matter.farm

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

These compounds may interact with:

Phosphatidylinositol 3-kinase regulatory subunit alpha

Potentially involved in: endometrial cancer; breast cancer; doid:2627; kidney cancer; carcinoma; cancer; diabetes mellitus; agammaglobulinemia; alcoholic intoxication, chronic; arthritis; burkitt lymphoma; conjunctivitis; coughing; diarrhea; enophthalmos; exanthema; fatigue; fetal growth retardation; fever; glaucoma

Disease data sourced from Pharos.

Agonist

FORMULA:C21H22ClN7O2

SMILES: Cc1nc(-c2c(N)ncnc2N[C@@H](C)C2=C[C@@H]3C=C(Cl)C=C[C@H]3C(=O)N2C2CC2)no1

BIRTHDAY: 2018-12-01T14:12:06.336836
ATC: C09A
- CARDIOVASCULAR SYSTEM
- AGENTS ACTING ON THE RENIN-ANGIOTENSIN SYSTEM
- ACE INHIBITORS, PLAIN
Synthesis Plan
FORMULA:C18H20N6O3

SMILES: N[C@]12C=C([C@@H]3NC=Cc4nc(C(=O)N5CCOCC5)[nH]c43)C=C[C@H]1OC=N2

BIRTHDAY: 2018-12-01T14:12:06.347447
ATC: A11H
- ALIMENTARY TRACT AND METABOLISM
- VITAMINS
- OTHER PLAIN VITAMIN PREPARATIONS
Synthesis Plan
FORMULA:C21H20ClN7O2

SMILES: Cc1nc(-c2c(N)ncnc2N[C@H](C)c2cc3cccc(Cl)c3c(=O)n2C2CC2)no1

BIRTHDAY: 2018-12-01T14:12:06.358799
ATC: J05A
- ANTIINFECTIVES FOR SYSTEMIC USE
- ANTIVIRALS FOR SYSTEMIC USE
- DIRECT ACTING ANTIVIRALS
Synthesis Plan
FORMULA:C18H20N6O3

SMILES: N[C@]12C=CC=C[C@]1([C@@]13NC=CC=C1N=C(C(=O)N1CCOCC1)N3)N=CO2

BIRTHDAY: 2018-12-01T14:12:06.369497
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C21H22ClN7O2

SMILES: Cc1noc(-c2ncc(N[C@H](C)[C@@]34C=CC=C[C@]3(Cl)C(=O)N(C3CC3)C=C4)c(N)n2)n1

BIRTHDAY: 2018-12-01T14:12:06.380324
ATC: N04A
- NERVOUS SYSTEM
- ANTI-PARKINSON DRUGS
- ANTICHOLINERGIC AGENTS
Synthesis Plan
FORMULA:C15H12Cl2N4O3S

SMILES: N#CCNC(=O)[C@@H](NS(=O)(=O)c1ccncc1)c1cc(Cl)ccc1Cl

BIRTHDAY: 2018-12-01T14:12:06.390362
ATC: C03X
- CARDIOVASCULAR SYSTEM
- DIURETICS
- OTHER DIURETICS
Synthesis Plan
FORMULA:C18H20N6O3

SMILES: N[C@]12OC=N[C@H]1C=CC=C2[C@@]12NC=CC=C1N=C(C(=O)N1CCOCC1)N2

BIRTHDAY: 2018-12-01T14:12:06.400786
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:C21H22ClN7O2

SMILES: Cc1noc(-c2ncc(N[C@@H](C)[C@]34C=CC=C[C@@]3(Cl)N(C3CC3)C=CC4=O)c(N)n2)n1

BIRTHDAY: 2018-12-01T14:12:06.412158
ATC: J05A
- ANTIINFECTIVES FOR SYSTEMIC USE
- ANTIVIRALS FOR SYSTEMIC USE
- DIRECT ACTING ANTIVIRALS
Synthesis Plan
FORMULA:C18H20N6O3

SMILES: N[C@]12C=CC=C[C@@]1([C@]13NC=CC=C1N=C(C(=O)N1CCOCC1)N3)N=CO2

BIRTHDAY: 2018-12-01T14:12:06.422796
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C21H22ClN7O2

SMILES: Cc1noc(-c2ncc(N[C@@H](C)[C@H]3CN(C4CC4)c4ccc(Cl)cc4C3=O)c(N)n2)n1

BIRTHDAY: 2018-12-01T14:12:06.433546
ATC: L01C
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- PLANT ALKALOIDS AND OTHER NATURAL PRODUCTS
Synthesis Plan
FORMULA:C18H20N6O3

SMILES: N[C@@]12C=CC=C[C@@]1([C@]13NC=CC=C1N=C(C(=O)N1CCOCC1)N3)N=CO2

BIRTHDAY: 2018-12-01T14:12:06.444205
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C21H22ClN7O2

SMILES: Cc1noc(-c2ncc(N[C@@H](C)[C@H]3Cc4cc(Cl)ccc4N(C4CC4)C3=O)c(N)n2)n1

BIRTHDAY: 2018-12-01T14:12:06.454930
ATC: J05A
- ANTIINFECTIVES FOR SYSTEMIC USE
- ANTIVIRALS FOR SYSTEMIC USE
- DIRECT ACTING ANTIVIRALS
Synthesis Plan
FORMULA:C20H19N7O2

SMILES: COc1ccc(Nc2nccc(-c3cnc(N4CC[C@@H](O)C4)c(C#N)c3)n2)cn1

BIRTHDAY: 2018-12-01T14:12:06.464788
ATC: A10B
- ALIMENTARY TRACT AND METABOLISM
- DRUGS USED IN DIABETES
- BLOOD GLUCOSE LOWERING DRUGS, EXCL. INSULINS
Synthesis Plan
FORMULA:C16H16N6O3S2

SMILES: CS(=O)(=O)N[C@H](C(=O)NCC#N)[C@]12SC=N[C@H]1C=CC=C2c1cncnc1

BIRTHDAY: 2018-12-25T02:03:57.248232
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:C11H11Cl2N3O3S

SMILES: CS(=O)(=O)N[C@H](C(=O)NCC#N)c1ccc(Cl)c(Cl)c1

BIRTHDAY: 2018-12-25T02:03:57.280918
ATC: C08C
- CARDIOVASCULAR SYSTEM
- CALCIUM CHANNEL BLOCKERS
- SELECTIVE CALCIUM CHANNEL BLOCKERS WITH MAINLY VASCULAR EFFECTS
Synthesis Plan
FORMULA:C21H22ClN7O2

SMILES: Cc1noc(-c2ncc(N[C@@H](C)[C@]34C(=O)CN(C5CC5)C=C3C=CC=C4Cl)c(N)n2)n1

BIRTHDAY: 2018-12-25T02:03:57.293186
ATC: N06B
- NERVOUS SYSTEM
- PSYCHOANALEPTICS
- PSYCHOSTIMULANTS, AGENTS USED FOR ADHD AND NOOTROPICS
Synthesis Plan
FORMULA:C21H22ClN7O2

SMILES: Cc1noc(-c2ncc(N[C@H](C)[C@@]34C=CC=C(Cl)C3=CN(C3CC3)C(=O)C4)c(N)n2)n1

BIRTHDAY: 2018-12-25T02:03:57.304052
ATC: J05A
- ANTIINFECTIVES FOR SYSTEMIC USE
- ANTIVIRALS FOR SYSTEMIC USE
- DIRECT ACTING ANTIVIRALS
Synthesis Plan
FORMULA:C11H11Cl2N3O3S

SMILES: CS(=O)(=O)N[C@@H](C(=O)NCC#N)c1cc(Cl)ccc1Cl

BIRTHDAY: 2018-12-03T02:40:14.223778
ATC: C02K
- CARDIOVASCULAR SYSTEM
- ANTIHYPERTENSIVES
- OTHER ANTIHYPERTENSIVES
Synthesis Plan
FORMULA:C21H22ClN7O2

SMILES: Cc1nc(-c2ncc(N[C@@H](C)[C@H]3CC(=O)N(C4CC4)c4ccc(Cl)cc43)c(N)n2)no1

BIRTHDAY: 2018-12-03T02:40:14.234583
ATC: J05A
- ANTIINFECTIVES FOR SYSTEMIC USE
- ANTIVIRALS FOR SYSTEMIC USE
- DIRECT ACTING ANTIVIRALS
Synthesis Plan
FORMULA:C7H14N2O

SMILES: CNC1=N[C@H](C)CCOC1

BIRTHDAY: 2018-12-03T02:40:14.240287
ATC: N05A
- NERVOUS SYSTEM
- PSYCHOLEPTICS
- ANTIPSYCHOTICS
Synthesis Plan
FORMULA:C21H22ClN7O2

SMILES: Cc1noc(-c2ncc(N[C@H](C)[C@@H]3CC(=O)N(C4CC4)c4ccc(Cl)cc43)c(N)n2)n1

BIRTHDAY: 2018-12-03T02:40:14.261574
ATC: J05A
- ANTIINFECTIVES FOR SYSTEMIC USE
- ANTIVIRALS FOR SYSTEMIC USE
- DIRECT ACTING ANTIVIRALS
Synthesis Plan
FORMULA:C21H22ClN7O2

SMILES: Cc1noc(-c2ncc(N[C@@H](C)[C@H]3C(=O)N(C4CC4)C=C4C=CC=C[C@@]43Cl)c(N)n2)n1

BIRTHDAY: 2018-12-03T02:40:14.294141
ATC: V03A
- VARIOUS
- ALL OTHER THERAPEUTIC PRODUCTS
- ALL OTHER THERAPEUTIC PRODUCTS
Synthesis Plan
FORMULA:C21H22ClN7O2

SMILES: Cc1noc(-c2ncc(N[C@@H](C)[C@]34C=CC=C[C@]3(Cl)C=CN(C3CC3)C4=O)c(N)n2)n1

BIRTHDAY: 2018-11-30T03:41:59.986981
ATC: V03A
- VARIOUS
- ALL OTHER THERAPEUTIC PRODUCTS
- ALL OTHER THERAPEUTIC PRODUCTS
Synthesis plan pending
FORMULA:C23H24N4O2

SMILES: Cc1ccc2cc1Oc1cccc(c1)CN1CC[C@H](C1)NCc1cncn1C2=O

BIRTHDAY: 2018-11-30T03:42:00.007374
ATC: J05A
- ANTIINFECTIVES FOR SYSTEMIC USE
- ANTIVIRALS FOR SYSTEMIC USE
- DIRECT ACTING ANTIVIRALS
Synthesis plan pending
FORMULA:C22H18ClN5O3S

SMILES: N#CCNC(=O)[C@H](NS(=O)(=O)c1ccnc2c1N=C[C@H]1C=CC=C[C@H]21)c1ccccc1Cl

BIRTHDAY: 2018-11-30T03:42:00.028942
ATC: C01D
- CARDIOVASCULAR SYSTEM
- CARDIAC THERAPY
- VASODILATORS USED IN CARDIAC DISEASES
Synthesis plan pending
FORMULA:C21H22ClN7O2

SMILES: Cc1noc(-c2ncc(N[C@H](C)[C@]34C=C(Cl)C=CC3=CN(C3CC3)C(=O)C4)c(N)n2)n1

BIRTHDAY: 2018-11-30T03:42:00.050922
ATC: J05A
- ANTIINFECTIVES FOR SYSTEMIC USE
- ANTIVIRALS FOR SYSTEMIC USE
- DIRECT ACTING ANTIVIRALS
Synthesis plan pending
FORMULA:C21H25N7O3

SMILES: COc1ccc(Nc2nc(-c3ccc(NCCO)nc3)cc(N3CCOCC3)n2)cn1

BIRTHDAY: 2018-11-30T03:42:00.061462
ATC: C10A
- CARDIOVASCULAR SYSTEM
- LIPID MODIFYING AGENTS
- LIPID MODIFYING AGENTS, PLAIN
Synthesis plan pending
FORMULA:C23H25N5O3S

SMILES: CS(=O)(=O)Nc1cccc(-c2ncc(N3CCOCC3)c(-c3cccc4c3NCC4)n2)c1

BIRTHDAY: 2018-11-30T03:42:00.071877
ATC: R05D
- RESPIRATORY SYSTEM
- COUGH AND COLD PREPARATIONS
- COUGH SUPPRESSANTS, EXCL. COMBINATIONS WITH EXPECTORANTS
Synthesis plan pending
FORMULA:C18H20N6O3

SMILES: N[C@@]12OC=N[C@H]1C=CC=C2[C@@]12NC=CC=C1N=C(C(=O)N1CCOCC1)N2

BIRTHDAY: 2018-11-30T03:42:00.082265
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 pending
FORMULA:C39H32ClFN10O2

SMILES: C[C@@H](Nc1nc(N)nc2nc3nc(c12)-c1cccc(c1)OCCC=CCNc1cccc(c1)N3)c1nc2cccc(Cl)c2c(=O)n1-c1ccc(F)cc1

BIRTHDAY: 2018-11-30T03:42:00.098648
ATC: N07C
- NERVOUS SYSTEM
- OTHER NERVOUS SYSTEM DRUGS
- ANTIVERTIGO PREPARATIONS
Synthesis plan pending
FORMULA:C18H19F3N6O3S

SMILES: CS(=O)(=O)Nc1ccc(-c2nc(N3CCOCC3)nc3c2cnn3CC(F)(F)F)cc1

BIRTHDAY: 2018-11-30T03:42:00.120694
ATC: N02B
- NERVOUS SYSTEM
- ANALGESICS
- OTHER ANALGESICS AND ANTIPYRETICS
Synthesis plan pending
FORMULA:C19H19N5O3

SMILES: N[C@@]12C=C(c3ccc4ncc(C(=O)N5CCOCC5)n4c3)C=C[C@H]1OC=N2

BIRTHDAY: 2018-11-30T03:42:00.130161
ATC: V08A
- VARIOUS
- CONTRAST MEDIA
- X-RAY CONTRAST MEDIA, IODINATED
Synthesis plan pending
FORMULA:C18H20N6O3

SMILES: N[C@@]12OC=N[C@@H]1C=CC=C2[C@]12NC=CC=C1N=C(C(=O)N1CCOCC1)N2

BIRTHDAY: 2018-11-30T03:42:00.140590
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 pending
FORMULA:C18H20N6O3

SMILES: N[C@@]12OC=N[C@H]1C=CC=C2[C@H]1NC=Cc2[nH]c(C(=O)N3CCOCC3)nc21

BIRTHDAY: 2018-11-19T08:16:08.867640
ATC: C03B
- CARDIOVASCULAR SYSTEM
- DIURETICS
- LOW-CEILING DIURETICS, EXCL. THIAZIDES
Synthesis plan pending
FORMULA:C21H22ClN7O2

SMILES: Cc1noc(-c2ncc(N[C@H](C)[C@@]34CC(=O)N(C5CC5)C=C3C=CC=C4Cl)c(N)n2)n1

BIRTHDAY: 2018-11-19T08:16:08.879408
ATC: A08A
- ALIMENTARY TRACT AND METABOLISM
- ANTIOBESITY PREPARATIONS, EXCL. DIET PRODUCTS
- ANTIOBESITY PREPARATIONS, EXCL. DIET PRODUCTS
Synthesis plan pending
FORMULA:C26H25N7O

SMILES: Nc1nc2cc(-c3nc(N4CCC(NCc5cccnc5)CC4)c4ccccc4n3)ccc2o1

BIRTHDAY: 2018-11-19T08:16:08.890555
ATC: B01A
- BLOOD AND BLOOD FORMING ORGANS
- ANTITHROMBOTIC AGENTS
- ANTITHROMBOTIC AGENTS
Synthesis plan pending
FORMULA:C22H27FN6

SMILES: C[C@H](Nc1cnc(C23CCC(CC2)CN3)nc1N)[C@]12C=CC=C(F)C1=CC=NC2

BIRTHDAY: 2018-11-19T08:16:08.900236
ATC: V08C
- VARIOUS
- CONTRAST MEDIA
- MAGNETIC RESONANCE IMAGING CONTRAST MEDIA
Synthesis plan pending
FORMULA:C20H19N7O2

SMILES: COc1ccc(Nc2nccc(-c3cnc(N4CC[C@H](O)C4)c(C#N)c3)n2)cn1

BIRTHDAY: 2018-11-19T08:16:08.910188
ATC: A10B
- ALIMENTARY TRACT AND METABOLISM
- DRUGS USED IN DIABETES
- BLOOD GLUCOSE LOWERING DRUGS, EXCL. INSULINS
Synthesis plan pending
FORMULA:C21H22ClN7O2

SMILES: Cc1noc(-c2ncc(N[C@@H](C)[C@@H]3C(=O)N(C4CC4)C=C4C=CC=C[C@@]43Cl)c(N)n2)n1

BIRTHDAY: 2018-11-19T08:16:08.921075
ATC: V03A
- VARIOUS
- ALL OTHER THERAPEUTIC PRODUCTS
- ALL OTHER THERAPEUTIC PRODUCTS
Synthesis plan pending
FORMULA:C20H20N4O

SMILES: C[C@H]1Cc2cccc(c2)Nc2nccc(n2)NCc2cccc(c2)O1

BIRTHDAY: 2018-11-19T08:16:08.930127
ATC: C02D
- CARDIOVASCULAR SYSTEM
- ANTIHYPERTENSIVES
- ARTERIOLAR SMOOTH MUSCLE, AGENTS ACTING ON
Synthesis plan pending
FORMULA:C19H17N5O3

SMILES: Nc1nc2cccc(-c3cccn4c(C(=O)N5CCOCC5)cnc34)c2o1

BIRTHDAY: 2018-11-19T08:16:08.939651
ATC: C05C
- CARDIOVASCULAR SYSTEM
- VASOPROTECTIVES
- CAPILLARY STABILIZING AGENTS
Synthesis plan pending
FORMULA:C21H22ClN7O2

SMILES: Cc1noc(-c2ncc(N[C@H](C)[C@H]3Cc4cc(Cl)ccc4N(C4CC4)C3=O)c(N)n2)n1

BIRTHDAY: 2018-11-19T08:16:08.971440
ATC: J05A
- ANTIINFECTIVES FOR SYSTEMIC USE
- ANTIVIRALS FOR SYSTEMIC USE
- DIRECT ACTING ANTIVIRALS
Synthesis plan pending
FORMULA:C18H20N6O3

SMILES: N[C@@]12C=C([C@@]34NC=CC=C3N=C(C(=O)N3CCOCC3)N4)C=C[C@@H]1N=CO2

BIRTHDAY: 2018-11-19T08:16:08.981748
ATC: N05A
- NERVOUS SYSTEM
- PSYCHOLEPTICS
- ANTIPSYCHOTICS
Synthesis plan pending
FORMULA:C27H32N8O2

SMILES: Cc1noc(-c2ncc(N[C@@H](C)[C@]34C=CC=C[C@@]3(C)C=CN([C@@H]3C[C@H]5C=CCN3CC5)C4=O)c(N)n2)n1

BIRTHDAY: 2018-11-19T08:16:08.994000
ATC: S01E
- SENSORY ORGANS
- OPHTHALMOLOGICALS
- ANTIGLAUCOMA PREPARATIONS AND MIOTICS
Synthesis plan pending
FORMULA:C16H13F3N6O

SMILES: CONc1cc(Nc2ccc(C(F)(F)F)nc2)nc(-c2ccccn2)n1

BIRTHDAY: 2018-11-19T08:16:09.003863
ATC: V08C
- VARIOUS
- CONTRAST MEDIA
- MAGNETIC RESONANCE IMAGING CONTRAST MEDIA
Synthesis plan pending
FORMULA:C18H20N6O3

SMILES: N[C@]12C=CC=C[C@@]1([C@@]13NC=CC=C1N=C(C(=O)N1CCOCC1)N3)N=CO2

BIRTHDAY: 2018-11-19T08:16:09.025128
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis plan pending
FORMULA:C21H22ClN7O2

SMILES: Cc1noc(-c2ncc(N[C@H](C)[C@@H]3Cc4cc(Cl)ccc4N(C4CC4)C3=O)c(N)n2)n1

BIRTHDAY: 2018-11-19T08:16:09.035933
ATC: J05A
- ANTIINFECTIVES FOR SYSTEMIC USE
- ANTIVIRALS FOR SYSTEMIC USE
- DIRECT ACTING ANTIVIRALS
Synthesis plan pending
FORMULA:C20H19N7O2

SMILES: COc1cnccc1Nc1cncnc1-c1c(C#N)ccnc1N1CCC[C@H]1O

BIRTHDAY: 2018-11-19T08:16:09.046354
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis plan pending
FORMULA:C21H22ClN7O2

SMILES: Cc1noc(-c2ncc(N[C@@H](C)[C@@]34C=CC=C(Cl)C3=CN(C3CC3)C(=O)C4)c(N)n2)n1

BIRTHDAY: 2018-11-19T08:16:09.067130
ATC: J05A
- ANTIINFECTIVES FOR SYSTEMIC USE
- ANTIVIRALS FOR SYSTEMIC USE
- DIRECT ACTING ANTIVIRALS
Synthesis plan pending
FORMULA:C15H12F3N3OS

SMILES: N[C@]12C=CC([C@@]34SN=C[C@@H]3C=CC=C4C(F)(F)F)=C[C@@H]1N=CO2

BIRTHDAY: 2018-11-19T08:16:09.077065
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 pending
FORMULA:C21H22ClN7O2

SMILES: Cc1noc(-c2ncc(N[C@H](C)[C@@H]3C(=O)N(C4CC4)C=C4C=CC=C[C@]43Cl)c(N)n2)n1

BIRTHDAY: 2018-11-19T08:16:09.087915
ATC: V03A
- VARIOUS
- ALL OTHER THERAPEUTIC PRODUCTS
- ALL OTHER THERAPEUTIC PRODUCTS
Synthesis plan pending
FORMULA:C41H38N10O4

SMILES: Cc1noc(-c2c(N)ncnc2N[C@@H](C)c2cc3ccc4c(c3c(=O)n2C2CC2)COCc2cccc(c2)Nc2nccc(n2)-c2cccc(c2)OCC4)n1

BIRTHDAY: 2018-11-19T08:16:09.105740
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis plan pending
FORMULA:C19H23Cl2N7O

SMILES: CC(C)N(Cc1cc(Cl)cc(Cl)c1)c1nc(N2CCOCC2)nc2nc(N)[nH]c12

BIRTHDAY: 2018-11-19T08:16:09.116231
ATC: N07C
- NERVOUS SYSTEM
- OTHER NERVOUS SYSTEM DRUGS
- ANTIVERTIGO PREPARATIONS
Synthesis plan pending
FORMULA:C26H24N8O2

SMILES: COc1ccnc(Nc2c(-c3cnccc3C)ncnc2-c2nccc(C#N)c2N2CCC[C@H]2O)c1

BIRTHDAY: 2018-11-19T08:16:09.130009
ATC: N02C
- NERVOUS SYSTEM
- ANALGESICS
- ANTIMIGRAINE PREPARATIONS
Synthesis plan pending
FORMULA:C21H22ClN7O2

SMILES: Cc1noc(-c2ncc(N[C@@H](C)[C@]34CC(=O)N(C5CC5)C=C3C=CC=C4Cl)c(N)n2)n1

BIRTHDAY: 2018-11-19T08:16:09.152380
ATC: A08A
- ALIMENTARY TRACT AND METABOLISM
- ANTIOBESITY PREPARATIONS, EXCL. DIET PRODUCTS
- ANTIOBESITY PREPARATIONS, EXCL. DIET PRODUCTS
Synthesis plan pending
FORMULA:C29H22ClN7O

SMILES: C[C@@H](Nc1nc(N)nc2c(-c3ccc(Cl)cc3)cccc12)c1nc2ccccc2c(=O)n1-c1cccnc1

BIRTHDAY: 2018-11-19T08:16:09.164302
ATC: L01C
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- PLANT ALKALOIDS AND OTHER NATURAL PRODUCTS
Synthesis plan pending
FORMULA:C14H17N3O

SMILES: Nc1nc2cc(C34CCN(CC3)CC4)ccc2o1

BIRTHDAY: 2018-11-19T08:16:09.171605
ATC: R01A
- RESPIRATORY SYSTEM
- NASAL PREPARATIONS
- DECONGESTANTS AND OTHER NASAL PREPARATIONS FOR TOPICAL USE
Synthesis plan pending
FORMULA:C19H19N5O3

SMILES: N[C@@]12C=CC=C(c3cccn4c(C(=O)N5CCOCC5)cnc34)[C@@H]1OC=N2

BIRTHDAY: 2018-11-19T08:16:09.181228
ATC: M02A
- MUSCULO-SKELETAL SYSTEM
- TOPICAL PRODUCTS FOR JOINT AND MUSCULAR PAIN
- TOPICAL PRODUCTS FOR JOINT AND MUSCULAR PAIN
Synthesis plan pending
FORMULA:C22H18F3N3O4S

SMILES: O=C(c1nn(-c2ccc(C(F)(F)F)cc2)c2c1-c1ccccc1CS2(=O)=O)N1CCOCC1

BIRTHDAY: 2018-11-19T08:16:09.192606
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 pending
FORMULA:C24H25N5O3S

SMILES: CS(=O)(=O)Nc1ccccc1-c1c(-c2cccc3c2C=NCC3)ncnc1N1CCOCC1

BIRTHDAY: 2018-11-19T08:16:09.205444
ATC: M03C
- MUSCULO-SKELETAL SYSTEM
- MUSCLE RELAXANTS
- MUSCLE RELAXANTS, DIRECTLY ACTING AGENTS
Synthesis plan pending
FORMULA:C18H22Cl2N6O2

SMILES: CC(C)N(Cc1cc(Cl)cc(Cl)c1)c1cnc(C(=O)N[C@@H](C)C(N)=O)nc1N

BIRTHDAY: 2018-11-19T08:16:09.215714
ATC: P01B
- ANTIPARASITIC PRODUCTS, INSECTICIDES AND REPELLENTS
- ANTIPROTOZOALS
- ANTIMALARIALS
Synthesis plan pending
FORMULA:C16H17F3N4O3S

SMILES: CS(=O)(=O)Nc1cccc(-c2c(N3CCOCC3)ncnc2C(F)(F)F)c1

BIRTHDAY: 2018-11-19T08:16:09.226153
ATC: C10A
- CARDIOVASCULAR SYSTEM
- LIPID MODIFYING AGENTS
- LIPID MODIFYING AGENTS, PLAIN
Synthesis plan pending
FORMULA:C21H22ClN7O2

SMILES: Cc1noc(-c2ncc(N[C@H](C)[C@@H]3CN(C4CC4)c4ccc(Cl)cc4C3=O)c(N)n2)n1

BIRTHDAY: 2018-11-19T08:16:09.248311
ATC: L01C
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- PLANT ALKALOIDS AND OTHER NATURAL PRODUCTS
Synthesis plan pending
FORMULA:C20H19N7O2

SMILES: COc1cnccc1Nc1cncnc1-c1ccnc(C#N)c1N1CCC[C@@H]1O

BIRTHDAY: 2018-11-19T08:16:09.258634
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis plan pending
FORMULA:C21H22ClN7O2

SMILES: Cc1noc(-c2ncc(N[C@H](C)[C@@]34C=CC=C[C@]3(Cl)C=CN(C3CC3)C4=O)c(N)n2)n1

BIRTHDAY: 2018-11-19T08:16:09.270329
ATC: V03A
- VARIOUS
- ALL OTHER THERAPEUTIC PRODUCTS
- ALL OTHER THERAPEUTIC PRODUCTS
Synthesis plan pending
FORMULA:C22H18F3N3O4S

SMILES: O=C(c1nn(-c2ccccc2C(F)(F)F)c2c1-c1ccccc1CS2(=O)=O)N1CCOCC1

BIRTHDAY: 2018-11-19T08:16:09.282017
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 pending
FORMULA:C24H24ClN9O3

SMILES: Cc1noc(-c2ncc(N[C@@H](C)[C@]34C=C(Cl)C=CC3=CN[C@@]3(C4=O)[C@@H]4C[C@@]45NC[C@H]3NC5=O)c(N)n2)n1

BIRTHDAY: 2018-11-19T08:16:09.295973
ATC: C03B
- CARDIOVASCULAR SYSTEM
- DIURETICS
- LOW-CEILING DIURETICS, EXCL. THIAZIDES
Synthesis plan pending
FORMULA:C11H11Cl2N3O3S

SMILES: CS(=O)(=O)N[C@H](C(=O)NCC#N)c1cc(Cl)cc(Cl)c1

BIRTHDAY: 2018-11-19T08:16:09.304779
ATC: M03A
- MUSCULO-SKELETAL SYSTEM
- MUSCLE RELAXANTS
- MUSCLE RELAXANTS, PERIPHERALLY ACTING AGENTS
Synthesis plan pending
FORMULA:C24H24N10O6

SMILES: Cc1noc(-c2cc(N[C@@H](C)C3=CN4C=COC(=O)C=CCOc5cnc(O)c(n5)N[C@H]4CC3=O)nc(N)n2)n1

BIRTHDAY: 2018-11-19T08:16:09.330522
ATC: L01D
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- CYTOTOXIC ANTIBIOTICS AND RELATED SUBSTANCES
Synthesis plan pending
FORMULA:C31H35N5O6S

SMILES: O=C(c1ccc(N2CCOCC2)cc1)N1CCC[C@@H](n2nc(C(=O)N3CCOCC3)c3c2-c2ccccc2S(=O)(=O)C3)C1

BIRTHDAY: 2018-11-19T08:16:09.365796
ATC: M01A
- MUSCULO-SKELETAL SYSTEM
- ANTIINFLAMMATORY AND ANTIRHEUMATIC PRODUCTS
- ANTIINFLAMMATORY AND ANTIRHEUMATIC PRODUCTS, NON-STEROIDS
Synthesis plan pending
FORMULA:C21H22ClN7O2

SMILES: Cc1noc(-c2ncc(N[C@H](C)[C@@]34C=CC(Cl)=CC3=CN(C3CC3)CC4=O)c(N)n2)n1

BIRTHDAY: 2018-11-19T08:16:09.377573
ATC: N06B
- NERVOUS SYSTEM
- PSYCHOANALEPTICS
- PSYCHOSTIMULANTS, AGENTS USED FOR ADHD AND NOOTROPICS
Synthesis plan pending
FORMULA:C18H20N6O3

SMILES: N[C@@]12OC=N[C@H]1C=CC=C2[C@@]12N=C(C(=O)N3CCOCC3)NC1=CC=CN2

BIRTHDAY: 2018-11-19T08:16:09.388184
ATC: C07A
- CARDIOVASCULAR SYSTEM
- BETA BLOCKING AGENTS
- BETA BLOCKING AGENTS
Synthesis plan pending
FORMULA:C17H22N6O3

SMILES: CC(C)[C@H](N)C(=O)N1CNC=CO[C@H](C#N)C=CCOc2cncc1n2

BIRTHDAY: 2018-11-30T17:24:30.570933
ATC: A10B
- ALIMENTARY TRACT AND METABOLISM
- DRUGS USED IN DIABETES
- BLOOD GLUCOSE LOWERING DRUGS, EXCL. INSULINS
Synthesis Plan
FORMULA:C19H24Cl2N4O

SMILES: Cc1cc(N2CCOCC2)nc(N(Cc2ccc(Cl)c(Cl)c2)C(C)C)n1

BIRTHDAY: 2018-11-30T17:24:30.579682
ATC: A08A
- ALIMENTARY TRACT AND METABOLISM
- ANTIOBESITY PREPARATIONS, EXCL. DIET PRODUCTS
- ANTIOBESITY PREPARATIONS, EXCL. DIET PRODUCTS
Synthesis Plan
FORMULA:C21H22ClN7O2

SMILES: Cc1noc(-c2ncc(N[C@H](C)[C@@]34C(=O)CN(C5CC5)C=C3C=CC=C4Cl)c(N)n2)n1

BIRTHDAY: 2018-11-30T17:24:30.601649
ATC: N06B
- NERVOUS SYSTEM
- PSYCHOANALEPTICS
- PSYCHOSTIMULANTS, AGENTS USED FOR ADHD AND NOOTROPICS
Synthesis Plan
FORMULA:C16H17F3N4O3S

SMILES: CS(=O)(=O)Nc1ccccc1-c1c(N2CCOCC2)ncnc1C(F)(F)F

BIRTHDAY: 2018-11-30T17:24:30.656421
ATC: C10A
- CARDIOVASCULAR SYSTEM
- LIPID MODIFYING AGENTS
- LIPID MODIFYING AGENTS, PLAIN
Synthesis Plan
FORMULA:C21H22ClN7O2

SMILES: Cc1noc(-c2ncc(N[C@H](C)[C@@]34C=CC(Cl)=CC3=CN(C3CC3)C(=O)C4)c(N)n2)n1

BIRTHDAY: 2018-11-30T17:24:30.667146
ATC: N07C
- NERVOUS SYSTEM
- OTHER NERVOUS SYSTEM DRUGS
- ANTIVERTIGO PREPARATIONS
Synthesis Plan
FORMULA:C20H25N7O

SMILES: CC(C)NC(=O)[C@H](Nc1cnc(-n2nccc2-c2ccccn2)nc1)C(C)C

BIRTHDAY: 2018-12-02T16:07:39.732710
ATC: J05A
- ANTIINFECTIVES FOR SYSTEMIC USE
- ANTIVIRALS FOR SYSTEMIC USE
- DIRECT ACTING ANTIVIRALS
Synthesis Plan
FORMULA:C21H22ClN7O2

SMILES: Cc1noc(-c2ncc(N[C@@H](C)[C@@H]3C(=O)CN(C4CC4)c4ccc(Cl)cc43)c(N)n2)n1

BIRTHDAY: 2018-12-02T16:07:39.776897
ATC: J05A
- ANTIINFECTIVES FOR SYSTEMIC USE
- ANTIVIRALS FOR SYSTEMIC USE
- DIRECT ACTING ANTIVIRALS
Synthesis Plan
FORMULA:C18H20N6O3

SMILES: N[C@]12C=CC=C[C@@]1(C1=CN[C@H]3N=C(C(=O)N4CCOCC4)NC3=C1)OC=N2

BIRTHDAY: 2018-12-02T16:07:39.829471
ATC: M01A
- MUSCULO-SKELETAL SYSTEM
- ANTIINFLAMMATORY AND ANTIRHEUMATIC PRODUCTS
- ANTIINFLAMMATORY AND ANTIRHEUMATIC PRODUCTS, NON-STEROIDS
Synthesis Plan
FORMULA:C21H22ClN7O2

SMILES: Cc1noc(-c2ncc(N[C@@H](C)[C@H]3C(=O)CN(C4CC4)c4ccc(Cl)cc43)c(N)n2)n1

BIRTHDAY: 2018-12-02T16:07:39.840146
ATC: J05A
- ANTIINFECTIVES FOR SYSTEMIC USE
- ANTIVIRALS FOR SYSTEMIC USE
- DIRECT ACTING ANTIVIRALS
Synthesis Plan
FORMULA:C21H22ClN7O2

SMILES: Cc1noc(-c2ncc(N[C@H](C)[C@@]34C=CC=C(Cl)[C@@H]3N(C3CC3)C=CC4=O)c(N)n2)n1

BIRTHDAY: 2018-12-02T16:07:39.851562
ATC: J04A
- ANTIINFECTIVES FOR SYSTEMIC USE
- ANTIMYCOBACTERIALS
- DRUGS FOR TREATMENT OF TUBERCULOSIS
Synthesis Plan
FORMULA:C23H25N5O3S

SMILES: CS(=O)(=O)Nc1ccccc1-c1c(-c2cccc3c2NCC3)ncnc1N1CCOCC1

BIRTHDAY: 2018-12-02T16:07:39.875387
ATC: N06A
- NERVOUS SYSTEM
- PSYCHOANALEPTICS
- ANTIDEPRESSANTS
Synthesis Plan
FORMULA:C21H20N4O2S2

SMILES: [O-]/[S+]=C\N1CC2=COc3ccccc3NCCN3Cc4cccc(c4S3)C(=N2)C1

BIRTHDAY: 2018-12-02T16:07:39.885640
ATC: A03F
- ALIMENTARY TRACT AND METABOLISM
- DRUGS FOR FUNCTIONAL GASTROINTESTINAL DISORDERS
- PROPULSIVES
Synthesis Plan
FORMULA:C21H22ClN7O2

SMILES: Cc1noc(-c2ncc(N[C@H](C)[C@]34C=CC=C[C@@]3(Cl)C(=O)N(C3CC3)C=C4)c(N)n2)n1

BIRTHDAY: 2018-12-03T10:44:00.773461
ATC: N04A
- NERVOUS SYSTEM
- ANTI-PARKINSON DRUGS
- ANTICHOLINERGIC AGENTS
Synthesis Plan
FORMULA:C38H35N7O2

SMILES: Nc1nc2cc(-c3ccn4c([C@@H]5CCNCc6cccc(c6)Oc6ccc7cccc(c7c6)N6CC[C@H](C6)N5)cnc4c3)ccc2o1

BIRTHDAY: 2018-12-03T10:44:00.787002
ATC: N06A
- NERVOUS SYSTEM
- PSYCHOANALEPTICS
- ANTIDEPRESSANTS
Synthesis Plan
FORMULA:C27H41N11O4

SMILES: Cc1nc(-c2nc(N[C@H](C)[C@H]3C=CN(C4CC4)[C@]4(NCCNCCNCCNCCCOC4=O)C3=O)ncc2N)no1

BIRTHDAY: 2018-12-03T10:44:00.801996
ATC: S01L
- SENSORY ORGANS
- OPHTHALMOLOGICALS
- OCULAR VASCULAR DISORDER AGENTS
Synthesis Plan
FORMULA:C21H22ClN7O2

SMILES: Cc1noc(-c2ncc(N[C@@H](C)[C@@H]3CC(=O)N(C4CC4)c4ccc(Cl)cc43)c(N)n2)n1

BIRTHDAY: 2018-12-03T10:44:00.812658
ATC: J05A
- ANTIINFECTIVES FOR SYSTEMIC USE
- ANTIVIRALS FOR SYSTEMIC USE
- DIRECT ACTING ANTIVIRALS
Synthesis Plan
FORMULA:C21H25N7O2

SMILES: c1cc2c(c(-c3nc4nc(N5CCOCC5)nc(N5CCOCC5)c4[nH]3)c1)NCC2

BIRTHDAY: 2018-12-03T10:44:00.823041
ATC: C05A
- CARDIOVASCULAR SYSTEM
- VASOPROTECTIVES
- AGENTS FOR TREATMENT OF HEMORRHOIDS AND ANAL FISSURES FOR TOPICAL USE
Synthesis Plan
FORMULA:C15H12Cl2N4O3S

SMILES: N#CCNC(=O)[C@@H](NS(=O)(=O)c1cccnc1)c1ccc(Cl)c(Cl)c1

BIRTHDAY: 2018-12-03T10:44:00.832860
ATC: C08C
- CARDIOVASCULAR SYSTEM
- CALCIUM CHANNEL BLOCKERS
- SELECTIVE CALCIUM CHANNEL BLOCKERS WITH MAINLY VASCULAR EFFECTS
Synthesis Plan
FORMULA:C18H20N6O3

SMILES: N[C@@]12C=CC=C[C@@]1([C@@H]1NC=Cc3[nH]c(C(=O)N4CCOCC4)nc31)OC=N2

BIRTHDAY: 2018-12-03T10:44:00.855583
ATC: P01B
- ANTIPARASITIC PRODUCTS, INSECTICIDES AND REPELLENTS
- ANTIPROTOZOALS
- ANTIMALARIALS
Synthesis Plan
FORMULA:C23H23ClN4O3

SMILES: COc1cccc(-c2nc(NCc3ccc(Cl)cc3)ncc2C(=O)N2CCOCC2)c1

BIRTHDAY: 2018-12-03T10:44:00.865530
ATC: C01B
- CARDIOVASCULAR SYSTEM
- CARDIAC THERAPY
- ANTIARRHYTHMICS, CLASS I AND III
Synthesis Plan
FORMULA:C19H25Cl2N5O

SMILES: CC(C)CNC(=O)c1cc(N(Cc2ccc(Cl)cc2Cl)C(C)C)nc(N)n1

BIRTHDAY: 2018-12-03T19:12:26.592268
ATC: R02A
- RESPIRATORY SYSTEM
- THROAT PREPARATIONS
- THROAT PREPARATIONS
Synthesis Plan
FORMULA:C18H20N6O3

SMILES: N[C@]12C=CC=C[C@]1(C1=CN[C@]3(C(=O)N4CCOCC4)N=CNC3=C1)N=CO2

BIRTHDAY: 2018-12-03T19:12:26.668494
ATC: J05A
- ANTIINFECTIVES FOR SYSTEMIC USE
- ANTIVIRALS FOR SYSTEMIC USE
- DIRECT ACTING ANTIVIRALS
Synthesis Plan
FORMULA:C17H18N5O4P

SMILES: COc1cncc(N[C@H]2COPO[C@H]2C(=O)Nc2nccc3cc[nH]c23)c1

BIRTHDAY: 2018-12-03T19:12:26.678504
ATC: C07A
- CARDIOVASCULAR SYSTEM
- BETA BLOCKING AGENTS
- BETA BLOCKING AGENTS
Synthesis Plan
FORMULA:C20H19N7O2

SMILES: COc1cnccc1Nc1cncnc1-c1ccnc(C#N)c1N1CCC[C@H]1O

BIRTHDAY: 2018-12-03T19:12:26.688786
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C20H19N7O2

SMILES: COc1ccnc(Nc2cncnc2-c2c(C#N)cncc2N2CCC[C@@H]2O)c1

BIRTHDAY: 2018-12-01T22:31:32.018398
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C19H17N5O3

SMILES: Nc1nc2cc(-c3ccn4cc(C(=O)N5CCOCC5)nc4c3)ccc2o1

BIRTHDAY: 2018-12-01T22:31:32.048315
ATC: C01B
- CARDIOVASCULAR SYSTEM
- CARDIAC THERAPY
- ANTIARRHYTHMICS, CLASS I AND III
Synthesis Plan
FORMULA:C18H17N7O2

SMILES: C[C@@]1(c2cnc3cc(-c4ccc5nc(N)oc5c4)ccn23)NCNC(=O)N1

BIRTHDAY: 2018-12-01T22:31:32.069361
ATC: N01A
- NERVOUS SYSTEM
- ANESTHETICS
- ANESTHETICS, GENERAL
Synthesis Plan
FORMULA:C13H9F2N3O3

SMILES: Nc1nc2cc(C3=CNCC4=C3OC(F)(F)O4)ccc2o1

BIRTHDAY: 2018-12-01T22:31:32.109902
ATC: C10A
- CARDIOVASCULAR SYSTEM
- LIPID MODIFYING AGENTS
- LIPID MODIFYING AGENTS, PLAIN
Synthesis Plan
FORMULA:C18H20N6O3

SMILES: N[C@]12OC=N[C@@H]1C=CC=C2[C@]12N=C(C(=O)N3CCOCC3)NC1=CC=CN2

BIRTHDAY: 2018-12-01T22:31:32.120292
ATC: C07A
- CARDIOVASCULAR SYSTEM
- BETA BLOCKING AGENTS
- BETA BLOCKING AGENTS
Synthesis Plan
FORMULA:C16H16N4O2

SMILES: N[C@]12C=CC=C[C@]1([C@H]1NC(=O)N1Cc1ccccc1)N=CO2

BIRTHDAY: 2018-12-01T22:31:32.171975
ATC: D01A
- DERMATOLOGICALS
- ANTIFUNGALS FOR DERMATOLOGICAL USE
- ANTIFUNGALS FOR TOPICAL USE
Synthesis Plan