O)Nc2cccc(C(=O)N[C@H](CC(C)C)C(=O)NCC(=O)O)c2C)c1C

BIRTHDAY: 2018-11-19T08:16:05.123931
ATC: C09C
- CARDIOVASCULAR SYSTEM
- AGENTS ACTING ON THE RENIN-ANGIOTENSIN SYSTEM
- ANGIOTENSIN II ANTAGONISTS, PLAIN
Synthesis Plan
FORMULA:C13H13NO3

SMILES: Cc1cccc(C)c1C(=O)NC1=COC=CO1

BIRTHDAY: 2018-11-19T08:16:05.130809
ATC: N07C
- NERVOUS SYSTEM
- OTHER NERVOUS SYSTEM DRUGS
- ANTIVERTIGO PREPARATIONS
Synthesis Plan
FORMULA:C23H19F3N2O2

SMILES: Cc1cc(C)cc(C(=O)Nc2cccc(C(=O)Nc3ccccc3C(F)(F)F)c2)c1

BIRTHDAY: 2018-11-19T08:16:05.140372
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C21H30N2O5

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

BIRTHDAY: 2018-11-19T08:16:05.157585
ATC: N03A
- NERVOUS SYSTEM
- ANTIEPILEPTICS
- ANTIEPILEPTICS
Synthesis Plan
FORMULA:C9H10O3S2

SMILES: OC1(O)CSC=CS[C@@H]1c1ccco1

BIRTHDAY: 2018-11-19T08:16:05.164441
ATC: C02C
- CARDIOVASCULAR SYSTEM
- ANTIHYPERTENSIVES
- ANTIADRENERGIC AGENTS, PERIPHERALLY ACTING
Synthesis Plan
FORMULA:C23H34N6O7

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

BIRTHDAY: 2018-11-19T08:16:05.176335
ATC: M04A
- MUSCULO-SKELETAL SYSTEM
- ANTIGOUT PREPARATIONS
- ANTIGOUT PREPARATIONS
Synthesis Plan
FORMULA:C24H24N2O3

SMILES: COc1ccccc1C(=O)Nc1cccc(C(=O)Nc2ccccc2C(C)C)c1

BIRTHDAY: 2018-11-19T08:16:05.185178
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C18H24O2

SMILES: C[C@H](C(C)(C)C)[C@@]12C[C@@H]3OC(=O)[C@]4(C=CC=C[C@@H]41)[C@H]3C2

BIRTHDAY: 2018-11-19T08:16:05.192431
ATC: C02A
- CARDIOVASCULAR SYSTEM
- ANTIHYPERTENSIVES
- ANTIADRENERGIC AGENTS, CENTRALLY ACTING
Synthesis Plan
FORMULA:C20H24N2O2

SMILES: Cc1ccc(NC(=O)c2ccccc2NC(=O)CC(C)C)c(C)c1

BIRTHDAY: 2018-11-19T08:16:05.200200
ATC: M01A
- MUSCULO-SKELETAL SYSTEM
- ANTIINFLAMMATORY AND ANTIRHEUMATIC PRODUCTS
- ANTIINFLAMMATORY AND ANTIRHEUMATIC PRODUCTS, NON-STEROIDS
Synthesis Plan
FORMULA:C19H20N2O2

SMILES: COc1ccc(C(=O)Nc2cccc3c2[C@H]2CCN(C3)C2)cc1

BIRTHDAY: 2018-11-19T08:16:05.208021
ATC: A03A
- ALIMENTARY TRACT AND METABOLISM
- DRUGS FOR FUNCTIONAL GASTROINTESTINAL DISORDERS
- DRUGS FOR FUNCTIONAL GASTROINTESTINAL DISORDERS
Synthesis Plan
FORMULA:C31H51NO3

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

BIRTHDAY: 2018-11-19T08:16:05.233367
ATC: A07A
- ALIMENTARY TRACT AND METABOLISM
- ANTIDIARRHEALS, INTESTINAL ANTIINFLAMMATORY/ANTIINFECTIVE AGENTS
- INTESTINAL ANTIINFECTIVES
Synthesis Plan
FORMULA:C27H47NO3

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

BIRTHDAY: 2018-11-19T08:16:05.242155
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:C24H29N3O5

SMILES: Cc1ccc(NC(=O)c2ccccc2C)c(C(=O)N[C@H](CC(C)C)C(=O)NCC(=O)O)c1

BIRTHDAY: 2018-11-19T08:16:05.252301
ATC: C03X
- CARDIOVASCULAR SYSTEM
- DIURETICS
- OTHER DIURETICS
Synthesis Plan
FORMULA:C27H28N2O3

SMILES: COc1cccc(C(=O)Nc2ccccc2C(=O)Nc2ccccc2C2(C)CCCC2)c1

BIRTHDAY: 2018-11-19T08:16:05.278578
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C23H21N3O3

SMILES: C[C@@H](C(=O)Nc1ccccc1)C(=O)Nc1cccc(C(=O)Nc2ccccc2)c1

BIRTHDAY: 2018-11-19T08:16:05.287815
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C33H45N3O6

SMILES: Cc1ccc(C)c(C(=O)N[C@@H](CC(C)C)C(=O)O)c1Nc1cc2ccc1NCCCCCC(=O)CC(=O)COCCC2

BIRTHDAY: 2018-11-19T08:16:05.312185
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C22H17F3N2O3

SMILES: COc1ccc(C(=O)Nc2ccc(C(=O)Nc3ccccc3C(F)(F)F)cc2)cc1

BIRTHDAY: 2018-11-19T08:16:05.321926
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C29H47NO3

SMILES: CCCCCCCCCCCCCCCCCC(=O)Nc1ccc(C(=O)C(=O)C(C)C)cc1

BIRTHDAY: 2018-11-19T08:16:05.329956
ATC: A07A
- ALIMENTARY TRACT AND METABOLISM
- ANTIDIARRHEALS, INTESTINAL ANTIINFLAMMATORY/ANTIINFECTIVE AGENTS
- INTESTINAL ANTIINFECTIVES
Synthesis Plan
FORMULA:C24H25N3O4

SMILES: CC(C)C[C@H](NC(=O)c1ccc(/C(C#N)=C/C(=O)O)cc1)C(=O)NCc1ccccc1

BIRTHDAY: 2018-11-19T08:16:05.339306
ATC: A12B
- ALIMENTARY TRACT AND METABOLISM
- MINERAL SUPPLEMENTS
- POTASSIUM
Synthesis Plan
FORMULA:C24H24N2O3

SMILES: COc1cccc(C(=O)Nc2cccc(C(=O)Nc3ccccc3C(C)C)c2)c1

BIRTHDAY: 2018-11-19T08:16:05.348088
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C22H17F3N2O3

SMILES: COc1ccc(C(=O)Nc2ccccc2C(=O)Nc2ccc(C(F)(F)F)cc2)cc1

BIRTHDAY: 2018-11-19T08:16:05.366573
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:C29H33N3O4

SMILES: COc1ccccc1CNC(=O)[C@@H](C)C(=O)Nc1ccccc1C(=O)Nc1cccc(C(C)(C)C)c1

BIRTHDAY: 2018-11-19T08:16:05.386376
ATC: C03B
- CARDIOVASCULAR SYSTEM
- DIURETICS
- LOW-CEILING DIURETICS, EXCL. THIAZIDES
Synthesis Plan
FORMULA:C40H65N4O7P

SMILES: C[C@H](C(=O)Nc1ccccc1C(=O)[C@]1(C)N=C2[C@H](N)C[C@]3(CC(C)(C)OPOC3=O)OC(C)(C)N2O1)C(C)(C)C(C)(C)C(C)(C)C(C)(C)C(C)(C)C

BIRTHDAY: 2018-11-19T08:16:05.401007
ATC: P03A
- ANTIPARASITIC PRODUCTS, INSECTICIDES AND REPELLENTS
- ECTOPARASITICIDES, INCL. SCABICIDES, INSECTICIDES AND REPELLENTS
- ECTOPARASITICIDES, INCL. SCABICIDES
Synthesis Plan
FORMULA:C27H43NO4

SMILES: COC(=O)C(=O)c1ccccc1NC(=O)CC(C)(C)C(C)(C)C(C)(C)C(C)(C)C(C)(C)C

BIRTHDAY: 2018-11-19T08:16:05.409459
ATC: L01C
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- PLANT ALKALOIDS AND OTHER NATURAL PRODUCTS
Synthesis Plan
FORMULA:C24H33N3O2

SMILES: Cc1cccc(CNC(=O)[C@H](CC(C)C)NC(=O)c2ccc(N)c(C)c2C)c1C

BIRTHDAY: 2018-11-19T08:16:05.418464
ATC: M01A
- MUSCULO-SKELETAL SYSTEM
- ANTIINFLAMMATORY AND ANTIRHEUMATIC PRODUCTS
- ANTIINFLAMMATORY AND ANTIRHEUMATIC PRODUCTS, NON-STEROIDS
Synthesis Plan
FORMULA:C16H17NO3

SMILES: COc1ccc(O)cc1C(=O)Nc1cc(C)cc(C)c1

BIRTHDAY: 2018-11-30T17:22:52.889340
ATC: N01A
- NERVOUS SYSTEM
- ANESTHETICS
- ANESTHETICS, GENERAL
Synthesis Plan
FORMULA:C21H30N2O4

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

BIRTHDAY: 2018-11-30T17:22:52.908346
ATC: C09D
- CARDIOVASCULAR SYSTEM
- AGENTS ACTING ON THE RENIN-ANGIOTENSIN SYSTEM
- ANGIOTENSIN II ANTAGONISTS, COMBINATIONS
Synthesis Plan
FORMULA:C22H30N6O3

SMILES: Cc1cc(C(=O)N[C@H](CC(C)C)C(=O)O)ccc1N[C@]12CNCN(Cn3cncc31)C2

BIRTHDAY: 2018-11-30T17:22:52.927300
ATC: P02C
- ANTIPARASITIC PRODUCTS, INSECTICIDES AND REPELLENTS
- ANTHELMINTICS
- ANTINEMATODAL AGENTS
Synthesis Plan
FORMULA:C26H32F3N3O3

SMILES: Cc1cc(C(=O)N[C@@H](CC(C)C)C(=O)NCC(C)C)ccc1NC(=O)c1ccc(C(F)(F)F)cc1

BIRTHDAY: 2018-11-30T17:22:52.945520
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:C27H21N3O3

SMILES: O=C(Nc1ccccc1)c1ccc(C(=O)Nc2ccccc2C(=O)Nc2ccccc2)cc1

BIRTHDAY: 2018-11-30T17:22:52.955275
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C23H26F3N3O3

SMILES: Cc1ccccc1NC(=O)CNC(=O)[C@@H](CC(C)C)NC(=O)c1cccc(C(F)(F)F)c1

BIRTHDAY: 2018-11-30T17:22:52.965613
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:C33H44N2O2

SMILES: Cc1cccc(C(=O)Nc2ccc(C)c(C)c2C(=O)N[C@H](CC(C)C)C2(C)C3CC4CC(C3)CC2C4)c1

BIRTHDAY: 2018-11-30T17:22:52.975593
ATC: A10B
- ALIMENTARY TRACT AND METABOLISM
- DRUGS USED IN DIABETES
- BLOOD GLUCOSE LOWERING DRUGS, EXCL. INSULINS
Synthesis Plan
FORMULA:C23H17ClN4O

SMILES: COc1ccc2c(c1)nc(Nc1cccc(Cl)c1)c1nn(-c3ccccc3)cc12

BIRTHDAY: 2018-11-30T17:22:53.011427
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C20H25NO3

SMILES: COc1ccc(CNC(=O)c2ccccc2C(C)(C)C)cc1OC

BIRTHDAY: 2018-11-30T17:22:53.018778
ATC: C02K
- CARDIOVASCULAR SYSTEM
- ANTIHYPERTENSIVES
- OTHER ANTIHYPERTENSIVES
Synthesis Plan
FORMULA:C23H36FN3O4

SMILES: CC(C)C[C@H](NC(=O)[C@H](CC(C)C)NC(=O)C(C)(C)O)C(=O)NCc1ccc(F)cc1

BIRTHDAY: 2018-12-02T16:06:01.306731
ATC: A12B
- ALIMENTARY TRACT AND METABOLISM
- MINERAL SUPPLEMENTS
- POTASSIUM
Synthesis Plan
FORMULA:C21H30N2O5

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

BIRTHDAY: 2018-12-02T16:06:01.323626
ATC: C08C
- CARDIOVASCULAR SYSTEM
- CALCIUM CHANNEL BLOCKERS
- SELECTIVE CALCIUM CHANNEL BLOCKERS WITH MAINLY VASCULAR EFFECTS
Synthesis Plan
FORMULA:C17H17NO6

SMILES: CCOc1ccc(CNC(=O)C(=O)c2cc(O)c(O)c(O)c2)cc1

BIRTHDAY: 2018-12-02T16:06:01.331800
ATC: B01A
- BLOOD AND BLOOD FORMING ORGANS
- ANTITHROMBOTIC AGENTS
- ANTITHROMBOTIC AGENTS
Synthesis Plan
FORMULA:C21H30N2O5

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

BIRTHDAY: 2018-12-02T16:06:01.355593
ATC: C02K
- CARDIOVASCULAR SYSTEM
- ANTIHYPERTENSIVES
- OTHER ANTIHYPERTENSIVES
Synthesis Plan
FORMULA:C14H28OS

SMILES: C[C@H](C1CC[S+]([O-])CC1)C(C)(C)C(C)(C)C

BIRTHDAY: 2018-12-02T16:06:01.361508
ATC: R07A
- RESPIRATORY SYSTEM
- OTHER RESPIRATORY SYSTEM PRODUCTS
- OTHER RESPIRATORY SYSTEM PRODUCTS
Synthesis Plan
FORMULA:C25H30N4O3

SMILES: COc1ccc([C@H]2NCCN(c3ccc(OC)cc3)C(=O)c3[nH]nc(C(C)(C)C)c32)cc1

BIRTHDAY: 2018-12-02T16:06:01.397838
ATC: B01A
- BLOOD AND BLOOD FORMING ORGANS
- ANTITHROMBOTIC AGENTS
- ANTITHROMBOTIC AGENTS
Synthesis Plan
FORMULA:C21H32N4O4

SMILES: CC(C)C[C@H](NC(=O)c1ccc2c(c1)COCC(N)=N2)C(=O)N[C@H](CO)C(C)C

BIRTHDAY: 2018-12-02T16:06:01.407179
ATC: C02D
- CARDIOVASCULAR SYSTEM
- ANTIHYPERTENSIVES
- ARTERIOLAR SMOOTH MUSCLE, AGENTS ACTING ON
Synthesis Plan
FORMULA:C22H17FN6O3

SMILES: COc1ccc(C(=O)Nc2cccc(C(=O)Nc3ccc(C4(F)N=NN=N4)cc3)c2)cc1

BIRTHDAY: 2018-12-02T16:06:01.417712
ATC: D11A
- DERMATOLOGICALS
- OTHER DERMATOLOGICAL PREPARATIONS
- OTHER DERMATOLOGICAL PREPARATIONS
Synthesis Plan
FORMULA:C23H22N4O3

SMILES: COc1ccccc1C(=O)Nc1cccc2c1Nc1cccc(c1)NCC(=O)CN2

BIRTHDAY: 2018-12-03T10:42:23.047209
ATC: R06A
- RESPIRATORY SYSTEM
- ANTIHISTAMINES FOR SYSTEMIC USE
- ANTIHISTAMINES FOR SYSTEMIC USE
Synthesis Plan
FORMULA:C21H30N2O4

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

BIRTHDAY: 2018-12-03T10:42:23.055843
ATC: C09D
- CARDIOVASCULAR SYSTEM
- AGENTS ACTING ON THE RENIN-ANGIOTENSIN SYSTEM
- ANGIOTENSIN II ANTAGONISTS, COMBINATIONS
Synthesis Plan
FORMULA:C19H16F3N3O2

SMILES: N#Cc1ccc(CNC(=O)CCC(=O)Nc2ccc(C(F)(F)F)cc2)cc1

BIRTHDAY: 2018-12-03T10:42:23.073542
ATC: N06A
- NERVOUS SYSTEM
- PSYCHOANALEPTICS
- ANTIDEPRESSANTS
Synthesis Plan
FORMULA:C29H51NO4

SMILES: COc1ccc(OC)c(OC)c1NC(=O)C(C)(C)C(C)(C)C(C)(C)C(C)(C)C(C)(C)C(C)(C)C

BIRTHDAY: 2018-12-03T10:42:23.082118
ATC: C01B
- CARDIOVASCULAR SYSTEM
- CARDIAC THERAPY
- ANTIARRHYTHMICS, CLASS I AND III
Synthesis Plan
FORMULA:C25H31N3O5

SMILES: Cc1cccc(C(=O)Nc2cccc(C(=O)N[C@@H](CC(C)C)C(=O)NCC(=O)O)c2C)c1C

BIRTHDAY: 2018-12-03T10:42:23.091949
ATC: C09C
- CARDIOVASCULAR SYSTEM
- AGENTS ACTING ON THE RENIN-ANGIOTENSIN SYSTEM
- ANGIOTENSIN II ANTAGONISTS, PLAIN
Synthesis Plan
FORMULA:C21H30N2O4

SMILES: CC(C)C[C@@H](NC(=O)c1ccc(C(C)(C)C)cc1)C(=O)N[C@H]1COCC1=O

BIRTHDAY: 2018-12-03T10:42:23.100333
ATC: R06A
- RESPIRATORY SYSTEM
- ANTIHISTAMINES FOR SYSTEMIC USE
- ANTIHISTAMINES FOR SYSTEMIC USE
Synthesis Plan
FORMULA:C22H17F3N2O2

SMILES: O=C(NCc1ccccc1)c1cccc(NC(=O)c2cccc(C(F)(F)F)c2)c1

BIRTHDAY: 2018-12-03T10:42:23.116994
ATC: C10A
- CARDIOVASCULAR SYSTEM
- LIPID MODIFYING AGENTS
- LIPID MODIFYING AGENTS, PLAIN
Synthesis Plan
FORMULA:C24H24N2O3

SMILES: COc1ccccc1C(=O)Nc1cccc(C(=O)Nc2cccc(C(C)C)c2)c1

BIRTHDAY: 2018-12-03T10:42:23.134365
ATC: S01X
- SENSORY ORGANS
- OPHTHALMOLOGICALS
- OTHER OPHTHALMOLOGICALS
Synthesis Plan
FORMULA:C22H27N2O4P

SMILES: Cc1cc2c(c(C)c1NC(=O)c1ccc(NC(=O)CC(C)C)cc1)CCOPO2

BIRTHDAY: 2018-12-03T10:42:23.143239
ATC: L02B
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ENDOCRINE THERAPY
- HORMONE ANTAGONISTS AND RELATED AGENTS
Synthesis Plan
FORMULA:C29H39N7O7

SMILES: CC(C)C[C@H](NC(=O)c1ccccc1C(=O)O)C(=O)N[C@@H](C(=O)N[C@@H](CO)C(=O)Nc1ccccc1)C(C)(C)N=C(N)N

BIRTHDAY: 2018-12-03T10:42:23.156899
ATC: G03D
- GENITO URINARY SYSTEM AND SEX HORMONES
- SEX HORMONES AND MODULATORS OF THE GENITAL SYSTEM
- PROGESTOGENS
Synthesis Plan
FORMULA:C17H13NO6S

SMILES: CCOC(=O)c1ccc(C(=O)c2c(O)cc3s[nH]c(=O)c3c2O)cc1

BIRTHDAY: 2018-12-03T10:42:23.175540
ATC: D01A
- DERMATOLOGICALS
- ANTIFUNGALS FOR DERMATOLOGICAL USE
- ANTIFUNGALS FOR TOPICAL USE
Synthesis Plan
FORMULA:C22H17F3N2O3

SMILES: COc1ccccc1C(=O)Nc1cccc(C(=O)Nc2ccccc2C(F)(F)F)c1

BIRTHDAY: 2018-12-03T10:42:23.194772
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C27H47NO3

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

BIRTHDAY: 2018-12-03T10:42:23.202999
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:C26H33N3O5

SMILES: Cc1cc(C)c(NC(=O)c2c(C)cccc2C)c(C(=O)N[C@H](CC(C)C)C(=O)NCC(=O)O)c1

BIRTHDAY: 2018-12-03T19:10:48.717475
ATC: N03A
- NERVOUS SYSTEM
- ANTIEPILEPTICS
- ANTIEPILEPTICS
Synthesis Plan
FORMULA:C25H33N3O3

SMILES: Cc1cccc(NC(=O)CNC(=O)[C@H](CC(C)C)NC(=O)c2cc(C)c(C)c(C)c2)c1

BIRTHDAY: 2018-12-03T19:10:48.737439
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C17H19NO3

SMILES: COc1cccc(O)c1C(=O)Nc1ccc(C)c(C)c1C

BIRTHDAY: 2018-12-03T19:10:48.744687
ATC: J01D
- ANTIINFECTIVES FOR SYSTEMIC USE
- ANTIBACTERIALS FOR SYSTEMIC USE
- OTHER BETA-LACTAM ANTIBACTERIALS
Synthesis Plan
FORMULA:C16H30N2O3

SMILES: CCCCCCCCCC[C@H]1[N-][O+]=N[C@H]1C(=O)C(C)(C)O

BIRTHDAY: 2018-12-03T19:10:48.771137
ATC: D08A
- DERMATOLOGICALS
- ANTISEPTICS AND DISINFECTANTS
- ANTISEPTICS AND DISINFECTANTS
Synthesis Plan
FORMULA:C22H17F3N2O3

SMILES: COc1cccc(C(=O)Nc2ccccc2C(=O)Nc2ccccc2C(F)(F)F)c1

BIRTHDAY: 2018-12-03T19:10:48.781488
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C21H26N2O6

SMILES: COc1ccc(CNC(=O)CCC(=O)Nc2ccc(OC)c(OC)c2)cc1OC

BIRTHDAY: 2018-12-03T19:10:48.790633
ATC: N01A
- NERVOUS SYSTEM
- ANESTHETICS
- ANESTHETICS, GENERAL
Synthesis Plan
FORMULA:C23H22N2O2

SMILES: Cc1ccc(NC(=O)c2cccc(NC(=O)c3ccccc3C)c2)cc1C

BIRTHDAY: 2018-12-03T19:10:48.807444
ATC: C03X
- CARDIOVASCULAR SYSTEM
- DIURETICS
- OTHER DIURETICS
Synthesis Plan
FORMULA:C23H22N2O3

SMILES: C[C@@H](C(=O)Nc1ccccc1)C(=O)Nc1cccc(OCc2ccccc2)c1

BIRTHDAY: 2018-12-03T19:10:48.816143
ATC: M03B
- MUSCULO-SKELETAL SYSTEM
- MUSCLE RELAXANTS
- MUSCLE RELAXANTS, CENTRALLY ACTING AGENTS
Synthesis Plan
FORMULA:C24H24N2O3

SMILES: COc1ccccc1C(=O)Nc1ccc(C(=O)Nc2ccccc2C(C)C)cc1

BIRTHDAY: 2018-12-03T19:10:48.844725
ATC: P01A
- ANTIPARASITIC PRODUCTS, INSECTICIDES AND REPELLENTS
- ANTIPROTOZOALS
- AGENTS AGAINST AMOEBIASIS AND OTHER PROTOZOAL DISEASES
Synthesis Plan
FORMULA:C27H38N6O3

SMILES: Cc1ccc(C(=O)N[C@H](CC(C)C)C(=O)N[C@H](CCCNC(=N)N)C(=O)Nc2ccccc2)c(C)c1

BIRTHDAY: 2018-12-01T22:29:53.232129
ATC: N02C
- NERVOUS SYSTEM
- ANALGESICS
- ANTIMIGRAINE PREPARATIONS
Synthesis Plan
FORMULA:C26H45NO3

SMILES: COc1cccc(NC(=O)CC(C)(C)C(C)(C)C(C)(C)C(C)(C)C(C)(C)C)c1OC

BIRTHDAY: 2018-12-01T22:29:53.239992
ATC: A02B
- ALIMENTARY TRACT AND METABOLISM
- DRUGS FOR ACID RELATED DISORDERS
- DRUGS FOR PEPTIC ULCER AND GASTRO-OESOPHAGEAL REFLUX DISEASE (GORD)
Synthesis Plan
FORMULA:C26H20N2O3

SMILES: O=C(Nc1ccccc1)c1cccc(C(=O)Nc2ccccc2Oc2ccccc2)c1

BIRTHDAY: 2018-12-01T22:29:53.265246
ATC: J01F
- ANTIINFECTIVES FOR SYSTEMIC USE
- ANTIBACTERIALS FOR SYSTEMIC USE
- MACROLIDES, LINCOSAMIDES AND STREPTOGRAMINS
Synthesis Plan
FORMULA:C28H45NO4

SMILES: CCCCCCCCCCCCCCCCCCC(=O)Nc1ccc(C(=O)C(=O)OC)cc1

BIRTHDAY: 2018-12-01T22:29:53.273489
ATC: A10B
- ALIMENTARY TRACT AND METABOLISM
- DRUGS USED IN DIABETES
- BLOOD GLUCOSE LOWERING DRUGS, EXCL. INSULINS
Synthesis Plan
FORMULA:C24H30N2O5

SMILES: Cc1cc(OCCCNc2ccccc2)ccc1C(=O)N[C@@H](CC(C)C)C(=O)C(=O)O

BIRTHDAY: 2018-12-01T22:29:53.307726
ATC: B01A
- BLOOD AND BLOOD FORMING ORGANS
- ANTITHROMBOTIC AGENTS
- ANTITHROMBOTIC AGENTS
Synthesis Plan
FORMULA:C31H48N2O

SMILES: Cc1ccccc1-c1ccc(NC(=O)CCCCCCCCCCCCCCCN(C)C)cc1

BIRTHDAY: 2018-12-01T22:29:53.315727
ATC: N06A
- NERVOUS SYSTEM
- PSYCHOANALEPTICS
- ANTIDEPRESSANTS
Synthesis Plan