matter.farm

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

These compounds may interact with:

Integrin beta-3

Potentially involved in: osteopetrosis; glanzmann's thrombasthenia; breast cancer; kidney cancer; carcinoma; thrombocytopenia; coronary artery disease; autoimmune thrombocytopenic purpura; cancer; bernard-soulier syndrome; purpura; cerebrovascular disease; thrombophilia; thrombocytosis; anemia; autistic disorder; carotid artery thrombosis; coronary thrombosis; ecchymosis; epistaxis

Disease data sourced from Pharos.

Antagonist

FORMULA:C23H41N3O6

SMILES: C[C@]1([C@]2(O)[C@H]3CCN4[C@@H](C3)OCC[C@@H]42)CCCNCCCCCCOCN[C@]1(O)C(=O)O

BIRTHDAY: 2018-12-01T14:10:38.869028
ATC: C10A
- CARDIOVASCULAR SYSTEM
- LIPID MODIFYING AGENTS
- LIPID MODIFYING AGENTS, PLAIN
Synthesis Plan
FORMULA:C22H26FN3O3

SMILES: O=C(O)CC[C@H](NC(=O)CCCc1ccc2c(n1)NCCC2)c1cccc(F)c1

BIRTHDAY: 2018-12-01T14:10:38.877686
ATC: J05A
- ANTIINFECTIVES FOR SYSTEMIC USE
- ANTIVIRALS FOR SYSTEMIC USE
- DIRECT ACTING ANTIVIRALS
Synthesis Plan
FORMULA:C17H25NO5

SMILES: CC(C)[C@@H](NC1=CCC(=O)CC=CCOCC(=O)CC1)C(=O)O

BIRTHDAY: 2018-12-01T14:10:38.885515
ATC: J01C
- ANTIINFECTIVES FOR SYSTEMIC USE
- ANTIBACTERIALS FOR SYSTEMIC USE
- BETA-LACTAM ANTIBACTERIALS, PENICILLINS
Synthesis Plan
FORMULA:C16H23N3O4

SMILES: CCC(C)(C)[C@@H](CC(=O)O)NC(=O)c1ccccc1C(=N)NO

BIRTHDAY: 2018-12-01T14:10:38.893664
ATC: A10B
- ALIMENTARY TRACT AND METABOLISM
- DRUGS USED IN DIABETES
- BLOOD GLUCOSE LOWERING DRUGS, EXCL. INSULINS
Synthesis Plan
FORMULA:C14H26N2O3

SMILES: C[C@@H]([C@H]1CCCCN1)C(C)(C)NC(=O)[C@@H](C)C(=O)O

BIRTHDAY: 2018-12-01T14:10:38.900603
ATC: R03D
- RESPIRATORY SYSTEM
- DRUGS FOR OBSTRUCTIVE AIRWAY DISEASES
- OTHER SYSTEMIC DRUGS FOR OBSTRUCTIVE AIRWAY DISEASES
Synthesis Plan
FORMULA:C14H26N2O3

SMILES: C[C@H](C(=O)O)C(=O)NC(C)(C)[C@@H](C)[C@H]1CCCCN1

BIRTHDAY: 2018-12-01T14:10:38.907555
ATC: R03D
- RESPIRATORY SYSTEM
- DRUGS FOR OBSTRUCTIVE AIRWAY DISEASES
- OTHER SYSTEMIC DRUGS FOR OBSTRUCTIVE AIRWAY DISEASES
Synthesis Plan
FORMULA:C24H29N5O4

SMILES: N=C(N)c1ccc(C(=O)N[C@H](CC(=O)O)CC(=O)N2CCN(Cc3ccccc3)CC2)cc1

BIRTHDAY: 2018-12-01T14:10:38.917797
ATC: J05A
- ANTIINFECTIVES FOR SYSTEMIC USE
- ANTIVIRALS FOR SYSTEMIC USE
- DIRECT ACTING ANTIVIRALS
Synthesis Plan
FORMULA:C17H16FN3O3

SMILES: N=C(N)c1cccc(C(=O)N[C@@H](CC(=O)O)c2ccc(F)cc2)c1

BIRTHDAY: 2018-12-01T14:10:38.926133
ATC: A10B
- ALIMENTARY TRACT AND METABOLISM
- DRUGS USED IN DIABETES
- BLOOD GLUCOSE LOWERING DRUGS, EXCL. INSULINS
Synthesis Plan
FORMULA:C23H32N6O7

SMILES: CC(C)[C@@H](NC(=O)[C@@H](CC(=O)O)NC(=O)[C@H]1CCN=C(CCc2ccc(C(=N)N)nc2)CO1)C(=O)O

BIRTHDAY: 2018-12-01T14:10:38.937385
ATC: S01A
- SENSORY ORGANS
- OPHTHALMOLOGICALS
- ANTIINFECTIVES
Synthesis Plan
FORMULA:C19H26N4O6

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

BIRTHDAY: 2018-12-01T14:10:38.946881
ATC: J05A
- ANTIINFECTIVES FOR SYSTEMIC USE
- ANTIVIRALS FOR SYSTEMIC USE
- DIRECT ACTING ANTIVIRALS
Synthesis Plan
FORMULA:C24H28N4O3

SMILES: CC(C)(C(=O)N[C@H](CC(=O)O)c1ccnc2c1CCC=C2)c1ccnc2c1CNCC2

BIRTHDAY: 2018-12-01T14:10:38.956573
ATC: A03F
- ALIMENTARY TRACT AND METABOLISM
- DRUGS FOR FUNCTIONAL GASTROINTESTINAL DISORDERS
- PROPULSIVES
Synthesis Plan
FORMULA:C16H23N3O4

SMILES: CCCCC[C@H](CC(=O)O)NC(=O)c1ccc(C(=N)NO)cc1

BIRTHDAY: 2018-12-01T14:10:38.973020
ATC: B05X
- BLOOD AND BLOOD FORMING ORGANS
- BLOOD SUBSTITUTES AND PERFUSION SOLUTIONS
- I.V. SOLUTION ADDITIVES
Synthesis Plan
FORMULA:C16H23N3O4

SMILES: CCC(C)(C)[C@H](CC(=O)O)NC(=O)c1ccccc1C(=N)NO

BIRTHDAY: 2018-12-01T14:10:38.981188
ATC: A10B
- ALIMENTARY TRACT AND METABOLISM
- DRUGS USED IN DIABETES
- BLOOD GLUCOSE LOWERING DRUGS, EXCL. INSULINS
Synthesis Plan
FORMULA:C13H24N2O3

SMILES: C[C@H](C(=O)O)C(=O)NC(C)(C)[C@]1(C)CCCNC1

BIRTHDAY: 2018-12-01T14:10:38.987977
ATC: A09A
- ALIMENTARY TRACT AND METABOLISM
- DIGESTIVES, INCL. ENZYMES
- DIGESTIVES, INCL. ENZYMES
Synthesis Plan
FORMULA:C20H30N4O4

SMILES: C[C@H](CC(=O)NCCCCCCC(=O)NCc1ccc(C(=N)N)cc1)C(=O)O

BIRTHDAY: 2018-12-01T14:10:38.996472
ATC: J04A
- ANTIINFECTIVES FOR SYSTEMIC USE
- ANTIMYCOBACTERIALS
- DRUGS FOR TREATMENT OF TUBERCULOSIS
Synthesis Plan
FORMULA:C17H16FN3O3

SMILES: N=C(N)c1ccccc1C(=O)N[C@@H](CC(=O)O)c1ccccc1F

BIRTHDAY: 2018-12-01T14:10:39.005327
ATC: A10B
- ALIMENTARY TRACT AND METABOLISM
- DRUGS USED IN DIABETES
- BLOOD GLUCOSE LOWERING DRUGS, EXCL. INSULINS
Synthesis Plan
FORMULA:C22H26FN3O3

SMILES: C[C@H](C(=O)O)[C@H](NC(=O)C(C)(C)c1ccnc2c1NCCC2)c1ccccc1F

BIRTHDAY: 2018-12-01T14:10:39.014466
ATC: D01A
- DERMATOLOGICALS
- ANTIFUNGALS FOR DERMATOLOGICAL USE
- ANTIFUNGALS FOR TOPICAL USE
Synthesis Plan
FORMULA:C18H26N6O4

SMILES: C[C@@]1(N)CNCCN1C(=O)C[C@@H](CC(=O)O)NC(=O)c1ccccc1C(=N)N

BIRTHDAY: 2018-12-01T14:10:39.024421
ATC: A07A
- ALIMENTARY TRACT AND METABOLISM
- ANTIDIARRHEALS, INTESTINAL ANTIINFLAMMATORY/ANTIINFECTIVE AGENTS
- INTESTINAL ANTIINFECTIVES
Synthesis Plan
FORMULA:C17H16FN3O3

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

BIRTHDAY: 2018-12-01T14:10:39.032747
ATC: N05A
- NERVOUS SYSTEM
- PSYCHOLEPTICS
- ANTIPSYCHOTICS
Synthesis Plan
FORMULA:C24H26N4O3

SMILES: O=C(O)C[C@H](NC(=O)CCCc1ccc2c(n1)NCCC2)c1cnc2ccccc2c1

BIRTHDAY: 2018-12-25T02:02:41.448891
ATC: H04A
- SYSTEMIC HORMONAL PREPARATIONS, EXCL. SEX HORMONES AND INSULINS
- PANCREATIC HORMONES
- GLYCOGENOLYTIC HORMONES
Synthesis Plan
FORMULA:C20H28N4O6

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

BIRTHDAY: 2018-12-25T02:02:41.458885
ATC: L03A
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- IMMUNOSTIMULANTS
- IMMUNOSTIMULANTS
Synthesis Plan
FORMULA:C24H28N4O3

SMILES: CC(C)(C(=O)N[C@@H](CC(=O)O)c1ccnc2c1C=CCC2)c1ccnc2c1NCCC2

BIRTHDAY: 2018-12-25T02:02:41.478686
ATC: A03F
- ALIMENTARY TRACT AND METABOLISM
- DRUGS FOR FUNCTIONAL GASTROINTESTINAL DISORDERS
- PROPULSIVES
Synthesis Plan
FORMULA:C20H26N4O6

SMILES: C[C@]1(C(=O)O)CCCCN1C(=O)C[C@H](CC(=O)O)NC(=O)c1ccccc1C(=N)N

BIRTHDAY: 2018-12-25T02:02:41.489230
ATC: N06B
- NERVOUS SYSTEM
- PSYCHOANALEPTICS
- PSYCHOSTIMULANTS, AGENTS USED FOR ADHD AND NOOTROPICS
Synthesis Plan
FORMULA:C17H17N3O3

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

BIRTHDAY: 2018-12-25T02:02:41.497307
ATC: A10B
- ALIMENTARY TRACT AND METABOLISM
- DRUGS USED IN DIABETES
- BLOOD GLUCOSE LOWERING DRUGS, EXCL. INSULINS
Synthesis Plan
FORMULA:C20H26N4O6

SMILES: C[C@]1(C(=O)O)CCCCN1C(=O)C[C@@H](CC(=O)O)NC(=O)c1ccccc1C(=N)N

BIRTHDAY: 2018-12-25T02:02:41.507914
ATC: N06B
- NERVOUS SYSTEM
- PSYCHOANALEPTICS
- PSYCHOSTIMULANTS, AGENTS USED FOR ADHD AND NOOTROPICS
Synthesis Plan
FORMULA:C22H41N3O3

SMILES: O=C(CCC(=O)OCCCCC1CCNCC1)NCCCCC1CCNCC1

BIRTHDAY: 2018-12-25T02:02:41.515915
ATC: N06D
- NERVOUS SYSTEM
- PSYCHOANALEPTICS
- ANTI-DEMENTIA DRUGS
Synthesis Plan
FORMULA:C18H24N8O8

SMILES: C[C@@H](NC(=O)[C@]1(C(=O)O)COc2cncc(n2)NCN[C@@]2(N)NC=N[C@]2(C)OCC1=O)C(=O)O

BIRTHDAY: 2018-12-25T02:02:41.530118
ATC: A11D
- ALIMENTARY TRACT AND METABOLISM
- VITAMINS
- VITAMIN B1, PLAIN AND IN COMBINATION WITH VITAMIN B6 AND B12
Synthesis Plan
FORMULA:C19H26N4O6

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

BIRTHDAY: 2018-12-25T02:02:41.540262
ATC: J01D
- ANTIINFECTIVES FOR SYSTEMIC USE
- ANTIBACTERIALS FOR SYSTEMIC USE
- OTHER BETA-LACTAM ANTIBACTERIALS
Synthesis Plan
FORMULA:C27H38N4O7

SMILES: CC(C)[C@H](NC(=O)[C@@H](CC(=O)O)NC(=O)[C@@H](C)c1ccccc1C(=N)N)[C@@]12CCC[C@@H](CO[C@H]1C(=O)O)C2

BIRTHDAY: 2018-12-25T02:02:41.553415
ATC: M01A
- MUSCULO-SKELETAL SYSTEM
- ANTIINFLAMMATORY AND ANTIRHEUMATIC PRODUCTS
- ANTIINFLAMMATORY AND ANTIRHEUMATIC PRODUCTS, NON-STEROIDS
Synthesis Plan
FORMULA:C23H28N6O4

SMILES: N=C(N)c1cccc(C(=O)N[C@@H](CC(=O)O)CC(=O)N2CCNC[C@@]2(N)c2ccccc2)c1

BIRTHDAY: 2018-12-25T02:02:41.566096
ATC: A10B
- ALIMENTARY TRACT AND METABOLISM
- DRUGS USED IN DIABETES
- BLOOD GLUCOSE LOWERING DRUGS, EXCL. INSULINS
Synthesis Plan
FORMULA:C19H26N4O6

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

BIRTHDAY: 2018-12-25T02:02:41.575895
ATC: J05A
- ANTIINFECTIVES FOR SYSTEMIC USE
- ANTIVIRALS FOR SYSTEMIC USE
- DIRECT ACTING ANTIVIRALS
Synthesis Plan
FORMULA:C14H26N2O3

SMILES: O=C(O)CCC(=O)NCCCCCC1CCNCC1

BIRTHDAY: 2018-12-25T02:02:41.592476
ATC: J04A
- ANTIINFECTIVES FOR SYSTEMIC USE
- ANTIMYCOBACTERIALS
- DRUGS FOR TREATMENT OF TUBERCULOSIS
Synthesis Plan
FORMULA:C18H26N6O5

SMILES: C[C@@]1(N)CNCCN1C(=O)C[C@@H](CC(=O)O)NC(=O)c1ccccc1C(=N)NO

BIRTHDAY: 2018-12-25T02:02:41.603213
ATC: J01X
- ANTIINFECTIVES FOR SYSTEMIC USE
- ANTIBACTERIALS FOR SYSTEMIC USE
- OTHER ANTIBACTERIALS
Synthesis Plan
FORMULA:C24H28N4O3

SMILES: CC(C)(C(=O)N[C@@H](CC(=O)O)c1ccnc2c1C=CCC2)c1ccnc2c1CCNC2

BIRTHDAY: 2018-12-25T02:02:41.613179
ATC: M03A
- MUSCULO-SKELETAL SYSTEM
- MUSCLE RELAXANTS
- MUSCLE RELAXANTS, PERIPHERALLY ACTING AGENTS
Synthesis Plan
FORMULA:C23H24N6O4

SMILES: CC(C)CC(=O)Nc1nnc(CC(=O)O)c2ccc(C(=O)Nc3ccc(C(=N)N)cc3)cc12

BIRTHDAY: 2018-12-25T02:02:41.623868
ATC: M01A
- MUSCULO-SKELETAL SYSTEM
- ANTIINFLAMMATORY AND ANTIRHEUMATIC PRODUCTS
- ANTIINFLAMMATORY AND ANTIRHEUMATIC PRODUCTS, NON-STEROIDS
Synthesis Plan
FORMULA:C24H26N4O3

SMILES: O=C(O)C[C@@H](NC(=O)CCCc1ccc2c(n1)NCCC2)c1cnc2ccccc2c1

BIRTHDAY: 2018-12-03T02:38:45.254900
ATC: H04A
- SYSTEMIC HORMONAL PREPARATIONS, EXCL. SEX HORMONES AND INSULINS
- PANCREATIC HORMONES
- GLYCOGENOLYTIC HORMONES
Synthesis Plan
FORMULA:C17H17N3O3

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

BIRTHDAY: 2018-12-03T02:38:45.283503
ATC: A07B
- ALIMENTARY TRACT AND METABOLISM
- ANTIDIARRHEALS, INTESTINAL ANTIINFLAMMATORY/ANTIINFECTIVE AGENTS
- INTESTINAL ADSORBENTS
Synthesis Plan
FORMULA:C18H23FN4O3

SMILES: N=C(N)[C@H]1[C@H]2CC[C@@H](CN2)N1C(=O)C[C@H](CC(=O)O)c1ccc(F)cc1

BIRTHDAY: 2018-12-03T02:38:45.293237
ATC: J05A
- ANTIINFECTIVES FOR SYSTEMIC USE
- ANTIVIRALS FOR SYSTEMIC USE
- DIRECT ACTING ANTIVIRALS
Synthesis Plan
FORMULA:C18H26N6O5

SMILES: C[C@]1(N)CNCCN1C(=O)C[C@H](CC(=O)O)NC(=O)c1ccccc1C(=N)NO

BIRTHDAY: 2018-12-03T02:38:45.303954
ATC: J01X
- ANTIINFECTIVES FOR SYSTEMIC USE
- ANTIBACTERIALS FOR SYSTEMIC USE
- OTHER ANTIBACTERIALS
Synthesis Plan
FORMULA:C20H28N4O6

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

BIRTHDAY: 2018-12-03T02:38:45.314157
ATC: M01A
- MUSCULO-SKELETAL SYSTEM
- ANTIINFLAMMATORY AND ANTIRHEUMATIC PRODUCTS
- ANTIINFLAMMATORY AND ANTIRHEUMATIC PRODUCTS, NON-STEROIDS
Synthesis Plan
FORMULA:C18H25N5O5

SMILES: N=C(NO)c1cccc(C(=O)N[C@H](CC(=O)O)C[C@]2(O)[C@H]3CNC[C@@H]2NC3)c1

BIRTHDAY: 2018-12-03T02:38:45.324494
ATC: A10B
- ALIMENTARY TRACT AND METABOLISM
- DRUGS USED IN DIABETES
- BLOOD GLUCOSE LOWERING DRUGS, EXCL. INSULINS
Synthesis Plan
FORMULA:C21H30N4O2

SMILES: CC(C)(C)C1=C(CCCC(=O)NCCC(N)=O)[C@@H]1c1ccc(C(=N)N)cc1

BIRTHDAY: 2018-12-03T02:38:45.342739
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:C17H17N3O3

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

BIRTHDAY: 2018-12-03T02:38:45.351312
ATC: A10B
- ALIMENTARY TRACT AND METABOLISM
- DRUGS USED IN DIABETES
- BLOOD GLUCOSE LOWERING DRUGS, EXCL. INSULINS
Synthesis Plan
FORMULA:C19H26N4O6

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

BIRTHDAY: 2018-12-03T02:38:45.361684
ATC: J05A
- ANTIINFECTIVES FOR SYSTEMIC USE
- ANTIVIRALS FOR SYSTEMIC USE
- DIRECT ACTING ANTIVIRALS
Synthesis Plan
FORMULA:C23H25FN4O4S

SMILES: N=C(N)c1ccc(C(=O)N[C@H](CC(=O)O)CC(=O)N2SCCC[C@@H]2c2ccc(F)cc2)cc1

BIRTHDAY: 2018-12-03T02:38:45.394348
ATC: D06B
- DERMATOLOGICALS
- ANTIBIOTICS AND CHEMOTHERAPEUTICS FOR DERMATOLOGICAL USE
- CHEMOTHERAPEUTICS FOR TOPICAL USE
Synthesis Plan
FORMULA:C19H26N4O6

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

BIRTHDAY: 2018-12-03T02:38:45.414176
ATC: J01D
- ANTIINFECTIVES FOR SYSTEMIC USE
- ANTIBACTERIALS FOR SYSTEMIC USE
- OTHER BETA-LACTAM ANTIBACTERIALS
Synthesis Plan
FORMULA:C28H36N4O4

SMILES: C[C@H](C(=O)N1CCCC[C@@H]1C(=O)N[C@H](CC(=O)O)c1ccncc1-c1ccccc1)C1CCNCC1

BIRTHDAY: 2018-11-30T03:40:41.547302
ATC: N05C
- NERVOUS SYSTEM
- PSYCHOLEPTICS
- HYPNOTICS AND SEDATIVES
Synthesis Plan
FORMULA:C19H26N4O6

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

BIRTHDAY: 2018-11-30T03:40:41.557088
ATC: J05A
- ANTIINFECTIVES FOR SYSTEMIC USE
- ANTIVIRALS FOR SYSTEMIC USE
- DIRECT ACTING ANTIVIRALS
Synthesis Plan
FORMULA:C14H19N3O4

SMILES: CC(C)[C@H](CC(=O)O)NC(=O)c1ccccc1C(=N)NO

BIRTHDAY: 2018-11-30T03:40:41.574875
ATC: A12A
- ALIMENTARY TRACT AND METABOLISM
- MINERAL SUPPLEMENTS
- CALCIUM
Synthesis Plan
FORMULA:C17H16FN3O3

SMILES: N=C(N)c1ccccc1C(=O)N[C@H](CC(=O)O)c1ccccc1F

BIRTHDAY: 2018-11-30T03:40:41.593925
ATC: A10B
- ALIMENTARY TRACT AND METABOLISM
- DRUGS USED IN DIABETES
- BLOOD GLUCOSE LOWERING DRUGS, EXCL. INSULINS
Synthesis Plan
FORMULA:C22H26FN3O3

SMILES: O=C(O)CC[C@@H](NC(=O)CCCc1ccc2c(n1)NCCC2)c1cccc(F)c1

BIRTHDAY: 2018-11-30T03:40:41.602839
ATC: J05A
- ANTIINFECTIVES FOR SYSTEMIC USE
- ANTIVIRALS FOR SYSTEMIC USE
- DIRECT ACTING ANTIVIRALS
Synthesis Plan
FORMULA:C36H40N8O4

SMILES: CC(C)(C(=O)N[C@H](CC(=O)O)[C@@H]1CC=CCNCc2cccc(c2)Nc2nccc(n2)-c2ccnc(c2)O1)c1ccnc2c1NCCC2

BIRTHDAY: 2018-11-30T03:40:41.617523
ATC: M03A
- MUSCULO-SKELETAL SYSTEM
- MUSCLE RELAXANTS
- MUSCLE RELAXANTS, PERIPHERALLY ACTING AGENTS
Synthesis Plan
FORMULA:C25H24N4O4

SMILES: O=C(O)CC(=O)N1CC=CCOCc2cccc(c2)-c2ccnc(n2)Nc2cccc(c2)C1

BIRTHDAY: 2018-11-30T03:40:41.627737
ATC: J01F
- ANTIINFECTIVES FOR SYSTEMIC USE
- ANTIBACTERIALS FOR SYSTEMIC USE
- MACROLIDES, LINCOSAMIDES AND STREPTOGRAMINS
Synthesis Plan
FORMULA:C24H28N4O3

SMILES: CC(C)(C(=O)N[C@H](CC(=O)O)c1ccnc2c1C=CCC2)c1ccnc2c1NCCC2

BIRTHDAY: 2018-11-30T03:40:41.637671
ATC: A03F
- ALIMENTARY TRACT AND METABOLISM
- DRUGS FOR FUNCTIONAL GASTROINTESTINAL DISORDERS
- PROPULSIVES
Synthesis Plan
FORMULA:C23H43N3O3

SMILES: C[C@@H]([C@H]1CCCNC1)C(C)(C)NC(=O)[C@@H](C)C(=O)OC(C)(C)[C@]1(C)CCCNC1

BIRTHDAY: 2018-11-30T03:40:41.646156
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C13H22N2O4S

SMILES: CC(C)(C)[C@@H](N[C@]1(C(=O)O)[C@@H]2CN[C@@H]1CSC2)C(=O)O

BIRTHDAY: 2018-11-30T03:40:41.662578
ATC: S01F
- SENSORY ORGANS
- OPHTHALMOLOGICALS
- MYDRIATICS AND CYCLOPLEGICS
Synthesis Plan
FORMULA:C26H33N5O3S

SMILES: CC(C)(C(=O)N[C@@H](CC(=O)O)[C@H]1CSN(Cc2ccccc2)C=CN1)c1ccnc2c1NCCC2

BIRTHDAY: 2018-11-30T03:40:41.673274
ATC: D01A
- DERMATOLOGICALS
- ANTIFUNGALS FOR DERMATOLOGICAL USE
- ANTIFUNGALS FOR TOPICAL USE
Synthesis Plan
FORMULA:C16H29N5O6

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

BIRTHDAY: 2018-11-30T03:40:41.682968
ATC: M01A
- MUSCULO-SKELETAL SYSTEM
- ANTIINFLAMMATORY AND ANTIRHEUMATIC PRODUCTS
- ANTIINFLAMMATORY AND ANTIRHEUMATIC PRODUCTS, NON-STEROIDS
Synthesis Plan
FORMULA:C26H31N5O4S

SMILES: CC(C)(C(=O)N[C@@H](CC(=O)O)c1ccccc1)[C@@]1(Cc2ccnc3c2NCCC3)SNC=CNC1=O

BIRTHDAY: 2018-11-30T03:40:41.694419
ATC: J05A
- ANTIINFECTIVES FOR SYSTEMIC USE
- ANTIVIRALS FOR SYSTEMIC USE
- DIRECT ACTING ANTIVIRALS
Synthesis Plan
FORMULA:C13H23N5O4

SMILES: C[C@H](NC(=O)[C@@H](C[C@@H]1N=CNN1)NC(=O)C(C)(C)C)C(=O)O

BIRTHDAY: 2018-11-30T03:40:41.713318
ATC: J05A
- ANTIINFECTIVES FOR SYSTEMIC USE
- ANTIVIRALS FOR SYSTEMIC USE
- DIRECT ACTING ANTIVIRALS
Synthesis Plan
FORMULA:C13H24N2O3

SMILES: O=C(O)CCC(=O)NCCCCC1CCNCC1

BIRTHDAY: 2018-11-19T08:11:20.522368
ATC: N03A
- NERVOUS SYSTEM
- ANTIEPILEPTICS
- ANTIEPILEPTICS
Synthesis Plan
FORMULA:C13H19NO5

SMILES: CC(C)[C@]1(C(=O)NCC(=O)O)[C@@H]2CC[C@]1(C(=O)O)C2

BIRTHDAY: 2018-11-19T08:11:20.530356
ATC: N05B
- NERVOUS SYSTEM
- PSYCHOLEPTICS
- ANXIOLYTICS
Synthesis Plan
FORMULA:C23H34N4O6

SMILES: CC(C)[C@H](NC(=O)[C@@H](CC(=O)O)NC(=O)CCCCCc1ccc2c(n1)NCCC2)C(=O)O

BIRTHDAY: 2018-11-19T08:11:20.540782
ATC: C08C
- CARDIOVASCULAR SYSTEM
- CALCIUM CHANNEL BLOCKERS
- SELECTIVE CALCIUM CHANNEL BLOCKERS WITH MAINLY VASCULAR EFFECTS
Synthesis Plan
FORMULA:C25H29N5O4

SMILES: C[C@@H](C(=O)NCC(=O)N[C@H](CC(=O)O)c1nccc2c1C=CCC2)c1ccnc2c1NCCC2

BIRTHDAY: 2018-11-19T08:11:20.551882
ATC: A10B
- ALIMENTARY TRACT AND METABOLISM
- DRUGS USED IN DIABETES
- BLOOD GLUCOSE LOWERING DRUGS, EXCL. INSULINS
Synthesis Plan
FORMULA:C15H24N4O8

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

BIRTHDAY: 2018-11-19T08:11:20.562380
ATC: R01A
- RESPIRATORY SYSTEM
- NASAL PREPARATIONS
- DECONGESTANTS AND OTHER NASAL PREPARATIONS FOR TOPICAL USE
Synthesis Plan
FORMULA:C19H26N4O6

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

BIRTHDAY: 2018-11-19T08:11:20.572629
ATC: J01D
- ANTIINFECTIVES FOR SYSTEMIC USE
- ANTIBACTERIALS FOR SYSTEMIC USE
- OTHER BETA-LACTAM ANTIBACTERIALS
Synthesis Plan
FORMULA:C17H16FN3O3

SMILES: N=C(N)c1ccccc1C(=O)N[C@@H](CC(=O)O)c1ccc(F)cc1

BIRTHDAY: 2018-11-19T08:11:20.581494
ATC: N05A
- NERVOUS SYSTEM
- PSYCHOLEPTICS
- ANTIPSYCHOTICS
Synthesis Plan
FORMULA:C29H36N4O6

SMILES: NC(=O)CNC(=O)CCC1=N[C@H]2N(C1)[C@@H](CCc1cccc(O)c1)CCOC[C@]2(CC(=O)O)c1ccccc1

BIRTHDAY: 2018-11-19T08:11:20.605207
ATC: J05A
- ANTIINFECTIVES FOR SYSTEMIC USE
- ANTIVIRALS FOR SYSTEMIC USE
- DIRECT ACTING ANTIVIRALS
Synthesis Plan
FORMULA:C20H28N4O6

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

BIRTHDAY: 2018-11-19T08:11:20.615419
ATC: M01A
- MUSCULO-SKELETAL SYSTEM
- ANTIINFLAMMATORY AND ANTIRHEUMATIC PRODUCTS
- ANTIINFLAMMATORY AND ANTIRHEUMATIC PRODUCTS, NON-STEROIDS
Synthesis Plan
FORMULA:C17H17N3O3

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

BIRTHDAY: 2018-11-19T08:11:20.623789
ATC: A07B
- ALIMENTARY TRACT AND METABOLISM
- ANTIDIARRHEALS, INTESTINAL ANTIINFLAMMATORY/ANTIINFECTIVE AGENTS
- INTESTINAL ADSORBENTS
Synthesis Plan
FORMULA:C22H26FN3O3

SMILES: C[C@@H](C(=O)O)[C@H](NC(=O)C(C)(C)c1ccnc2c1NCCC2)c1ccccc1F

BIRTHDAY: 2018-11-19T08:11:20.633366
ATC: D01A
- DERMATOLOGICALS
- ANTIFUNGALS FOR DERMATOLOGICAL USE
- ANTIFUNGALS FOR TOPICAL USE
Synthesis Plan
FORMULA:C17H17N3O3

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

BIRTHDAY: 2018-11-19T08:11:20.641732
ATC: A10B
- ALIMENTARY TRACT AND METABOLISM
- DRUGS USED IN DIABETES
- BLOOD GLUCOSE LOWERING DRUGS, EXCL. INSULINS
Synthesis Plan
FORMULA:C25H29N5O4

SMILES: C[C@H](C(=O)NCC(=O)N[C@@H](CC(=O)O)c1nccc2c1C=CCC2)c1ccnc2c1NCCC2

BIRTHDAY: 2018-11-19T08:11:20.652744
ATC: A10B
- ALIMENTARY TRACT AND METABOLISM
- DRUGS USED IN DIABETES
- BLOOD GLUCOSE LOWERING DRUGS, EXCL. INSULINS
Synthesis Plan
FORMULA:C18H26N6O4

SMILES: C[C@]1(N)CNCCN1C(=O)C[C@@H](CC(=O)O)NC(=O)c1ccccc1C(=N)N

BIRTHDAY: 2018-11-19T08:11:20.663453
ATC: A07A
- ALIMENTARY TRACT AND METABOLISM
- ANTIDIARRHEALS, INTESTINAL ANTIINFLAMMATORY/ANTIINFECTIVE AGENTS
- INTESTINAL ANTIINFECTIVES
Synthesis Plan
FORMULA:C23H43N3O3

SMILES: C[C@H](NC(=O)CCC(=O)OC[C@@H](C)[C@]1(C)CCCNC1)[C@H](C)[C@]1(C)CCCNC1

BIRTHDAY: 2018-11-19T08:11:20.672620
ATC: G04C
- GENITO URINARY SYSTEM AND SEX HORMONES
- UROLOGICALS
- DRUGS USED IN BENIGN PROSTATIC HYPERTROPHY
Synthesis Plan
FORMULA:C21H25N5O4

SMILES: O=C(O)C[C@H](NC(=O)CNC(=O)CCc1ccc2c(n1)NCCC2)c1cccnc1

BIRTHDAY: 2018-11-19T08:11:20.682373
ATC: L03A
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- IMMUNOSTIMULANTS
- IMMUNOSTIMULANTS
Synthesis Plan
FORMULA:C22H29F3N4O5

SMILES: CC(C)[C@@H](NC(=O)[C@@H](C[C@]1(O)C[C@@H]2CC[C@H]1NC2)NC(=O)c1ccc(C(F)(F)F)cn1)C(=O)O

BIRTHDAY: 2018-11-19T08:11:20.694254
ATC: N05A
- NERVOUS SYSTEM
- PSYCHOLEPTICS
- ANTIPSYCHOTICS
Synthesis Plan
FORMULA:C16H27N3O5

SMILES: CC(C)(C)[C@H](N[C@]12C[C@H]3C[C@H](C[C@@H](O3)[C@@]1(N)CC(=O)O)N2)C(=O)O

BIRTHDAY: 2018-11-19T08:11:20.714063
ATC: N05A
- NERVOUS SYSTEM
- PSYCHOLEPTICS
- ANTIPSYCHOTICS
Synthesis Plan
FORMULA:C22H26FN3O3

SMILES: C[C@H](C(=O)O)[C@@H](NC(=O)C(C)(C)c1ccnc2c1NCCC2)c1ccccc1F

BIRTHDAY: 2018-11-19T08:11:20.723610
ATC: D01A
- DERMATOLOGICALS
- ANTIFUNGALS FOR DERMATOLOGICAL USE
- ANTIFUNGALS FOR TOPICAL USE
Synthesis Plan
FORMULA:C22H41N3O3

SMILES: C[C@@H](C(=O)NC(C)(C)[C@@]1(C)CCCNC1)C(=O)OC(C)(C)[C@@]1(C)CCCNC1

BIRTHDAY: 2018-11-19T08:11:20.732182
ATC: L01C
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- PLANT ALKALOIDS AND OTHER NATURAL PRODUCTS
Synthesis Plan
FORMULA:C23H28N6O4

SMILES: N=C(N)c1ccccc1C(=O)N[C@H](CC(=O)O)CC(=O)N1CCNC[C@@]1(N)c1ccccc1

BIRTHDAY: 2018-11-19T08:11:20.743776
ATC: C09A
- CARDIOVASCULAR SYSTEM
- AGENTS ACTING ON THE RENIN-ANGIOTENSIN SYSTEM
- ACE INHIBITORS, PLAIN
Synthesis Plan
FORMULA:C19H26N4O6

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

BIRTHDAY: 2018-11-19T08:11:20.764215
ATC: J01D
- ANTIINFECTIVES FOR SYSTEMIC USE
- ANTIBACTERIALS FOR SYSTEMIC USE
- OTHER BETA-LACTAM ANTIBACTERIALS
Synthesis Plan
FORMULA:C24H40N6O6

SMILES: CC(C)(C)CC(=O)N[C@H](Cc1ncc2nc1NCNCCOCCCCCCO2)C(=O)NCC(=O)O

BIRTHDAY: 2018-11-19T08:11:20.783791
ATC: L01D
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- CYTOTOXIC ANTIBIOTICS AND RELATED SUBSTANCES
Synthesis Plan
FORMULA:C19H26N4O6

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

BIRTHDAY: 2018-11-19T08:11:20.793996
ATC: J01D
- ANTIINFECTIVES FOR SYSTEMIC USE
- ANTIBACTERIALS FOR SYSTEMIC USE
- OTHER BETA-LACTAM ANTIBACTERIALS
Synthesis Plan
FORMULA:C16H26N2O5

SMILES: CC(C)[C@H](NC(=O)[C@H](CC1(C)C[C@H]2C[C@@H](C1)N2)C(=O)O)C(=O)O

BIRTHDAY: 2018-11-19T08:11:20.802547
ATC: A04A
- ALIMENTARY TRACT AND METABOLISM
- ANTIEMETICS AND ANTINAUSEANTS
- ANTIEMETICS AND ANTINAUSEANTS
Synthesis Plan
FORMULA:C35H55N9O3

SMILES: CC(C)[C@@H](NC(=O)[C@@H](CC(=O)O)N1CCCCNCCNCCCCN=CNC[C@]23C=CC=C[C@@]2(C(=N)N)[C@@H]1CN3)c1ccccc1

BIRTHDAY: 2018-11-19T08:11:20.823468
ATC: A10B
- ALIMENTARY TRACT AND METABOLISM
- DRUGS USED IN DIABETES
- BLOOD GLUCOSE LOWERING DRUGS, EXCL. INSULINS
Synthesis Plan
FORMULA:C24H28N4O3

SMILES: CC(C)(C(=O)N[C@H](CC(=O)O)c1ccnc2c1C=CCC2)c1cncc2c1CCCN2

BIRTHDAY: 2018-11-19T08:11:20.833456
ATC: M05B
- MUSCULO-SKELETAL SYSTEM
- DRUGS FOR TREATMENT OF BONE DISEASES
- DRUGS AFFECTING BONE STRUCTURE AND MINERALIZATION
Synthesis Plan
FORMULA:C22H26FN3O3

SMILES: O=C(O)CC[C@@H](NC(=O)CCCc1ccc2c(n1)NCCC2)c1ccc(F)cc1

BIRTHDAY: 2018-11-19T08:11:20.862939
ATC: J05A
- ANTIINFECTIVES FOR SYSTEMIC USE
- ANTIVIRALS FOR SYSTEMIC USE
- DIRECT ACTING ANTIVIRALS
Synthesis Plan
FORMULA:C20H38N8O4S

SMILES: CC(C)C[C@@H](NC(=O)[C@@]1(C(C)(C)C)N[C@@](N)(S[C@H]2NC=NC2(N)N)CNCCC1=O)C(=O)O

BIRTHDAY: 2018-11-19T08:11:20.876642
ATC: C02K
- CARDIOVASCULAR SYSTEM
- ANTIHYPERTENSIVES
- OTHER ANTIHYPERTENSIVES
Synthesis Plan
FORMULA:C20H28N4O6

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

BIRTHDAY: 2018-11-19T08:11:20.887507
ATC: M01A
- MUSCULO-SKELETAL SYSTEM
- ANTIINFLAMMATORY AND ANTIRHEUMATIC PRODUCTS
- ANTIINFLAMMATORY AND ANTIRHEUMATIC PRODUCTS, NON-STEROIDS
Synthesis Plan
FORMULA:C19H26N4O6

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

BIRTHDAY: 2018-11-19T08:11:20.897751
ATC: J01D
- ANTIINFECTIVES FOR SYSTEMIC USE
- ANTIBACTERIALS FOR SYSTEMIC USE
- OTHER BETA-LACTAM ANTIBACTERIALS
Synthesis Plan
FORMULA:C23H28N6O4

SMILES: N=C(N)c1ccccc1C(=O)N[C@H](CC(=O)O)CC(=O)N1CCNC[C@]1(N)c1ccccc1

BIRTHDAY: 2018-11-19T08:11:20.909363
ATC: C09A
- CARDIOVASCULAR SYSTEM
- AGENTS ACTING ON THE RENIN-ANGIOTENSIN SYSTEM
- ACE INHIBITORS, PLAIN
Synthesis Plan
FORMULA:C16H26N4O8

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

BIRTHDAY: 2018-11-19T08:11:20.919959
ATC: R01A
- RESPIRATORY SYSTEM
- NASAL PREPARATIONS
- DECONGESTANTS AND OTHER NASAL PREPARATIONS FOR TOPICAL USE
Synthesis Plan
FORMULA:C21H25N5O4

SMILES: O=C(O)C[C@@H](NC(=O)CNC(=O)CCc1cnc2c(c1)CCCN2)c1ccncc1

BIRTHDAY: 2018-11-19T08:11:20.929719
ATC: H04A
- SYSTEMIC HORMONAL PREPARATIONS, EXCL. SEX HORMONES AND INSULINS
- PANCREATIC HORMONES
- GLYCOGENOLYTIC HORMONES
Synthesis Plan
FORMULA:C19H26N4O6

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

BIRTHDAY: 2018-11-19T08:11:20.950359
ATC: J01D
- ANTIINFECTIVES FOR SYSTEMIC USE
- ANTIBACTERIALS FOR SYSTEMIC USE
- OTHER BETA-LACTAM ANTIBACTERIALS
Synthesis Plan
FORMULA:C20H28N4O6

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

BIRTHDAY: 2018-11-19T08:11:20.961255
ATC: M01A
- MUSCULO-SKELETAL SYSTEM
- ANTIINFLAMMATORY AND ANTIRHEUMATIC PRODUCTS
- ANTIINFLAMMATORY AND ANTIRHEUMATIC PRODUCTS, NON-STEROIDS
Synthesis Plan
FORMULA:C15H27N5O6

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

BIRTHDAY: 2018-11-19T08:11:20.981601
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:C19H27N5O4

SMILES: CCN1CCN(C(=O)C[C@@H](CC(=O)O)NC(=O)c2ccc(C(=N)N)cc2)CC1

BIRTHDAY: 2018-11-19T08:11:20.992188
ATC: J05A
- ANTIINFECTIVES FOR SYSTEMIC USE
- ANTIVIRALS FOR SYSTEMIC USE
- DIRECT ACTING ANTIVIRALS
Synthesis Plan
FORMULA:C17H25N3O4

SMILES: CC(C)C(C)(C)[C@H](CC(=O)O)NC(=O)c1ccccc1C(=N)NO

BIRTHDAY: 2018-11-19T08:11:21.001265
ATC: A02A
- ALIMENTARY TRACT AND METABOLISM
- DRUGS FOR ACID RELATED DISORDERS
- ANTACIDS
Synthesis Plan
FORMULA:C24H28N4O6

SMILES: O=C(O)CC[C@@H](NC(=O)CNC(=O)CCc1ccc2c(n1)NCCC2)c1ccc2c(c1)OCO2

BIRTHDAY: 2018-11-19T08:11:21.012131
ATC: H04A
- SYSTEMIC HORMONAL PREPARATIONS, EXCL. SEX HORMONES AND INSULINS
- PANCREATIC HORMONES
- GLYCOGENOLYTIC HORMONES
Synthesis Plan
FORMULA:C26H25N5O5

SMILES: N=C(N)c1ccc(C(=O)Nc2cccc(C(=O)NCC(=O)N[C@H](CC(=O)O)c3ccccc3)c2)cc1

BIRTHDAY: 2018-11-19T08:11:21.023265
ATC: A10B
- ALIMENTARY TRACT AND METABOLISM
- DRUGS USED IN DIABETES
- BLOOD GLUCOSE LOWERING DRUGS, EXCL. INSULINS
Synthesis Plan
FORMULA:C23H26N6O3

SMILES: Cc1nc(-c2cccc(O)c2)c2nc1NCNCCOc1cc(C(=N)N)ccc1CCO2

BIRTHDAY: 2018-11-19T08:11:21.033617
ATC: P02C
- ANTIPARASITIC PRODUCTS, INSECTICIDES AND REPELLENTS
- ANTHELMINTICS
- ANTINEMATODAL AGENTS
Synthesis Plan
FORMULA:C23H28N6O4

SMILES: N=C(N)c1ccccc1C(=O)N[C@@H](CC(=O)O)CC(=O)N1CCNC[C@@]1(N)c1ccccc1

BIRTHDAY: 2018-11-19T08:11:21.045266
ATC: C09A
- CARDIOVASCULAR SYSTEM
- AGENTS ACTING ON THE RENIN-ANGIOTENSIN SYSTEM
- ACE INHIBITORS, PLAIN
Synthesis Plan
FORMULA:C29H27N5O2

SMILES: N=C(N)c1ccc(-c2ccc3cc2-c2ccnc(n2)Nc2cccc(c2)COCC=CCCO3)cc1

BIRTHDAY: 2018-11-19T08:11:21.066477
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C24H28N4O3

SMILES: CC(C)(C(=O)N[C@H](CC(=O)O)c1nccc2c1C=CCC2)c1ccnc2c1NCCC2

BIRTHDAY: 2018-11-19T08:11:21.076501
ATC: A03F
- ALIMENTARY TRACT AND METABOLISM
- DRUGS FOR FUNCTIONAL GASTROINTESTINAL DISORDERS
- PROPULSIVES
Synthesis Plan
FORMULA:C22H29N3O4

SMILES: C/C=[N+]1\CC=CC[C@](C)(C(=O)N[C@@H](C(=O)NCc2ccccc2)[C@@H](C)C(=O)[O-])C1

BIRTHDAY: 2018-11-19T08:11:21.095571
ATC: A05B
- ALIMENTARY TRACT AND METABOLISM
- BILE AND LIVER THERAPY
- LIVER THERAPY, LIPOTROPICS
Synthesis Plan
FORMULA:C20H23FN2O4S

SMILES: C[C@H](C(=O)N[C@@H](CC(=O)O)c1cccc(F)c1)[C@]12C=CC=C[C@@H]1OCCNS2

BIRTHDAY: 2018-11-19T08:11:21.105234
ATC: A03A
- ALIMENTARY TRACT AND METABOLISM
- DRUGS FOR FUNCTIONAL GASTROINTESTINAL DISORDERS
- DRUGS FOR FUNCTIONAL GASTROINTESTINAL DISORDERS
Synthesis Plan
FORMULA:C16H22N4O4

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

BIRTHDAY: 2018-11-19T08:11:21.123140
ATC: J05A
- ANTIINFECTIVES FOR SYSTEMIC USE
- ANTIVIRALS FOR SYSTEMIC USE
- DIRECT ACTING ANTIVIRALS
Synthesis Plan
FORMULA:C19H27N5O5

SMILES: CCN1CCN(C(=O)C[C@@H](CC(=O)O)NC(=O)c2ccc(C(=N)NO)cc2)CC1

BIRTHDAY: 2018-11-19T08:11:21.144279
ATC: M01C
- MUSCULO-SKELETAL SYSTEM
- ANTIINFLAMMATORY AND ANTIRHEUMATIC PRODUCTS
- SPECIFIC ANTIRHEUMATIC AGENTS
Synthesis Plan
FORMULA:C25H31FN6O2

SMILES: CC1=NN(CCCCCCCC(=O)Nc2ccc(C(=N)N)cc2)CN1C(=O)c1ccc(F)cc1

BIRTHDAY: 2018-11-19T08:11:21.172699
ATC: C01D
- CARDIOVASCULAR SYSTEM
- CARDIAC THERAPY
- VASODILATORS USED IN CARDIAC DISEASES
Synthesis Plan
FORMULA:C33H32N6O5

SMILES: N=C(N)c1ccc(C(=O)N[C@H](C[C@H]2CC=CCOCc3cccc(c3)Nc3nccc(n3)-c3cccc(c3)O2)C(=O)O)cc1

BIRTHDAY: 2018-11-19T08:11:21.204173
ATC: C09A
- CARDIOVASCULAR SYSTEM
- AGENTS ACTING ON THE RENIN-ANGIOTENSIN SYSTEM
- ACE INHIBITORS, PLAIN
Synthesis Plan
FORMULA:C17H16FN3O3

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

BIRTHDAY: 2018-11-19T08:11:21.212745
ATC: N05A
- NERVOUS SYSTEM
- PSYCHOLEPTICS
- ANTIPSYCHOTICS
Synthesis Plan
FORMULA:C16H18N4O3S

SMILES: Cc1ccc([C@H](CC(=O)O)NC(=O)Cc2ccc(C(=N)N)s2)nc1

BIRTHDAY: 2018-11-19T08:11:21.231591
ATC: D06B
- DERMATOLOGICALS
- ANTIBIOTICS AND CHEMOTHERAPEUTICS FOR DERMATOLOGICAL USE
- CHEMOTHERAPEUTICS FOR TOPICAL USE
Synthesis Plan
FORMULA:C20H26N4O6

SMILES: C[C@@]1(C(=O)O)CCCCN1C(=O)C[C@@H](CC(=O)O)NC(=O)c1ccccc1C(=N)N

BIRTHDAY: 2018-11-19T08:11:21.242145
ATC: N06B
- NERVOUS SYSTEM
- PSYCHOANALEPTICS
- PSYCHOSTIMULANTS, AGENTS USED FOR ADHD AND NOOTROPICS
Synthesis Plan
FORMULA:C13H24N2O3

SMILES: C[C@@H](C(=O)O)C(=O)NC(C)(C)[C@@]1(C)CCCNC1

BIRTHDAY: 2018-11-30T17:23:03.309731
ATC: A09A
- ALIMENTARY TRACT AND METABOLISM
- DIGESTIVES, INCL. ENZYMES
- DIGESTIVES, INCL. ENZYMES
Synthesis Plan
FORMULA:C11H18N4O5S

SMILES: CC(C)[C@@H](NC(=O)[C@@H](CC(=O)O)N[C@H]1NC=NS1)C(=O)O

BIRTHDAY: 2018-11-30T17:23:03.325860
ATC: A03F
- ALIMENTARY TRACT AND METABOLISM
- DRUGS FOR FUNCTIONAL GASTROINTESTINAL DISORDERS
- PROPULSIVES
Synthesis Plan
FORMULA:C21H25N5O4

SMILES: O=C(O)C[C@@H](NC(=O)CNC(=O)CCc1ccc2c(n1)NCCC2)c1cccnc1

BIRTHDAY: 2018-11-30T17:23:03.345408
ATC: L03A
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- IMMUNOSTIMULANTS
- IMMUNOSTIMULANTS
Synthesis Plan
FORMULA:C35H39N3O4

SMILES: CC(C)(NC(=O)c1cccc([C@@H](Cc2ccccc2)C(=O)O)c1)[C@@]1(C(=O)Nc2cccc3c2C=CCC3)CCCNC1

BIRTHDAY: 2018-11-30T17:23:03.358710
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C20H26N4O6

SMILES: N=C(N)c1cccc(C(=O)N[C@@H](CC(=O)O)CC(=O)N2CCCC[C@H]2CC(=O)O)c1

BIRTHDAY: 2018-11-30T17:23:03.428535
ATC: J05A
- ANTIINFECTIVES FOR SYSTEMIC USE
- ANTIVIRALS FOR SYSTEMIC USE
- DIRECT ACTING ANTIVIRALS
Synthesis Plan
FORMULA:C19H24N8O

SMILES: C=C(C#N)NC(=N)N1CCc2ccc(CC[C@H](N)N3CN=CC(O)=N3)cc2C1

BIRTHDAY: 2018-11-30T17:23:03.448072
ATC: C01B
- CARDIOVASCULAR SYSTEM
- CARDIAC THERAPY
- ANTIARRHYTHMICS, CLASS I AND III
Synthesis Plan
FORMULA:C23H34N4O6

SMILES: CC(C)[C@@H](NC(=O)[C@@H](CC(=O)O)NC(=O)CCCCCc1ccc2c(n1)NCCC2)C(=O)O

BIRTHDAY: 2018-11-30T17:23:03.467865
ATC: C08C
- CARDIOVASCULAR SYSTEM
- CALCIUM CHANNEL BLOCKERS
- SELECTIVE CALCIUM CHANNEL BLOCKERS WITH MAINLY VASCULAR EFFECTS
Synthesis Plan
FORMULA:C32H51N9O5S2

SMILES: O=C(O)C[C@@H](NC(=O)CCCc1ccc2c(n1)NCCC2)[C@@]12C[C@@H]3C=CCCSSC[C@@H](CNCCNCCO3)NCCN1NC(=O)N2

BIRTHDAY: 2018-11-30T17:23:03.503670
ATC: C08C
- CARDIOVASCULAR SYSTEM
- CALCIUM CHANNEL BLOCKERS
- SELECTIVE CALCIUM CHANNEL BLOCKERS WITH MAINLY VASCULAR EFFECTS
Synthesis Plan
FORMULA:C26H40N6O4

SMILES: CN1[C@H]2CN(CC(=O)NCCCCCCCC(=O)NCc3ccc(C(=N)N)cc3)C(=O)[C@H]1CC[C@H]2O

BIRTHDAY: 2018-12-02T16:06:12.382256
ATC: J01X
- ANTIINFECTIVES FOR SYSTEMIC USE
- ANTIBACTERIALS FOR SYSTEMIC USE
- OTHER ANTIBACTERIALS
Synthesis Plan
FORMULA:C19H27N5O5

SMILES: CCN1CCN(C(=O)C[C@H](CC(=O)O)NC(=O)c2ccc(C(=N)NO)cc2)CC1

BIRTHDAY: 2018-12-02T16:06:12.392716
ATC: M01C
- MUSCULO-SKELETAL SYSTEM
- ANTIINFLAMMATORY AND ANTIRHEUMATIC PRODUCTS
- SPECIFIC ANTIRHEUMATIC AGENTS
Synthesis Plan
FORMULA:C15H28N6O6

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

BIRTHDAY: 2018-12-02T16:06:12.402780
ATC: G03D
- GENITO URINARY SYSTEM AND SEX HORMONES
- SEX HORMONES AND MODULATORS OF THE GENITAL SYSTEM
- PROGESTOGENS
Synthesis Plan
FORMULA:C19H19N5O4

SMILES: Cc1cccc(-c2nc3cccc(C(=N)N)c3[nH]2)c1OCC(=O)NCC(=O)O

BIRTHDAY: 2018-12-02T16:06:12.422432
ATC: S01A
- SENSORY ORGANS
- OPHTHALMOLOGICALS
- ANTIINFECTIVES
Synthesis Plan
FORMULA:C28H36N4O4

SMILES: C[C@H](C(=O)N1CCCC[C@@H]1C(=O)N[C@H](CC(=O)O)c1ccncc1-c1ccccc1)[C@H]1CCCCN1

BIRTHDAY: 2018-12-02T16:06:12.464810
ATC: N05C
- NERVOUS SYSTEM
- PSYCHOLEPTICS
- HYPNOTICS AND SEDATIVES
Synthesis Plan
FORMULA:C38H45N7O8

SMILES: NC(=O)[C@H](CC(=O)O)NC(=O)[C@H]1CCCCN1C(=O)Cc1cc2cc3c(cccc13)[C@@]1(CCCCN1)NC(=O)C(=O)NCCNCc1cccc(c1)O2

BIRTHDAY: 2018-12-02T16:06:12.512728
ATC: D07A
- DERMATOLOGICALS
- CORTICOSTEROIDS, DERMATOLOGICAL PREPARATIONS
- CORTICOSTEROIDS, PLAIN
Synthesis Plan
FORMULA:C21H39N3O7

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

BIRTHDAY: 2018-12-02T16:06:12.540143
ATC: J01F
- ANTIINFECTIVES FOR SYSTEMIC USE
- ANTIBACTERIALS FOR SYSTEMIC USE
- MACROLIDES, LINCOSAMIDES AND STREPTOGRAMINS
Synthesis Plan
FORMULA:C27H25N7O2

SMILES: N=C(N)c1ccc2c(c1)C=CCOC=CNCNc1nc(cnc1-c1ccc3ccc(N)cc3c1)O2

BIRTHDAY: 2018-12-03T10:42:33.501086
ATC: L02B
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ENDOCRINE THERAPY
- HORMONE ANTAGONISTS AND RELATED AGENTS
Synthesis Plan
FORMULA:C28H34N4O5

SMILES: N=C(N)c1ccccc1C(=O)N[C@@H](CC(=O)O)CC(=O)N1CCCC[C@]12COCCC=C1C=CC=C[C@H]12

BIRTHDAY: 2018-12-03T10:42:33.513928
ATC: C09D
- CARDIOVASCULAR SYSTEM
- AGENTS ACTING ON THE RENIN-ANGIOTENSIN SYSTEM
- ANGIOTENSIN II ANTAGONISTS, COMBINATIONS
Synthesis Plan
FORMULA:C24H28N4O3

SMILES: C[C@@H](Cc1ccnc2c1CCNC2)C(=O)N[C@@H](CC(=O)O)c1cnc2c(c1)C=CCC2

BIRTHDAY: 2018-12-03T10:42:33.523587
ATC: A11H
- ALIMENTARY TRACT AND METABOLISM
- VITAMINS
- OTHER PLAIN VITAMIN PREPARATIONS
Synthesis Plan
FORMULA:C24H29N5O6

SMILES: CC(C)[C@H](NC(=O)[C@@H](CC(=O)O)NC(=O)[C@@H](C)c1ccncc1-c1ccccc1C(=N)N)C(=O)O

BIRTHDAY: 2018-12-03T10:42:33.535240
ATC: L01D
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- CYTOTOXIC ANTIBIOTICS AND RELATED SUBSTANCES
Synthesis Plan
FORMULA:C18H24N4O4

SMILES: N=C(N)c1ccc(C(=O)N[C@H](CC(=O)O)CC(=O)N2CCCCC2)cc1

BIRTHDAY: 2018-12-03T10:42:33.544474
ATC: N06B
- NERVOUS SYSTEM
- PSYCHOANALEPTICS
- PSYCHOSTIMULANTS, AGENTS USED FOR ADHD AND NOOTROPICS
Synthesis Plan
FORMULA:C27H40N8O7

SMILES: CC(C)(NC(=O)C[C@@]1(C(=O)O)COC(=O)C(=O)NCCNCCN[C@@]12CCCCN2)NC(=O)c1ccccc1C(=N)N

BIRTHDAY: 2018-12-03T10:42:33.581886
ATC: C10A
- CARDIOVASCULAR SYSTEM
- LIPID MODIFYING AGENTS
- LIPID MODIFYING AGENTS, PLAIN
Synthesis Plan
FORMULA:C32H47N5O4

SMILES: CC(C)C[C@@H](C#N)NC(=O)[C@H](CC(=O)O)NC(=O)CCc1ccc([C@@H]2CCCNCCCC3=CN(CC3)CC2)cc1

BIRTHDAY: 2018-12-03T10:42:33.594064
ATC: M03C
- MUSCULO-SKELETAL SYSTEM
- MUSCLE RELAXANTS
- MUSCLE RELAXANTS, DIRECTLY ACTING AGENTS
Synthesis Plan
FORMULA:C24H26FNO3

SMILES: CC(C)(C(=O)N[C@@H](CC(=O)O)c1ccccc1F)C1=C2C=CC=C[C@@H]2CC=CC1

BIRTHDAY: 2018-12-03T10:42:33.652628
ATC: R05C
- RESPIRATORY SYSTEM
- COUGH AND COLD PREPARATIONS
- EXPECTORANTS, EXCL. COMBINATIONS WITH COUGH SUPPRESSANTS
Synthesis Plan
FORMULA:C20H26N4O6

SMILES: C[C@@]1(C(=O)O)CCCCN1C(=O)C[C@H](CC(=O)O)NC(=O)c1ccccc1C(=N)N

BIRTHDAY: 2018-12-03T19:10:59.043791
ATC: N06B
- NERVOUS SYSTEM
- PSYCHOANALEPTICS
- PSYCHOSTIMULANTS, AGENTS USED FOR ADHD AND NOOTROPICS
Synthesis Plan
FORMULA:C24H26N4O3

SMILES: O=C(O)C[C@@H](NC(=O)CCCc1ccc2c(n1)CCNC2)c1cnc2ccccc2c1

BIRTHDAY: 2018-12-03T19:10:59.053511
ATC: M03A
- MUSCULO-SKELETAL SYSTEM
- MUSCLE RELAXANTS
- MUSCLE RELAXANTS, PERIPHERALLY ACTING AGENTS
Synthesis Plan
FORMULA:C24H29N5O4

SMILES: N=C(N)c1ccc(C(=O)N[C@@H](CC(=O)O)CC(=O)N2CCN(Cc3ccccc3)CC2)cc1

BIRTHDAY: 2018-12-03T19:10:59.073880
ATC: J05A
- ANTIINFECTIVES FOR SYSTEMIC USE
- ANTIVIRALS FOR SYSTEMIC USE
- DIRECT ACTING ANTIVIRALS
Synthesis Plan
FORMULA:C17H25N3O4

SMILES: CCCCCC[C@@H](CC(=O)O)NC(=O)c1ccc(C(=N)NO)cc1

BIRTHDAY: 2018-12-03T19:10:59.082116
ATC: N06B
- NERVOUS SYSTEM
- PSYCHOANALEPTICS
- PSYCHOSTIMULANTS, AGENTS USED FOR ADHD AND NOOTROPICS
Synthesis Plan
FORMULA:C27H34N4O3

SMILES: O=C(O)CCC(=O)NCC1=C2C=CC(=N2)c2ccc([nH]2)CCCCCCCCCc2ccc1[nH]2

BIRTHDAY: 2018-12-03T19:10:59.113495
ATC: N06A
- NERVOUS SYSTEM
- PSYCHOANALEPTICS
- ANTIDEPRESSANTS
Synthesis Plan
FORMULA:C19H31NO3

SMILES: O=C(O)CCC(=O)NCCCC[C@H]1CC=CCCCC=CCC1

BIRTHDAY: 2018-12-03T19:10:59.120541
ATC: J04A
- ANTIINFECTIVES FOR SYSTEMIC USE
- ANTIMYCOBACTERIALS
- DRUGS FOR TREATMENT OF TUBERCULOSIS
Synthesis Plan
FORMULA:C19H27N5O6S

SMILES: CC(C)[C@H](NC(=O)[C@@H](CC(=O)O)Nc1c(NC(C)(C)C2=COC2)ncsc1=O)C(N)=O

BIRTHDAY: 2018-12-03T19:10:59.141981
ATC: C08C
- CARDIOVASCULAR SYSTEM
- CALCIUM CHANNEL BLOCKERS
- SELECTIVE CALCIUM CHANNEL BLOCKERS WITH MAINLY VASCULAR EFFECTS
Synthesis Plan
FORMULA:C17H22N4O8

SMILES: NC(=O)c1ccccc1NC(=O)[C@H](CC(=O)O)N[C@@]1(C(=O)O)CNCCOCO1

BIRTHDAY: 2018-12-03T19:10:59.173776
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C20H28N4O6

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

BIRTHDAY: 2018-12-01T22:30:03.778030
ATC: L03A
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- IMMUNOSTIMULANTS
- IMMUNOSTIMULANTS
Synthesis Plan
FORMULA:C24H29N5O3

SMILES: CC(C)(C(=O)N[C@H](CC(=O)O)c1ccnc2c1[C@H]1CN[C@H]2C1)c1ccnc2c1NCCC2

BIRTHDAY: 2018-12-01T22:30:03.788359
ATC: M05B
- MUSCULO-SKELETAL SYSTEM
- DRUGS FOR TREATMENT OF BONE DISEASES
- DRUGS AFFECTING BONE STRUCTURE AND MINERALIZATION
Synthesis Plan
FORMULA:C24H26F2N2O3

SMILES: O=C(O)C[C@H](NC(=O)CC[C@H]1CCN2CC[C@H]1c1ccc(F)c(F)c12)c1ccccc1

BIRTHDAY: 2018-12-01T22:30:03.857701
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:C22H26ClN7O3

SMILES: C[C@H](NC(=O)c1ccccc1NC(=N)N)[C@]1(N)NCC(=O)C=CN[C@]1(O)c1cccc(Cl)c1

BIRTHDAY: 2018-12-01T22:30:03.887936
ATC: N02B
- NERVOUS SYSTEM
- ANALGESICS
- OTHER ANALGESICS AND ANTIPYRETICS
Synthesis Plan
FORMULA:C25H28N4O3

SMILES: O=C(O)CC[C@@H](NC(=O)CCCc1ccc2c(n1)NCCC2)c1cnc2ccccc2c1

BIRTHDAY: 2018-12-01T22:30:03.906993
ATC: L03A
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- IMMUNOSTIMULANTS
- IMMUNOSTIMULANTS
Synthesis Plan