matter.farm

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

These compounds may interact with:

Epidermal growth factor receptor

Potentially involved in: lung cancer; cancer; immune system cancer; lymphoid leukemia; esophageal carcinoma; brain cancer; doid:159; breast cancer; peritoneum cancer; melanoma; doid:2627; kidney cancer; carcinoma; malignant glioma; skin cancer; biliary tract cancer; upper respiratory tract disease; doid:9917; exanthem; diarrhea

Disease data sourced from Pharos.

Antagonist

FORMULA:C24H35N5O

SMILES: CC(C)C[C@H](Nc1ncc(C(=O)NCCCN2CCCCC2)cn1)c1ccccc1

BIRTHDAY: 2018-12-01T14:10:35.432385
ATC: N05A
- NERVOUS SYSTEM
- PSYCHOLEPTICS
- ANTIPSYCHOTICS
Synthesis Plan
FORMULA:C23H30ClN5O2

SMILES: CC(C)C[C@@H](Nc1nccc(C(=O)NC(C)(C)N2CCCC2=O)n1)c1ccc(Cl)cc1

BIRTHDAY: 2018-12-01T14:10:35.442250
ATC: A03F
- ALIMENTARY TRACT AND METABOLISM
- DRUGS FOR FUNCTIONAL GASTROINTESTINAL DISORDERS
- PROPULSIVES
Synthesis Plan
FORMULA:C21H29N7O

SMILES: CC(C)C[C@@H](CO)Nc1nc(Nc2ccccc2C#N)nc2c1N(C(C)C)CN2

BIRTHDAY: 2018-12-01T14:10:35.451988
ATC: H01B
- SYSTEMIC HORMONAL PREPARATIONS, EXCL. SEX HORMONES AND INSULINS
- PITUITARY AND HYPOTHALAMIC HORMONES AND ANALOGUES
- POSTERIOR PITUITARY LOBE HORMONES
Synthesis Plan
FORMULA:C22H33N5O4

SMILES: COc1cc2ncnc(N[C@H](CC(C)C)C(=O)NCC(=O)NCC(C)C)c2cc1OC

BIRTHDAY: 2018-12-01T14:10:35.461781
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C25H30N6O2

SMILES: CC(C)(C)c1ccccc1Nc1cnc(C(=O)Nc2cccc([C@]3(N)COCCN3)c2)nc1

BIRTHDAY: 2018-12-01T14:10:35.471804
ATC: C03B
- CARDIOVASCULAR SYSTEM
- DIURETICS
- LOW-CEILING DIURETICS, EXCL. THIAZIDES
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: 2018-12-01T14:10:35.481303
ATC: J01M
- ANTIINFECTIVES FOR SYSTEMIC USE
- ANTIBACTERIALS FOR SYSTEMIC USE
- QUINOLONE ANTIBACTERIALS
Synthesis Plan
FORMULA:C23H24ClN7O

SMILES: CN(C)CCCNc1nc(Nc2cccc(Cl)c2)c2ncn(C(=O)c3ccccc3)c2n1

BIRTHDAY: 2018-12-01T14:10:35.491581
ATC: N05A
- NERVOUS SYSTEM
- PSYCHOLEPTICS
- ANTIPSYCHOTICS
Synthesis Plan
FORMULA:C23H27FN4O3

SMILES: COc1cc2ncnc(N[C@H](CC(C)C)C(=O)NCc3ccc(F)cc3)c2cc1OC

BIRTHDAY: 2018-12-01T14:10:35.501244
ATC: N05A
- NERVOUS SYSTEM
- PSYCHOLEPTICS
- ANTIPSYCHOTICS
Synthesis Plan
FORMULA:C26H21ClFN7O

SMILES: O=C(NCc1ccccc1)n1cnc2nc(Nc3ccccc3Cl)nc(NCc3cccc(F)c3)c21

BIRTHDAY: 2018-12-01T14:10:35.512617
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C24H31N5O4

SMILES: COC1(OC)C=CC=C2N=C(N[C@@H](CC(C)C)C(=O)NCC(=O)Nc3ccccc3)N=C[C@@H]21

BIRTHDAY: 2018-12-01T14:10:35.522958
ATC: P01A
- ANTIPARASITIC PRODUCTS, INSECTICIDES AND REPELLENTS
- ANTIPROTOZOALS
- AGENTS AGAINST AMOEBIASIS AND OTHER PROTOZOAL DISEASES
Synthesis Plan
FORMULA:C22H31ClN6O

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

BIRTHDAY: 2018-12-01T14:10:35.532755
ATC: H01C
- SYSTEMIC HORMONAL PREPARATIONS, EXCL. SEX HORMONES AND INSULINS
- PITUITARY AND HYPOTHALAMIC HORMONES AND ANALOGUES
- HYPOTHALAMIC HORMONES
Synthesis Plan
FORMULA:C19H26ClN7

SMILES: CC(C)n1cnc2nc(NC(C)(C)N(C)C)nc(Nc3ccccc3Cl)c21

BIRTHDAY: 2018-12-01T14:10:35.542212
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:C28H32FN7O2

SMILES: C[C@@H](NC(=O)c1ncncc1NCc1ccccc1F)[C@H]1CCNc2cccc(c2)N[C@@H]2CN(CC2=O)C1

BIRTHDAY: 2018-12-01T14:10:35.554089
ATC: J01F
- ANTIINFECTIVES FOR SYSTEMIC USE
- ANTIBACTERIALS FOR SYSTEMIC USE
- MACROLIDES, LINCOSAMIDES AND STREPTOGRAMINS
Synthesis Plan
FORMULA:C22H33ClN6O

SMILES: CC(C)C[C@H](Nc1nc2c(c(Nc3ccccc3Cl)n1)N(C(C)C)CN2)C(C)(C)O

BIRTHDAY: 2018-12-01T14:10:35.564189
ATC: C02K
- CARDIOVASCULAR SYSTEM
- ANTIHYPERTENSIVES
- OTHER ANTIHYPERTENSIVES
Synthesis Plan
FORMULA:C25H25N7O

SMILES: COc1c(Nc2cncnc2Nc2ccc(C#N)cc2)ccc2c1[C@@]13NC[C@@H](CC[C@@H]1N3)C2

BIRTHDAY: 2018-12-01T14:10:35.574590
ATC: N05A
- NERVOUS SYSTEM
- PSYCHOLEPTICS
- ANTIPSYCHOTICS
Synthesis Plan
FORMULA:C36H56N2O2

SMILES: CCCCCCCCCCCCCCCCCCCCCCC(=O)Nc1cccc(-c2cccc(C(N)=O)c2)c1

BIRTHDAY: 2018-12-01T14:10:35.583574
ATC: N05A
- NERVOUS SYSTEM
- PSYCHOLEPTICS
- ANTIPSYCHOTICS
Synthesis Plan
FORMULA:C24H33N3O2

SMILES: CN(C)C(C)(C)C(C)(C)C(C)(C)[C@]12C=CC=C[C@H]1Oc1cc(C#N)cc(=O)n1C2

BIRTHDAY: 2018-12-01T14:10:35.595545
ATC: C07A
- CARDIOVASCULAR SYSTEM
- BETA BLOCKING AGENTS
- BETA BLOCKING AGENTS
Synthesis Plan
FORMULA:C24H29N5O4

SMILES: COc1cc2ncnc(N[C@H](CC(C)C)C(=O)NCC(=O)Nc3ccccc3)c2cc1OC

BIRTHDAY: 2018-12-01T14:10:35.609947
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C23H24Cl2N8O

SMILES: CN(C)C(C)(C)Nc1nc(Nc2cccc(Cl)c2)c2c(ncn2C(=O)Nc2cccc(Cl)c2)n1

BIRTHDAY: 2018-12-01T14:10:35.625614
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:C29H28N6O4

SMILES: COC1=CC(O)(O)[C@H]2C=NC(N3CCCc4cccc(c4)OCc4cccc(c4)Nc4nccc3n4)=NC2=C1

BIRTHDAY: 2018-12-25T02:02:37.994650
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C23H33ClN6

SMILES: CC(C)C[C@@H](Nc1nc(Nc2ccccc2Cl)c2c(ncn2C(C)C)n1)C(C)(C)C

BIRTHDAY: 2018-12-25T02:02:38.004137
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C26H31N5O2

SMILES: CC(C)(C)c1ccc(Nc2ncncc2C(=O)Nc2ccccc2CN2CCOCC2)cc1

BIRTHDAY: 2018-12-25T02:02:38.022794
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C24H34N6O3

SMILES: CC(=O)NC[C@H](O)[C@H](CC(C)C)Nc1cncnc1N1CCN(C(=O)c2ccccc2)CC1

BIRTHDAY: 2018-12-25T02:02:38.033811
ATC: V09X
- VARIOUS
- DIAGNOSTIC RADIOPHARMACEUTICALS
- OTHER DIAGNOSTIC RADIOPHARMACEUTICALS
Synthesis Plan
FORMULA:C24H21N5O4

SMILES: COC1=Cc2cnc(Nc3ccc(CNC(=O)c4cccc(C#N)c4)cc3)nc2CC1(O)O

BIRTHDAY: 2018-12-25T02:02:38.044070
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C25H30FN5O2S

SMILES: CC(C)C[C@H](Nc1nc(C(=O)NCCCN2CCCC2=O)c2sccc2n1)c1ccc(F)cc1

BIRTHDAY: 2018-12-25T02:02:38.054879
ATC: N05A
- NERVOUS SYSTEM
- PSYCHOLEPTICS
- ANTIPSYCHOTICS
Synthesis Plan
FORMULA:C26H31N5O2

SMILES: CC(C)(C)c1ccc(Nc2cc(C(=O)Nc3ccc(CN4CCOCC4)cc3)ncn2)cc1

BIRTHDAY: 2018-12-25T02:02:38.064853
ATC: R06A
- RESPIRATORY SYSTEM
- ANTIHISTAMINES FOR SYSTEMIC USE
- ANTIHISTAMINES FOR SYSTEMIC USE
Synthesis Plan
FORMULA:C12H11ClFN3OS

SMILES: O[C@@H]1C[C@]2(Nc3cc(F)ccc3Cl)C=NC=N[C@H]2S1

BIRTHDAY: 2018-12-25T02:02:38.073181
ATC: H02A
- SYSTEMIC HORMONAL PREPARATIONS, EXCL. SEX HORMONES AND INSULINS
- CORTICOSTEROIDS FOR SYSTEMIC USE
- CORTICOSTEROIDS FOR SYSTEMIC USE, PLAIN
Synthesis Plan
FORMULA:C24H30FN5O4

SMILES: COC1(OC)C=CC=C2C=NC(N[C@H](CC(C)C)C(=O)NCC(=O)Nc3cccc(F)c3)=N[C@H]21

BIRTHDAY: 2018-12-25T02:02:38.084164
ATC: V09C
- VARIOUS
- DIAGNOSTIC RADIOPHARMACEUTICALS
- RENAL SYSTEM
Synthesis Plan
FORMULA:C21H29N5O2

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

BIRTHDAY: 2018-12-25T02:02:38.093522
ATC: A03F
- ALIMENTARY TRACT AND METABOLISM
- DRUGS FOR FUNCTIONAL GASTROINTESTINAL DISORDERS
- PROPULSIVES
Synthesis Plan
FORMULA:C23H31N7O

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

BIRTHDAY: 2018-12-25T02:02:38.103338
ATC: J01M
- ANTIINFECTIVES FOR SYSTEMIC USE
- ANTIBACTERIALS FOR SYSTEMIC USE
- QUINOLONE ANTIBACTERIALS
Synthesis Plan
FORMULA:C24H27FN6O2

SMILES: Fc1cccc(Nc2ncnc3cc(N4C[CH-]C=[NH+]4)cc(OCCCN4CCOCC4)c23)c1

BIRTHDAY: 2018-12-25T02:02:38.114322
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C22H33ClN6O

SMILES: CC(C)C[C@@H](Nc1nc(Nc2ccccc2Cl)c2c(n1)N(C(C)C)CN2)C(C)(C)O

BIRTHDAY: 2018-12-25T02:02:38.124232
ATC: C02K
- CARDIOVASCULAR SYSTEM
- ANTIHYPERTENSIVES
- OTHER ANTIHYPERTENSIVES
Synthesis Plan
FORMULA:C26H21ClFN7O

SMILES: O=C(NCc1ccccc1)n1cnc2c(NCc3ccc(F)cc3)nc(Nc3cccc(Cl)c3)nc21

BIRTHDAY: 2018-12-25T02:02:38.135615
ATC: H05A
- SYSTEMIC HORMONAL PREPARATIONS, EXCL. SEX HORMONES AND INSULINS
- CALCIUM HOMEOSTASIS
- PARATHYROID HORMONES AND ANALOGUES
Synthesis Plan
FORMULA:C27H26N2O4

SMILES: C=C(C(=O)Nc1cccc(C(=O)Nc2ccccc2C(=O)O)c1)c1cccc(C(C)(C)C)c1

BIRTHDAY: 2018-12-25T02:02:38.145058
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C25H30N6O2

SMILES: CC(C)(C)c1ccccc1Nc1ncc(C(=O)Nc2ccccc2[C@@]2(N)COCCN2)cn1

BIRTHDAY: 2018-12-25T02:02:38.155258
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C19H26ClN7

SMILES: CC(C)n1cnc2nc(Nc3ccccc3Cl)nc(NC(C)(C)N(C)C)c21

BIRTHDAY: 2018-12-25T02:02:38.164709
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C24H26N8O2

SMILES: COc1ccccc1Nc1nc(Nc2ccccc2C#N)c2c(n1)C(=O)N[C@@]2(N)[C@@H](C)N(C)C

BIRTHDAY: 2018-12-25T02:02:38.176030
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C23H30ClN5O2

SMILES: CC(C)C[C@H](Nc1ncc(C(=O)NCCCN2CCCC2=O)cn1)c1ccc(Cl)cc1

BIRTHDAY: 2018-12-03T02:38:41.836590
ATC: N05A
- NERVOUS SYSTEM
- PSYCHOLEPTICS
- ANTIPSYCHOTICS
Synthesis Plan
FORMULA:C18H22N4O3

SMILES: COC1=CCC(O)(O)c2cnc(Nc3ccccc3CN(C)C)nc21

BIRTHDAY: 2018-12-03T02:38:41.845435
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C16H15NO2

SMILES: COC1=CC(OC)=C2C=Cc3ccccc3N=C2C1

BIRTHDAY: 2018-12-03T02:38:41.852561
ATC: B01A
- BLOOD AND BLOOD FORMING ORGANS
- ANTITHROMBOTIC AGENTS
- ANTITHROMBOTIC AGENTS
Synthesis Plan
FORMULA:C23H33N7O

SMILES: CC(C)C[C@H](Nc1nc(Nc2ccc(C#N)cc2)c2c(n1)N(C(C)C)CN2)C(C)(C)O

BIRTHDAY: 2018-12-03T02:38:41.862531
ATC: B02A
- BLOOD AND BLOOD FORMING ORGANS
- ANTIHEMORRHAGICS
- ANTIFIBRINOLYTICS
Synthesis Plan
FORMULA:C22H24BrN5O2

SMILES: O=C(CCCN1CCOCC1)Nc1ccc2ncnc(Nc3cccc(Br)c3)c2c1

BIRTHDAY: 2018-12-03T02:38:41.872338
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C23H33N7

SMILES: CC(C)C[C@H](Nc1nc(Nc2ccc(C#N)cc2)c2c(n1)N(C(C)C)CN2)C(C)C

BIRTHDAY: 2018-12-03T02:38:41.881841
ATC: J05A
- ANTIINFECTIVES FOR SYSTEMIC USE
- ANTIVIRALS FOR SYSTEMIC USE
- DIRECT ACTING ANTIVIRALS
Synthesis Plan
FORMULA:C19H18FN5O4

SMILES: COC1=Cc2ncnc(N[C@H](C#N)CC(=O)Nc3ccc(F)cc3)c2CC1(O)O

BIRTHDAY: 2018-12-03T02:38:41.891841
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:C24H21N5O4

SMILES: COC1=CC=C2N=C(Nc3ccccc3CNC(=O)c3ccccc3C#N)N=C[C@H]2C1(O)O

BIRTHDAY: 2018-12-03T02:38:41.902363
ATC: A05B
- ALIMENTARY TRACT AND METABOLISM
- BILE AND LIVER THERAPY
- LIVER THERAPY, LIPOTROPICS
Synthesis Plan
FORMULA:C25H30ClN5O4

SMILES: C=CC(=O)NC1=CC=C(OC(C)(C)N2CCOCC2)[C@]2(Nc3c(Cl)cccc3OC)N=CN=C[C@H]12

BIRTHDAY: 2018-12-03T02:38:41.914550
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C19H17N5O2

SMILES: COc1cccc(Nc2cnc(Nc3ccc(C#N)cc3)nc2)c1OC

BIRTHDAY: 2018-12-03T02:38:41.923446
ATC: N05A
- NERVOUS SYSTEM
- PSYCHOLEPTICS
- ANTIPSYCHOTICS
Synthesis Plan
FORMULA:C24H33FN6O2

SMILES: O=C(NCCCN1CCOCC1)c1cnc(NCc2ccc(F)cc2)nc1NC1CCCC1

BIRTHDAY: 2018-12-03T02:38:41.933695
ATC: A03F
- ALIMENTARY TRACT AND METABOLISM
- DRUGS FOR FUNCTIONAL GASTROINTESTINAL DISORDERS
- PROPULSIVES
Synthesis Plan
FORMULA:C24H21N5O4

SMILES: COC1=CC(O)(O)[C@H]2N=C(Nc3ccccc3CNC(=O)c3ccccc3C#N)N=CC2=C1

BIRTHDAY: 2018-12-03T02:38:41.944180
ATC: C03D
- CARDIOVASCULAR SYSTEM
- DIURETICS
- POTASSIUM-SPARING AGENTS
Synthesis Plan
FORMULA:C25H21N5O3

SMILES: COc1cc2cnc(Nc3cccc(CNC(=O)c4cccc(C#N)c4)c3)nc2cc1OC

BIRTHDAY: 2018-12-03T02:38:41.954030
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C24H25N5O4

SMILES: C=C(C)NC(=O)/C(C#N)=C/c1cc(C(=O)N2CCOCC2)[nH]c1C(=O)NCc1ccccc1

BIRTHDAY: 2018-12-03T02:38:41.964876
ATC: N03A
- NERVOUS SYSTEM
- ANTIEPILEPTICS
- ANTIEPILEPTICS
Synthesis Plan
FORMULA:C22H33ClN6O

SMILES: CC(C)C[C@H](Nc1nc(Nc2cccc(Cl)c2)c2c(n1)N(C(C)C)CN2)C(C)(C)O

BIRTHDAY: 2018-12-03T02:38:41.974713
ATC: A08A
- ALIMENTARY TRACT AND METABOLISM
- ANTIOBESITY PREPARATIONS, EXCL. DIET PRODUCTS
- ANTIOBESITY PREPARATIONS, EXCL. DIET PRODUCTS
Synthesis Plan
FORMULA:C22H18ClN5O2

SMILES: COc1cccc(N[C@H]2COc3ncc(C#N)c(N)c3C(c3ccc(Cl)cc3)=N2)c1

BIRTHDAY: 2018-12-03T02:38:41.984562
ATC: V08C
- VARIOUS
- CONTRAST MEDIA
- MAGNETIC RESONANCE IMAGING CONTRAST MEDIA
Synthesis Plan
FORMULA:C21H14F3N3O4

SMILES: O=C(Nc1ccccc1C(F)(F)F)c1ccc(NC(=O)c2ccccc2[N+](=O)[O-])cc1

BIRTHDAY: 2018-12-03T02:38:41.994932
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C20H21ClFN5O

SMILES: CN(C)CCCNC(=O)c1ccc2ncnc(Nc3ccc(F)c(Cl)c3)c2c1

BIRTHDAY: 2018-12-03T02:38:42.004102
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C24H21N5O4

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

BIRTHDAY: 2018-11-30T03:40:38.152950
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C20H27N5O3

SMILES: CN(C)CCc1ncc2nc1OCCCCCOc1ccccc1NC(=O)N2

BIRTHDAY: 2018-11-30T03:40:38.162365
ATC: A02B
- ALIMENTARY TRACT AND METABOLISM
- DRUGS FOR ACID RELATED DISORDERS
- DRUGS FOR PEPTIC ULCER AND GASTRO-OESOPHAGEAL REFLUX DISEASE (GORD)
Synthesis Plan
FORMULA:C37H41N9O6

SMILES: CC(C)(CC(=O)NO)OC1=CC=C2C=NC(N3[C@H]4CCN(C4)c4cccc5ccc(cc45)Oc4cccc(c4)CN[C@@]4(N)NN=C[C@@H]34)=N[C@@H]2C1(O)O

BIRTHDAY: 2018-11-30T03:40:38.178250
ATC: J04B
- ANTIINFECTIVES FOR SYSTEMIC USE
- ANTIMYCOBACTERIALS
- DRUGS FOR TREATMENT OF LEPRA
Synthesis Plan
FORMULA:C15H17N3O3

SMILES: [CH2-][C@]12[CH+]C[C@H](Oc3cccc4c3OCO4)N[C@]1([CH2-])[NH+]=CN2

BIRTHDAY: 2018-11-30T03:40:38.197399
ATC: C02C
- CARDIOVASCULAR SYSTEM
- ANTIHYPERTENSIVES
- ANTIADRENERGIC AGENTS, PERIPHERALLY ACTING
Synthesis Plan
FORMULA:C22H35N5O4

SMILES: COC1(OC)CC=Cc2nc(N[C@H](CC(C)C)C(=O)NCC(=O)NCC(C)C)ncc21

BIRTHDAY: 2018-11-30T03:40:38.226076
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C20H16BrN5O

SMILES: O=c1[nH]cc(Br)n1Cc1ccccc1Nc1cnc(-c2ccccc2)nc1

BIRTHDAY: 2018-11-30T03:40:38.235657
ATC: J02A
- ANTIINFECTIVES FOR SYSTEMIC USE
- ANTIMYCOTICS FOR SYSTEMIC USE
- ANTIMYCOTICS FOR SYSTEMIC USE
Synthesis Plan
FORMULA:C26H35N5O4

SMILES: O[C@]12C[C@H]3CCN1[C@](c1cccc4c1OCCCCCCOc1cncc(n1)NCN4)(CCO2)C3

BIRTHDAY: 2018-11-30T03:40:38.246753
ATC: A01A
- ALIMENTARY TRACT AND METABOLISM
- STOMATOLOGICAL PREPARATIONS
- STOMATOLOGICAL PREPARATIONS
Synthesis Plan
FORMULA:C23H24ClN7O

SMILES: CN(C)C(C)(C)Nc1nc(Nc2ccccc2Cl)c2c(ncn2C(=O)c2ccccc2)n1

BIRTHDAY: 2018-11-30T03:40:38.257120
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:C24H33FN6O2

SMILES: CC(C)(NC(=O)c1ncnc(NC2CCCC2)c1NCc1ccccc1F)N1CCOCC1

BIRTHDAY: 2018-11-30T03:40:38.277606
ATC: H01C
- SYSTEMIC HORMONAL PREPARATIONS, EXCL. SEX HORMONES AND INSULINS
- PITUITARY AND HYPOTHALAMIC HORMONES AND ANALOGUES
- HYPOTHALAMIC HORMONES
Synthesis Plan
FORMULA:C26H21ClFN7O

SMILES: O=C(NCc1ccccc1)n1cnc2c(NCc3cccc(F)c3)nc(Nc3ccccc3Cl)nc21

BIRTHDAY: 2018-11-30T03:40:38.288946
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C23H24Cl2N8O

SMILES: CN(C)CCCNc1nc(Nc2ccccc2Cl)c2ncn(C(=O)Nc3ccccc3Cl)c2n1

BIRTHDAY: 2018-11-30T03:40:38.300108
ATC: N02B
- NERVOUS SYSTEM
- ANALGESICS
- OTHER ANALGESICS AND ANTIPYRETICS
Synthesis Plan
FORMULA:C25H30N6O2

SMILES: CC(C)(C)c1ccccc1Nc1cnc(C(=O)Nc2cccc([C@@]3(N)COCCN3)c2)nc1

BIRTHDAY: 2018-11-30T03:40:38.310141
ATC: C03B
- CARDIOVASCULAR SYSTEM
- DIURETICS
- LOW-CEILING DIURETICS, EXCL. THIAZIDES
Synthesis Plan
FORMULA:C24H21N5O4

SMILES: COC1=Cc2nc(Nc3ccc(CNC(=O)c4ccc(C#N)cc4)cc3)ncc2CC1(O)O

BIRTHDAY: 2018-11-30T03:40:38.320858
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C22H35N5O4

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

BIRTHDAY: 2018-11-30T03:40:38.330763
ATC: A11H
- ALIMENTARY TRACT AND METABOLISM
- VITAMINS
- OTHER PLAIN VITAMIN PREPARATIONS
Synthesis Plan
FORMULA:C21H33N5O5

SMILES: COC1=CC(O)(O)[C@@H]2N=C(N[C@@H](CC(C)C)C(=O)NCC(=O)NCC(C)C)N=CC2=C1

BIRTHDAY: 2018-11-30T03:40:38.341007
ATC: C02D
- CARDIOVASCULAR SYSTEM
- ANTIHYPERTENSIVES
- ARTERIOLAR SMOOTH MUSCLE, AGENTS ACTING ON
Synthesis Plan
FORMULA:C32H57NO3

SMILES: COc1cccc(OC)c1NC(=O)CC(C)(C)C(C)(C)C(C)(C)C(C)(C)C(C)(C)C(C)(C)C(C)(C)C

BIRTHDAY: 2018-11-19T08:13:46.402070
ATC: V03A
- VARIOUS
- ALL OTHER THERAPEUTIC PRODUCTS
- ALL OTHER THERAPEUTIC PRODUCTS
Synthesis Plan
FORMULA:C27H27N3O3

SMILES: C=C(C(=O)Nc1cccc(C(=O)Nc2ccc(C(N)=O)cc2)c1)c1ccccc1C(C)(C)C

BIRTHDAY: 2018-11-19T08:13:46.411907
ATC: P01A
- ANTIPARASITIC PRODUCTS, INSECTICIDES AND REPELLENTS
- ANTIPROTOZOALS
- AGENTS AGAINST AMOEBIASIS AND OTHER PROTOZOAL DISEASES
Synthesis Plan
FORMULA:C23H28FN5O5

SMILES: COC1=Cc2c(ncnc2N[C@H](CC(C)C)C(=O)NCC(=O)Nc2ccccc2F)CC1(O)O

BIRTHDAY: 2018-11-19T08:13:46.423023
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C20H21ClN4

SMILES: CC(C)(C)c1ccc(Nc2ccnc(Nc3ccccc3Cl)n2)cc1

BIRTHDAY: 2018-11-19T08:13:46.431340
ATC: D10A
- DERMATOLOGICALS
- ANTI-ACNE PREPARATIONS
- ANTI-ACNE PREPARATIONS FOR TOPICAL USE
Synthesis Plan
FORMULA:C25H24N6O3

SMILES: CN1CCNCc2cc(ccc2O)Oc2ccc3c(c2)[C@H](c2c-3n[nH]c2C#N)N2CC[C@@H]1C2=O

BIRTHDAY: 2018-11-19T08:13:46.443083
ATC: N06A
- NERVOUS SYSTEM
- PSYCHOANALEPTICS
- ANTIDEPRESSANTS
Synthesis Plan
FORMULA:C35H53N3O

SMILES: CN(C)CCCCCCCCCCCCCCCCCCCNC(=O)c1ccc(-c2ccc(C#N)cc2)cc1

BIRTHDAY: 2018-11-19T08:13:46.452233
ATC: N06A
- NERVOUS SYSTEM
- PSYCHOANALEPTICS
- ANTIDEPRESSANTS
Synthesis Plan
FORMULA:C21H29N7O

SMILES: CC(C)C[C@H](CO)Nc1nc(Nc2cccc(C#N)c2)c2c(n1)N(C(C)C)CN2

BIRTHDAY: 2018-11-19T08:13:46.472559
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:C24H35N5O

SMILES: CC(C)C[C@H](Nc1cnc(C(=O)NC(C)(C)N2CCCCC2)nc1)c1ccccc1

BIRTHDAY: 2018-11-19T08:13:46.481545
ATC: H01C
- SYSTEMIC HORMONAL PREPARATIONS, EXCL. SEX HORMONES AND INSULINS
- PITUITARY AND HYPOTHALAMIC HORMONES AND ANALOGUES
- HYPOTHALAMIC HORMONES
Synthesis Plan
FORMULA:C26H30N6O2

SMILES: CC(C)(C)c1ccc(Nc2cc(C(=O)Nc3ccccc3CNC(=O)C3(N)CC3)ncn2)cc1

BIRTHDAY: 2018-11-19T08:13:46.492328
ATC: N07B
- NERVOUS SYSTEM
- OTHER NERVOUS SYSTEM DRUGS
- DRUGS USED IN ADDICTIVE DISORDERS
Synthesis Plan
FORMULA:C23H34N8O2

SMILES: CC(C)C[C@@H](Nc1c(C(=O)NC(C)(C)N2CCC(=O)C2)ncnc1-c1[nH]ncc1N)C1CC1

BIRTHDAY: 2018-11-19T08:13:46.508315
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C22H26F3N7O

SMILES: CC(C)C[C@H](Nc1nc(Nc2ccccc2C#N)nc2c1N(C(C)C)CN2)C(=O)C(F)(F)F

BIRTHDAY: 2018-11-19T08:13:46.524623
ATC: L01C
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- PLANT ALKALOIDS AND OTHER NATURAL PRODUCTS
Synthesis Plan
FORMULA:C36H54N6O

SMILES: CN(C)C(C)(C)C(C)(C)C(C)(C)C(C)(C)C(C)(C)C(C)(C)C(=O)Nc1ccccc1Nc1cncnc1-c1ccccn1

BIRTHDAY: 2018-11-19T08:13:46.540928
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C21H28N4O2

SMILES: CC(C)C[C@@H](Nc1cnc(C(=O)N[C@]2(C)CCCO2)nc1)c1ccccc1

BIRTHDAY: 2018-11-19T08:13:46.552932
ATC: N05A
- NERVOUS SYSTEM
- PSYCHOLEPTICS
- ANTIPSYCHOTICS
Synthesis Plan
FORMULA:C19H26ClN7

SMILES: CC(C)n1cnc2c(Nc3cccc(Cl)c3)nc(NCCCN(C)C)nc21

BIRTHDAY: 2018-11-19T08:13:46.562676
ATC: N06A
- NERVOUS SYSTEM
- PSYCHOANALEPTICS
- ANTIDEPRESSANTS
Synthesis Plan
FORMULA:C24H27ClFN5O3

SMILES: C=CC(=O)NC1=CC=C[C@@]2(Nc3cc(F)ccc3Cl)N=CN=C[C@@]12OC(C)(C)N1CCOCC1

BIRTHDAY: 2018-11-19T08:13:46.583637
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C21H33N5O5

SMILES: COC1=Cc2c(ncnc2N[C@@H](CC(C)C)C(=O)NCC(=O)NCC(C)C)CC1(O)O

BIRTHDAY: 2018-11-19T08:13:46.593763
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C18H24N4O5

SMILES: COc1cc2ncnc(N[C@H](CC(C)C)C(=O)NCC(=O)O)c2cc1OC

BIRTHDAY: 2018-11-19T08:13:46.605633
ATC: N05A
- NERVOUS SYSTEM
- PSYCHOLEPTICS
- ANTIPSYCHOTICS
Synthesis Plan
FORMULA:C25H21N5O3

SMILES: COc1cc2ncnc(Nc3cccc(CNC(=O)c4cccc(C#N)c4)c3)c2cc1OC

BIRTHDAY: 2018-11-19T08:13:46.615775
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C36H39N7O3

SMILES: COc1cc2c(NC3=CCOCCN(c4cnc(C)nc4C)Cc4cccc(c4)CNCC3)ncnc2cc1Oc1ccccc1

BIRTHDAY: 2018-11-19T08:13:46.628829
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C25H30N6O2

SMILES: CC(C)(C)c1ccccc1Nc1cnc(C(=O)Nc2cccc([C@]3(N)CNCCO3)c2)nc1

BIRTHDAY: 2018-11-19T08:13:46.639003
ATC: N02B
- NERVOUS SYSTEM
- ANALGESICS
- OTHER ANALGESICS AND ANTIPYRETICS
Synthesis Plan
FORMULA:C22H33ClN6O

SMILES: CC(C)C[C@@H](Nc1nc2c(c(Nc3ccccc3Cl)n1)N(C(C)C)CN2)C(C)(C)O

BIRTHDAY: 2018-11-19T08:13:46.649173
ATC: C02K
- CARDIOVASCULAR SYSTEM
- ANTIHYPERTENSIVES
- OTHER ANTIHYPERTENSIVES
Synthesis Plan
FORMULA:C24H20ClN5O2

SMILES: OC1(O)Cc2cccc(c2)Nc2nc(ncc2Cl)Nc2ccc(Nc3ccccc3)c1c2

BIRTHDAY: 2018-11-19T08:13:46.668486
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C35H61N3O6

SMILES: CCCCCCCCCCCCCCCCCCCCC[C@@H](NC(=O)c1ccc(OC)c(OC)c1)C(=O)N[C@@H](CO)C(N)=O

BIRTHDAY: 2018-11-19T08:13:46.679905
ATC: V04C
- VARIOUS
- DIAGNOSTIC AGENTS
- OTHER DIAGNOSTIC AGENTS
Synthesis Plan
FORMULA:C23H19N5O5

SMILES: N#Cc1ccccc1C(=O)NCc1ccccc1Nc1ncc2c(n1)C=CC(O)(O)C2(O)O

BIRTHDAY: 2018-11-19T08:13:46.691388
ATC: A02B
- ALIMENTARY TRACT AND METABOLISM
- DRUGS FOR ACID RELATED DISORDERS
- DRUGS FOR PEPTIC ULCER AND GASTRO-OESOPHAGEAL REFLUX DISEASE (GORD)
Synthesis Plan
FORMULA:C29H34ClN3O2S

SMILES: CC(C)(C)c1ccc(N2c3cc(Cl)ccc3N[C@@H]3CC[C@@]2(C(=O)Nc2ccc(C(C)(C)C)s2)O3)cc1

BIRTHDAY: 2018-11-19T08:13:46.713323
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C28H34ClN7O

SMILES: CC(C)CCNc1ncc2c(n1)c(Nc1ccccc1Cl)nc1cc(C(=O)NCCCN(C)C)ccc12

BIRTHDAY: 2018-11-19T08:13:46.734489
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C30H57N7

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

BIRTHDAY: 2018-11-19T08:13:46.744493
ATC: L01A
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- ALKYLATING AGENTS
Synthesis Plan
FORMULA:C41H74N2O2

SMILES: C[C@H]1CCCCCC(=O)CNCCc2ccc(cc2)O[C@@]1(C)[C@@H](C)C(C)(C)C(C)(C)C(C)(C)C(C)(C)C(C)(C)C(C)(C)N(C)C

BIRTHDAY: 2018-11-19T08:13:46.755043
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C23H31N7O

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

BIRTHDAY: 2018-11-19T08:13:46.765065
ATC: N05A
- NERVOUS SYSTEM
- PSYCHOLEPTICS
- ANTIPSYCHOTICS
Synthesis Plan
FORMULA:C23H32N2O

SMILES: CC(C)C[C@H]1CCCC=CCCC[C@@H](C(=O)Nc2ccccc2C#N)C1

BIRTHDAY: 2018-11-19T08:13:46.772793
ATC: C09A
- CARDIOVASCULAR SYSTEM
- AGENTS ACTING ON THE RENIN-ANGIOTENSIN SYSTEM
- ACE INHIBITORS, PLAIN
Synthesis Plan
FORMULA:C20H24BrN5O

SMILES: C[C@@H](N[C@]12C=CC=C[C@@]1(Nc1ccccc1Br)C=NC=N2)N1CCOCC1

BIRTHDAY: 2018-11-19T08:13:46.782019
ATC: N01A
- NERVOUS SYSTEM
- ANESTHETICS
- ANESTHETICS, GENERAL
Synthesis Plan
FORMULA:C27H25F3N2O2

SMILES: CC(C)(C)c1ccc(/C=C/C(=O)Nc2ccccc2C(=O)Nc2cccc(C(F)(F)F)c2)cc1

BIRTHDAY: 2018-11-19T08:13:46.792395
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C23H24Cl2N8O

SMILES: C[C@@H](CN(C)C)Nc1nc(Nc2ccc(Cl)cc2)nc2c1ncn2C(=O)Nc1ccccc1Cl

BIRTHDAY: 2018-11-19T08:13:46.803777
ATC: A11D
- ALIMENTARY TRACT AND METABOLISM
- VITAMINS
- VITAMIN B1, PLAIN AND IN COMBINATION WITH VITAMIN B6 AND B12
Synthesis Plan
FORMULA:C21H33N5O5

SMILES: CO[C@H]1c2cnc(N[C@H](CC(C)C)C(=O)NCC(=O)NCC(C)C)nc2C=CC1(O)O

BIRTHDAY: 2018-11-19T08:13:46.814093
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C22H35N5O4

SMILES: COC1(OC)CC=Cc2nc(N[C@@H](CC(C)C)C(=O)NCC(=O)NCC(C)C)ncc21

BIRTHDAY: 2018-11-19T08:13:46.824065
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C22H33N5O4

SMILES: COc1cc2ncnc(N[C@@H](CC(C)C)C(=O)NCC(=O)NCC(C)C)c2cc1OC

BIRTHDAY: 2018-11-19T08:13:46.833933
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C20H20ClN5O

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

BIRTHDAY: 2018-11-19T08:13:46.842723
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C18H22N4O3

SMILES: CO[C@]12C(=CC=CC1(O)O)N=CN=C2Nc1ccccc1CN(C)C

BIRTHDAY: 2018-11-19T08:13:46.851949
ATC: L01D
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- CYTOTOXIC ANTIBIOTICS AND RELATED SUBSTANCES
Synthesis Plan
FORMULA:C22H26BrN5O2

SMILES: CC(C)(C(=O)NC1=C[C@@H]2C=NC=N[C@@]2(Nc2ccccc2Br)C=C1)N1CCOCC1

BIRTHDAY: 2018-11-19T08:13:46.861654
ATC: J01M
- ANTIINFECTIVES FOR SYSTEMIC USE
- ANTIBACTERIALS FOR SYSTEMIC USE
- QUINOLONE ANTIBACTERIALS
Synthesis Plan
FORMULA:C26H39FN6O2

SMILES: CC(C)C[C@H](Nc1ncc(C(=O)NCCCN2CCOCC2)c(Nc2ccc(F)cc2)n1)C(C)C

BIRTHDAY: 2018-11-19T08:13:46.872073
ATC: N05A
- NERVOUS SYSTEM
- PSYCHOLEPTICS
- ANTIPSYCHOTICS
Synthesis Plan
FORMULA:C29H42N8O6

SMILES: CC(C)C[C@@H](Nc1nc(Nc2ccc(C#N)cc2)c2c(n1)N[C@]1(COCCOCCOCCOCCO1)N2)C(=O)N(C)C

BIRTHDAY: 2018-11-19T08:13:46.886512
ATC: P01B
- ANTIPARASITIC PRODUCTS, INSECTICIDES AND REPELLENTS
- ANTIPROTOZOALS
- ANTIMALARIALS
Synthesis Plan
FORMULA:C15H23N5O4

SMILES: CO[C@H]1c2cnc(N[C@H](CC(C)C)C(=O)NN)nc2C=CC1(O)O

BIRTHDAY: 2018-11-19T08:13:46.895617
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C32H40N8O9

SMILES: COC1=c2nc(N[C@H](C#N)[C@H]3COCCCCCOc4cncc(n4)NCN3)nc(COc3cccc(OC(C)(O)O)c3)c2=CCC1(O)O

BIRTHDAY: 2018-11-19T08:13:46.921485
ATC: N05A
- NERVOUS SYSTEM
- PSYCHOLEPTICS
- ANTIPSYCHOTICS
Synthesis Plan
FORMULA:C23H31N7O

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

BIRTHDAY: 2018-11-19T08:13:46.931484
ATC: N05A
- NERVOUS SYSTEM
- PSYCHOLEPTICS
- ANTIPSYCHOTICS
Synthesis Plan
FORMULA:C23H30ClN5O2

SMILES: CC(C)C[C@@H](Nc1cnc(C(=O)NC(C)(C)N2CCC(=O)C2)nc1)c1ccccc1Cl

BIRTHDAY: 2018-11-19T08:13:46.941470
ATC: A03F
- ALIMENTARY TRACT AND METABOLISM
- DRUGS FOR FUNCTIONAL GASTROINTESTINAL DISORDERS
- PROPULSIVES
Synthesis Plan
FORMULA:C44H49N9O5

SMILES: COc1ccc(Nc2ncc3c(n2)c(OCCCN2CCOCC2)c(OC)c2c4nc(nc23)Nc2cccc(c2)CNCC=CCCNc2cccc-4c2)cc1OC

BIRTHDAY: 2018-11-19T08:13:46.958438
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C25H23N5O3

SMILES: COC1(OC)C=CC=C2N=C(Nc3ccccc3CNC(=O)c3ccccc3C#N)N=C[C@@H]21

BIRTHDAY: 2018-11-19T08:13:46.968699
ATC: A05B
- ALIMENTARY TRACT AND METABOLISM
- BILE AND LIVER THERAPY
- LIVER THERAPY, LIPOTROPICS
Synthesis Plan
FORMULA:C24H35N5O

SMILES: CC(C)C[C@@H](Nc1cnc(C(=O)NC(C)(C)N2CCCCC2)nc1)c1ccccc1

BIRTHDAY: 2018-11-19T08:13:46.977624
ATC: H01C
- SYSTEMIC HORMONAL PREPARATIONS, EXCL. SEX HORMONES AND INSULINS
- PITUITARY AND HYPOTHALAMIC HORMONES AND ANALOGUES
- HYPOTHALAMIC HORMONES
Synthesis Plan
FORMULA:C21H35N9O

SMILES: CC(C)C[C@H](C)Nc1nc(N[C@]2(C)NC[C@@H]3CNC(C)(C)[C@]2(N)C3=O)c2nc[nH]c2n1

BIRTHDAY: 2018-11-19T08:13:46.988862
ATC: S01A
- SENSORY ORGANS
- OPHTHALMOLOGICALS
- ANTIINFECTIVES
Synthesis Plan
FORMULA:C23H31N7O

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

BIRTHDAY: 2018-11-19T08:13:46.998914
ATC: N05A
- NERVOUS SYSTEM
- PSYCHOLEPTICS
- ANTIPSYCHOTICS
Synthesis Plan
FORMULA:C24H21N5O4

SMILES: COC1=C2N=C(Nc3ccccc3CNC(=O)c3ccccc3C#N)N=C[C@@H]2C(O)(O)C=C1

BIRTHDAY: 2018-11-19T08:13:47.009500
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C25H23N5O3

SMILES: COC1(OC)C=c2cnc(Nc3ccccc3CNC(=O)c3ccccc3C#N)nc2=CC1

BIRTHDAY: 2018-11-19T08:13:47.030882
ATC: A02B
- ALIMENTARY TRACT AND METABOLISM
- DRUGS FOR ACID RELATED DISORDERS
- DRUGS FOR PEPTIC ULCER AND GASTRO-OESOPHAGEAL REFLUX DISEASE (GORD)
Synthesis Plan
FORMULA:C18H26N4O5

SMILES: COC1(OC)C=CC=C2C=NC(N[C@H](CC(C)C)C(=O)NCC(=O)O)=N[C@H]21

BIRTHDAY: 2018-11-19T08:13:47.040637
ATC: C02D
- CARDIOVASCULAR SYSTEM
- ANTIHYPERTENSIVES
- ARTERIOLAR SMOOTH MUSCLE, AGENTS ACTING ON
Synthesis Plan
FORMULA:C35H56N2O

SMILES: C[C@@H](NC(=O)c1ccccc1-c1ccccc1)C(C)(C)C(C)(C)C(C)(C)C(C)(C)C(C)(C)C(C)(C)N(C)C

BIRTHDAY: 2018-11-19T08:13:47.049703
ATC: C03B
- CARDIOVASCULAR SYSTEM
- DIURETICS
- LOW-CEILING DIURETICS, EXCL. THIAZIDES
Synthesis Plan
FORMULA:C17H19N3O3

SMILES: COC1=Cc2ncnc(N[C@@H](C)c3ccccc3)c2CC1(O)O

BIRTHDAY: 2018-11-19T08:13:47.057948
ATC: C03C
- CARDIOVASCULAR SYSTEM
- DIURETICS
- HIGH-CEILING DIURETICS
Synthesis Plan
FORMULA:C35H30N4O3

SMILES: Oc1ccccc1[C@@H]1C=CCOCc2cnc(/C=C/c3ccccc3)c(c2)-c2ccnc(n2)Nc2cccc(c2)CO1

BIRTHDAY: 2018-11-19T08:13:47.069746
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C24H31NO8

SMILES: COC(=O)[C@H]1Cc2ccc(c3cc(OC)c(OC)c(OC)c23)OCCCCOCCC(=O)N1

BIRTHDAY: 2018-11-19T08:13:47.080216
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C22H26FN5O6

SMILES: CC(C)C[C@H](Nc1ncc2c(n1)=CC(O)(O)C(O)(O)C=2)C(=O)NCC(=O)Nc1cccc(F)c1

BIRTHDAY: 2018-11-19T08:13:47.091745
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C23H31N7O

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

BIRTHDAY: 2018-11-19T08:13:47.101639
ATC: J01M
- ANTIINFECTIVES FOR SYSTEMIC USE
- ANTIBACTERIALS FOR SYSTEMIC USE
- QUINOLONE ANTIBACTERIALS
Synthesis Plan
FORMULA:C33H55N5O2

SMILES: CC1=CCCC[C@@H](CCCCCCCCCCCN(C)C)C(=O)N[C@@]2(CNCCC1)NC(=O)c1ccccc1N2

BIRTHDAY: 2018-11-19T08:13:47.132058
ATC: J01F
- ANTIINFECTIVES FOR SYSTEMIC USE
- ANTIBACTERIALS FOR SYSTEMIC USE
- MACROLIDES, LINCOSAMIDES AND STREPTOGRAMINS
Synthesis Plan
FORMULA:C23H16F3N3O4

SMILES: C=C(C(=O)Nc1ccc(C(=O)Nc2ccccc2C(F)(F)F)cc1)c1ccccc1[N+](=O)[O-]

BIRTHDAY: 2018-11-19T08:13:47.143067
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C23H33N7O

SMILES: CC(C)C[C@H](Nc1nc(Nc2ccccc2C#N)nc2c1NCN2C(C)C)C(C)(C)O

BIRTHDAY: 2018-11-19T08:13:47.153269
ATC: A08A
- ALIMENTARY TRACT AND METABOLISM
- ANTIOBESITY PREPARATIONS, EXCL. DIET PRODUCTS
- ANTIOBESITY PREPARATIONS, EXCL. DIET PRODUCTS
Synthesis Plan
FORMULA:C16H15Cl2N3O2

SMILES: COC1(OC)C=CC=C2C=NC(Nc3cc(Cl)ccc3Cl)=N[C@H]21

BIRTHDAY: 2018-11-19T08:13:47.162091
ATC: B02B
- BLOOD AND BLOOD FORMING ORGANS
- ANTIHEMORRHAGICS
- VITAMIN K AND OTHER HEMOSTATICS
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: 2018-11-19T08:13:47.171714
ATC: J01M
- ANTIINFECTIVES FOR SYSTEMIC USE
- ANTIBACTERIALS FOR SYSTEMIC USE
- QUINOLONE ANTIBACTERIALS
Synthesis Plan
FORMULA:C23H19N5O5

SMILES: N#Cc1ccccc1C(=O)NCc1ccccc1Nc1ncc2c(n1)C(O)(O)C(O)(O)C=C2

BIRTHDAY: 2018-11-19T08:13:47.183110
ATC: N02C
- NERVOUS SYSTEM
- ANALGESICS
- ANTIMIGRAINE PREPARATIONS
Synthesis Plan
FORMULA:C22H25FN4O3

SMILES: COc1cc2ncnc(N[C@H](CC(C)C)C(=O)Nc3ccc(F)cc3)c2cc1OC

BIRTHDAY: 2018-11-19T08:13:47.192906
ATC: N05A
- NERVOUS SYSTEM
- PSYCHOLEPTICS
- ANTIPSYCHOTICS
Synthesis Plan
FORMULA:C23H29N5O5

SMILES: COC1=CC(O)(O)Cc2cnc(N[C@H](CC(C)C)C(=O)NCC(=O)Nc3ccccc3)nc21

BIRTHDAY: 2018-11-30T17:22:59.995875
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C23H28FN5O5

SMILES: COC1=Cc2ncnc(N[C@H](CC(C)C)C(=O)NCC(=O)Nc3ccc(F)cc3)c2CC1(O)O

BIRTHDAY: 2018-11-30T17:23:00.006774
ATC: N05A
- NERVOUS SYSTEM
- PSYCHOLEPTICS
- ANTIPSYCHOTICS
Synthesis Plan
FORMULA:C24H21N5O4

SMILES: COC1=c2nc(Nc3ccccc3CNC(=O)c3ccccc3C#N)ncc2=CC(O)(O)C1

BIRTHDAY: 2018-11-30T17:23:00.017118
ATC: A02B
- ALIMENTARY TRACT AND METABOLISM
- DRUGS FOR ACID RELATED DISORDERS
- DRUGS FOR PEPTIC ULCER AND GASTRO-OESOPHAGEAL REFLUX DISEASE (GORD)
Synthesis Plan
FORMULA:C19H17Cl2N5

SMILES: C[C@@]1(c2cccc(Cl)c2)Cc2nc(Nc3ccccc3Cl)nc(N)c2N1

BIRTHDAY: 2018-11-30T17:23:00.025996
ATC: A10B
- ALIMENTARY TRACT AND METABOLISM
- DRUGS USED IN DIABETES
- BLOOD GLUCOSE LOWERING DRUGS, EXCL. INSULINS
Synthesis Plan
FORMULA:C20H30N4O3

SMILES: COc1cc2ncnc(N[C@@H](CC(C)C)C(=O)NCC(C)C)c2cc1OC

BIRTHDAY: 2018-11-30T17:23:00.034689
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C21H33N5O5

SMILES: COC1=Cc2c(ncnc2N[C@H](CC(C)C)C(=O)NCC(=O)NCC(C)C)CC1(O)O

BIRTHDAY: 2018-11-30T17:23:00.044729
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C18H26N4O5

SMILES: COC1(OC)C=CC=C2C=NC(N[C@@H](CC(C)C)C(=O)NCC(=O)O)=N[C@@H]21

BIRTHDAY: 2018-11-30T17:23:00.054366
ATC: C02D
- CARDIOVASCULAR SYSTEM
- ANTIHYPERTENSIVES
- ARTERIOLAR SMOOTH MUSCLE, AGENTS ACTING ON
Synthesis Plan
FORMULA:C24H21N5O4

SMILES: COC1=Cc2cnc(Nc3ccccc3CNC(=O)c3ccccc3C#N)nc2C(O)(O)C1

BIRTHDAY: 2018-11-30T17:23:00.064623
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C18H21N3O2

SMILES: COC1(OC)C=CC=C2C=NC(N[C@H](C)c3ccccc3)=N[C@@H]21

BIRTHDAY: 2018-11-30T17:23:00.072825
ATC: B05A
- BLOOD AND BLOOD FORMING ORGANS
- BLOOD SUBSTITUTES AND PERFUSION SOLUTIONS
- BLOOD AND RELATED PRODUCTS
Synthesis Plan
FORMULA:C34H55N3O

SMILES: CN(C)CCCCCCCCCCCCCCCCCCCNC(=O)c1ccc(-c2ccccc2)cc1N

BIRTHDAY: 2018-11-30T17:23:00.101236
ATC: N02B
- NERVOUS SYSTEM
- ANALGESICS
- OTHER ANALGESICS AND ANTIPYRETICS
Synthesis Plan
FORMULA:C22H26ClN5O3

SMILES: COc1cccc(Cl)c1N[C@@]12C=CC=C[C@]1(C(=O)N[C@H](C)N1CCOCC1)N=CN=C2

BIRTHDAY: 2018-11-30T17:23:00.113571
ATC: R06A
- RESPIRATORY SYSTEM
- ANTIHISTAMINES FOR SYSTEMIC USE
- ANTIHISTAMINES FOR SYSTEMIC USE
Synthesis Plan
FORMULA:C25H23N5O3

SMILES: COC1(OC)C=CC=C2C=NC(Nc3ccccc3CNC(=O)c3ccccc3C#N)=N[C@@H]21

BIRTHDAY: 2018-11-30T17:23:00.143652
ATC: N02C
- NERVOUS SYSTEM
- ANALGESICS
- ANTIMIGRAINE PREPARATIONS
Synthesis Plan
FORMULA:C22H26BrN5O2

SMILES: CC(C)(C(=O)N[C@]12C=CC=C[C@]1(Nc1ccccc1Br)N=CN=C2)N1CCOCC1

BIRTHDAY: 2018-11-30T17:23:00.153235
ATC: L01D
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- CYTOTOXIC ANTIBIOTICS AND RELATED SUBSTANCES
Synthesis Plan
FORMULA:C22H33ClN6O

SMILES: CC(C)C[C@H](Nc1nc(Nc2ccccc2Cl)c2c(n1)N(C(C)C)CN2)C(C)(C)O

BIRTHDAY: 2018-11-30T17:23:00.163015
ATC: C02K
- CARDIOVASCULAR SYSTEM
- ANTIHYPERTENSIVES
- OTHER ANTIHYPERTENSIVES
Synthesis Plan
FORMULA:C15H11Cl2N5O

SMILES: NNC(=O)c1ccc2ncnc(Nc3ccc(Cl)c(Cl)c3)c2c1

BIRTHDAY: 2018-12-02T16:06:09.075078
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C16H22N4O7

SMILES: CC(C)C[C@@H](Nc1ncc2c(n1)=CC(O)(O)C(O)(O)C=2)C(=O)NCC(=O)O

BIRTHDAY: 2018-12-02T16:06:09.085116
ATC: N05A
- NERVOUS SYSTEM
- PSYCHOLEPTICS
- ANTIPSYCHOTICS
Synthesis Plan
FORMULA:C18H23N3O2S

SMILES: Cc1ccccc1C1=C[C@]2(C(C)(C)C)[C@](N)(C=C1)N=CNS2(=O)=O

BIRTHDAY: 2018-12-02T16:06:09.094012
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C23H33N7

SMILES: CC(C)C[C@H](Nc1nc2c(c(Nc3ccccc3C#N)n1)N(C(C)C)CN2)C(C)C

BIRTHDAY: 2018-12-02T16:06:09.122766
ATC: N05A
- NERVOUS SYSTEM
- PSYCHOLEPTICS
- ANTIPSYCHOTICS
Synthesis Plan
FORMULA:C22H25FN4O3

SMILES: COc1cc2ncnc(N[C@@H](CC(C)C)C(=O)Nc3ccc(F)cc3)c2cc1OC

BIRTHDAY: 2018-12-02T16:06:09.132490
ATC: N05A
- NERVOUS SYSTEM
- PSYCHOLEPTICS
- ANTIPSYCHOTICS
Synthesis Plan
FORMULA:C23H24ClN7O

SMILES: CN(C)C(C)(C)Nc1nc(Nc2ccccc2Cl)nc2ncn(C(=O)c3ccccc3)c12

BIRTHDAY: 2018-12-02T16:06:09.142908
ATC: C03C
- CARDIOVASCULAR SYSTEM
- DIURETICS
- HIGH-CEILING DIURETICS
Synthesis Plan
FORMULA:C23H30ClN5O2

SMILES: CC(C)C[C@@H](Nc1ncc(C(=O)NCCCN2CCCC2=O)cn1)c1cccc(Cl)c1

BIRTHDAY: 2018-12-02T16:06:09.191535
ATC: N05A
- NERVOUS SYSTEM
- PSYCHOLEPTICS
- ANTIPSYCHOTICS
Synthesis Plan
FORMULA:C14H11Cl2N3O4

SMILES: OC1(O)C=Cc2cnc(Nc3cc(Cl)ccc3Cl)nc2C1(O)O

BIRTHDAY: 2018-12-02T16:06:09.200722
ATC: L04A
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- IMMUNOSUPPRESSANTS
- IMMUNOSUPPRESSANTS
Synthesis Plan
FORMULA:C24H21N5O4

SMILES: COC1=c2cnc(Nc3ccccc3CNC(=O)c3ccccc3C#N)nc2=CC(O)(O)C1

BIRTHDAY: 2018-12-02T16:06:09.211116
ATC: N05A
- NERVOUS SYSTEM
- PSYCHOLEPTICS
- ANTIPSYCHOTICS
Synthesis Plan
FORMULA:C22H35N5O5

SMILES: COC1=Cc2c(ncnc2N[C@H](CC(C)C)C(=O)NCC(=O)NCC(C)(C)C)CC1(O)O

BIRTHDAY: 2018-12-02T16:06:09.221366
ATC: N05A
- NERVOUS SYSTEM
- PSYCHOLEPTICS
- ANTIPSYCHOTICS
Synthesis Plan
FORMULA:C20H24BrN5O

SMILES: C[C@H](N[C@]12C=CC=C[C@]1(Nc1ccccc1Br)C=NC=N2)N1CCOCC1

BIRTHDAY: 2018-12-02T16:06:09.230625
ATC: N01A
- NERVOUS SYSTEM
- ANESTHETICS
- ANESTHETICS, GENERAL
Synthesis Plan
FORMULA:C23H33ClN6

SMILES: CC(C)C[C@@H](Nc1nc(Nc2cccc(Cl)c2)c2ncn(C(C)C)c2n1)C(C)(C)C

BIRTHDAY: 2018-12-03T10:42:30.173301
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C23H24FN5OS2

SMILES: CC(C)C[C@@H](Nc1cc(N2CSc3c(F)cccc3S2)ncn1)C(=O)Nc1ccccc1

BIRTHDAY: 2018-12-03T10:42:30.183734
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C22H35N5O5

SMILES: COC1=C2C=NC(N[C@@H](CC(C)C)C(=O)NCC(=O)NCC(C)(C)C)=N[C@H]2C(O)(O)C=C1

BIRTHDAY: 2018-12-03T10:42:30.203696
ATC: C02D
- CARDIOVASCULAR SYSTEM
- ANTIHYPERTENSIVES
- ARTERIOLAR SMOOTH MUSCLE, AGENTS ACTING ON
Synthesis Plan
FORMULA:C22H20F3N5

SMILES: CC(C)(C)c1ccc(Nc2nc(Nc3cccc(C#N)c3)ncc2C(F)(F)F)cc1

BIRTHDAY: 2018-12-03T10:42:30.213497
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C21H33N5O5

SMILES: COC1=CC=C2N=C(N[C@@H](CC(C)C)C(=O)NCC(=O)NCC(C)C)N=C[C@@H]2C1(O)O

BIRTHDAY: 2018-12-03T10:42:30.223930
ATC: C10A
- CARDIOVASCULAR SYSTEM
- LIPID MODIFYING AGENTS
- LIPID MODIFYING AGENTS, PLAIN
Synthesis Plan
FORMULA:C15H13Cl2N3O3

SMILES: COC1=Cc2nc(Nc3cc(Cl)ccc3Cl)ncc2CC1(O)O

BIRTHDAY: 2018-12-03T10:42:30.232874
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C23H37N5O4

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

BIRTHDAY: 2018-12-03T10:42:30.243009
ATC: A11H
- ALIMENTARY TRACT AND METABOLISM
- VITAMINS
- OTHER PLAIN VITAMIN PREPARATIONS
Synthesis Plan
FORMULA:C33H35N9O5

SMILES: COC1=CC=C2N=C(Nc3ccccc3-c3c4cccc3NCC[C@@]3(NCCCN4)N[C@H](n4ccnc4)C(=O)C3=O)N=C[C@H]2C1(O)O

BIRTHDAY: 2018-12-03T10:42:30.259200
ATC: P02C
- ANTIPARASITIC PRODUCTS, INSECTICIDES AND REPELLENTS
- ANTHELMINTICS
- ANTINEMATODAL AGENTS
Synthesis Plan
FORMULA:C18H22N4O3

SMILES: CO[C@]12C=NC(Nc3ccccc3CN(C)C)=NC1=CC=CC2(O)O

BIRTHDAY: 2018-12-03T10:42:30.268092
ATC: V08D
- VARIOUS
- CONTRAST MEDIA
- ULTRASOUND CONTRAST MEDIA
Synthesis Plan
FORMULA:C24H21N5O4

SMILES: COC1=Cc2cnc(Nc3ccccc3CNC(=O)c3ccccc3C#N)nc2CC1(O)O

BIRTHDAY: 2018-12-03T10:42:30.311492
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C22H33N5O4

SMILES: COc1cc(OC)c2ncnc(N[C@@H](CC(C)C)C(=O)NCC(=O)NCC(C)C)c2c1

BIRTHDAY: 2018-12-03T10:42:30.321445
ATC: V09X
- VARIOUS
- DIAGNOSTIC RADIOPHARMACEUTICALS
- OTHER DIAGNOSTIC RADIOPHARMACEUTICALS
Synthesis Plan
FORMULA:C19H20FN3O4

SMILES: COC1(OC)CC=Cc2nc(N[C@@H](CC(=O)O)c3ccccc3F)ncc21

BIRTHDAY: 2018-12-03T10:42:30.360263
ATC: A10B
- ALIMENTARY TRACT AND METABOLISM
- DRUGS USED IN DIABETES
- BLOOD GLUCOSE LOWERING DRUGS, EXCL. INSULINS
Synthesis Plan
FORMULA:C21H33N5O5

SMILES: COC1=CC=C2N=C(N[C@@H](CC(C)C)C(=O)NCC(=O)NCC(C)C)N=C[C@H]2C1(O)O

BIRTHDAY: 2018-12-03T19:10:55.696636
ATC: C10A
- CARDIOVASCULAR SYSTEM
- LIPID MODIFYING AGENTS
- LIPID MODIFYING AGENTS, PLAIN
Synthesis Plan
FORMULA:C19H25Cl2N7

SMILES: CC(C)n1cnc2c(Nc3ccc(Cl)c(Cl)c3)nc(NCCCN(C)C)nc21

BIRTHDAY: 2018-12-03T19:10:55.717267
ATC: J01M
- ANTIINFECTIVES FOR SYSTEMIC USE
- ANTIBACTERIALS FOR SYSTEMIC USE
- QUINOLONE ANTIBACTERIALS
Synthesis Plan
FORMULA:C21H25FN4O4

SMILES: COC1=Cc2ncnc(N[C@@H](CC(C)C)C(=O)Nc3ccc(F)cc3)c2CC1(O)O

BIRTHDAY: 2018-12-03T19:10:55.727571
ATC: N05A
- NERVOUS SYSTEM
- PSYCHOLEPTICS
- ANTIPSYCHOTICS
Synthesis Plan
FORMULA:C19H22N4O2

SMILES: COc1cc2ncnc(Nc3ccc(CN(C)C)cc3)c2cc1OC

BIRTHDAY: 2018-12-03T19:10:55.736082
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C16H22N4O7

SMILES: CC(C)C[C@@H](Nc1ncc2c(n1)C=CC(O)(O)C2(O)O)C(=O)NCC(=O)O

BIRTHDAY: 2018-12-03T19:10:55.746220
ATC: M01A
- MUSCULO-SKELETAL SYSTEM
- ANTIINFLAMMATORY AND ANTIRHEUMATIC PRODUCTS
- ANTIINFLAMMATORY AND ANTIRHEUMATIC PRODUCTS, NON-STEROIDS
Synthesis Plan
FORMULA:C34H40N6O5

SMILES: CC(C)C[C@@H](Nc1nccc(N2CCCNCc3cccc(c3)Oc3ccc4ccc(C(=O)O)c(c4c3)CNCC2)n1)C(=O)O

BIRTHDAY: 2018-12-03T19:10:55.759811
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C26H21ClFN7O

SMILES: O=C(NCc1ccccc1)n1cnc2nc(Nc3ccccc3Cl)nc(NCc3ccccc3F)c21

BIRTHDAY: 2018-12-03T19:10:55.771493
ATC: J01F
- ANTIINFECTIVES FOR SYSTEMIC USE
- ANTIBACTERIALS FOR SYSTEMIC USE
- MACROLIDES, LINCOSAMIDES AND STREPTOGRAMINS
Synthesis Plan
FORMULA:C24H24N6O2

SMILES: COc1ccc(Nc2nc(Nc3ccccc3C#N)c3c(n2)C(=O)N(CC(C)C)C3)cc1

BIRTHDAY: 2018-12-03T19:10:55.782113
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C24H21N5O4

SMILES: COC1=Cc2ncnc(Nc3ccc(CNC(=O)c4cccc(C#N)c4)cc3)c2CC1(O)O

BIRTHDAY: 2018-12-03T19:10:55.792524
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C37H58N2O2

SMILES: CCCCCCCCCCCCCCCCCCCCCCCC(=O)Nc1ccc(-c2cccc(C(N)=O)c2)cc1

BIRTHDAY: 2018-12-03T19:10:55.811954
ATC: C08D
- CARDIOVASCULAR SYSTEM
- CALCIUM CHANNEL BLOCKERS
- SELECTIVE CALCIUM CHANNEL BLOCKERS WITH DIRECT CARDIAC EFFECTS
Synthesis Plan
FORMULA:C24H35N5O

SMILES: CC(C)C[C@@H](Nc1cncnc1C(=O)NC(C)(C)N1CCCCC1)c1ccccc1

BIRTHDAY: 2018-12-03T19:10:55.851818
ATC: N07B
- NERVOUS SYSTEM
- OTHER NERVOUS SYSTEM DRUGS
- DRUGS USED IN ADDICTIVE DISORDERS
Synthesis Plan
FORMULA:C26H33N3O5

SMILES: COc1cc2ncnc(N3CCCc4cc(OCCO)ccc4CCCOCC3)c2cc1OC

BIRTHDAY: 2018-12-03T19:10:55.872367
ATC: C10A
- CARDIOVASCULAR SYSTEM
- LIPID MODIFYING AGENTS
- LIPID MODIFYING AGENTS, PLAIN
Synthesis Plan
FORMULA:C17H18N6O5

SMILES: CO[C@]12N=C(Nc3ccccc3[C@]3(N)NC(=O)NO3)N=CC1=CC=CC2(O)O

BIRTHDAY: 2018-12-01T22:30:00.422676
ATC: V03A
- VARIOUS
- ALL OTHER THERAPEUTIC PRODUCTS
- ALL OTHER THERAPEUTIC PRODUCTS
Synthesis Plan
FORMULA:C24H21N5O4

SMILES: COC1=CC(O)(O)Cc2nc(Nc3ccccc3CNC(=O)c3ccccc3C#N)ncc21

BIRTHDAY: 2018-12-01T22:30:00.433125
ATC: A10B
- ALIMENTARY TRACT AND METABOLISM
- DRUGS USED IN DIABETES
- BLOOD GLUCOSE LOWERING DRUGS, EXCL. INSULINS
Synthesis Plan
FORMULA:C21H33N5O5

SMILES: COC1=Cc2ncnc(N[C@H](CC(C)C)C(=O)NCC(=O)NCC(C)C)c2CC1(O)O

BIRTHDAY: 2018-12-01T22:30:00.443301
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C23H24Cl2N8O

SMILES: CN(C)C(C)(C)Nc1nc(Nc2ccccc2Cl)c2c(ncn2C(=O)Nc2cccc(Cl)c2)n1

BIRTHDAY: 2018-12-01T22:30:00.464577
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:C23H25N6O4PS

SMILES: COC1=c2cnc(Nc3cccc(Cn4snc5nco[pH]c-5c4C(C)C)c3)nc2=CC(O)(O)C1

BIRTHDAY: 2018-12-01T22:30:00.476235
ATC: H01B
- SYSTEMIC HORMONAL PREPARATIONS, EXCL. SEX HORMONES AND INSULINS
- PITUITARY AND HYPOTHALAMIC HORMONES AND ANALOGUES
- POSTERIOR PITUITARY LOBE HORMONES
Synthesis Plan
FORMULA:C19H15ClFN5O

SMILES: Fc1ccc(CNc2nc(Nc3ccc(Cl)cc3)nc3c2OC=CN3)cc1

BIRTHDAY: 2018-12-01T22:30:00.485564
ATC: J05A
- ANTIINFECTIVES FOR SYSTEMIC USE
- ANTIVIRALS FOR SYSTEMIC USE
- DIRECT ACTING ANTIVIRALS
Synthesis Plan
FORMULA:C25H21N5O3

SMILES: COc1cc2ncnc(Nc3ccc(CNC(=O)c4cccc(C#N)c4)cc3)c2cc1OC

BIRTHDAY: 2018-12-01T22:30:00.495610
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C25H30ClN5O4

SMILES: C=CC(=O)N[C@@]12N=CN=C[C@@]1(Nc1c(Cl)cccc1OC)C=CC=C2OC(C)(C)N1CCOCC1

BIRTHDAY: 2018-12-01T22:30:00.517868
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C23H26BrN5O2

SMILES: O=C(CCCCN1CCOCC1)Nc1ccc2ncnc(Nc3cccc(Br)c3)c2c1

BIRTHDAY: 2018-12-01T22:30:00.547911
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C33H52N2O3

SMILES: CN(C)C(C)(C)C(C)(C)C(C)(C)C(C)(C)C(C)(C)C(C)(C)Oc1ccccc1NC(=O)c1cccc(O)c1

BIRTHDAY: 2018-12-01T22:30:00.577603
ATC: D01A
- DERMATOLOGICALS
- ANTIFUNGALS FOR DERMATOLOGICAL USE
- ANTIFUNGALS FOR TOPICAL USE
Synthesis Plan
FORMULA:C42H40N10O

SMILES: CC(C)C[C@H](Nc1nc(Nc2ccc(C#N)cc2)nc2c1N[C@@H]1CCc3cccc(c3)OCc3cccc(c3)Nc3nccc(n3)N21)c1ccccc1

BIRTHDAY: 2018-12-01T22:30:00.593210
ATC: N05A
- NERVOUS SYSTEM
- PSYCHOLEPTICS
- ANTIPSYCHOTICS
Synthesis Plan