matter.farm

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

These compounds may interact with:

G1/S-specific cyclin-D1

Potentially involved in: cancer; multiple myeloma; immune system cancer; lymphoid leukemia; endometrial cancer; breast cancer; kidney cancer; carcinoma; adenoma; ductal carcinoma in situ; gastrointestinal system disease; vascular disease; parathyroid adenoma; intestinal benign neoplasm; familial adenomatous polyposis; primary hyperparathyroidism; papilloma; adenocarcinoma; anemia; anorexia

Disease data sourced from Pharos.

Antagonist

FORMULA:C24H19F3N6O

SMILES: COc1cccc(-c2nn3c(c2-c2cncnc2Nc2ccccc2C(F)(F)F)C=CCN3)c1

BIRTHDAY: 2018-12-01T14:12:14.607689
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C24H19F3N6O

SMILES: COc1ccccc1-c1nn2c(c1-c1cncnc1Nc1ccccc1C(F)(F)F)C=CCN2

BIRTHDAY: 2018-12-01T14:12:14.619253
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C26H31N5O2

SMILES: O=C1NC(=O)c2c1c1c(c3[nH]c4ccccc4c23)[C@]2(CCCCCNCCNCCC2)CN1

BIRTHDAY: 2018-12-01T14:12:14.629606
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:C17H26N6

SMILES: CC[C@@H](C)c1[nH]ncc1-c1ccnc(NC2CCN(C)CC2)n1

BIRTHDAY: 2018-12-01T14:12:14.637800
ATC: M02A
- MUSCULO-SKELETAL SYSTEM
- TOPICAL PRODUCTS FOR JOINT AND MUSCULAR PAIN
- TOPICAL PRODUCTS FOR JOINT AND MUSCULAR PAIN
Synthesis Plan
FORMULA:C18H26N10

SMILES: CC(C)c1cc(-c2c(N[C@]3(N)CCCCN3)ncnc2-c2[nH]ncc2N)[nH]n1

BIRTHDAY: 2018-12-01T14:12:14.648400
ATC: N05A
- NERVOUS SYSTEM
- PSYCHOLEPTICS
- ANTIPSYCHOTICS
Synthesis Plan
FORMULA:C20H33N7O

SMILES: CC(C)Cn1cc(C(C)C)c(-c2ncc(N[C@H]3CCC[C@@](N)(CO)N3)cn2)n1

BIRTHDAY: 2018-12-01T14:12:14.657759
ATC: J05A
- ANTIINFECTIVES FOR SYSTEMIC USE
- ANTIVIRALS FOR SYSTEMIC USE
- DIRECT ACTING ANTIVIRALS
Synthesis Plan
FORMULA:C24H19F3N6O

SMILES: COc1ccccc1-c1c(-c2cnc(Nc3ccccc3C(F)(F)F)nc2)nn2c1C=CCN2

BIRTHDAY: 2018-12-01T14:12:14.668793
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C23H30N6

SMILES: CC(C)c1[nH]ncc1-c1ccnc(NC2CCN(CCc3ccccc3)CC2)n1

BIRTHDAY: 2018-12-01T14:12:14.677547
ATC: G03B
- GENITO URINARY SYSTEM AND SEX HORMONES
- SEX HORMONES AND MODULATORS OF THE GENITAL SYSTEM
- ANDROGENS
Synthesis Plan
FORMULA:C20H28F3N7O

SMILES: CC(C)c1cc(-c2ccnc(N[C@H]3CCCN(CCC(N)=O)C3)n2)n(CC(F)(F)F)n1

BIRTHDAY: 2018-12-01T14:12:14.688094
ATC: V09X
- VARIOUS
- DIAGNOSTIC RADIOPHARMACEUTICALS
- OTHER DIAGNOSTIC RADIOPHARMACEUTICALS
Synthesis Plan
FORMULA:C24H17F3N6O

SMILES: COc1ccc(-c2nn3ncccc3c2-c2ccnc(Nc3ccc(C(F)(F)F)cc3)n2)cc1

BIRTHDAY: 2018-12-01T14:12:14.699260
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C23H39N7

SMILES: CC(C)Cn1nc(-c2ncc(N[C@H]3CNC[C@@](N)(CC(C)C)C3)cn2)cc1C(C)C

BIRTHDAY: 2018-12-01T14:12:14.708708
ATC: L02B
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ENDOCRINE THERAPY
- HORMONE ANTAGONISTS AND RELATED AGENTS
Synthesis Plan
FORMULA:C29H28N8O5

SMILES: COc1ccccc1-c1[nH]nc2c1-c1cc(NC(=O)N(N)C(=O)c3cccc(O)c3N3CCNC[C@@H]3N)ccc1C2=O

BIRTHDAY: 2018-12-01T14:12:14.722787
ATC: B06A
- BLOOD AND BLOOD FORMING ORGANS
- OTHER HEMATOLOGICAL AGENTS
- OTHER HEMATOLOGICAL AGENTS
Synthesis Plan
FORMULA:C26H50N4OS

SMILES: CN(C)CCCCCCCCCCCCCCCCCCC[C@@]12NC(=O)SN1C=CN2C

BIRTHDAY: 2018-12-01T14:12:14.742927
ATC: D06B
- DERMATOLOGICALS
- ANTIBIOTICS AND CHEMOTHERAPEUTICS FOR DERMATOLOGICAL USE
- CHEMOTHERAPEUTICS FOR TOPICAL USE
Synthesis Plan
FORMULA:C38H64ClN3OS

SMILES: C[C@@H](NC(=O)c1scnc1-c1ccc(Cl)cc1)C(C)(C)C(C)(C)C(C)(C)C(C)(C)C(C)(C)C(C)(C)C(C)(C)C(C)(C)N(C)C

BIRTHDAY: 2018-12-01T14:12:14.765224
ATC: N05B
- NERVOUS SYSTEM
- PSYCHOLEPTICS
- ANXIOLYTICS
Synthesis Plan
FORMULA:C24H24N6O4

SMILES: COc1ccccc1-c1n[nH]c2c1-c1cc(NC(=O)[C@]3(N)CCC[C@@H](C(N)=O)N3)ccc1C2=O

BIRTHDAY: 2018-12-01T14:12:14.776873
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C21H28N8O

SMILES: CC(C)c1c(-c2ncc(N[C@@H]3C[C@](N)(CC(N)=O)CCN3)cn2)nn2ccccc12

BIRTHDAY: 2018-12-25T02:04:15.284176
ATC: A10B
- ALIMENTARY TRACT AND METABOLISM
- DRUGS USED IN DIABETES
- BLOOD GLUCOSE LOWERING DRUGS, EXCL. INSULINS
Synthesis Plan
FORMULA:C23H30N6

SMILES: CC(C)c1c[nH]nc1-c1ncc(N[C@@H]2CCCCN2[C@@H](C)c2ccccc2)cn1

BIRTHDAY: 2018-12-25T02:04:15.304946
ATC: M04A
- MUSCULO-SKELETAL SYSTEM
- ANTIGOUT PREPARATIONS
- ANTIGOUT PREPARATIONS
Synthesis Plan
FORMULA:C16H16N4O

SMILES: CC1(C)[CH+][N-]Nc2cccc(NC(=O)c3cccnc3)c21

BIRTHDAY: 2018-12-25T02:04:15.313040
ATC: V08A
- VARIOUS
- CONTRAST MEDIA
- X-RAY CONTRAST MEDIA, IODINATED
Synthesis Plan
FORMULA:C22H39NO

SMILES: C[C@H]1[C@H]2C=C[C@@H](C1(C)C)[C@](C)(C(C)(C)C(C)(C)N(C)C)CCC2=O

BIRTHDAY: 2018-12-25T02:04:15.320251
ATC: M03A
- MUSCULO-SKELETAL SYSTEM
- MUSCLE RELAXANTS
- MUSCLE RELAXANTS, PERIPHERALLY ACTING AGENTS
Synthesis Plan
FORMULA:C12H17FSi

SMILES: CC1(C)CC[SiH2][C@@H]1c1cccc(F)c1

BIRTHDAY: 2018-12-25T02:04:15.326138
ATC: A07X
- ALIMENTARY TRACT AND METABOLISM
- ANTIDIARRHEALS, INTESTINAL ANTIINFLAMMATORY/ANTIINFECTIVE AGENTS
- OTHER ANTIDIARRHEALS
Synthesis Plan
FORMULA:C18H17Cl2N5O

SMILES: CN(C)CC(=O)Nc1[nH]nc(-c2ccncc2)c1-c1ccc(Cl)c(Cl)c1

BIRTHDAY: 2018-12-25T02:04:15.335682
ATC: M01A
- MUSCULO-SKELETAL SYSTEM
- ANTIINFLAMMATORY AND ANTIRHEUMATIC PRODUCTS
- ANTIINFLAMMATORY AND ANTIRHEUMATIC PRODUCTS, NON-STEROIDS
Synthesis Plan
FORMULA:C25H37N7

SMILES: CC(C)c1nn2ccccc2c1-c1cc(NC2CCN(C)CC2)nc(N[C@H](C)C(C)C)n1

BIRTHDAY: 2018-12-25T02:04:15.345886
ATC: N02C
- NERVOUS SYSTEM
- ANALGESICS
- ANTIMIGRAINE PREPARATIONS
Synthesis Plan
FORMULA:C20H28F3N7O

SMILES: CC(C)c1nn(CC(F)(F)F)cc1-c1ccnc(N[C@H]2CCCN(CCC(N)=O)C2)n1

BIRTHDAY: 2018-12-25T02:04:15.356502
ATC: J05A
- ANTIINFECTIVES FOR SYSTEMIC USE
- ANTIVIRALS FOR SYSTEMIC USE
- DIRECT ACTING ANTIVIRALS
Synthesis Plan
FORMULA:C20H18N4O3

SMILES: O=C1NC(=O)c2c1c1c(c3[nH]c4ccccc4c23)[C@@]2(CNCCOC2)CN1

BIRTHDAY: 2018-12-25T02:04:15.366547
ATC: C03D
- CARDIOVASCULAR SYSTEM
- DIURETICS
- POTASSIUM-SPARING AGENTS
Synthesis Plan
FORMULA:C29H25N7O6

SMILES: COc1ccc(-c2n[nH]c3c2C(=O)c2c(NC(=O)NNC(=O)c4cccc(N5CCNC(=O)C5)c4O)cccc2-3)cc1

BIRTHDAY: 2018-12-25T02:04:15.379973
ATC: C09C
- CARDIOVASCULAR SYSTEM
- AGENTS ACTING ON THE RENIN-ANGIOTENSIN SYSTEM
- ANGIOTENSIN II ANTAGONISTS, PLAIN
Synthesis Plan
FORMULA:C24H19F3N6O

SMILES: COc1ccccc1-c1c(-c2cncnc2Nc2ccccc2C(F)(F)F)nn2c1C=CCN2

BIRTHDAY: 2018-12-25T02:04:15.400307
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C23H32N8

SMILES: Cc1cc(C)nc(Nc2nc(NC3CCN(C)CC3)cc(-c3n[nH]cc3C(C)C)n2)c1

BIRTHDAY: 2018-12-25T02:04:15.411076
ATC: L01D
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- CYTOTOXIC ANTIBIOTICS AND RELATED SUBSTANCES
Synthesis Plan
FORMULA:C29H24ClN5O5

SMILES: O=C1OC=NN2C3=NC(=C(c4cccc(Cl)c4)[C@]12O)c1cncc(c1)COCC=CCOCc1cccc(c1)N3

BIRTHDAY: 2018-12-25T02:04:15.424074
ATC: C02D
- CARDIOVASCULAR SYSTEM
- ANTIHYPERTENSIVES
- ARTERIOLAR SMOOTH MUSCLE, AGENTS ACTING ON
Synthesis Plan
FORMULA:C11H12N4OS

SMILES: NNC(=O)c1csc(NCc2ccccc2)n1

BIRTHDAY: 2018-12-25T02:04:15.431624
ATC: M02A
- MUSCULO-SKELETAL SYSTEM
- TOPICAL PRODUCTS FOR JOINT AND MUSCULAR PAIN
- TOPICAL PRODUCTS FOR JOINT AND MUSCULAR PAIN
Synthesis Plan
FORMULA:C11H21NS

SMILES: CC(C)C1(C(C)C)CCN=CCS1

BIRTHDAY: 2018-12-25T02:04:15.437123
ATC: D08A
- DERMATOLOGICALS
- ANTISEPTICS AND DISINFECTANTS
- ANTISEPTICS AND DISINFECTANTS
Synthesis Plan
FORMULA:C20H34N8

SMILES: CC(C)c1cn[nH]c1-c1c(N[C@H](C)C(C)C)ncnc1N[C@]1(N)CCCCN1

BIRTHDAY: 2018-12-25T02:04:15.447487
ATC: V08D
- VARIOUS
- CONTRAST MEDIA
- ULTRASOUND CONTRAST MEDIA
Synthesis Plan
FORMULA:C25H35N9O

SMILES: Cc1cc(C(=O)N(C)C)cc(Nc2nc(NC3CCN(C)CC3)ncc2-c2cc(C(C)C)[nH]n2)n1

BIRTHDAY: 2018-12-25T02:04:15.458833
ATC: A11H
- ALIMENTARY TRACT AND METABOLISM
- VITAMINS
- OTHER PLAIN VITAMIN PREPARATIONS
Synthesis Plan
FORMULA:C24H36N8

SMILES: CC(C)c1c(-c2c(N[C@@H](C)C(C)C)ncnc2N[C@]2(N)CCCCN2)nn2ccccc12

BIRTHDAY: 2018-12-03T02:40:22.654411
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C22H22F3N3

SMILES: CC[C@H](C)[C@H](C)c1ccc(-c2[nH]nc3c2Cc2cc(C(F)(F)F)ncc2-3)cc1

BIRTHDAY: 2018-12-03T02:40:22.663541
ATC: N05A
- NERVOUS SYSTEM
- PSYCHOLEPTICS
- ANTIPSYCHOTICS
Synthesis Plan
FORMULA:C15H23N7

SMILES: CC(C)c1cn[nH]c1-c1ncc(N[C@H]2CC[C@H](N)CN2)cn1

BIRTHDAY: 2018-12-03T02:40:22.671922
ATC: J05A
- ANTIINFECTIVES FOR SYSTEMIC USE
- ANTIVIRALS FOR SYSTEMIC USE
- DIRECT ACTING ANTIVIRALS
Synthesis Plan
FORMULA:C35H58ClN3OS

SMILES: CN(C)CCCCCCCCCCCCCCCCCCCCCCCNC(=O)c1csc(-c2ccc(Cl)cc2)n1

BIRTHDAY: 2018-12-03T02:40:22.681904
ATC: N05A
- NERVOUS SYSTEM
- PSYCHOLEPTICS
- ANTIPSYCHOTICS
Synthesis Plan
FORMULA:C22H36N6O

SMILES: CC(C)CCN1CCC(Nc2nccc(-c3cc(C(C)C)nn3CCO)n2)CC1

BIRTHDAY: 2018-12-03T02:40:22.690872
ATC: H01C
- SYSTEMIC HORMONAL PREPARATIONS, EXCL. SEX HORMONES AND INSULINS
- PITUITARY AND HYPOTHALAMIC HORMONES AND ANALOGUES
- HYPOTHALAMIC HORMONES
Synthesis Plan
FORMULA:C34H57N3OS

SMILES: CN(C)CCCCCCCCCCCCCCCCCCCCCCNC(=O)c1nc(-c2ccccc2)cs1

BIRTHDAY: 2018-12-03T02:40:22.700121
ATC: N06A
- NERVOUS SYSTEM
- PSYCHOANALEPTICS
- ANTIDEPRESSANTS
Synthesis Plan
FORMULA:C35H33N7O4

SMILES: CNC(=O)c1ccc(NC(=O)c2ncc3cc2-c2nc(nc4ccc(OC)cc24)Nc2cccc(c2)CNCC=CCOC3)cc1

BIRTHDAY: 2018-12-03T02:40:22.715050
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C16H11NO2

SMILES: O=C1NC(=O)c2cc(/C=C\c3ccccc3)ccc21

BIRTHDAY: 2018-12-03T02:40:22.722106
ATC: N07A
- NERVOUS SYSTEM
- OTHER NERVOUS SYSTEM DRUGS
- PARASYMPATHOMIMETICS
Synthesis Plan
FORMULA:C25H37N7

SMILES: CC(C)c1nn2ccccc2c1-c1cc(NC2CCN(C)CC2)nc(N[C@@H](C)C(C)C)n1

BIRTHDAY: 2018-12-03T02:40:22.732105
ATC: N02C
- NERVOUS SYSTEM
- ANALGESICS
- ANTIMIGRAINE PREPARATIONS
Synthesis Plan
FORMULA:C23H20Cl3N5OS

SMILES: CCc1c2c(=O)[nH]c(Cc3cccc4c3NCCCS4)nc2nn1-c1cc(Cl)c(Cl)c(Cl)c1

BIRTHDAY: 2018-12-03T02:40:22.742862
ATC: A11D
- ALIMENTARY TRACT AND METABOLISM
- VITAMINS
- VITAMIN B1, PLAIN AND IN COMBINATION WITH VITAMIN B6 AND B12
Synthesis Plan
FORMULA:C20H34N8

SMILES: CC(C)c1cn[nH]c1-c1c(N[C@@H](C)C(C)C)ncnc1N[C@@]1(N)CCCCN1

BIRTHDAY: 2018-12-03T02:40:22.753197
ATC: V08D
- VARIOUS
- CONTRAST MEDIA
- ULTRASOUND CONTRAST MEDIA
Synthesis Plan
FORMULA:C32H37N5O6

SMILES: COc1ccccc1-c1n[nH]c2c1-c1cc(NC(=O)N(N)[C@H]3OCCCCCCOC=C[C@@H]4CCC[C@@H]3O4)ccc1C2=O

BIRTHDAY: 2018-12-03T02:40:22.766073
ATC: C08D
- CARDIOVASCULAR SYSTEM
- CALCIUM CHANNEL BLOCKERS
- SELECTIVE CALCIUM CHANNEL BLOCKERS WITH DIRECT CARDIAC EFFECTS
Synthesis Plan
FORMULA:C18H24N4O2

SMILES: CN(C)CC(=O)Nc1cnn2c1C(=O)[C@@]1(C(C)(C)C)C=CC=C[C@H]21

BIRTHDAY: 2018-12-03T02:40:22.774615
ATC: N05A
- NERVOUS SYSTEM
- PSYCHOLEPTICS
- ANTIPSYCHOTICS
Synthesis Plan
FORMULA:C14H14N4O

SMILES: CC1=NC=C2C(N)=CNN2C(c2ccccc2O)=C1

BIRTHDAY: 2018-12-03T02:40:22.792337
ATC: B01A
- BLOOD AND BLOOD FORMING ORGANS
- ANTITHROMBOTIC AGENTS
- ANTITHROMBOTIC AGENTS
Synthesis Plan
FORMULA:C21H28N10O2

SMILES: CC(C)c1c(-c2ncc(N[C@H]3NCCC[C@]3(N)CO)cn2)nn2c1C(=O)N[C@@H]1N=CN=C[C@H]12

BIRTHDAY: 2018-12-03T02:40:22.803958
ATC: J05A
- ANTIINFECTIVES FOR SYSTEMIC USE
- ANTIVIRALS FOR SYSTEMIC USE
- DIRECT ACTING ANTIVIRALS
Synthesis Plan
FORMULA:C25H27N7O

SMILES: COc1ccc(-c2n[nH]cc2-c2ccnc(Nc3ccc(N4CCN(C)CC4)cc3)n2)cc1

BIRTHDAY: 2018-12-03T02:40:22.814191
ATC: J01D
- ANTIINFECTIVES FOR SYSTEMIC USE
- ANTIBACTERIALS FOR SYSTEMIC USE
- OTHER BETA-LACTAM ANTIBACTERIALS
Synthesis Plan
FORMULA:C25H37N7

SMILES: CC(C)c1nn2ccccc2c1-c1cc(N[C@@H](C)C(C)C)nc(NC2CCN(C)CC2)n1

BIRTHDAY: 2018-11-30T03:42:18.934437
ATC: J05A
- ANTIINFECTIVES FOR SYSTEMIC USE
- ANTIVIRALS FOR SYSTEMIC USE
- DIRECT ACTING ANTIVIRALS
Synthesis plan pending
FORMULA:C18H19FN6

SMILES: CC(C)c1cc(-c2ncc3c(n2)NCN(c2cccc(F)c2)C3)n[nH]1

BIRTHDAY: 2018-11-30T03:42:18.943386
ATC: C09C
- CARDIOVASCULAR SYSTEM
- AGENTS ACTING ON THE RENIN-ANGIOTENSIN SYSTEM
- ANGIOTENSIN II ANTAGONISTS, PLAIN
Synthesis plan pending
FORMULA:C37H72N2

SMILES: CCC(C)(C)C(C)(C)C(C)(C)C(C)(C)C(C)(C)C(C)(C)C(C)(C)C(C)(C)N(C)[C@@]1(C)C(C)=CC2CCN1CC2

BIRTHDAY: 2018-11-30T03:42:18.952016
ATC: M04A
- MUSCULO-SKELETAL SYSTEM
- ANTIGOUT PREPARATIONS
- ANTIGOUT PREPARATIONS
Synthesis plan pending
FORMULA:C34H56ClN3OS

SMILES: CN(C)C(C)(C)C(C)(C)C(C)(C)C(C)(C)C(C)(C)C(C)(C)C(C)(C)CNC(=O)c1scnc1-c1cccc(Cl)c1

BIRTHDAY: 2018-11-30T03:42:18.962073
ATC: N05B
- NERVOUS SYSTEM
- PSYCHOLEPTICS
- ANXIOLYTICS
Synthesis plan pending
FORMULA:C19H20N6O

SMILES: C=CCNc1nccc(-c2cnn(CC(=O)Nc3ccccc3)c2C)n1

BIRTHDAY: 2018-11-30T03:42:18.971187
ATC: J01F
- ANTIINFECTIVES FOR SYSTEMIC USE
- ANTIBACTERIALS FOR SYSTEMIC USE
- MACROLIDES, LINCOSAMIDES AND STREPTOGRAMINS
Synthesis plan pending
FORMULA:C35H61NO6

SMILES: CN(C)C(C)(C)C(C)(C)C(C)(C)C(C)(C)C(C)(C)C(C)(C)C(C)(C)C(C)(C)C[C@]12C=C(O)C=C(O)[C@H]1C(=O)OC(=O)O2

BIRTHDAY: 2018-11-30T03:42:18.981894
ATC: R03D
- RESPIRATORY SYSTEM
- DRUGS FOR OBSTRUCTIVE AIRWAY DISEASES
- OTHER SYSTEMIC DRUGS FOR OBSTRUCTIVE AIRWAY DISEASES
Synthesis plan pending
FORMULA:C29H49N3O3

SMILES: C[C@@H]1CCN2C=C(C=C(C(=O)O)C3=CN(CC3)C[C@@H](CCCCCCCCN(C)C)[C@@H](C)O1)CC2

BIRTHDAY: 2018-11-30T03:42:18.991803
ATC: C10A
- CARDIOVASCULAR SYSTEM
- LIPID MODIFYING AGENTS
- LIPID MODIFYING AGENTS, PLAIN
Synthesis plan pending
FORMULA:C27H32N6

SMILES: CC(C)c1nn2ccccc2c1-c1ccnc(NC2CCN(CCc3ccccc3)CC2)n1

BIRTHDAY: 2018-11-30T03:42:19.012723
ATC: H03B
- SYSTEMIC HORMONAL PREPARATIONS, EXCL. SEX HORMONES AND INSULINS
- THYROID THERAPY
- ANTITHYROID PREPARATIONS
Synthesis plan pending
FORMULA:C18H26N10

SMILES: CC(C)c1cc(-c2c(N[C@@]3(N)CCCCN3)ncnc2-c2[nH]ncc2N)[nH]n1

BIRTHDAY: 2018-11-30T03:42:19.023488
ATC: N05A
- NERVOUS SYSTEM
- PSYCHOLEPTICS
- ANTIPSYCHOTICS
Synthesis plan pending
FORMULA:C27H35FN6S

SMILES: CC(C)c1cc(-c2ccnc(N[C@@H]3CCN[C@@]4(C)C[C@H](C)[C@@H](C)S[C@H]34)n2)n(-c2ccccc2F)n1

BIRTHDAY: 2018-11-30T03:42:19.034429
ATC: A08A
- ALIMENTARY TRACT AND METABOLISM
- ANTIOBESITY PREPARATIONS, EXCL. DIET PRODUCTS
- ANTIOBESITY PREPARATIONS, EXCL. DIET PRODUCTS
Synthesis plan pending
FORMULA:C23H28F3N7

SMILES: CC(C)c1c[nH]nc1-c1cc(NC2CCN(C)CC2)nc(Nc2cccc(C(F)(F)F)c2)n1

BIRTHDAY: 2018-11-30T03:42:19.045342
ATC: H01A
- SYSTEMIC HORMONAL PREPARATIONS, EXCL. SEX HORMONES AND INSULINS
- PITUITARY AND HYPOTHALAMIC HORMONES AND ANALOGUES
- ANTERIOR PITUITARY LOBE HORMONES AND ANALOGUES
Synthesis plan pending
FORMULA:C22H29N7

SMILES: CC(C)c1cn[nH]c1-c1ncc(N[C@@H]2NCCC[C@@]2(N)Cc2ccccc2)cn1

BIRTHDAY: 2018-11-30T03:42:19.054788
ATC: N05A
- NERVOUS SYSTEM
- PSYCHOLEPTICS
- ANTIPSYCHOTICS
Synthesis plan pending
FORMULA:C21H28N8O

SMILES: CC(C)c1c(-c2ncc(N[C@@H]3CCC[C@](N)(CC(N)=O)N3)cn2)nn2ccccc12

BIRTHDAY: 2018-11-30T03:42:19.073767
ATC: M01A
- MUSCULO-SKELETAL SYSTEM
- ANTIINFLAMMATORY AND ANTIRHEUMATIC PRODUCTS
- ANTIINFLAMMATORY AND ANTIRHEUMATIC PRODUCTS, NON-STEROIDS
Synthesis plan pending
FORMULA:C18H17Cl2N5O

SMILES: CN(C)CC(=O)Nc1n[nH]c(-c2c(Cl)cccc2Cl)c1-c1ccccn1

BIRTHDAY: 2018-11-30T03:42:19.083767
ATC: R07A
- RESPIRATORY SYSTEM
- OTHER RESPIRATORY SYSTEM PRODUCTS
- OTHER RESPIRATORY SYSTEM PRODUCTS
Synthesis plan pending
FORMULA:C21H35N7O

SMILES: CC(C)C[C@@]1(N)CC[C@H](Nc2ncncc2-c2c(C(C)C)cnn2[C@@H](C)O)NC1

BIRTHDAY: 2018-11-30T03:42:19.094151
ATC: A07A
- ALIMENTARY TRACT AND METABOLISM
- ANTIDIARRHEALS, INTESTINAL ANTIINFLAMMATORY/ANTIINFECTIVE AGENTS
- INTESTINAL ANTIINFECTIVES
Synthesis plan pending
FORMULA:C22H29N7

SMILES: CC(C)c1cn[nH]c1-c1ncc(N[C@H]2NCCC[C@]2(N)Cc2ccccc2)cn1

BIRTHDAY: 2018-11-19T08:16:30.384408
ATC: N05A
- NERVOUS SYSTEM
- PSYCHOLEPTICS
- ANTIPSYCHOTICS
Synthesis plan pending
FORMULA:C35H58ClN3OS

SMILES: CN(C)CCCCCCCCCCCCCCCCCCCCCCCNC(=O)c1nc(-c2ccccc2Cl)cs1

BIRTHDAY: 2018-11-19T08:16:30.395092
ATC: N06A
- NERVOUS SYSTEM
- PSYCHOANALEPTICS
- ANTIDEPRESSANTS
Synthesis plan pending
FORMULA:C24H36N8

SMILES: CC(C)c1c(-c2c(N[C@@H](C)C(C)C)ncnc2N[C@@]2(N)CCCCN2)nn2ccccc12

BIRTHDAY: 2018-11-19T08:16:30.420142
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis plan pending
FORMULA:C21H17Cl3N4O2

SMILES: CC(C)c1nn(-c2cc(Cl)c(Cl)c(Cl)c2)c2nc(Cc3ccccc3O)[nH]c(=O)c12

BIRTHDAY: 2018-11-19T08:16:30.431343
ATC: L01B
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- ANTIMETABOLITES
Synthesis plan pending
FORMULA:C20H28F3N7O

SMILES: CC(C)c1cc(-c2ccnc(NC3CCN(CCC(N)=O)CC3)n2)n(CC(F)(F)F)n1

BIRTHDAY: 2018-11-19T08:16:30.456055
ATC: V09X
- VARIOUS
- DIAGNOSTIC RADIOPHARMACEUTICALS
- OTHER DIAGNOSTIC RADIOPHARMACEUTICALS
Synthesis plan pending
FORMULA:C50H92O3

SMILES: CCCCCCCCCCCCCCCCCCCCCCCCCCCCCCC(=O)OCCCC1=CCCC=CCCC[C@H]2C[C@@H](CCO2)CC1

BIRTHDAY: 2018-11-19T08:16:30.467206
ATC: A11D
- ALIMENTARY TRACT AND METABOLISM
- VITAMINS
- VITAMIN B1, PLAIN AND IN COMBINATION WITH VITAMIN B6 AND B12
Synthesis plan pending
FORMULA:C17H15BrN2O

SMILES: O=C1C=C2C=CC=C[C@H]2[C@]2(Cc3cccc(Br)c3N2)NC1

BIRTHDAY: 2018-11-19T08:16:30.475146
ATC: D01A
- DERMATOLOGICALS
- ANTIFUNGALS FOR DERMATOLOGICAL USE
- ANTIFUNGALS FOR TOPICAL USE
Synthesis plan pending
FORMULA:C20H16BN3O3

SMILES: COc1ccccc1-c1[nH]nc2c1-c1c(N[C@@H]3C=CBO3)cccc1C2=O

BIRTHDAY: 2018-11-19T08:16:30.484941
ATC: J01F
- ANTIINFECTIVES FOR SYSTEMIC USE
- ANTIBACTERIALS FOR SYSTEMIC USE
- MACROLIDES, LINCOSAMIDES AND STREPTOGRAMINS
Synthesis plan pending
FORMULA:C17H16F2N4O

SMILES: CN(C)CC(=O)Nc1cnn2cccc(-c3ccc(F)cc3F)c12

BIRTHDAY: 2018-11-19T08:16:30.494089
ATC: C03A
- CARDIOVASCULAR SYSTEM
- DIURETICS
- LOW-CEILING DIURETICS, THIAZIDES
Synthesis plan pending
FORMULA:C34H59N3O2

SMILES: CN(C)CCCCCCCCCCCCCCCCCCCCCCCN1N=CCc2c(O)cccc2C1=O

BIRTHDAY: 2018-11-19T08:16:30.503381
ATC: N07C
- NERVOUS SYSTEM
- OTHER NERVOUS SYSTEM DRUGS
- ANTIVERTIGO PREPARATIONS
Synthesis plan pending
FORMULA:C21H34N6O

SMILES: CC(C)Cn1ncc(C(C)C)c1-c1ncc(N[C@H]2CCCCN2[C@H](C)O)cn1

BIRTHDAY: 2018-11-19T08:16:30.512544
ATC: G01A
- GENITO URINARY SYSTEM AND SEX HORMONES
- GYNECOLOGICAL ANTIINFECTIVES AND ANTISEPTICS
- ANTIINFECTIVES AND ANTISEPTICS, EXCL. COMBINATIONS WITH CORTICOSTEROIDS
Synthesis plan pending
FORMULA:C22H21N5O4

SMILES: COc1cccc(-c2[nH]nc3c2-c2cc(NC(=O)[C@]4(N)CNCCO4)ccc2C3=O)c1

BIRTHDAY: 2018-11-19T08:16:30.532042
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis plan pending
FORMULA:C17H10N6O2

SMILES: O=C1NC(=O)c2c1c1[nH]c3ccccc3c1c1cc3n(c21)NCN=N3

BIRTHDAY: 2018-11-19T08:16:30.542435
ATC: A12A
- ALIMENTARY TRACT AND METABOLISM
- MINERAL SUPPLEMENTS
- CALCIUM
Synthesis plan pending
FORMULA:C19H14N6O2S

SMILES: O=C(Nc1cncs1)c1ccc(NC(=O)c2ccccc2-c2nnc[nH]2)cc1

BIRTHDAY: 2018-11-19T08:16:30.552896
ATC: C03X
- CARDIOVASCULAR SYSTEM
- DIURETICS
- OTHER DIURETICS
Synthesis plan pending
FORMULA:C22H38N6O

SMILES: CC(C)c1cnn2c1CNCCCCC[C@H]1N=CN[C@@]1(N)C(C)(C)C(=O)CCC2

BIRTHDAY: 2018-11-19T08:16:30.562869
ATC: C03C
- CARDIOVASCULAR SYSTEM
- DIURETICS
- HIGH-CEILING DIURETICS
Synthesis plan pending
FORMULA:C24H19F3N6O

SMILES: COc1ccc(-c2c(-c3cncnc3Nc3ccccc3C(F)(F)F)nn3c2C=CCN3)cc1

BIRTHDAY: 2018-11-19T08:16:30.574645
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis plan pending
FORMULA:C21H35N7O

SMILES: CC(C)C[C@]1(N)CCN[C@@H](Nc2cnc(-c3nn([C@@H](C)O)cc3C(C)C)nc2)C1

BIRTHDAY: 2018-11-19T08:16:30.584298
ATC: A10B
- ALIMENTARY TRACT AND METABOLISM
- DRUGS USED IN DIABETES
- BLOOD GLUCOSE LOWERING DRUGS, EXCL. INSULINS
Synthesis plan pending
FORMULA:C20H15Cl3N4O3

SMILES: CCc1nn(-c2cc(Cl)c(Cl)c(Cl)c2)c2c(=O)[nH]c(Cc3cccc(O)c3O)nc12

BIRTHDAY: 2018-11-19T08:16:30.594757
ATC: V09C
- VARIOUS
- DIAGNOSTIC RADIOPHARMACEUTICALS
- RENAL SYSTEM
Synthesis plan pending
FORMULA:C29H31N3O6

SMILES: O=C1NC(=O)c2c1c1c(c3c2[nH]c2ccccc23)[C@]2(CN1)CO[C@@]13CCC[C@@H](CCOCCCO[C@H]2C1)O3

BIRTHDAY: 2018-11-19T08:16:30.616831
ATC: A05B
- ALIMENTARY TRACT AND METABOLISM
- BILE AND LIVER THERAPY
- LIVER THERAPY, LIPOTROPICS
Synthesis plan pending
FORMULA:C16H9N3O2

SMILES: O=C1NC(=O)c2c1c1[nH]ccc1c1c2[nH]c2ccccc21

BIRTHDAY: 2018-11-19T08:16:30.625161
ATC: L01C
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- PLANT ALKALOIDS AND OTHER NATURAL PRODUCTS
Synthesis plan pending
FORMULA:C29H25N7O6

SMILES: COc1ccccc1-c1n[nH]c2c1-c1cc(NC(=O)N(N)C(=O)c3cc(O)ccc3N3CCNCC3=O)ccc1C2=O

BIRTHDAY: 2018-11-19T08:16:30.639334
ATC: B06A
- BLOOD AND BLOOD FORMING ORGANS
- OTHER HEMATOLOGICAL AGENTS
- OTHER HEMATOLOGICAL AGENTS
Synthesis plan pending
FORMULA:C30H29N7O5

SMILES: COc1ccc(-c2n[nH]c3c2C(=O)c2c(NC(=O)NNC(=O)c4cccc(N5CCN(C)CC5)c4O)cccc2-3)cc1

BIRTHDAY: 2018-11-19T08:16:30.652235
ATC: L01D
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- CYTOTOXIC ANTIBIOTICS AND RELATED SUBSTANCES
Synthesis plan pending
FORMULA:C20H19Cl2N5O

SMILES: CN(C)CC(=O)Nc1cccc(-c2ccnc(Nc3ccc(Cl)c(Cl)c3)n2)c1

BIRTHDAY: 2018-11-19T08:16:30.661470
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis plan pending
FORMULA:C22H36N6O

SMILES: CC(C)CCn1cc(-c2ccnc(NC3CCN([C@@H](C)O)CC3)n2)c(C(C)C)n1

BIRTHDAY: 2018-11-19T08:16:30.670623
ATC: H05A
- SYSTEMIC HORMONAL PREPARATIONS, EXCL. SEX HORMONES AND INSULINS
- CALCIUM HOMEOSTASIS
- PARATHYROID HORMONES AND ANALOGUES
Synthesis plan pending
FORMULA:C35H58ClN3OS

SMILES: CN(C)CCCCCCCCCCCCCCCCCCCCCCCNC(=O)c1csc(-c2ccccc2Cl)n1

BIRTHDAY: 2018-11-19T08:16:30.681297
ATC: J01X
- ANTIINFECTIVES FOR SYSTEMIC USE
- ANTIBACTERIALS FOR SYSTEMIC USE
- OTHER ANTIBACTERIALS
Synthesis plan pending
FORMULA:C35H59N3OS

SMILES: Cc1nc(-c2ccccc2)c(C(=O)NCC(C)(C)C(C)(C)C(C)(C)C(C)(C)C(C)(C)C(C)(C)C(C)(C)N(C)C)s1

BIRTHDAY: 2018-11-19T08:16:30.691507
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis plan pending
FORMULA:C29H28N8O5

SMILES: COc1ccccc1-c1[nH]nc2c1-c1cc(NC(=O)N(N)C(=O)c3cccc(O)c3N3CCNC[C@H]3N)ccc1C2=O

BIRTHDAY: 2018-11-19T08:16:30.705814
ATC: B06A
- BLOOD AND BLOOD FORMING ORGANS
- OTHER HEMATOLOGICAL AGENTS
- OTHER HEMATOLOGICAL AGENTS
Synthesis plan pending
FORMULA:C31H63NO3

SMILES: CN(C)CCCCCCCCCCCCCCCCCCCCCCCC1COC(C)(CO)OC1

BIRTHDAY: 2018-11-19T08:16:30.713945
ATC: C10A
- CARDIOVASCULAR SYSTEM
- LIPID MODIFYING AGENTS
- LIPID MODIFYING AGENTS, PLAIN
Synthesis plan pending
FORMULA:C40H69N5O2S

SMILES: CN(C)CCCCCCCCCCCCCCCCCCCCCCCCCCNC(=O)c1nsc(C(N)=O)c1NCc1ccccc1

BIRTHDAY: 2018-11-19T08:16:30.725713
ATC: A12A
- ALIMENTARY TRACT AND METABOLISM
- MINERAL SUPPLEMENTS
- CALCIUM
Synthesis plan pending
FORMULA:C16H22F3N7

SMILES: CC(C)c1cn[nH]c1-c1c(N[C@@]2(N)CCCCN2)ncnc1C(F)(F)F

BIRTHDAY: 2018-11-19T08:16:30.736449
ATC: C01A
- CARDIOVASCULAR SYSTEM
- CARDIAC THERAPY
- CARDIAC GLYCOSIDES
Synthesis plan pending
FORMULA:C21H35N7O

SMILES: CC(C)c1cnn([C@@H](C)C(C)C)c1-c1cncnc1N[C@H]1NCCC[C@]1(N)CO

BIRTHDAY: 2018-11-19T08:16:30.756753
ATC: S01L
- SENSORY ORGANS
- OPHTHALMOLOGICALS
- OCULAR VASCULAR DISORDER AGENTS
Synthesis plan pending
FORMULA:C17H23F3N6

SMILES: CC(C)c1[nH]ncc1-c1nc(NC2CCN(C)CC2)ncc1C(F)(F)F

BIRTHDAY: 2018-11-19T08:16:30.766436
ATC: H01B
- SYSTEMIC HORMONAL PREPARATIONS, EXCL. SEX HORMONES AND INSULINS
- PITUITARY AND HYPOTHALAMIC HORMONES AND ANALOGUES
- POSTERIOR PITUITARY LOBE HORMONES
Synthesis plan pending
FORMULA:C19H14N6O2S

SMILES: O=C(Nc1ccc(C(=O)Nc2nccs2)cc1)c1ccc(-c2nnc[nH]2)cc1

BIRTHDAY: 2018-11-19T08:16:30.776147
ATC: C09A
- CARDIOVASCULAR SYSTEM
- AGENTS ACTING ON THE RENIN-ANGIOTENSIN SYSTEM
- ACE INHIBITORS, PLAIN
Synthesis plan pending
FORMULA:C23H23N5O3

SMILES: COc1ccccc1-c1[nH]nc2c1-c1cc(NC(=O)NN3CCCCC3)ccc1C2=O

BIRTHDAY: 2018-11-19T08:16:30.786533
ATC: G03B
- GENITO URINARY SYSTEM AND SEX HORMONES
- SEX HORMONES AND MODULATORS OF THE GENITAL SYSTEM
- ANDROGENS
Synthesis plan pending
FORMULA:C20H31N7O

SMILES: CC(C)c1cc(-c2nc(NC3CCN(C)CC3)cc(N3CCOCC3)n2)n[nH]1

BIRTHDAY: 2018-11-19T08:16:30.807237
ATC: A01A
- ALIMENTARY TRACT AND METABOLISM
- STOMATOLOGICAL PREPARATIONS
- STOMATOLOGICAL PREPARATIONS
Synthesis plan pending
FORMULA:C27H47N11

SMILES: CC(C)c1cn[nH]c1-c1cncnc1N[C@@H]1CC[C@@](N)([C@@H]2CNCCNC[C@@H]3CC[C@H](C3)NCCN2)CN1

BIRTHDAY: 2018-11-19T08:16:30.819699
ATC: N03A
- NERVOUS SYSTEM
- ANTIEPILEPTICS
- ANTIEPILEPTICS
Synthesis plan pending
FORMULA:C27H50N6O3S

SMILES: CN(C)CCCCCCCCCCCCCCCC(C)(C)CC1=N[C@@]2(N=CN1O)NC(CO)=NSC2=O

BIRTHDAY: 2018-11-19T08:16:30.830551
ATC: N01A
- NERVOUS SYSTEM
- ANESTHETICS
- ANESTHETICS, GENERAL
Synthesis plan pending
FORMULA:C29H25N7O6

SMILES: COc1ccc(-c2n[nH]c3c2C(=O)c2cc(NC(=O)NNC(=O)c4cccc(N5CCNC(=O)C5)c4O)ccc2-3)cc1

BIRTHDAY: 2018-11-19T08:16:30.843818
ATC: L01D
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- CYTOTOXIC ANTIBIOTICS AND RELATED SUBSTANCES
Synthesis plan pending
FORMULA:C22H29N7

SMILES: CC(C)c1c[nH]nc1-c1ncc(N[C@@H]2CC[C@@](N)(Cc3ccccc3)CN2)cn1

BIRTHDAY: 2018-11-19T08:16:30.853191
ATC: N06B
- NERVOUS SYSTEM
- PSYCHOANALEPTICS
- PSYCHOSTIMULANTS, AGENTS USED FOR ADHD AND NOOTROPICS
Synthesis plan pending
FORMULA:C21H34N6O

SMILES: CC(C)Cn1nc(C(C)C)cc1-c1ccnc(NC2CCN(CCO)CC2)n1

BIRTHDAY: 2018-11-19T08:16:30.862042
ATC: H01C
- SYSTEMIC HORMONAL PREPARATIONS, EXCL. SEX HORMONES AND INSULINS
- PITUITARY AND HYPOTHALAMIC HORMONES AND ANALOGUES
- HYPOTHALAMIC HORMONES
Synthesis plan pending
FORMULA:C11H13N5O2

SMILES: C[C@@H]1C=NON1NC(=O)c1ccccc1C(=N)N

BIRTHDAY: 2018-11-19T08:16:30.870200
ATC: L02B
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ENDOCRINE THERAPY
- HORMONE ANTAGONISTS AND RELATED AGENTS
Synthesis plan pending
FORMULA:C19H26N6O2

SMILES: CC(C)c1c(C2=CNOC(=O)N2)nn2ccc(N3C[C@H](C)C[C@@H](C)C3)nc12

BIRTHDAY: 2018-11-19T08:16:30.879634
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis plan pending
FORMULA:C20H15Cl3N4O3

SMILES: CCc1nn(-c2cc(Cl)c(Cl)c(Cl)c2)c2nc(Cc3cccc(O)c3O)[nH]c(=O)c12

BIRTHDAY: 2018-11-19T08:16:30.890321
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis plan pending
FORMULA:C20H28F3N7O

SMILES: CC(C)c1cn(CC(F)(F)F)nc1-c1ncc(N[C@@H]2CCCCN2[C@@H](C)C(N)=O)cn1

BIRTHDAY: 2018-11-19T08:16:30.900989
ATC: R07A
- RESPIRATORY SYSTEM
- OTHER RESPIRATORY SYSTEM PRODUCTS
- OTHER RESPIRATORY SYSTEM PRODUCTS
Synthesis plan pending
FORMULA:C31H61FeN

SMILES: [CH-]=[C-]C(C)(C)C(C)(C)C(C)(C)C(C)(C)C(C)(C)C(C)(C)C(C)(C)C(C)(C)C(C)(C)N(C)C.[Fe+2]

BIRTHDAY: 2018-11-19T08:16:30.908744
ATC: D01A
- DERMATOLOGICALS
- ANTIFUNGALS FOR DERMATOLOGICAL USE
- ANTIFUNGALS FOR TOPICAL USE
Synthesis plan pending
FORMULA:C24H36N8

SMILES: CC(C)c1c(-c2c(N[C@H](C)C(C)C)ncnc2N[C@]2(N)CCCCN2)nn2ccccc12

BIRTHDAY: 2018-11-19T08:16:30.920271
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis plan pending
FORMULA:C24H24N6O4

SMILES: COc1ccccc1-c1[nH]nc2c1-c1cc(NC(=O)[C@]3(N)CCC[C@H](C(N)=O)N3)ccc1C2=O

BIRTHDAY: 2018-11-19T08:16:30.931904
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis plan pending
FORMULA:C20H15Cl3N4O3

SMILES: CCc1c2c(=O)[nH]c(Cc3cccc(O)c3O)nc2nn1-c1cc(Cl)c(Cl)c(Cl)c1

BIRTHDAY: 2018-11-19T08:16:30.942185
ATC: G01A
- GENITO URINARY SYSTEM AND SEX HORMONES
- GYNECOLOGICAL ANTIINFECTIVES AND ANTISEPTICS
- ANTIINFECTIVES AND ANTISEPTICS, EXCL. COMBINATIONS WITH CORTICOSTEROIDS
Synthesis plan pending
FORMULA:C20H26N6O3

SMILES: CC(C)c1[nH]nc2c1C(=O)[C@]1(NC(=O)[C@]3(N)NCCC[C@@H]3C(N)=O)C=CC=C[C@H]21

BIRTHDAY: 2018-11-19T08:16:30.952390
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis plan pending
FORMULA:C21H29N9

SMILES: Cc1cnccc1Nc1nc(-c2[nH]ncc2C(C)C)ncc1N[C@]1(N)CCCCN1

BIRTHDAY: 2018-11-19T08:16:30.962758
ATC: V08D
- VARIOUS
- CONTRAST MEDIA
- ULTRASOUND CONTRAST MEDIA
Synthesis plan pending
FORMULA:C26H41N9

SMILES: CC(C)n1cc(-c2cnc(NC3CCN(C)CC3)nc2-c2cn(C(C)C)nc2C(C)(C)C)c(N)n1

BIRTHDAY: 2018-11-19T08:16:30.973692
ATC: A10B
- ALIMENTARY TRACT AND METABOLISM
- DRUGS USED IN DIABETES
- BLOOD GLUCOSE LOWERING DRUGS, EXCL. INSULINS
Synthesis plan pending
FORMULA:C17H25N7O

SMILES: CC(C)c1cn[nH]c1-c1cnc(N[C@@]23NCCC[C@@H]2CCON3)nc1

BIRTHDAY: 2018-11-19T08:16:30.982871
ATC: D01A
- DERMATOLOGICALS
- ANTIFUNGALS FOR DERMATOLOGICAL USE
- ANTIFUNGALS FOR TOPICAL USE
Synthesis plan pending
FORMULA:C20H28F3N7O

SMILES: CC(C)c1nn(CC(F)(F)F)cc1-c1ccnc(N[C@@H]2CCCN(CCC(N)=O)C2)n1

BIRTHDAY: 2018-11-19T08:16:30.993354
ATC: J05A
- ANTIINFECTIVES FOR SYSTEMIC USE
- ANTIVIRALS FOR SYSTEMIC USE
- DIRECT ACTING ANTIVIRALS
Synthesis plan pending
FORMULA:C26H36ClNS

SMILES: CN(C)CCCCCCCCCCC[C@H]1c2ccccc2Sc2ccc(Cl)cc21

BIRTHDAY: 2018-11-19T08:16:31.001159
ATC: N05A
- NERVOUS SYSTEM
- PSYCHOLEPTICS
- ANTIPSYCHOTICS
Synthesis plan pending
FORMULA:C23H22N4O4

SMILES: COc1ccc(-c2[nH]nc3c2C(=O)c2cccc(NC(=O)CN4CCOCC4)c2-3)cc1

BIRTHDAY: 2018-11-19T08:16:31.010989
ATC: M01A
- MUSCULO-SKELETAL SYSTEM
- ANTIINFLAMMATORY AND ANTIRHEUMATIC PRODUCTS
- ANTIINFLAMMATORY AND ANTIRHEUMATIC PRODUCTS, NON-STEROIDS
Synthesis plan pending
FORMULA:C21H28N8O

SMILES: CC(C)c1c(-c2ncc(N[C@@H]3CC[C@@](N)(CC(N)=O)CN3)cn2)nn2ccccc12

BIRTHDAY: 2018-11-19T08:16:31.032577
ATC: M01A
- MUSCULO-SKELETAL SYSTEM
- ANTIINFLAMMATORY AND ANTIRHEUMATIC PRODUCTS
- ANTIINFLAMMATORY AND ANTIRHEUMATIC PRODUCTS, NON-STEROIDS
Synthesis plan pending
FORMULA:C43H46N10O2

SMILES: CN(C)CCCCc1cccc(Nc2ncc3c(n2)-c2c(c(-c4c5cccc4Nc4nccc(n4)-c4ccnc(c4)OCCC=CCOC5)nn2C)CC3)c1

BIRTHDAY: 2018-11-19T08:16:31.048490
ATC: V09X
- VARIOUS
- DIAGNOSTIC RADIOPHARMACEUTICALS
- OTHER DIAGNOSTIC RADIOPHARMACEUTICALS
Synthesis plan pending
FORMULA:C34H66O3

SMILES: CCCCCCCCCCCCCCCCCCCCCCCCCCCCCCC1COC(=O)OC1

BIRTHDAY: 2018-11-19T08:16:31.056547
ATC: A12A
- ALIMENTARY TRACT AND METABOLISM
- MINERAL SUPPLEMENTS
- CALCIUM
Synthesis plan pending
FORMULA:C24H17F3N6O

SMILES: COc1ccccc1-c1nn2ncccc2c1-c1ccnc(Nc2ccc(C(F)(F)F)cc2)n1

BIRTHDAY: 2018-11-19T08:16:31.067767
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis plan pending
FORMULA:C21H28N8O

SMILES: CC(C)c1c(-c2ncc(N[C@H]3CC[C@](N)(CC(N)=O)CN3)cn2)nn2ccccc12

BIRTHDAY: 2018-11-19T08:16:31.077872
ATC: M01A
- MUSCULO-SKELETAL SYSTEM
- ANTIINFLAMMATORY AND ANTIRHEUMATIC PRODUCTS
- ANTIINFLAMMATORY AND ANTIRHEUMATIC PRODUCTS, NON-STEROIDS
Synthesis plan pending
FORMULA:C21H29N9

SMILES: Cc1cnccc1Nc1nc(-c2[nH]ncc2C(C)C)ncc1N[C@@]1(N)CCCCN1

BIRTHDAY: 2018-11-19T08:16:31.088298
ATC: V08D
- VARIOUS
- CONTRAST MEDIA
- ULTRASOUND CONTRAST MEDIA
Synthesis plan pending
FORMULA:C16H17F2N5O

SMILES: CN(C)CC(=O)Nc1[nH]nc2c1CNC(c1ccc(F)c(F)c1)=C2

BIRTHDAY: 2018-11-19T08:16:31.096943
ATC: N06A
- NERVOUS SYSTEM
- PSYCHOANALEPTICS
- ANTIDEPRESSANTS
Synthesis plan pending
FORMULA:C21H35N7O

SMILES: CC(C)c1cnn([C@@H](C)C(C)C)c1-c1ncc(N[C@H]2NCCC[C@]2(N)CO)cn1

BIRTHDAY: 2018-11-19T08:16:31.106988
ATC: J05A
- ANTIINFECTIVES FOR SYSTEMIC USE
- ANTIVIRALS FOR SYSTEMIC USE
- DIRECT ACTING ANTIVIRALS
Synthesis plan pending
FORMULA:C25H35N9O

SMILES: Cc1cc(Nc2nc(NC3CCN(C)CC3)ncc2-c2cc(C(C)C)[nH]n2)ncc1C(=O)N(C)C

BIRTHDAY: 2018-11-19T08:16:31.118435
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis plan pending
FORMULA:C40H68FN3

SMILES: CN(Cc1ccccc1F)C(C)(C)C(C)(C)C(C)(C)C(C)(C)C(C)(C)C(C)(C)C(C)(C)C(C)(C)C(C)(C)Nc1cccnc1

BIRTHDAY: 2018-11-19T08:16:31.129120
ATC: C08C
- CARDIOVASCULAR SYSTEM
- CALCIUM CHANNEL BLOCKERS
- SELECTIVE CALCIUM CHANNEL BLOCKERS WITH MAINLY VASCULAR EFFECTS
Synthesis plan pending
FORMULA:C20H26N6O3

SMILES: CC(C)c1n[nH]c2c1[C@@H]1C=CC=C[C@@]1(NC(=O)[C@]1(N)C[C@H](C(N)=O)CCN1)C2=O

BIRTHDAY: 2018-11-19T08:16:31.140441
ATC: J01F
- ANTIINFECTIVES FOR SYSTEMIC USE
- ANTIBACTERIALS FOR SYSTEMIC USE
- MACROLIDES, LINCOSAMIDES AND STREPTOGRAMINS
Synthesis plan pending
FORMULA:C23H29FN8O2

SMILES: CC(C)c1c(-c2ncc(N[C@@H]3C[C@](N)(CO)CCN3)cn2)nn2c1C(=O)N[C@@H]1C=CC=C[C@]12F

BIRTHDAY: 2018-11-19T08:16:31.152344
ATC: J05A
- ANTIINFECTIVES FOR SYSTEMIC USE
- ANTIVIRALS FOR SYSTEMIC USE
- DIRECT ACTING ANTIVIRALS
Synthesis plan pending
FORMULA:C37H63N3OS

SMILES: CN(C)CCCCCCCCCCCCCCCCCCCCCCCCCNC(=O)c1nc(-c2ccccc2)cs1

BIRTHDAY: 2018-11-19T08:16:31.162200
ATC: N06A
- NERVOUS SYSTEM
- PSYCHOANALEPTICS
- ANTIDEPRESSANTS
Synthesis plan pending
FORMULA:C38H54N6O

SMILES: CN(C)C(C)(C)C(C)(C)C(C)(C)[C@@]1(C)[C@@H]2CCN1CCc1cc(cc3[nH]ncc13)Oc1cc(cc3ccccc13)CNCCN2

BIRTHDAY: 2018-11-19T08:16:31.174753
ATC: B01A
- BLOOD AND BLOOD FORMING ORGANS
- ANTITHROMBOTIC AGENTS
- ANTITHROMBOTIC AGENTS
Synthesis plan pending
FORMULA:C20H15Cl3N4O3

SMILES: CCc1nn(-c2c(Cl)cc(Cl)cc2Cl)c2nc(Cc3ccc(O)c(O)c3)[nH]c(=O)c12

BIRTHDAY: 2018-11-19T08:16:31.185538
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis plan pending
FORMULA:C20H26N6O3

SMILES: CC(C)c1n[nH]c2c1[C@H]1C=CC=C[C@@]1(NC(=O)[C@]1(N)CCC[C@@H](C(N)=O)N1)C2=O

BIRTHDAY: 2018-11-19T08:16:31.195689
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:C16H23N5O2

SMILES: CC(C)c1n[nH]c2[nH]cc(C(=O)NC3CCN(C)CC3)c(=O)c12

BIRTHDAY: 2018-11-19T08:16:31.204075
ATC: M01C
- MUSCULO-SKELETAL SYSTEM
- ANTIINFLAMMATORY AND ANTIRHEUMATIC PRODUCTS
- SPECIFIC ANTIRHEUMATIC AGENTS
Synthesis plan pending
FORMULA:C16H8N2O2S

SMILES: O=C1NC(=O)c2c1c1ccsc1c1c2[nH]c2ccccc21

BIRTHDAY: 2018-11-19T08:16:31.212424
ATC: C10A
- CARDIOVASCULAR SYSTEM
- LIPID MODIFYING AGENTS
- LIPID MODIFYING AGENTS, PLAIN
Synthesis plan pending
FORMULA:C20H28N8

SMILES: Cc1n[nH]c(-c2cncnc2N[C@@]23NC=CNCC=C2CCCN3)c1C(C)C

BIRTHDAY: 2018-11-30T17:24:38.728766
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C22H30N8O

SMILES: CN(C)C(C)(C)Cc1ccccc1Nc1ncnc2c1[C@@]1(N)NN=C[C@]1(C(N)=O)CC2

BIRTHDAY: 2018-11-30T17:24:38.739141
ATC: C03A
- CARDIOVASCULAR SYSTEM
- DIURETICS
- LOW-CEILING DIURETICS, THIAZIDES
Synthesis Plan
FORMULA:C20H31N7O

SMILES: COC1(Nc2ncnc3c2N=C[C@@H]2C=NN[C@@]32N)CCCCCCCCCC1

BIRTHDAY: 2018-11-30T17:24:38.748597
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C23H16ClF3N6O2

SMILES: CCc1ccnn1-c1cc(Cl)c2c(c1)C(=O)Nc1c(Nc3ccc(C(F)(F)F)cc3)ncnc1O2

BIRTHDAY: 2018-11-30T17:24:38.770073
ATC: M01A
- MUSCULO-SKELETAL SYSTEM
- ANTIINFLAMMATORY AND ANTIRHEUMATIC PRODUCTS
- ANTIINFLAMMATORY AND ANTIRHEUMATIC PRODUCTS, NON-STEROIDS
Synthesis Plan
FORMULA:C22H29N7

SMILES: CC(C)c1c[nH]nc1-c1ncc(N[C@@H]2NCCC[C@@]2(N)Cc2ccccc2)cn1

BIRTHDAY: 2018-11-30T17:24:38.779489
ATC: N06B
- NERVOUS SYSTEM
- PSYCHOANALEPTICS
- PSYCHOSTIMULANTS, AGENTS USED FOR ADHD AND NOOTROPICS
Synthesis Plan
FORMULA:C16H11N3O2

SMILES: O=C1NC(=O)c2c1c1c(c3[nH]c4ccccc4c23)NCC1

BIRTHDAY: 2018-11-30T17:24:38.797416
ATC: L01C
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- PLANT ALKALOIDS AND OTHER NATURAL PRODUCTS
Synthesis Plan
FORMULA:C26H32N6O2

SMILES: CN(C)CC(=O)N1CCCC[C@@H]1c1cccc([C@H]2C=CCCC2)c1NC(=O)c1cnc(C#N)[nH]1

BIRTHDAY: 2018-11-30T17:24:38.809830
ATC: C03B
- CARDIOVASCULAR SYSTEM
- DIURETICS
- LOW-CEILING DIURETICS, EXCL. THIAZIDES
Synthesis Plan
FORMULA:C36H61NO6

SMILES: CCC1(CCCCCCCCCCCCCCCCCCCCCCN(C)C)C(=O)OC(c2ccc(O)cc2O)OC1=O

BIRTHDAY: 2018-11-30T17:24:38.842698
ATC: N02A
- NERVOUS SYSTEM
- ANALGESICS
- OPIOIDS
Synthesis Plan
FORMULA:C19H14N6O2S

SMILES: O=C(Nc1cccc(C(=O)Nc2cncs2)c1)c1cccc(-c2nnc[nH]2)c1

BIRTHDAY: 2018-11-30T17:24:38.852718
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C21H28N8O

SMILES: CC(C)c1c(-c2ncc(N[C@H]3NCCC[C@]3(N)CC(N)=O)cn2)nn2ccccc12

BIRTHDAY: 2018-11-30T17:24:38.874580
ATC: M01A
- MUSCULO-SKELETAL SYSTEM
- ANTIINFLAMMATORY AND ANTIRHEUMATIC PRODUCTS
- ANTIINFLAMMATORY AND ANTIRHEUMATIC PRODUCTS, NON-STEROIDS
Synthesis Plan
FORMULA:C24H32N10O

SMILES: CC(C)c1cc(-c2cc(-n3ncc4cnn(C(C)C)c4c3=O)nc(NC3CCN(C)CC3)n2)[nH]n1

BIRTHDAY: 2018-11-30T17:24:38.886382
ATC: H01C
- SYSTEMIC HORMONAL PREPARATIONS, EXCL. SEX HORMONES AND INSULINS
- PITUITARY AND HYPOTHALAMIC HORMONES AND ANALOGUES
- HYPOTHALAMIC HORMONES
Synthesis Plan
FORMULA:C20H29N7

SMILES: CCn1cc(-c2ccnc(N[C@@H]3CCN4CCN=C[C@@H]4C3)n2)c(C(C)C)n1

BIRTHDAY: 2018-11-30T17:24:38.896139
ATC: A01A
- ALIMENTARY TRACT AND METABOLISM
- STOMATOLOGICAL PREPARATIONS
- STOMATOLOGICAL PREPARATIONS
Synthesis Plan
FORMULA:C42H72ClN5

SMILES: CN(C)C(C)(C)C(C)(C)C(C)(C)C(C)(C)C(C)(C)C(C)(C)C(C)(C)C(C)(C)C(C)(C)CNc1ncnc2c1N(c1ccccc1Cl)CC2

BIRTHDAY: 2018-12-02T16:07:47.812464
ATC: R05D
- RESPIRATORY SYSTEM
- COUGH AND COLD PREPARATIONS
- COUGH SUPPRESSANTS, EXCL. COMBINATIONS WITH EXPECTORANTS
Synthesis Plan
FORMULA:C38H64ClN3OS

SMILES: CN(C)CCCCCCCCCCCCCCCCCCCCCCCCCCNC(=O)c1csc(-c2ccccc2Cl)n1

BIRTHDAY: 2018-12-02T16:07:47.844617
ATC: J01X
- ANTIINFECTIVES FOR SYSTEMIC USE
- ANTIBACTERIALS FOR SYSTEMIC USE
- OTHER ANTIBACTERIALS
Synthesis Plan
FORMULA:C18H15N7O2

SMILES: O=C(Nc1[nH]ncc1Cc1ccccc1)c1cnoc1Nc1cncnc1

BIRTHDAY: 2018-12-02T16:07:47.864787
ATC: G03B
- GENITO URINARY SYSTEM AND SEX HORMONES
- SEX HORMONES AND MODULATORS OF THE GENITAL SYSTEM
- ANDROGENS
Synthesis Plan
FORMULA:C22H36N6O

SMILES: CC(C)c1cn([C@H](C)O)nc1-c1cncnc1N[C@H]1CCCCN1[C@@H](C)C(C)C

BIRTHDAY: 2018-12-02T16:07:47.874229
ATC: A02B
- ALIMENTARY TRACT AND METABOLISM
- DRUGS FOR ACID RELATED DISORDERS
- DRUGS FOR PEPTIC ULCER AND GASTRO-OESOPHAGEAL REFLUX DISEASE (GORD)
Synthesis Plan
FORMULA:C20H16N4O3S

SMILES: O=C1NCC[C@]2(CS1)Cc1c3c(c4c([nH]c5ccccc54)c1N2)C(=O)NC3=O

BIRTHDAY: 2018-12-02T16:07:47.915513
ATC: N06D
- NERVOUS SYSTEM
- PSYCHOANALEPTICS
- ANTI-DEMENTIA DRUGS
Synthesis Plan
FORMULA:C22H29N7

SMILES: CC(C)c1c[nH]nc1-c1ncc(N[C@H]2CCC[C@](N)(Cc3ccccc3)N2)cn1

BIRTHDAY: 2018-12-02T16:07:47.933070
ATC: N06B
- NERVOUS SYSTEM
- PSYCHOANALEPTICS
- PSYCHOSTIMULANTS, AGENTS USED FOR ADHD AND NOOTROPICS
Synthesis Plan
FORMULA:C29H28N8O5

SMILES: COc1ccccc1-c1n[nH]c2c1-c1cc(NC(=O)N(N)C(=O)c3cccc(O)c3N3CCNC[C@H]3N)ccc1C2=O

BIRTHDAY: 2018-12-02T16:07:47.946824
ATC: B06A
- BLOOD AND BLOOD FORMING ORGANS
- OTHER HEMATOLOGICAL AGENTS
- OTHER HEMATOLOGICAL AGENTS
Synthesis Plan
FORMULA:C34H70N2O5

SMILES: CN(C)CCCCCCCCCCCCCCCCCCCCCCN[C@@H]1COCCOCCOCCOCCO1

BIRTHDAY: 2018-12-02T16:07:47.956636
ATC: N06A
- NERVOUS SYSTEM
- PSYCHOANALEPTICS
- ANTIDEPRESSANTS
Synthesis Plan
FORMULA:C24H22N8

SMILES: N#Cc1ccccc1-c1cn[nH]c1-c1ncc(Nc2ccccc2[C@]2(N)CCCN2)cn1

BIRTHDAY: 2018-12-03T10:44:09.154803
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C24H36N8

SMILES: CC(C)c1c(-c2c(N[C@H](C)C(C)C)ncnc2N[C@@]2(N)CCCCN2)nn2ccccc12

BIRTHDAY: 2018-12-03T10:44:09.166331
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C29H28N8O5

SMILES: COc1ccccc1-c1[nH]nc2c1-c1cc(NC(=O)N(N)C(=O)c3cc(O)cc(N4CCNC[C@H]4N)c3)ccc1C2=O

BIRTHDAY: 2018-12-03T10:44:09.190543
ATC: C03D
- CARDIOVASCULAR SYSTEM
- DIURETICS
- POTASSIUM-SPARING AGENTS
Synthesis Plan
FORMULA:C22H21N5O2

SMILES: O=C1NC(=O)c2c1c1c(c3[nH]c4ccccc4c23)N[C@@]2(C1)NC[C@@H]1CNC[C@@H]2C1

BIRTHDAY: 2018-12-03T10:44:09.210623
ATC: L01C
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- PLANT ALKALOIDS AND OTHER NATURAL PRODUCTS
Synthesis Plan
FORMULA:C22H29N7O

SMILES: CC(C)c1nn2ccccc2c1-c1ccnc(NC2CCN(CCC(N)=O)CC2)n1

BIRTHDAY: 2018-12-03T10:44:09.220206
ATC: H01C
- SYSTEMIC HORMONAL PREPARATIONS, EXCL. SEX HORMONES AND INSULINS
- PITUITARY AND HYPOTHALAMIC HORMONES AND ANALOGUES
- HYPOTHALAMIC HORMONES
Synthesis Plan
FORMULA:C25H19N5O6

SMILES: COc1ccccc1-c1[nH]nc2c1-c1cc(NC(=O)N(N)C(=O)c3c(O)cccc3O)ccc1C2=O

BIRTHDAY: 2018-12-03T10:44:09.232282
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C23H29N7O

SMILES: CN(C)CCCCc1cccc(Nc2ncc3c(n2)-c2c(c(C(N)=O)nn2C)CC3)c1

BIRTHDAY: 2018-12-03T10:44:09.252665
ATC: N04B
- NERVOUS SYSTEM
- ANTI-PARKINSON DRUGS
- DOPAMINERGIC AGENTS
Synthesis Plan
FORMULA:C21H35N7

SMILES: CC(C)c1cc(-c2cc(NC3CCN(C)CC3)nc(N[C@@H](C)C(C)C)n2)n[nH]1

BIRTHDAY: 2018-12-03T10:44:09.271552
ATC: J05A
- ANTIINFECTIVES FOR SYSTEMIC USE
- ANTIVIRALS FOR SYSTEMIC USE
- DIRECT ACTING ANTIVIRALS
Synthesis Plan
FORMULA:C23H43NOS2

SMILES: CC1=C(C)C(=O)S[C@H](CCCCCCCCCCCCCCN(C)C)SC1

BIRTHDAY: 2018-12-03T10:44:09.278884
ATC: R05C
- RESPIRATORY SYSTEM
- COUGH AND COLD PREPARATIONS
- EXPECTORANTS, EXCL. COMBINATIONS WITH COUGH SUPPRESSANTS
Synthesis Plan
FORMULA:C43H75N3O4S

SMILES: CN(C)CCCCCCCCCCCCCCCCCCCCCCCCCNC(=O)c1csc([C@@H]2C[C@H]3C=COCC=CCOC[C@@H](C2)O3)n1

BIRTHDAY: 2018-12-03T19:12:34.877523
ATC: C02C
- CARDIOVASCULAR SYSTEM
- ANTIHYPERTENSIVES
- ANTIADRENERGIC AGENTS, PERIPHERALLY ACTING
Synthesis Plan
FORMULA:C14H15N3O

SMILES: O=C1NN[C@H]2C=CC=C[C@H]2N1Cc1ccccc1

BIRTHDAY: 2018-12-03T19:12:34.884880
ATC: B05A
- BLOOD AND BLOOD FORMING ORGANS
- BLOOD SUBSTITUTES AND PERFUSION SOLUTIONS
- BLOOD AND RELATED PRODUCTS
Synthesis Plan
FORMULA:C25H23N7

SMILES: N#Cc1cccc(-c2[nH]ncc2-c2ccnc(Nc3ccc(CN4CCCC4)cc3)n2)c1

BIRTHDAY: 2018-12-03T19:12:34.894917
ATC: B01A
- BLOOD AND BLOOD FORMING ORGANS
- ANTITHROMBOTIC AGENTS
- ANTITHROMBOTIC AGENTS
Synthesis Plan
FORMULA:C37H62ClN3OS

SMILES: CN(C)C(C)(C)C(C)(C)C(C)(C)C(C)(C)C(C)(C)C(C)(C)C(C)(C)C(C)(C)CNC(=O)c1scnc1-c1cccc(Cl)c1

BIRTHDAY: 2018-12-03T19:12:34.936738
ATC: N05B
- NERVOUS SYSTEM
- PSYCHOLEPTICS
- ANXIOLYTICS
Synthesis Plan
FORMULA:C36H60ClN3OS

SMILES: C[C@@H](CCCCCCCN(C)C)[C@@H](C)[C@@H](C)CC(C)(C)CCC(C)(C)CCNC(=O)c1nc(-c2ccccc2Cl)cs1

BIRTHDAY: 2018-12-03T19:12:34.959094
ATC: D04A
- DERMATOLOGICALS
- ANTIPRURITICS, INCL. ANTIHISTAMINES, ANESTHETICS, ETC.
- ANTIPRURITICS, INCL. ANTIHISTAMINES, ANESTHETICS, ETC.
Synthesis Plan
FORMULA:C26H24F3N5OS

SMILES: COc1cccc(-c2c(-c3cnc(Nc4ccccc4C(F)(F)F)nc3)nn3c2CCSCCC3)c1

BIRTHDAY: 2018-12-03T19:12:34.970479
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C35H58ClN3OS

SMILES: C[C@H](NC(=O)c1scnc1-c1cccc(Cl)c1)C(C)(C)C(C)(C)C(C)(C)C(C)(C)C(C)(C)C(C)(C)C(C)(C)N(C)C

BIRTHDAY: 2018-12-03T19:12:34.980939
ATC: C03A
- CARDIOVASCULAR SYSTEM
- DIURETICS
- LOW-CEILING DIURETICS, THIAZIDES
Synthesis Plan
FORMULA:C22H37N7

SMILES: CC(C)Nc1nc(NC2CCN(C)CC2)cc(-c2c(C(C)C)cnn2C(C)C)n1

BIRTHDAY: 2018-12-03T19:12:34.990166
ATC: A11H
- ALIMENTARY TRACT AND METABOLISM
- VITAMINS
- OTHER PLAIN VITAMIN PREPARATIONS
Synthesis Plan
FORMULA:C37H62ClN3OS

SMILES: CN(C)CCCCCCCCCCCCCCCCCCCCCCCCCNC(=O)c1nc(-c2ccccc2Cl)cs1

BIRTHDAY: 2018-12-03T19:12:35.011956
ATC: N06A
- NERVOUS SYSTEM
- PSYCHOANALEPTICS
- ANTIDEPRESSANTS
Synthesis Plan
FORMULA:C33H63NO2

SMILES: CCCCCCCCCCCCCCCCCCCCCCCCCCCCCCc1cc(=O)[nH]o1

BIRTHDAY: 2018-12-03T19:12:35.019872
ATC: S02A
- SENSORY ORGANS
- OTOLOGICALS
- ANTIINFECTIVES
Synthesis Plan
FORMULA:C41H83NO3

SMILES: CC(C)(C[C@@H](N)CO)OC(=O)C(C)(C)C(C)(C)C(C)(C)C(C)(C)C(C)(C)C(C)(C)C(C)(C)C(C)(C)C(C)(C)C(C)(C)C(C)(C)C

BIRTHDAY: 2018-12-03T19:12:35.029534
ATC: J05A
- ANTIINFECTIVES FOR SYSTEMIC USE
- ANTIVIRALS FOR SYSTEMIC USE
- DIRECT ACTING ANTIVIRALS
Synthesis Plan
FORMULA:C22H29N7

SMILES: CC(C)c1c[nH]nc1-c1ncc(N[C@H]2NCCC[C@@]2(N)Cc2ccccc2)cn1

BIRTHDAY: 2018-12-03T19:12:35.039093
ATC: N06B
- NERVOUS SYSTEM
- PSYCHOANALEPTICS
- PSYCHOSTIMULANTS, AGENTS USED FOR ADHD AND NOOTROPICS
Synthesis Plan
FORMULA:C26H33N7

SMILES: CC(C)c1cc(-c2ncc(N[C@@H]3NCCC[C@@]34N[C@@H]3CC=C[C@]5(C=CC=C[C@@H]54)C3)cn2)n[nH]1

BIRTHDAY: 2018-12-03T19:12:35.049527
ATC: J05A
- ANTIINFECTIVES FOR SYSTEMIC USE
- ANTIVIRALS FOR SYSTEMIC USE
- DIRECT ACTING ANTIVIRALS
Synthesis Plan
FORMULA:C38H65N5O2S

SMILES: CN(C)CCCCCCCCCCCCCCCCCCCCCCCCNC(=O)c1nsc(C(N)=O)c1NCc1ccccc1

BIRTHDAY: 2018-12-03T19:12:35.071075
ATC: A12A
- ALIMENTARY TRACT AND METABOLISM
- MINERAL SUPPLEMENTS
- CALCIUM
Synthesis Plan
FORMULA:C16H14BrN5

SMILES: Brc1ccccc1Nc1cncnc1NCc1ccccn1

BIRTHDAY: 2018-12-01T22:31:40.065978
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C35H61NO6

SMILES: CN(C)C(C)(C)C(C)(C)C(C)(C)C(C)(C)C(C)(C)C(C)(C)C(C)(C)C(C)(C)C[C@@]12C=CC=C(O)[C@@]1(O)OC(=O)OC2=O

BIRTHDAY: 2018-12-01T22:31:40.076764
ATC: D01A
- DERMATOLOGICALS
- ANTIFUNGALS FOR DERMATOLOGICAL USE
- ANTIFUNGALS FOR TOPICAL USE
Synthesis Plan
FORMULA:C22H26F3N7O

SMILES: CN(C)CC(=O)N1CC[C@@H]2C=CC=C(Nc3cnc(C(F)(F)F)nc3-c3cnn(C)c3)[C@H]2C1

BIRTHDAY: 2018-12-01T22:31:40.088251
ATC: L01C
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- PLANT ALKALOIDS AND OTHER NATURAL PRODUCTS
Synthesis Plan
FORMULA:C22H29N7

SMILES: CC(C)c1c[nH]nc1-c1cncnc1N[C@H]1CC[C@](N)(Cc2ccccc2)CN1

BIRTHDAY: 2018-12-01T22:31:40.109079
ATC: N06B
- NERVOUS SYSTEM
- PSYCHOANALEPTICS
- PSYCHOSTIMULANTS, AGENTS USED FOR ADHD AND NOOTROPICS
Synthesis Plan
FORMULA:C24H19F3N6O

SMILES: COc1cccc(-c2c(-c3cncnc3Nc3ccccc3C(F)(F)F)nn3c2C=CCN3)c1

BIRTHDAY: 2018-12-01T22:31:40.120250
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C23H14F4N6

SMILES: Fc1ccc(-c2nn3ncccc3c2-c2ccnc(Nc3ccc(C(F)(F)F)cc3)n2)cc1

BIRTHDAY: 2018-12-01T22:31:40.131277
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C35H32ClN7

SMILES: CC(C)c1cc([C@@H]2Nc3cnc4cccc(c4n3)-c3cc4c([nH]3)[C@H](CNC4)Cc3ccccc32)n(-c2ccc(Cl)cc2)n1

BIRTHDAY: 2018-12-01T22:31:40.144098
ATC: N06A
- NERVOUS SYSTEM
- PSYCHOANALEPTICS
- ANTIDEPRESSANTS
Synthesis Plan
FORMULA:C20H29N9

SMILES: CC(C)c1[nH]ncc1-c1cc(-c2cnn(C)c2N)nc(NC2CCN(C)CC2)n1

BIRTHDAY: 2018-12-01T22:31:40.165252
ATC: J01C
- ANTIINFECTIVES FOR SYSTEMIC USE
- ANTIBACTERIALS FOR SYSTEMIC USE
- BETA-LACTAM ANTIBACTERIALS, PENICILLINS
Synthesis Plan
FORMULA:C23H24FN7O2

SMILES: Nc1ncc(-c2ccccc2F)nc1C(=O)Nc1cnccc1N1[C@@H]2COC[C@@H]1CC(N)C2

BIRTHDAY: 2018-12-01T22:31:40.176815
ATC: M01A
- MUSCULO-SKELETAL SYSTEM
- ANTIINFLAMMATORY AND ANTIRHEUMATIC PRODUCTS
- ANTIINFLAMMATORY AND ANTIRHEUMATIC PRODUCTS, NON-STEROIDS
Synthesis Plan
FORMULA:C20H19FN6O2

SMILES: Cc1noc(-c2ccc(-c3cccc4c(NC(=O)CN(C)C)cnn34)c(F)c2)n1

BIRTHDAY: 2018-12-01T22:31:40.186598
ATC: N07C
- NERVOUS SYSTEM
- OTHER NERVOUS SYSTEM DRUGS
- ANTIVERTIGO PREPARATIONS
Synthesis Plan
FORMULA:C18H15N3O2S

SMILES: Cc1cccc(C(=O)Nc2ccccc2C(=O)Nc2cscn2)c1

BIRTHDAY: 2018-12-01T22:31:40.195384
ATC: P02C
- ANTIPARASITIC PRODUCTS, INSECTICIDES AND REPELLENTS
- ANTHELMINTICS
- ANTINEMATODAL AGENTS
Synthesis Plan
FORMULA:C26H27N5O2

SMILES: C[C@@]12C=CC=C[C@@]1(C#N)N1CCN2CC(=O)NCc2cccc(c2)Oc2cccc(c2)[C@@H]1N

BIRTHDAY: 2018-12-01T22:31:40.205939
ATC: N01A
- NERVOUS SYSTEM
- ANESTHETICS
- ANESTHETICS, GENERAL
Synthesis Plan
FORMULA:C38H64ClN3OS

SMILES: C[C@H](NC(=O)c1scnc1-c1cccc(Cl)c1)C(C)(C)C(C)(C)C(C)(C)C(C)(C)C(C)(C)C(C)(C)C(C)(C)C(C)(C)N(C)C

BIRTHDAY: 2018-12-01T22:31:40.224951
ATC: C03A
- CARDIOVASCULAR SYSTEM
- DIURETICS
- LOW-CEILING DIURETICS, THIAZIDES
Synthesis Plan
FORMULA:C21H35N7O

SMILES: CC(C)Nc1nc(NC2CCN(C)CC2)cc(-c2cc(C(C)C)nn2CCO)n1

BIRTHDAY: 2018-12-01T22:31:40.235115
ATC: A10B
- ALIMENTARY TRACT AND METABOLISM
- DRUGS USED IN DIABETES
- BLOOD GLUCOSE LOWERING DRUGS, EXCL. INSULINS
Synthesis Plan
FORMULA:C39H76O4

SMILES: CCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCC(=O)OCCCC(=O)OC

BIRTHDAY: 2018-12-01T22:31:40.244790
ATC: V03A
- VARIOUS
- ALL OTHER THERAPEUTIC PRODUCTS
- ALL OTHER THERAPEUTIC PRODUCTS
Synthesis Plan
FORMULA:C22H30N8

SMILES: Cc1ccc(Nc2cc(-c3cc(C(C)C)[nH]n3)nc(NC3CCN(C)CC3)n2)nc1

BIRTHDAY: 2018-12-01T22:31:40.255086
ATC: L01D
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- CYTOTOXIC ANTIBIOTICS AND RELATED SUBSTANCES
Synthesis Plan