matter.farm

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

These compounds may interact with:

Receptor tyrosine-protein kinase erbB-3

Potentially involved in: kidney cancer; carcinoma; type 1 diabetes mellitus; alopecia areata; cancer; arthrogryposis; bipolar disorder; mental depression; edema; gallbladder neoplasm; polyhydramnios; hydronephrosis; lung neoplasms; micrognathism; prostatic neoplasms; schizophrenia; unipolar depression; akinesia; muscle degeneration; reduced fetal movement

Disease data sourced from Pharos.

Inhibitor

FORMULA:C21H24ClFN4O3

SMILES: C[C@@H](OC1=C2N=C(Nc3cc(F)ccc3Cl)N=C[C@H]2C(O)(O)C=C1)N1CCCCC1

BIRTHDAY: 2018-12-01T14:11:26.001075
ATC: C02K
- CARDIOVASCULAR SYSTEM
- ANTIHYPERTENSIVES
- OTHER ANTIHYPERTENSIVES
Synthesis Plan
FORMULA:C23H31N3O2

SMILES: CN(C)Cc1c(NC(=O)c2ccccc2C(C)(C)C)cccc1C(=O)N(C)C

BIRTHDAY: 2018-12-01T14:11:26.009417
ATC: C02K
- CARDIOVASCULAR SYSTEM
- ANTIHYPERTENSIVES
- OTHER ANTIHYPERTENSIVES
Synthesis Plan
FORMULA:C24H20F3N3O3

SMILES: CN(C)C(=O)c1ccc(NC(=O)c2ccccc2C(=O)Nc2ccccc2C(F)(F)F)cc1

BIRTHDAY: 2018-12-01T14:11:26.020151
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C27H28ClN3O3

SMILES: CN(C)C(=O)c1c(NC(=O)c2ccccc2C(C)(C)C)cccc1C(=O)Nc1ccccc1Cl

BIRTHDAY: 2018-12-01T14:11:26.029943
ATC: C02K
- CARDIOVASCULAR SYSTEM
- ANTIHYPERTENSIVES
- OTHER ANTIHYPERTENSIVES
Synthesis Plan
FORMULA:C20H22N4O3

SMILES: COc1cc2ncnc(Nc3cccc(CN(C)C)c3)c2c2c1OCCO2

BIRTHDAY: 2018-12-01T14:11:26.050115
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C19H25Cl2N7

SMILES: CC(C)n1cnc2nc(Nc3c(Cl)cccc3Cl)nc(NC(C)(C)N(C)C)c21

BIRTHDAY: 2018-12-01T14:11:26.060058
ATC: N06A
- NERVOUS SYSTEM
- PSYCHOANALEPTICS
- ANTIDEPRESSANTS
Synthesis Plan
FORMULA:C17H13Cl2N3O3

SMILES: COc1cc2ncnc(Nc3ccc(Cl)c(Cl)c3)c2c2c1OCCO2

BIRTHDAY: 2018-12-01T14:11:26.069066
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C31H32F2N4O4

SMILES: CC1(OC2=CC(O)(O)[C@@H]3N=C(Nc4cc(F)cc(Oc5ccccc5F)c4)N=CC3=C2)[C@H]2CC3CNC(C2)C[C@H]1C3

BIRTHDAY: 2018-12-01T14:11:26.081664
ATC: M01A
- MUSCULO-SKELETAL SYSTEM
- ANTIINFLAMMATORY AND ANTIRHEUMATIC PRODUCTS
- ANTIINFLAMMATORY AND ANTIRHEUMATIC PRODUCTS, NON-STEROIDS
Synthesis Plan
FORMULA:C21H31N7O

SMILES: CC(C)[C@@H](Nc1nc(NCc2ccncc2)c2c(ncn2C(C)C)n1)C(C)(C)O

BIRTHDAY: 2018-12-01T14:11:26.091265
ATC: C03C
- CARDIOVASCULAR SYSTEM
- DIURETICS
- HIGH-CEILING DIURETICS
Synthesis Plan
FORMULA:C21H31N7O

SMILES: CC(C)[C@@H](Nc1nc(NCc2cccnc2)c2ncn(C(C)C)c2n1)C(C)(C)O

BIRTHDAY: 2018-12-01T14:11:26.101013
ATC: N06A
- NERVOUS SYSTEM
- PSYCHOANALEPTICS
- ANTIDEPRESSANTS
Synthesis Plan
FORMULA:C19H22N4O4

SMILES: CN(C)Cc1cccc(Nc2ncnc3c2C=C2OCCO[C@H]2C3(O)O)c1

BIRTHDAY: 2018-12-01T14:11:26.110410
ATC: L04A
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- IMMUNOSUPPRESSANTS
- IMMUNOSUPPRESSANTS
Synthesis Plan
FORMULA:C22H26F3N7O

SMILES: CC(C)NC(=O)[C@@H](Nc1cnc(C(F)(F)F)nc1Nc1cccc(-c2ccn[nH]2)c1)C(C)C

BIRTHDAY: 2018-12-01T14:11:26.121402
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C23H35N7O

SMILES: CC(C)[C@@H](Nc1nc(NCc2ccncc2)c2c(ncn2C(C)C)n1)[C@H](O)C(C)(C)C

BIRTHDAY: 2018-12-01T14:11:26.131228
ATC: C08D
- CARDIOVASCULAR SYSTEM
- CALCIUM CHANNEL BLOCKERS
- SELECTIVE CALCIUM CHANNEL BLOCKERS WITH DIRECT CARDIAC EFFECTS
Synthesis Plan
FORMULA:C17H24N8OS

SMILES: Cc1nscc1Nc1ncnc(-c2[nH]ncc2N)c1N[C@@H](C(C)C)[C@H](C)O

BIRTHDAY: 2018-12-01T14:11:26.142383
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C22H24N8O2

SMILES: CC(C)[C@H](Nc1nc(Nc2ccc(-c3cn[nH]c3)cc2)ncc1-c1ccn(C)n1)C(=O)O

BIRTHDAY: 2018-12-01T14:11:26.153123
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C20H17F4N5O

SMILES: CNc1nc(Nc2ccc(CNC(=O)c3ccccc3F)cc2)ncc1C(F)(F)F

BIRTHDAY: 2018-12-01T14:11:26.163239
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C22H29N7O

SMILES: CC(C)[C@H](Nc1nc(Nc2ccc(C#N)cc2)c2ncn(C(C)C)c2n1)C(C)(C)O

BIRTHDAY: 2018-12-01T14:11:26.172956
ATC: J01M
- ANTIINFECTIVES FOR SYSTEMIC USE
- ANTIBACTERIALS FOR SYSTEMIC USE
- QUINOLONE ANTIBACTERIALS
Synthesis Plan
FORMULA:C27H24F2N6O2

SMILES: CN(C)C(=O)c1ccccc1NC(=O)c1ccccc1CNc1cncnc1Nc1cc(F)ccc1F

BIRTHDAY: 2018-12-01T14:11:26.184534
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C22H26F3N7O

SMILES: CC(C)NC(=O)[C@@H](Nc1cnc(Nc2cccc(-c3ccn[nH]3)c2)nc1C(F)(F)F)C(C)C

BIRTHDAY: 2018-12-25T02:03:29.079381
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C24H24N8O2

SMILES: CN(C)C(=O)c1ccccc1NC(=O)c1ccccc1CNc1cncnc1-c1nc(N)c[nH]1

BIRTHDAY: 2018-12-25T02:03:29.090841
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C19H22N4O4

SMILES: CN(C)Cc1cccc(Nc2ncnc3c2C2=C(CC3(O)O)OCCO2)c1

BIRTHDAY: 2018-12-25T02:03:29.100322
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C22H24ClFN4O2

SMILES: COc1cc2c(Nc3cccc(Cl)c3F)ncnc2cc1OCCN1CCCCC1

BIRTHDAY: 2018-12-25T02:03:29.110064
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C26H24N6O2

SMILES: CN(C)C(=O)c1ccc(NC(=O)c2ccccc2CNc2cncnc2-c2cccnc2)cc1

BIRTHDAY: 2018-12-25T02:03:29.121054
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C23H35N7O

SMILES: CC(C)[C@H](Nc1nc(NCc2cccnc2)c2ncn(C(C)C)c2n1)[C@@H](O)C(C)(C)C

BIRTHDAY: 2018-12-25T02:03:29.131362
ATC: A10B
- ALIMENTARY TRACT AND METABOLISM
- DRUGS USED IN DIABETES
- BLOOD GLUCOSE LOWERING DRUGS, EXCL. INSULINS
Synthesis Plan
FORMULA:C22H33N7O

SMILES: CC(C)n1cnc2nc(NCc3ccncc3)nc(N[C@@H](C(C)(C)C)C(C)(C)O)c21

BIRTHDAY: 2018-12-25T02:03:29.141639
ATC: C03C
- CARDIOVASCULAR SYSTEM
- DIURETICS
- HIGH-CEILING DIURETICS
Synthesis Plan
FORMULA:C20H22N4O3

SMILES: CO[C@@]12C=CC=C3C=NC(Nc4ccccc4CN(C)C)=N[C@@]31OC=CO2

BIRTHDAY: 2018-12-25T02:03:29.151170
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C19H22N4O4

SMILES: CN(C)Cc1ccccc1Nc1ncc2c(n1)C(O)(O)[C@H]1OCCOC1=C2

BIRTHDAY: 2018-12-25T02:03:29.160789
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C31H35N5O2

SMILES: COc1cccc2c(N3C[C@@H](CN[C@@](C)(c4ccccc4)C(C)(C)C)C(=O)Nc4ccccc43)ncnc12

BIRTHDAY: 2018-12-25T02:03:29.172258
ATC: V09C
- VARIOUS
- DIAGNOSTIC RADIOPHARMACEUTICALS
- RENAL SYSTEM
Synthesis Plan
FORMULA:C20H22N4O3

SMILES: COc1cc2ncnc(Nc3ccc(CN(C)C)cc3)c2c2c1OCCO2

BIRTHDAY: 2018-12-25T02:03:29.181307
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C19H22N4O4

SMILES: CN(C)Cc1ccccc1Nc1ncnc2c1C1=C(OCCO1)C(O)(O)C2

BIRTHDAY: 2018-12-25T02:03:29.191204
ATC: N05A
- NERVOUS SYSTEM
- PSYCHOLEPTICS
- ANTIPSYCHOTICS
Synthesis Plan
FORMULA:C27H26N8O2

SMILES: CN(C)C(=O)c1ccccc1NC(=O)c1ccccc1CNc1cncnc1-c1nc2c([nH]1)CNC=C2

BIRTHDAY: 2018-12-25T02:03:29.213099
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C21H24ClFN4O3

SMILES: OC1(O)C=C(OCCN2CCCCC2)c2ncnc(Nc3ccc(F)c(Cl)c3)c2C1

BIRTHDAY: 2018-12-25T02:03:29.223173
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C21H24ClFN4O3

SMILES: OC1(O)Cc2ncnc(Nc3cccc(Cl)c3F)c2C=C1OCCN1CCCCC1

BIRTHDAY: 2018-12-25T02:03:29.233699
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C16H13Cl2N3O4

SMILES: OC1(O)Cc2ncnc(Nc3ccc(Cl)c(Cl)c3)c2C2=C1OCCO2

BIRTHDAY: 2018-12-03T02:39:34.367770
ATC: N05A
- NERVOUS SYSTEM
- PSYCHOLEPTICS
- ANTIPSYCHOTICS
Synthesis Plan
FORMULA:C16H15FN2O5

SMILES: O=C1N=COC2=c3cccc(F)c3=CC(O)(O)[C@]12N1CCOCC1

BIRTHDAY: 2018-12-03T02:39:34.388116
ATC: J05A
- ANTIINFECTIVES FOR SYSTEMIC USE
- ANTIVIRALS FOR SYSTEMIC USE
- DIRECT ACTING ANTIVIRALS
Synthesis Plan
FORMULA:C16H13Cl2N3O4

SMILES: OC1(O)c2ncnc(Nc3ccc(Cl)c(Cl)c3)c2C=C2OCCO[C@H]21

BIRTHDAY: 2018-12-03T02:39:34.397669
ATC: C02A
- CARDIOVASCULAR SYSTEM
- ANTIHYPERTENSIVES
- ANTIADRENERGIC AGENTS, CENTRALLY ACTING
Synthesis Plan
FORMULA:C19H22BF3N6

SMILES: BC[C@@H](Nc1c(Nc2ccc(-c3ccn[nH]3)cc2)ncnc1C(F)(F)F)C(C)C

BIRTHDAY: 2018-12-03T02:39:34.408023
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C21H13FN8O

SMILES: N#Cc1nc(Nc2ncccn2)cnc1C(=O)Nc1cc(-c2ccccc2F)ccn1

BIRTHDAY: 2018-12-03T02:39:34.427598
ATC: L02B
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ENDOCRINE THERAPY
- HORMONE ANTAGONISTS AND RELATED AGENTS
Synthesis Plan
FORMULA:C22H26F3N7O

SMILES: CC(C)NC(=O)[C@H](Nc1nc(Nc2ccc(-c3cn[nH]c3)cc2)ncc1C(F)(F)F)C(C)C

BIRTHDAY: 2018-12-03T02:39:34.438659
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C18H25N7OS

SMILES: Cc1cc(Nc2ncc(-c3cnn(C)c3)c(N[C@@H](C(C)C)[C@H](C)O)n2)sn1

BIRTHDAY: 2018-12-03T02:39:34.448302
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C22H26ClFN4O2

SMILES: CO[C@]1(O[C@H](C)N2CCCCC2)C=CC=C2C=NC=N[C@@]21Nc1cc(F)ccc1Cl

BIRTHDAY: 2018-12-03T02:39:34.459017
ATC: J01X
- ANTIINFECTIVES FOR SYSTEMIC USE
- ANTIBACTERIALS FOR SYSTEMIC USE
- OTHER ANTIBACTERIALS
Synthesis Plan
FORMULA:C22H29N7O

SMILES: CC(C)[C@H](Nc1nc(Nc2ccccc2C#N)c2c(ncn2C(C)C)n1)C(C)(C)O

BIRTHDAY: 2018-12-03T02:39:34.468827
ATC: N05A
- NERVOUS SYSTEM
- PSYCHOLEPTICS
- ANTIPSYCHOTICS
Synthesis Plan
FORMULA:C21H23N9O2

SMILES: CC(C)[C@H](Nc1c(Nc2ccccc2-c2ccn[nH]2)ncnc1-c1cn[nH]c1N)C(=O)O

BIRTHDAY: 2018-12-03T02:39:34.482353
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C22H29N7

SMILES: CC(C)C(Nc1nc(Nc2ccccc2C#N)nc2ncn(C(C)C)c12)C(C)C

BIRTHDAY: 2018-12-03T02:39:34.500705
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C29H21FN4O

SMILES: O=C(Nc1ccc(-c2cccnc2)cc1)c1ccccc1Nc1cccc(-c2ccccc2F)n1

BIRTHDAY: 2018-12-03T02:39:34.510876
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C10H11N5OS

SMILES: CN1CSC(c2nc(C3CC3)no2)=C(C#N)N1

BIRTHDAY: 2018-12-03T02:39:34.518678
ATC: C01B
- CARDIOVASCULAR SYSTEM
- CARDIAC THERAPY
- ANTIARRHYTHMICS, CLASS I AND III
Synthesis Plan
FORMULA:C23H35N7O

SMILES: CC(C)[C@@H](Nc1nc(NCc2cccnc2)c2ncn(C(C)C)c2n1)[C@H](O)C(C)(C)C

BIRTHDAY: 2018-12-03T02:39:34.528701
ATC: A10B
- ALIMENTARY TRACT AND METABOLISM
- DRUGS USED IN DIABETES
- BLOOD GLUCOSE LOWERING DRUGS, EXCL. INSULINS
Synthesis Plan
FORMULA:C22H24N8O2

SMILES: CC(C)[C@@H](Nc1nc(Nc2ccc(-c3cn[nH]c3)cc2)ncc1-c1ccn(C)n1)C(=O)O

BIRTHDAY: 2018-12-03T02:39:34.539484
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C22H25N7O3

SMILES: C[C@H](O[C@@H]1C=Cc2cnc(Nc3ccc4nncnc4c3)nc2C1(O)O)N1CCCCC1

BIRTHDAY: 2018-11-30T03:41:30.343720
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis plan pending
FORMULA:C20H21ClFN5O3

SMILES: CN(C)C/C=C\C(=O)NC1=Cc2c(ncnc2Nc2ccc(F)c(Cl)c2)CC1(O)O

BIRTHDAY: 2018-11-30T03:41:30.363488
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis plan pending
FORMULA:C23H35N7O

SMILES: CC(C)[C@H](Nc1nc(NCc2ccncc2)nc2ncn(C(C)C)c12)[C@@H](O)C(C)(C)C

BIRTHDAY: 2018-11-30T03:41:30.373341
ATC: C03C
- CARDIOVASCULAR SYSTEM
- DIURETICS
- HIGH-CEILING DIURETICS
Synthesis plan pending
FORMULA:C32H37F3N8O

SMILES: CC(C)C(Nc1c(N[C@@H]2Cc3cccc(c3)OCCc3cccc(c3)Nc3nccc(n3)N2)ncnc1C(F)(F)F)C(C)C

BIRTHDAY: 2018-11-30T03:41:30.399938
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis plan pending
FORMULA:C30H39FN6O

SMILES: CN(C)C(C)(C)C(=O)Nc1ccccc1Nc1cnc(Nc2ccc3c(c2)CCCCCCCC3)nc1F

BIRTHDAY: 2018-11-30T03:41:30.410494
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis plan pending
FORMULA:C17H13Cl2N3O3

SMILES: CO[C@@]12C=CC=C3C=NC(Nc4c(Cl)cccc4Cl)=N[C@@]31OC=CO2

BIRTHDAY: 2018-11-30T03:41:30.419780
ATC: N02C
- NERVOUS SYSTEM
- ANALGESICS
- ANTIMIGRAINE PREPARATIONS
Synthesis plan pending
FORMULA:C19H22N4O4

SMILES: CN(C)Cc1cccc(Nc2ncnc3c2C=C2OCCO[C@@H]2C3(O)O)c1

BIRTHDAY: 2018-11-30T03:41:30.429018
ATC: L04A
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- IMMUNOSUPPRESSANTS
- IMMUNOSUPPRESSANTS
Synthesis plan pending
FORMULA:C27H41N9

SMILES: CC(C)N1[C@@H]2CCC[C@@H](NC2)[C@@]1(Nc1nc(NCc2ccncc2)nc2ncn(C(C)C)c12)C(C)C

BIRTHDAY: 2018-11-30T03:41:30.440337
ATC: C03C
- CARDIOVASCULAR SYSTEM
- DIURETICS
- HIGH-CEILING DIURETICS
Synthesis plan pending
FORMULA:C21H31N7

SMILES: CC(C)C(Nc1nc(NCc2ccncc2)c2c(ncn2C(C)C)n1)C(C)C

BIRTHDAY: 2018-11-30T03:41:30.449325
ATC: C08D
- CARDIOVASCULAR SYSTEM
- CALCIUM CHANNEL BLOCKERS
- SELECTIVE CALCIUM CHANNEL BLOCKERS WITH DIRECT CARDIAC EFFECTS
Synthesis plan pending
FORMULA:C23H33N9O

SMILES: CC(C)[C@@H](C)Nc1nc(NCc2ccncc2)c2c(ncn2[C@]23NCCN[C@H](C[C@@H]2C)O3)n1

BIRTHDAY: 2018-11-30T03:41:30.460429
ATC: D06B
- DERMATOLOGICALS
- ANTIBIOTICS AND CHEMOTHERAPEUTICS FOR DERMATOLOGICAL USE
- CHEMOTHERAPEUTICS FOR TOPICAL USE
Synthesis plan pending
FORMULA:C25H25N7O2

SMILES: CN(C)C(=O)c1ccc(NC(=O)c2ccc(CNc3nccc(-c4cncn4C)n3)cc2)cc1

BIRTHDAY: 2018-11-30T03:41:30.470696
ATC: C10A
- CARDIOVASCULAR SYSTEM
- LIPID MODIFYING AGENTS
- LIPID MODIFYING AGENTS, PLAIN
Synthesis plan pending
FORMULA:C27H28ClN3O3

SMILES: CN(C)C(=O)c1cc(NC(=O)c2ccc(C(C)(C)C)cc2)cc(C(=O)Nc2ccc(Cl)cc2)c1

BIRTHDAY: 2018-11-30T03:41:30.490045
ATC: N02B
- NERVOUS SYSTEM
- ANALGESICS
- OTHER ANALGESICS AND ANTIPYRETICS
Synthesis plan pending
FORMULA:C17H13Cl2N3O3

SMILES: COc1cc2ncnc(Nc3cc(Cl)cc(Cl)c3)c2c2c1OCCO2

BIRTHDAY: 2018-11-30T03:41:30.499056
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis plan pending
FORMULA:C23H27N5O3

SMILES: Cc1nc([C@]23C=CC=C[C@@]2(c2ccccc2NC(=O)CC(C)(C)N(C)C)N=CO3)no1

BIRTHDAY: 2018-11-30T03:41:30.508970
ATC: J05A
- ANTIINFECTIVES FOR SYSTEMIC USE
- ANTIVIRALS FOR SYSTEMIC USE
- DIRECT ACTING ANTIVIRALS
Synthesis plan pending
FORMULA:C24H26N6O4

SMILES: CN(C)C(C)(C)NC(=O)c1ccccc1Nc1cnc(C(=O)Nc2ccc(C(=O)O)cc2)nc1

BIRTHDAY: 2018-11-30T03:41:30.528711
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis plan pending
FORMULA:C24H23N7O2

SMILES: CN(C)C(=O)c1ccccc1NC(=O)c1ccccc1CNc1cncnc1-c1ccn[nH]1

BIRTHDAY: 2018-11-19T08:18:46.563916
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis plan pending
FORMULA:C25H30N4O4

SMILES: CC(C)[C@H](Nc1cc(N2C[C@H]3O[C@H]4CC[C@@]25OC(=O)OCC[C@@H]4[C@@H]35)ncn1)c1ccccc1

BIRTHDAY: 2018-11-19T08:18:46.574811
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis plan pending
FORMULA:C22H35N9

SMILES: CC(C)NCc1cnccc1Nc1nc(N[C@@H](C)NC(C)C)c2c(ncn2C(C)C)n1

BIRTHDAY: 2018-11-19T08:18:46.585211
ATC: N05A
- NERVOUS SYSTEM
- PSYCHOLEPTICS
- ANTIPSYCHOTICS
Synthesis plan pending
FORMULA:C20H19F3N6O

SMILES: CN(C)CC(=O)Nc1ccccc1Nc1c(F)ncnc1Nc1cc(F)cc(F)c1

BIRTHDAY: 2018-11-19T08:18:46.595494
ATC: M01A
- MUSCULO-SKELETAL SYSTEM
- ANTIINFLAMMATORY AND ANTIRHEUMATIC PRODUCTS
- ANTIINFLAMMATORY AND ANTIRHEUMATIC PRODUCTS, NON-STEROIDS
Synthesis plan pending
FORMULA:C22H26F3N7O

SMILES: CC(C)NC(=O)[C@H](Nc1cnc(C(F)(F)F)nc1Nc1ccccc1-c1ccn[nH]1)C(C)C

BIRTHDAY: 2018-11-19T08:18:46.607011
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis plan pending
FORMULA:C25H18N6S

SMILES: N#Cc1ccccc1-c1ncccc1Nc1ccccc1CNc1ncc2ccsc2n1

BIRTHDAY: 2018-11-19T08:18:46.617263
ATC: M01A
- MUSCULO-SKELETAL SYSTEM
- ANTIINFLAMMATORY AND ANTIRHEUMATIC PRODUCTS
- ANTIINFLAMMATORY AND ANTIRHEUMATIC PRODUCTS, NON-STEROIDS
Synthesis plan pending
FORMULA:C24H20F3N3O3

SMILES: CN(C)C(=O)c1ccccc1NC(=O)c1ccc(C(=O)Nc2ccc(C(F)(F)F)cc2)cc1

BIRTHDAY: 2018-11-19T08:18:46.638481
ATC: N06A
- NERVOUS SYSTEM
- PSYCHOANALEPTICS
- ANTIDEPRESSANTS
Synthesis plan pending
FORMULA:C21H34ClN5O3

SMILES: CC(C)[C@@H](Nc1c2cc(C(N)=O)cc1N[C@H](C)[C@@H](Cl)[C@H](C)N[C@H](C)CCN2)C(=O)O

BIRTHDAY: 2018-11-19T08:18:46.668821
ATC: J01D
- ANTIINFECTIVES FOR SYSTEMIC USE
- ANTIBACTERIALS FOR SYSTEMIC USE
- OTHER BETA-LACTAM ANTIBACTERIALS
Synthesis plan pending
FORMULA:C27H29FN4O5S

SMILES: CN(C)c1cc(/C=C\C(=O)Nc2ccc(C(=O)Nc3cc4c(cc3F)OCCCSCCCO4)cc2)[o+][n-]1

BIRTHDAY: 2018-11-19T08:18:46.690498
ATC: J05A
- ANTIINFECTIVES FOR SYSTEMIC USE
- ANTIVIRALS FOR SYSTEMIC USE
- DIRECT ACTING ANTIVIRALS
Synthesis plan pending
FORMULA:C28H25N7O2

SMILES: CN(C)C(=O)c1cccc(NC(=O)c2ccc(CNc3nccc(-c4cnn5ccccc45)n3)cc2)c1

BIRTHDAY: 2018-11-19T08:18:46.701724
ATC: M01A
- MUSCULO-SKELETAL SYSTEM
- ANTIINFLAMMATORY AND ANTIRHEUMATIC PRODUCTS
- ANTIINFLAMMATORY AND ANTIRHEUMATIC PRODUCTS, NON-STEROIDS
Synthesis plan pending
FORMULA:C16H19N7O2S

SMILES: Cc1sncc1Nc1ncnc(-c2ccn[nH]2)c1N[C@@H](C(=O)O)C(C)C

BIRTHDAY: 2018-11-19T08:18:46.712828
ATC: A10B
- ALIMENTARY TRACT AND METABOLISM
- DRUGS USED IN DIABETES
- BLOOD GLUCOSE LOWERING DRUGS, EXCL. INSULINS
Synthesis plan pending
FORMULA:C22H29N7O

SMILES: CC(C)[C@H](Nc1nc(Nc2ccccc2C#N)nc2ncn(C(C)C)c12)C(C)(C)O

BIRTHDAY: 2018-11-19T08:18:46.722865
ATC: N05A
- NERVOUS SYSTEM
- PSYCHOLEPTICS
- ANTIPSYCHOTICS
Synthesis plan pending
FORMULA:C21H31N7O

SMILES: CC(C)[C@H](Nc1nc(NCc2cccnc2)c2ncn(C(C)C)c2n1)C(C)(C)O

BIRTHDAY: 2018-11-19T08:18:46.732660
ATC: N06A
- NERVOUS SYSTEM
- PSYCHOANALEPTICS
- ANTIDEPRESSANTS
Synthesis plan pending
FORMULA:C21H31N7O

SMILES: CC(C)[C@H](Nc1nc(NCc2ccncc2)c2c(ncn2C(C)C)n1)C(C)(C)O

BIRTHDAY: 2018-11-19T08:18:46.751454
ATC: C03C
- CARDIOVASCULAR SYSTEM
- DIURETICS
- HIGH-CEILING DIURETICS
Synthesis plan pending
FORMULA:C20H24N4O3

SMILES: CO[C@@]12C=CC=C3C=NC(Nc4ccccc4CN(C)C)=N[C@]31OCCO2

BIRTHDAY: 2018-11-19T08:18:46.760812
ATC: J01F
- ANTIINFECTIVES FOR SYSTEMIC USE
- ANTIBACTERIALS FOR SYSTEMIC USE
- MACROLIDES, LINCOSAMIDES AND STREPTOGRAMINS
Synthesis plan pending
FORMULA:C24H29N7O6

SMILES: O=c1[nH]c2cc(Nc3ncnc4c3CC(O)(O)C=C4)ccc2nc1N[C@H]1CNCCOCCOCCO1

BIRTHDAY: 2018-11-19T08:18:46.773255
ATC: N02B
- NERVOUS SYSTEM
- ANALGESICS
- OTHER ANALGESICS AND ANTIPYRETICS
Synthesis plan pending
FORMULA:C22H31FN6O

SMILES: CN(C)CCCCC(=O)Nc1ccc(Nc2ncc(F)c(NC3CCCC3)n2)cc1

BIRTHDAY: 2018-11-19T08:18:46.782708
ATC: A10B
- ALIMENTARY TRACT AND METABOLISM
- DRUGS USED IN DIABETES
- BLOOD GLUCOSE LOWERING DRUGS, EXCL. INSULINS
Synthesis plan pending
FORMULA:C25H22FN5O3S

SMILES: O=C(Nc1ccccc1-c1cnc(Nc2cccc(F)c2)nc1)[C@H]1[C@H]2C=CC=C[C@@H]2CNS1(=O)=O

BIRTHDAY: 2018-11-19T08:18:46.794595
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis plan pending
FORMULA:C19H22N4O4

SMILES: CN(C)Cc1ccccc1N[C@]12C=NC=NC1=CC1=C(OCCO1)C2(O)O

BIRTHDAY: 2018-11-19T08:18:46.804711
ATC: D07A
- DERMATOLOGICALS
- CORTICOSTEROIDS, DERMATOLOGICAL PREPARATIONS
- CORTICOSTEROIDS, PLAIN
Synthesis plan pending
FORMULA:C24H20F3N3O3

SMILES: CN(C)C(=O)c1ccc(NC(=O)c2ccccc2C(=O)Nc2cccc(C(F)(F)F)c2)cc1

BIRTHDAY: 2018-11-19T08:18:46.815282
ATC: B01A
- BLOOD AND BLOOD FORMING ORGANS
- ANTITHROMBOTIC AGENTS
- ANTITHROMBOTIC AGENTS
Synthesis plan pending
FORMULA:C20H29N7

SMILES: CC(C)n1cnc2c(NCc3ccccc3)nc(NCCCN(C)C)nc21

BIRTHDAY: 2018-11-19T08:18:46.834395
ATC: N06A
- NERVOUS SYSTEM
- PSYCHOANALEPTICS
- ANTIDEPRESSANTS
Synthesis plan pending
FORMULA:C16H13Cl2N3O4

SMILES: OC1(O)c2ncnc(Nc3ccc(Cl)c(Cl)c3)c2C=C2OCCO[C@@H]21

BIRTHDAY: 2018-11-19T08:18:46.843958
ATC: C02A
- CARDIOVASCULAR SYSTEM
- ANTIHYPERTENSIVES
- ANTIADRENERGIC AGENTS, CENTRALLY ACTING
Synthesis plan pending
FORMULA:C22H25N5O

SMILES: Cc1cccc(NC(=O)c2ncc(Nc3ccccc3[C@H](C)N(C)C)cn2)c1

BIRTHDAY: 2018-11-19T08:18:46.852818
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis plan pending
FORMULA:C21H23N9O2

SMILES: CC(C)[C@@H](Nc1c(Nc2ccccc2-c2ccn[nH]2)ncnc1-c1cn[nH]c1N)C(=O)O

BIRTHDAY: 2018-11-19T08:18:46.866532
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis plan pending
FORMULA:C21H23N9O2

SMILES: CC(C)[C@@H](Nc1c(Nc2ccccc2-c2ccn[nH]2)ncnc1-c1c[nH]nc1N)C(=O)O

BIRTHDAY: 2018-11-19T08:18:46.880217
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis plan pending
FORMULA:C19H20N4O4

SMILES: CN(C)Cc1ccccc1NC1=N[C@H]2C(=C3OC=COC3=CC2(O)O)C=N1

BIRTHDAY: 2018-11-19T08:18:46.899081
ATC: D11A
- DERMATOLOGICALS
- OTHER DERMATOLOGICAL PREPARATIONS
- OTHER DERMATOLOGICAL PREPARATIONS
Synthesis plan pending
FORMULA:C26H33N7O3

SMILES: COc1cccc2c(Nc3cccc(CN4C(=O)CCNCCNCCN[C@@H](C)C4=O)c3)ncnc12

BIRTHDAY: 2018-11-19T08:18:46.911763
ATC: D11A
- DERMATOLOGICALS
- OTHER DERMATOLOGICAL PREPARATIONS
- OTHER DERMATOLOGICAL PREPARATIONS
Synthesis plan pending
FORMULA:C21H23N9O2

SMILES: CC(C)[C@H](Nc1c(Nc2ccccc2-c2ccn[nH]2)ncnc1-c1c[nH]nc1N)C(=O)O

BIRTHDAY: 2018-11-19T08:18:46.925393
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis plan pending
FORMULA:C22H30N4O

SMILES: CN(C)C12CCC(CC1)N2C(=O)c1cccc(-n2nccc2C(C)(C)C)c1

BIRTHDAY: 2018-11-19T08:18:46.933817
ATC: N02B
- NERVOUS SYSTEM
- ANALGESICS
- OTHER ANALGESICS AND ANTIPYRETICS
Synthesis plan pending
FORMULA:C30H33N9O

SMILES: CC(C)[C@H](C#N)Nc1nc(Nc2cccc(-c3cn[nH]c3)c2)ncc1-c1n[nH]c2c1C1=C[C@@H](CCCCC2)OC1

BIRTHDAY: 2018-11-19T08:18:46.946403
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis plan pending
FORMULA:C22H29N7O

SMILES: CC(C)[C@@H](Nc1nc(Nc2ccccc2C#N)nc2ncn(C(C)C)c12)C(C)(C)O

BIRTHDAY: 2018-11-19T08:18:46.966151
ATC: N05A
- NERVOUS SYSTEM
- PSYCHOLEPTICS
- ANTIPSYCHOTICS
Synthesis plan pending
FORMULA:C19H22N4

SMILES: CC(C)[C@H](Nc1ncc2c(n1)[C@H]1C=CN2CC1)c1ccccc1

BIRTHDAY: 2018-11-19T08:18:46.974181
ATC: A02B
- ALIMENTARY TRACT AND METABOLISM
- DRUGS FOR ACID RELATED DISORDERS
- DRUGS FOR PEPTIC ULCER AND GASTRO-OESOPHAGEAL REFLUX DISEASE (GORD)
Synthesis plan pending
FORMULA:C18H22N8O

SMILES: CCNC(=O)[C@H](Nc1cc(Nc2cccc3nnncc23)ncn1)C(C)C

BIRTHDAY: 2018-11-19T08:18:46.983980
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis plan pending
FORMULA:C22H29N7O

SMILES: CC(C)[C@@H](Nc1nc(Nc2ccccc2C#N)c2c(ncn2C(C)C)n1)C(C)(C)O

BIRTHDAY: 2018-11-19T08:18:46.993898
ATC: N05A
- NERVOUS SYSTEM
- PSYCHOLEPTICS
- ANTIPSYCHOTICS
Synthesis plan pending
FORMULA:C20H23N3O3

SMILES: COC1=C[C@H]2N=CN=C(Nc3ccc(C)c(C)c3C)[C@]23OCCOC3=C1

BIRTHDAY: 2018-11-19T08:18:47.002700
ATC: V08C
- VARIOUS
- CONTRAST MEDIA
- MAGNETIC RESONANCE IMAGING CONTRAST MEDIA
Synthesis plan pending
FORMULA:C21H31N7O

SMILES: CC(C)[C@H](Nc1nc(NCc2ccncc2)nc2ncn(C(C)C)c12)C(C)(C)O

BIRTHDAY: 2018-11-19T08:18:47.012415
ATC: C03C
- CARDIOVASCULAR SYSTEM
- DIURETICS
- HIGH-CEILING DIURETICS
Synthesis plan pending
FORMULA:C22H23F3N6O

SMILES: CN(C)CCCC(=O)Nc1cccc(Nc2ncc(F)c(Nc3c(F)cccc3F)n2)c1

BIRTHDAY: 2018-11-19T08:18:47.022854
ATC: M01A
- MUSCULO-SKELETAL SYSTEM
- ANTIINFLAMMATORY AND ANTIRHEUMATIC PRODUCTS
- ANTIINFLAMMATORY AND ANTIRHEUMATIC PRODUCTS, NON-STEROIDS
Synthesis plan pending
FORMULA:C23H35N7O

SMILES: CC(C)[C@@H](Nc1nc(NCc2ccncc2)nc2ncn(C(C)C)c12)[C@H](O)C(C)(C)C

BIRTHDAY: 2018-11-19T08:18:47.032914
ATC: C03C
- CARDIOVASCULAR SYSTEM
- DIURETICS
- HIGH-CEILING DIURETICS
Synthesis plan pending
FORMULA:C20H15F3N6O

SMILES: CNC(=O)c1ccc(Nc2c(Nc3ccccc3C#N)ncnc2C(F)(F)F)cc1

BIRTHDAY: 2018-11-19T08:18:47.043835
ATC: D11A
- DERMATOLOGICALS
- OTHER DERMATOLOGICAL PREPARATIONS
- OTHER DERMATOLOGICAL PREPARATIONS
Synthesis plan pending
FORMULA:C24H23N7O2

SMILES: CN(C)C(=O)c1cccc(NC(=O)c2cccc(CNc3nccc(-c4cn[nH]c4)n3)c2)c1

BIRTHDAY: 2018-11-19T08:18:47.082441
ATC: C10A
- CARDIOVASCULAR SYSTEM
- LIPID MODIFYING AGENTS
- LIPID MODIFYING AGENTS, PLAIN
Synthesis plan pending
FORMULA:C28H18ClFN4O3

SMILES: O=C(Nc1cccc([C@]23C=CC(c4noc(-c5ccccc5Cl)n4)=C[C@@H]2OC=N3)c1)c1ccccc1F

BIRTHDAY: 2018-11-19T08:18:47.094257
ATC: C05C
- CARDIOVASCULAR SYSTEM
- VASOPROTECTIVES
- CAPILLARY STABILIZING AGENTS
Synthesis plan pending
FORMULA:C22H29N7

SMILES: CC(C)C(Nc1nc(Nc2ccc(C#N)cc2)c2ncn(C(C)C)c2n1)C(C)C

BIRTHDAY: 2018-11-19T08:18:47.103557
ATC: J01M
- ANTIINFECTIVES FOR SYSTEMIC USE
- ANTIBACTERIALS FOR SYSTEMIC USE
- QUINOLONE ANTIBACTERIALS
Synthesis plan pending
FORMULA:C22H26F3N7O

SMILES: CC(C)NC(=O)[C@H](Nc1nc(Nc2cccc(-c3cn[nH]c3)c2)ncc1C(F)(F)F)C(C)C

BIRTHDAY: 2018-11-19T08:18:47.114659
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis plan pending
FORMULA:C27H26F2N4O

SMILES: CN(C)C(C)(C)[C@]1(c2cccc(F)c2)COc2cccc(-c3nnc(-c4cccc(F)c4)[nH]3)c21

BIRTHDAY: 2018-11-19T08:18:47.126432
ATC: A02B
- ALIMENTARY TRACT AND METABOLISM
- DRUGS FOR ACID RELATED DISORDERS
- DRUGS FOR PEPTIC ULCER AND GASTRO-OESOPHAGEAL REFLUX DISEASE (GORD)
Synthesis plan pending
FORMULA:C18H14N6O4

SMILES: O=c1[nH]c2c(o1)-c1cnc(Nc3ccc(-c4cn[nH]c4)cc3)nc1C(O)(O)C2

BIRTHDAY: 2018-11-19T08:18:47.136692
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis plan pending
FORMULA:C29H43N5O2

SMILES: OC1(O)C=Cc2ncnc(Nc3cccc(CN4CCCCCCCCCCCCNCC4)c3)c2C1

BIRTHDAY: 2018-11-19T08:18:47.147016
ATC: H01B
- SYSTEMIC HORMONAL PREPARATIONS, EXCL. SEX HORMONES AND INSULINS
- PITUITARY AND HYPOTHALAMIC HORMONES AND ANALOGUES
- POSTERIOR PITUITARY LOBE HORMONES
Synthesis plan pending
FORMULA:C30H37N5O3

SMILES: CC(C)[C@@H]1COCCNCc2cc(C(=O)Nc3ccc(C(=O)N(C)C)cc3)ccc2Nc2cccc(c2)N1

BIRTHDAY: 2018-11-19T08:18:47.157922
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis plan pending
FORMULA:C20H22N4O2

SMILES: CNC(=O)c1cc2c(Nc3c(C)cc(C)cc3C)ncnc2cc1OC

BIRTHDAY: 2018-11-19T08:18:47.177369
ATC: N03A
- NERVOUS SYSTEM
- ANTIEPILEPTICS
- ANTIEPILEPTICS
Synthesis plan pending
FORMULA:C19H22N4O4

SMILES: CN(C)Cc1ccccc1Nc1ncnc2c1C(O)(O)CC1=C2OCCO1

BIRTHDAY: 2018-11-19T08:18:47.186782
ATC: N05A
- NERVOUS SYSTEM
- PSYCHOLEPTICS
- ANTIPSYCHOTICS
Synthesis plan pending
FORMULA:C16H13Cl2N3O4

SMILES: OC1(O)Cc2nc(Nc3c(Cl)cccc3Cl)ncc2C2=C1OCCO2

BIRTHDAY: 2018-11-19T08:18:47.196275
ATC: A10B
- ALIMENTARY TRACT AND METABOLISM
- DRUGS USED IN DIABETES
- BLOOD GLUCOSE LOWERING DRUGS, EXCL. INSULINS
Synthesis plan pending
FORMULA:C26H24N6O2

SMILES: CN(C)C(=O)c1cccc(NC(=O)c2ccc(CNc3nccc(-c4cccnc4)n3)cc2)c1

BIRTHDAY: 2018-11-19T08:18:47.217852
ATC: C10A
- CARDIOVASCULAR SYSTEM
- LIPID MODIFYING AGENTS
- LIPID MODIFYING AGENTS, PLAIN
Synthesis plan pending
FORMULA:C19H16F4N6O

SMILES: CC(=O)NCc1cccc(Nc2nc(C(F)(F)F)ncc2Nc2cccc(F)c2)n1

BIRTHDAY: 2018-11-19T08:18:47.228444
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis plan pending
FORMULA:C22H26F3N7O

SMILES: CC(C)NC(=O)[C@H](Nc1nc(Nc2ccccc2-c2cn[nH]c2)ncc1C(F)(F)F)C(C)C

BIRTHDAY: 2018-11-19T08:18:47.239905
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis plan pending
FORMULA:C12H21NOS2

SMILES: CC(C)C(=O)N[C@]1(C(C)C)CCSC=CS1

BIRTHDAY: 2018-11-19T08:18:47.246574
ATC: P03A
- ANTIPARASITIC PRODUCTS, INSECTICIDES AND REPELLENTS
- ECTOPARASITICIDES, INCL. SCABICIDES, INSECTICIDES AND REPELLENTS
- ECTOPARASITICIDES, INCL. SCABICIDES
Synthesis plan pending
FORMULA:C23H24F3N5O2

SMILES: C[C@H](c1ccccc1Nc1cnc(C(=O)Nc2cccc([C@@H](O)C(F)(F)F)c2)nc1)N(C)C

BIRTHDAY: 2018-11-19T08:18:47.257204
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis plan pending
FORMULA:C21H28N10O

SMILES: Cc1n[nH]c([C@@H](Nc2nc(NCc3ccncc3)c3c(ncn3C(C)C)n2)C(C)(C)O)n1

BIRTHDAY: 2018-11-19T08:18:47.268325
ATC: P01B
- ANTIPARASITIC PRODUCTS, INSECTICIDES AND REPELLENTS
- ANTIPROTOZOALS
- ANTIMALARIALS
Synthesis plan pending
FORMULA:C17H13Cl2N3O3

SMILES: CO[C@@]12OC=COC1=CC=C1C=NC(Nc3c(Cl)cccc3Cl)=N[C@@H]12

BIRTHDAY: 2018-11-19T08:18:47.288869
ATC: S01G
- SENSORY ORGANS
- OPHTHALMOLOGICALS
- DECONGESTANTS AND ANTIALLERGICS
Synthesis plan pending
FORMULA:C26H24N6O2

SMILES: CN(C)C(=O)c1ccccc1NC(=O)c1ccccc1CNc1cncnc1-c1ccccn1

BIRTHDAY: 2018-11-19T08:18:47.299530
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis plan pending
FORMULA:C39H46N6O4

SMILES: CCCCNC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](C(C)C)N1C(=O)Cc2cccc(c2)OCCCc2cccc(c2)Nc2nccc1n2

BIRTHDAY: 2018-11-19T08:18:47.316115
ATC: L01B
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- ANTIMETABOLITES
Synthesis plan pending
FORMULA:C23H31FN6O2

SMILES: O=C(NCCN1CCOCC1)c1cnc(NCc2ccc(F)cc2)nc1NC1CCCC1

BIRTHDAY: 2018-11-19T08:18:47.326270
ATC: N06A
- NERVOUS SYSTEM
- PSYCHOANALEPTICS
- ANTIDEPRESSANTS
Synthesis plan pending
FORMULA:C19H22N4O4

SMILES: CN(C)Cc1ccccc1Nc1ncc2c(n1)=C1OCCO[C@@H]1C(O)(O)C=2

BIRTHDAY: 2018-11-19T08:18:47.335807
ATC: M01A
- MUSCULO-SKELETAL SYSTEM
- ANTIINFLAMMATORY AND ANTIRHEUMATIC PRODUCTS
- ANTIINFLAMMATORY AND ANTIRHEUMATIC PRODUCTS, NON-STEROIDS
Synthesis plan pending
FORMULA:C17H22FN3

SMILES: CC1(C)CCC[C@@H]2C[C@@]3(c4ccccc4F)NC=N[C@@]13N2

BIRTHDAY: 2018-11-30T17:23:52.035206
ATC: N05C
- NERVOUS SYSTEM
- PSYCHOLEPTICS
- HYPNOTICS AND SEDATIVES
Synthesis Plan
FORMULA:C18H26N6O3S

SMILES: COC(=O)[C@@H](Nc1cnc(Nc2c(C)nsc2C(=O)NC(C)C)nc1)C(C)C

BIRTHDAY: 2018-11-30T17:23:52.045228
ATC: N05A
- NERVOUS SYSTEM
- PSYCHOLEPTICS
- ANTIPSYCHOTICS
Synthesis Plan
FORMULA:C17H24N8OS

SMILES: Cc1nscc1Nc1ncnc(-c2[nH]ncc2N)c1N[C@H](C(C)C)[C@@H](C)O

BIRTHDAY: 2018-11-30T17:23:52.056395
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C23H35N7O

SMILES: CC(C)[C@H](Nc1nc(NCc2cccnc2)c2ncn(C(C)C)c2n1)[C@H](O)C(C)(C)C

BIRTHDAY: 2018-11-30T17:23:52.075780
ATC: A10B
- ALIMENTARY TRACT AND METABOLISM
- DRUGS USED IN DIABETES
- BLOOD GLUCOSE LOWERING DRUGS, EXCL. INSULINS
Synthesis Plan
FORMULA:C24H21N5O4

SMILES: COC1=Cc2ncnc(Nc3cccc(CNC(=O)c4cccc(C#N)c4)c3)c2CC1(O)O

BIRTHDAY: 2018-11-30T17:23:52.086102
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C28H30N10S

SMILES: CC(C)[C@@H](C)Nc1cnc(Nc2nsc3cc4cc(c23)CCc2cncc(c2)Nc2nccc(n2)NC4)nc1

BIRTHDAY: 2018-11-30T17:23:52.098377
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C19H20N4O4

SMILES: CN(C)Cc1ccccc1NC1=NC2=CC3=C(OC=CO3)C(O)(O)[C@H]2C=N1

BIRTHDAY: 2018-11-30T17:23:52.107765
ATC: A11H
- ALIMENTARY TRACT AND METABOLISM
- VITAMINS
- OTHER PLAIN VITAMIN PREPARATIONS
Synthesis Plan
FORMULA:C23H31N9

SMILES: CC(C)[C@@H](Nc1nc(Nc2ccccc2C#N)c2[nH]c(N3CC[C@@H]3N)nc2n1)C(C)(C)C

BIRTHDAY: 2018-11-30T17:23:52.118839
ATC: N05A
- NERVOUS SYSTEM
- PSYCHOLEPTICS
- ANTIPSYCHOTICS
Synthesis Plan
FORMULA:C22H29N7O

SMILES: CC(C)[C@@H](Nc1nc(Nc2cccc(C#N)c2)c2ncn(C(C)C)c2n1)C(C)(C)O

BIRTHDAY: 2018-11-30T17:23:52.137808
ATC: J01M
- ANTIINFECTIVES FOR SYSTEMIC USE
- ANTIBACTERIALS FOR SYSTEMIC USE
- QUINOLONE ANTIBACTERIALS
Synthesis Plan
FORMULA:C21H31N7O

SMILES: CC(C)[C@H](Nc1nc(NCc2ccccn2)nc2c1ncn2C(C)C)C(C)(C)O

BIRTHDAY: 2018-11-30T17:23:52.147655
ATC: C03C
- CARDIOVASCULAR SYSTEM
- DIURETICS
- HIGH-CEILING DIURETICS
Synthesis Plan
FORMULA:C28H36F3N3O3

SMILES: CN(C)C(=O)c1ccccc1NC(=O)C1(Nc2ccccc2[C@@H](O)C(F)(F)F)CCCCCCCCC1

BIRTHDAY: 2018-11-30T17:23:52.169665
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:C19H22N4O4

SMILES: CN(C)Cc1ccccc1Nc1ncc2c(n1)=CC(O)(O)[C@@H]1OCCOC=21

BIRTHDAY: 2018-11-30T17:23:52.178962
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C20H22N4O3

SMILES: CO[C@]12N=CN=C[C@@]1(Nc1ccccc1CN(C)C)C=CC1=C2OC=CO1

BIRTHDAY: 2018-11-30T17:23:52.188176
ATC: L01C
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- PLANT ALKALOIDS AND OTHER NATURAL PRODUCTS
Synthesis Plan
FORMULA:C23H35N7O

SMILES: CC(C)[C@@H](Nc1nc(NCc2ccncc2)nc2ncn(C(C)C)c12)[C@@H](O)C(C)(C)C

BIRTHDAY: 2018-12-02T16:06:59.858607
ATC: C03C
- CARDIOVASCULAR SYSTEM
- DIURETICS
- HIGH-CEILING DIURETICS
Synthesis Plan
FORMULA:C27H28F2N4O

SMILES: CN(C)C(C)(C)[C@]1(c2cccc(F)c2)CO[C@@H]2C=CC=C[C@]21c1nnc(-c2cccc(F)c2)[nH]1

BIRTHDAY: 2018-12-02T16:06:59.881330
ATC: C03C
- CARDIOVASCULAR SYSTEM
- DIURETICS
- HIGH-CEILING DIURETICS
Synthesis Plan
FORMULA:C26H32N6O2

SMILES: CN(C)CC(=O)N1CCC[C@@H](c2cccc([C@@H]3C=CCCC3)c2NC(=O)c2cnc(C#N)[nH]2)C1

BIRTHDAY: 2018-12-02T16:06:59.903200
ATC: C08C
- CARDIOVASCULAR SYSTEM
- CALCIUM CHANNEL BLOCKERS
- SELECTIVE CALCIUM CHANNEL BLOCKERS WITH MAINLY VASCULAR EFFECTS
Synthesis Plan
FORMULA:C27H24F2N6O2

SMILES: CN(C)C(=O)c1ccccc1NC(=O)c1ccccc1CNc1cncnc1Nc1cc(F)cc(F)c1

BIRTHDAY: 2018-12-02T16:06:59.914787
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C22H26F3N7O

SMILES: CC(C)NC(=O)[C@H](Nc1cnc(C(F)(F)F)nc1Nc1cccc(-c2ccn[nH]2)c1)C(C)C

BIRTHDAY: 2018-12-02T16:06:59.925766
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C25H28N2O

SMILES: CC(C)c1ccccc1-c1ccc(C(=O)Nc2ccc(CN(C)C)cc2)cc1

BIRTHDAY: 2018-12-02T16:06:59.933362
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C37H40N6O4

SMILES: C[C@H](c1ccccc1Nc1cncnc1C(=O)Nc1ccccc1-c1cc2ccc1CCNCC(=O)CC(=O)CC=CCO2)N(C)C

BIRTHDAY: 2018-12-02T16:06:59.958259
ATC: C02A
- CARDIOVASCULAR SYSTEM
- ANTIHYPERTENSIVES
- ANTIADRENERGIC AGENTS, CENTRALLY ACTING
Synthesis Plan
FORMULA:C23H25NO7

SMILES: O=C1O[C@H](c2ccc(O)c(O)c2)CCCOC(=O)[C@@H]2N[C@H]1CC[C@@H]2c1ccc(O)cc1

BIRTHDAY: 2018-12-02T16:06:59.968110
ATC: C01C
- CARDIOVASCULAR SYSTEM
- CARDIAC THERAPY
- CARDIAC STIMULANTS EXCL. CARDIAC GLYCOSIDES
Synthesis Plan
FORMULA:C18H25N7OS

SMILES: Cc1cc(Nc2cc(-c3cnn(C)c3)nc(N[C@H](C(C)C)[C@@H](C)O)n2)sn1

BIRTHDAY: 2018-12-02T16:07:00.008893
ATC: J01F
- ANTIINFECTIVES FOR SYSTEMIC USE
- ANTIBACTERIALS FOR SYSTEMIC USE
- MACROLIDES, LINCOSAMIDES AND STREPTOGRAMINS
Synthesis Plan
FORMULA:C20H22F3N7O

SMILES: CNC(=O)[C@H](Nc1nc(Nc2ccc(-c3cn[nH]c3)cc2)ncc1C(F)(F)F)C(C)C

BIRTHDAY: 2018-12-02T16:07:00.019636
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C22H21N3O

SMILES: C1=NCC[C@H](c2ccc(Oc3ccccc3)cc2)[C@H](c2cccnc2)N1

BIRTHDAY: 2018-12-02T16:07:00.027930
ATC: N07C
- NERVOUS SYSTEM
- OTHER NERVOUS SYSTEM DRUGS
- ANTIVERTIGO PREPARATIONS
Synthesis Plan
FORMULA:C32H36ClN5O5

SMILES: CC(C)[C@H](C(=O)NO)N1CCN2CCN(CC2)Cc2cccc(c2)Oc2cc(ccc2C(=O)Nc2ccc(Cl)cc2)C1=O

BIRTHDAY: 2018-12-02T16:07:00.042570
ATC: G01A
- GENITO URINARY SYSTEM AND SEX HORMONES
- GYNECOLOGICAL ANTIINFECTIVES AND ANTISEPTICS
- ANTIINFECTIVES AND ANTISEPTICS, EXCL. COMBINATIONS WITH CORTICOSTEROIDS
Synthesis Plan
FORMULA:C16H19N7O2S

SMILES: Cc1cc(Nc2ncc(-c3ccn[nH]3)c(N[C@H](C(=O)O)C(C)C)n2)sn1

BIRTHDAY: 2018-12-02T16:07:00.052442
ATC: A10B
- ALIMENTARY TRACT AND METABOLISM
- DRUGS USED IN DIABETES
- BLOOD GLUCOSE LOWERING DRUGS, EXCL. INSULINS
Synthesis Plan
FORMULA:C23H35N7O

SMILES: CC(C)[C@@H](Nc1nc(NCc2ccncc2)c2c(ncn2C(C)C)n1)[C@@H](O)C(C)(C)C

BIRTHDAY: 2018-12-03T10:43:21.967634
ATC: C08D
- CARDIOVASCULAR SYSTEM
- CALCIUM CHANNEL BLOCKERS
- SELECTIVE CALCIUM CHANNEL BLOCKERS WITH DIRECT CARDIAC EFFECTS
Synthesis Plan
FORMULA:C21H24ClFN4O3

SMILES: C[C@@H](O[C@@H]1c2nc(Nc3cc(F)ccc3Cl)ncc2C=CC1(O)O)N1CCCCC1

BIRTHDAY: 2018-12-03T10:43:21.987972
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C19H20N4O4

SMILES: CN(C)Cc1ccccc1Nc1ncc2c(n1)C1=C(OC=CO1)C(O)(O)C2

BIRTHDAY: 2018-12-03T10:43:21.997443
ATC: N05A
- NERVOUS SYSTEM
- PSYCHOLEPTICS
- ANTIPSYCHOTICS
Synthesis Plan
FORMULA:C21H23N9O2

SMILES: CC(C)[C@@H](Nc1c(Nc2cccc(-c3cc[nH]n3)c2)ncnc1-c1[nH]ncc1N)C(=O)O

BIRTHDAY: 2018-12-03T10:43:22.021338
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C19H20N4O4

SMILES: CN(C)Cc1ccccc1Nc1ncc2c(n1)C(O)(O)[C@H]1OC=COC1=C2

BIRTHDAY: 2018-12-03T10:43:22.030810
ATC: M01A
- MUSCULO-SKELETAL SYSTEM
- ANTIINFLAMMATORY AND ANTIRHEUMATIC PRODUCTS
- ANTIINFLAMMATORY AND ANTIRHEUMATIC PRODUCTS, NON-STEROIDS
Synthesis Plan
FORMULA:C20H29N7

SMILES: CC(C)n1cnc2nc(NCc3ccccc3)nc(NC(C)(C)N(C)C)c21

BIRTHDAY: 2018-12-03T10:43:22.050972
ATC: C03C
- CARDIOVASCULAR SYSTEM
- DIURETICS
- HIGH-CEILING DIURETICS
Synthesis Plan
FORMULA:C24H29N7O2

SMILES: CN(C)CC(=O)N1CCCC[C@H]1N[C@]12C=NC=N[C@@H]1C=CC(c1cccc3nc(N)oc13)=C2

BIRTHDAY: 2018-12-03T10:43:22.062309
ATC: C08D
- CARDIOVASCULAR SYSTEM
- CALCIUM CHANNEL BLOCKERS
- SELECTIVE CALCIUM CHANNEL BLOCKERS WITH DIRECT CARDIAC EFFECTS
Synthesis Plan
FORMULA:C20H22N4O4

SMILES: CN(C)Cc1ccccc1Nc1ncc2c(n1)C=CC(O)(O)[C@]21COC=CO1

BIRTHDAY: 2018-12-03T10:43:22.083021
ATC: A02B
- ALIMENTARY TRACT AND METABOLISM
- DRUGS FOR ACID RELATED DISORDERS
- DRUGS FOR PEPTIC ULCER AND GASTRO-OESOPHAGEAL REFLUX DISEASE (GORD)
Synthesis Plan
FORMULA:C23H35N7O

SMILES: CC(C)[C@H](Nc1nc(NCc2ccncc2)nc2ncn(C(C)C)c12)[C@H](O)C(C)(C)C

BIRTHDAY: 2018-12-03T10:43:22.102968
ATC: C03C
- CARDIOVASCULAR SYSTEM
- DIURETICS
- HIGH-CEILING DIURETICS
Synthesis Plan
FORMULA:C16H19N7O2S

SMILES: Cc1cc(Nc2ncc(-c3cn[nH]c3)c(N[C@H](C(=O)O)C(C)C)n2)sn1

BIRTHDAY: 2018-12-03T10:43:22.122530
ATC: A10B
- ALIMENTARY TRACT AND METABOLISM
- DRUGS USED IN DIABETES
- BLOOD GLUCOSE LOWERING DRUGS, EXCL. INSULINS
Synthesis Plan
FORMULA:C23H28N8O2

SMILES: CN(C)CCCC(=O)Nc1ccccc1Nc1ncc2c(n1)-c1c(c(C(N)=O)nn1C)CC2

BIRTHDAY: 2018-12-03T10:43:22.134753
ATC: N04B
- NERVOUS SYSTEM
- ANTI-PARKINSON DRUGS
- DOPAMINERGIC AGENTS
Synthesis Plan
FORMULA:C21H24ClFN4O3

SMILES: C[C@@H](OC1=CC=C2C=NC(Nc3cc(F)ccc3Cl)=N[C@@H]2C1(O)O)N1CCCCC1

BIRTHDAY: 2018-12-03T19:11:46.740197
ATC: M02A
- MUSCULO-SKELETAL SYSTEM
- TOPICAL PRODUCTS FOR JOINT AND MUSCULAR PAIN
- TOPICAL PRODUCTS FOR JOINT AND MUSCULAR PAIN
Synthesis Plan
FORMULA:C19H22N4O4

SMILES: CN(C)Cc1ccc(Nc2ncnc3c2C(O)(O)[C@H]2OCCOC2=C3)cc1

BIRTHDAY: 2018-12-03T19:11:46.749490
ATC: C02A
- CARDIOVASCULAR SYSTEM
- ANTIHYPERTENSIVES
- ANTIADRENERGIC AGENTS, CENTRALLY ACTING
Synthesis Plan
FORMULA:C25H28N8O2

SMILES: CN(C)C(=O)c1ccccc1NC(=O)c1ccccc1CNc1ncnc2c1CNC=CN[C@H]2N

BIRTHDAY: 2018-12-03T19:11:46.770384
ATC: N05A
- NERVOUS SYSTEM
- PSYCHOLEPTICS
- ANTIPSYCHOTICS
Synthesis Plan
FORMULA:C39H42N10O3

SMILES: CC(C)[C@@H](Nc1nc(NCc2ccncc2)nc2nc(N3c4cccc(c4)COCC=CCCOc4cccc(c4)-c4ccnc3n4)[nH]c12)[C@H](C)O

BIRTHDAY: 2018-12-03T19:11:46.817289
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C20H22N4O4

SMILES: CN(C)Cc1ccccc1Nc1ncc2c(n1)=CC(O)(O)[C@]1(C=2)COC=CO1

BIRTHDAY: 2018-12-03T19:11:46.826959
ATC: A02B
- ALIMENTARY TRACT AND METABOLISM
- DRUGS FOR ACID RELATED DISORDERS
- DRUGS FOR PEPTIC ULCER AND GASTRO-OESOPHAGEAL REFLUX DISEASE (GORD)
Synthesis Plan
FORMULA:C14H17ClFN5S

SMILES: C[C@H]([C@@H]1C=NN2N=CN[C@]2(c2cc(F)cc(Cl)c2)S1)N(C)C

BIRTHDAY: 2018-12-03T19:11:46.876733
ATC: A10B
- ALIMENTARY TRACT AND METABOLISM
- DRUGS USED IN DIABETES
- BLOOD GLUCOSE LOWERING DRUGS, EXCL. INSULINS
Synthesis Plan
FORMULA:C27H26N8O2

SMILES: CN(C)C(=O)c1ccccc1NC(=O)c1ccccc1CNc1cncnc1-c1nc2c([nH]1)NCC=C2

BIRTHDAY: 2018-12-03T19:11:46.888840
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C24H31N5O4

SMILES: Cc1ccc(C)c(Nc2ncc3c(n2)C=C[C@@H](C(=O)N[C@H](C)N2CCOCC2)C3(O)O)c1C

BIRTHDAY: 2018-12-03T19:11:46.910234
ATC: M01A
- MUSCULO-SKELETAL SYSTEM
- ANTIINFLAMMATORY AND ANTIRHEUMATIC PRODUCTS
- ANTIINFLAMMATORY AND ANTIRHEUMATIC PRODUCTS, NON-STEROIDS
Synthesis Plan
FORMULA:C19H25Cl2N7

SMILES: CC(C)n1cnc2nc(NC(C)(C)N(C)C)nc(Nc3c(Cl)cccc3Cl)c21

BIRTHDAY: 2018-12-01T22:30:52.800562
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:C21H13FN8O

SMILES: N#Cc1cnc(Nc2cncnc2)c(C(=O)Nc2cccnc2-c2cccc(F)c2)n1

BIRTHDAY: 2018-12-01T22:30:52.812205
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C23H35N7O

SMILES: CC(C)[C@H](Nc1nc(NCc2ccncc2)c2c(ncn2C(C)C)n1)[C@H](O)C(C)(C)C

BIRTHDAY: 2018-12-01T22:30:52.832189
ATC: C08D
- CARDIOVASCULAR SYSTEM
- CALCIUM CHANNEL BLOCKERS
- SELECTIVE CALCIUM CHANNEL BLOCKERS WITH DIRECT CARDIAC EFFECTS
Synthesis Plan
FORMULA:C22H26ClFN4O2

SMILES: CO[C@@]1(O[C@H](C)N2CCCCC2)C=CC=C2C=NC(Nc3cc(F)ccc3Cl)=N[C@H]21

BIRTHDAY: 2018-12-01T22:30:52.843348
ATC: N02C
- NERVOUS SYSTEM
- ANALGESICS
- ANTIMIGRAINE PREPARATIONS
Synthesis Plan
FORMULA:C21H23NO3

SMILES: CC(C)c1cc(-c2ccc(-n3cc(O)oc3=O)cc2)cc(C(C)C)c1

BIRTHDAY: 2018-12-01T22:30:52.851174
ATC: H03B
- SYSTEMIC HORMONAL PREPARATIONS, EXCL. SEX HORMONES AND INSULINS
- THYROID THERAPY
- ANTITHYROID PREPARATIONS
Synthesis Plan
FORMULA:C20H24N4O3

SMILES: CO[C@]12C=CC=C3C=NC(Nc4ccccc4CN(C)C)=N[C@]31OCCO2

BIRTHDAY: 2018-12-01T22:30:52.860478
ATC: J01F
- ANTIINFECTIVES FOR SYSTEMIC USE
- ANTIBACTERIALS FOR SYSTEMIC USE
- MACROLIDES, LINCOSAMIDES AND STREPTOGRAMINS
Synthesis Plan
FORMULA:C22H26F3N7O

SMILES: CC(C)NC(=O)[C@H](Nc1c(Nc2ccc(-c3ccn[nH]3)cc2)ncnc1C(F)(F)F)C(C)C

BIRTHDAY: 2018-12-01T22:30:52.873184
ATC: J05A
- ANTIINFECTIVES FOR SYSTEMIC USE
- ANTIVIRALS FOR SYSTEMIC USE
- DIRECT ACTING ANTIVIRALS
Synthesis Plan
FORMULA:C18H21N3O2

SMILES: COC1(OC)C=CC=C2N=C(N[C@@H](C)c3ccccc3)N=C[C@H]21

BIRTHDAY: 2018-12-01T22:30:52.901405
ATC: V08A
- VARIOUS
- CONTRAST MEDIA
- X-RAY CONTRAST MEDIA, IODINATED
Synthesis Plan
FORMULA:C22H32N4O4S

SMILES: CC(C)c1ccc2c(c1)N([C@H](N)CNC(=O)C(C)(C)C)C(=O)[C@]13C[C@H](CN21)SC3(O)O

BIRTHDAY: 2018-12-01T22:30:52.950334
ATC: N05A
- NERVOUS SYSTEM
- PSYCHOLEPTICS
- ANTIPSYCHOTICS
Synthesis Plan
FORMULA:C20H24N4O3

SMILES: CO[C@@]12C=CC=C3N=C(Nc4ccccc4CN(C)C)N=C[C@@]31OCCO2

BIRTHDAY: 2018-12-01T22:30:52.959506
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C18H14F3N3O3

SMILES: CO[C@]12C=CC=C3C(Nc4ccccc4C(F)(F)F)=NC=N[C@]31OC=CO2

BIRTHDAY: 2018-12-01T22:30:52.969722
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C22H26F3N7O

SMILES: CC(C)NC(=O)[C@@H](Nc1nc(Nc2ccc(-c3cn[nH]c3)cc2)ncc1C(F)(F)F)C(C)C

BIRTHDAY: 2018-12-01T22:30:52.980738
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan