matter.farm

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

These compounds may interact with:

Tyrosine-protein kinase ZAP-70

Potentially involved in: severe combined immunodeficiency; kidney cancer; carcinoma; chronic lymphocytic leukemia; t cell deficiency; lymphoma; chromosome 13q14 deletion syndrome; lymphoproliferative syndrome; diarrhea; eczema; hepatomegaly; immunologic deficiency syndromes; pneumonia; splenomegaly; failure to gain weight; panhypogammaglobulinemia; frequent candida infections; pediatric failure to thrive; zap70 deficiency; t cell immunodeficiency primary

Disease data sourced from Pharos.

Inhibitor

FORMULA:C22H31N7O4

SMILES: COc1cccc(OC)c1NC1=C(C(N)=O)N=CN2C=CN[C@]12NC(C)(C)N1CCOCC1

BIRTHDAY: 2018-12-01T14:10:40.763918
ATC: A07A
- ALIMENTARY TRACT AND METABOLISM
- ANTIDIARRHEALS, INTESTINAL ANTIINFLAMMATORY/ANTIINFECTIVE AGENTS
- INTESTINAL ANTIINFECTIVES
Synthesis Plan
FORMULA:C20H29N7O

SMILES: CC(C)[C@H](Nc1nc(NCc2ccncc2)c2ncn(C(C)C)c2n1)[C@@H](C)O

BIRTHDAY: 2018-12-01T14:10:40.773254
ATC: C01D
- CARDIOVASCULAR SYSTEM
- CARDIAC THERAPY
- VASODILATORS USED IN CARDIAC DISEASES
Synthesis Plan
FORMULA:C22H23F3N6O

SMILES: CN(C)C(C)(C)NC(=O)c1ccccc1Nc1c(F)ncnc1Nc1cc(F)cc(F)c1

BIRTHDAY: 2018-12-01T14:10:40.783451
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C18H22F3N5O

SMILES: Cc1cccc(Nc2cncnc2C(F)(F)F)c1C(=O)NC(C)(C)N(C)C

BIRTHDAY: 2018-12-01T14:10:40.792805
ATC: C02K
- CARDIOVASCULAR SYSTEM
- ANTIHYPERTENSIVES
- OTHER ANTIHYPERTENSIVES
Synthesis Plan
FORMULA:C19H17F3N6O

SMILES: COc1cccc(C(F)(F)F)c1Nc1cnc(-c2cc3n(n2)NCC=C3C)nc1

BIRTHDAY: 2018-12-01T14:10:40.802860
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C22H29N7O4

SMILES: COc1cc(Nc2nc(NCCCN3CCOCC3)n3ccnc3c2C(N)=O)cc(OC)c1

BIRTHDAY: 2018-12-01T14:10:40.813758
ATC: M01A
- MUSCULO-SKELETAL SYSTEM
- ANTIINFLAMMATORY AND ANTIRHEUMATIC PRODUCTS
- ANTIINFLAMMATORY AND ANTIRHEUMATIC PRODUCTS, NON-STEROIDS
Synthesis Plan
FORMULA:C22H31N7O4

SMILES: COc1cccc(NC2=C(C(N)=O)N=CN3C=CN[C@]23NC(C)(C)N2CCOCC2)c1OC

BIRTHDAY: 2018-12-01T14:10:40.826862
ATC: J05A
- ANTIINFECTIVES FOR SYSTEMIC USE
- ANTIVIRALS FOR SYSTEMIC USE
- DIRECT ACTING ANTIVIRALS
Synthesis Plan
FORMULA:C17H20F2N4O

SMILES: CN(C)CCCNC(=O)c1cc(-c2cc(F)cc(F)c2)cnc1N

BIRTHDAY: 2018-12-01T14:10:40.835014
ATC: N05A
- NERVOUS SYSTEM
- PSYCHOLEPTICS
- ANTIPSYCHOTICS
Synthesis Plan
FORMULA:C38H39N5O3

SMILES: CN(C)CCC[C@H](NC(=O)c1ccc2c(c1)COCc1cccc(c1)Nc1nccc(n1)-c1cccc(c1)OC2)c1ccccc1

BIRTHDAY: 2018-12-01T14:10:40.847265
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C21H27N5O4

SMILES: CNc1cnccc1C(=O)Nc1ccccc1C[C@@H](NC(=O)[C@H](N)C(C)C)C(=O)O

BIRTHDAY: 2018-12-01T14:10:40.867685
ATC: C10A
- CARDIOVASCULAR SYSTEM
- LIPID MODIFYING AGENTS
- LIPID MODIFYING AGENTS, PLAIN
Synthesis Plan
FORMULA:C20H29N7O

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

BIRTHDAY: 2018-12-01T14:10:40.877093
ATC: P01A
- ANTIPARASITIC PRODUCTS, INSECTICIDES AND REPELLENTS
- ANTIPROTOZOALS
- AGENTS AGAINST AMOEBIASIS AND OTHER PROTOZOAL DISEASES
Synthesis Plan
FORMULA:C19H16ClN5O3

SMILES: COc1ccc(Nc2nccc(C(=O)Nc3ccccc3C(N)=O)n2)cc1Cl

BIRTHDAY: 2018-12-01T14:10:40.886632
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C22H24F2N6O

SMILES: CN(C)CCCNC(=O)c1cccc(Nc2ncc(F)c(Nc3ccc(F)cc3)n2)c1

BIRTHDAY: 2018-12-01T14:10:40.896245
ATC: A10B
- ALIMENTARY TRACT AND METABOLISM
- DRUGS USED IN DIABETES
- BLOOD GLUCOSE LOWERING DRUGS, EXCL. INSULINS
Synthesis Plan
FORMULA:C28H38N4O5

SMILES: C[C@@H]([C@@H](NC(=O)c1ccccc1N1CCCCC(=O)COc2ccc(c(CO)c2)CC1)C(N)=O)N(C)C

BIRTHDAY: 2018-12-01T14:10:40.939108
ATC: B03X
- BLOOD AND BLOOD FORMING ORGANS
- ANTIANEMIC PREPARATIONS
- OTHER ANTIANEMIC PREPARATIONS
Synthesis Plan
FORMULA:C20H29N7O

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

BIRTHDAY: 2018-12-01T14:10:40.948380
ATC: P01A
- ANTIPARASITIC PRODUCTS, INSECTICIDES AND REPELLENTS
- ANTIPROTOZOALS
- AGENTS AGAINST AMOEBIASIS AND OTHER PROTOZOAL DISEASES
Synthesis Plan
FORMULA:C23H24N6

SMILES: N#Cc1cccc(Nc2cccc(-c3ccnc(NCC4CCNCC4)c3)n2)c1

BIRTHDAY: 2018-12-25T02:02:43.343293
ATC: B01A
- BLOOD AND BLOOD FORMING ORGANS
- ANTITHROMBOTIC AGENTS
- ANTITHROMBOTIC AGENTS
Synthesis Plan
FORMULA:C17H19N9O3

SMILES: COc1cccc(OC)c1N[C@]12NC(C(N)=O)=NC=C1N=C(c1n[nH]cc1N)N2

BIRTHDAY: 2018-12-25T02:02:43.355847
ATC: B03A
- BLOOD AND BLOOD FORMING ORGANS
- ANTIANEMIC PREPARATIONS
- IRON PREPARATIONS
Synthesis Plan
FORMULA:C23H25FN6O3

SMILES: CN(C)C(C)(C)[C@H](NC(=O)c1cccc(F)c1Nc1cncnc1-c1ccccn1)C(=O)O

BIRTHDAY: 2018-12-25T02:02:43.366905
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C18H27N5O3

SMILES: C[C@]1(C(N)=O)CON1CCCCCCC(=O)Nc1ccc(C(=N)N)cc1

BIRTHDAY: 2018-12-25T02:02:43.388659
ATC: N05A
- NERVOUS SYSTEM
- PSYCHOLEPTICS
- ANTIPSYCHOTICS
Synthesis Plan
FORMULA:C22H23F3N6O

SMILES: CN(C)CCCNC(=O)c1cccc(Nc2ncc(F)c(Nc3c(F)cccc3F)n2)c1

BIRTHDAY: 2018-12-25T02:02:43.399052
ATC: A10B
- ALIMENTARY TRACT AND METABOLISM
- DRUGS USED IN DIABETES
- BLOOD GLUCOSE LOWERING DRUGS, EXCL. INSULINS
Synthesis Plan
FORMULA:C21H25N3O4

SMILES: CC(C)[C@@H](N)C(=O)N[C@H](Cc1ccccc1-c1ccc(C(N)=O)cc1)C(=O)O

BIRTHDAY: 2018-12-25T02:02:43.408117
ATC: H05A
- SYSTEMIC HORMONAL PREPARATIONS, EXCL. SEX HORMONES AND INSULINS
- CALCIUM HOMEOSTASIS
- PARATHYROID HORMONES AND ANALOGUES
Synthesis Plan
FORMULA:C22H31N7O4

SMILES: COc1cccc(NC2=C(C(N)=O)N=CN3C=CN[C@@]23NC(C)(C)N2CCOCC2)c1OC

BIRTHDAY: 2018-12-25T02:02:43.421692
ATC: J05A
- ANTIINFECTIVES FOR SYSTEMIC USE
- ANTIVIRALS FOR SYSTEMIC USE
- DIRECT ACTING ANTIVIRALS
Synthesis Plan
FORMULA:C21H30N6

SMILES: CC(C)C(Nc1nc(NCc2cccnc2)nc2c1[C@H]1C[C@@H](C2)N1)C(C)C

BIRTHDAY: 2018-12-25T02:02:43.430728
ATC: N03A
- NERVOUS SYSTEM
- ANTIEPILEPTICS
- ANTIEPILEPTICS
Synthesis Plan
FORMULA:C19H28N10O2

SMILES: COC(=O)C(N)(N)c1cnccc1Nc1nc(NC(C)(C)N)nc2ncn(C(C)C)c12

BIRTHDAY: 2018-12-25T02:02:43.441883
ATC: N05A
- NERVOUS SYSTEM
- PSYCHOLEPTICS
- ANTIPSYCHOTICS
Synthesis Plan
FORMULA:C23H32N4

SMILES: Cc1ccc(N2C[C@@H]3CN[C@@H]2[C@H]3N[C@@H](CCN(C)C)c2ccccc2)cc1

BIRTHDAY: 2018-12-25T02:02:43.461058
ATC: R06A
- RESPIRATORY SYSTEM
- ANTIHISTAMINES FOR SYSTEMIC USE
- ANTIHISTAMINES FOR SYSTEMIC USE
Synthesis Plan
FORMULA:C18H25N7O3

SMILES: COc1cccc(OC)c1NC1=CN=C(C(N)=O)N2C=CN[C@@]12NC(C)(C)N

BIRTHDAY: 2018-12-25T02:02:43.472390
ATC: V08A
- VARIOUS
- CONTRAST MEDIA
- X-RAY CONTRAST MEDIA, IODINATED
Synthesis Plan
FORMULA:C20H29N7O

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

BIRTHDAY: 2018-12-25T02:02:43.482048
ATC: C01D
- CARDIOVASCULAR SYSTEM
- CARDIAC THERAPY
- VASODILATORS USED IN CARDIAC DISEASES
Synthesis Plan
FORMULA:C18H21FN6

SMILES: CC(C)[C@H](Nc1nccc(-c2cnn(C)c2N)n1)c1ccc(F)cc1

BIRTHDAY: 2018-12-25T02:02:43.491128
ATC: H05A
- SYSTEMIC HORMONAL PREPARATIONS, EXCL. SEX HORMONES AND INSULINS
- CALCIUM HOMEOSTASIS
- PARATHYROID HORMONES AND ANALOGUES
Synthesis Plan
FORMULA:C20H29N7O

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

BIRTHDAY: 2018-12-25T02:02:43.500641
ATC: P01A
- ANTIPARASITIC PRODUCTS, INSECTICIDES AND REPELLENTS
- ANTIPROTOZOALS
- AGENTS AGAINST AMOEBIASIS AND OTHER PROTOZOAL DISEASES
Synthesis Plan
FORMULA:C22H29N7O4

SMILES: COc1ccc(Nc2nc(NCCCN3CCOCC3)n3cncc3c2C(N)=O)cc1OC

BIRTHDAY: 2018-12-25T02:02:43.511933
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C17H20F2N4O

SMILES: CN(C)C(C)(C)NC(=O)c1ccnc(-c2cccc(F)c2F)c1N

BIRTHDAY: 2018-12-25T02:02:43.529894
ATC: G03A
- GENITO URINARY SYSTEM AND SEX HORMONES
- SEX HORMONES AND MODULATORS OF THE GENITAL SYSTEM
- HORMONAL CONTRACEPTIVES FOR SYSTEMIC USE
Synthesis Plan
FORMULA:C17H21FN4O

SMILES: CN(C)C(C)(C)NC(=O)c1ccnc(-c2ccccc2F)c1N

BIRTHDAY: 2018-12-03T02:38:47.271650
ATC: G03A
- GENITO URINARY SYSTEM AND SEX HORMONES
- SEX HORMONES AND MODULATORS OF THE GENITAL SYSTEM
- HORMONAL CONTRACEPTIVES FOR SYSTEMIC USE
Synthesis Plan
FORMULA:C17H21FN4O

SMILES: CN(C)CCCNC(=O)c1nc(N)ccc1-c1ccc(F)cc1

BIRTHDAY: 2018-12-03T02:38:47.289706
ATC: N05A
- NERVOUS SYSTEM
- PSYCHOLEPTICS
- ANTIPSYCHOTICS
Synthesis Plan
FORMULA:C22H31N7O4

SMILES: COc1ccc(NC2=C(C(N)=O)N=CN3C=CN[C@]23NC(C)(C)N2CCOCC2)c(OC)c1

BIRTHDAY: 2018-12-03T02:38:47.302940
ATC: A01A
- ALIMENTARY TRACT AND METABOLISM
- STOMATOLOGICAL PREPARATIONS
- STOMATOLOGICAL PREPARATIONS
Synthesis Plan
FORMULA:C15H19FN4OS

SMILES: C[C@@H](C1=C2c3ccc(F)cc3N[C@@H]2N(C(N)=O)CS1)N(C)C

BIRTHDAY: 2018-12-03T02:38:47.321383
ATC: J05A
- ANTIINFECTIVES FOR SYSTEMIC USE
- ANTIVIRALS FOR SYSTEMIC USE
- DIRECT ACTING ANTIVIRALS
Synthesis Plan
FORMULA:C20H16N6O2S

SMILES: COc1cc(Nc2nccc(-c3cccnc3)n2)cc(C(=O)Nc2nccs2)c1

BIRTHDAY: 2018-12-03T02:38:47.331340
ATC: M01A
- MUSCULO-SKELETAL SYSTEM
- ANTIINFLAMMATORY AND ANTIRHEUMATIC PRODUCTS
- ANTIINFLAMMATORY AND ANTIRHEUMATIC PRODUCTS, NON-STEROIDS
Synthesis Plan
FORMULA:C18H27N7O2

SMILES: CC(C)(C)NC(=O)CNCc1ccncc1Nc1nccc(NCCO)n1

BIRTHDAY: 2018-12-03T02:38:47.340506
ATC: J05A
- ANTIINFECTIVES FOR SYSTEMIC USE
- ANTIVIRALS FOR SYSTEMIC USE
- DIRECT ACTING ANTIVIRALS
Synthesis Plan
FORMULA:C16H22F3N7O

SMILES: CNc1nc(Nc2cn(CC(=O)NC(C)(C)C)nc2C)ncc1C(F)(F)F

BIRTHDAY: 2018-12-03T02:38:47.350238
ATC: D11A
- DERMATOLOGICALS
- OTHER DERMATOLOGICAL PREPARATIONS
- OTHER DERMATOLOGICAL PREPARATIONS
Synthesis Plan
FORMULA:C22H24F2N6O

SMILES: CN(C)C(C)(C)NC(=O)c1ccccc1Nc1c(F)ncnc1Nc1cccc(F)c1

BIRTHDAY: 2018-12-03T02:38:47.360308
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C20H29N7O

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

BIRTHDAY: 2018-12-03T02:38:47.381020
ATC: P01A
- ANTIPARASITIC PRODUCTS, INSECTICIDES AND REPELLENTS
- ANTIPROTOZOALS
- AGENTS AGAINST AMOEBIASIS AND OTHER PROTOZOAL DISEASES
Synthesis Plan
FORMULA:C19H15F3N6O

SMILES: COc1ccc(Nc2nccc(-c3cnn4nc(C)ccc34)n2)cc1C(F)(F)F

BIRTHDAY: 2018-12-03T02:38:47.404182
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C29H37N7O2

SMILES: CN(C)C(C)(C)NC(=O)c1ccccc1Nc1cnc(C(N)=O)nc1NC1(c2ccccc2)CCCCC1

BIRTHDAY: 2018-12-03T02:38:47.427027
ATC: G02A
- GENITO URINARY SYSTEM AND SEX HORMONES
- OTHER GYNECOLOGICALS
- UTEROTONICS
Synthesis Plan
FORMULA:C20H29N7O

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

BIRTHDAY: 2018-12-03T02:38:47.436658
ATC: C01D
- CARDIOVASCULAR SYSTEM
- CARDIAC THERAPY
- VASODILATORS USED IN CARDIAC DISEASES
Synthesis Plan
FORMULA:C20H29N7O2

SMILES: CC(C)[C@@H](Nc1nc(NCc2cccnc2O)c2ncn(C(C)C)c2n1)[C@H](C)O

BIRTHDAY: 2018-11-30T03:40:43.590779
ATC: S01A
- SENSORY ORGANS
- OPHTHALMOLOGICALS
- ANTIINFECTIVES
Synthesis Plan
FORMULA:C19H16ClN5O3

SMILES: COc1cccc(Cl)c1Nc1cnc(C(=O)Nc2ccc(C(N)=O)cc2)nc1

BIRTHDAY: 2018-11-30T03:40:43.600256
ATC: C03B
- CARDIOVASCULAR SYSTEM
- DIURETICS
- LOW-CEILING DIURETICS, EXCL. THIAZIDES
Synthesis Plan
FORMULA:C23H31N9O

SMILES: Cc1nc(-c2ccccc2CNc2nc(NC(C)(C)N(C)C)nc3ncn(C(C)C)c23)no1

BIRTHDAY: 2018-11-30T03:40:43.620747
ATC: N05A
- NERVOUS SYSTEM
- PSYCHOLEPTICS
- ANTIPSYCHOTICS
Synthesis Plan
FORMULA:C25H33N9O4

SMILES: COc1cccc(OC)c1N[C@]1(NC(C)(C)N2CCOCC2)C=C(C(N)=O)N=C2NC=C(c3ccn[nH]3)N21

BIRTHDAY: 2018-11-30T03:40:43.646458
ATC: J05A
- ANTIINFECTIVES FOR SYSTEMIC USE
- ANTIVIRALS FOR SYSTEMIC USE
- DIRECT ACTING ANTIVIRALS
Synthesis Plan
FORMULA:C8H12N2S

SMILES: NCN1C=[SH][C@@H]2C=CC=C[C@H]21

BIRTHDAY: 2018-11-30T03:40:43.652462
ATC: N06B
- NERVOUS SYSTEM
- PSYCHOANALEPTICS
- PSYCHOSTIMULANTS, AGENTS USED FOR ADHD AND NOOTROPICS
Synthesis Plan
FORMULA:C21H32N6

SMILES: CC(C)[C@H](Nc1nccc(NC[C@H]2CCNCCCN2)n1)c1ccccc1

BIRTHDAY: 2018-11-30T03:40:43.661144
ATC: C03C
- CARDIOVASCULAR SYSTEM
- DIURETICS
- HIGH-CEILING DIURETICS
Synthesis Plan
FORMULA:C18H25N7O3

SMILES: COc1cccc(OC)c1NC1=C(C(N)=O)N=CN2C=CN[C@@]12NC(C)(C)N

BIRTHDAY: 2018-11-30T03:40:43.719058
ATC: P01C
- ANTIPARASITIC PRODUCTS, INSECTICIDES AND REPELLENTS
- ANTIPROTOZOALS
- AGENTS AGAINST LEISHMANIASIS AND TRYPANOSOMIASIS
Synthesis Plan
FORMULA:C20H29N7O

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

BIRTHDAY: 2018-11-19T08:14:35.307844
ATC: P01A
- ANTIPARASITIC PRODUCTS, INSECTICIDES AND REPELLENTS
- ANTIPROTOZOALS
- AGENTS AGAINST AMOEBIASIS AND OTHER PROTOZOAL DISEASES
Synthesis Plan
FORMULA:C19H24N4O

SMILES: CN(C)CC[C@@H](NC(=O)c1ccc(C(=N)N)cc1)c1ccccc1

BIRTHDAY: 2018-11-19T08:14:35.315891
ATC: N05A
- NERVOUS SYSTEM
- PSYCHOLEPTICS
- ANTIPSYCHOTICS
Synthesis Plan
FORMULA:C18H16F3N7O

SMILES: COc1cccc(C(F)(F)F)c1Nc1cnc(-c2n[nH]c3c2C=NN[C@H]3C)nc1

BIRTHDAY: 2018-11-19T08:14:35.326850
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C17H26N8O2

SMILES: C[C@@H](O)Nc1cnc(Nc2ccnc(C(N)(N)C(=O)NC(C)(C)C)c2)nc1

BIRTHDAY: 2018-11-19T08:14:35.346319
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C34H48N8O

SMILES: CC(C)[C@@H](Nc1nc(NCc2ccnc(O)c2)nc2ncn(C(C)C)c12)[C@H]1CCCCc2cccc(c2)CCCNCC1

BIRTHDAY: 2018-11-19T08:14:35.369824
ATC: C03C
- CARDIOVASCULAR SYSTEM
- DIURETICS
- HIGH-CEILING DIURETICS
Synthesis Plan
FORMULA:C19H17F3N6O2

SMILES: COC1=CCNn2nc(-c3ncncc3Nc3c(OC)cccc3C(F)(F)F)cc21

BIRTHDAY: 2018-11-19T08:14:35.380679
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C22H23F3N6O

SMILES: CN(C)C(C)(C)NC(=O)c1ccccc1Nc1cnc(F)nc1Nc1ccc(F)cc1F

BIRTHDAY: 2018-11-19T08:14:35.400862
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C20H29N7O

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

BIRTHDAY: 2018-11-19T08:14:35.410576
ATC: C01D
- CARDIOVASCULAR SYSTEM
- CARDIAC THERAPY
- VASODILATORS USED IN CARDIAC DISEASES
Synthesis Plan
FORMULA:C20H30N10O2

SMILES: CNC(=O)C(N)(N)c1ccc(Nc2nc(NCC(C)(C)O)c3c(ncn3C(C)C)n2)nc1

BIRTHDAY: 2018-11-19T08:14:35.441778
ATC: C09D
- CARDIOVASCULAR SYSTEM
- AGENTS ACTING ON THE RENIN-ANGIOTENSIN SYSTEM
- ANGIOTENSIN II ANTAGONISTS, COMBINATIONS
Synthesis Plan
FORMULA:C22H24F2N6O

SMILES: C[C@@H](CNC(=O)c1ccc(Nc2cnc(Nc3cccc(F)c3)nc2F)cc1)N(C)C

BIRTHDAY: 2018-11-19T08:14:35.462511
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C26H28N4O5S

SMILES: COc1ccc(Nc2nc3c(c(=O)[nH]2)[C@H](CCCN2CCCCC2=O)S(=O)(=O)c2ccccc2-3)cc1

BIRTHDAY: 2018-11-19T08:14:35.473911
ATC: N06B
- NERVOUS SYSTEM
- PSYCHOANALEPTICS
- PSYCHOSTIMULANTS, AGENTS USED FOR ADHD AND NOOTROPICS
Synthesis Plan
FORMULA:C23H23F2N7O2

SMILES: CNc1nc(Nc2cccc(OC)c2C(=O)Nc2cccc(F)c2F)nc2ncn(C(C)C)c12

BIRTHDAY: 2018-11-19T08:14:35.485278
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C31H27N7O

SMILES: Cc1cc2c(cc1Nc1cnccc1N1C=CN(C(=O)c3cccc(-c4ccncc4)c3)C[C@@H]1C#N)NCC2

BIRTHDAY: 2018-11-19T08:14:35.496675
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C22H23N9O2

SMILES: CN(C)CCCNC(=O)c1ccncc1NC(=O)c1nc(C#N)ccc1Nc1cncnc1

BIRTHDAY: 2018-11-19T08:14:35.507720
ATC: N06A
- NERVOUS SYSTEM
- PSYCHOANALEPTICS
- ANTIDEPRESSANTS
Synthesis Plan
FORMULA:C18H27N9O2

SMILES: CNC(=O)C(N)(N)c1c(Nc2ncncc2NC)ccnc1C(=O)NC(C)(C)C

BIRTHDAY: 2018-11-19T08:14:35.527920
ATC: L01C
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- PLANT ALKALOIDS AND OTHER NATURAL PRODUCTS
Synthesis Plan
FORMULA:C17H21FN4O

SMILES: CN(C)CCCNC(=O)c1cc(-c2ccc(F)cc2)cnc1N

BIRTHDAY: 2018-11-19T08:14:35.546040
ATC: M01A
- MUSCULO-SKELETAL SYSTEM
- ANTIINFLAMMATORY AND ANTIRHEUMATIC PRODUCTS
- ANTIINFLAMMATORY AND ANTIRHEUMATIC PRODUCTS, NON-STEROIDS
Synthesis Plan
FORMULA:C20H29N7O2

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

BIRTHDAY: 2018-11-19T08:14:35.556113
ATC: C03C
- CARDIOVASCULAR SYSTEM
- DIURETICS
- HIGH-CEILING DIURETICS
Synthesis Plan
FORMULA:C21H22N4O2

SMILES: COc1c(C)cccc1Nc1cnc(C(=O)Nc2cc(C)cc(C)c2)nc1

BIRTHDAY: 2018-11-19T08:14:35.564673
ATC: G01A
- GENITO URINARY SYSTEM AND SEX HORMONES
- GYNECOLOGICAL ANTIINFECTIVES AND ANTISEPTICS
- ANTIINFECTIVES AND ANTISEPTICS, EXCL. COMBINATIONS WITH CORTICOSTEROIDS
Synthesis Plan
FORMULA:C28H36N4O

SMILES: CN(C)c1ccc2cc1Oc1cc(c3ccccc3c1)CNCCN(C)[C@H]1CCN(CC2)C1

BIRTHDAY: 2018-11-19T08:14:35.574461
ATC: C03D
- CARDIOVASCULAR SYSTEM
- DIURETICS
- POTASSIUM-SPARING AGENTS
Synthesis Plan
FORMULA:C30H35ClN8O2

SMILES: C[C@H]([C@H](N)Cc1ccccc1Cl)N1C(=O)NC(=O)[C@H]2N=Cc3nccc(-c4cc(NC(C)(C)N(C)C)ccn4)c3[C@H]21

BIRTHDAY: 2018-11-19T08:14:35.588122
ATC: C09C
- CARDIOVASCULAR SYSTEM
- AGENTS ACTING ON THE RENIN-ANGIOTENSIN SYSTEM
- ANGIOTENSIN II ANTAGONISTS, PLAIN
Synthesis Plan
FORMULA:C19H17F3N6O

SMILES: COc1cccc(C(F)(F)F)c1Nc1cncnc1-c1cc2n(n1)NCC=C2C

BIRTHDAY: 2018-11-19T08:14:35.618569
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C21H23F3N6

SMILES: CN(C)C(C)(C)Nc1c(Nc2ccccc2C(F)(F)F)ncnc1-c1ccncc1

BIRTHDAY: 2018-11-19T08:14:35.642486
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C16H21N7OS2

SMILES: CC(C)[C@@H](C)Nc1ncc2c(n1)N[SH](C)(=O)c1nc(-c3cscn3)[nH]c1-2

BIRTHDAY: 2018-11-19T08:14:35.652450
ATC: D06B
- DERMATOLOGICALS
- ANTIBIOTICS AND CHEMOTHERAPEUTICS FOR DERMATOLOGICAL USE
- CHEMOTHERAPEUTICS FOR TOPICAL USE
Synthesis Plan
FORMULA:C22H23FN6O3

SMILES: CN(C)CC[C@H](NC(=O)c1ccc(Nc2nccc(-c3cccnc3)n2)cc1F)C(=O)O

BIRTHDAY: 2018-11-19T08:14:35.662982
ATC: C01D
- CARDIOVASCULAR SYSTEM
- CARDIAC THERAPY
- VASODILATORS USED IN CARDIAC DISEASES
Synthesis Plan
FORMULA:C14H19FN2

SMILES: CN1CC=CCN(Cc2ccc(F)cc2)CC1

BIRTHDAY: 2018-11-19T08:14:35.669561
ATC: D08A
- DERMATOLOGICALS
- ANTISEPTICS AND DISINFECTANTS
- ANTISEPTICS AND DISINFECTANTS
Synthesis Plan
FORMULA:C27H25N7

SMILES: N#Cc1ccccc1Nc1ccnc(-c2ncc(Nc3ccccc3[C@@H]3CCCCN3)cn2)c1

BIRTHDAY: 2018-11-19T08:14:35.701062
ATC: M01A
- MUSCULO-SKELETAL SYSTEM
- ANTIINFLAMMATORY AND ANTIRHEUMATIC PRODUCTS
- ANTIINFLAMMATORY AND ANTIRHEUMATIC PRODUCTS, NON-STEROIDS
Synthesis Plan
FORMULA:C29H33F2N7O2

SMILES: CN(C)CCCNC(=O)c1cccc(Nc2ncc(F)c(N[C@H]3C[C@H]4CC[C@@H]3N4C(=O)c3ccc(F)cc3)n2)c1

BIRTHDAY: 2018-11-19T08:14:35.714535
ATC: A10B
- ALIMENTARY TRACT AND METABOLISM
- DRUGS USED IN DIABETES
- BLOOD GLUCOSE LOWERING DRUGS, EXCL. INSULINS
Synthesis Plan
FORMULA:C40H41N7O3

SMILES: CC(C)[C@@H](Nc1nc(NCc2cccnc2)c2ncn(-c3ccc4cc3CCc3ccc(cc3)CCCCc3ccc(cc3)O4)c2n1)C(=O)O

BIRTHDAY: 2018-11-19T08:14:35.748972
ATC: C08D
- CARDIOVASCULAR SYSTEM
- CALCIUM CHANNEL BLOCKERS
- SELECTIVE CALCIUM CHANNEL BLOCKERS WITH DIRECT CARDIAC EFFECTS
Synthesis Plan
FORMULA:C25H28FN9

SMILES: CC(C)C(Nc1nc(NCc2ccccn2)c2c(n1)nc1[nH]nc(-c3cccc(F)c3)n12)C(C)C

BIRTHDAY: 2018-11-19T08:14:35.760367
ATC: N05A
- NERVOUS SYSTEM
- PSYCHOLEPTICS
- ANTIPSYCHOTICS
Synthesis Plan
FORMULA:C22H31N7O4

SMILES: COc1ccc(OC)c(N[C@@H]2C(C(N)=O)=C(NCCCN3CCOCC3)N=C3NC=CN32)c1

BIRTHDAY: 2018-11-19T08:14:35.771594
ATC: C01B
- CARDIOVASCULAR SYSTEM
- CARDIAC THERAPY
- ANTIARRHYTHMICS, CLASS I AND III
Synthesis Plan
FORMULA:C23H25FN6O3

SMILES: CN(C)C(C)(C)[C@H](NC(=O)c1cccc(F)c1Nc1cncnc1-c1ccncc1)C(=O)O

BIRTHDAY: 2018-11-19T08:14:35.782686
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C22H31N7O4

SMILES: COc1cccc(OC)c1NC1=C(C(N)=O)N=CN2C=CN[C@@]12NC(C)(C)N1CCOCC1

BIRTHDAY: 2018-11-19T08:14:35.817217
ATC: A07A
- ALIMENTARY TRACT AND METABOLISM
- ANTIDIARRHEALS, INTESTINAL ANTIINFLAMMATORY/ANTIINFECTIVE AGENTS
- INTESTINAL ANTIINFECTIVES
Synthesis Plan
FORMULA:C26H33N7O2

SMILES: CN(C)CCCNc1ccc(-c2ccc3c(ncc4c(=O)n(CCC(C)(C)C)c(=O)[nH]c43)n2)cn1

BIRTHDAY: 2018-11-19T08:14:35.827680
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C24H28N6O3

SMILES: Cc1ccc(C(=O)N[C@H](CCCN(C)C)C(=O)O)cc1Nc1nccc(-c2cccnc2)n1

BIRTHDAY: 2018-11-19T08:14:35.848721
ATC: C10A
- CARDIOVASCULAR SYSTEM
- LIPID MODIFYING AGENTS
- LIPID MODIFYING AGENTS, PLAIN
Synthesis Plan
FORMULA:C22H31N7O4

SMILES: COc1ccc(NC2=CN=C(C(N)=O)N3C=CN[C@]23NC(C)(C)N2CCOCC2)c(OC)c1

BIRTHDAY: 2018-11-19T08:14:35.861280
ATC: C02A
- CARDIOVASCULAR SYSTEM
- ANTIHYPERTENSIVES
- ANTIADRENERGIC AGENTS, CENTRALLY ACTING
Synthesis Plan
FORMULA:C19H22N4O4S

SMILES: COc1cccc(Nc2cnc([C@@]3(C(C)(C)O)C=NC=CS3)[nH]c2=O)c1OC

BIRTHDAY: 2018-11-19T08:14:35.872137
ATC: V08D
- VARIOUS
- CONTRAST MEDIA
- ULTRASOUND CONTRAST MEDIA
Synthesis Plan
FORMULA:C20H24N8O3S

SMILES: COc1ccc(Nc2nc(NC[C@@H]3N[C@H]4CS[C@@H]3C4)n3cnnc3c2C(N)=O)cc1OC

BIRTHDAY: 2018-11-30T17:23:05.304198
ATC: M01A
- MUSCULO-SKELETAL SYSTEM
- ANTIINFLAMMATORY AND ANTIRHEUMATIC PRODUCTS
- ANTIINFLAMMATORY AND ANTIRHEUMATIC PRODUCTS, NON-STEROIDS
Synthesis Plan
FORMULA:C20H15ClF3N5O3

SMILES: NC(=O)c1ccc(NC(=O)c2ncc(Nc3c(Cl)cccc3OCC(F)(F)F)cn2)cc1

BIRTHDAY: 2018-11-30T17:23:05.366770
ATC: N02B
- NERVOUS SYSTEM
- ANALGESICS
- OTHER ANALGESICS AND ANTIPYRETICS
Synthesis Plan
FORMULA:C20H19FN6O2

SMILES: CNc1nc(Nc2ccc(CNC(=O)c3ccc(F)cc3)cc2)ncc1C(N)=O

BIRTHDAY: 2018-11-30T17:23:05.387603
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C17H24N8O3

SMILES: COc1cccc(OC)c1N[C@]12NC=NC1=CN=C(C(N)=O)N2[C@](C)(N)CN

BIRTHDAY: 2018-11-30T17:23:05.429782
ATC: V08A
- VARIOUS
- CONTRAST MEDIA
- X-RAY CONTRAST MEDIA, IODINATED
Synthesis Plan
FORMULA:C23H23F2N7O2

SMILES: CNc1nc(Nc2cc(C(=O)Nc3ccc(F)c(F)c3)ccc2OC)nc2c1ncn2C(C)C

BIRTHDAY: 2018-12-02T16:06:14.345980
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C17H24N8O3

SMILES: COc1cccc(OC)c1N[C@]12NC=NC1=C(C(N)=O)N=CN2[C@@](C)(N)CN

BIRTHDAY: 2018-12-02T16:06:14.357913
ATC: A09A
- ALIMENTARY TRACT AND METABOLISM
- DIGESTIVES, INCL. ENZYMES
- DIGESTIVES, INCL. ENZYMES
Synthesis Plan
FORMULA:C20H29N7O2

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

BIRTHDAY: 2018-12-02T16:06:14.367988
ATC: C03C
- CARDIOVASCULAR SYSTEM
- DIURETICS
- HIGH-CEILING DIURETICS
Synthesis Plan
FORMULA:C18H16F3N7O

SMILES: COc1cccc(C(F)(F)F)c1Nc1cncnc1-c1n[nH]c2c1C=NN[C@@H]2C

BIRTHDAY: 2018-12-02T16:06:14.392467
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C33H38N2O3

SMILES: COc1ccc(N2[C@H]3[C@H]4C[C@H](c5ccc(C(C)(C)C)cc5)[C@@H](C(=O)Nc5cccc(O)c5)[C@H]3C[C@H]2C4)cc1

BIRTHDAY: 2018-12-02T16:06:14.402936
ATC: N06B
- NERVOUS SYSTEM
- PSYCHOANALEPTICS
- PSYCHOSTIMULANTS, AGENTS USED FOR ADHD AND NOOTROPICS
Synthesis Plan
FORMULA:C23H26FN7O2

SMILES: COc1cccc(Nc2nc(NCCCN)[nH]c(=O)c2[C@H]2C[C@H](c3ccc(F)cc3)N=N2)c1

BIRTHDAY: 2018-12-02T16:06:14.413806
ATC: A01A
- ALIMENTARY TRACT AND METABOLISM
- STOMATOLOGICAL PREPARATIONS
- STOMATOLOGICAL PREPARATIONS
Synthesis Plan
FORMULA:C25H30N8O2

SMILES: COc1ccccc1NC1=C(N2[C@H]3CNC[C@H]2COC3)N=C2NN=CN2[C@@]1(N)Cc1ccccc1

BIRTHDAY: 2018-12-02T16:06:14.437115
ATC: G02C
- GENITO URINARY SYSTEM AND SEX HORMONES
- OTHER GYNECOLOGICALS
- OTHER GYNECOLOGICALS
Synthesis Plan
FORMULA:C22H23F3N6O

SMILES: CN(C)C(C)(C)NC(=O)c1ccccc1Nc1c(F)ncnc1Nc1cccc(F)c1F

BIRTHDAY: 2018-12-02T16:06:14.461161
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C33H33N3O4S

SMILES: COc1ccc(N2c3ccc(C(=O)Nc4ccc(C(=O)NCC(C)(C)C)cc4)cc3C[S@+]([O-])c3ccccc32)cc1

BIRTHDAY: 2018-12-02T16:06:14.472707
ATC: A08A
- ALIMENTARY TRACT AND METABOLISM
- ANTIOBESITY PREPARATIONS, EXCL. DIET PRODUCTS
- ANTIOBESITY PREPARATIONS, EXCL. DIET PRODUCTS
Synthesis Plan
FORMULA:C23H25N7O3

SMILES: CN(C)CCCNC(=O)c1ccc(Nc2ncc(C(N)=O)c3nc(-c4ccco4)cn23)cc1

BIRTHDAY: 2018-12-02T16:06:14.528966
ATC: D08A
- DERMATOLOGICALS
- ANTISEPTICS AND DISINFECTANTS
- ANTISEPTICS AND DISINFECTANTS
Synthesis Plan
FORMULA:C24H38N6O2

SMILES: COc1cccc(NC2=C[C@H]3CC[C@@H](C(=O)NCCC(C)C)CN3C(NCCCN)=N2)c1

BIRTHDAY: 2018-12-03T10:42:35.449702
ATC: J01X
- ANTIINFECTIVES FOR SYSTEMIC USE
- ANTIBACTERIALS FOR SYSTEMIC USE
- OTHER ANTIBACTERIALS
Synthesis Plan
FORMULA:C21H23F3N6O

SMILES: CN(C)CCCNC(=O)c1cncc(-c2ccn[nH]2)c1Nc1cccc(C(F)(F)F)c1

BIRTHDAY: 2018-12-03T10:42:35.461790
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C19H27N9O3

SMILES: COC(=O)C(N)(N)c1cnccc1Nc1nc(NC(C)(C)O)c2c(ncn2C(C)C)n1

BIRTHDAY: 2018-12-03T10:42:35.522006
ATC: N05A
- NERVOUS SYSTEM
- PSYCHOLEPTICS
- ANTIPSYCHOTICS
Synthesis Plan
FORMULA:C23H28N10O3

SMILES: COc1ccc(Nc2ncc(C3=CN=c4cn[nH]c4=NC3)c(=O)n2[C@@](C)(N)[C@]2(N)COCCN2)cc1

BIRTHDAY: 2018-12-03T10:42:35.555585
ATC: J05A
- ANTIINFECTIVES FOR SYSTEMIC USE
- ANTIVIRALS FOR SYSTEMIC USE
- DIRECT ACTING ANTIVIRALS
Synthesis Plan
FORMULA:C14H17ClN4OS

SMILES: CC(C)[C@H](N)C(=O)NC1=NN=C(c2ccc(Cl)cc2)CS1

BIRTHDAY: 2018-12-03T10:42:35.563582
ATC: A16A
- ALIMENTARY TRACT AND METABOLISM
- OTHER ALIMENTARY TRACT AND METABOLISM PRODUCTS
- OTHER ALIMENTARY TRACT AND METABOLISM PRODUCTS
Synthesis Plan
FORMULA:C22H26N6O

SMILES: Cc1ccc(Nc2ncnc(C(N)=O)c2Nc2ccccc2[C@H](C)N(C)C)cc1

BIRTHDAY: 2018-12-03T10:42:35.586189
ATC: N05B
- NERVOUS SYSTEM
- PSYCHOLEPTICS
- ANXIOLYTICS
Synthesis Plan
FORMULA:C22H29N5O

SMILES: C[C@@H](c1ccccc1Nc1ncc2c(n1)C(=O)CN(C1CCCC1)C2)N(C)C

BIRTHDAY: 2018-12-03T10:42:35.612950
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C20H16N6O2S

SMILES: COc1cccc(C(=O)Nc2cncs2)c1Nc1cnc(-c2ccccn2)nc1

BIRTHDAY: 2018-12-03T19:11:01.028904
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C19H20F3N5OS

SMILES: CC(C)[C@@H](Nc1cncnc1N1SC=CN=C1CO)c1ccccc1C(F)(F)F

BIRTHDAY: 2018-12-03T19:11:01.039764
ATC: P01B
- ANTIPARASITIC PRODUCTS, INSECTICIDES AND REPELLENTS
- ANTIPROTOZOALS
- ANTIMALARIALS
Synthesis Plan
FORMULA:C17H20F2N4O

SMILES: CN(C)C(C)(C)NC(=O)c1c(N)cncc1-c1cccc(F)c1F

BIRTHDAY: 2018-12-03T19:11:01.048476
ATC: M01C
- MUSCULO-SKELETAL SYSTEM
- ANTIINFLAMMATORY AND ANTIRHEUMATIC PRODUCTS
- SPECIFIC ANTIRHEUMATIC AGENTS
Synthesis Plan
FORMULA:C21H27N5O4

SMILES: CNc1cnccc1C(=O)Nc1ccccc1C[C@H](NC(=O)[C@@H](N)C(C)C)C(=O)O

BIRTHDAY: 2018-12-03T19:11:01.069616
ATC: C10A
- CARDIOVASCULAR SYSTEM
- LIPID MODIFYING AGENTS
- LIPID MODIFYING AGENTS, PLAIN
Synthesis Plan
FORMULA:C17H20F2N4O

SMILES: CN(C)CCCNC(=O)c1ccc(N)nc1-c1ccc(F)c(F)c1

BIRTHDAY: 2018-12-03T19:11:01.089451
ATC: C04A
- CARDIOVASCULAR SYSTEM
- PERIPHERAL VASODILATORS
- PERIPHERAL VASODILATORS
Synthesis Plan
FORMULA:C18H16F3N7O

SMILES: COc1cccc(C(F)(F)F)c1Nc1cncnc1-c1n[nH]c2c1C=NN[C@H]2C

BIRTHDAY: 2018-12-03T19:11:01.110879
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C14H20F3N7O2

SMILES: CNC(=O)[C@H](Nc1c(N[C@@]2(C)CN=[O+][N-]2)ncnc1C(F)(F)F)C(C)C

BIRTHDAY: 2018-12-03T19:11:01.132420
ATC: B03A
- BLOOD AND BLOOD FORMING ORGANS
- ANTIANEMIC PREPARATIONS
- IRON PREPARATIONS
Synthesis Plan
FORMULA:C21H27N5O4

SMILES: CNc1cccc(C(=O)Nc2ccc(C[C@@H](NC(=O)[C@H](N)C(C)C)C(=O)O)cc2)n1

BIRTHDAY: 2018-12-03T19:11:01.142272
ATC: N02B
- NERVOUS SYSTEM
- ANALGESICS
- OTHER ANALGESICS AND ANTIPYRETICS
Synthesis Plan
FORMULA:C20H26N6O3S

SMILES: CC(C)[C@@H](C)Nc1ncc2c(n1)N=C(N1C=N[C@]3(O)C=CC=C[C@]3(CO)S1)COC2

BIRTHDAY: 2018-12-03T19:11:01.162558
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C26H30N2O5

SMILES: OC1=C[C@@H]2COCC[C@@](O)(c3c(O)cccc3O)N3C=C(C=CC4=CN(CC4)[C@@H]2C=C1)CC3

BIRTHDAY: 2018-12-03T19:11:01.192301
ATC: H02A
- SYSTEMIC HORMONAL PREPARATIONS, EXCL. SEX HORMONES AND INSULINS
- CORTICOSTEROIDS FOR SYSTEMIC USE
- CORTICOSTEROIDS FOR SYSTEMIC USE, PLAIN
Synthesis Plan
FORMULA:C37H42N8

SMILES: Cc1nc2ccccc2cc1CN(C)CCCNc1ccc2cc1CNCC=CCNCc1cccc(c1)-c1ccnc(n1)N2

BIRTHDAY: 2018-12-03T19:11:01.204624
ATC: L01C
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- PLANT ALKALOIDS AND OTHER NATURAL PRODUCTS
Synthesis Plan
FORMULA:C17H20F2N4O

SMILES: CN(C)CCCNC(=O)c1nccc(N)c1-c1c(F)cccc1F

BIRTHDAY: 2018-12-03T19:11:01.213846
ATC: G03A
- GENITO URINARY SYSTEM AND SEX HORMONES
- SEX HORMONES AND MODULATORS OF THE GENITAL SYSTEM
- HORMONAL CONTRACEPTIVES FOR SYSTEMIC USE
Synthesis Plan
FORMULA:C21H27N5O4

SMILES: CNc1cc(C(=O)Nc2ccc(C[C@H](NC(=O)[C@@H](N)C(C)C)C(=O)O)cc2)ccn1

BIRTHDAY: 2018-12-01T22:30:05.745092
ATC: C10A
- CARDIOVASCULAR SYSTEM
- LIPID MODIFYING AGENTS
- LIPID MODIFYING AGENTS, PLAIN
Synthesis Plan
FORMULA:C23H23F2N7O2

SMILES: CNc1nc(Nc2cc(C(=O)Nc3cc(F)cc(F)c3)ccc2OC)nc2c1ncn2C(C)C

BIRTHDAY: 2018-12-01T22:30:05.756266
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C22H31N7O4

SMILES: COc1cccc(OC)c1NC1=CN=C(C(N)=O)N2C=CN[C@@]12NC(C)(C)N1CCOCC1

BIRTHDAY: 2018-12-01T22:30:05.778541
ATC: C02A
- CARDIOVASCULAR SYSTEM
- ANTIHYPERTENSIVES
- ANTIADRENERGIC AGENTS, CENTRALLY ACTING
Synthesis Plan
FORMULA:C18H22N6OS

SMILES: Cc1csc(-c2cc(N[C@@H](C(=O)N3CCC[C@H]3C#N)C(C)C)ncn2)n1

BIRTHDAY: 2018-12-01T22:30:05.788005
ATC: A10B
- ALIMENTARY TRACT AND METABOLISM
- DRUGS USED IN DIABETES
- BLOOD GLUCOSE LOWERING DRUGS, EXCL. INSULINS
Synthesis Plan
FORMULA:C18H22N6OS

SMILES: Cc1nc(-c2cc(N[C@H](C(=O)N3CCC[C@@H]3C#N)C(C)C)ncn2)cs1

BIRTHDAY: 2018-12-01T22:30:05.797470
ATC: G03D
- GENITO URINARY SYSTEM AND SEX HORMONES
- SEX HORMONES AND MODULATORS OF THE GENITAL SYSTEM
- PROGESTOGENS
Synthesis Plan
FORMULA:C28H34N8O

SMILES: CC(C)[C@@H](C)Nc1ncnc2c1CCc1ccc(cc1)[C@@]1(C(N)=O)NC=N[C@H]1NCc1cccc(c1)N2

BIRTHDAY: 2018-12-01T22:30:05.877939
ATC: D11A
- DERMATOLOGICALS
- OTHER DERMATOLOGICAL PREPARATIONS
- OTHER DERMATOLOGICAL PREPARATIONS
Synthesis Plan
FORMULA:C20H16N6O2S

SMILES: COc1cc(Nc2cc(-c3ccccn3)ncn2)cc(C(=O)Nc2cncs2)c1

BIRTHDAY: 2018-12-01T22:30:05.898348
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C18H16F3N7O

SMILES: COc1cccc(C(F)(F)F)c1Nc1cnc(-c2[nH]nc3c2C=NN[C@H]3C)nc1

BIRTHDAY: 2018-12-01T22:30:05.908959
ATC: C02K
- CARDIOVASCULAR SYSTEM
- ANTIHYPERTENSIVES
- OTHER ANTIHYPERTENSIVES
Synthesis Plan