matter.farm

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

These compounds may interact with:

Tyrosine-protein kinase ITK/TSK

Potentially involved in: lung cancer; kidney cancer; carcinoma; asthma; hepatitis c; agammaglobulinemia; liver disease; cancer; anemia; autoimmune diseases; hepatomegaly; lymphoma; pancytopenia; splenomegaly; aphthous stomatitis; thrombocytopenia; esr raised; hemoglobin low; igg deficiency; recurrent infections

Disease data sourced from Pharos.

Inhibitor

FORMULA:C27H29N3O2

SMILES: CN(C)CCCCCC(=O)Nc1ccc(-c2ccc(-c3nc4ccccc4o3)cc2)cc1

BIRTHDAY: 2018-12-01T14:11:23.737570
ATC: A10B
- ALIMENTARY TRACT AND METABOLISM
- DRUGS USED IN DIABETES
- BLOOD GLUCOSE LOWERING DRUGS, EXCL. INSULINS
Synthesis Plan
FORMULA:C28H30N4O4

SMILES: C[C@H](C(=O)Nc1cccc(-c2ccccc2C(N)=O)c1)C(C)(C)N(C)C(=O)c1ccccc1C(N)=O

BIRTHDAY: 2018-12-01T14:11:23.748378
ATC: C08D
- CARDIOVASCULAR SYSTEM
- CALCIUM CHANNEL BLOCKERS
- SELECTIVE CALCIUM CHANNEL BLOCKERS WITH DIRECT CARDIAC EFFECTS
Synthesis Plan
FORMULA:C26H23N5O2

SMILES: COc1cccc(-c2cnn3c2N=C[C@@H](Nc2ccccc2NC(=O)c2ccccc2)C3)c1

BIRTHDAY: 2018-12-01T14:11:23.758462
ATC: R06A
- RESPIRATORY SYSTEM
- ANTIHISTAMINES FOR SYSTEMIC USE
- ANTIHISTAMINES FOR SYSTEMIC USE
Synthesis Plan
FORMULA:C27H31N5O

SMILES: CN(C)CCCCCCC(=O)Nc1ccc(-n2cnc3cc(-c4cccnc4)ccc32)cc1

BIRTHDAY: 2018-12-01T14:11:23.767746
ATC: R05D
- RESPIRATORY SYSTEM
- COUGH AND COLD PREPARATIONS
- COUGH SUPPRESSANTS, EXCL. COMBINATIONS WITH EXPECTORANTS
Synthesis Plan
FORMULA:C27H31N5O

SMILES: CN(C)CCCCCCC(=O)Nc1ccc(-n2cnc3ccc(-c4cccnc4)cc32)cc1

BIRTHDAY: 2018-12-01T14:11:23.777172
ATC: J01X
- ANTIINFECTIVES FOR SYSTEMIC USE
- ANTIBACTERIALS FOR SYSTEMIC USE
- OTHER ANTIBACTERIALS
Synthesis Plan
FORMULA:C21H31N7O

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

BIRTHDAY: 2018-12-01T14:11:23.786762
ATC: P01A
- ANTIPARASITIC PRODUCTS, INSECTICIDES AND REPELLENTS
- ANTIPROTOZOALS
- AGENTS AGAINST AMOEBIASIS AND OTHER PROTOZOAL DISEASES
Synthesis Plan
FORMULA:C25H18F3N5O4

SMILES: CC(=O)Nc1cccc(-c2nc(C(=O)Nc3ccc(C(=O)Nc4ccccc4C(F)(F)F)cc3)no2)c1

BIRTHDAY: 2018-12-01T14:11:23.798755
ATC: N02B
- NERVOUS SYSTEM
- ANALGESICS
- OTHER ANALGESICS AND ANTIPYRETICS
Synthesis Plan
FORMULA:C26H36N2O

SMILES: N[C@H]1C=C(CCCCN(CCCc2ccccc2)Cc2ccccc2)COCC1

BIRTHDAY: 2018-12-01T14:11:23.806637
ATC: R05D
- RESPIRATORY SYSTEM
- COUGH AND COLD PREPARATIONS
- COUGH SUPPRESSANTS, EXCL. COMBINATIONS WITH EXPECTORANTS
Synthesis Plan
FORMULA:C24H28N8O4

SMILES: COc1cccc([C@@]23N=C(N[C@@H](C)C(=O)N[C@@H](C)O)N=CC2=NN[C@@]3(N)c2ccccc2C(N)=O)c1

BIRTHDAY: 2018-12-01T14:11:23.819438
ATC: L02B
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ENDOCRINE THERAPY
- HORMONE ANTAGONISTS AND RELATED AGENTS
Synthesis Plan
FORMULA:C27H33N5O

SMILES: CN(C)C(C)(C)C(C)(C)C(=O)Nc1ccccc1N1C=N[C@@H]2C=CC=C[C@@]21c1ccncc1

BIRTHDAY: 2018-12-01T14:11:23.829955
ATC: P01B
- ANTIPARASITIC PRODUCTS, INSECTICIDES AND REPELLENTS
- ANTIPROTOZOALS
- ANTIMALARIALS
Synthesis Plan
FORMULA:C27H26N6O2

SMILES: COc1ccccc1[C@]12C=NN(Cc3ccc(C(N)=O)cc3)[C@]1(NCc1ccccc1)C=NC=N2

BIRTHDAY: 2018-12-01T14:11:23.840982
ATC: L01D
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- CYTOTOXIC ANTIBIOTICS AND RELATED SUBSTANCES
Synthesis Plan
FORMULA:C24H30N4O2

SMILES: Cc1nc(-c2ccc(-c3ccc(NC(=O)CCCCCCN(C)C)cc3)cc2)no1

BIRTHDAY: 2018-12-01T14:11:23.849613
ATC: C02A
- CARDIOVASCULAR SYSTEM
- ANTIHYPERTENSIVES
- ANTIADRENERGIC AGENTS, CENTRALLY ACTING
Synthesis Plan
FORMULA:C21H31N7O

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

BIRTHDAY: 2018-12-01T14:11:23.859590
ATC: A07A
- ALIMENTARY TRACT AND METABOLISM
- ANTIDIARRHEALS, INTESTINAL ANTIINFLAMMATORY/ANTIINFECTIVE AGENTS
- INTESTINAL ANTIINFECTIVES
Synthesis Plan
FORMULA:C27H33N5O

SMILES: CN(C)C(C)(C)C(C)(C)C(=O)Nc1ccccc1N1C=N[C@@]2(c3ccccn3)C=CC=C[C@H]12

BIRTHDAY: 2018-12-01T14:11:23.869615
ATC: R06A
- RESPIRATORY SYSTEM
- ANTIHISTAMINES FOR SYSTEMIC USE
- ANTIHISTAMINES FOR SYSTEMIC USE
Synthesis Plan
FORMULA:C23H26N2O3

SMILES: CC(C)[C@]1(C)Nc2cccc(c2)CNCCc2ccc(cc2)C(=O)C(=O)C1=O

BIRTHDAY: 2018-12-01T14:11:23.878837
ATC: N02B
- NERVOUS SYSTEM
- ANALGESICS
- OTHER ANALGESICS AND ANTIPYRETICS
Synthesis Plan
FORMULA:C29H33N7O3

SMILES: N[C@@]1(C2CC2)CNC[C@@]2(c3ccc(NC(=O)c4noc(-c5ccccc5NC(=O)C5CC5)n4)cc3)CC[C@H]1N2

BIRTHDAY: 2018-12-01T14:11:23.899516
ATC: A10B
- ALIMENTARY TRACT AND METABOLISM
- DRUGS USED IN DIABETES
- BLOOD GLUCOSE LOWERING DRUGS, EXCL. INSULINS
Synthesis Plan
FORMULA:C25H33N5O2

SMILES: C[C@@H]1CC(=O)c2c(n(CCN(C)C)c3ccc(C(=O)Nc4cc(C(C)(C)C)n[nH]4)cc23)C1

BIRTHDAY: 2018-12-01T14:11:23.909096
ATC: N05A
- NERVOUS SYSTEM
- PSYCHOLEPTICS
- ANTIPSYCHOTICS
Synthesis Plan
FORMULA:C23H25N7O

SMILES: CN(C)CCC[C@H](C#N)NC(=O)c1cccc(Nc2nccc(-c3cccnc3)n2)c1

BIRTHDAY: 2018-12-01T14:11:23.918795
ATC: C10A
- CARDIOVASCULAR SYSTEM
- LIPID MODIFYING AGENTS
- LIPID MODIFYING AGENTS, PLAIN
Synthesis Plan
FORMULA:C27H33N5O

SMILES: CN(C)C(C)(C)C(C)(C)C(=O)Nc1ccccc1N1C=N[C@]2(c3ccccn3)C=CC=C[C@H]12

BIRTHDAY: 2018-12-25T02:03:26.863631
ATC: R06A
- RESPIRATORY SYSTEM
- ANTIHISTAMINES FOR SYSTEMIC USE
- ANTIHISTAMINES FOR SYSTEMIC USE
Synthesis Plan
FORMULA:C27H31N5O

SMILES: CN(C)CCCCCCC(=O)Nc1ccc(-n2cnc3cc(-c4ccncc4)ccc32)cc1

BIRTHDAY: 2018-12-25T02:03:26.873729
ATC: R05D
- RESPIRATORY SYSTEM
- COUGH AND COLD PREPARATIONS
- COUGH SUPPRESSANTS, EXCL. COMBINATIONS WITH EXPECTORANTS
Synthesis Plan
FORMULA:C18H18N4O3

SMILES: CC(C)CC(=O)Nc1cn[nH]c1-c1ccc(-c2cc(=O)ocn2)cc1

BIRTHDAY: 2018-12-25T02:03:26.882983
ATC: C10A
- CARDIOVASCULAR SYSTEM
- LIPID MODIFYING AGENTS
- LIPID MODIFYING AGENTS, PLAIN
Synthesis Plan
FORMULA:C26H31N5O3

SMILES: C[C@@H](CC(=O)Nc1cc(C(C)(C)C)n(CC(=O)Nc2cccc(C(N)=O)c2)n1)c1ccccc1

BIRTHDAY: 2018-12-25T02:03:26.893628
ATC: N02B
- NERVOUS SYSTEM
- ANALGESICS
- OTHER ANALGESICS AND ANTIPYRETICS
Synthesis Plan
FORMULA:C25H20N6O2

SMILES: COc1ccccc1-c1[nH]nc2ncnc(Nc3ccc(NC(=O)c4ccccc4)cc3)c12

BIRTHDAY: 2018-12-25T02:03:26.904025
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C25H32N6O

SMILES: CN(C)C(C)(C)C(C)(C)C(=O)Nc1ccccc1N1C=N[C@@]2(c3ccn[nH]3)C=CC=C[C@H]12

BIRTHDAY: 2018-12-25T02:03:26.914182
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C25H35N7O3S

SMILES: Cc1ccc2nc1CNCCCOCCN(C(=O)c1cc(NC(=O)CC(C)C)n[nH]1)C[C@@H]1CSC2=N1

BIRTHDAY: 2018-12-25T02:03:26.925809
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C21H29N5O3

SMILES: CC(C)CC(=O)Nc1cc(C(C)(C)C)n(CC(=O)Nc2cccc(C(N)=O)c2)n1

BIRTHDAY: 2018-12-25T02:03:26.935553
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C25H31N3O

SMILES: Cc1ccccc1-n1nc(-c2ccc(C(C)(C)C)cc2)cc1NC(=O)CC(C)C

BIRTHDAY: 2018-12-25T02:03:26.944137
ATC: N06A
- NERVOUS SYSTEM
- PSYCHOANALEPTICS
- ANTIDEPRESSANTS
Synthesis Plan
FORMULA:C26H23N5O2

SMILES: COc1cccc(-c2cnn3c2N=C[C@H](Nc2ccccc2NC(=O)c2ccccc2)C3)c1

BIRTHDAY: 2018-12-25T02:03:26.954425
ATC: R06A
- RESPIRATORY SYSTEM
- ANTIHISTAMINES FOR SYSTEMIC USE
- ANTIHISTAMINES FOR SYSTEMIC USE
Synthesis Plan
FORMULA:C21H29N5O3

SMILES: CC(C)CC(=O)Nc1nn(CC(=O)Nc2cccc(C(N)=O)c2)cc1C(C)(C)C

BIRTHDAY: 2018-12-25T02:03:26.964103
ATC: C02B
- CARDIOVASCULAR SYSTEM
- ANTIHYPERTENSIVES
- ANTIADRENERGIC AGENTS, GANGLION-BLOCKING
Synthesis Plan
FORMULA:C28H33N3O5

SMILES: COc1cccc([C@@]2(C(C)=O)C=NN[C@]2(N)c2ccccc2[C@@H]2COC[C@@H]3CCC[C@H](C=CO2)O3)c1

BIRTHDAY: 2018-12-25T02:03:26.976454
ATC: C02A
- CARDIOVASCULAR SYSTEM
- ANTIHYPERTENSIVES
- ANTIADRENERGIC AGENTS, CENTRALLY ACTING
Synthesis Plan
FORMULA:C26H18N4O2

SMILES: O=C(Nc1cccc(-c2noc(-c3ccccn3)n2)c1)c1ccc(-c2ccccc2)cc1

BIRTHDAY: 2018-12-25T02:03:26.994453
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C28H37N3O

SMILES: CC(C)CC(=O)Nc1cc(-c2ccc(C(C)(C)C)cc2)nn1-c1ccc(C(C)(C)C)cc1

BIRTHDAY: 2018-12-25T02:03:27.013708
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C25H30N6O

SMILES: CN(C)CCCCCCC(=O)Nc1ccc(-n2cnc3ccc(-c4cn[nH]c4)cc32)cc1

BIRTHDAY: 2018-12-25T02:03:27.032823
ATC: J01X
- ANTIINFECTIVES FOR SYSTEMIC USE
- ANTIBACTERIALS FOR SYSTEMIC USE
- OTHER ANTIBACTERIALS
Synthesis Plan
FORMULA:C27H23N7O3

SMILES: COc1cccc(-c2nn(Cc3ccccc3NC(=O)c3cccc(C(N)=O)c3)c3ncnc(N)c23)c1

BIRTHDAY: 2018-12-25T02:03:27.044510
ATC: M03A
- MUSCULO-SKELETAL SYSTEM
- MUSCLE RELAXANTS
- MUSCLE RELAXANTS, PERIPHERALLY ACTING AGENTS
Synthesis Plan
FORMULA:C21H29N9O2

SMILES: CN(CCC[C@@H]1CNCCO1)c1nc(Nc2cc(C3CC3)[nH]n2)c2cc(C(N)=O)[nH]c2n1

BIRTHDAY: 2018-12-25T02:03:27.055848
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:C21H29N5O3

SMILES: CC(C)CC(=O)Nc1cn(CC(=O)Nc2cccc(C(N)=O)c2)nc1C(C)(C)C

BIRTHDAY: 2018-12-03T02:39:32.075496
ATC: D11A
- DERMATOLOGICALS
- OTHER DERMATOLOGICAL PREPARATIONS
- OTHER DERMATOLOGICAL PREPARATIONS
Synthesis Plan
FORMULA:C30H35N7O5

SMILES: CC(C)C[C@@H](NC(=O)c1cccc(NC(=O)c2cccc(C(N)=O)c2)c1)C(=O)N[C@@H](C(N)=O)[C@H](C)c1ncccc1N

BIRTHDAY: 2018-12-03T02:39:32.088399
ATC: C01B
- CARDIOVASCULAR SYSTEM
- CARDIAC THERAPY
- ANTIARRHYTHMICS, CLASS I AND III
Synthesis Plan
FORMULA:C25H27N7O4

SMILES: COc1ccc(-c2nn(Cc3cccc(C(N)=O)c3)c3nc(NCCC(=O)NCCO)ncc23)cc1

BIRTHDAY: 2018-12-03T02:39:32.099912
ATC: M02A
- MUSCULO-SKELETAL SYSTEM
- TOPICAL PRODUCTS FOR JOINT AND MUSCULAR PAIN
- TOPICAL PRODUCTS FOR JOINT AND MUSCULAR PAIN
Synthesis Plan
FORMULA:C20H23N5O3

SMILES: CC(C)(CC(=O)Nc1cc(C2CC2)n[nH]1)NC(=O)c1cccc2c1CC(=O)N2

BIRTHDAY: 2018-12-03T02:39:32.128207
ATC: C02D
- CARDIOVASCULAR SYSTEM
- ANTIHYPERTENSIVES
- ARTERIOLAR SMOOTH MUSCLE, AGENTS ACTING ON
Synthesis Plan
FORMULA:C28H37N3O

SMILES: CC(C)CC(=O)Nc1cn(-c2ccc(C(C)(C)C)cc2)nc1-c1ccc(C(C)(C)C)cc1

BIRTHDAY: 2018-12-03T02:39:32.137161
ATC: M01A
- MUSCULO-SKELETAL SYSTEM
- ANTIINFLAMMATORY AND ANTIRHEUMATIC PRODUCTS
- ANTIINFLAMMATORY AND ANTIRHEUMATIC PRODUCTS, NON-STEROIDS
Synthesis Plan
FORMULA:C20H20N6O3S

SMILES: C[C@H]1C[C@H]2N[C@@H]3C(=O)[C@@H]4N[C@@H]([C@H]2c2ccc(C(=O)Nc5nnc(C(N)=O)s5)cc24)[C@@H]13

BIRTHDAY: 2018-12-03T02:39:32.148014
ATC: R02A
- RESPIRATORY SYSTEM
- THROAT PREPARATIONS
- THROAT PREPARATIONS
Synthesis Plan
FORMULA:C24H42N2

SMILES: CN(C)CCCCC[C@@H]1CCCCCCc2ccccc2CCNCC1

BIRTHDAY: 2018-12-03T02:39:32.155003
ATC: B01A
- BLOOD AND BLOOD FORMING ORGANS
- ANTITHROMBOTIC AGENTS
- ANTITHROMBOTIC AGENTS
Synthesis Plan
FORMULA:C19H21F3N4O2

SMILES: CC(C)(CC(=O)Nc1cn[nH]c1C1CC1)NC(=O)c1cccc(C(F)(F)F)c1

BIRTHDAY: 2018-12-03T02:39:32.164430
ATC: C10A
- CARDIOVASCULAR SYSTEM
- LIPID MODIFYING AGENTS
- LIPID MODIFYING AGENTS, PLAIN
Synthesis Plan
FORMULA:C26H36N4O3S

SMILES: Cc1ccc(Cn2nc(NC(=O)CC(C)C)cc2C(=O)NCC[C@H]2C[C@H]3CS[C@H](C3)O2)cc1C

BIRTHDAY: 2018-12-03T02:39:32.184211
ATC: N05A
- NERVOUS SYSTEM
- PSYCHOLEPTICS
- ANTIPSYCHOTICS
Synthesis Plan
FORMULA:C28H37N3O

SMILES: CC(C)CC(=O)Nc1cn(-c2ccccc2C(C)(C)C)nc1-c1ccccc1C(C)(C)C

BIRTHDAY: 2018-12-03T02:39:32.193173
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:C26H18N4O2

SMILES: O=C(Nc1ccc(-c2noc(-c3ccccn3)n2)cc1)c1ccccc1-c1ccccc1

BIRTHDAY: 2018-12-03T02:39:32.202711
ATC: C10A
- CARDIOVASCULAR SYSTEM
- LIPID MODIFYING AGENTS
- LIPID MODIFYING AGENTS, PLAIN
Synthesis Plan
FORMULA:C17H31N3S

SMILES: CC(C)C[C@H]1NCS[C@]2(NC=CC[C@H]2C2CCCCC2)N1

BIRTHDAY: 2018-12-03T02:39:32.228567
ATC: J04A
- ANTIINFECTIVES FOR SYSTEMIC USE
- ANTIMYCOBACTERIALS
- DRUGS FOR TREATMENT OF TUBERCULOSIS
Synthesis Plan
FORMULA:C22H29N3O2

SMILES: CN(C)C(C)(C)C(C)(C)C(=O)Nc1ccccc1-c1ccccc1C(N)=O

BIRTHDAY: 2018-12-03T02:39:32.236728
ATC: M03A
- MUSCULO-SKELETAL SYSTEM
- MUSCLE RELAXANTS
- MUSCLE RELAXANTS, PERIPHERALLY ACTING AGENTS
Synthesis Plan
FORMULA:C20H24N4O

SMILES: C[C@H](C(=O)Nc1ccccc1-c1ccnc(C#N)c1)C(C)(C)N(C)C

BIRTHDAY: 2018-12-03T02:39:32.245094
ATC: N03A
- NERVOUS SYSTEM
- ANTIEPILEPTICS
- ANTIEPILEPTICS
Synthesis Plan
FORMULA:C27H29N7O6

SMILES: CNc1nc(NC)c2c(-c3ccc(OC)cc3)nn(Cc3ccc(C(=O)N[C@H](CCC(=O)O)C(=O)O)cc3)c2n1

BIRTHDAY: 2018-12-03T02:39:32.257918
ATC: B03X
- BLOOD AND BLOOD FORMING ORGANS
- ANTIANEMIC PREPARATIONS
- OTHER ANTIANEMIC PREPARATIONS
Synthesis Plan
FORMULA:C10H14N4

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

BIRTHDAY: 2018-11-30T03:41:28.084737
ATC: A12A
- ALIMENTARY TRACT AND METABOLISM
- MINERAL SUPPLEMENTS
- CALCIUM
Synthesis plan pending
FORMULA:C32H33ClN4O

SMILES: COc1ccccc1[C@@]12C=C(c3ccccc3)C=CC1=NN[C@]2(N)[C@]12CCCN(CC1)[C@]1(Cl)C=CC=C[C@@H]12

BIRTHDAY: 2018-11-30T03:41:28.097957
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis plan pending
FORMULA:C25H31N3O

SMILES: Cc1cccc(-n2cc(NC(=O)CC(C)C)c(-c3ccccc3C(C)(C)C)n2)c1

BIRTHDAY: 2018-11-30T03:41:28.106337
ATC: C02K
- CARDIOVASCULAR SYSTEM
- ANTIHYPERTENSIVES
- OTHER ANTIHYPERTENSIVES
Synthesis plan pending
FORMULA:C23H20N8O2

SMILES: COc1cccc(-c2cc(-c3cc(-c4ccccc4C(=O)Nc4[nH]ncc4N)n[nH]3)n[nH]2)c1

BIRTHDAY: 2018-11-30T03:41:28.117159
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis plan pending
FORMULA:C24H33N5O4

SMILES: CC(C)CC(=O)Nc1cc(C(C)(C)C)nn1CC(=O)Nc1cccc2c1COC(=O)CCN2

BIRTHDAY: 2018-11-30T03:41:28.135463
ATC: J01X
- ANTIINFECTIVES FOR SYSTEMIC USE
- ANTIBACTERIALS FOR SYSTEMIC USE
- OTHER ANTIBACTERIALS
Synthesis plan pending
FORMULA:C25H19N7O2

SMILES: O=C(Nc1cccc(-c2nc(-c3ccncc3)no2)c1)c1cc(NCc2ccccn2)ccn1

BIRTHDAY: 2018-11-30T03:41:28.155099
ATC: N03A
- NERVOUS SYSTEM
- ANTIEPILEPTICS
- ANTIEPILEPTICS
Synthesis plan pending
FORMULA:C28H37N3O

SMILES: CC(C)CC(=O)Nc1cnn(-c2ccccc2C(C)(C)C)c1-c1ccccc1C(C)(C)C

BIRTHDAY: 2018-11-30T03:41:28.164343
ATC: N05A
- NERVOUS SYSTEM
- PSYCHOLEPTICS
- ANTIPSYCHOTICS
Synthesis plan pending
FORMULA:C20H28BN5O4

SMILES: CNC(=O)[C@@]1(Nc2ccccc2NC(=O)c2ccncc2N)CO[BH2-][OH+][C@@H]1C(C)C

BIRTHDAY: 2018-11-30T03:41:28.175728
ATC: M03A
- MUSCULO-SKELETAL SYSTEM
- MUSCLE RELAXANTS
- MUSCLE RELAXANTS, PERIPHERALLY ACTING AGENTS
Synthesis plan pending
FORMULA:C24H29FN6O3

SMILES: CC(C)CC(=O)Nc1cnn([C@]2(N)NCCCc3cncc(c3)OC(=O)[C@@H]3C(F)=CC=C[C@H]32)c1

BIRTHDAY: 2018-11-30T03:41:28.195879
ATC: M01A
- MUSCULO-SKELETAL SYSTEM
- ANTIINFLAMMATORY AND ANTIRHEUMATIC PRODUCTS
- ANTIINFLAMMATORY AND ANTIRHEUMATIC PRODUCTS, NON-STEROIDS
Synthesis plan pending
FORMULA:C25H19N7O2

SMILES: O=C(Nc1ccc(-c2nc(-c3ccncc3)no2)cc1)c1ccc(NCc2ccccn2)cn1

BIRTHDAY: 2018-11-30T03:41:28.206203
ATC: V08A
- VARIOUS
- CONTRAST MEDIA
- X-RAY CONTRAST MEDIA, IODINATED
Synthesis plan pending
FORMULA:C26H18N4O2

SMILES: O=C(Nc1ccccc1-c1nc(-c2ccccn2)no1)c1cccc(-c2ccccc2)c1

BIRTHDAY: 2018-11-30T03:41:28.216314
ATC: G03B
- GENITO URINARY SYSTEM AND SEX HORMONES
- SEX HORMONES AND MODULATORS OF THE GENITAL SYSTEM
- ANDROGENS
Synthesis plan pending
FORMULA:C28H25F3N6O2

SMILES: COc1ccc([C@]23C=NN(Cc4ccc(C(N)=O)cc4)[C@]2(NCc2ccccc2C(F)(F)F)C=NC=N3)cc1

BIRTHDAY: 2018-11-30T03:41:28.229053
ATC: C08D
- CARDIOVASCULAR SYSTEM
- CALCIUM CHANNEL BLOCKERS
- SELECTIVE CALCIUM CHANNEL BLOCKERS WITH DIRECT CARDIAC EFFECTS
Synthesis plan pending
FORMULA:C24H37N7O3

SMILES: CC(C)CC1=CN(C(=O)c2ccc(C(=O)N[C@@H](CCCNC(=N)N)C(=O)N(C)C)cc2)CCN1

BIRTHDAY: 2018-11-30T03:41:28.239336
ATC: G03D
- GENITO URINARY SYSTEM AND SEX HORMONES
- SEX HORMONES AND MODULATORS OF THE GENITAL SYSTEM
- PROGESTOGENS
Synthesis plan pending
FORMULA:C21H29N5O3

SMILES: CC(C)CC(=O)Nc1cc(C(C)(C)C)nn1CC(=O)Nc1ccc(C(N)=O)cc1

BIRTHDAY: 2018-11-19T08:14:06.934622
ATC: N02B
- NERVOUS SYSTEM
- ANALGESICS
- OTHER ANALGESICS AND ANTIPYRETICS
Synthesis plan pending
FORMULA:C28H33N3O2

SMILES: CN(CCCCCCC(=O)Nc1cccc(-c2cccc(C(N)=O)c2)c1)Cc1ccccc1

BIRTHDAY: 2018-11-19T08:14:06.943785
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:C21H26N6O3

SMILES: CC(C)(CC(=O)Nc1cn[nH]c1C1CC1)NC(=O)c1ccc2c(c1)N[C@H](C(N)=O)C2

BIRTHDAY: 2018-11-19T08:14:06.953785
ATC: H01B
- SYSTEMIC HORMONAL PREPARATIONS, EXCL. SEX HORMONES AND INSULINS
- PITUITARY AND HYPOTHALAMIC HORMONES AND ANALOGUES
- POSTERIOR PITUITARY LOBE HORMONES
Synthesis plan pending
FORMULA:C25H33N5O2

SMILES: C[C@H]1CC(=O)c2c(n(CCN(C)C)c3ccc(C(=O)Nc4cc(C(C)(C)C)n[nH]4)cc23)C1

BIRTHDAY: 2018-11-19T08:14:06.963492
ATC: N05A
- NERVOUS SYSTEM
- PSYCHOLEPTICS
- ANTIPSYCHOTICS
Synthesis plan pending
FORMULA:C28H37N3O

SMILES: CC(C)CC(=O)Nc1cc(-c2ccc(C(C)(C)C)cc2)n(-c2ccc(C(C)(C)C)cc2)n1

BIRTHDAY: 2018-11-19T08:14:06.972291
ATC: M01A
- MUSCULO-SKELETAL SYSTEM
- ANTIINFLAMMATORY AND ANTIRHEUMATIC PRODUCTS
- ANTIINFLAMMATORY AND ANTIRHEUMATIC PRODUCTS, NON-STEROIDS
Synthesis plan pending
FORMULA:C25H31N3O

SMILES: Cc1cccc(-n2ncc(NC(=O)CC(C)C)c2-c2ccccc2C(C)(C)C)c1

BIRTHDAY: 2018-11-19T08:14:06.990447
ATC: M02A
- MUSCULO-SKELETAL SYSTEM
- TOPICAL PRODUCTS FOR JOINT AND MUSCULAR PAIN
- TOPICAL PRODUCTS FOR JOINT AND MUSCULAR PAIN
Synthesis plan pending
FORMULA:C11H17N3O

SMILES: CC(C)CC(=O)Nc1cn[nH]c1C1CC1

BIRTHDAY: 2018-11-19T08:14:06.997064
ATC: C10A
- CARDIOVASCULAR SYSTEM
- LIPID MODIFYING AGENTS
- LIPID MODIFYING AGENTS, PLAIN
Synthesis plan pending
FORMULA:C28H37N3O

SMILES: CC(C)CC(=O)Nc1cn(-c2cccc(C(C)(C)C)c2)nc1-c1ccccc1C(C)(C)C

BIRTHDAY: 2018-11-19T08:14:07.005935
ATC: C02A
- CARDIOVASCULAR SYSTEM
- ANTIHYPERTENSIVES
- ANTIADRENERGIC AGENTS, CENTRALLY ACTING
Synthesis plan pending
FORMULA:C26H32N4O2

SMILES: CC(C)CC(=O)Nc1cnn(Cc2ccccc2C(N)=O)c1-c1ccccc1C(C)(C)C

BIRTHDAY: 2018-11-19T08:14:07.015618
ATC: B03X
- BLOOD AND BLOOD FORMING ORGANS
- ANTIANEMIC PREPARATIONS
- OTHER ANTIANEMIC PREPARATIONS
Synthesis plan pending
FORMULA:C41H37N5O4S

SMILES: COc1ccccc1[C@@H]1[C@H]2C(=O)CCCC2=NN1Cc1ccc2c(c1)C(=O)NCc1cccc(c1)-c1cc(ncn1)Sc1cccc(c1)OCC2

BIRTHDAY: 2018-11-19T08:14:07.032059
ATC: C08D
- CARDIOVASCULAR SYSTEM
- CALCIUM CHANNEL BLOCKERS
- SELECTIVE CALCIUM CHANNEL BLOCKERS WITH DIRECT CARDIAC EFFECTS
Synthesis plan pending
FORMULA:C18H25N3O

SMILES: CC(C)CC(=O)Nc1cn[nH]c1-c1ccccc1C(C)(C)C

BIRTHDAY: 2018-11-19T08:14:07.048973
ATC: M01A
- MUSCULO-SKELETAL SYSTEM
- ANTIINFLAMMATORY AND ANTIRHEUMATIC PRODUCTS
- ANTIINFLAMMATORY AND ANTIRHEUMATIC PRODUCTS, NON-STEROIDS
Synthesis plan pending
FORMULA:C11H17N3O

SMILES: CC(C)CC(=O)Nc1cc(C2CC2)n[nH]1

BIRTHDAY: 2018-11-19T08:14:07.055291
ATC: P01A
- ANTIPARASITIC PRODUCTS, INSECTICIDES AND REPELLENTS
- ANTIPROTOZOALS
- AGENTS AGAINST AMOEBIASIS AND OTHER PROTOZOAL DISEASES
Synthesis plan pending
FORMULA:C26H25N7O2

SMILES: COc1cccc([C@]23C(=NN[C@@]2(N)c2ccc(C(N)=O)cc2)N=CN=C3NCc2ccccc2)c1

BIRTHDAY: 2018-11-19T08:14:07.066845
ATC: N03A
- NERVOUS SYSTEM
- ANTIEPILEPTICS
- ANTIEPILEPTICS
Synthesis plan pending
FORMULA:C21H26N4O

SMILES: C[C@H](C[C@@H](C)C(=O)Nc1ccc(-c2cncc(C#N)c2)cc1)CN(C)C

BIRTHDAY: 2018-11-19T08:14:07.074900
ATC: R07A
- RESPIRATORY SYSTEM
- OTHER RESPIRATORY SYSTEM PRODUCTS
- OTHER RESPIRATORY SYSTEM PRODUCTS
Synthesis plan pending
FORMULA:C28H33N3O2

SMILES: CN(CCCCCCC(=O)Nc1ccc(-c2cccc(C(N)=O)c2)cc1)Cc1ccccc1

BIRTHDAY: 2018-11-19T08:14:07.083972
ATC: C08D
- CARDIOVASCULAR SYSTEM
- CALCIUM CHANNEL BLOCKERS
- SELECTIVE CALCIUM CHANNEL BLOCKERS WITH DIRECT CARDIAC EFFECTS
Synthesis plan pending
FORMULA:C27H24N6O2

SMILES: COc1ccccc1-c1nn(Cc2ccccc2C(N)=O)c2nc(NCc3ccccc3)ncc12

BIRTHDAY: 2018-11-19T08:14:07.105130
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:C20H23N5O3

SMILES: CC(C)(CC(=O)Nc1cn[nH]c1C1CC1)NC(=O)c1cccc2c1C(=O)CN2

BIRTHDAY: 2018-11-19T08:14:07.114554
ATC: C02D
- CARDIOVASCULAR SYSTEM
- ANTIHYPERTENSIVES
- ARTERIOLAR SMOOTH MUSCLE, AGENTS ACTING ON
Synthesis plan pending
FORMULA:C24H28N6O2

SMILES: COc1ccccc1[C@@]12N=CC=C(N)N1N=C[C@]2(N)c1cccc(C(=O)NC(C)(C)C)c1

BIRTHDAY: 2018-11-19T08:14:07.125550
ATC: S01A
- SENSORY ORGANS
- OPHTHALMOLOGICALS
- ANTIINFECTIVES
Synthesis plan pending
FORMULA:C21H31N7O

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

BIRTHDAY: 2018-11-19T08:14:07.135440
ATC: A07A
- ALIMENTARY TRACT AND METABOLISM
- ANTIDIARRHEALS, INTESTINAL ANTIINFLAMMATORY/ANTIINFECTIVE AGENTS
- INTESTINAL ANTIINFECTIVES
Synthesis plan pending
FORMULA:C21H22N6O2

SMILES: CN(C)C(C)(C)C(=O)Nc1cccc2[nH]c(NC(=O)c3ccccc3C#N)nc12

BIRTHDAY: 2018-11-19T08:14:07.145074
ATC: M01A
- MUSCULO-SKELETAL SYSTEM
- ANTIINFLAMMATORY AND ANTIRHEUMATIC PRODUCTS
- ANTIINFLAMMATORY AND ANTIRHEUMATIC PRODUCTS, NON-STEROIDS
Synthesis plan pending
FORMULA:C22H33N7O

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

BIRTHDAY: 2018-11-19T08:14:07.155107
ATC: N06A
- NERVOUS SYSTEM
- PSYCHOANALEPTICS
- ANTIDEPRESSANTS
Synthesis plan pending
FORMULA:C27H33N5O

SMILES: CN(C)C(C)(C)C(C)(C)C(=O)Nc1ccccc1N1C=N[C@]2(c3ccccn3)C=CC=C[C@@H]12

BIRTHDAY: 2018-11-19T08:14:07.165174
ATC: R06A
- RESPIRATORY SYSTEM
- ANTIHISTAMINES FOR SYSTEMIC USE
- ANTIHISTAMINES FOR SYSTEMIC USE
Synthesis plan pending
FORMULA:C25H31N3O

SMILES: CC(C)CC(=O)Nc1cnn(Cc2ccccc2)c1-c1ccccc1C(C)(C)C

BIRTHDAY: 2018-11-19T08:14:07.173836
ATC: B03X
- BLOOD AND BLOOD FORMING ORGANS
- ANTIANEMIC PREPARATIONS
- OTHER ANTIANEMIC PREPARATIONS
Synthesis plan pending
FORMULA:C26H18N4O2

SMILES: O=C(Nc1ccc(-c2noc(-c3cccnc3)n2)cc1)c1ccc(-c2ccccc2)cc1

BIRTHDAY: 2018-11-19T08:14:07.183262
ATC: N06B
- NERVOUS SYSTEM
- PSYCHOANALEPTICS
- PSYCHOSTIMULANTS, AGENTS USED FOR ADHD AND NOOTROPICS
Synthesis plan pending
FORMULA:C23H24N4O2

SMILES: CC(C)[C@@]1(C)Nc2ccnc(n2)Nc2cccc(c2)CC(=O)Oc2cccc1c2

BIRTHDAY: 2018-11-19T08:14:07.193295
ATC: L01B
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- ANTIMETABOLITES
Synthesis plan pending
FORMULA:C28H23F3N6O2

SMILES: COc1ccccc1-c1nn(Cc2cccc(C(N)=O)c2)c2cnc(NCc3ccc(C(F)(F)F)cc3)nc12

BIRTHDAY: 2018-11-19T08:14:07.205391
ATC: A12A
- ALIMENTARY TRACT AND METABOLISM
- MINERAL SUPPLEMENTS
- CALCIUM
Synthesis plan pending
FORMULA:C21H13F3N4O2

SMILES: O=C(Nc1cccc(-c2nc(-c3ccccn3)no2)c1)c1ccccc1C(F)(F)F

BIRTHDAY: 2018-11-19T08:14:07.215660
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis plan pending
FORMULA:C24H30N4O2

SMILES: Cc1noc(-c2ccccc2-c2cccc(NC(=O)C(C)(C)C(C)(C)N(C)C)c2)n1

BIRTHDAY: 2018-11-19T08:14:07.224687
ATC: C07A
- CARDIOVASCULAR SYSTEM
- BETA BLOCKING AGENTS
- BETA BLOCKING AGENTS
Synthesis plan pending
FORMULA:C25H35N3O

SMILES: CN(CCCCCCCCCC1=NON(c2ccccc2)C1)Cc1ccccc1

BIRTHDAY: 2018-11-19T08:14:07.232645
ATC: N06A
- NERVOUS SYSTEM
- PSYCHOANALEPTICS
- ANTIDEPRESSANTS
Synthesis plan pending
FORMULA:C28H24N2O3

SMILES: COc1cccc([C@H]2CN(C(=O)c3ccccc3-c3ccoc3)N=C2c2cccc(C)c2)c1

BIRTHDAY: 2018-11-19T08:14:07.251677
ATC: L01D
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- CYTOTOXIC ANTIBIOTICS AND RELATED SUBSTANCES
Synthesis plan pending
FORMULA:C19H23N5O2

SMILES: CC(C)(C)CC(=O)Nc1n[nH]c2c1N[C@@H](c1ccccc1C(N)=O)C=C2

BIRTHDAY: 2018-11-19T08:14:07.260586
ATC: N02B
- NERVOUS SYSTEM
- ANALGESICS
- OTHER ANALGESICS AND ANTIPYRETICS
Synthesis plan pending
FORMULA:C18H30N6O2

SMILES: CC(C)CC(=O)Nc1n[nH]c2c1N(C(=O)[C@]1(N)CCCNC1)CC2(C)C

BIRTHDAY: 2018-11-19T08:14:07.270144
ATC: L01C
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- PLANT ALKALOIDS AND OTHER NATURAL PRODUCTS
Synthesis plan pending
FORMULA:C24H22N4O4

SMILES: CN(C)C(=O)c1ccccc1NC(=O)c1ccccc1C(=O)Nc1ccc(C(N)=O)cc1

BIRTHDAY: 2018-11-19T08:14:07.280136
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis plan pending
FORMULA:C17H24N6

SMILES: c1ncc(N2CCCC2)c(Nc2cn[nH]c2C2CCCCC2)n1

BIRTHDAY: 2018-11-19T08:14:07.288865
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis plan pending
FORMULA:C23H26N6O2

SMILES: CNc1cccnc1C(=O)Nc1ccccc1[C@@H](C)CC(=O)Nc1cn[nH]c1C1CC1

BIRTHDAY: 2018-11-19T08:14:07.299090
ATC: C02D
- CARDIOVASCULAR SYSTEM
- ANTIHYPERTENSIVES
- ARTERIOLAR SMOOTH MUSCLE, AGENTS ACTING ON
Synthesis plan pending
FORMULA:C14H25NO

SMILES: CN(C)CCCCCCC1=CCC(=O)CC1

BIRTHDAY: 2018-11-19T08:14:07.304650
ATC: N06A
- NERVOUS SYSTEM
- PSYCHOANALEPTICS
- ANTIDEPRESSANTS
Synthesis plan pending
FORMULA:C27H24N6O2

SMILES: COc1ccc(-c2nn(Cc3cccc(C(N)=O)c3)c3nc(NCc4ccccc4)ncc23)cc1

BIRTHDAY: 2018-11-19T08:14:07.315526
ATC: M01A
- MUSCULO-SKELETAL SYSTEM
- ANTIINFLAMMATORY AND ANTIRHEUMATIC PRODUCTS
- ANTIINFLAMMATORY AND ANTIRHEUMATIC PRODUCTS, NON-STEROIDS
Synthesis plan pending
FORMULA:C21H13F4N5O

SMILES: O=C(Nc1cc(-c2cnccn2)nn1-c1ccc(C(F)(F)F)cc1)c1ccc(F)cc1

BIRTHDAY: 2018-11-19T08:14:07.326322
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis plan pending
FORMULA:C18H25N3O

SMILES: CC(C)CC(=O)Nc1cc(-c2ccc(C(C)(C)C)cc2)n[nH]1

BIRTHDAY: 2018-11-19T08:14:07.333298
ATC: M01A
- MUSCULO-SKELETAL SYSTEM
- ANTIINFLAMMATORY AND ANTIRHEUMATIC PRODUCTS
- ANTIINFLAMMATORY AND ANTIRHEUMATIC PRODUCTS, NON-STEROIDS
Synthesis plan pending
FORMULA:C21H16N4O2

SMILES: Cc1ccc(C(=O)Nc2ccc(-c3nc(-c4ccncc4)no3)cc2)cc1

BIRTHDAY: 2018-11-19T08:14:07.341899
ATC: R03D
- RESPIRATORY SYSTEM
- DRUGS FOR OBSTRUCTIVE AIRWAY DISEASES
- OTHER SYSTEMIC DRUGS FOR OBSTRUCTIVE AIRWAY DISEASES
Synthesis plan pending
FORMULA:C18H21N5O2

SMILES: CC(C)CC(=O)Nc1n[nH]c2c1N[C@@H](c1ccccc1C(N)=O)C=C2

BIRTHDAY: 2018-11-19T08:14:07.359268
ATC: N02B
- NERVOUS SYSTEM
- ANALGESICS
- OTHER ANALGESICS AND ANTIPYRETICS
Synthesis plan pending
FORMULA:C12H15N3O2

SMILES: CC(C)Cc1c[nH+]c(C=C2NC(=O)C(=O)N2)[cH-]1

BIRTHDAY: 2018-11-19T08:14:07.366419
ATC: V03A
- VARIOUS
- ALL OTHER THERAPEUTIC PRODUCTS
- ALL OTHER THERAPEUTIC PRODUCTS
Synthesis plan pending
FORMULA:C28H25F3N6O2

SMILES: COc1cccc([C@@]23C=NC(NCc4ccccc4C(F)(F)F)=NC2=NN(Cc2ccc(C(N)=O)cc2)C3)c1

BIRTHDAY: 2018-11-19T08:14:07.378748
ATC: C08D
- CARDIOVASCULAR SYSTEM
- CALCIUM CHANNEL BLOCKERS
- SELECTIVE CALCIUM CHANNEL BLOCKERS WITH DIRECT CARDIAC EFFECTS
Synthesis plan pending
FORMULA:C28H45N5O3

SMILES: COc1cccc([C@@H](C)N(C)C(C)(C)C(C)(C)[C@H]2CCCOc3cncc(n3)NCNCCOC2)c1

BIRTHDAY: 2018-11-19T08:14:07.389279
ATC: A03F
- ALIMENTARY TRACT AND METABOLISM
- DRUGS FOR FUNCTIONAL GASTROINTESTINAL DISORDERS
- PROPULSIVES
Synthesis plan pending
FORMULA:C22H34N4O3

SMILES: CC(C)CC(=O)Nc1n[nH]c2c3ccc(c12)CCCNCCC[C@](C)(O)CCO3

BIRTHDAY: 2018-11-19T08:14:07.398390
ATC: D11A
- DERMATOLOGICALS
- OTHER DERMATOLOGICAL PREPARATIONS
- OTHER DERMATOLOGICAL PREPARATIONS
Synthesis plan pending
FORMULA:C16H22N3O2PS

SMILES: CN(C)C(C)(C)C1=NSN(c2ccccc2)C2=C1OPOCC2

BIRTHDAY: 2018-11-19T08:14:07.406899
ATC: C01B
- CARDIOVASCULAR SYSTEM
- CARDIAC THERAPY
- ANTIARRHYTHMICS, CLASS I AND III
Synthesis plan pending
FORMULA:C28H31N3O2

SMILES: CN(C)CCCCCCC(=O)Nc1ccc(-c2ccc(-c3nc4ccccc4o3)cc2)cc1

BIRTHDAY: 2018-11-19T08:14:07.415891
ATC: A10B
- ALIMENTARY TRACT AND METABOLISM
- DRUGS USED IN DIABETES
- BLOOD GLUCOSE LOWERING DRUGS, EXCL. INSULINS
Synthesis plan pending
FORMULA:C19H31N5O2

SMILES: CC(C)CC(=O)Nc1[nH]nc2c1CN(C(=O)C1CCN(C)CC1)C2(C)C

BIRTHDAY: 2018-11-19T08:14:07.425010
ATC: C02B
- CARDIOVASCULAR SYSTEM
- ANTIHYPERTENSIVES
- ANTIADRENERGIC AGENTS, GANGLION-BLOCKING
Synthesis plan pending
FORMULA:C35H36N4O2S

SMILES: COc1ccc(-c2nn(Cc3cccc(C4(N)CCSCC4)c3)c3ccc(C(=O)N[C@H](C)c4ccccc4)cc23)cc1

BIRTHDAY: 2018-11-19T08:14:07.436700
ATC: A10B
- ALIMENTARY TRACT AND METABOLISM
- DRUGS USED IN DIABETES
- BLOOD GLUCOSE LOWERING DRUGS, EXCL. INSULINS
Synthesis plan pending
FORMULA:C21H16N4O2

SMILES: Cc1ccccc1C(=O)Nc1cccc(-c2nc(-c3ccccn3)no2)c1

BIRTHDAY: 2018-11-19T08:14:07.445553
ATC: V09C
- VARIOUS
- DIAGNOSTIC RADIOPHARMACEUTICALS
- RENAL SYSTEM
Synthesis plan pending
FORMULA:C19H18FN5O

SMILES: COc1ccccc1[C@@]12CN(Cc3cccc(F)c3)N=C1C=NC(N)=N2

BIRTHDAY: 2018-11-19T08:14:07.454904
ATC: R05D
- RESPIRATORY SYSTEM
- COUGH AND COLD PREPARATIONS
- COUGH SUPPRESSANTS, EXCL. COMBINATIONS WITH EXPECTORANTS
Synthesis plan pending
FORMULA:C25H32N6O

SMILES: CN(C)C(C)(C)C(C)(C)C(=O)Nc1ccccc1N1C=N[C@@]2(c3ccn[nH]3)C=CC=C[C@@H]12

BIRTHDAY: 2018-11-19T08:14:07.465082
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis plan pending
FORMULA:C19H21F3N4O2

SMILES: CC(C)(CC(=O)Nc1cc(C2CC2)n[nH]1)NC(=O)c1ccc(C(F)(F)F)cc1

BIRTHDAY: 2018-11-19T08:14:07.475159
ATC: C09A
- CARDIOVASCULAR SYSTEM
- AGENTS ACTING ON THE RENIN-ANGIOTENSIN SYSTEM
- ACE INHIBITORS, PLAIN
Synthesis plan pending
FORMULA:C28H25N5O2

SMILES: CC(C)c1ccccc1-c1cc(-c2ccccc2C(=O)Nc2ccccc2C(=O)NCC#N)n[nH]1

BIRTHDAY: 2018-11-19T08:14:07.485589
ATC: C02A
- CARDIOVASCULAR SYSTEM
- ANTIHYPERTENSIVES
- ANTIADRENERGIC AGENTS, CENTRALLY ACTING
Synthesis plan pending
FORMULA:C27H31ClN2OS

SMILES: CN(CCCCC[C@@]12C=CC=C[C@@H]1Sc1ccccc1C(=O)N2C)Cc1ccc(Cl)cc1

BIRTHDAY: 2018-11-19T08:14:07.495329
ATC: J05A
- ANTIINFECTIVES FOR SYSTEMIC USE
- ANTIVIRALS FOR SYSTEMIC USE
- DIRECT ACTING ANTIVIRALS
Synthesis plan pending
FORMULA:C32H35N7O3

SMILES: CN(CCCCCCC(=O)Nc1ccc(-c2ccc(C(N)=O)cc2)cc1)c1cc(C(=O)Nc2ccccc2)nc(N)n1

BIRTHDAY: 2018-11-19T08:14:07.507320
ATC: P01B
- ANTIPARASITIC PRODUCTS, INSECTICIDES AND REPELLENTS
- ANTIPROTOZOALS
- ANTIMALARIALS
Synthesis plan pending
FORMULA:C25H24F3N5O3

SMILES: C[C@@](CC(=O)Nc1cc(C2CC2)n[nH]1)(NC(=O)c1ccc(C(F)(F)F)cc1)C(=O)Nc1ccccc1

BIRTHDAY: 2018-11-19T08:14:07.521157
ATC: B01A
- BLOOD AND BLOOD FORMING ORGANS
- ANTITHROMBOTIC AGENTS
- ANTITHROMBOTIC AGENTS
Synthesis plan pending
FORMULA:C28H30N4O4

SMILES: CN(CCCCCC(=O)Nc1ccccc1-c1ccc(C(N)=O)cc1)C(=O)c1ccc(C(N)=O)cc1

BIRTHDAY: 2018-11-19T08:14:07.542280
ATC: C01E
- CARDIOVASCULAR SYSTEM
- CARDIAC THERAPY
- OTHER CARDIAC PREPARATIONS
Synthesis plan pending
FORMULA:C28H34N8O5

SMILES: COc1ccccc1[C@]12C=NN(Cc3ccccc3C(N)=O)[C@@H]1N=CN=C2N[C@@H](C)C(=O)N[C@@H](C)C(=O)N[C@@H](C)O

BIRTHDAY: 2018-11-19T08:14:07.556582
ATC: C08D
- CARDIOVASCULAR SYSTEM
- CALCIUM CHANNEL BLOCKERS
- SELECTIVE CALCIUM CHANNEL BLOCKERS WITH DIRECT CARDIAC EFFECTS
Synthesis plan pending
FORMULA:C27H33N5O

SMILES: CN(C)C(C)(C)C(C)(C)C(=O)Nc1ccccc1N1C=N[C@@H]2C=CC=C[C@@]21c1ccccn1

BIRTHDAY: 2018-11-19T08:14:07.567233
ATC: P01B
- ANTIPARASITIC PRODUCTS, INSECTICIDES AND REPELLENTS
- ANTIPROTOZOALS
- ANTIMALARIALS
Synthesis plan pending
FORMULA:C33H49N5O4

SMILES: CN(CCCCCCCCCCCCCCCC(=O)Nc1ccc(NC(=O)c2ccc(C(=N)N)cc2)cc1)CC(=O)O

BIRTHDAY: 2018-11-19T08:14:07.578365
ATC: N06A
- NERVOUS SYSTEM
- PSYCHOANALEPTICS
- ANTIDEPRESSANTS
Synthesis plan pending
FORMULA:C36H50N4O2

SMILES: CN(Cc1ccccc1)C(C)(C)C(C)(C)C(C)(C)C(C)(C)C(C)(C)C(=O)Nc1ccccc1NC(=O)c1ccncc1

BIRTHDAY: 2018-11-19T08:14:07.589281
ATC: N07B
- NERVOUS SYSTEM
- OTHER NERVOUS SYSTEM DRUGS
- DRUGS USED IN ADDICTIVE DISORDERS
Synthesis plan pending
FORMULA:C4H7N3

SMILES: CN1C=CN=NC1

BIRTHDAY: 2018-11-19T08:14:07.594448
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis plan pending
FORMULA:C18H25N3O

SMILES: Cc1c2ncn1CCCCOc1cccc(c1)[C@H](C)NCC2

BIRTHDAY: 2018-11-19T08:14:07.602246
ATC: N06D
- NERVOUS SYSTEM
- PSYCHOANALEPTICS
- ANTI-DEMENTIA DRUGS
Synthesis plan pending
FORMULA:C24H32N10O5S

SMILES: CCCn1nc(NC(=O)CC(C)C)cc1[C@H]1NC(=O)Cn2nnc(n2)-c2csc(n2)C(=O)NCC[C@H](C)OC1=O

BIRTHDAY: 2018-11-19T08:14:07.616011
ATC: A12B
- ALIMENTARY TRACT AND METABOLISM
- MINERAL SUPPLEMENTS
- POTASSIUM
Synthesis plan pending
FORMULA:C42H44N6O2

SMILES: CNC(=O)N1C[C@@](N)(c2ccc3c(c2)Cc2ccc4cc(ccc4c2)N2CCCN(CC2)Cc2cccc(c2)C3)C(c2ccc(OC)cc2)=N1

BIRTHDAY: 2018-11-19T08:14:07.633281
ATC: M01C
- MUSCULO-SKELETAL SYSTEM
- ANTIINFLAMMATORY AND ANTIRHEUMATIC PRODUCTS
- SPECIFIC ANTIRHEUMATIC AGENTS
Synthesis plan pending
FORMULA:C25H36N8O2

SMILES: CNc1nc(N2CCOCC2)c2ncn(-c3ccc(NC(=O)CCCCCCN(C)C)cc3)c2n1

BIRTHDAY: 2018-11-19T08:14:07.644076
ATC: L04A
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- IMMUNOSUPPRESSANTS
- IMMUNOSUPPRESSANTS
Synthesis plan pending
FORMULA:C24H39N9O3

SMILES: CC(C)C[C@@H](Nc1cc(-c2cnn(CC(N)=O)c2N)ncn1)C(=O)N[C@@H](C)C(=O)N[C@@H](C)C(C)(C)C

BIRTHDAY: 2018-11-30T17:23:49.890709
ATC: C08D
- CARDIOVASCULAR SYSTEM
- CALCIUM CHANNEL BLOCKERS
- SELECTIVE CALCIUM CHANNEL BLOCKERS WITH DIRECT CARDIAC EFFECTS
Synthesis Plan
FORMULA:C32H49N5O2

SMILES: CN(C)C(C)(C)C(C)(C)C(C)(C)C(C)(C)C(C)(C)C(=O)Nc1ccccc1NC(=O)c1ccccc1C(=N)N

BIRTHDAY: 2018-11-30T17:23:49.909558
ATC: M03A
- MUSCULO-SKELETAL SYSTEM
- MUSCLE RELAXANTS
- MUSCLE RELAXANTS, PERIPHERALLY ACTING AGENTS
Synthesis Plan
FORMULA:C21H26N4O2

SMILES: CN(C)CCCCCC(=O)Nc1ccc(-c2ccc3oc(N)nc3c2)cc1

BIRTHDAY: 2018-11-30T17:23:49.966136
ATC: N06A
- NERVOUS SYSTEM
- PSYCHOANALEPTICS
- ANTIDEPRESSANTS
Synthesis Plan
FORMULA:C19H23N5O2

SMILES: CC(C)(C)CC(=O)Nc1n[nH]c2c1N[C@H](c1ccccc1C(N)=O)C=C2

BIRTHDAY: 2018-11-30T17:23:49.974826
ATC: N02B
- NERVOUS SYSTEM
- ANALGESICS
- OTHER ANALGESICS AND ANTIPYRETICS
Synthesis Plan
FORMULA:C26H18N4O2

SMILES: O=C(Nc1ccccc1-c1nc(-c2ccncc2)no1)c1cccc(-c2ccccc2)c1

BIRTHDAY: 2018-11-30T17:23:49.984905
ATC: C08C
- CARDIOVASCULAR SYSTEM
- CALCIUM CHANNEL BLOCKERS
- SELECTIVE CALCIUM CHANNEL BLOCKERS WITH MAINLY VASCULAR EFFECTS
Synthesis Plan
FORMULA:C25H30N4O2

SMILES: CC(C)CC(=O)Nc1cnn(-c2ccccc2C(N)=O)c1-c1ccccc1C(C)(C)C

BIRTHDAY: 2018-11-30T17:23:49.994327
ATC: N02B
- NERVOUS SYSTEM
- ANALGESICS
- OTHER ANALGESICS AND ANTIPYRETICS
Synthesis Plan
FORMULA:C26H32N4O2

SMILES: CC(C)CC(=O)Nc1cc(-c2ccc(C(C)(C)C)cc2)nn1Cc1cccc(C(N)=O)c1

BIRTHDAY: 2018-11-30T17:23:50.030811
ATC: N02B
- NERVOUS SYSTEM
- ANALGESICS
- OTHER ANALGESICS AND ANTIPYRETICS
Synthesis Plan
FORMULA:C21H26N4O2

SMILES: C[C@H](C(=O)Nc1ccccc1-c1cccc2nc(N)oc12)C(C)(C)N(C)C

BIRTHDAY: 2018-11-30T17:23:50.039503
ATC: N01A
- NERVOUS SYSTEM
- ANESTHETICS
- ANESTHETICS, GENERAL
Synthesis Plan
FORMULA:C20H23N5O3

SMILES: CC(C)(CC(=O)Nc1cn[nH]c1C1CC1)NC(=O)c1cccc2c1NCC2=O

BIRTHDAY: 2018-11-30T17:23:50.048626
ATC: C02D
- CARDIOVASCULAR SYSTEM
- ANTIHYPERTENSIVES
- ARTERIOLAR SMOOTH MUSCLE, AGENTS ACTING ON
Synthesis Plan
FORMULA:C27H24N6O2

SMILES: COc1ccccc1-c1nn(Cc2ccccc2C(N)=O)c2cnc(NCc3ccccc3)nc12

BIRTHDAY: 2018-11-30T17:23:50.059073
ATC: C03C
- CARDIOVASCULAR SYSTEM
- DIURETICS
- HIGH-CEILING DIURETICS
Synthesis Plan
FORMULA:C33H27N5O

SMILES: O=C(Nc1ccnn1Cc1ccccc1)c1cn[nH]c1-c1ccccc1C(c1ccccc1)c1ccccc1

BIRTHDAY: 2018-12-02T16:06:57.617592
ATC: V08C
- VARIOUS
- CONTRAST MEDIA
- MAGNETIC RESONANCE IMAGING CONTRAST MEDIA
Synthesis Plan
FORMULA:C34H52N4O3

SMILES: Cc1ccccc1C(=O)Nc1ccc(NC(=O)CCCCCCCCCCCCCCCCN(C)CC(N)=O)cc1

BIRTHDAY: 2018-12-02T16:06:57.627852
ATC: C07A
- CARDIOVASCULAR SYSTEM
- BETA BLOCKING AGENTS
- BETA BLOCKING AGENTS
Synthesis Plan
FORMULA:C19H36N6O

SMILES: CC(C)CC(=O)Nc1cnn2c1CNCCCNCCNCCC2(C)C

BIRTHDAY: 2018-12-02T16:06:57.636319
ATC: M01A
- MUSCULO-SKELETAL SYSTEM
- ANTIINFLAMMATORY AND ANTIRHEUMATIC PRODUCTS
- ANTIINFLAMMATORY AND ANTIRHEUMATIC PRODUCTS, NON-STEROIDS
Synthesis Plan
FORMULA:C34H41N11O2

SMILES: N#C[C@H]1CN2CCNCc3cccc(c3)Oc3cccc(c3)[C@](N)(N[C@@]34NCCC(=O)CNc5cccc(c5)N[C@H]3C=NN4)N1CC2

BIRTHDAY: 2018-12-02T16:06:57.653851
ATC: C02K
- CARDIOVASCULAR SYSTEM
- ANTIHYPERTENSIVES
- OTHER ANTIHYPERTENSIVES
Synthesis Plan
FORMULA:C23H22ClN3O3

SMILES: O=C1CNCc2cc(cc(-c3cccc(Cl)c3)c2)OCC(O)=CCn2cnc(c2)C1

BIRTHDAY: 2018-12-02T16:06:57.663362
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C28H24N2O3

SMILES: COc1cccc([C@]2(c3ccccc3C)C=NN(C(=O)c3ccccc3-c3ccoc3)C2)c1

BIRTHDAY: 2018-12-02T16:06:57.673084
ATC: R03D
- RESPIRATORY SYSTEM
- DRUGS FOR OBSTRUCTIVE AIRWAY DISEASES
- OTHER SYSTEMIC DRUGS FOR OBSTRUCTIVE AIRWAY DISEASES
Synthesis Plan
FORMULA:C18H25N3O

SMILES: CC(C)CC(=O)Nc1cc(-c2ccccc2C(C)(C)C)n[nH]1

BIRTHDAY: 2018-12-02T16:06:57.680198
ATC: N02B
- NERVOUS SYSTEM
- ANALGESICS
- OTHER ANALGESICS AND ANTIPYRETICS
Synthesis Plan
FORMULA:C27H30N4O2

SMILES: CC(=O)N1c2cccc(c2)CNCC=CCCOc2cccc(c2)-c2cc(C(C)C)nc1n2

BIRTHDAY: 2018-12-02T16:06:57.717117
ATC: D11A
- DERMATOLOGICALS
- OTHER DERMATOLOGICAL PREPARATIONS
- OTHER DERMATOLOGICAL PREPARATIONS
Synthesis Plan
FORMULA:C19H21F3N4O2

SMILES: CC(C)(CC(=O)Nc1cn[nH]c1C1CC1)NC(=O)c1ccccc1C(F)(F)F

BIRTHDAY: 2018-12-02T16:06:57.736528
ATC: C02D
- CARDIOVASCULAR SYSTEM
- ANTIHYPERTENSIVES
- ARTERIOLAR SMOOTH MUSCLE, AGENTS ACTING ON
Synthesis Plan
FORMULA:C25H30N4O2

SMILES: CC(C)CC(=O)Nc1cn(-c2ccccc2C(N)=O)nc1-c1ccccc1C(C)(C)C

BIRTHDAY: 2018-12-02T16:06:57.785355
ATC: M02A
- MUSCULO-SKELETAL SYSTEM
- TOPICAL PRODUCTS FOR JOINT AND MUSCULAR PAIN
- TOPICAL PRODUCTS FOR JOINT AND MUSCULAR PAIN
Synthesis Plan
FORMULA:C23H27F2N5

SMILES: CC(C)C[C@@H]1C2CCC(CC2)[C@@H]1Nc1cnc(-c2c[nH]c3ncc(F)cc23)nc1F

BIRTHDAY: 2018-12-03T10:43:19.834062
ATC: L02B
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ENDOCRINE THERAPY
- HORMONE ANTAGONISTS AND RELATED AGENTS
Synthesis Plan
FORMULA:C31H30N8O4

SMILES: COc1ccc(-c2nn(Cc3cccc(C(N)=O)c3)c3nc(NCC(=O)NCC(=O)NCc4ccccc4)ncc23)cc1

BIRTHDAY: 2018-12-03T10:43:19.854346
ATC: M01A
- MUSCULO-SKELETAL SYSTEM
- ANTIINFLAMMATORY AND ANTIRHEUMATIC PRODUCTS
- ANTIINFLAMMATORY AND ANTIRHEUMATIC PRODUCTS, NON-STEROIDS
Synthesis Plan
FORMULA:C18H21N5O2

SMILES: CC(C)CC(=O)Nc1n[nH]c2c1C=CN[C@H]2c1ccccc1C(N)=O

BIRTHDAY: 2018-12-03T10:43:19.863189
ATC: S01E
- SENSORY ORGANS
- OPHTHALMOLOGICALS
- ANTIGLAUCOMA PREPARATIONS AND MIOTICS
Synthesis Plan
FORMULA:C37H50N4O3

SMILES: C[C@@H](C(=O)Nc1ccccc1NC(=O)c1ccccc1C(N)=O)C(C)(C)C(C)(C)C(C)(C)C(C)(C)N(C)Cc1ccccc1

BIRTHDAY: 2018-12-03T10:43:19.874865
ATC: N07B
- NERVOUS SYSTEM
- OTHER NERVOUS SYSTEM DRUGS
- DRUGS USED IN ADDICTIVE DISORDERS
Synthesis Plan
FORMULA:C29H29N7O4

SMILES: COc1ccc([C@H]2[C@@H]3N=C(NCCO)N=CC3=NN2Cc2ccccc2C(=O)Nc2ccccc2C(N)=O)cc1

BIRTHDAY: 2018-12-03T10:43:19.888410
ATC: P02C
- ANTIPARASITIC PRODUCTS, INSECTICIDES AND REPELLENTS
- ANTHELMINTICS
- ANTINEMATODAL AGENTS
Synthesis Plan
FORMULA:C26H18N4O2

SMILES: O=C(Nc1cccc(-c2noc(-c3ccncc3)n2)c1)c1ccc(-c2ccccc2)cc1

BIRTHDAY: 2018-12-03T10:43:19.897777
ATC: C02K
- CARDIOVASCULAR SYSTEM
- ANTIHYPERTENSIVES
- OTHER ANTIHYPERTENSIVES
Synthesis Plan
FORMULA:C21H25N5O2S

SMILES: CC(C)C[C@@H](Nc1cncnc1-c1scnc1-c1ccccc1)C(=O)N[C@@H](C)O

BIRTHDAY: 2018-12-03T10:43:19.907591
ATC: N05A
- NERVOUS SYSTEM
- PSYCHOLEPTICS
- ANTIPSYCHOTICS
Synthesis Plan
FORMULA:C24H29N3O4

SMILES: CN1C[C@@H]2OC[C@](C(=O)Nc3ccccc3C(=O)Nc3ccccc3C(C)(C)C)(C1)O2

BIRTHDAY: 2018-12-03T10:43:19.917438
ATC: C02K
- CARDIOVASCULAR SYSTEM
- ANTIHYPERTENSIVES
- OTHER ANTIHYPERTENSIVES
Synthesis Plan
FORMULA:C26H26F3N5O3

SMILES: Cc1ccc(NC(=O)[C@](C)(CC(=O)Nc2cc(C3CC3)n[nH]2)NC(=O)c2ccc(C(F)(F)F)cc2)cc1

BIRTHDAY: 2018-12-03T10:43:19.929050
ATC: B01A
- BLOOD AND BLOOD FORMING ORGANS
- ANTITHROMBOTIC AGENTS
- ANTITHROMBOTIC AGENTS
Synthesis Plan
FORMULA:C28H30N4O4

SMILES: CN(CCCCCC(=O)Nc1ccc(-c2cccc(C(N)=O)c2)cc1)C(=O)c1cccc(C(N)=O)c1

BIRTHDAY: 2018-12-03T10:43:19.981344
ATC: C07A
- CARDIOVASCULAR SYSTEM
- BETA BLOCKING AGENTS
- BETA BLOCKING AGENTS
Synthesis Plan
FORMULA:C28H31N7O2

SMILES: CN(CCCCCC(=O)Nc1cccc(-c2cccc(C(N)=O)c2)c1)c1cc(C2=NC=CC2)nc(N)n1

BIRTHDAY: 2018-12-03T19:11:44.429469
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C40H52N6O2

SMILES: CN(C)C(C)(C)C(C)(C)C(=O)Nc1ccccc1N1C=N[C@@]2(c3ccccn3)C=CC=C3C4=CC=C(OCCCCCCNCCC4)[C@@]312

BIRTHDAY: 2018-12-03T19:11:44.443245
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C24H26N4O

SMILES: Cc1ccc2cc1OCCC=CCNCc1cccc(c1)N(C)c1nccc-2n1

BIRTHDAY: 2018-12-03T19:11:44.461694
ATC: C02D
- CARDIOVASCULAR SYSTEM
- ANTIHYPERTENSIVES
- ARTERIOLAR SMOOTH MUSCLE, AGENTS ACTING ON
Synthesis Plan
FORMULA:C29H36N4O

SMILES: CN(C)CCCCCc1nc2cn1C(=O)C=CCc1cccc(c1)CN(c1ccccc1)CC2

BIRTHDAY: 2018-12-03T19:11:44.499046
ATC: B05A
- BLOOD AND BLOOD FORMING ORGANS
- BLOOD SUBSTITUTES AND PERFUSION SOLUTIONS
- BLOOD AND RELATED PRODUCTS
Synthesis Plan
FORMULA:C25H32N6O

SMILES: CN(C)C(C)(C)C(C)(C)C(=O)Nc1ccccc1N1C=N[C@]2(c3ccn[nH]3)C=CC=C[C@H]12

BIRTHDAY: 2018-12-03T19:11:44.509169
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C27H26N6O2

SMILES: COc1cccc([C@@]23CN(Cc4ccc(C(N)=O)cc4)N=C2C(NCc2ccccc2)=NC=N3)c1

BIRTHDAY: 2018-12-03T19:11:44.519937
ATC: N03A
- NERVOUS SYSTEM
- ANTIEPILEPTICS
- ANTIEPILEPTICS
Synthesis Plan
FORMULA:C27H30N6O3

SMILES: COc1ccccc1-c1[nH]ncc1NC(=O)c1cn(-c2cccc(C(C)C)c2)nc1C(=O)NC(C)C

BIRTHDAY: 2018-12-03T19:11:44.531466
ATC: J05A
- ANTIINFECTIVES FOR SYSTEMIC USE
- ANTIVIRALS FOR SYSTEMIC USE
- DIRECT ACTING ANTIVIRALS
Synthesis Plan
FORMULA:C37H50N4O3

SMILES: C[C@@H](C(=O)Nc1cccc(NC(=O)c2ccccc2C(N)=O)c1)C(C)(C)C(C)(C)C(C)(C)C(C)(C)N(C)Cc1ccccc1

BIRTHDAY: 2018-12-03T19:11:44.552322
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C34H42N6O3

SMILES: C[C@@H](C(=O)Nc1ccccc1-c1ccccc1C(N)=O)C(C)(C)N(C)c1nc(N)c2c(n1)CC=CCOCCCCC=C2

BIRTHDAY: 2018-12-03T19:11:44.564719
ATC: L01A
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- ALKYLATING AGENTS
Synthesis Plan
FORMULA:C31H29N7O5

SMILES: COc1ccccc1C1=Nn2c(nc(N3CCOCC3)cc2=O)[C@]1(N)c1ccc(C(=O)Nc2cccc(C(N)=O)c2)cc1

BIRTHDAY: 2018-12-03T19:11:44.587373
ATC: V09C
- VARIOUS
- DIAGNOSTIC RADIOPHARMACEUTICALS
- RENAL SYSTEM
Synthesis Plan
FORMULA:C25H26F3N5O2

SMILES: C[C@H](C(=O)Nc1ccccc1-c1ccccc1C(N)=O)C(C)(C)N(C)c1cncnc1C(F)(F)F

BIRTHDAY: 2018-12-03T19:11:44.599195
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C27H21N7O5

SMILES: COc1ccc(C2=Nn3c(nc4[nH]oc4c3=O)[C@]2(N)c2ccc(C(=O)Nc3cccc(C(N)=O)c3)cc2)cc1

BIRTHDAY: 2018-12-01T22:30:50.551400
ATC: C03X
- CARDIOVASCULAR SYSTEM
- DIURETICS
- OTHER DIURETICS
Synthesis Plan
FORMULA:C18H22N2O

SMILES: C=CC(=O)Nc1cccc2c1N[C@H]1C=C[C@]2(CC(C)C)C1

BIRTHDAY: 2018-12-01T22:30:50.558560
ATC: J01F
- ANTIINFECTIVES FOR SYSTEMIC USE
- ANTIBACTERIALS FOR SYSTEMIC USE
- MACROLIDES, LINCOSAMIDES AND STREPTOGRAMINS
Synthesis Plan
FORMULA:C27H33N5O

SMILES: CN(C)C(C)(C)C(C)(C)C(=O)Nc1ccccc1N1C=N[C@]2(c3ccncc3)C=CC=C[C@@H]12

BIRTHDAY: 2018-12-01T22:30:50.585234
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C31H23N5O

SMILES: O=C(Nc1ccccc1-c1[nH]ncc1-c1n[nH]cc1-c1ccccc1)c1ccccc1-c1ccccc1

BIRTHDAY: 2018-12-01T22:30:50.598640
ATC: D11A
- DERMATOLOGICALS
- OTHER DERMATOLOGICAL PREPARATIONS
- OTHER DERMATOLOGICAL PREPARATIONS
Synthesis Plan
FORMULA:C26H18N4O2

SMILES: O=C(Nc1cccc(-c2nc(-c3cccnc3)no2)c1)c1cccc(-c2ccccc2)c1

BIRTHDAY: 2018-12-01T22:30:50.608213
ATC: M04A
- MUSCULO-SKELETAL SYSTEM
- ANTIGOUT PREPARATIONS
- ANTIGOUT PREPARATIONS
Synthesis Plan
FORMULA:C26H28N4O2

SMILES: CN(C)CCCCCC(=O)Nc1ccc(-c2ccc(-c3nc4ccncc4o3)cc2)cc1

BIRTHDAY: 2018-12-01T22:30:50.653848
ATC: C03B
- CARDIOVASCULAR SYSTEM
- DIURETICS
- LOW-CEILING DIURETICS, EXCL. THIAZIDES
Synthesis Plan
FORMULA:C38H51N5O3

SMILES: CN(CCCCCCCCCCCCCCCC(=O)Nc1ccc(NC(=O)c2ccc(C(=N)N)cc2)cc1)C(=O)c1ccccc1

BIRTHDAY: 2018-12-01T22:30:50.674341
ATC: A10B
- ALIMENTARY TRACT AND METABOLISM
- DRUGS USED IN DIABETES
- BLOOD GLUCOSE LOWERING DRUGS, EXCL. INSULINS
Synthesis Plan