matter.farm

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

These compounds may interact with:

G1/S-specific cyclin-E1

Potentially involved in: urinary bladder cancer; cancer; facial dermatosis; chronic endophthalmitis; phlyctenulosis; rosacea; bladder neoplasm; medulloblastoma; ovarian neoplasm; mammary neoplasms; liver carcinoma; adrenocortical carcinoma; breast cancer; intraductal papillary-mucinous neoplasm (ipmn); lung adenocarcinoma; lung cancer; non-small cell lung cancer; osteosarcoma; ovarian cancer; psoriasis

Disease data sourced from Pharos.

Unknown Action

FORMULA:C19H24Cl2N6O

SMILES: CC(C)[C@@H](CO)Nc1nc(Nc2cc(Cl)cc(Cl)c2)c2ncn(C(C)C)c2n1

BIRTHDAY: 2018-12-01T14:11:34.561510
ATC: L04A
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- IMMUNOSUPPRESSANTS
- IMMUNOSUPPRESSANTS
Synthesis Plan
FORMULA:C26H34N8

SMILES: CC(C)N1C=N[C@]2(NCc3ccccc3-c3ccncc3)N=CN=C[C@]12NC1(N)CCCCC1

BIRTHDAY: 2018-12-01T14:11:34.573504
ATC: G02A
- GENITO URINARY SYSTEM AND SEX HORMONES
- OTHER GYNECOLOGICALS
- UTEROTONICS
Synthesis Plan
FORMULA:C24H17F3N6O

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

BIRTHDAY: 2018-12-01T14:11:34.584669
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C15H17F3N4O

SMILES: CC(C)(C)c1c[nH]nc1NC(=O)Nc1ccccc1C(F)(F)F

BIRTHDAY: 2018-12-01T14:11:34.593546
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C15H22N4O2S

SMILES: Cc1nc(NC(=O)C(C)(C)C)sc1-c1noc(C(C)(C)C)n1

BIRTHDAY: 2018-12-01T14:11:34.613500
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C26H34N8

SMILES: CC(C)N1C=N[C@@]2(NCc3ccccc3-c3ccncc3)N=CN=C[C@@]12NC1(N)CCCCC1

BIRTHDAY: 2018-12-01T14:11:34.636398
ATC: G02A
- GENITO URINARY SYSTEM AND SEX HORMONES
- OTHER GYNECOLOGICALS
- UTEROTONICS
Synthesis Plan
FORMULA:C20H20F6N6

SMILES: CC(C)(C)c1cc(Nc2nc(NCc3ccccc3C(F)(F)F)cc(C(F)(F)F)n2)[nH]n1

BIRTHDAY: 2018-12-01T14:11:34.647302
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: 2018-12-01T14:11:34.658735
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C14H16Cl2N4O

SMILES: CC(C)(C)c1c[nH]nc1NC(=O)Nc1cc(Cl)cc(Cl)c1

BIRTHDAY: 2018-12-01T14:11:34.666876
ATC: D11A
- DERMATOLOGICALS
- OTHER DERMATOLOGICAL PREPARATIONS
- OTHER DERMATOLOGICAL PREPARATIONS
Synthesis Plan
FORMULA:C19H27N7O

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

BIRTHDAY: 2018-12-01T14:11:34.676265
ATC: L01A
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- ALKYLATING AGENTS
Synthesis Plan
FORMULA:C24H19F3N6O

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

BIRTHDAY: 2018-12-01T14:11:34.687465
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C26H32N8

SMILES: CC(C)n1cnc2c(NCc3cccc(-c4cccnc4)c3)nc(N[C@@H]3CCCC[C@H]3N)nc21

BIRTHDAY: 2018-12-01T14:11:34.698010
ATC: C08C
- CARDIOVASCULAR SYSTEM
- CALCIUM CHANNEL BLOCKERS
- SELECTIVE CALCIUM CHANNEL BLOCKERS WITH MAINLY VASCULAR EFFECTS
Synthesis Plan
FORMULA:C19H27N7O

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

BIRTHDAY: 2018-12-01T14:11:34.707435
ATC: L01A
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- ALKYLATING AGENTS
Synthesis Plan
FORMULA:C20H20N8OS

SMILES: Cc1cnccc1-c1sc(C(=O)Nc2[nH]ncc2C(C)C)nc1Nc1ncccn1

BIRTHDAY: 2018-12-25T02:03:37.513928
ATC: V10A
- VARIOUS
- THERAPEUTIC RADIOPHARMACEUTICALS
- ANTIINFLAMMATORY AGENTS
Synthesis Plan
FORMULA:C26H34N8

SMILES: CC(C)N1C=N[C@]2(NCc3ccccc3-c3ccncc3)N=CN=C[C@@]12NC1(N)CCCCC1

BIRTHDAY: 2018-12-25T02:03:37.525706
ATC: G02A
- GENITO URINARY SYSTEM AND SEX HORMONES
- OTHER GYNECOLOGICALS
- UTEROTONICS
Synthesis Plan
FORMULA:C13H18N8O3S

SMILES: Cc1sc(C(=O)Nc2n[nH]c(C(N)=O)c2N)nc1NC(=O)CN(C)C

BIRTHDAY: 2018-12-25T02:03:37.535459
ATC: S01E
- SENSORY ORGANS
- OPHTHALMOLOGICALS
- ANTIGLAUCOMA PREPARATIONS AND MIOTICS
Synthesis Plan
FORMULA:C26H34N8

SMILES: CC(C)N1C=N[C@@]2(NCc3ccccc3-c3ccncc3)N=CN=C[C@]12NC1(N)CCCCC1

BIRTHDAY: 2018-12-25T02:03:37.547165
ATC: G02A
- GENITO URINARY SYSTEM AND SEX HORMONES
- OTHER GYNECOLOGICALS
- UTEROTONICS
Synthesis Plan
FORMULA:C35H55NO2S

SMILES: CN(C)C(C)(C)C(C)(C)C(C)(C)C(C)(C)C(C)(C)C(C)(C)[C@H]1OC(c2ccccc2)(c2ccccc2)C[S@+]1[O-]

BIRTHDAY: 2018-12-25T02:03:37.556552
ATC: J05A
- ANTIINFECTIVES FOR SYSTEMIC USE
- ANTIVIRALS FOR SYSTEMIC USE
- DIRECT ACTING ANTIVIRALS
Synthesis Plan
FORMULA:C23H35N7O2

SMILES: CC(C)(C)C(C)(C)c1[nH]nc2c1C(=O)[C@]1(NC(=O)[C@]3(N)CNC[C@](C)(N)N3)C=CC=C[C@H]21

BIRTHDAY: 2018-12-25T02:03:37.567235
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C22H31N5O2

SMILES: CN(C)C(C)(C)Cc1nc2cn1C(=O)C=CCOc1ccc(cc1)[C@H](N)NCC2

BIRTHDAY: 2018-12-25T02:03:37.587313
ATC: C02A
- CARDIOVASCULAR SYSTEM
- ANTIHYPERTENSIVES
- ANTIADRENERGIC AGENTS, CENTRALLY ACTING
Synthesis Plan
FORMULA:C20H25N5O

SMILES: CC1=[N+]([O-])[C@@](c2ccc3c(c2)N[C@H](N)C3)(c2ccccn2)N(C(C)C)C1

BIRTHDAY: 2018-12-25T02:03:37.596935
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C26H32N8

SMILES: CC(C)n1cnc2c(NCc3ccc(-c4ccncc4)cc3)nc(N[C@@H]3CCC[C@H](N)C3)nc21

BIRTHDAY: 2018-12-25T02:03:37.607373
ATC: J01D
- ANTIINFECTIVES FOR SYSTEMIC USE
- ANTIBACTERIALS FOR SYSTEMIC USE
- OTHER BETA-LACTAM ANTIBACTERIALS
Synthesis Plan
FORMULA:C24H17F3N6O

SMILES: COc1cccc(-c2nn3ncccc3c2-c2ccnc(Nc3ccc(C(F)(F)F)cc3)n2)c1

BIRTHDAY: 2018-12-25T02:03:37.618276
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C35H55NO2S

SMILES: CN(C)CCCCCCCCCCCCCCCCCC[C@H]1C[S@@+]([O-])C(c2ccccc2)(c2ccccc2)O1

BIRTHDAY: 2018-12-25T02:03:37.627514
ATC: J05A
- ANTIINFECTIVES FOR SYSTEMIC USE
- ANTIVIRALS FOR SYSTEMIC USE
- DIRECT ACTING ANTIVIRALS
Synthesis Plan
FORMULA:C23H35N7O2

SMILES: CC(C)(C)C(C)(C)c1n[nH]c2c1[C@H]1C=CC=C[C@]1(NC(=O)[C@]1(N)CN[C@](C)(N)CN1)C2=O

BIRTHDAY: 2018-12-25T02:03:37.637704
ATC: C10A
- CARDIOVASCULAR SYSTEM
- LIPID MODIFYING AGENTS
- LIPID MODIFYING AGENTS, PLAIN
Synthesis Plan
FORMULA:C22H23ClN6O

SMILES: COc1ccccc1CNc1nc(Nc2cccc(Cl)c2)nc2c1ncn2C(C)C

BIRTHDAY: 2018-12-25T02:03:37.647533
ATC: A10B
- ALIMENTARY TRACT AND METABOLISM
- DRUGS USED IN DIABETES
- BLOOD GLUCOSE LOWERING DRUGS, EXCL. INSULINS
Synthesis Plan
FORMULA:C36H57NO2S

SMILES: CN(C)C(C)(C)C(C)(C)C(C)(C)C(C)(C)C(C)(C)C(C)(C)[C@@]1(C)OC(c2ccccc2)(c2ccccc2)C[S@+]1[O-]

BIRTHDAY: 2018-12-25T02:03:37.668833
ATC: R03D
- RESPIRATORY SYSTEM
- DRUGS FOR OBSTRUCTIVE AIRWAY DISEASES
- OTHER SYSTEMIC DRUGS FOR OBSTRUCTIVE AIRWAY DISEASES
Synthesis Plan
FORMULA:C24H19F3N6O

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

BIRTHDAY: 2018-12-03T02:39:43.002631
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C24H19F3N6O

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

BIRTHDAY: 2018-12-03T02:39:43.036819
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C21H34N6

SMILES: CC(C)c1c(-c2cnc(N[C@@H]3CCCCN3C)nc2)cnn1[C@H](C)C(C)C

BIRTHDAY: 2018-12-03T02:39:43.045546
ATC: D06B
- DERMATOLOGICALS
- ANTIBIOTICS AND CHEMOTHERAPEUTICS FOR DERMATOLOGICAL USE
- CHEMOTHERAPEUTICS FOR TOPICAL USE
Synthesis Plan
FORMULA:C24H23ClN6

SMILES: CC(C)(C)c1[nH]cnc1-c1nn2c(c1-c1cccc(Cl)c1)C(c1ccccn1)=CNC2

BIRTHDAY: 2018-12-03T02:39:43.055568
ATC: N05A
- NERVOUS SYSTEM
- PSYCHOLEPTICS
- ANTIPSYCHOTICS
Synthesis Plan
FORMULA:C19H31N5O2

SMILES: CN1CCC(C(=O)N2Cc3c(n[nH]c3NC(=O)C(C)(C)C)C2(C)C)CC1

BIRTHDAY: 2018-12-03T02:39:43.072748
ATC: N06A
- NERVOUS SYSTEM
- PSYCHOANALEPTICS
- ANTIDEPRESSANTS
Synthesis Plan
FORMULA:C24H19F3N6O

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

BIRTHDAY: 2018-12-03T02:39:43.083819
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C18H30N6O2

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

BIRTHDAY: 2018-12-03T02:39:43.093362
ATC: L01C
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- PLANT ALKALOIDS AND OTHER NATURAL PRODUCTS
Synthesis Plan
FORMULA:C29H44N4O2

SMILES: CN(C)CCCCCCCCCCC[C@@H]1C=CC(=O)n2cnc(c2)CCNCc2cccc(c2)O1

BIRTHDAY: 2018-12-03T02:39:43.102916
ATC: N02B
- NERVOUS SYSTEM
- ANALGESICS
- OTHER ANALGESICS AND ANTIPYRETICS
Synthesis Plan
FORMULA:C27H32N6

SMILES: CN[C@@]12N=CN=C[C@]1(NCc1cccc3c1[C@H]1C[C@@H](C=C4C=CC=C[C@@H]41)C3)N(C(C)C)C=N2

BIRTHDAY: 2018-12-03T02:39:43.148329
ATC: A05A
- ALIMENTARY TRACT AND METABOLISM
- BILE AND LIVER THERAPY
- BILE THERAPY
Synthesis Plan
FORMULA:C34H52N4O3

SMILES: C[C@@H](OC(=O)c1ccccc1NC(=O)c1ccccc1C(=N)N)C(C)(C)C(C)(C)C(C)(C)C(C)(C)C(C)(C)N(C)C

BIRTHDAY: 2018-12-03T02:39:43.167530
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:C21H35NO4

SMILES: C[C@H](C(C)(C)C(C)(C)C(C)(C)N(C)C)[C@]12C=C(O)C(O)=C[C@H]1COC2=O

BIRTHDAY: 2018-11-30T03:41:39.055406
ATC: D01A
- DERMATOLOGICALS
- ANTIFUNGALS FOR DERMATOLOGICAL USE
- ANTIFUNGALS FOR TOPICAL USE
Synthesis plan pending
FORMULA:C15H22N4O2S

SMILES: Cc1sc(-c2nc(C(C)(C)C)no2)nc1NC(=O)C(C)(C)C

BIRTHDAY: 2018-11-30T03:41:39.074529
ATC: C02A
- CARDIOVASCULAR SYSTEM
- ANTIHYPERTENSIVES
- ANTIADRENERGIC AGENTS, CENTRALLY ACTING
Synthesis plan pending
FORMULA:C34H33FN10O

SMILES: CC(C)n1cnc2c(Nc3cccc(F)c3)nc(Nc3cc4nc(n3)Nc3cccc(c3)CCCOc3cccc(c3)CN4)nc21

BIRTHDAY: 2018-11-30T03:41:39.104625
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis plan pending
FORMULA:C29H25N7O2S

SMILES: O=C(Nc1nc2c3cc(cc2s1)CNCC=CCCOc1cccc(c1)-c1ccnc(n1)N3)c1ccncc1

BIRTHDAY: 2018-11-30T03:41:39.116598
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis plan pending
FORMULA:C23H31N5O2

SMILES: CC(C)C(C)(C)c1[nH]nc2c1C(=O)c1c(NC(=O)CN3CCN(C)CC3)cccc1-2

BIRTHDAY: 2018-11-30T03:41:39.125784
ATC: C03C
- CARDIOVASCULAR SYSTEM
- DIURETICS
- HIGH-CEILING DIURETICS
Synthesis plan pending
FORMULA:C18H30N6O2

SMILES: CC(C)(C)C(=O)Nc1n[nH]c2c1N(C(=O)[C@]1(N)CCCCN1)CC2(C)C

BIRTHDAY: 2018-11-30T03:41:39.135291
ATC: N03A
- NERVOUS SYSTEM
- ANTIEPILEPTICS
- ANTIEPILEPTICS
Synthesis plan pending
FORMULA:C26H29N5O2

SMILES: COc1ccc(-c2nn3c(c2-c2ccnc(N4CC5CCCC4CCC5)n2)CCC3=O)cc1

BIRTHDAY: 2018-11-30T03:41:39.145326
ATC: A11C
- ALIMENTARY TRACT AND METABOLISM
- VITAMINS
- VITAMIN A AND D, INCL. COMBINATIONS OF THE TWO
Synthesis plan pending
FORMULA:C21H23F3N6O2

SMILES: COc1ccc(C(=O)c2c[nH]nc2Nc2cc(C(F)(F)F)nc(NCC(C)(C)C)n2)cc1

BIRTHDAY: 2018-11-30T03:41:39.167385
ATC: A16A
- ALIMENTARY TRACT AND METABOLISM
- OTHER ALIMENTARY TRACT AND METABOLISM PRODUCTS
- OTHER ALIMENTARY TRACT AND METABOLISM PRODUCTS
Synthesis plan pending
FORMULA:C20H29N7O

SMILES: CC(C)n1cnc2c(NCc3cccnc3)nc(N[C@H](CO)C(C)(C)C)nc21

BIRTHDAY: 2018-11-30T03:41:39.176923
ATC: A10B
- ALIMENTARY TRACT AND METABOLISM
- DRUGS USED IN DIABETES
- BLOOD GLUCOSE LOWERING DRUGS, EXCL. INSULINS
Synthesis plan pending
FORMULA:C36H57NO2

SMILES: CN(C)C(C)(C)C(C)(C)C(C)(C)C(C)(C)C(C)(C)C(C)(C)C(C)(C)Oc1ccccc1C(=O)c1ccccc1

BIRTHDAY: 2018-11-19T08:17:40.335684
ATC: N05C
- NERVOUS SYSTEM
- PSYCHOLEPTICS
- HYPNOTICS AND SEDATIVES
Synthesis plan pending
FORMULA:C18H25N5O4

SMILES: CC(C)(C(=O)C#N)[C@@]1(C)COCCCC(=O)COc2cncc(n2)NCN1

BIRTHDAY: 2018-11-19T08:17:40.345536
ATC: A14A
- ALIMENTARY TRACT AND METABOLISM
- ANABOLIC AGENTS FOR SYSTEMIC USE
- ANABOLIC STEROIDS
Synthesis plan pending
FORMULA:C26H33N7O2

SMILES: CC(C)N1C=N[C@@]2(NCc3ccccc3-c3ccncc3)N=CN=C[C@@]12N[C@H]1CCCCC1(O)O

BIRTHDAY: 2018-11-19T08:17:40.380626
ATC: G02A
- GENITO URINARY SYSTEM AND SEX HORMONES
- OTHER GYNECOLOGICALS
- UTEROTONICS
Synthesis plan pending
FORMULA:C35H55NO2S

SMILES: CN(C)CCCCCCCCCCCCCCCCCC[C@@H]1OCC(c2ccccc2)(c2ccccc2)[S@@+]1[O-]

BIRTHDAY: 2018-11-19T08:17:40.390100
ATC: J04A
- ANTIINFECTIVES FOR SYSTEMIC USE
- ANTIMYCOBACTERIALS
- DRUGS FOR TREATMENT OF TUBERCULOSIS
Synthesis plan pending
FORMULA:C24H26N6O2

SMILES: COc1ccccc1C(=O)c1c[nH]nc1Nc1nc(NCC(C)(C)C)nc2ccccc12

BIRTHDAY: 2018-11-19T08:17:40.401157
ATC: A10B
- ALIMENTARY TRACT AND METABOLISM
- DRUGS USED IN DIABETES
- BLOOD GLUCOSE LOWERING DRUGS, EXCL. INSULINS
Synthesis plan pending
FORMULA:C24H21NO

SMILES: O=C1c2cc(-c3ccccc3)ccc2C2(c3ccccc3)CCN1CC2

BIRTHDAY: 2018-11-19T08:17:40.409506
ATC: J05A
- ANTIINFECTIVES FOR SYSTEMIC USE
- ANTIVIRALS FOR SYSTEMIC USE
- DIRECT ACTING ANTIVIRALS
Synthesis plan pending
FORMULA:C21H26N8O

SMILES: Cc1nc(-c2ccccc2CNc2nc(NC(C)C)c3c(ncn3C(C)C)n2)no1

BIRTHDAY: 2018-11-19T08:17:40.420267
ATC: M01A
- MUSCULO-SKELETAL SYSTEM
- ANTIINFLAMMATORY AND ANTIRHEUMATIC PRODUCTS
- ANTIINFLAMMATORY AND ANTIRHEUMATIC PRODUCTS, NON-STEROIDS
Synthesis plan pending
FORMULA:C21H27FN8

SMILES: CC(C)c1cn[nH]c1-c1ncc(Nc2ccccc2F)c(N[C@@]2(N)CCCCN2)n1

BIRTHDAY: 2018-11-19T08:17:40.430779
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:C19H16N4O4S

SMILES: CC(=O)Nc1ccc2c(c1)-c1n[nH]c(-c3ccc(NS(C)(=O)=O)cc3)c1C2=O

BIRTHDAY: 2018-11-19T08:17:40.440480
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis plan pending
FORMULA:C17H23F3N6

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

BIRTHDAY: 2018-11-19T08:17:40.450191
ATC: H01B
- SYSTEMIC HORMONAL PREPARATIONS, EXCL. SEX HORMONES AND INSULINS
- PITUITARY AND HYPOTHALAMIC HORMONES AND ANALOGUES
- POSTERIOR PITUITARY LOBE HORMONES
Synthesis plan pending
FORMULA:C25H30N12OS

SMILES: CC(C)n1cnc2c(NCc3cccc4c3OCCNCCn3nnc(n3)-c3csc(n3)CNC4)ncnc21

BIRTHDAY: 2018-11-19T08:17:40.474990
ATC: N02B
- NERVOUS SYSTEM
- ANALGESICS
- OTHER ANALGESICS AND ANTIPYRETICS
Synthesis plan pending
FORMULA:C32H35N5O

SMILES: COc1ccc(-c2n[nH]cc2-c2cc3[nH]c2C2=NC(=Cc4ccc([nH]4)CCCCCCCCC3)C=C2)cc1

BIRTHDAY: 2018-11-19T08:17:40.498162
ATC: J01F
- ANTIINFECTIVES FOR SYSTEMIC USE
- ANTIBACTERIALS FOR SYSTEMIC USE
- MACROLIDES, LINCOSAMIDES AND STREPTOGRAMINS
Synthesis plan pending
FORMULA:C18H29N5O2

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

BIRTHDAY: 2018-11-19T08:17:40.507311
ATC: V08A
- VARIOUS
- CONTRAST MEDIA
- X-RAY CONTRAST MEDIA, IODINATED
Synthesis plan pending
FORMULA:C23H29NO2S4

SMILES: CC(C)(C)c1ccccc1[C@]12C=CC=C[C@@]1(C)[SH]=N[S@@]21[C@@H]2C=C[C@H]1[C@](S)([SH](=O)=O)C2

BIRTHDAY: 2018-11-19T08:17:40.518379
ATC: C03X
- CARDIOVASCULAR SYSTEM
- DIURETICS
- OTHER DIURETICS
Synthesis plan pending
FORMULA:C20H27N7O

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

BIRTHDAY: 2018-11-19T08:17:40.528038
ATC: N05A
- NERVOUS SYSTEM
- PSYCHOLEPTICS
- ANTIPSYCHOTICS
Synthesis plan pending
FORMULA:C34H53NO2S

SMILES: CN(C)CCCCCCCCCCCCCCCCC[C@@H]1C[S@@+]([O-])C(c2ccccc2)(c2ccccc2)O1

BIRTHDAY: 2018-11-19T08:17:40.537354
ATC: J05A
- ANTIINFECTIVES FOR SYSTEMIC USE
- ANTIVIRALS FOR SYSTEMIC USE
- DIRECT ACTING ANTIVIRALS
Synthesis plan pending
FORMULA:C20H29N7O

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

BIRTHDAY: 2018-11-19T08:17:40.547036
ATC: C03C
- CARDIOVASCULAR SYSTEM
- DIURETICS
- HIGH-CEILING DIURETICS
Synthesis plan pending
FORMULA:C16H21F3N6O

SMILES: CNC(=O)c1ncnc(C(F)(F)F)c1Nc1[nH]ncc1C(C)(C)C(C)C

BIRTHDAY: 2018-11-19T08:17:40.557883
ATC: D11A
- DERMATOLOGICALS
- OTHER DERMATOLOGICAL PREPARATIONS
- OTHER DERMATOLOGICAL PREPARATIONS
Synthesis plan pending
FORMULA:C18H30N6O2

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

BIRTHDAY: 2018-11-19T08:17:40.567477
ATC: L01C
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- PLANT ALKALOIDS AND OTHER NATURAL PRODUCTS
Synthesis plan pending
FORMULA:C21H25NO2

SMILES: O=C(CCCCCCCc1ccccc1)C(=O)Nc1ccccc1

BIRTHDAY: 2018-11-19T08:17:40.574444
ATC: A06A
- ALIMENTARY TRACT AND METABOLISM
- DRUGS FOR CONSTIPATION
- DRUGS FOR CONSTIPATION
Synthesis plan pending
FORMULA:C24H17F3N6O

SMILES: COc1ccc(-c2nn3ncccc3c2-c2cnc(Nc3ccc(C(F)(F)F)cc3)nc2)cc1

BIRTHDAY: 2018-11-19T08:17:40.585700
ATC: C10A
- CARDIOVASCULAR SYSTEM
- LIPID MODIFYING AGENTS
- LIPID MODIFYING AGENTS, PLAIN
Synthesis plan pending
FORMULA:C19H30N6

SMILES: CC(C)N1C=N[C@@H]2N=CN=C[C@]21NC1(C)C[C@@H]2CC3CCN2[C@H](C3)C1

BIRTHDAY: 2018-11-19T08:17:40.603323
ATC: C08C
- CARDIOVASCULAR SYSTEM
- CALCIUM CHANNEL BLOCKERS
- SELECTIVE CALCIUM CHANNEL BLOCKERS WITH MAINLY VASCULAR EFFECTS
Synthesis plan pending
FORMULA:C37H50N6

SMILES: CN(C)CCCCCCCCCCCc1ccc2cc1CNCC=CCCn1ccc3ccc(cc31)-c1ccnc(n1)N2

BIRTHDAY: 2018-11-19T08:17:40.614351
ATC: N06A
- NERVOUS SYSTEM
- PSYCHOANALEPTICS
- ANTIDEPRESSANTS
Synthesis plan pending
FORMULA:C14H17N5O

SMILES: Cc1nccnc1C(=O)Nc1ccncc1NC(C)C

BIRTHDAY: 2018-11-19T08:17:40.633426
ATC: C03C
- CARDIOVASCULAR SYSTEM
- DIURETICS
- HIGH-CEILING DIURETICS
Synthesis plan pending
FORMULA:C19H24Cl2N6O

SMILES: CC(C)[C@H](CO)Nc1nc(Nc2cc(Cl)cc(Cl)c2)c2ncn(C(C)C)c2n1

BIRTHDAY: 2018-11-19T08:17:40.653128
ATC: L04A
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- IMMUNOSUPPRESSANTS
- IMMUNOSUPPRESSANTS
Synthesis plan pending
FORMULA:C40H40FN7O8S4

SMILES: CC(=O)N[S@+]([O-])C1=C(OCC(=O)Nc2nc(-c3ccc(F)cc3)cs2)O[C@@](O)([C@H]2Nc3cccc4c3N=C2c2cccc3c2SN(CCNCCO4)C3)C2(CCOCC2)S1

BIRTHDAY: 2018-11-19T08:17:40.674502
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis plan pending
FORMULA:C24H19F3N6O

SMILES: COc1cccc(-c2c(-c3cnc(Nc4ccccc4C(F)(F)F)nc3)nn3c2C=CCN3)c1

BIRTHDAY: 2018-11-19T08:17:40.693786
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis plan pending
FORMULA:C20H19NO5

SMILES: COc1ccc(C2=CN/C(=C\c3ccc(OC)c(OC)c3)C(=O)O2)cc1

BIRTHDAY: 2018-11-19T08:17:40.702341
ATC: B03A
- BLOOD AND BLOOD FORMING ORGANS
- ANTIANEMIC PREPARATIONS
- IRON PREPARATIONS
Synthesis plan pending
FORMULA:C34H53NO2S

SMILES: C[C@@H]([C@H]1OCC(c2ccccc2)(c2ccccc2)[S@+]1[O-])C(C)(C)C(C)(C)C(C)(C)C(C)(C)C(C)(C)N(C)C

BIRTHDAY: 2018-11-19T08:17:40.711845
ATC: J05A
- ANTIINFECTIVES FOR SYSTEMIC USE
- ANTIVIRALS FOR SYSTEMIC USE
- DIRECT ACTING ANTIVIRALS
Synthesis plan pending
FORMULA:C19H27N7O

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

BIRTHDAY: 2018-11-19T08:17:40.721432
ATC: A10B
- ALIMENTARY TRACT AND METABOLISM
- DRUGS USED IN DIABETES
- BLOOD GLUCOSE LOWERING DRUGS, EXCL. INSULINS
Synthesis plan pending
FORMULA:C27H30Cl2N8O

SMILES: CC(C)CN[C@@]12C=CC=C[C@H]1OC=C(n1cnc3nc(Nc4c(Cl)cccc4Cl)nc(NC(C)C)c31)C=N2

BIRTHDAY: 2018-11-19T08:17:40.733625
ATC: A02A
- ALIMENTARY TRACT AND METABOLISM
- DRUGS FOR ACID RELATED DISORDERS
- ANTACIDS
Synthesis plan pending
FORMULA:C34H41FN6O

SMILES: CC(C)CC(=O)Nc1n[nH]c2c1N[C@H]1C3=CC=C4C=C(C=C[C@@]421)N1CCN(CC[C@@H]1F)Cc1cccc(c1)CCCC3

BIRTHDAY: 2018-11-19T08:17:40.746060
ATC: N02B
- NERVOUS SYSTEM
- ANALGESICS
- OTHER ANALGESICS AND ANTIPYRETICS
Synthesis plan pending
FORMULA:C20H29N7O

SMILES: CC(C)n1cnc2c(NCc3cccnc3)nc(N[C@@H](CO)C(C)(C)C)nc21

BIRTHDAY: 2018-11-19T08:17:40.755784
ATC: A10B
- ALIMENTARY TRACT AND METABOLISM
- DRUGS USED IN DIABETES
- BLOOD GLUCOSE LOWERING DRUGS, EXCL. INSULINS
Synthesis plan pending
FORMULA:C30H36N8

SMILES: CC(C)N1C=N[C@@]2(NCc3ccc(-c4ccncc4)cc3)N=CN=C[C@@]12N[C@@]12CCCC[C@@H]1C=CC=CN2

BIRTHDAY: 2018-11-19T08:17:40.768126
ATC: N07B
- NERVOUS SYSTEM
- OTHER NERVOUS SYSTEM DRUGS
- DRUGS USED IN ADDICTIVE DISORDERS
Synthesis plan pending
FORMULA:C19H31N5O2

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

BIRTHDAY: 2018-11-19T08:17:40.777276
ATC: C02B
- CARDIOVASCULAR SYSTEM
- ANTIHYPERTENSIVES
- ANTIADRENERGIC AGENTS, GANGLION-BLOCKING
Synthesis plan pending
FORMULA:C20H24N4O2S

SMILES: Cc1sc(-c2noc(-c3ccccc3C(C)C)n2)nc1NC(=O)C(C)(C)C

BIRTHDAY: 2018-11-19T08:17:40.786181
ATC: R01A
- RESPIRATORY SYSTEM
- NASAL PREPARATIONS
- DECONGESTANTS AND OTHER NASAL PREPARATIONS FOR TOPICAL USE
Synthesis plan pending
FORMULA:C17H11F3N2OS

SMILES: O=C(Nc1ncsc1-c1ccccc1)c1ccccc1C(F)(F)F

BIRTHDAY: 2018-11-19T08:17:40.795106
ATC: N05B
- NERVOUS SYSTEM
- PSYCHOLEPTICS
- ANXIOLYTICS
Synthesis plan pending
FORMULA:C16H22F3N7

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

BIRTHDAY: 2018-11-19T08:17:40.805793
ATC: C01A
- CARDIOVASCULAR SYSTEM
- CARDIAC THERAPY
- CARDIAC GLYCOSIDES
Synthesis plan pending
FORMULA:C15H22N4O2S

SMILES: Cc1nc(NC(=O)C(C)(C)C)sc1-c1nc(C(C)(C)C)no1

BIRTHDAY: 2018-11-19T08:17:40.813813
ATC: D11A
- DERMATOLOGICALS
- OTHER DERMATOLOGICAL PREPARATIONS
- OTHER DERMATOLOGICAL PREPARATIONS
Synthesis plan pending
FORMULA:C25H27FN6O3S

SMILES: O=C1CNCCNC(=O)CN[C@@](F)(c2ccccc2C(=O)Nc2ncsc2-c2ccccc2)CNC1

BIRTHDAY: 2018-11-19T08:17:40.837668
ATC: C09C
- CARDIOVASCULAR SYSTEM
- AGENTS ACTING ON THE RENIN-ANGIOTENSIN SYSTEM
- ANGIOTENSIN II ANTAGONISTS, PLAIN
Synthesis plan pending
FORMULA:C22H28N4O3

SMILES: CC(C)C(C)(C)c1[nH]nc2c1C(=O)c1c(NC(=O)CN3CCOCC3)cccc1-2

BIRTHDAY: 2018-11-19T08:17:40.870340
ATC: C08E
- CARDIOVASCULAR SYSTEM
- CALCIUM CHANNEL BLOCKERS
- NON-SELECTIVE CALCIUM CHANNEL BLOCKERS
Synthesis plan pending
FORMULA:C34H51F3N2O2

SMILES: Cc1nc(C(F)(F)F)ccc1C(=O)OCCCCCCCCCCCCCCCCCCN(C)Cc1ccccc1

BIRTHDAY: 2018-11-19T08:17:40.880688
ATC: S01B
- SENSORY ORGANS
- OPHTHALMOLOGICALS
- ANTIINFLAMMATORY AGENTS
Synthesis plan pending
FORMULA:C34H53NO2S

SMILES: CN(C)CCCCCCCCCCCCCCCCC[C@@H]1OCC(c2ccccc2)(c2ccccc2)[S@@+]1[O-]

BIRTHDAY: 2018-11-19T08:17:40.890016
ATC: J04A
- ANTIINFECTIVES FOR SYSTEMIC USE
- ANTIMYCOBACTERIALS
- DRUGS FOR TREATMENT OF TUBERCULOSIS
Synthesis plan pending
FORMULA:C19H24Cl2N6O

SMILES: CC(C)[C@H](CO)Nc1nc(Nc2c(Cl)cccc2Cl)c2c(ncn2C(C)C)n1

BIRTHDAY: 2018-11-19T08:17:40.900798
ATC: N05A
- NERVOUS SYSTEM
- PSYCHOLEPTICS
- ANTIPSYCHOTICS
Synthesis plan pending
FORMULA:C22H16F3N3O2

SMILES: O=C(CNC(=O)c1cccc2c1[nH]c1ccccc12)Nc1ccccc1C(F)(F)F

BIRTHDAY: 2018-11-19T08:17:40.911080
ATC: V04C
- VARIOUS
- DIAGNOSTIC AGENTS
- OTHER DIAGNOSTIC AGENTS
Synthesis plan pending
FORMULA:C24H17F3N6O

SMILES: COc1ccccc1-c1nn2ncccc2c1-c1ccnc(Nc2cccc(C(F)(F)F)c2)n1

BIRTHDAY: 2018-11-19T08:17:40.934379
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis plan pending
FORMULA:C24H19F3N6O

SMILES: COc1ccccc1-c1nn2c(c1-c1cnc(Nc3ccccc3C(F)(F)F)nc1)C=CCN2

BIRTHDAY: 2018-11-19T08:17:40.958052
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis plan pending
FORMULA:C20H29N7O

SMILES: CC(C)n1cnc2c(N[C@H](CO)C(C)(C)C)nc(NCc3ccncc3)nc21

BIRTHDAY: 2018-11-30T17:24:00.510674
ATC: C10A
- CARDIOVASCULAR SYSTEM
- LIPID MODIFYING AGENTS
- LIPID MODIFYING AGENTS, PLAIN
Synthesis Plan
FORMULA:C21H22ClN5O2

SMILES: CC(C)(C)c1cnn(-c2ccccc2C(N)=O)c1NC(=O)Nc1ccccc1Cl

BIRTHDAY: 2018-11-30T17:24:00.521394
ATC: A02B
- ALIMENTARY TRACT AND METABOLISM
- DRUGS FOR ACID RELATED DISORDERS
- DRUGS FOR PEPTIC ULCER AND GASTRO-OESOPHAGEAL REFLUX DISEASE (GORD)
Synthesis Plan
FORMULA:C22H28FN7

SMILES: CC(C)c1[nH]ncc1-c1cc(Nc2cccc(F)c2)nc(NC2CCN(C)CC2)n1

BIRTHDAY: 2018-11-30T17:24:00.531276
ATC: N05A
- NERVOUS SYSTEM
- PSYCHOLEPTICS
- ANTIPSYCHOTICS
Synthesis Plan
FORMULA:C18H16N6OSe

SMILES: COc1cccc(-c2cc(-c3cncnc3Nc3[se]cnc3C)n[nH]2)c1

BIRTHDAY: 2018-11-30T17:24:00.562890
ATC: M01A
- MUSCULO-SKELETAL SYSTEM
- ANTIINFLAMMATORY AND ANTIRHEUMATIC PRODUCTS
- ANTIINFLAMMATORY AND ANTIRHEUMATIC PRODUCTS, NON-STEROIDS
Synthesis Plan
FORMULA:C23H26N6O

SMILES: COc1cccc(CNc2nc(NCc3ccccc3)nc3ncn(C(C)C)c23)c1

BIRTHDAY: 2018-11-30T17:24:00.591667
ATC: C03C
- CARDIOVASCULAR SYSTEM
- DIURETICS
- HIGH-CEILING DIURETICS
Synthesis Plan
FORMULA:C21H28N8O

SMILES: CC(C)N1C=N[C@@]2(NCc3ccc4nccnc4c3)N=CN=C[C@]12NCC(C)(C)O

BIRTHDAY: 2018-11-30T17:24:00.633024
ATC: C01B
- CARDIOVASCULAR SYSTEM
- CARDIAC THERAPY
- ANTIARRHYTHMICS, CLASS I AND III
Synthesis Plan
FORMULA:C23H16F4N6

SMILES: Fc1ccc(-c2nn3c(c2-c2ncc(Nc4ccccc4C(F)(F)F)cn2)C=CCN3)cc1

BIRTHDAY: 2018-11-30T17:24:00.643917
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C18H30N6O2

SMILES: CC(C)(C)C(=O)Nc1n[nH]c2c1N(C(=O)[C@@]1(N)CCCCN1)C(C)(C)C2

BIRTHDAY: 2018-11-30T17:24:00.665273
ATC: B05A
- BLOOD AND BLOOD FORMING ORGANS
- BLOOD SUBSTITUTES AND PERFUSION SOLUTIONS
- BLOOD AND RELATED PRODUCTS
Synthesis Plan
FORMULA:C16H17N9O

SMILES: CC(C)c1c(-c2ncc(N3C=CNO3)cn2)n[nH]c1-c1cncnc1N

BIRTHDAY: 2018-12-02T16:07:08.625390
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C14H17ClN4O

SMILES: CC(C)(C)c1c[nH]nc1NC(=O)Nc1ccc(Cl)cc1

BIRTHDAY: 2018-12-02T16:07:08.633262
ATC: N05B
- NERVOUS SYSTEM
- PSYCHOLEPTICS
- ANXIOLYTICS
Synthesis Plan
FORMULA:C21H26N8O

SMILES: Cc1noc(-c2ccc(CNc3nc(NC(C)C)nc4c3ncn4C(C)C)cc2)n1

BIRTHDAY: 2018-12-02T16:07:08.643457
ATC: A08A
- ALIMENTARY TRACT AND METABOLISM
- ANTIOBESITY PREPARATIONS, EXCL. DIET PRODUCTS
- ANTIOBESITY PREPARATIONS, EXCL. DIET PRODUCTS
Synthesis Plan
FORMULA:C28H50FNO

SMILES: CN(CCCCCCCCCCCCCCCCCCCCO)Cc1ccc(F)cc1

BIRTHDAY: 2018-12-02T16:07:08.650908
ATC: D06B
- DERMATOLOGICALS
- ANTIBIOTICS AND CHEMOTHERAPEUTICS FOR DERMATOLOGICAL USE
- CHEMOTHERAPEUTICS FOR TOPICAL USE
Synthesis Plan
FORMULA:C23H28F3N7

SMILES: CC(C)c1cn[nH]c1-c1cc(NC2CCN(C)CC2)nc(Nc2cccc(C(F)(F)F)c2)n1

BIRTHDAY: 2018-12-02T16:07:08.672785
ATC: H01A
- SYSTEMIC HORMONAL PREPARATIONS, EXCL. SEX HORMONES AND INSULINS
- PITUITARY AND HYPOTHALAMIC HORMONES AND ANALOGUES
- ANTERIOR PITUITARY LOBE HORMONES AND ANALOGUES
Synthesis Plan
FORMULA:C23H35N7O2

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

BIRTHDAY: 2018-12-02T16:07:08.692047
ATC: M01A
- MUSCULO-SKELETAL SYSTEM
- ANTIINFLAMMATORY AND ANTIRHEUMATIC PRODUCTS
- ANTIINFLAMMATORY AND ANTIRHEUMATIC PRODUCTS, NON-STEROIDS
Synthesis Plan
FORMULA:C22H17N7OS

SMILES: O=C(Nc1ncc(-c2ccccc2)s1)c1ccccc1CNc1ncc2nc[nH]c2n1

BIRTHDAY: 2018-12-02T16:07:08.702721
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C34H53NO2S

SMILES: C[C@H]([C@H]1[S@+]([O-])COC1(c1ccccc1)c1ccccc1)C(C)(C)C(C)(C)C(C)(C)C(C)(C)C(C)(C)N(C)C

BIRTHDAY: 2018-12-02T16:07:08.712684
ATC: A14A
- ALIMENTARY TRACT AND METABOLISM
- ANABOLIC AGENTS FOR SYSTEMIC USE
- ANABOLIC STEROIDS
Synthesis Plan
FORMULA:C35H55NO2S

SMILES: CN(C)C(C)(C)C(C)(C)C(C)(C)C(C)(C)C(C)(C)C(C)(C)[C@@H]1[S@+]([O-])COC1(c1ccccc1)c1ccccc1

BIRTHDAY: 2018-12-02T16:07:08.735342
ATC: G03H
- GENITO URINARY SYSTEM AND SEX HORMONES
- SEX HORMONES AND MODULATORS OF THE GENITAL SYSTEM
- ANTIANDROGENS
Synthesis Plan
FORMULA:C27H34N8OS2

SMILES: COc1ccccc1CN[C@@]12N=CN=C[C@]1(NCc1ccccc1[C@]13CN[C@@H](CN1)SS3)N(C(C)C)C=N2

BIRTHDAY: 2018-12-02T16:07:08.781784
ATC: M03A
- MUSCULO-SKELETAL SYSTEM
- MUSCLE RELAXANTS
- MUSCLE RELAXANTS, PERIPHERALLY ACTING AGENTS
Synthesis Plan
FORMULA:C27H29NO2

SMILES: O=C(CCCCCCCc1ccccc1)Nc1ccc(C(=O)c2ccccc2)cc1

BIRTHDAY: 2018-12-03T10:43:30.521353
ATC: L04A
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- IMMUNOSUPPRESSANTS
- IMMUNOSUPPRESSANTS
Synthesis Plan
FORMULA:C22H21N5O4

SMILES: COc1ccccc1-c1[nH]nc2c1-c1cc(NC(=O)[C@]3(N)CNCCO3)ccc1C2=O

BIRTHDAY: 2018-12-03T10:43:30.532297
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C30H37N7O

SMILES: CC(C)n1cnc2c(NCc3ccc(-c4ccccn4)cc3)nc(N3C[C@@H]4CC[C@H](CC(CO)C4)C3)nc21

BIRTHDAY: 2018-12-03T10:43:30.543715
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:C20H24N4O2S

SMILES: Cc1nc(NC(=O)C(C)(C)C)sc1-c1nc(-c2ccc(C(C)C)cc2)no1

BIRTHDAY: 2018-12-03T10:43:30.630410
ATC: N06D
- NERVOUS SYSTEM
- PSYCHOANALEPTICS
- ANTI-DEMENTIA DRUGS
Synthesis Plan
FORMULA:C20H20F6N6

SMILES: CC(C)(C)c1cc(Nc2cc(C(F)(F)F)nc(NCc3ccccc3C(F)(F)F)n2)[nH]n1

BIRTHDAY: 2018-12-03T10:43:30.641585
ATC: N05A
- NERVOUS SYSTEM
- PSYCHOLEPTICS
- ANTIPSYCHOTICS
Synthesis Plan
FORMULA:C26H32N8

SMILES: CC(C)n1cnc2c(NCc3cccc(-c4cccnc4)c3)nc(N[C@H]3CCCC[C@@H]3N)nc21

BIRTHDAY: 2018-12-03T10:43:30.660338
ATC: C08C
- CARDIOVASCULAR SYSTEM
- CALCIUM CHANNEL BLOCKERS
- SELECTIVE CALCIUM CHANNEL BLOCKERS WITH MAINLY VASCULAR EFFECTS
Synthesis Plan
FORMULA:C18H30N6O2

SMILES: CC(C)(C)C(=O)Nc1n[nH]c2c1N(C(=O)[C@@]1(N)CCCCN1)CC2(C)C

BIRTHDAY: 2018-12-03T10:43:30.669953
ATC: N03A
- NERVOUS SYSTEM
- ANTIEPILEPTICS
- ANTIEPILEPTICS
Synthesis Plan
FORMULA:C34H39N9OS

SMILES: CC(C)C(=O)NC1=Nc2cc3cc(c2[S@@]12NC=N[C@@H]2NCc1ccccc1)CN1CC=CC(=N1)c1cccc(c1)CNCNC3

BIRTHDAY: 2018-12-03T10:43:30.704494
ATC: L01C
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- PLANT ALKALOIDS AND OTHER NATURAL PRODUCTS
Synthesis Plan
FORMULA:C36H38N6O2

SMILES: COc1cccc(-c2cc(-c3ncncc3Nc3ccccc3[C@@H]3CCC=CCOc4ccc(cc4)CCNCC3)[nH]n2)c1

BIRTHDAY: 2018-12-03T10:43:30.719624
ATC: N05A
- NERVOUS SYSTEM
- PSYCHOLEPTICS
- ANTIPSYCHOTICS
Synthesis Plan
FORMULA:C19H14N2O3

SMILES: COc1ccc(-c2cnn3cc(-c4ccccc4)c(=O)oc23)cc1

BIRTHDAY: 2018-12-03T19:11:55.386005
ATC: C01D
- CARDIOVASCULAR SYSTEM
- CARDIAC THERAPY
- VASODILATORS USED IN CARDIAC DISEASES
Synthesis Plan
FORMULA:C15H22N4O2S

SMILES: Cc1sc(-c2noc(C(C)(C)C)n2)nc1NC(=O)C(C)(C)C

BIRTHDAY: 2018-12-03T19:11:55.394096
ATC: R06A
- RESPIRATORY SYSTEM
- ANTIHISTAMINES FOR SYSTEMIC USE
- ANTIHISTAMINES FOR SYSTEMIC USE
Synthesis Plan
FORMULA:C28H32N4O3

SMILES: COc1ccccc1-c1c2ncn1CC=CCOc1cccc(c1)CNCC[C@@H]2NC(=O)C1CC1

BIRTHDAY: 2018-12-03T19:11:55.404891
ATC: J05A
- ANTIINFECTIVES FOR SYSTEMIC USE
- ANTIVIRALS FOR SYSTEMIC USE
- DIRECT ACTING ANTIVIRALS
Synthesis Plan
FORMULA:C16H22F3N7

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

BIRTHDAY: 2018-12-03T19:11:55.423781
ATC: C01A
- CARDIOVASCULAR SYSTEM
- CARDIAC THERAPY
- CARDIAC GLYCOSIDES
Synthesis Plan
FORMULA:C23H17IN6O

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

BIRTHDAY: 2018-12-03T19:11:55.445552
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C19H29N7O4

SMILES: CC(C)N1C=N[C@]2(N[C@@]3(C)NC=CCOC3=O)N=CN=C[C@@]12N1CCC[C@@]1(O)CO

BIRTHDAY: 2018-12-03T19:11:55.492182
ATC: L01A
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- ALKYLATING AGENTS
Synthesis Plan
FORMULA:C34H34N6O3

SMILES: COc1cccc(-c2cn[nH]c2-c2ncc(Nc3ccccc3[C@H]3OCCNCCOCC=Cc4cccc3c4)cn2)c1

BIRTHDAY: 2018-12-03T19:11:55.527441
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C16H24N6O2S

SMILES: Cc1nc(NC(=O)CN(C)C)sc1C(=O)Nc1c[nH]nc1C(C)(C)C

BIRTHDAY: 2018-12-03T19:11:55.536473
ATC: S01E
- SENSORY ORGANS
- OPHTHALMOLOGICALS
- ANTIGLAUCOMA PREPARATIONS AND MIOTICS
Synthesis Plan
FORMULA:C29H51N5O

SMILES: C[C@@H]1CCC(C)(C)[C@]2(CCNc3cc(cc(C(=O)NC(C)(C)C)c3)N[C@H](C)[C@H](N(C)C)[C@@H](C)N2)C1

BIRTHDAY: 2018-12-03T19:11:55.546509
ATC: N02A
- NERVOUS SYSTEM
- ANALGESICS
- OPIOIDS
Synthesis Plan
FORMULA:C27H48FNO

SMILES: CN(Cc1ccccc1F)C(C)(C)C(C)(C)C(C)(C)C(C)(C)C(C)(C)C(C)(C)CO

BIRTHDAY: 2018-12-01T22:31:01.338392
ATC: G03D
- GENITO URINARY SYSTEM AND SEX HORMONES
- SEX HORMONES AND MODULATORS OF THE GENITAL SYSTEM
- PROGESTOGENS
Synthesis Plan
FORMULA:C19H31N7

SMILES: CC(C)Nc1nc(NC2CCN(C)CC2)cc(-c2cc(C(C)C)[nH]n2)n1

BIRTHDAY: 2018-12-01T22:31:01.378428
ATC: J05A
- ANTIINFECTIVES FOR SYSTEMIC USE
- ANTIVIRALS FOR SYSTEMIC USE
- DIRECT ACTING ANTIVIRALS
Synthesis Plan
FORMULA:C31H33N5O4

SMILES: COc1ccccc1-c1n[nH]cc1-c1ccnc(Nc2ccc([C@@H]3COC=C[C@@H]4CCC[C@@H](COC3)O4)cc2)n1

BIRTHDAY: 2018-12-01T22:31:01.453183
ATC: A10B
- ALIMENTARY TRACT AND METABOLISM
- DRUGS USED IN DIABETES
- BLOOD GLUCOSE LOWERING DRUGS, EXCL. INSULINS
Synthesis Plan
FORMULA:C26H34N8

SMILES: CC(C)N1C=N[C@H]2C(N[C@H]3CCCC[C@@H]3N)=NC(NCc3ccc(-c4cccnc4)cc3)=N[C@H]21

BIRTHDAY: 2018-12-01T22:31:01.472348
ATC: P03B
- ANTIPARASITIC PRODUCTS, INSECTICIDES AND REPELLENTS
- ECTOPARASITICIDES, INCL. SCABICIDES, INSECTICIDES AND REPELLENTS
- INSECTICIDES AND REPELLENTS
Synthesis Plan