matter.farm

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

These compounds may interact with:

Serine/threonine-protein kinase PAK 4

Potentially involved in: carcinoma; cancer; breast adenoma; atypical teratoid / rhabdoid tumor; glioblastoma; malignant mesothelioma; medulloblastoma, large-cell; osteosarcoma

Disease data sourced from Pharos.

Inhibitor

FORMULA:C22H28N8O2

SMILES: COC[C@@H](C)Nc1nc(NCc2cccc(-c3nc(C)no3)c2)c2c(ncn2C(C)C)n1

BIRTHDAY: 2018-12-01T14:11:43.885890
ATC: N03A
- NERVOUS SYSTEM
- ANTIEPILEPTICS
- ANTIEPILEPTICS
Synthesis Plan
FORMULA:C23H36N6O

SMILES: CC(C)C[C@@H](Nc1cnc(NC(=O)c2ccncc2NC(C)(C)C)nc1)C(C)(C)C

BIRTHDAY: 2018-12-01T14:11:43.895031
ATC: N05A
- NERVOUS SYSTEM
- PSYCHOLEPTICS
- ANTIPSYCHOTICS
Synthesis Plan
FORMULA:C24H24N8S

SMILES: CC(C)C[C@H](Nc1ccnc(Nc2ccc(-c3cn[nH]c3)cn2)n1)c1nc2ccccc2s1

BIRTHDAY: 2018-12-01T14:11:43.906090
ATC: J05A
- ANTIINFECTIVES FOR SYSTEMIC USE
- ANTIVIRALS FOR SYSTEMIC USE
- DIRECT ACTING ANTIVIRALS
Synthesis Plan
FORMULA:C24H23F4N5O4S

SMILES: CN(C)C[C@@H](NC(=O)Nc1ccccc1[C@]12N=CC=C[C@]1(S(=O)(=O)c1ccccc1F)N=CO2)C(F)(F)F

BIRTHDAY: 2018-12-01T14:11:43.919842
ATC: C02K
- CARDIOVASCULAR SYSTEM
- ANTIHYPERTENSIVES
- OTHER ANTIHYPERTENSIVES
Synthesis Plan
FORMULA:C23H36N6O

SMILES: CC(C)C[C@H](Nc1cncnc1NC(=O)c1ccncc1NC(C)(C)C)C(C)(C)C

BIRTHDAY: 2018-12-01T14:11:43.928985
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C22H29N5O3

SMILES: COc1ccc(C(=O)Nc2[nH]nc3c2CN(C(=O)C2CCN(C)CC2)C3(C)C)cc1

BIRTHDAY: 2018-12-01T14:11:43.938596
ATC: N07B
- NERVOUS SYSTEM
- OTHER NERVOUS SYSTEM DRUGS
- DRUGS USED IN ADDICTIVE DISORDERS
Synthesis Plan
FORMULA:C23H24Cl2N8O

SMILES: C[C@H](CN(C)C)NC(=O)Nc1cccc2nc(-c3ccn[nH]3)c(Nc3cc(Cl)ccc3Cl)nc12

BIRTHDAY: 2018-12-01T14:11:43.949866
ATC: N06A
- NERVOUS SYSTEM
- PSYCHOANALEPTICS
- ANTIDEPRESSANTS
Synthesis Plan
FORMULA:C22H25N7O

SMILES: CC(C)C[C@H](Nc1ccnc(Nc2ccc(C#N)cc2)n1)C(=O)N1CCC[C@H]1C#N

BIRTHDAY: 2018-12-01T14:11:43.959860
ATC: J05A
- ANTIINFECTIVES FOR SYSTEMIC USE
- ANTIVIRALS FOR SYSTEMIC USE
- DIRECT ACTING ANTIVIRALS
Synthesis Plan
FORMULA:C19H26N6O3

SMILES: CC(C)C[C@@H](Nc1cnc(NC(=O)c2ccncc2NC(C)C)nc1)C(=O)O

BIRTHDAY: 2018-12-01T14:11:43.969316
ATC: P01B
- ANTIPARASITIC PRODUCTS, INSECTICIDES AND REPELLENTS
- ANTIPROTOZOALS
- ANTIMALARIALS
Synthesis Plan
FORMULA:C23H36N6O

SMILES: CC(C)C[C@H](Nc1nccc(NC(=O)c2cccc(NC(C)(C)C)n2)n1)C(C)(C)C

BIRTHDAY: 2018-12-01T14:11:43.978276
ATC: C09A
- CARDIOVASCULAR SYSTEM
- AGENTS ACTING ON THE RENIN-ANGIOTENSIN SYSTEM
- ACE INHIBITORS, PLAIN
Synthesis Plan
FORMULA:C24H26N8S

SMILES: CC(C)C[C@@H](Nc1cncnc1Nc1ccncc1-c1cc[nH]n1)[C@]12C=CC=C[C@H]1SC=N2

BIRTHDAY: 2018-12-01T14:11:43.991029
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C23H31N3O3

SMILES: COc1cccc([C@]2(N)C=CCCCCN[C@@]3(OC)C=CC=C[C@H]3NCC2=O)c1

BIRTHDAY: 2018-12-01T14:11:44.011936
ATC: J05A
- ANTIINFECTIVES FOR SYSTEMIC USE
- ANTIVIRALS FOR SYSTEMIC USE
- DIRECT ACTING ANTIVIRALS
Synthesis Plan
FORMULA:C21H28N6O3

SMILES: COc1cccc(C(=O)Nc2n[nH]c3c2N(C(=O)[C@]2(N)CCCCN2)C(C)(C)C3)c1

BIRTHDAY: 2018-12-01T14:11:44.022090
ATC: D11A
- DERMATOLOGICALS
- OTHER DERMATOLOGICAL PREPARATIONS
- OTHER DERMATOLOGICAL PREPARATIONS
Synthesis Plan
FORMULA:C20H19N3O3S

SMILES: COc1ccc(C(=O)NCCc2ccc(C(=O)Nc3nccs3)cc2)cc1

BIRTHDAY: 2018-12-01T14:11:44.030690
ATC: C01E
- CARDIOVASCULAR SYSTEM
- CARDIAC THERAPY
- OTHER CARDIAC PREPARATIONS
Synthesis Plan
FORMULA:C27H29N7O2

SMILES: COc1ccc(-c2n[nH]cc2-c2ccnc(Nc3ccc(C(=O)NC4CCN(C)CC4)cc3)n2)cc1

BIRTHDAY: 2018-12-01T14:11:44.041495
ATC: M01A
- MUSCULO-SKELETAL SYSTEM
- ANTIINFLAMMATORY AND ANTIRHEUMATIC PRODUCTS
- ANTIINFLAMMATORY AND ANTIRHEUMATIC PRODUCTS, NON-STEROIDS
Synthesis Plan
FORMULA:C19H16F2N4O2

SMILES: COCC(=O)Nc1cccc(-c2cc(Nc3ccc(F)c(F)c3)ncn2)c1

BIRTHDAY: 2018-12-01T14:11:44.063674
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C17H25N7O

SMILES: Cc1cn[nH]c1Nc1ncc(N[C@@H](CC(C)C)C2CC2)c(C(N)=O)n1

BIRTHDAY: 2018-12-01T14:11:44.072459
ATC: C10A
- CARDIOVASCULAR SYSTEM
- LIPID MODIFYING AGENTS
- LIPID MODIFYING AGENTS, PLAIN
Synthesis Plan
FORMULA:C22H31N7

SMILES: CC(C)C[C@@H](Nc1ccnc(Nc2cc(-c3cnn(C)c3)ccn2)n1)C(C)(C)C

BIRTHDAY: 2018-12-01T14:11:44.082032
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C24H24FN5O6S

SMILES: CN(C)C[C@@H](NC(=O)Nc1ccccc1[C@]12N=CC=C[C@]1(S(=O)(=O)c1cccc(F)c1)N=CO2)C(=O)O

BIRTHDAY: 2018-12-25T02:03:45.507824
ATC: L04A
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- IMMUNOSUPPRESSANTS
- IMMUNOSUPPRESSANTS
Synthesis Plan
FORMULA:C16H14O4

SMILES: O=C1COCc2cccc(OCc3ccccc3)c2O1

BIRTHDAY: 2018-12-25T02:03:45.515115
ATC: G01A
- GENITO URINARY SYSTEM AND SEX HORMONES
- GYNECOLOGICAL ANTIINFECTIVES AND ANTISEPTICS
- ANTIINFECTIVES AND ANTISEPTICS, EXCL. COMBINATIONS WITH CORTICOSTEROIDS
Synthesis Plan
FORMULA:C27H33N3O2S

SMILES: CN(CC(=O)Nc1nc(-c2ccc(C(C)(C)C)cc2)cs1)C(=O)c1ccc(C(C)(C)C)cc1

BIRTHDAY: 2018-12-25T02:03:45.524621
ATC: M01A
- MUSCULO-SKELETAL SYSTEM
- ANTIINFLAMMATORY AND ANTIRHEUMATIC PRODUCTS
- ANTIINFLAMMATORY AND ANTIRHEUMATIC PRODUCTS, NON-STEROIDS
Synthesis Plan
FORMULA:C30H39FN4O

SMILES: O=C1CN([C@H]2CCCCN2C2CCCCCCC2)[C@]2(NC3(c4ccccc4F)CC3)C=CC=CC2=N1

BIRTHDAY: 2018-12-25T02:03:45.536572
ATC: C10A
- CARDIOVASCULAR SYSTEM
- LIPID MODIFYING AGENTS
- LIPID MODIFYING AGENTS, PLAIN
Synthesis Plan
FORMULA:C22H31N7O2

SMILES: CC(C)C[C@H](Nc1cnc(NC(=O)c2cc(NC(C)(C)C)ccn2)nc1)C1=CNOC1

BIRTHDAY: 2018-12-25T02:03:45.546530
ATC: N05A
- NERVOUS SYSTEM
- PSYCHOLEPTICS
- ANTIPSYCHOTICS
Synthesis Plan
FORMULA:C23H36N6O

SMILES: CC(C)C[C@@H](Nc1cncnc1NC(=O)c1ccncc1NC(C)(C)C)C(C)(C)C

BIRTHDAY: 2018-12-25T02:03:45.555794
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C23H36N6O

SMILES: CC(C)C[C@@H](Nc1nccc(NC(=O)c2cccc(NC(C)(C)C)n2)n1)C(C)(C)C

BIRTHDAY: 2018-12-25T02:03:45.564846
ATC: C09A
- CARDIOVASCULAR SYSTEM
- AGENTS ACTING ON THE RENIN-ANGIOTENSIN SYSTEM
- ACE INHIBITORS, PLAIN
Synthesis Plan
FORMULA:C18H18F3N3O3

SMILES: O=C1CCC(c2ccccc2Nc2cncnc2C(F)(F)F)(C(O)O)CC1

BIRTHDAY: 2018-12-25T02:03:45.574847
ATC: D10A
- DERMATOLOGICALS
- ANTI-ACNE PREPARATIONS
- ANTI-ACNE PREPARATIONS FOR TOPICAL USE
Synthesis Plan
FORMULA:C22H27ClN4O

SMILES: CN(C)C[C@@H](NC(=O)Nc1ccc2c(c1)[C@@H]1CC[C@@]2(C)N1)c1ccc(Cl)cc1

BIRTHDAY: 2018-12-25T02:03:45.583727
ATC: R05D
- RESPIRATORY SYSTEM
- COUGH AND COLD PREPARATIONS
- COUGH SUPPRESSANTS, EXCL. COMBINATIONS WITH EXPECTORANTS
Synthesis Plan
FORMULA:C23H24Cl2N8O

SMILES: C[C@@H](CN(C)C)NC(=O)Nc1cccc2nc(-c3ccn[nH]3)c(Nc3cc(Cl)ccc3Cl)nc12

BIRTHDAY: 2018-12-25T02:03:45.595127
ATC: N06A
- NERVOUS SYSTEM
- PSYCHOANALEPTICS
- ANTIDEPRESSANTS
Synthesis Plan
FORMULA:C24H24N8S

SMILES: CC(C)C[C@@H](Nc1ccnc(Nc2ccc(-c3cn[nH]c3)cn2)n1)c1nc2ccccc2s1

BIRTHDAY: 2018-12-25T02:03:45.606229
ATC: J05A
- ANTIINFECTIVES FOR SYSTEMIC USE
- ANTIVIRALS FOR SYSTEMIC USE
- DIRECT ACTING ANTIVIRALS
Synthesis Plan
FORMULA:C21H19N7O2

SMILES: C=CC(=O)N1CC[C@@H](c2cn[nH]c2NC(=O)c2cn[nH]c2-c2ccccc2C#N)C1

BIRTHDAY: 2018-12-25T02:03:45.616564
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C22H34N6O2

SMILES: CC(C)Nc1cnccc1C(=O)Nc1ncncc1N[C@@H](CC(C)(C)O)C(C)(C)C

BIRTHDAY: 2018-12-25T02:03:45.626661
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C21H24O5

SMILES: COC(=O)[C@]1(c2ccccc2)C(=O)C(=O)C(=O)[C@H]2[C@@H](C)C[C@@H](C)C[C@@]21C

BIRTHDAY: 2018-12-25T02:03:45.635540
ATC: S01E
- SENSORY ORGANS
- OPHTHALMOLOGICALS
- ANTIGLAUCOMA PREPARATIONS AND MIOTICS
Synthesis Plan
FORMULA:C24H25N5

SMILES: CN(CC1(c2ccccc2N)CC1)c1ncc2c(ccn2Cc2ccccc2)n1

BIRTHDAY: 2018-12-25T02:03:45.644691
ATC: D01A
- DERMATOLOGICALS
- ANTIFUNGALS FOR DERMATOLOGICAL USE
- ANTIFUNGALS FOR TOPICAL USE
Synthesis Plan
FORMULA:C22H19ClN4O2S

SMILES: COc1ccc(-c2cc(C(=O)Nc3nc(C)c(C)s3)nn2-c2ccccc2Cl)cc1

BIRTHDAY: 2018-12-25T02:03:45.654665
ATC: N02B
- NERVOUS SYSTEM
- ANALGESICS
- OTHER ANALGESICS AND ANTIPYRETICS
Synthesis Plan
FORMULA:C21H19F4N5O

SMILES: COCC1(c2ccc(Nc3ncc(F)c(Nc4ccc(C(F)(F)F)nc4)n3)cc2)CC1

BIRTHDAY: 2018-12-25T02:03:45.665209
ATC: N05A
- NERVOUS SYSTEM
- PSYCHOLEPTICS
- ANTIPSYCHOTICS
Synthesis Plan
FORMULA:C16H22N6O2

SMILES: CC(C)C[C@@H](Nc1nccc(Nc2cc(C3CC3)[nH]n2)n1)C(=O)O

BIRTHDAY: 2018-12-25T02:03:45.685437
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C26H29N7O3

SMILES: CC(C)Oc1cncc(-c2noc(-c3ccccc3NC(=O)N[C@H](CN(C)C)c3ccccc3)n2)n1

BIRTHDAY: 2018-12-25T02:03:45.697406
ATC: R05D
- RESPIRATORY SYSTEM
- COUGH AND COLD PREPARATIONS
- COUGH SUPPRESSANTS, EXCL. COMBINATIONS WITH EXPECTORANTS
Synthesis Plan
FORMULA:C23H27N7O3

SMILES: Cn1nc(C(N)=O)c2c1-c1nc(Nc3cccc(C4(C(O)O)CCNCC4)c3)ncc1CC2

BIRTHDAY: 2018-12-03T02:39:51.716622
ATC: A10X
- ALIMENTARY TRACT AND METABOLISM
- DRUGS USED IN DIABETES
- OTHER DRUGS USED IN DIABETES
Synthesis Plan
FORMULA:C23H22N6S

SMILES: CC(C)C[C@@H](Nc1cc(Nc2cccc(C#N)c2)ncn1)c1nc2ccccc2s1

BIRTHDAY: 2018-12-03T02:39:51.726639
ATC: N06A
- NERVOUS SYSTEM
- PSYCHOANALEPTICS
- ANTIDEPRESSANTS
Synthesis Plan
FORMULA:C24H26N8S

SMILES: CC(C)C[C@@H](Nc1cncnc1Nc1ccncc1-c1ccn[nH]1)[C@@]12C=CC=C[C@@H]1SC=N2

BIRTHDAY: 2018-12-03T02:39:51.739445
ATC: N05A
- NERVOUS SYSTEM
- PSYCHOLEPTICS
- ANTIPSYCHOTICS
Synthesis Plan
FORMULA:C20H20ClN5O

SMILES: CN(C)CC(=O)Nc1cccc(-c2cc(Nc3cccc(Cl)c3)ncn2)c1

BIRTHDAY: 2018-12-03T02:39:51.748567
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C26H33N5

SMILES: CC(C)C[C@@H](Nc1ccnc(Nc2cccc(C#N)c2)n1)C12CC3CC(CC(C3)C1)C2

BIRTHDAY: 2018-12-03T02:39:51.758173
ATC: J05A
- ANTIINFECTIVES FOR SYSTEMIC USE
- ANTIVIRALS FOR SYSTEMIC USE
- DIRECT ACTING ANTIVIRALS
Synthesis Plan
FORMULA:C24H26N8S

SMILES: CC(C)C[C@@H](Nc1cncnc1Nc1ccncc1-c1ccn[nH]1)[C@]12C=CC=C[C@H]1SC=N2

BIRTHDAY: 2018-12-03T02:39:51.771003
ATC: N05A
- NERVOUS SYSTEM
- PSYCHOLEPTICS
- ANTIPSYCHOTICS
Synthesis Plan
FORMULA:C25H24N8OS

SMILES: CN(C)C[C@H](NC(=O)Nc1cccc2ncc(Nc3ccc4snnc4c3)nc12)c1ccccc1

BIRTHDAY: 2018-12-03T02:39:51.782282
ATC: V08C
- VARIOUS
- CONTRAST MEDIA
- MAGNETIC RESONANCE IMAGING CONTRAST MEDIA
Synthesis Plan
FORMULA:C14H11FTe

SMILES: Fc1cccc([C@@]23C=CC=CC2=C[Te]C3)c1

BIRTHDAY: 2018-12-03T02:39:51.788624
ATC: A11C
- ALIMENTARY TRACT AND METABOLISM
- VITAMINS
- VITAMIN A AND D, INCL. COMBINATIONS OF THE TWO
Synthesis Plan
FORMULA:C20H20ClN5O

SMILES: CN(C)CC(=O)Nc1cccc(-c2ccnc(Nc3cccc(Cl)c3)n2)c1

BIRTHDAY: 2018-12-03T02:39:51.797405
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C24H33N7

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

BIRTHDAY: 2018-12-03T02:39:51.807228
ATC: J01M
- ANTIINFECTIVES FOR SYSTEMIC USE
- ANTIBACTERIALS FOR SYSTEMIC USE
- QUINOLONE ANTIBACTERIALS
Synthesis Plan
FORMULA:C17H16Cl3FN2O

SMILES: CN(C)CC(=O)N[C@@H](c1ccccc1Cl)c1cc(Cl)c(F)cc1Cl

BIRTHDAY: 2018-12-03T02:39:51.816512
ATC: A16A
- ALIMENTARY TRACT AND METABOLISM
- OTHER ALIMENTARY TRACT AND METABOLISM PRODUCTS
- OTHER ALIMENTARY TRACT AND METABOLISM PRODUCTS
Synthesis Plan
FORMULA:C24H22F3N5O

SMILES: COCC1(c2cccc(Nc3ncc4c(n3)N(c3ccc(C(F)(F)F)cn3)CC=C4)c2)CC1

BIRTHDAY: 2018-12-03T02:39:51.827258
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C23H24Cl2N8O

SMILES: C[C@H](CN(C)C)NC(=O)Nc1ccc2nc(-c3cn[nH]c3)c(Nc3ccc(Cl)c(Cl)c3)nc2c1

BIRTHDAY: 2018-12-03T02:39:51.838681
ATC: C03C
- CARDIOVASCULAR SYSTEM
- DIURETICS
- HIGH-CEILING DIURETICS
Synthesis Plan
FORMULA:C21H17N5O2

SMILES: CN(C)CC(=O)Nc1ccc2c(c1)-c1c(-c3ccccc3C#N)n[nH]c1C2=O

BIRTHDAY: 2018-12-03T02:39:51.848401
ATC: N06A
- NERVOUS SYSTEM
- PSYCHOANALEPTICS
- ANTIDEPRESSANTS
Synthesis Plan
FORMULA:C22H25N7O

SMILES: CC(C)C[C@@H](Nc1cncnc1Nc1ccccc1C#N)C(=O)N1CC[C@H](C#N)C1

BIRTHDAY: 2018-12-03T02:39:51.858585
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C26H33N5

SMILES: CC(C)C[C@H](Nc1cncnc1Nc1ccccc1C#N)C1C2CC3CC(C2)CC1C3

BIRTHDAY: 2018-12-03T02:39:51.868156
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C24H24F3N5O

SMILES: COCC1(c2ccc(Nc3ncnc4c3CN(c3ccc(C(F)(F)F)cn3)CC4)cc2)CC1

BIRTHDAY: 2018-12-03T02:39:51.878570
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C24H26N8S

SMILES: CC(C)C[C@H](Nc1cncnc1Nc1ccncc1-c1ccn[nH]1)[C@@]12C=CC=C[C@H]1SC=N2

BIRTHDAY: 2018-12-03T02:39:51.902563
ATC: N05A
- NERVOUS SYSTEM
- PSYCHOLEPTICS
- ANTIPSYCHOTICS
Synthesis Plan
FORMULA:C18H17ClF3N3O3

SMILES: O=C1CCC(c2cccc(Cl)c2Nc2cncnc2C(F)(F)F)(C(O)O)CC1

BIRTHDAY: 2018-12-03T02:39:51.912962
ATC: D10A
- DERMATOLOGICALS
- ANTI-ACNE PREPARATIONS
- ANTI-ACNE PREPARATIONS FOR TOPICAL USE
Synthesis Plan
FORMULA:C22H30N4O2

SMILES: CC(C)[C@H](C)n1oc2c(NC(=O)N[C@@H](CN(C)C)c3ccccc3)cccc21

BIRTHDAY: 2018-11-30T03:41:47.444319
ATC: R05D
- RESPIRATORY SYSTEM
- COUGH AND COLD PREPARATIONS
- COUGH SUPPRESSANTS, EXCL. COMBINATIONS WITH EXPECTORANTS
Synthesis plan pending
FORMULA:C20H20ClN5O

SMILES: CN(C)CC(=O)Nc1ccc(-c2ccnc(Nc3cccc(Cl)c3)n2)cc1

BIRTHDAY: 2018-11-30T03:41:47.453219
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[C@@H](Nc1cnc(C(N)=O)nc1Nc1ccccc1-c1ccn[nH]1)C(C)C

BIRTHDAY: 2018-11-30T03:41:47.476380
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis plan pending
FORMULA:C22H28F3N3O

SMILES: CN(C)C[C@H](NC(=O)Nc1ccc(C(C)(C)C)cc1)c1ccc(C(F)(F)F)cc1

BIRTHDAY: 2018-11-30T03:41:47.485289
ATC: N05A
- NERVOUS SYSTEM
- PSYCHOLEPTICS
- ANTIPSYCHOTICS
Synthesis plan pending
FORMULA:C22H25FN6O

SMILES: CC(C)C[C@@H](Nc1nccc(-c2cn(C3CC3)c(-c3ccc(F)cc3)n2)n1)C(N)=O

BIRTHDAY: 2018-11-30T03:41:47.495050
ATC: A10B
- ALIMENTARY TRACT AND METABOLISM
- DRUGS USED IN DIABETES
- BLOOD GLUCOSE LOWERING DRUGS, EXCL. INSULINS
Synthesis plan pending
FORMULA:C29H27N5O4

SMILES: COc1cccc(C(=O)Nc2ncc3cc2COCC=CCOCc2cccc(c2)Nc2nccc-3n2)c1

BIRTHDAY: 2018-11-30T03:41:47.506422
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis plan pending
FORMULA:C19H13F3N6

SMILES: N#Cc1ccccc1-c1[nH]nc2c1C(Nc1ccc(C(F)(F)F)cc1)=NCN2

BIRTHDAY: 2018-11-30T03:41:47.516278
ATC: N06A
- NERVOUS SYSTEM
- PSYCHOANALEPTICS
- ANTIDEPRESSANTS
Synthesis plan pending
FORMULA:C17H20N6O

SMILES: CC(C)C[C@H](Nc1cc(Nc2cccc(C#N)c2)ncn1)C(N)=O

BIRTHDAY: 2018-11-30T03:41:47.543181
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis plan pending
FORMULA:C20H20ClN5O

SMILES: CN(C)CC(=O)Nc1ccc(-c2cncnc2Nc2ccccc2Cl)cc1

BIRTHDAY: 2018-11-30T03:41:47.552182
ATC: M01A
- MUSCULO-SKELETAL SYSTEM
- ANTIINFLAMMATORY AND ANTIRHEUMATIC PRODUCTS
- ANTIINFLAMMATORY AND ANTIRHEUMATIC PRODUCTS, NON-STEROIDS
Synthesis plan pending
FORMULA:C23H31N9S

SMILES: CC(C)C[C@H](Nc1nc(NCc2ccncc2)c2c(ncn2C2=CSC=N[C@H]2N)n1)C(C)C

BIRTHDAY: 2018-11-30T03:41:47.563132
ATC: N05A
- NERVOUS SYSTEM
- PSYCHOLEPTICS
- ANTIPSYCHOTICS
Synthesis plan pending
FORMULA:C21H30N8

SMILES: CC(C)C[C@@H](Nc1cncnc1Nc1ccnc(-c2n[nH]cc2N)c1)C(C)(C)C

BIRTHDAY: 2018-11-30T03:41:47.582859
ATC: H01B
- SYSTEMIC HORMONAL PREPARATIONS, EXCL. SEX HORMONES AND INSULINS
- PITUITARY AND HYPOTHALAMIC HORMONES AND ANALOGUES
- POSTERIOR PITUITARY LOBE HORMONES
Synthesis plan pending
FORMULA:C31H29N3O5

SMILES: O=C1C[C@@H]2c3ccccc3C(=O)N2Cc2cccc(c2)Oc2ccc3cccc(c3c2)N[C@@H](OCCO)CN1

BIRTHDAY: 2018-11-30T03:41:47.605956
ATC: N03A
- NERVOUS SYSTEM
- ANTIEPILEPTICS
- ANTIEPILEPTICS
Synthesis plan pending
FORMULA:C18H21N5O3S2

SMILES: CC(C)C[C@@H](Nc1cncnc1NC(=O)c1ccnc2c1CSCS2)C(=O)O

BIRTHDAY: 2018-11-30T03:41:47.616449
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis plan pending
FORMULA:C23H31N7O

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

BIRTHDAY: 2018-11-19T08:13:40.643705
ATC: N05A
- NERVOUS SYSTEM
- PSYCHOLEPTICS
- ANTIPSYCHOTICS
Synthesis plan pending
FORMULA:C23H31N7O

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

BIRTHDAY: 2018-11-19T08:13:40.675294
ATC: J01M
- ANTIINFECTIVES FOR SYSTEMIC USE
- ANTIBACTERIALS FOR SYSTEMIC USE
- QUINOLONE ANTIBACTERIALS
Synthesis plan pending
FORMULA:C22H33N7O

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

BIRTHDAY: 2018-11-19T08:13:40.685168
ATC: N06A
- NERVOUS SYSTEM
- PSYCHOANALEPTICS
- ANTIDEPRESSANTS
Synthesis plan pending
FORMULA:C14H14FN3O

SMILES: C[C@@H]1CCOC(c2ccnn2-c2ccc(F)cc2)=N1

BIRTHDAY: 2018-11-19T08:13:40.693059
ATC: L01A
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- ALKYLATING AGENTS
Synthesis plan pending
FORMULA:C22H34N8O

SMILES: CC(C)C[C@@H](Nc1nc(Nc2[nH]ncc2C2CC2)c2c(ncn2C(C)C)n1)C(C)(C)O

BIRTHDAY: 2018-11-19T08:13:40.703460
ATC: N05A
- NERVOUS SYSTEM
- PSYCHOLEPTICS
- ANTIPSYCHOTICS
Synthesis plan pending
FORMULA:C22H28F3N3O

SMILES: CN(C)C[C@@H](NC(=O)Nc1ccc(C(C)(C)C)cc1)c1ccc(C(F)(F)F)cc1

BIRTHDAY: 2018-11-19T08:13:40.712333
ATC: N05A
- NERVOUS SYSTEM
- PSYCHOLEPTICS
- ANTIPSYCHOTICS
Synthesis plan pending
FORMULA:C18H30N2O4

SMILES: CN(C)C[C@@H](N[C@H]1COCCOCCOCCO1)c1ccccc1

BIRTHDAY: 2018-11-19T08:13:40.720474
ATC: N06A
- NERVOUS SYSTEM
- PSYCHOANALEPTICS
- ANTIDEPRESSANTS
Synthesis plan pending
FORMULA:C26H29N7O3

SMILES: CC(C)Oc1cnc(-c2nc(-c3ccc(NC(=O)N[C@H](CN(C)C)c4ccccc4)cc3)no2)cn1

BIRTHDAY: 2018-11-19T08:13:40.731491
ATC: C02K
- CARDIOVASCULAR SYSTEM
- ANTIHYPERTENSIVES
- OTHER ANTIHYPERTENSIVES
Synthesis plan pending
FORMULA:C23H24N6S

SMILES: CC(C)C[C@@H](Nc1cncnc1Nc1ccccc1C#N)[C@@]12C=CC=C[C@@H]1SC=N2

BIRTHDAY: 2018-11-19T08:13:40.742721
ATC: N05A
- NERVOUS SYSTEM
- PSYCHOLEPTICS
- ANTIPSYCHOTICS
Synthesis plan pending
FORMULA:C20H25FN6O2

SMILES: CC1(C)CN(C(=O)[C@@]2(N)CCCCN2)c2c(NC(=O)c3cccc(F)c3)n[nH]c21

BIRTHDAY: 2018-11-19T08:13:40.753037
ATC: C09C
- CARDIOVASCULAR SYSTEM
- AGENTS ACTING ON THE RENIN-ANGIOTENSIN SYSTEM
- ANGIOTENSIN II ANTAGONISTS, PLAIN
Synthesis plan pending
FORMULA:C29H29FN4O3

SMILES: C=C(C(=O)N1CCCC[C@@H]1N1C(=O)CN=C2C=CC=C[C@]21NC1(c2ccccc2F)CC1)c1ccoc1

BIRTHDAY: 2018-11-19T08:13:40.765222
ATC: C03X
- CARDIOVASCULAR SYSTEM
- DIURETICS
- OTHER DIURETICS
Synthesis plan pending
FORMULA:C22H28N8O2

SMILES: COC[C@@H](C)Nc1nc(NCc2ccc(-c3noc(C)n3)cc2)c2ncn(C(C)C)c2n1

BIRTHDAY: 2018-11-19T08:13:40.775909
ATC: A10B
- ALIMENTARY TRACT AND METABOLISM
- DRUGS USED IN DIABETES
- BLOOD GLUCOSE LOWERING DRUGS, EXCL. INSULINS
Synthesis plan pending
FORMULA:C16H22N6O2

SMILES: CC(C)C[C@@H](Nc1cncnc1Nc1cn[nH]c1C1CC1)C(=O)O

BIRTHDAY: 2018-11-19T08:13:40.785053
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis plan pending
FORMULA:C26H33N5

SMILES: CC(C)C[C@H](Nc1ccnc(Nc2cccc(C#N)c2)n1)C12CC3CC(CC(C3)C1)C2

BIRTHDAY: 2018-11-19T08:13:40.794617
ATC: J05A
- ANTIINFECTIVES FOR SYSTEMIC USE
- ANTIVIRALS FOR SYSTEMIC USE
- DIRECT ACTING ANTIVIRALS
Synthesis plan pending
FORMULA:C23H24N6S

SMILES: CC(C)C[C@H](Nc1ncncc1Nc1ccc(C#N)cc1)[C@@]12C=CC=C[C@@H]1N=CS2

BIRTHDAY: 2018-11-19T08:13:40.814898
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis plan pending
FORMULA:C27H30N8O4S

SMILES: COC[C@@H](c1ccccc1)c1ccccc1Nc1sc2nc1-c1nnn(n1)CCNC(=O)C(=O)OCCCNC2

BIRTHDAY: 2018-11-19T08:13:40.827917
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis plan pending
FORMULA:C26H37F2N5O

SMILES: CC1=C2NN=C[C@@]2(NC(=O)c2cc(F)ccc2F)N2CCC1(N[C@@H](CC(C)C)C(C)(C)C)CC2

BIRTHDAY: 2018-11-19T08:13:40.847319
ATC: A03A
- ALIMENTARY TRACT AND METABOLISM
- DRUGS FOR FUNCTIONAL GASTROINTESTINAL DISORDERS
- DRUGS FOR FUNCTIONAL GASTROINTESTINAL DISORDERS
Synthesis plan pending
FORMULA:C24H26N8S

SMILES: CC(C)C[C@H](Nc1cncnc1Nc1ccncc1-c1ccn[nH]1)[C@@]12C=CC=C[C@@H]1SC=N2

BIRTHDAY: 2018-11-19T08:13:40.860081
ATC: N05A
- NERVOUS SYSTEM
- PSYCHOLEPTICS
- ANTIPSYCHOTICS
Synthesis plan pending
FORMULA:C26H33N5

SMILES: CC(C)C[C@@H](Nc1cncnc1Nc1ccccc1C#N)C1C2CC3CC(C2)CC1C3

BIRTHDAY: 2018-11-19T08:13:40.882338
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis plan pending
FORMULA:C8H13N3O

SMILES: CN(C)CC(=O)Nc1c[cH-]c[nH+]1

BIRTHDAY: 2018-11-19T08:13:40.888630
ATC: C03C
- CARDIOVASCULAR SYSTEM
- DIURETICS
- HIGH-CEILING DIURETICS
Synthesis plan pending
FORMULA:C23H24Cl2N8O

SMILES: C[C@H](CN(C)C)NC(=O)Nc1ccc2nc(-c3cn[nH]c3)c(Nc3ccc(Cl)cc3Cl)nc2c1

BIRTHDAY: 2018-11-19T08:13:40.900007
ATC: C02K
- CARDIOVASCULAR SYSTEM
- ANTIHYPERTENSIVES
- OTHER ANTIHYPERTENSIVES
Synthesis plan pending
FORMULA:C23H36N6O

SMILES: CC(C)C[C@H](Nc1cc(NC(=O)c2cccc(NC(C)(C)C)n2)ncn1)C(C)(C)C

BIRTHDAY: 2018-11-19T08:13:40.922013
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis plan pending
FORMULA:C22H25N7O

SMILES: CC(C)C[C@@H](Nc1cnc(Nc2ccc(C#N)cc2)nc1)C(=O)N1CC[C@H](C#N)C1

BIRTHDAY: 2018-11-19T08:13:40.945347
ATC: L02B
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ENDOCRINE THERAPY
- HORMONE ANTAGONISTS AND RELATED AGENTS
Synthesis plan pending
FORMULA:C17H20N6O

SMILES: CC(C)C[C@H](Nc1cncnc1Nc1ccccc1C#N)C(N)=O

BIRTHDAY: 2018-11-19T08:13:40.953884
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis plan pending
FORMULA:C28H26Cl2N8O

SMILES: CN(C)C[C@H](NC(=O)Nc1ccc2nc(-c3cn[nH]c3)c(Nc3ccc(Cl)c(Cl)c3)nc2c1)c1ccccc1

BIRTHDAY: 2018-11-19T08:13:40.966139
ATC: C03C
- CARDIOVASCULAR SYSTEM
- DIURETICS
- HIGH-CEILING DIURETICS
Synthesis plan pending
FORMULA:C20H18FN5O3

SMILES: COc1ccc(C(=O)Nc2[nH]nc3c2CN(C(=O)Nc2cccc(F)c2)C3)cc1

BIRTHDAY: 2018-11-19T08:13:40.975930
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis plan pending
FORMULA:C20H25N7O2

SMILES: CNC(=O)CNC(=O)[C@@H](CC(C)C)Nc1cncnc1Nc1ccccc1C#N

BIRTHDAY: 2018-11-19T08:13:40.985544
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis plan pending
FORMULA:C22H21Cl2N3O3S

SMILES: CC(C)(C)c1ccc(NC(=O)c2csc(NC(=O)COc3c(Cl)cccc3Cl)n2)cc1

BIRTHDAY: 2018-11-19T08:13:40.995391
ATC: L02B
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ENDOCRINE THERAPY
- HORMONE ANTAGONISTS AND RELATED AGENTS
Synthesis plan pending
FORMULA:C29H27FN4O3

SMILES: O=C(/C=C\c1ccco1)N1CCC(n2c(=O)c(NC3(c4ccc(F)cc4)CC3)nc3ccccc32)CC1

BIRTHDAY: 2018-11-19T08:13:41.006915
ATC: A08A
- ALIMENTARY TRACT AND METABOLISM
- ANTIOBESITY PREPARATIONS, EXCL. DIET PRODUCTS
- ANTIOBESITY PREPARATIONS, EXCL. DIET PRODUCTS
Synthesis plan pending
FORMULA:C22H25N7O

SMILES: CC(C)C[C@H](Nc1cnc(Nc2cccc(C#N)c2)nc1)C(=O)N1CC[C@@H](C#N)C1

BIRTHDAY: 2018-11-19T08:13:41.016986
ATC: V08C
- VARIOUS
- CONTRAST MEDIA
- MAGNETIC RESONANCE IMAGING CONTRAST MEDIA
Synthesis plan pending
FORMULA:C24H32N8O3

SMILES: CC(C)n1cnc2nc(NCc3ccncc3)nc(N[C@@]3(C(C)C)NC4(CC4)COCOC3=O)c21

BIRTHDAY: 2018-11-19T08:13:41.031167
ATC: C03C
- CARDIOVASCULAR SYSTEM
- DIURETICS
- HIGH-CEILING DIURETICS
Synthesis plan pending
FORMULA:C23H24Cl2N8O

SMILES: C[C@@H](CN(C)C)NC(=O)Nc1ccc2nc(-c3cn[nH]c3)c(Nc3ccc(Cl)c(Cl)c3)nc2c1

BIRTHDAY: 2018-11-19T08:13:41.051635
ATC: C03C
- CARDIOVASCULAR SYSTEM
- DIURETICS
- HIGH-CEILING DIURETICS
Synthesis plan pending
FORMULA:C28H26Cl2N8O

SMILES: CN(C)C[C@@H](NC(=O)Nc1cccc2nc(-c3ccn[nH]3)c(Nc3c(Cl)cccc3Cl)nc12)c1ccccc1

BIRTHDAY: 2018-11-19T08:13:41.063967
ATC: N06A
- NERVOUS SYSTEM
- PSYCHOANALEPTICS
- ANTIDEPRESSANTS
Synthesis plan pending
FORMULA:C21H30N8O4

SMILES: CC(C)C[C@@H](Nc1cncnc1Nc1cn[nH]c1C1CC1)C(=O)N[C@@H](C(N)=O)[C@@H](C)C(=O)O

BIRTHDAY: 2018-11-19T08:13:41.075383
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis plan pending
FORMULA:C20H18FN5O3

SMILES: COc1cccc(C(=O)Nc2[nH]nc3c2N(C(=O)Nc2ccccc2F)CC3)c1

BIRTHDAY: 2018-11-19T08:13:41.085508
ATC: N02B
- NERVOUS SYSTEM
- ANALGESICS
- OTHER ANALGESICS AND ANTIPYRETICS
Synthesis plan pending
FORMULA:C26H26N8O3

SMILES: CN(C)C[C@H](NC(=O)Nc1ccc(-c2noc(-c3cnc(N4CC(=O)C4)cn3)n2)cc1)c1ccccc1

BIRTHDAY: 2018-11-19T08:13:41.097223
ATC: H01C
- SYSTEMIC HORMONAL PREPARATIONS, EXCL. SEX HORMONES AND INSULINS
- PITUITARY AND HYPOTHALAMIC HORMONES AND ANALOGUES
- HYPOTHALAMIC HORMONES
Synthesis plan pending
FORMULA:C17H20N6O

SMILES: CC(C)C[C@@H](Nc1cnc(Nc2ccccc2C#N)nc1)C(N)=O

BIRTHDAY: 2018-11-19T08:13:41.105659
ATC: N05A
- NERVOUS SYSTEM
- PSYCHOLEPTICS
- ANTIPSYCHOTICS
Synthesis plan pending
FORMULA:C26H33N5

SMILES: CC(C)C[C@H](Nc1cc(Nc2cccc(C#N)c2)ncn1)C12CC3CC(CC(C3)C1)C2

BIRTHDAY: 2018-11-19T08:13:41.115375
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis plan pending
FORMULA:C20H23N7O3

SMILES: CC1=CCOc2ccc(cc2)CN2N=C(N)N[C@H]2Cc2nc(C(N)=O)n(c2C)C1=O

BIRTHDAY: 2018-11-19T08:13:41.126414
ATC: A01A
- ALIMENTARY TRACT AND METABOLISM
- STOMATOLOGICAL PREPARATIONS
- STOMATOLOGICAL PREPARATIONS
Synthesis plan pending
FORMULA:C17H17F4N

SMILES: CN(C)C[C@H](c1cccc(F)c1)c1ccccc1C(F)(F)F

BIRTHDAY: 2018-11-19T08:13:41.134854
ATC: N04A
- NERVOUS SYSTEM
- ANTI-PARKINSON DRUGS
- ANTICHOLINERGIC AGENTS
Synthesis plan pending
FORMULA:C18H22N6O2

SMILES: Cc1nccnc1N1CC=Cc2nc(N[C@H](CC(C)C)C(=O)O)ncc21

BIRTHDAY: 2018-11-19T08:13:41.143944
ATC: B03B
- BLOOD AND BLOOD FORMING ORGANS
- ANTIANEMIC PREPARATIONS
- VITAMIN B12 AND FOLIC ACID
Synthesis plan pending
FORMULA:C19H23N7O

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

BIRTHDAY: 2018-11-19T08:13:41.153411
ATC: D01A
- DERMATOLOGICALS
- ANTIFUNGALS FOR DERMATOLOGICAL USE
- ANTIFUNGALS FOR TOPICAL USE
Synthesis plan pending
FORMULA:C17H14Cl2N4O2

SMILES: COc1ccc(-c2cc(NC(=O)Nc3c(Cl)cccc3Cl)[nH]n2)cc1

BIRTHDAY: 2018-11-19T08:13:41.162111
ATC: J01G
- ANTIINFECTIVES FOR SYSTEMIC USE
- ANTIBACTERIALS FOR SYSTEMIC USE
- AMINOGLYCOSIDE ANTIBACTERIALS
Synthesis plan pending
FORMULA:C28H32N4O3S

SMILES: CC1(C)Sc2c(C3CC3)n[nH]c2-c2c(OCC(=O)Nc3ccccc3CNC3(CO)CC3)cccc21

BIRTHDAY: 2018-11-19T08:13:41.191210
ATC: A10B
- ALIMENTARY TRACT AND METABOLISM
- DRUGS USED IN DIABETES
- BLOOD GLUCOSE LOWERING DRUGS, EXCL. INSULINS
Synthesis plan pending
FORMULA:C21H31N7O

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

BIRTHDAY: 2018-11-19T08:13:41.200850
ATC: P01A
- ANTIPARASITIC PRODUCTS, INSECTICIDES AND REPELLENTS
- ANTIPROTOZOALS
- AGENTS AGAINST AMOEBIASIS AND OTHER PROTOZOAL DISEASES
Synthesis plan pending
FORMULA:C24H24ClN5OS

SMILES: CN(C)C[C@@H](NC(=O)Nc1cccc2nc(Nc3cccc(Cl)c3)sc12)c1ccccc1

BIRTHDAY: 2018-11-19T08:13:41.222184
ATC: N05A
- NERVOUS SYSTEM
- PSYCHOLEPTICS
- ANTIPSYCHOTICS
Synthesis plan pending
FORMULA:C17H14Cl2N4O2

SMILES: COc1cccc(-c2[nH]ncc2NC(=O)Nc2ccc(Cl)cc2Cl)c1

BIRTHDAY: 2018-11-19T08:13:41.231132
ATC: A01A
- ALIMENTARY TRACT AND METABOLISM
- STOMATOLOGICAL PREPARATIONS
- STOMATOLOGICAL PREPARATIONS
Synthesis plan pending
FORMULA:C25H28ClN5O

SMILES: C=CC(=O)N1CCC[C@H](n2ccc3ncnc(N(C)CC4(c5ccccc5Cl)CC4)c32)C1

BIRTHDAY: 2018-11-19T08:13:41.242332
ATC: C02K
- CARDIOVASCULAR SYSTEM
- ANTIHYPERTENSIVES
- OTHER ANTIHYPERTENSIVES
Synthesis plan pending
FORMULA:C20H22Cl2N6O

SMILES: C[C@H](CN(C)C)NC(=O)Nc1ccc2ncc(Nc3ccc(Cl)c(Cl)c3)nc2c1

BIRTHDAY: 2018-11-19T08:13:41.252130
ATC: C03C
- CARDIOVASCULAR SYSTEM
- DIURETICS
- HIGH-CEILING DIURETICS
Synthesis plan pending
FORMULA:C19H29N3O5

SMILES: Cc1ccc(C)c(NC(=O)N[C@H](CC(C)C)C(=O)N[C@@H]2OC[C@H](O)[C@H]2O)c1

BIRTHDAY: 2018-11-19T08:13:41.261717
ATC: A10B
- ALIMENTARY TRACT AND METABOLISM
- DRUGS USED IN DIABETES
- BLOOD GLUCOSE LOWERING DRUGS, EXCL. INSULINS
Synthesis plan pending
FORMULA:C18H18N4O2

SMILES: COc1cccc(C(=O)N[C@H](C)c2n[nH]cc2-c2ccccn2)c1

BIRTHDAY: 2018-11-19T08:13:41.290719
ATC: V08C
- VARIOUS
- CONTRAST MEDIA
- MAGNETIC RESONANCE IMAGING CONTRAST MEDIA
Synthesis plan pending
FORMULA:C31H51N9O2

SMILES: Cc1cc(N[C@@H]2C=CCCCCCCNCCNC2=O)nc(N[C@@H](CC(C)C)C(=O)N[C@H](Cc2cnc[nH]2)C(C)C)n1

BIRTHDAY: 2018-11-19T08:13:41.303141
ATC: J05A
- ANTIINFECTIVES FOR SYSTEMIC USE
- ANTIVIRALS FOR SYSTEMIC USE
- DIRECT ACTING ANTIVIRALS
Synthesis plan pending
FORMULA:C23H24Cl2N8O

SMILES: C[C@H](CN(C)C)NC(=O)Nc1cccc2nc(-c3cc[nH]n3)c(Nc3cc(Cl)ccc3Cl)nc12

BIRTHDAY: 2018-11-19T08:13:41.314456
ATC: M03B
- MUSCULO-SKELETAL SYSTEM
- MUSCLE RELAXANTS
- MUSCLE RELAXANTS, CENTRALLY ACTING AGENTS
Synthesis plan pending
FORMULA:C20H18FN5O3

SMILES: COc1ccc(C(=O)Nc2[nH]nc3c2CN(C(=O)Nc2ccc(F)cc2)C3)cc1

BIRTHDAY: 2018-11-19T08:13:41.324224
ATC: J01F
- ANTIINFECTIVES FOR SYSTEMIC USE
- ANTIBACTERIALS FOR SYSTEMIC USE
- MACROLIDES, LINCOSAMIDES AND STREPTOGRAMINS
Synthesis plan pending
FORMULA:C26H29N3O2

SMILES: CN(C)C[C@H](NC(=O)Nc1ccc2c(c1)C=CC(=O)C=CCCC=C2)c1ccccc1

BIRTHDAY: 2018-11-19T08:13:41.333124
ATC: C03B
- CARDIOVASCULAR SYSTEM
- DIURETICS
- LOW-CEILING DIURETICS, EXCL. THIAZIDES
Synthesis plan pending
FORMULA:C22H25N7O

SMILES: CC(C)C[C@@H](Nc1ccnc(Nc2ccc(C#N)cc2)n1)C(=O)N1CCC[C@@H]1C#N

BIRTHDAY: 2018-11-19T08:13:41.354270
ATC: J05A
- ANTIINFECTIVES FOR SYSTEMIC USE
- ANTIVIRALS FOR SYSTEMIC USE
- DIRECT ACTING ANTIVIRALS
Synthesis plan pending
FORMULA:C23H24Cl2N8O

SMILES: C[C@@H](CN(C)C)NC(=O)Nc1cccc2nc(-c3ccn[nH]3)c(Nc3cc(Cl)cc(Cl)c3)nc12

BIRTHDAY: 2018-11-19T08:13:41.376643
ATC: N03A
- NERVOUS SYSTEM
- ANTIEPILEPTICS
- ANTIEPILEPTICS
Synthesis plan pending
FORMULA:C20H20ClN5O

SMILES: CN(C)CC(=O)Nc1ccccc1-c1cncnc1Nc1ccccc1Cl

BIRTHDAY: 2018-11-19T08:13:41.385575
ATC: D11A
- DERMATOLOGICALS
- OTHER DERMATOLOGICAL PREPARATIONS
- OTHER DERMATOLOGICAL PREPARATIONS
Synthesis plan pending
FORMULA:C25H28Cl2N8O2

SMILES: C[C@H](O)[C@@H](CN(C)C)NC(=O)Nc1ccc2nc(-c3cnn(C)c3)c(Nc3ccc(Cl)cc3Cl)nc2c1

BIRTHDAY: 2018-11-19T08:13:41.406891
ATC: C03B
- CARDIOVASCULAR SYSTEM
- DIURETICS
- LOW-CEILING DIURETICS, EXCL. THIAZIDES
Synthesis plan pending
FORMULA:C21H17N5O2

SMILES: CN(C)CC(=O)Nc1cccc2c1-c1[nH]nc(-c3ccc(C#N)cc3)c1C2=O

BIRTHDAY: 2018-11-19T08:13:41.415879
ATC: A10B
- ALIMENTARY TRACT AND METABOLISM
- DRUGS USED IN DIABETES
- BLOOD GLUCOSE LOWERING DRUGS, EXCL. INSULINS
Synthesis plan pending
FORMULA:C29H36FN5O

SMILES: CN(C)C[C@H](N[C@]1(C(N)=O)C=CCCCCC=C[C@]2(c3cccc(F)c3)N=CN[C@@H]12)c1ccccc1

BIRTHDAY: 2018-11-30T17:24:08.958201
ATC: A03A
- ALIMENTARY TRACT AND METABOLISM
- DRUGS FOR FUNCTIONAL GASTROINTESTINAL DISORDERS
- DRUGS FOR FUNCTIONAL GASTROINTESTINAL DISORDERS
Synthesis Plan
FORMULA:C17H19FN4O3

SMILES: CC(C)C[C@H](Nc1nccc(NC(=O)c2ccc(F)cc2)n1)C(=O)O

BIRTHDAY: 2018-11-30T17:24:08.975811
ATC: N07C
- NERVOUS SYSTEM
- OTHER NERVOUS SYSTEM DRUGS
- ANTIVERTIGO PREPARATIONS
Synthesis Plan
FORMULA:C25H32N8O2

SMILES: CC(C)C[C@H](Nc1cc(Nc2ccc3c(n2)Nc2cccc(c2)NCCNCC3)ncn1)C(=O)O

BIRTHDAY: 2018-11-30T17:24:08.987046
ATC: C09C
- CARDIOVASCULAR SYSTEM
- AGENTS ACTING ON THE RENIN-ANGIOTENSIN SYSTEM
- ANGIOTENSIN II ANTAGONISTS, PLAIN
Synthesis Plan
FORMULA:C20H23N3O2

SMILES: COC(=O)[C@]1(c2ccccc2)CCCCN1c1ccccc1C(=N)N

BIRTHDAY: 2018-11-30T17:24:08.995454
ATC: C03C
- CARDIOVASCULAR SYSTEM
- DIURETICS
- HIGH-CEILING DIURETICS
Synthesis Plan
FORMULA:C22H29FN8O

SMILES: CN(C1=CN[C@@]2(c3cccc(F)c3)N=CN[C@H]2N1)[C@@]1(C(N)=O)[C@H]2C[C@@H]3CN(CCN1C3)C2

BIRTHDAY: 2018-11-30T17:24:09.017675
ATC: C08E
- CARDIOVASCULAR SYSTEM
- CALCIUM CHANNEL BLOCKERS
- NON-SELECTIVE CALCIUM CHANNEL BLOCKERS
Synthesis Plan
FORMULA:C36H48N10O

SMILES: CC(C)C[C@@H](Nc1cncnc1Nc1ccccc1C#N)C(=O)N1CCC[C@@]12CNCCN1C=C(C=CC3=CN(CCN2)CC3)CC1

BIRTHDAY: 2018-11-30T17:24:09.044873
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C23H35N7O

SMILES: Cc1cnccc1CNc1nc(N[C@@H](CC(C)C)C(C)(C)O)nc2ncn(C(C)C)c12

BIRTHDAY: 2018-11-30T17:24:09.075375
ATC: C09D
- CARDIOVASCULAR SYSTEM
- AGENTS ACTING ON THE RENIN-ANGIOTENSIN SYSTEM
- ANGIOTENSIN II ANTAGONISTS, COMBINATIONS
Synthesis Plan
FORMULA:C25H22ClF2N3O2

SMILES: CN(CC1(c2ccccc2N)CC1)C(=O)c1cc(Cl)cc(C(=O)Nc2cc(F)cc(F)c2)c1

BIRTHDAY: 2018-11-30T17:24:09.085416
ATC: N05A
- NERVOUS SYSTEM
- PSYCHOLEPTICS
- ANTIPSYCHOTICS
Synthesis Plan
FORMULA:C26H26N4O5

SMILES: COC(=O)c1ccccc1C(=O)Nc1ccccc1C(=O)Nc1ccncc1NC(=O)C(C)(C)C

BIRTHDAY: 2018-11-30T17:24:09.116292
ATC: N01A
- NERVOUS SYSTEM
- ANESTHETICS
- ANESTHETICS, GENERAL
Synthesis Plan
FORMULA:C28H26Cl2N8O

SMILES: CN(C)C[C@@H](NC(=O)Nc1ccc2nc(-c3cn[nH]c3)c(Nc3ccc(Cl)c(Cl)c3)nc2c1)c1ccccc1

BIRTHDAY: 2018-11-30T17:24:09.128482
ATC: C03C
- CARDIOVASCULAR SYSTEM
- DIURETICS
- HIGH-CEILING DIURETICS
Synthesis Plan
FORMULA:C20H31N3

SMILES: CC(C)C[C@H](NC1(N)C2CC3CC1CC(C2)N3)c1ccccc1

BIRTHDAY: 2018-11-30T17:24:09.136137
ATC: S01F
- SENSORY ORGANS
- OPHTHALMOLOGICALS
- MYDRIATICS AND CYCLOPLEGICS
Synthesis Plan
FORMULA:C23H22FN3O2

SMILES: CC(C)C[C@H](c1ccccc1)N1NC(=O)C=Cc2c1[nH]c(=O)c1ccc(F)cc21

BIRTHDAY: 2018-11-30T17:24:09.145318
ATC: R06A
- RESPIRATORY SYSTEM
- ANTIHISTAMINES FOR SYSTEMIC USE
- ANTIHISTAMINES FOR SYSTEMIC USE
Synthesis Plan
FORMULA:C25H24Cl2N6O

SMILES: CN(C)C[C@@H](NC(=O)Nc1cccc2ncc(Nc3cccc(Cl)c3Cl)nc12)c1ccccc1

BIRTHDAY: 2018-12-02T16:07:17.512226
ATC: M01A
- MUSCULO-SKELETAL SYSTEM
- ANTIINFLAMMATORY AND ANTIRHEUMATIC PRODUCTS
- ANTIINFLAMMATORY AND ANTIRHEUMATIC PRODUCTS, NON-STEROIDS
Synthesis Plan
FORMULA:C23H30N6O3

SMILES: COC(=O)c1ccc(CNc2nc(NC3CCC(O)CC3)nc3c2ncn3C(C)C)cc1

BIRTHDAY: 2018-12-02T16:07:17.531718
ATC: A10B
- ALIMENTARY TRACT AND METABOLISM
- DRUGS USED IN DIABETES
- BLOOD GLUCOSE LOWERING DRUGS, EXCL. INSULINS
Synthesis Plan
FORMULA:C30H42N8O

SMILES: CC(C)C[C@H](Nc1ccnc(Nc2ccc3c(c2)[C@@H]2C[C@H]4CC[C@H]2N(CC3)C4=O)n1)[C@H]1NCN2CNC[C@H]1C2

BIRTHDAY: 2018-12-02T16:07:17.553639
ATC: J05A
- ANTIINFECTIVES FOR SYSTEMIC USE
- ANTIVIRALS FOR SYSTEMIC USE
- DIRECT ACTING ANTIVIRALS
Synthesis Plan
FORMULA:C21H27FN4O2S

SMILES: CCCNC(=O)[C@@H](CC(C)C)N1SCCC(=O)c2cnn(-c3ccc(F)cc3)c21

BIRTHDAY: 2018-12-02T16:07:17.575965
ATC: N01B
- NERVOUS SYSTEM
- ANESTHETICS
- ANESTHETICS, LOCAL
Synthesis Plan
FORMULA:C18H17F4N3O3

SMILES: O=C1CCCC[C@]1(c1cccc(F)c1Nc1cnc(C(F)(F)F)nc1)C(O)O

BIRTHDAY: 2018-12-02T16:07:17.586445
ATC: D01A
- DERMATOLOGICALS
- ANTIFUNGALS FOR DERMATOLOGICAL USE
- ANTIFUNGALS FOR TOPICAL USE
Synthesis Plan
FORMULA:C23H31N11

SMILES: Cc1cnn(-c2nc3nc(Nc4[nH]ncc4C4CC4)nc(N[C@H](CC(C)C)C4CC4)c3[nH]2)c1N

BIRTHDAY: 2018-12-02T16:07:17.598075
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C25H21ClN4O

SMILES: CN(CC1(c2ccc(Cl)cc2)CC1)c1ncnc2[nH]c3c(c12)Cc1ccccc1C3=O

BIRTHDAY: 2018-12-02T16:07:17.618194
ATC: M01A
- MUSCULO-SKELETAL SYSTEM
- ANTIINFLAMMATORY AND ANTIRHEUMATIC PRODUCTS
- ANTIINFLAMMATORY AND ANTIRHEUMATIC PRODUCTS, NON-STEROIDS
Synthesis Plan
FORMULA:C24H26N8S

SMILES: CC(C)C[C@@H](Nc1cncnc1Nc1ccncc1-c1ccn[nH]1)[C@@]12C=CC=C[C@H]1SC=N2

BIRTHDAY: 2018-12-02T16:07:17.631018
ATC: N05A
- NERVOUS SYSTEM
- PSYCHOLEPTICS
- ANTIPSYCHOTICS
Synthesis Plan
FORMULA:C25H30N2

SMILES: CC(C)CC1=CN(CCCc2ccccc2)CCc2c1[nH]c1ccccc21

BIRTHDAY: 2018-12-02T16:07:17.639150
ATC: C04A
- CARDIOVASCULAR SYSTEM
- PERIPHERAL VASODILATORS
- PERIPHERAL VASODILATORS
Synthesis Plan
FORMULA:C20H20F3N5O

SMILES: CN(C)C[C@@H](NC(=O)Nc1cccc2nccnc12)c1ccccc1C(F)(F)F

BIRTHDAY: 2018-12-02T16:07:17.649257
ATC: N01A
- NERVOUS SYSTEM
- ANESTHETICS
- ANESTHETICS, GENERAL
Synthesis Plan
FORMULA:C24H33N7O

SMILES: CC(C)n1cnc2c(Nc3ccc(C#N)cc3)nc(N[C@H](CC(C)(C)O)C(C)(C)C)nc21

BIRTHDAY: 2018-12-02T16:07:17.659627
ATC: J01M
- ANTIINFECTIVES FOR SYSTEMIC USE
- ANTIBACTERIALS FOR SYSTEMIC USE
- QUINOLONE ANTIBACTERIALS
Synthesis Plan
FORMULA:C17H20N3P

SMILES: CN(C)C[C@H](c1ccccc1)c1cccc2c1N=CNP2

BIRTHDAY: 2018-12-03T10:43:38.928491
ATC: S01B
- SENSORY ORGANS
- OPHTHALMOLOGICALS
- ANTIINFLAMMATORY AGENTS
Synthesis Plan
FORMULA:C29H31N7O2

SMILES: CN(C)C[C@H](NC(=O)Nc1cccc2ncc(N[C@@]34C=CC=C[C@@H]3C=CC(=O)CN4)nc12)c1ccccc1

BIRTHDAY: 2018-12-03T10:43:38.951871
ATC: M02A
- MUSCULO-SKELETAL SYSTEM
- TOPICAL PRODUCTS FOR JOINT AND MUSCULAR PAIN
- TOPICAL PRODUCTS FOR JOINT AND MUSCULAR PAIN
Synthesis Plan
FORMULA:C22H25N7O

SMILES: CC(C)C[C@@H](Nc1cncnc1Nc1ccccc1C#N)C(=O)N1CC[C@@H](C#N)C1

BIRTHDAY: 2018-12-03T10:43:38.962135
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C35H45F4N7O3

SMILES: COC[C@@]1(c2ccccc2Nc2ncc(F)c(C(F)(F)F)n2)C[C@H]1NC(=O)[C@]1(c2ccccc2)CCCNCCOCCCCNCCN1

BIRTHDAY: 2018-12-03T10:43:38.979054
ATC: H01B
- SYSTEMIC HORMONAL PREPARATIONS, EXCL. SEX HORMONES AND INSULINS
- PITUITARY AND HYPOTHALAMIC HORMONES AND ANALOGUES
- POSTERIOR PITUITARY LOBE HORMONES
Synthesis Plan
FORMULA:C23H24N6S

SMILES: CC(C)C[C@@H](Nc1cncnc1Nc1ccccc1C#N)[C@]12C=CC=C[C@H]1SC=N2

BIRTHDAY: 2018-12-03T10:43:38.990610
ATC: N05A
- NERVOUS SYSTEM
- PSYCHOLEPTICS
- ANTIPSYCHOTICS
Synthesis Plan
FORMULA:C20H20ClN5O

SMILES: CN(C)CC(=O)Nc1ccccc1-c1cnc(Nc2ccccc2Cl)nc1

BIRTHDAY: 2018-12-03T10:43:38.999797
ATC: M01A
- MUSCULO-SKELETAL SYSTEM
- ANTIINFLAMMATORY AND ANTIRHEUMATIC PRODUCTS
- ANTIINFLAMMATORY AND ANTIRHEUMATIC PRODUCTS, NON-STEROIDS
Synthesis Plan
FORMULA:C21H28N6O3

SMILES: COc1cccc(C(=O)Nc2n[nH]c3c2N(C(=O)[C@@]2(N)CCCCN2)CC3(C)C)c1

BIRTHDAY: 2018-12-03T10:43:39.010210
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C21H28FNO3

SMILES: CC(C)C[C@@]12CC=C[C@H](COC1)[C@]2(CO)C(=O)NCc1cccc(F)c1

BIRTHDAY: 2018-12-03T10:43:39.018467
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C24H22F3N5O

SMILES: COCC1(c2cccc(Nc3ncc4c(n3)C=CCN4c3ccnc(C(F)(F)F)c3)c2)CC1

BIRTHDAY: 2018-12-03T10:43:39.028918
ATC: C08D
- CARDIOVASCULAR SYSTEM
- CALCIUM CHANNEL BLOCKERS
- SELECTIVE CALCIUM CHANNEL BLOCKERS WITH DIRECT CARDIAC EFFECTS
Synthesis Plan
FORMULA:C22H28F3N3O

SMILES: CN(C)C[C@H](NC(=O)Nc1ccccc1C(C)(C)C)c1ccccc1C(F)(F)F

BIRTHDAY: 2018-12-03T10:43:39.038112
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C28H34BrN5O

SMILES: Cc1ccc2cc1COCC=CCNCc1cccc(c1[C@@H](CC(C)C)NBr)Nc1nccc-2n1

BIRTHDAY: 2018-12-03T10:43:39.048557
ATC: M03A
- MUSCULO-SKELETAL SYSTEM
- MUSCLE RELAXANTS
- MUSCLE RELAXANTS, PERIPHERALLY ACTING AGENTS
Synthesis Plan
FORMULA:C20H20ClN5O

SMILES: CN(C)CC(=O)Nc1ccc(-c2cc(Nc3ccc(Cl)cc3)ncn2)cc1

BIRTHDAY: 2018-12-03T10:43:39.057668
ATC: M01A
- MUSCULO-SKELETAL SYSTEM
- ANTIINFLAMMATORY AND ANTIRHEUMATIC PRODUCTS
- ANTIINFLAMMATORY AND ANTIRHEUMATIC PRODUCTS, NON-STEROIDS
Synthesis Plan
FORMULA:C24H26N8S

SMILES: CC(C)C[C@H](Nc1cncnc1Nc1ccncc1-c1ccn[nH]1)[C@]12C=CC=C[C@H]1SC=N2

BIRTHDAY: 2018-12-03T10:43:39.071838
ATC: N05A
- NERVOUS SYSTEM
- PSYCHOLEPTICS
- ANTIPSYCHOTICS
Synthesis Plan
FORMULA:C22H25N7O

SMILES: CC(C)C[C@H](Nc1cncnc1Nc1ccccc1C#N)C(=O)N1CC[C@@H](C#N)C1

BIRTHDAY: 2018-12-03T10:43:39.082095
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C24H25N5

SMILES: CN(CC1(c2cccc(N)c2)CC1)c1ncnc2c1ccn2Cc1ccccc1

BIRTHDAY: 2018-12-03T10:43:39.091345
ATC: R06A
- RESPIRATORY SYSTEM
- ANTIHISTAMINES FOR SYSTEMIC USE
- ANTIHISTAMINES FOR SYSTEMIC USE
Synthesis Plan
FORMULA:C21H25F3N4

SMILES: CN(C)C[C@]1(c2ccc(Nc3nccc(C(F)(F)F)n3)cc2)C[C@@H]2CC[C@@H]1C2

BIRTHDAY: 2018-12-03T10:43:39.100585
ATC: H05B
- SYSTEMIC HORMONAL PREPARATIONS, EXCL. SEX HORMONES AND INSULINS
- CALCIUM HOMEOSTASIS
- ANTI-PARATHYROID AGENTS
Synthesis Plan
FORMULA:C17H22N6O3

SMILES: CNc1cnccc1C(=O)Nc1ncc(N[C@H](CC(C)C)C(=O)O)cn1

BIRTHDAY: 2018-12-03T10:43:39.109781
ATC: C10A
- CARDIOVASCULAR SYSTEM
- LIPID MODIFYING AGENTS
- LIPID MODIFYING AGENTS, PLAIN
Synthesis Plan
FORMULA:C21H28N4O2

SMILES: COc1ccc(C(=O)Nc2[nH]nc3c2C(C)(C)N2CCCCCC[C@@H]32)cc1

BIRTHDAY: 2018-12-03T10:43:39.118352
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:C25H23F3N2O3

SMILES: CC(C)(C)c1cccc(NC(=O)c2cccc(NC(=O)c3ccccc3OC(F)(F)F)c2)c1

BIRTHDAY: 2018-12-03T19:12:03.784445
ATC: R05D
- RESPIRATORY SYSTEM
- COUGH AND COLD PREPARATIONS
- COUGH SUPPRESSANTS, EXCL. COMBINATIONS WITH EXPECTORANTS
Synthesis Plan
FORMULA:C20H25NO7S

SMILES: O=C1C(=O)[C@@H](O)OCCCCCCC[C@]23C=CC=C[C@]2(NC(CO)=COS3)C1=O

BIRTHDAY: 2018-12-03T19:12:03.806999
ATC: S01A
- SENSORY ORGANS
- OPHTHALMOLOGICALS
- ANTIINFECTIVES
Synthesis Plan
FORMULA:C20H17N5O

SMILES: O=C(Nc1cnn2c(-c3ccccc3)cccc12)c1cc(C2CC2)n[nH]1

BIRTHDAY: 2018-12-03T19:12:03.824967
ATC: N03A
- NERVOUS SYSTEM
- ANTIEPILEPTICS
- ANTIEPILEPTICS
Synthesis Plan
FORMULA:C24H26N8S

SMILES: CC(C)C[C@H](Nc1cncnc1Nc1ccncc1-c1cc[nH]n1)[C@@]12C=CC=C[C@@H]1SC=N2

BIRTHDAY: 2018-12-03T19:12:03.837823
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C18H18F3N3O3

SMILES: O=C1CCCC[C@]1(c1ccccc1Nc1cncnc1C(F)(F)F)C(O)O

BIRTHDAY: 2018-12-03T19:12:03.848271
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C27H33N5O

SMILES: CN(C)CC(=O)Nc1cccc2c1Cn1cnc(c1)CCNCc1ccc(C3CC3)c(c1)C2

BIRTHDAY: 2018-12-03T19:12:03.858112
ATC: C02K
- CARDIOVASCULAR SYSTEM
- ANTIHYPERTENSIVES
- OTHER ANTIHYPERTENSIVES
Synthesis Plan
FORMULA:C19H20F3N3O2

SMILES: COC[C@@]1(c2cccc(Nc3nccc(C(F)(F)F)n3)c2)CCCC(=O)C1

BIRTHDAY: 2018-12-03T19:12:03.867353
ATC: N02C
- NERVOUS SYSTEM
- ANALGESICS
- ANTIMIGRAINE PREPARATIONS
Synthesis Plan
FORMULA:C27H35N7O3

SMILES: CC(C)C[C@@H](Nc1ncc(Nc2cccc([C@@H]3C[C@H]4COCN[C@H]3O4)c2)cn1)C(=O)N1CC[C@H](C#N)C1

BIRTHDAY: 2018-12-03T19:12:03.879973
ATC: A03A
- ALIMENTARY TRACT AND METABOLISM
- DRUGS FOR FUNCTIONAL GASTROINTESTINAL DISORDERS
- DRUGS FOR FUNCTIONAL GASTROINTESTINAL DISORDERS
Synthesis Plan
FORMULA:C22H25N7O

SMILES: CC(C)C[C@H](Nc1cncnc1Nc1ccccc1C#N)C(=O)N1CC[C@H](C#N)C1

BIRTHDAY: 2018-12-03T19:12:03.890241
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C22H28N8O2

SMILES: COC[C@@H](C)Nc1nc(NCc2ccccc2-c2nc(C)no2)c2c(ncn2C(C)C)n1

BIRTHDAY: 2018-12-03T19:12:03.919725
ATC: N06A
- NERVOUS SYSTEM
- PSYCHOANALEPTICS
- ANTIDEPRESSANTS
Synthesis Plan
FORMULA:C22H21F2N5O

SMILES: CN(CC1(c2ccc(N)cc2)CC1)c1ncc(C(=O)Nc2ccc(F)c(F)c2)cn1

BIRTHDAY: 2018-12-03T19:12:03.929462
ATC: M01A
- MUSCULO-SKELETAL SYSTEM
- ANTIINFLAMMATORY AND ANTIRHEUMATIC PRODUCTS
- ANTIINFLAMMATORY AND ANTIRHEUMATIC PRODUCTS, NON-STEROIDS
Synthesis Plan
FORMULA:C28H31ClN6OS

SMILES: CC1=NC=C(C(=O)N2CCC(n3ccc4c(N(C)CC5(c6ccc(Cl)cc6)CC5)ncnc43)CC2)SC1

BIRTHDAY: 2018-12-03T19:12:03.941033
ATC: J05A
- ANTIINFECTIVES FOR SYSTEMIC USE
- ANTIVIRALS FOR SYSTEMIC USE
- DIRECT ACTING ANTIVIRALS
Synthesis Plan
FORMULA:C23H24N6S

SMILES: CC(C)C[C@H](Nc1cncnc1Nc1ccccc1C#N)[C@]12C=CC=C[C@H]1SC=N2

BIRTHDAY: 2018-12-03T19:12:03.952469
ATC: N05A
- NERVOUS SYSTEM
- PSYCHOLEPTICS
- ANTIPSYCHOTICS
Synthesis Plan
FORMULA:C23H36N6O

SMILES: CC(C)C[C@H](Nc1cc(NC(=O)c2ccnc(NC(C)(C)C)c2)ncn1)C(C)(C)C

BIRTHDAY: 2018-12-03T19:12:03.961801
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C23H24N6S

SMILES: CC(C)C[C@H](Nc1cncnc1Nc1ccccc1C#N)[C@@]12C=CC=C[C@H]1SC=N2

BIRTHDAY: 2018-12-01T22:31:09.777627
ATC: N05A
- NERVOUS SYSTEM
- PSYCHOLEPTICS
- ANTIPSYCHOTICS
Synthesis Plan
FORMULA:C20H20F3N5O

SMILES: CN(C)C[C@@H](NC(=O)Nc1ccc2nccnc2c1)c1cccc(C(F)(F)F)c1

BIRTHDAY: 2018-12-01T22:31:09.797464
ATC: R05D
- RESPIRATORY SYSTEM
- COUGH AND COLD PREPARATIONS
- COUGH SUPPRESSANTS, EXCL. COMBINATIONS WITH EXPECTORANTS
Synthesis Plan
FORMULA:C20H20FN5O3

SMILES: CC(C)C[C@@H](c1cccc2c(Nc3cccc(F)c3)n[nH]c12)n1c(=O)[nH]oc1=O

BIRTHDAY: 2018-12-01T22:31:09.808476
ATC: M01A
- MUSCULO-SKELETAL SYSTEM
- ANTIINFLAMMATORY AND ANTIRHEUMATIC PRODUCTS
- ANTIINFLAMMATORY AND ANTIRHEUMATIC PRODUCTS, NON-STEROIDS
Synthesis Plan
FORMULA:C26H33N5

SMILES: CC(C)C[C@H](Nc1cncnc1Nc1ccccc1C#N)C12CC3CC(CC(C3)C1)C2

BIRTHDAY: 2018-12-01T22:31:09.827791
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C37H50N8O4

SMILES: CN(C)CC1(NC(=O)Nc2ccc3ncc(N4C[C@@H]5CC[C@H]4CN5C(=O)[C@H]4COc5ccccc5CCCCCOCCN4)nc3c2)CC1

BIRTHDAY: 2018-12-01T22:31:09.841779
ATC: R05D
- RESPIRATORY SYSTEM
- COUGH AND COLD PREPARATIONS
- COUGH SUPPRESSANTS, EXCL. COMBINATIONS WITH EXPECTORANTS
Synthesis Plan
FORMULA:C20H20F3N5O

SMILES: CN(C)C[C@H](NC(=O)Nc1ccc2nccnc2c1)c1ccc(C(F)(F)F)cc1

BIRTHDAY: 2018-12-01T22:31:09.881645
ATC: R05D
- RESPIRATORY SYSTEM
- COUGH AND COLD PREPARATIONS
- COUGH SUPPRESSANTS, EXCL. COMBINATIONS WITH EXPECTORANTS
Synthesis Plan
FORMULA:C26H20FN3O3

SMILES: COc1ccc2c(c1C(=O)N[C@H](C)c1ccccc1)-c1c(-c3cccc(F)c3)n[nH]c1C2=O

BIRTHDAY: 2018-12-01T22:31:09.892513
ATC: V08C
- VARIOUS
- CONTRAST MEDIA
- MAGNETIC RESONANCE IMAGING CONTRAST MEDIA
Synthesis Plan
FORMULA:C19H23N7O2

SMILES: CC(C)C[C@@H](Nc1cncnc1Nc1ccc(C#N)cc1)C(=O)NCC(N)=O

BIRTHDAY: 2018-12-01T22:31:09.901840
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C21H29N7O3

SMILES: CC(C)C[C@H](Nc1cncnc1Nc1cn[nH]c1C1CC1)C(=O)N1CC[C@H](C(=O)O)C1

BIRTHDAY: 2018-12-01T22:31:09.923728
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C23H24Cl2N8O

SMILES: C[C@@H](CN(C)C)NC(=O)Nc1cccc2nc(-c3ccn[nH]3)c(Nc3cccc(Cl)c3Cl)nc12

BIRTHDAY: 2018-12-01T22:31:09.974666
ATC: N06A
- NERVOUS SYSTEM
- PSYCHOANALEPTICS
- ANTIDEPRESSANTS
Synthesis Plan