matter.farm

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

These compounds may interact with:

Integrin alpha-IIb

Potentially involved in: glanzmann's thrombasthenia; kidney cancer; carcinoma; thrombocytopenia; coronary artery disease; autoimmune thrombocytopenic purpura; bernard-soulier syndrome; cerebrovascular disease; purpura; von willebrand's disease; beta thalassemia; cancer; atherosclerosis; heart disease; anemia; diabetes mellitus; peripheral vascular disease; alpha thalassemia; carotid artery thrombosis; ecchymosis

Disease data sourced from Pharos.

Antagonist

FORMULA:C28H42N2O7

SMILES: C[C@H](C(=O)O)[C@@H](NC(=O)C(C)(C)c1cc2ccc1NCCCCCCCCC(=O)COCCC2)C(=O)O

BIRTHDAY: 2018-12-01T14:11:26.739525
ATC: H02A
- SYSTEMIC HORMONAL PREPARATIONS, EXCL. SEX HORMONES AND INSULINS
- CORTICOSTEROIDS FOR SYSTEMIC USE
- CORTICOSTEROIDS FOR SYSTEMIC USE, PLAIN
Synthesis Plan
FORMULA:C16H20N4O3

SMILES: N=C(N)c1ccc(C(=O)N[C@@H](C[C@@H]2CCCC=N2)C(=O)O)cc1

BIRTHDAY: 2018-12-01T14:11:26.747919
ATC: J05A
- ANTIINFECTIVES FOR SYSTEMIC USE
- ANTIVIRALS FOR SYSTEMIC USE
- DIRECT ACTING ANTIVIRALS
Synthesis Plan
FORMULA:C14H18BrN3O3

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

BIRTHDAY: 2018-12-01T14:11:26.756391
ATC: J05A
- ANTIINFECTIVES FOR SYSTEMIC USE
- ANTIVIRALS FOR SYSTEMIC USE
- DIRECT ACTING ANTIVIRALS
Synthesis Plan
FORMULA:C22H26FN3O3

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

BIRTHDAY: 2018-12-01T14:11:26.765448
ATC: J05A
- ANTIINFECTIVES FOR SYSTEMIC USE
- ANTIVIRALS FOR SYSTEMIC USE
- DIRECT ACTING ANTIVIRALS
Synthesis Plan
FORMULA:C17H17N3O3

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

BIRTHDAY: 2018-12-01T14:11:26.773629
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)[C@@H](C)c1ccccc1C(=N)N)C(=O)O

BIRTHDAY: 2018-12-01T14:11:26.783812
ATC: J01D
- ANTIINFECTIVES FOR SYSTEMIC USE
- ANTIBACTERIALS FOR SYSTEMIC USE
- OTHER BETA-LACTAM ANTIBACTERIALS
Synthesis Plan
FORMULA:C23H39N5O8

SMILES: CC(C)[C@H](NC(=O)[C@]1(CC(=O)O)NC[C@H]2COC[C@@]1(CC(C)(C)C)N2)C(=O)N[C@@H](CC(=O)O)C(N)=O

BIRTHDAY: 2018-12-01T14:11:26.797607
ATC: B03B
- BLOOD AND BLOOD FORMING ORGANS
- ANTIANEMIC PREPARATIONS
- VITAMIN B12 AND FOLIC ACID
Synthesis Plan
FORMULA:C19H25N5O6

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

BIRTHDAY: 2018-12-01T14:11:26.808151
ATC: N06B
- NERVOUS SYSTEM
- PSYCHOANALEPTICS
- PSYCHOSTIMULANTS, AGENTS USED FOR ADHD AND NOOTROPICS
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: 2018-12-01T14:11:26.816649
ATC: L01C
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- PLANT ALKALOIDS AND OTHER NATURAL PRODUCTS
Synthesis Plan
FORMULA:C17H25N3O4

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

BIRTHDAY: 2018-12-01T14:11:26.825234
ATC: A02A
- ALIMENTARY TRACT AND METABOLISM
- DRUGS FOR ACID RELATED DISORDERS
- ANTACIDS
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: 2018-12-01T14:11:26.835881
ATC: N06B
- NERVOUS SYSTEM
- PSYCHOANALEPTICS
- PSYCHOSTIMULANTS, AGENTS USED FOR ADHD AND NOOTROPICS
Synthesis Plan
FORMULA:C18H24N6O6

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

BIRTHDAY: 2018-12-01T14:11:26.847788
ATC: J02A
- ANTIINFECTIVES FOR SYSTEMIC USE
- ANTIMYCOTICS FOR SYSTEMIC USE
- ANTIMYCOTICS FOR SYSTEMIC USE
Synthesis Plan
FORMULA:C23H28N6O4

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

BIRTHDAY: 2018-12-01T14:11:26.859397
ATC: C09A
- CARDIOVASCULAR SYSTEM
- AGENTS ACTING ON THE RENIN-ANGIOTENSIN SYSTEM
- ACE INHIBITORS, PLAIN
Synthesis Plan
FORMULA:C18H24N4O4

SMILES: N=C(N)c1ccccc1C(=O)N[C@H](CC(=O)O)CC(=O)N1CCCCC1

BIRTHDAY: 2018-12-01T14:11:26.868699
ATC: N06B
- NERVOUS SYSTEM
- PSYCHOANALEPTICS
- PSYCHOSTIMULANTS, AGENTS USED FOR ADHD AND NOOTROPICS
Synthesis Plan
FORMULA:C19H26N4O6

SMILES: CC(C)[C@@H](NC(=O)[C@@H](CC(=O)O)NC(=O)CCc1ccccc1C(=N)N)C(=O)O

BIRTHDAY: 2018-12-01T14:11:26.878716
ATC: J05A
- ANTIINFECTIVES FOR SYSTEMIC USE
- ANTIVIRALS FOR SYSTEMIC USE
- DIRECT ACTING ANTIVIRALS
Synthesis Plan
FORMULA:C23H35N5O5

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

BIRTHDAY: 2018-12-01T14:11:26.889086
ATC: C08C
- CARDIOVASCULAR SYSTEM
- CALCIUM CHANNEL BLOCKERS
- SELECTIVE CALCIUM CHANNEL BLOCKERS WITH MAINLY VASCULAR EFFECTS
Synthesis Plan
FORMULA:C14H17NO7

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

BIRTHDAY: 2018-12-01T14:11:26.897766
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)CCc1ccc(C(=N)N)cc1)C(=O)O

BIRTHDAY: 2018-12-25T02:03:29.814641
ATC: J05A
- ANTIINFECTIVES FOR SYSTEMIC USE
- ANTIVIRALS FOR SYSTEMIC USE
- DIRECT ACTING ANTIVIRALS
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: 2018-12-25T02:03:29.825041
ATC: J01D
- ANTIINFECTIVES FOR SYSTEMIC USE
- ANTIBACTERIALS FOR SYSTEMIC USE
- OTHER BETA-LACTAM ANTIBACTERIALS
Synthesis Plan
FORMULA:C17H34N3O4Sb

SMILES: COC(=O)CC[C@H](NC(=O)C[SbH2])C(=O)NCCCCCCCCCN

BIRTHDAY: 2018-12-25T02:03:29.833395
ATC: D08A
- DERMATOLOGICALS
- ANTISEPTICS AND DISINFECTANTS
- ANTISEPTICS AND DISINFECTANTS
Synthesis Plan
FORMULA:C16H17N3O6

SMILES: N=C(N)c1ccccc1C(=O)N[C@@H](CC(=O)O)[C@H]1OCC=CC(=O)O1

BIRTHDAY: 2018-12-25T02:03:29.843185
ATC: J01C
- ANTIINFECTIVES FOR SYSTEMIC USE
- ANTIBACTERIALS FOR SYSTEMIC USE
- BETA-LACTAM ANTIBACTERIALS, PENICILLINS
Synthesis Plan
FORMULA:C24H28N4O3

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

BIRTHDAY: 2018-12-25T02:03:29.853311
ATC: A03F
- ALIMENTARY TRACT AND METABOLISM
- DRUGS FOR FUNCTIONAL GASTROINTESTINAL DISORDERS
- PROPULSIVES
Synthesis Plan
FORMULA:C24H27N5O5

SMILES: CC(C)[C@H](NC(=O)[C@@H](c1ccccc1C(=N)N)[C@]1(CC(=O)O)C=NN=C2C=CC=C[C@H]21)C(=O)O

BIRTHDAY: 2018-12-25T02:03:29.867078
ATC: A02B
- ALIMENTARY TRACT AND METABOLISM
- DRUGS FOR ACID RELATED DISORDERS
- DRUGS FOR PEPTIC ULCER AND GASTRO-OESOPHAGEAL REFLUX DISEASE (GORD)
Synthesis Plan
FORMULA:C9H8N2O3

SMILES: N=C(N=O)c1ccc2c(c1)OCOC2

BIRTHDAY: 2018-12-25T02:03:29.873876
ATC: A01A
- ALIMENTARY TRACT AND METABOLISM
- STOMATOLOGICAL PREPARATIONS
- STOMATOLOGICAL PREPARATIONS
Synthesis Plan
FORMULA:C14H19N3O4

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

BIRTHDAY: 2018-12-25T02:03:29.882030
ATC: A12A
- ALIMENTARY TRACT AND METABOLISM
- MINERAL SUPPLEMENTS
- CALCIUM
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: 2018-12-25T02:03:29.892353
ATC: J01D
- ANTIINFECTIVES FOR SYSTEMIC USE
- ANTIBACTERIALS FOR SYSTEMIC USE
- OTHER BETA-LACTAM ANTIBACTERIALS
Synthesis Plan
FORMULA:C13H24N2O3

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

BIRTHDAY: 2018-12-25T02:03:29.919830
ATC: A09A
- ALIMENTARY TRACT AND METABOLISM
- DIGESTIVES, INCL. ENZYMES
- DIGESTIVES, INCL. ENZYMES
Synthesis Plan
FORMULA:C24H33N5O3

SMILES: C[C@@H](N)Cc1cnccc1[C@@H](NC(=O)C(C)(C)c1ccnc2c1NCCC2)[C@@H](C)C(=O)O

BIRTHDAY: 2018-12-25T02:03:29.940330
ATC: L01C
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- PLANT ALKALOIDS AND OTHER NATURAL PRODUCTS
Synthesis Plan
FORMULA:C20H28N4O4

SMILES: CC(C)[C@@H](NC(=O)c1ccccc1C(=N)N)C(=O)N1CCCC[C@]1(C)C(=O)O

BIRTHDAY: 2018-12-25T02:03:29.949981
ATC: J05A
- ANTIINFECTIVES FOR SYSTEMIC USE
- ANTIVIRALS FOR SYSTEMIC USE
- DIRECT ACTING ANTIVIRALS
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: 2018-12-25T02:03:29.960744
ATC: N06B
- NERVOUS SYSTEM
- PSYCHOANALEPTICS
- PSYCHOSTIMULANTS, AGENTS USED FOR ADHD AND NOOTROPICS
Synthesis Plan
FORMULA:C38H65N5O2

SMILES: C[C@@H](C(=O)O)C(C)(C)C(C)(C)C(C)(C)C(C)(C)C(C)(C)C(C)(C)C(C)(C)[C@]1(N)NCN2C[C@@H]3C[C@@H]1[C@@H]2c1cccc(C(=N)N)c13

BIRTHDAY: 2018-12-25T02:03:29.972617
ATC: G03B
- GENITO URINARY SYSTEM AND SEX HORMONES
- SEX HORMONES AND MODULATORS OF THE GENITAL SYSTEM
- ANDROGENS
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: 2018-12-25T02:03:29.982544
ATC: J05A
- ANTIINFECTIVES FOR SYSTEMIC USE
- ANTIVIRALS FOR SYSTEMIC USE
- DIRECT ACTING ANTIVIRALS
Synthesis Plan
FORMULA:C22H26FN3O3

SMILES: C[C@@H](C(=O)O)[C@H](NC(=O)C(C)(C)c1ccnc2c1CNCC2)c1ccccc1F

BIRTHDAY: 2018-12-03T02:39:35.072893
ATC: A08A
- ALIMENTARY TRACT AND METABOLISM
- ANTIOBESITY PREPARATIONS, EXCL. DIET PRODUCTS
- ANTIOBESITY PREPARATIONS, EXCL. DIET PRODUCTS
Synthesis Plan
FORMULA:C14H26N2O3

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

BIRTHDAY: 2018-12-03T02:39:35.079679
ATC: J04A
- ANTIINFECTIVES FOR SYSTEMIC USE
- ANTIMYCOBACTERIALS
- DRUGS FOR TREATMENT OF TUBERCULOSIS
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: 2018-12-03T02:39:35.108727
ATC: J01D
- ANTIINFECTIVES FOR SYSTEMIC USE
- ANTIBACTERIALS FOR SYSTEMIC USE
- OTHER BETA-LACTAM ANTIBACTERIALS
Synthesis Plan
FORMULA:C17H16FN3O3

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

BIRTHDAY: 2018-12-03T02:39:35.117347
ATC: N05A
- NERVOUS SYSTEM
- PSYCHOLEPTICS
- ANTIPSYCHOTICS
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: 2018-12-03T02:39:35.138871
ATC: N06B
- NERVOUS SYSTEM
- PSYCHOANALEPTICS
- PSYCHOSTIMULANTS, AGENTS USED FOR ADHD AND NOOTROPICS
Synthesis Plan
FORMULA:C22H39N7O6

SMILES: CC(C)[C@H](NC(=O)[C@H](CC1CCC1)NC(=O)CCC(=O)O)C(=O)N[C@H](CCCNC(=N)N)C(N)=O

BIRTHDAY: 2018-12-03T02:39:35.161017
ATC: H05B
- SYSTEMIC HORMONAL PREPARATIONS, EXCL. SEX HORMONES AND INSULINS
- CALCIUM HOMEOSTASIS
- ANTI-PARATHYROID AGENTS
Synthesis Plan
FORMULA:C23H31N3O6

SMILES: COC(=O)[C@]1(C)N2C=C[C@]1([C@@H](C)C(=O)N/N=C\c1c(OC)ccc(OC)c1OC)CCC2

BIRTHDAY: 2018-12-03T02:39:35.171432
ATC: N02C
- NERVOUS SYSTEM
- ANALGESICS
- ANTIMIGRAINE PREPARATIONS
Synthesis Plan
FORMULA:C6H11NS

SMILES: CC1=NCCCSC1

BIRTHDAY: 2018-12-03T02:39:35.176483
ATC: M04A
- MUSCULO-SKELETAL SYSTEM
- ANTIGOUT PREPARATIONS
- ANTIGOUT PREPARATIONS
Synthesis Plan
FORMULA:C13H24N2O3

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

BIRTHDAY: 2018-12-03T02:39:35.183074
ATC: N03A
- NERVOUS SYSTEM
- ANTIEPILEPTICS
- ANTIEPILEPTICS
Synthesis Plan
FORMULA:C29H47N5O7

SMILES: CC(C)[C@H](NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](C)c1ccccc1C(=N)N)[C@@]1(O)CNCCOCCCCCCCO1

BIRTHDAY: 2018-12-03T02:39:35.196362
ATC: A02B
- ALIMENTARY TRACT AND METABOLISM
- DRUGS FOR ACID RELATED DISORDERS
- DRUGS FOR PEPTIC ULCER AND GASTRO-OESOPHAGEAL REFLUX DISEASE (GORD)
Synthesis Plan
FORMULA:C22H26FN3O3

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

BIRTHDAY: 2018-12-03T02:39:35.205338
ATC: J05A
- ANTIINFECTIVES FOR SYSTEMIC USE
- ANTIVIRALS FOR SYSTEMIC USE
- DIRECT ACTING ANTIVIRALS
Synthesis Plan
FORMULA:C4H8S5

SMILES: CC1(C)CSSSSS1

BIRTHDAY: 2018-11-30T03:41:31.126572
ATC: J01C
- ANTIINFECTIVES FOR SYSTEMIC USE
- ANTIBACTERIALS FOR SYSTEMIC USE
- BETA-LACTAM ANTIBACTERIALS, PENICILLINS
Synthesis plan pending
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: 2018-11-30T03:41:31.136710
ATC: J01D
- ANTIINFECTIVES FOR SYSTEMIC USE
- ANTIBACTERIALS FOR SYSTEMIC USE
- OTHER BETA-LACTAM ANTIBACTERIALS
Synthesis plan pending
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: 2018-11-30T03:41:31.146762
ATC: J01D
- ANTIINFECTIVES FOR SYSTEMIC USE
- ANTIBACTERIALS FOR SYSTEMIC USE
- OTHER BETA-LACTAM ANTIBACTERIALS
Synthesis plan pending
FORMULA:C19H22N6O4S

SMILES: N=C(N)c1ccccc1C(=O)N[C@H](Cc1cnns1)C(=O)N1CCCC[C@@H]1C(=O)O

BIRTHDAY: 2018-11-30T03:41:31.158007
ATC: C09A
- CARDIOVASCULAR SYSTEM
- AGENTS ACTING ON THE RENIN-ANGIOTENSIN SYSTEM
- ACE INHIBITORS, PLAIN
Synthesis plan pending
FORMULA:C23H43N3O3

SMILES: O=C(CCC(=O)OCCCCC1CCNCC1)NCCCCCC1CCNCC1

BIRTHDAY: 2018-11-30T03:41:31.166014
ATC: C03D
- CARDIOVASCULAR SYSTEM
- DIURETICS
- POTASSIUM-SPARING AGENTS
Synthesis plan pending
FORMULA:C24H28F3N5O4

SMILES: CC(C)(C(=O)N[C@@H](CC(=O)O)c1ncccc1C[C@@H](C(N)=O)C(F)(F)F)c1ccnc2c1NCCC2

BIRTHDAY: 2018-11-30T03:41:31.184413
ATC: L01C
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- PLANT ALKALOIDS AND OTHER NATURAL PRODUCTS
Synthesis plan pending
FORMULA:C25H30N6O3S

SMILES: CC(C)(CO)Oc1cc2nc(n1)Nc1cccc(c1)CNCC(C(=N)N)=CCOCc1ccc-2s1

BIRTHDAY: 2018-11-30T03:41:31.195391
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis plan pending
FORMULA:C20H31N5O7S2

SMILES: CC(=O)N[C@@H](C)C(=O)N[C@H](CCCCNC(C)=S)C(=O)N[C@H](C(=O)O)C1=CN(C)C(=O)CSO1

BIRTHDAY: 2018-11-30T03:41:31.206874
ATC: L02B
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ENDOCRINE THERAPY
- HORMONE ANTAGONISTS AND RELATED AGENTS
Synthesis plan pending
FORMULA:C33H39N5O7

SMILES: CC(C)[C@@H](NC(=O)[C@H](CC(=O)O)Nc1cc2c3cc(ccc3c1)Oc1cccc(c1)CNCCCN1CCN2C(=O)C1)C(=O)O

BIRTHDAY: 2018-11-30T03:41:31.220294
ATC: P02C
- ANTIPARASITIC PRODUCTS, INSECTICIDES AND REPELLENTS
- ANTHELMINTICS
- ANTINEMATODAL AGENTS
Synthesis plan pending
FORMULA:C14H16N4O4

SMILES: N=C(N)c1ccc(C2=NO[C@@H](CC(=O)NCC(=O)O)C2)cc1

BIRTHDAY: 2018-11-30T03:41:31.228658
ATC: A10B
- ALIMENTARY TRACT AND METABOLISM
- DRUGS USED IN DIABETES
- BLOOD GLUCOSE LOWERING DRUGS, EXCL. INSULINS
Synthesis plan pending
FORMULA:C13H13FN2O3

SMILES: O=C(O)C[C@@H](NC1=CCON=C1)c1ccc(F)cc1

BIRTHDAY: 2018-11-30T03:41:31.236454
ATC: N05A
- NERVOUS SYSTEM
- PSYCHOLEPTICS
- ANTIPSYCHOTICS
Synthesis plan pending
FORMULA:C28H34N4O6

SMILES: O=C(O)CCNC(=O)Cc1c2cc(cc1C(=O)OCC(=O)c1ccccc1)NCCCCN1CC[C@@H](C1)N2

BIRTHDAY: 2018-11-30T03:41:31.248264
ATC: P03B
- ANTIPARASITIC PRODUCTS, INSECTICIDES AND REPELLENTS
- ECTOPARASITICIDES, INCL. SCABICIDES, INSECTICIDES AND REPELLENTS
- INSECTICIDES AND REPELLENTS
Synthesis plan pending
FORMULA:C22H26FN3O3

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

BIRTHDAY: 2018-11-30T03:41:31.257697
ATC: D01A
- DERMATOLOGICALS
- ANTIFUNGALS FOR DERMATOLOGICAL USE
- ANTIFUNGALS FOR TOPICAL USE
Synthesis plan pending
FORMULA:C27H36N6O3

SMILES: C[C@]1([C@@H](CC(=O)O)NC(=O)c2ccccc2C(=N)N)[C@H]2CCCN1CCCCNc1cccc(c1)N2

BIRTHDAY: 2018-11-30T03:41:31.269171
ATC: A07A
- ALIMENTARY TRACT AND METABOLISM
- ANTIDIARRHEALS, INTESTINAL ANTIINFLAMMATORY/ANTIINFECTIVE AGENTS
- INTESTINAL ANTIINFECTIVES
Synthesis plan pending
FORMULA:C29H31N3O2S

SMILES: O=C(NCCCC1CCNCC1)c1ccc2c(c1)N(Cc1ccccc1)C(=O)c1ccccc1S2

BIRTHDAY: 2018-11-30T03:41:31.279381
ATC: N06A
- NERVOUS SYSTEM
- PSYCHOANALEPTICS
- ANTIDEPRESSANTS
Synthesis plan pending
FORMULA:C24H26N4O3

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

BIRTHDAY: 2018-11-30T03:41:31.298865
ATC: H04A
- SYSTEMIC HORMONAL PREPARATIONS, EXCL. SEX HORMONES AND INSULINS
- PANCREATIC HORMONES
- GLYCOGENOLYTIC HORMONES
Synthesis plan pending
FORMULA:C23H34N4O6

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

BIRTHDAY: 2018-11-19T08:16:23.009125
ATC: J05A
- ANTIINFECTIVES FOR SYSTEMIC USE
- ANTIVIRALS FOR SYSTEMIC USE
- DIRECT ACTING ANTIVIRALS
Synthesis plan pending
FORMULA:C23H34N4O6

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

BIRTHDAY: 2018-11-19T08:16:23.020273
ATC: C08C
- CARDIOVASCULAR SYSTEM
- CALCIUM CHANNEL BLOCKERS
- SELECTIVE CALCIUM CHANNEL BLOCKERS WITH MAINLY VASCULAR EFFECTS
Synthesis plan pending
FORMULA:C14H15N3O3S2

SMILES: C[C@@H](C(=O)O)C1(NC(=O)c2ccccc2C(=N)N)SC=CS1

BIRTHDAY: 2018-11-19T08:16:23.029631
ATC: A07A
- ALIMENTARY TRACT AND METABOLISM
- ANTIDIARRHEALS, INTESTINAL ANTIINFLAMMATORY/ANTIINFECTIVE AGENTS
- INTESTINAL ANTIINFECTIVES
Synthesis plan pending
FORMULA:C20H26N4O6

SMILES: C[C@]1(C(=O)O)CCCCN1C(=O)C[C@@H](CC(=O)O)NC(=O)c1ccc(C(=N)N)cc1

BIRTHDAY: 2018-11-19T08:16:23.040555
ATC: J05A
- ANTIINFECTIVES FOR SYSTEMIC USE
- ANTIVIRALS FOR SYSTEMIC USE
- DIRECT ACTING ANTIVIRALS
Synthesis plan pending
FORMULA:C15H23N5O4S

SMILES: CC(C)[C@@H](Nc1sccc1C(=N)N)C(=O)NCC(=O)N[C@@H](C)C(=O)O

BIRTHDAY: 2018-11-19T08:16:23.050028
ATC: J05A
- ANTIINFECTIVES FOR SYSTEMIC USE
- ANTIVIRALS FOR SYSTEMIC USE
- DIRECT ACTING ANTIVIRALS
Synthesis plan pending
FORMULA:C20H26N4O6

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

BIRTHDAY: 2018-11-19T08:16:23.060739
ATC: N06B
- NERVOUS SYSTEM
- PSYCHOANALEPTICS
- PSYCHOSTIMULANTS, AGENTS USED FOR ADHD AND NOOTROPICS
Synthesis plan pending
FORMULA:C21H29N3O7S

SMILES: CC(C)[C@@H](NC(=O)[C@@]12C=CC=C[C@@]1(CC(=O)O)SCCC2)C(=O)N[C@@H](CC(=O)O)C(N)=O

BIRTHDAY: 2018-11-19T08:16:23.081841
ATC: M05B
- MUSCULO-SKELETAL SYSTEM
- DRUGS FOR TREATMENT OF BONE DISEASES
- DRUGS AFFECTING BONE STRUCTURE AND MINERALIZATION
Synthesis plan pending
FORMULA:C14H16N4O4

SMILES: N=C(N)c1ccccc1[C@@]1(CC(=O)NCC(=O)O)C=NOC1

BIRTHDAY: 2018-11-19T08:16:23.090558
ATC: N02B
- NERVOUS SYSTEM
- ANALGESICS
- OTHER ANALGESICS AND ANTIPYRETICS
Synthesis plan pending
FORMULA:C17H17N3O3

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

BIRTHDAY: 2018-11-19T08:16:23.099051
ATC: A07B
- ALIMENTARY TRACT AND METABOLISM
- ANTIDIARRHEALS, INTESTINAL ANTIINFLAMMATORY/ANTIINFECTIVE AGENTS
- INTESTINAL ADSORBENTS
Synthesis plan pending
FORMULA:C22H26FN3O3

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

BIRTHDAY: 2018-11-19T08:16:23.108615
ATC: D01A
- DERMATOLOGICALS
- ANTIFUNGALS FOR DERMATOLOGICAL USE
- ANTIFUNGALS FOR TOPICAL USE
Synthesis plan pending
FORMULA:C25H28N4O3

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

BIRTHDAY: 2018-11-19T08:16:23.128740
ATC: L03A
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- IMMUNOSTIMULANTS
- IMMUNOSTIMULANTS
Synthesis plan pending
FORMULA:C25H30N4O3

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

BIRTHDAY: 2018-11-19T08:16:23.138722
ATC: M05B
- MUSCULO-SKELETAL SYSTEM
- DRUGS FOR TREATMENT OF BONE DISEASES
- DRUGS AFFECTING BONE STRUCTURE AND MINERALIZATION
Synthesis plan pending
FORMULA:C16H23N3O4

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

BIRTHDAY: 2018-11-19T08:16:23.146908
ATC: B05X
- BLOOD AND BLOOD FORMING ORGANS
- BLOOD SUBSTITUTES AND PERFUSION SOLUTIONS
- I.V. SOLUTION ADDITIVES
Synthesis plan pending
FORMULA:C21H26N4O3

SMILES: O=C(O)CC[C@@H](NC(=O)CCCc1ccc2c(n1)NCCC2)c1cccnc1

BIRTHDAY: 2018-11-19T08:16:23.155888
ATC: J05A
- ANTIINFECTIVES FOR SYSTEMIC USE
- ANTIVIRALS FOR SYSTEMIC USE
- DIRECT ACTING ANTIVIRALS
Synthesis plan pending
FORMULA:C19H19F2N5O4

SMILES: N=C(N)Nc1ccccc1C(=O)NCC(=O)N[C@@H](CC(=O)O)c1c(F)cccc1F

BIRTHDAY: 2018-11-19T08:16:23.167949
ATC: A10B
- ALIMENTARY TRACT AND METABOLISM
- DRUGS USED IN DIABETES
- BLOOD GLUCOSE LOWERING DRUGS, EXCL. INSULINS
Synthesis plan pending
FORMULA:C10H15NO3S

SMILES: CC(C)[C@]12C[C@@H](CO[C@@H]1C(=O)O)SC=N2

BIRTHDAY: 2018-11-19T08:16:23.175256
ATC: N07C
- NERVOUS SYSTEM
- OTHER NERVOUS SYSTEM DRUGS
- ANTIVERTIGO PREPARATIONS
Synthesis plan pending
FORMULA:C21H25N5O4

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

BIRTHDAY: 2018-11-19T08:16:23.185088
ATC: L03A
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- IMMUNOSTIMULANTS
- IMMUNOSTIMULANTS
Synthesis plan pending
FORMULA:C16H18N4O6

SMILES: N=C(N)c1ccc(C2=NO[C@H](CC(=O)N[C@@H](CC(=O)O)C(=O)O)C2)cc1

BIRTHDAY: 2018-11-19T08:16:23.205015
ATC: M01A
- MUSCULO-SKELETAL SYSTEM
- ANTIINFLAMMATORY AND ANTIRHEUMATIC PRODUCTS
- ANTIINFLAMMATORY AND ANTIRHEUMATIC PRODUCTS, NON-STEROIDS
Synthesis plan pending
FORMULA:C28H36N4O4

SMILES: C[C@H](C(=O)N1CCCC[C@@H]1C(=O)N[C@@H](CC(=O)O)c1ncccc1-c1ccccc1)[C@@H]1CCCNC1

BIRTHDAY: 2018-11-19T08:16:23.215824
ATC: A05B
- ALIMENTARY TRACT AND METABOLISM
- BILE AND LIVER THERAPY
- LIVER THERAPY, LIPOTROPICS
Synthesis plan pending
FORMULA:C23H34N4O6

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

BIRTHDAY: 2018-11-19T08:16:23.226528
ATC: J05A
- ANTIINFECTIVES FOR SYSTEMIC USE
- ANTIVIRALS FOR SYSTEMIC USE
- DIRECT ACTING ANTIVIRALS
Synthesis plan pending
FORMULA:C22H41N3O3

SMILES: C[C@@H](C(=O)NC(C)(C)[C@]1(C)CCCNC1)C(=O)OC(C)(C)[C@@]1(C)CCCCN1

BIRTHDAY: 2018-11-19T08:16:23.235136
ATC: C03C
- CARDIOVASCULAR SYSTEM
- DIURETICS
- HIGH-CEILING DIURETICS
Synthesis plan pending
FORMULA:C25H30N4O3

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

BIRTHDAY: 2018-11-19T08:16:23.245105
ATC: M05B
- MUSCULO-SKELETAL SYSTEM
- DRUGS FOR TREATMENT OF BONE DISEASES
- DRUGS AFFECTING BONE STRUCTURE AND MINERALIZATION
Synthesis plan pending
FORMULA:C19H26N4O2

SMILES: C[C@]1(CC(=O)O)N2CCN3C[C@H](C2)C[C@]1(c1ccccc1C(=N)N)C3

BIRTHDAY: 2018-11-19T08:16:23.264558
ATC: A10B
- ALIMENTARY TRACT AND METABOLISM
- DRUGS USED IN DIABETES
- BLOOD GLUCOSE LOWERING DRUGS, EXCL. INSULINS
Synthesis plan pending
FORMULA:C22H28N4O3

SMILES: Cc1ccc([C@H](CCC(=O)O)NC(=O)CCCc2ccc3c(n2)NCCC3)cn1

BIRTHDAY: 2018-11-19T08:16:23.280385
ATC: J05A
- ANTIINFECTIVES FOR SYSTEMIC USE
- ANTIVIRALS FOR SYSTEMIC USE
- DIRECT ACTING ANTIVIRALS
Synthesis plan pending
FORMULA:C24H31N5O4

SMILES: C[C@@H](Cc1ccc([C@H](CC(=O)O)NC(=O)CCCc2ccc3c(n2)NCCC3)cn1)C(N)=O

BIRTHDAY: 2018-11-19T08:16:23.290931
ATC: J05A
- ANTIINFECTIVES FOR SYSTEMIC USE
- ANTIVIRALS FOR SYSTEMIC USE
- DIRECT ACTING ANTIVIRALS
Synthesis plan pending
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: 2018-11-19T08:16:23.300866
ATC: J05A
- ANTIINFECTIVES FOR SYSTEMIC USE
- ANTIVIRALS FOR SYSTEMIC USE
- DIRECT ACTING ANTIVIRALS
Synthesis plan pending
FORMULA:C15H25N3O6S

SMILES: CC(C)[C@H](NC1=C[C@H]2CC[C@H]1[SH]2(=O)NCC(=O)O)C(=O)NCC(=O)O

BIRTHDAY: 2018-11-19T08:16:23.319034
ATC: V08A
- VARIOUS
- CONTRAST MEDIA
- X-RAY CONTRAST MEDIA, IODINATED
Synthesis plan pending
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: 2018-11-19T08:16:23.329340
ATC: J01D
- ANTIINFECTIVES FOR SYSTEMIC USE
- ANTIBACTERIALS FOR SYSTEMIC USE
- OTHER BETA-LACTAM ANTIBACTERIALS
Synthesis plan pending
FORMULA:C15H16N4O4

SMILES: N=C(N)c1ccc(C(=O)N[C@@H](CC2=COC=CN2)C(=O)O)cc1

BIRTHDAY: 2018-11-19T08:16:23.338001
ATC: A10B
- ALIMENTARY TRACT AND METABOLISM
- DRUGS USED IN DIABETES
- BLOOD GLUCOSE LOWERING DRUGS, EXCL. INSULINS
Synthesis plan pending
FORMULA:C22H26FN3O3

SMILES: CC(C)(C(=O)N[C@H](CCC(=O)O)c1ccccc1F)c1ccnc2c1NCCC2

BIRTHDAY: 2018-11-19T08:16:23.347451
ATC: A10B
- ALIMENTARY TRACT AND METABOLISM
- DRUGS USED IN DIABETES
- BLOOD GLUCOSE LOWERING DRUGS, EXCL. INSULINS
Synthesis plan pending
FORMULA:C23H34N4O6

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

BIRTHDAY: 2018-11-19T08:16:23.358207
ATC: J05A
- ANTIINFECTIVES FOR SYSTEMIC USE
- ANTIVIRALS FOR SYSTEMIC USE
- DIRECT ACTING ANTIVIRALS
Synthesis plan pending
FORMULA:C22H26FN3O3

SMILES: C[C@@H](C(=O)O)[C@@H](NC(=O)C(C)(C)c1ccnc2c1NCCC2)c1ccc(F)cc1

BIRTHDAY: 2018-11-19T08:16:23.367750
ATC: D01A
- DERMATOLOGICALS
- ANTIFUNGALS FOR DERMATOLOGICAL USE
- ANTIFUNGALS FOR TOPICAL USE
Synthesis plan pending
FORMULA:C16H18N4O6

SMILES: N=C(N)c1ccc(C2=NO[C@@H](CC(=O)N[C@H](CC(=O)O)C(=O)O)C2)cc1

BIRTHDAY: 2018-11-19T08:16:23.386574
ATC: M01A
- MUSCULO-SKELETAL SYSTEM
- ANTIINFLAMMATORY AND ANTIRHEUMATIC PRODUCTS
- ANTIINFLAMMATORY AND ANTIRHEUMATIC PRODUCTS, NON-STEROIDS
Synthesis plan pending
FORMULA:C23H34N4O6

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

BIRTHDAY: 2018-11-19T08:16:23.396977
ATC: C08C
- CARDIOVASCULAR SYSTEM
- CALCIUM CHANNEL BLOCKERS
- SELECTIVE CALCIUM CHANNEL BLOCKERS WITH MAINLY VASCULAR EFFECTS
Synthesis plan pending
FORMULA:C23H34N4O6

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

BIRTHDAY: 2018-11-19T08:16:23.427835
ATC: J05A
- ANTIINFECTIVES FOR SYSTEMIC USE
- ANTIVIRALS FOR SYSTEMIC USE
- DIRECT ACTING ANTIVIRALS
Synthesis plan pending
FORMULA:C16H23N3O4

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

BIRTHDAY: 2018-11-19T08:16:23.436381
ATC: A10B
- ALIMENTARY TRACT AND METABOLISM
- DRUGS USED IN DIABETES
- BLOOD GLUCOSE LOWERING DRUGS, EXCL. INSULINS
Synthesis plan pending
FORMULA:C26H42N8O5

SMILES: CC(C)[C@@]1(NC(=O)[C@@H](CC(=O)O)NC(=O)CCc2ccc(C(=N)N)cc2)CCNC(=O)CNCCNCCN1

BIRTHDAY: 2018-11-19T08:16:23.449963
ATC: P02C
- ANTIPARASITIC PRODUCTS, INSECTICIDES AND REPELLENTS
- ANTHELMINTICS
- ANTINEMATODAL AGENTS
Synthesis plan pending
FORMULA:C5H10N2O

SMILES: NC1=CCOCCN1

BIRTHDAY: 2018-11-19T08:16:23.455350
ATC: V03A
- VARIOUS
- ALL OTHER THERAPEUTIC PRODUCTS
- ALL OTHER THERAPEUTIC PRODUCTS
Synthesis plan pending
FORMULA:C41H57N5O7

SMILES: CC(C)[C@H](NC(=O)C1([C@@]2(c3cc4ncc3CNCC(=O)c3cccc(c3)OCC=CCO4)CNCCCCCC(=O)CCCCCCN2)CC1)C(=O)O

BIRTHDAY: 2018-11-19T08:16:23.484228
ATC: B03B
- BLOOD AND BLOOD FORMING ORGANS
- ANTIANEMIC PREPARATIONS
- VITAMIN B12 AND FOLIC ACID
Synthesis plan pending
FORMULA:C25H40N8O3S2

SMILES: N=C(N)c1ccc(C2=NO[C@H](CC(=O)N3CCNCCNCCNCCSSCCC(=O)NCC3)C2)cc1

BIRTHDAY: 2018-11-19T08:16:23.496575
ATC: M01A
- MUSCULO-SKELETAL SYSTEM
- ANTIINFLAMMATORY AND ANTIRHEUMATIC PRODUCTS
- ANTIINFLAMMATORY AND ANTIRHEUMATIC PRODUCTS, NON-STEROIDS
Synthesis plan pending
FORMULA:C24H26N4O3

SMILES: C[C@@H](Cc1cnc2c(c1)CNCC2)C(=O)N[C@@H](CC(=O)O)c1cnc2ccccc2c1

BIRTHDAY: 2018-11-19T08:16:23.506668
ATC: N04A
- NERVOUS SYSTEM
- ANTI-PARKINSON DRUGS
- ANTICHOLINERGIC AGENTS
Synthesis plan pending
FORMULA:C24H36N4O6

SMILES: CC(C)[C@H](NC(=O)[C@@H](CC(=O)O)NC(=O)CCCCCCc1ccc2c(n1)NCCC2)C(=O)O

BIRTHDAY: 2018-11-19T08:16:23.517306
ATC: C08C
- CARDIOVASCULAR SYSTEM
- CALCIUM CHANNEL BLOCKERS
- SELECTIVE CALCIUM CHANNEL BLOCKERS WITH MAINLY VASCULAR EFFECTS
Synthesis plan pending
FORMULA:C17H17N3O3

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

BIRTHDAY: 2018-11-19T08:16:23.525827
ATC: A07B
- ALIMENTARY TRACT AND METABOLISM
- ANTIDIARRHEALS, INTESTINAL ANTIINFLAMMATORY/ANTIINFECTIVE AGENTS
- INTESTINAL ADSORBENTS
Synthesis plan pending
FORMULA:C16H18N4O6

SMILES: N=C(N)c1ccccc1[C@@]1(CC(=O)N[C@@H](CC(=O)O)C(=O)O)C=NOC1

BIRTHDAY: 2018-11-19T08:16:23.535622
ATC: A07E
- ALIMENTARY TRACT AND METABOLISM
- ANTIDIARRHEALS, INTESTINAL ANTIINFLAMMATORY/ANTIINFECTIVE AGENTS
- INTESTINAL ANTIINFLAMMATORY AGENTS
Synthesis plan pending
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: 2018-11-19T08:16:23.545575
ATC: J05A
- ANTIINFECTIVES FOR SYSTEMIC USE
- ANTIVIRALS FOR SYSTEMIC USE
- DIRECT ACTING ANTIVIRALS
Synthesis plan pending
FORMULA:C25H28N4O3

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

BIRTHDAY: 2018-11-19T08:16:23.573999
ATC: L03A
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- IMMUNOSTIMULANTS
- IMMUNOSTIMULANTS
Synthesis plan pending
FORMULA:C27H30N6O4

SMILES: CC(C)[C@H](NC(=O)c1ccc2cc1CNCC=CCOCc1cncc(c1)-c1ccnc(n1)N2)C(=O)O

BIRTHDAY: 2018-11-19T08:16:23.585567
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis plan pending
FORMULA:C17H16FN3O3

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

BIRTHDAY: 2018-11-19T08:16:23.594896
ATC: A10B
- ALIMENTARY TRACT AND METABOLISM
- DRUGS USED IN DIABETES
- BLOOD GLUCOSE LOWERING DRUGS, EXCL. INSULINS
Synthesis plan pending
FORMULA:C37H46N6O3

SMILES: CC(C)[C@H](NC(=O)c1cc2nc(n1)Nc1cccc(c1)NCC=CCCOc1cccc-2c1)C(=O)N[C@]12C[C@H](C)[C@H](C1)C(C)(C)C2

BIRTHDAY: 2018-11-19T08:16:23.608059
ATC: A10B
- ALIMENTARY TRACT AND METABOLISM
- DRUGS USED IN DIABETES
- BLOOD GLUCOSE LOWERING DRUGS, EXCL. INSULINS
Synthesis plan pending
FORMULA:C16H27N3O6S

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

BIRTHDAY: 2018-11-30T17:23:52.760018
ATC: R06A
- RESPIRATORY SYSTEM
- ANTIHISTAMINES FOR SYSTEMIC USE
- ANTIHISTAMINES FOR SYSTEMIC USE
Synthesis Plan
FORMULA:C25H32N6O5

SMILES: C[C@@H](C(=O)O)[C@H](NC(=O)C(C)(C)c1ccnc2c1NCCC2)c1ccncc1CC(C(N)=O)C(N)=O

BIRTHDAY: 2018-11-30T17:23:52.771326
ATC: L01C
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- PLANT ALKALOIDS AND OTHER NATURAL PRODUCTS
Synthesis Plan
FORMULA:C18H24N4O4

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

BIRTHDAY: 2018-11-30T17:23:52.780341
ATC: N06B
- NERVOUS SYSTEM
- PSYCHOANALEPTICS
- PSYCHOSTIMULANTS, AGENTS USED FOR ADHD AND NOOTROPICS
Synthesis Plan
FORMULA:C14H26N2O3

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

BIRTHDAY: 2018-11-30T17:23:52.817256
ATC: R03D
- RESPIRATORY SYSTEM
- DRUGS FOR OBSTRUCTIVE AIRWAY DISEASES
- OTHER SYSTEMIC DRUGS FOR OBSTRUCTIVE AIRWAY DISEASES
Synthesis Plan
FORMULA:C17H22N4O4

SMILES: N=C(N)c1ccc(C(=O)N[C@@H](C[C@]2(O)NCC3CC2C3)C(=O)O)cc1

BIRTHDAY: 2018-11-30T17:23:52.835703
ATC: G03A
- GENITO URINARY SYSTEM AND SEX HORMONES
- SEX HORMONES AND MODULATORS OF THE GENITAL SYSTEM
- HORMONAL CONTRACEPTIVES FOR SYSTEMIC USE
Synthesis Plan
FORMULA:C14H16N4O4

SMILES: N=C(N)c1ccccc1[C@]1(CC(=O)NCC(=O)O)C=NOC1

BIRTHDAY: 2018-11-30T17:23:52.863351
ATC: N02B
- NERVOUS SYSTEM
- ANALGESICS
- OTHER ANALGESICS AND ANTIPYRETICS
Synthesis Plan
FORMULA:C20H32N6O7

SMILES: CC(C)[C@H](NC(=O)[C@H](C[C@H]1CCCNC=C(C(=N)N)NC1=O)NC(=O)CCC(=O)O)C(=O)O

BIRTHDAY: 2018-11-30T17:23:52.874768
ATC: V09H
- VARIOUS
- DIAGNOSTIC RADIOPHARMACEUTICALS
- INFLAMMATION AND INFECTION DETECTION
Synthesis Plan
FORMULA:C26H31N3O2

SMILES: CC(C)[C@]1(c2ccccc2)[C@@H]2CC[C@H]3C[C@@]1(NC(=O)c1ccccc1C(N)=O)CCN32

BIRTHDAY: 2018-12-02T16:07:00.666683
ATC: C01B
- CARDIOVASCULAR SYSTEM
- CARDIAC THERAPY
- ANTIARRHYTHMICS, CLASS I AND III
Synthesis Plan
FORMULA:C24H30N6O5

SMILES: CC(C)(C(=O)N[C@H](CC(=O)O)c1ccncc1CC(C(N)=O)C(N)=O)c1ccnc2c1NCCC2

BIRTHDAY: 2018-12-02T16:07:00.688153
ATC: L01C
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- PLANT ALKALOIDS AND OTHER NATURAL PRODUCTS
Synthesis Plan
FORMULA:C24H26N4O3

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

BIRTHDAY: 2018-12-02T16:07:00.717613
ATC: H04A
- SYSTEMIC HORMONAL PREPARATIONS, EXCL. SEX HORMONES AND INSULINS
- PANCREATIC HORMONES
- GLYCOGENOLYTIC HORMONES
Synthesis Plan
FORMULA:C14H26N2O3

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

BIRTHDAY: 2018-12-02T16:07:00.724885
ATC: N07A
- NERVOUS SYSTEM
- OTHER NERVOUS SYSTEM DRUGS
- PARASYMPATHOMIMETICS
Synthesis Plan
FORMULA:C16H18N4O6

SMILES: N=C(N)c1ccccc1[C@]1(CC(=O)N[C@H](CC(=O)O)C(=O)O)C=NOC1

BIRTHDAY: 2018-12-02T16:07:00.745261
ATC: A07E
- ALIMENTARY TRACT AND METABOLISM
- ANTIDIARRHEALS, INTESTINAL ANTIINFLAMMATORY/ANTIINFECTIVE AGENTS
- INTESTINAL ANTIINFLAMMATORY AGENTS
Synthesis Plan
FORMULA:C28H25N5O2

SMILES: CN1CCc2nccn2Cc2ccc(C#N)c(c2)Oc2ccc3cccc(c3c2)N2CC[C@@H]1C2=O

BIRTHDAY: 2018-12-02T16:07:00.756209
ATC: J01F
- ANTIINFECTIVES FOR SYSTEMIC USE
- ANTIBACTERIALS FOR SYSTEMIC USE
- MACROLIDES, LINCOSAMIDES AND STREPTOGRAMINS
Synthesis Plan
FORMULA:C25H36N6O4

SMILES: N=C(N)c1ccc(C(=O)N[C@H](CC(=O)O)CC(=O)N2CCC(C3=CNCCCCCN3)CC2)cc1

BIRTHDAY: 2018-12-02T16:07:00.767387
ATC: A10B
- ALIMENTARY TRACT AND METABOLISM
- DRUGS USED IN DIABETES
- BLOOD GLUCOSE LOWERING DRUGS, EXCL. INSULINS
Synthesis Plan
FORMULA:C20H26N4O6

SMILES: N=C(N)c1ccc(C(=O)N[C@@H](CC(=O)O)CC(=O)N2CCC[C@@H](CC(=O)O)C2)cc1

BIRTHDAY: 2018-12-02T16:07:00.777918
ATC: A08A
- ALIMENTARY TRACT AND METABOLISM
- ANTIOBESITY PREPARATIONS, EXCL. DIET PRODUCTS
- ANTIOBESITY PREPARATIONS, EXCL. DIET PRODUCTS
Synthesis Plan
FORMULA:C16H18N4O6

SMILES: N=C(N)c1ccc(C2=NO[C@@H](CC(=O)N[C@@H](CC(=O)O)C(=O)O)C2)cc1

BIRTHDAY: 2018-12-02T16:07:00.795974
ATC: M01A
- MUSCULO-SKELETAL SYSTEM
- ANTIINFLAMMATORY AND ANTIRHEUMATIC PRODUCTS
- ANTIINFLAMMATORY AND ANTIRHEUMATIC PRODUCTS, NON-STEROIDS
Synthesis Plan
FORMULA:C31H36N8O8

SMILES: COC(=O)C[C@@H](NC(=O)[C@H](C)[C@@H]1COc2cccc(c2)Nc2nccc(n2)NCc2cccc(c2)O1)C(=O)N[C@@H](CC(N)=O)C(N)=O

BIRTHDAY: 2018-12-03T10:43:22.688507
ATC: C02D
- CARDIOVASCULAR SYSTEM
- ANTIHYPERTENSIVES
- ARTERIOLAR SMOOTH MUSCLE, AGENTS ACTING ON
Synthesis Plan
FORMULA:C16H18N4O6

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

BIRTHDAY: 2018-12-03T10:43:22.699014
ATC: M03A
- MUSCULO-SKELETAL SYSTEM
- MUSCLE RELAXANTS
- MUSCLE RELAXANTS, PERIPHERALLY ACTING AGENTS
Synthesis Plan
FORMULA:C24H31N5O4

SMILES: C[C@H](Cc1ccc([C@@H](CC(=O)O)NC(=O)CCCc2ccc3c(n2)NCCC3)cn1)C(N)=O

BIRTHDAY: 2018-12-03T10:43:22.739169
ATC: J05A
- ANTIINFECTIVES FOR SYSTEMIC USE
- ANTIVIRALS FOR SYSTEMIC USE
- DIRECT ACTING ANTIVIRALS
Synthesis Plan
FORMULA:C19H26N4O6

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

BIRTHDAY: 2018-12-03T10:43:22.749260
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)CCCCN1

BIRTHDAY: 2018-12-03T10:43:22.756243
ATC: R03D
- RESPIRATORY SYSTEM
- DRUGS FOR OBSTRUCTIVE AIRWAY DISEASES
- OTHER SYSTEMIC DRUGS FOR OBSTRUCTIVE AIRWAY DISEASES
Synthesis Plan
FORMULA:C29H25N5O5S

SMILES: N=C(N)c1ccccc1C(=O)Nc1c2cccc1-c1ncnc(c1CC(=O)O)Sc1cccc(c1)OCCCO2

BIRTHDAY: 2018-12-03T10:43:22.798106
ATC: B01A
- BLOOD AND BLOOD FORMING ORGANS
- ANTITHROMBOTIC AGENTS
- ANTITHROMBOTIC AGENTS
Synthesis Plan
FORMULA:C22H26FN3O3

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

BIRTHDAY: 2018-12-03T10:43:22.807547
ATC: D01A
- DERMATOLOGICALS
- ANTIFUNGALS FOR DERMATOLOGICAL USE
- ANTIFUNGALS FOR TOPICAL USE
Synthesis Plan
FORMULA:C17H23N3O6

SMILES: N=C(N)c1ccc(C(=O)N[C@@H](CC2(O)CCOCOCC2)C(=O)O)cc1

BIRTHDAY: 2018-12-03T10:43:22.826528
ATC: N06A
- NERVOUS SYSTEM
- PSYCHOANALEPTICS
- ANTIDEPRESSANTS
Synthesis Plan
FORMULA:C18H23N5O4

SMILES: CC(C)(C(=O)N[C@H](CC(=O)O)C(=O)NCCc1ccncc1)C1=NC=NC1

BIRTHDAY: 2018-12-03T19:11:47.452024
ATC: M01C
- MUSCULO-SKELETAL SYSTEM
- ANTIINFLAMMATORY AND ANTIRHEUMATIC PRODUCTS
- SPECIFIC ANTIRHEUMATIC AGENTS
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: 2018-12-03T19:11:47.481369
ATC: L01C
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- PLANT ALKALOIDS AND OTHER NATURAL PRODUCTS
Synthesis Plan
FORMULA:C18H28N8O8

SMILES: N=C(N)C(=O)NCCCC[C@@H](NC(=O)C1=NO[C@@H](CCC(N)=O)C1)C(=O)N[C@@H](C(N)=O)C(=O)O

BIRTHDAY: 2018-12-03T19:11:47.493683
ATC: J04A
- ANTIINFECTIVES FOR SYSTEMIC USE
- ANTIMYCOBACTERIALS
- DRUGS FOR TREATMENT OF TUBERCULOSIS
Synthesis Plan
FORMULA:C13H20N4O8

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

BIRTHDAY: 2018-12-03T19:11:47.512925
ATC: M01C
- MUSCULO-SKELETAL SYSTEM
- ANTIINFLAMMATORY AND ANTIRHEUMATIC PRODUCTS
- SPECIFIC ANTIRHEUMATIC AGENTS
Synthesis Plan
FORMULA:C16H23N3O4

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

BIRTHDAY: 2018-12-03T19:11:47.542669
ATC: A10B
- ALIMENTARY TRACT AND METABOLISM
- DRUGS USED IN DIABETES
- BLOOD GLUCOSE LOWERING DRUGS, EXCL. INSULINS
Synthesis Plan
FORMULA:C28H36N4O4

SMILES: O=C(O)C[C@H](NC(=O)[C@@H]1CCCN(C(=O)CCC2CCNCC2)C1)c1ccc(-c2ccccc2)nc1

BIRTHDAY: 2018-12-03T19:11:47.553249
ATC: A10B
- ALIMENTARY TRACT AND METABOLISM
- DRUGS USED IN DIABETES
- BLOOD GLUCOSE LOWERING DRUGS, EXCL. INSULINS
Synthesis Plan
FORMULA:C17H21N3O4

SMILES: O=C(O)CCC(=O)NCC[C@@H]1N[C@@H]2CCN(C1=O)c1ccccc12

BIRTHDAY: 2018-12-03T19:11:47.561856
ATC: N06A
- NERVOUS SYSTEM
- PSYCHOANALEPTICS
- ANTIDEPRESSANTS
Synthesis Plan
FORMULA:C17H25N3O4

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

BIRTHDAY: 2018-12-03T19:11:47.581277
ATC: N06B
- NERVOUS SYSTEM
- PSYCHOANALEPTICS
- PSYCHOSTIMULANTS, AGENTS USED FOR ADHD AND NOOTROPICS
Synthesis Plan
FORMULA:C23H37N7O7

SMILES: CC[C@H](NC(=O)[C@H](CCCCNC(=O)C(=N)N)NC(=O)C1=NO[C@H](C[C@H]2C[C@@H]3C[C@@H](CN3)O2)C1)C(=O)O

BIRTHDAY: 2018-12-03T19:11:47.593854
ATC: V08A
- VARIOUS
- CONTRAST MEDIA
- X-RAY CONTRAST MEDIA, IODINATED
Synthesis Plan
FORMULA:C14H19N3O4

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

BIRTHDAY: 2018-12-01T22:30:53.495917
ATC: B03B
- BLOOD AND BLOOD FORMING ORGANS
- ANTIANEMIC PREPARATIONS
- VITAMIN B12 AND FOLIC ACID
Synthesis Plan
FORMULA:C13H17N3O3S2

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

BIRTHDAY: 2018-12-01T22:30:53.504493
ATC: J05A
- ANTIINFECTIVES FOR SYSTEMIC USE
- ANTIVIRALS FOR SYSTEMIC USE
- DIRECT ACTING ANTIVIRALS
Synthesis Plan
FORMULA:C18H30N4O7

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

BIRTHDAY: 2018-12-01T22:30:53.514939
ATC: G02A
- GENITO URINARY SYSTEM AND SEX HORMONES
- OTHER GYNECOLOGICALS
- UTEROTONICS
Synthesis Plan
FORMULA:C16H18N4O6

SMILES: N=C(N)c1ccccc1[C@@H]1CON=C1CC(=O)N[C@@H](CC(=O)O)C(=O)O

BIRTHDAY: 2018-12-01T22:30:53.565269
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)CCc1cccc(C(=N)N)c1)C(=O)O

BIRTHDAY: 2018-12-01T22:30:53.575127
ATC: J05A
- ANTIINFECTIVES FOR SYSTEMIC USE
- ANTIVIRALS FOR SYSTEMIC USE
- DIRECT ACTING ANTIVIRALS
Synthesis Plan
FORMULA:C24H27N5O4

SMILES: CC(C)[C@@H](NC(=O)[C@@H](CC(=O)O)NC(=O)c1cc2cc(C(=N)N)ccc2[nH]1)c1ccccc1

BIRTHDAY: 2018-12-01T22:30:53.594557
ATC: A10B
- ALIMENTARY TRACT AND METABOLISM
- DRUGS USED IN DIABETES
- BLOOD GLUCOSE LOWERING DRUGS, EXCL. INSULINS
Synthesis Plan
FORMULA:C25H47N5O3S

SMILES: CC(=S)NCCCC[C@H](N[C@@H]1C=CCCCNCCNCCCC1)C(=O)N[C@@H](C(=O)O)C(C)C

BIRTHDAY: 2018-12-01T22:30:53.604583
ATC: C10A
- CARDIOVASCULAR SYSTEM
- LIPID MODIFYING AGENTS
- LIPID MODIFYING AGENTS, PLAIN
Synthesis Plan
FORMULA:C16H23N3O4

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

BIRTHDAY: 2018-12-01T22:30:53.612690
ATC: B05X
- BLOOD AND BLOOD FORMING ORGANS
- BLOOD SUBSTITUTES AND PERFUSION SOLUTIONS
- I.V. SOLUTION ADDITIVES
Synthesis Plan