matter.farm

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

These compounds may interact with:

Cyclin-dependent-like kinase 5

Potentially involved in: lissencephaly; neurodegenerative disease; alzheimer's disease; toxic encephalopathy; amyotrophic lateral sclerosis; parkinson's disease; cancer; dementia; brain disease; arthrogryposis; hirsutism; lymphedema; micrognathism; schizophrenia; agenesis of corpus callosum; absent reflex; clenched hands; lymphatic obstruction; mandibular hypoplasia; reflex, deep tendon, absent

Disease data sourced from Pharos.

Inhibitor

FORMULA:C33H47N7O5

SMILES: CC(C)CC(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CO)C(=O)Nc1cc2ccc1CCc1ccc(cc1)CC2

BIRTHDAY: 2018-12-01T14:10:48.068980
ATC: D11A
- DERMATOLOGICALS
- OTHER DERMATOLOGICAL PREPARATIONS
- OTHER DERMATOLOGICAL PREPARATIONS
Synthesis Plan
FORMULA:C23H26F3N7

SMILES: CC(C)N1C=N[C@]2(NCc3cccc(-c4ccncc4)c3)N=CN=C[C@]12N[C@H](C)C(F)(F)F

BIRTHDAY: 2018-12-01T14:10:48.082657
ATC: H01C
- SYSTEMIC HORMONAL PREPARATIONS, EXCL. SEX HORMONES AND INSULINS
- PITUITARY AND HYPOTHALAMIC HORMONES AND ANALOGUES
- HYPOTHALAMIC HORMONES
Synthesis Plan
FORMULA:C18H30N6O2

SMILES: CC(C)CC(=O)Nc1n[nH]c2c1N(C(=O)[C@]1(N)CCCNC1)C(C)(C)C2

BIRTHDAY: 2018-12-01T14:10:48.092142
ATC: L01C
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- PLANT ALKALOIDS AND OTHER NATURAL PRODUCTS
Synthesis Plan
FORMULA:C23H15ClN4O

SMILES: O=C(Nc1ccc2nc3c[nH]c(-c4ccc(Cl)cc4)cc-3c2c1)c1cccnc1

BIRTHDAY: 2018-12-01T14:10:48.101346
ATC: V09A
- VARIOUS
- DIAGNOSTIC RADIOPHARMACEUTICALS
- CENTRAL NERVOUS SYSTEM
Synthesis Plan
FORMULA:C26H26N2O4

SMILES: C=C(C(=O)Nc1cccc(C(=O)Nc2cccc(C(C)C)c2)c1)c1cccc(O)c1OC

BIRTHDAY: 2018-12-01T14:10:48.110491
ATC: C10A
- CARDIOVASCULAR SYSTEM
- LIPID MODIFYING AGENTS
- LIPID MODIFYING AGENTS, PLAIN
Synthesis Plan
FORMULA:C18H24N6O4S

SMILES: COc1cccc(-c2nnc3c(C)nn(C)c3n2)c1S(=O)(=O)NCC(C)(C)CO

BIRTHDAY: 2018-12-01T14:10:48.121139
ATC: C03D
- CARDIOVASCULAR SYSTEM
- DIURETICS
- POTASSIUM-SPARING AGENTS
Synthesis Plan
FORMULA:C20H14FN5O

SMILES: O=C(Nc1cc(-c2ccccn2)n[nH]1)c1ccc(-c2cccnc2)cc1F

BIRTHDAY: 2018-12-01T14:10:48.130542
ATC: J05A
- ANTIINFECTIVES FOR SYSTEMIC USE
- ANTIVIRALS FOR SYSTEMIC USE
- DIRECT ACTING ANTIVIRALS
Synthesis Plan
FORMULA:C10H17N5O2

SMILES: CC(C)CC(=O)N[C@@H](C)C(=O)NC1=NN=NC1

BIRTHDAY: 2018-12-01T14:10:48.138387
ATC: D11A
- DERMATOLOGICALS
- OTHER DERMATOLOGICAL PREPARATIONS
- OTHER DERMATOLOGICAL PREPARATIONS
Synthesis Plan
FORMULA:C19H27N7O

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

BIRTHDAY: 2018-12-01T14:10:48.147721
ATC: A10B
- ALIMENTARY TRACT AND METABOLISM
- DRUGS USED IN DIABETES
- BLOOD GLUCOSE LOWERING DRUGS, EXCL. INSULINS
Synthesis Plan
FORMULA:C26H26N2O4

SMILES: COc1cc(/C=C/C(=O)Nc2ccccc2C(=O)Nc2ccc(C(C)C)cc2)ccc1O

BIRTHDAY: 2018-12-01T14:10:48.157225
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C23H21NO2

SMILES: COc1ccc(/C=C2\N=C3C=CC=C(C)[C@H]3c3ccccc32)cc1OC

BIRTHDAY: 2018-12-01T14:10:48.165038
ATC: C07A
- CARDIOVASCULAR SYSTEM
- BETA BLOCKING AGENTS
- BETA BLOCKING AGENTS
Synthesis Plan
FORMULA:C19H36N4O6

SMILES: CC(C)CC(=O)N[C@H](C)C(=O)N[C@H](CCCCO)C(=O)N[C@H](CCCO)C(N)=O

BIRTHDAY: 2018-12-01T14:10:48.174699
ATC: L03A
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- IMMUNOSTIMULANTS
- IMMUNOSTIMULANTS
Synthesis Plan
FORMULA:C26H42N4O2

SMILES: COc1cccc(CC(=O)Nc2nn(C(C)(C)C(C)(C)CNC(C)C)cc2C(C)(C)C)c1

BIRTHDAY: 2018-12-01T14:10:48.183940
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: 2018-12-01T14:10:48.195716
ATC: G02A
- GENITO URINARY SYSTEM AND SEX HORMONES
- OTHER GYNECOLOGICALS
- UTEROTONICS
Synthesis Plan
FORMULA:C20H38N8O7

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

BIRTHDAY: 2018-12-01T14:10:48.207765
ATC: G02A
- GENITO URINARY SYSTEM AND SEX HORMONES
- OTHER GYNECOLOGICALS
- UTEROTONICS
Synthesis Plan
FORMULA:C25H26N2O3

SMILES: COc1ccccc1C(=O)Nc1ccccc1C(=O)Nc1ccc(C(C)(C)C)cc1

BIRTHDAY: 2018-12-01T14:10:48.216476
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C25H27N3O

SMILES: CN(C)C(C)(C)NC(=O)c1cccc2c1[C@]1(c3ccccc3)C=CC=CC1=NC2

BIRTHDAY: 2018-12-01T14:10:48.225810
ATC: G01A
- GENITO URINARY SYSTEM AND SEX HORMONES
- GYNECOLOGICAL ANTIINFECTIVES AND ANTISEPTICS
- ANTIINFECTIVES AND ANTISEPTICS, EXCL. COMBINATIONS WITH CORTICOSTEROIDS
Synthesis Plan
FORMULA:C23H24F3N7

SMILES: CC(C)n1cnc2c(NCc3ccc(-c4ccccn4)cc3)nc(NCCC(F)(F)F)nc21

BIRTHDAY: 2018-12-25T02:02:50.893221
ATC: N05B
- NERVOUS SYSTEM
- PSYCHOLEPTICS
- ANXIOLYTICS
Synthesis Plan
FORMULA:C19H31N5O2

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

BIRTHDAY: 2018-12-25T02:02:50.902337
ATC: C02B
- CARDIOVASCULAR SYSTEM
- ANTIHYPERTENSIVES
- ANTIADRENERGIC AGENTS, GANGLION-BLOCKING
Synthesis Plan
FORMULA:C44H36N6O4

SMILES: COc1ccc(/C=C/C(=O)Nc2ccc(C(=O)Nc3ccc4c(c3)COCc3cccc(c3)Nc3nccc(n3)-c3ccc5ccn(c5c3)C4)cc2)cc1

BIRTHDAY: 2018-12-25T02:02:50.917577
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C18H24N6O4S

SMILES: COc1ccc(S(=O)(=O)NCC(C)(C)CO)cc1-c1nnc2c(n1)c(C)nn2C

BIRTHDAY: 2018-12-25T02:02:50.927911
ATC: C05B
- CARDIOVASCULAR SYSTEM
- VASOPROTECTIVES
- ANTIVARICOSE THERAPY
Synthesis Plan
FORMULA:C19H27N7O

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

BIRTHDAY: 2018-12-25T02:02:50.937353
ATC: L01A
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- ALKYLATING AGENTS
Synthesis Plan
FORMULA:C26H42N4O2

SMILES: COc1cccc(CC(=O)Nc2cn(C(C)(C)C(C)(C)CNC(C)C)nc2C(C)(C)C)c1

BIRTHDAY: 2018-12-25T02:02:50.946798
ATC: A10B
- ALIMENTARY TRACT AND METABOLISM
- DRUGS USED IN DIABETES
- BLOOD GLUCOSE LOWERING DRUGS, EXCL. INSULINS
Synthesis Plan
FORMULA:C26H26N2O4

SMILES: COc1cc(/C=C\C(=O)Nc2ccccc2C(=O)Nc2ccc(C(C)C)cc2)ccc1O

BIRTHDAY: 2018-12-25T02:02:50.956104
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C46H54N10O4

SMILES: COc1cccc([C@@]2(NC(=O)N[C@H]3CN4C=C(C=CC5=CN(CCNCCN3)[C@@H](O)C5)CC4)NCC=CCOCc3cccc(c3)-c3ccnc(n3)Nc3cccc2c3)c1

BIRTHDAY: 2018-12-25T02:02:50.977736
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C20H38N8O7

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

BIRTHDAY: 2018-12-25T02:02:50.990027
ATC: V04C
- VARIOUS
- DIAGNOSTIC AGENTS
- OTHER DIAGNOSTIC AGENTS
Synthesis Plan
FORMULA:C26H26N2O4

SMILES: C=C(C(=O)Nc1cccc(C(=O)Nc2ccccc2C(C)C)c1)c1cc(O)cc(OC)c1

BIRTHDAY: 2018-12-25T02:02:50.999550
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: 2018-12-25T02:02:51.011536
ATC: G02A
- GENITO URINARY SYSTEM AND SEX HORMONES
- OTHER GYNECOLOGICALS
- UTEROTONICS
Synthesis Plan
FORMULA:C21H20N6O3

SMILES: C=CC(=O)N1C=C[C@H]2C[C@@H]1Oc1c(OC)ccc(-c3nnc4c(C)nn(C)c4n3)c12

BIRTHDAY: 2018-12-25T02:02:51.031718
ATC: B03B
- BLOOD AND BLOOD FORMING ORGANS
- ANTIANEMIC PREPARATIONS
- VITAMIN B12 AND FOLIC ACID
Synthesis Plan
FORMULA:C16H14O6

SMILES: COc1cc(/C=C\C(=O)c2cc(O)c(O)c(O)c2)ccc1O

BIRTHDAY: 2018-12-25T02:02:51.039653
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:C20H38N8O7

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

BIRTHDAY: 2018-12-25T02:02:51.051989
ATC: G02A
- GENITO URINARY SYSTEM AND SEX HORMONES
- OTHER GYNECOLOGICALS
- UTEROTONICS
Synthesis Plan
FORMULA:C17H28N2O5

SMILES: CC(C)CC(=O)N[C@@H](C)C(=O)N1CCC[C@H]2CCO[C@]1(C(=O)O)C2

BIRTHDAY: 2018-12-25T02:02:51.061052
ATC: A16A
- ALIMENTARY TRACT AND METABOLISM
- OTHER ALIMENTARY TRACT AND METABOLISM PRODUCTS
- OTHER ALIMENTARY TRACT AND METABOLISM PRODUCTS
Synthesis Plan
FORMULA:C24H24N2O3

SMILES: COc1ccccc1C(=O)Nc1cccc(C(=O)Nc2cccc(C(C)C)c2)c1

BIRTHDAY: 2018-12-25T02:02:51.069589
ATC: S01X
- SENSORY ORGANS
- OPHTHALMOLOGICALS
- OTHER OPHTHALMOLOGICALS
Synthesis Plan
FORMULA:C20H35N7O2

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

BIRTHDAY: 2018-12-25T02:02:51.079671
ATC: B05A
- BLOOD AND BLOOD FORMING ORGANS
- BLOOD SUBSTITUTES AND PERFUSION SOLUTIONS
- BLOOD AND RELATED PRODUCTS
Synthesis Plan
FORMULA:C18H33N3O3

SMILES: CC(C)CC(=O)N[C@@H](C)C(=O)N[C@@H](C)[C@@]1(C)C[C@H]2CCO[C@H](C2)N1

BIRTHDAY: 2018-12-25T02:02:51.088082
ATC: L01A
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- ALKYLATING AGENTS
Synthesis Plan
FORMULA:C20H38N8O7

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

BIRTHDAY: 2018-12-25T02:02:51.100444
ATC: G02A
- GENITO URINARY SYSTEM AND SEX HORMONES
- OTHER GYNECOLOGICALS
- UTEROTONICS
Synthesis Plan
FORMULA:C19H27N7O

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

BIRTHDAY: 2018-12-03T02:38:54.913221
ATC: A10B
- ALIMENTARY TRACT AND METABOLISM
- DRUGS USED IN DIABETES
- BLOOD GLUCOSE LOWERING DRUGS, EXCL. INSULINS
Synthesis Plan
FORMULA:C19H27N7O

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

BIRTHDAY: 2018-12-03T02:38:54.922773
ATC: L01A
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- ALKYLATING AGENTS
Synthesis Plan
FORMULA:C29H31FN4O2

SMILES: O=C(Nc1ccccc1C(=O)NCc1ccccc1)Nc1ccccc1[C@]1(F)C2CCCN1CCC2

BIRTHDAY: 2018-12-03T02:38:54.934225
ATC: N02B
- NERVOUS SYSTEM
- ANALGESICS
- OTHER ANALGESICS AND ANTIPYRETICS
Synthesis Plan
FORMULA:C17H32N4O6

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

BIRTHDAY: 2018-12-03T02:38:54.943915
ATC: J01E
- ANTIINFECTIVES FOR SYSTEMIC USE
- ANTIBACTERIALS FOR SYSTEMIC USE
- SULFONAMIDES AND TRIMETHOPRIM
Synthesis Plan
FORMULA:C22H18F3N3O2

SMILES: O=C(Nc1ccc(C(=O)NCc2ccccc2)cc1)Nc1cccc(C(F)(F)F)c1

BIRTHDAY: 2018-12-03T02:38:54.953273
ATC: N03A
- NERVOUS SYSTEM
- ANTIEPILEPTICS
- ANTIEPILEPTICS
Synthesis Plan
FORMULA:C20H38N8O7

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

BIRTHDAY: 2018-12-03T02:38:54.974974
ATC: V04C
- VARIOUS
- DIAGNOSTIC AGENTS
- OTHER DIAGNOSTIC AGENTS
Synthesis Plan
FORMULA:C20H21N5O

SMILES: COc1ccccc1[C@H]1N([C@@H](C)c2ccccc2)N=C2N=CN=C[C@@]21N

BIRTHDAY: 2018-12-03T02:38:54.993845
ATC: M01A
- MUSCULO-SKELETAL SYSTEM
- ANTIINFLAMMATORY AND ANTIRHEUMATIC PRODUCTS
- ANTIINFLAMMATORY AND ANTIRHEUMATIC PRODUCTS, NON-STEROIDS
Synthesis Plan
FORMULA:C26H34N8

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

BIRTHDAY: 2018-12-03T02:38:55.005774
ATC: G02A
- GENITO URINARY SYSTEM AND SEX HORMONES
- OTHER GYNECOLOGICALS
- UTEROTONICS
Synthesis Plan
FORMULA:C25H26N2O3

SMILES: COc1ccc(C(=O)Nc2cccc(C(=O)Nc3ccc(C(C)(C)C)cc3)c2)cc1

BIRTHDAY: 2018-12-03T02:38:55.014406
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C30H30N2O2

SMILES: COc1ccc(/C=C\c2c3c4ccccc4n2CCCCc2ccccc2NC(=O)CC3)cc1

BIRTHDAY: 2018-12-03T02:38:55.025592
ATC: B02A
- BLOOD AND BLOOD FORMING ORGANS
- ANTIHEMORRHAGICS
- ANTIFIBRINOLYTICS
Synthesis Plan
FORMULA:C20H29N7O

SMILES: CC(C)C[C@H](CO)Nc1nc(NCc2ccncc2)c2ncn(C(C)C)c2n1

BIRTHDAY: 2018-12-03T02:38:55.047360
ATC: A03F
- ALIMENTARY TRACT AND METABOLISM
- DRUGS FOR FUNCTIONAL GASTROINTESTINAL DISORDERS
- PROPULSIVES
Synthesis Plan
FORMULA:C24H25F3O

SMILES: C=C(c1ccccc1Oc1ccccc1C(F)(F)F)[C@@H]1CC=CCCCCC1

BIRTHDAY: 2018-12-03T02:38:55.055774
ATC: C10A
- CARDIOVASCULAR SYSTEM
- LIPID MODIFYING AGENTS
- LIPID MODIFYING AGENTS, PLAIN
Synthesis Plan
FORMULA:C23H34O7

SMILES: C=C(C(=O)OC(C)(C)C(C)(C)C(C)(C)CC(=O)O[C@@H](C)O)c1cccc(O)c1OC

BIRTHDAY: 2018-12-03T02:38:55.064773
ATC: N06A
- NERVOUS SYSTEM
- PSYCHOANALEPTICS
- ANTIDEPRESSANTS
Synthesis Plan
FORMULA:C18H34N4O6

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

BIRTHDAY: 2018-12-03T02:38:55.074779
ATC: D07A
- DERMATOLOGICALS
- CORTICOSTEROIDS, DERMATOLOGICAL PREPARATIONS
- CORTICOSTEROIDS, PLAIN
Synthesis Plan
FORMULA:C26H26N2O3

SMILES: C=C(C(=O)Nc1ccc(C(=O)Nc2ccccc2C(C)C)cc1)c1ccccc1OC

BIRTHDAY: 2018-12-03T02:38:55.083743
ATC: P01A
- ANTIPARASITIC PRODUCTS, INSECTICIDES AND REPELLENTS
- ANTIPROTOZOALS
- AGENTS AGAINST AMOEBIASIS AND OTHER PROTOZOAL DISEASES
Synthesis Plan
FORMULA:C26H33N7O

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

BIRTHDAY: 2018-12-03T02:38:55.095638
ATC: C08D
- CARDIOVASCULAR SYSTEM
- CALCIUM CHANNEL BLOCKERS
- SELECTIVE CALCIUM CHANNEL BLOCKERS WITH DIRECT CARDIAC EFFECTS
Synthesis Plan
FORMULA:C23H36N6O6

SMILES: CC(C)CC(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCc1cccnc1)C(N)=O

BIRTHDAY: 2018-11-30T03:40:51.933016
ATC: D07A
- DERMATOLOGICALS
- CORTICOSTEROIDS, DERMATOLOGICAL PREPARATIONS
- CORTICOSTEROIDS, PLAIN
Synthesis Plan
FORMULA:C25H22N4O4

SMILES: C=C(C)NC(=O)c1ccc(NC(=O)c2ccc(NC(=O)c3cccc(NC=O)c3)cc2)cc1

BIRTHDAY: 2018-11-30T03:40:51.943478
ATC: N02B
- NERVOUS SYSTEM
- ANALGESICS
- OTHER ANALGESICS AND ANTIPYRETICS
Synthesis Plan
FORMULA:C20H38N8O7

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

BIRTHDAY: 2018-11-30T03:40:51.955741
ATC: G02A
- GENITO URINARY SYSTEM AND SEX HORMONES
- OTHER GYNECOLOGICALS
- UTEROTONICS
Synthesis Plan
FORMULA:C25H26N2O3

SMILES: COc1cccc(C(=O)Nc2ccc(C(=O)Nc3ccccc3C(C)(C)C)cc2)c1

BIRTHDAY: 2018-11-30T03:40:51.976398
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C18H30N6O2

SMILES: CC(C)CC(=O)Nc1[nH]nc2c1C(C)(C)N(C(=O)[C@H]1CC[C@H](N)CN1)C2

BIRTHDAY: 2018-11-30T03:40:51.994741
ATC: A02A
- ALIMENTARY TRACT AND METABOLISM
- DRUGS FOR ACID RELATED DISORDERS
- ANTACIDS
Synthesis Plan
FORMULA:C35H45N9O8

SMILES: CC(C)CC(=O)N[C@H](C)C(=O)N[C@H](C)C(=O)N[C@@H](CO)C(=O)N[C@@H](C(N)=O)c1cnc2nc1NCc1cccc(c1)OCCOc1cccc(c1)N2

BIRTHDAY: 2018-11-30T03:40:52.012804
ATC: D07A
- DERMATOLOGICALS
- CORTICOSTEROIDS, DERMATOLOGICAL PREPARATIONS
- CORTICOSTEROIDS, PLAIN
Synthesis Plan
FORMULA:C27H29N5O4

SMILES: CN(C)CCCNC(=O)c1ccccc1NC(=O)c1ccc(NC(=O)c2ccc(NC=O)cc2)cc1

BIRTHDAY: 2018-11-30T03:40:52.023582
ATC: N02B
- NERVOUS SYSTEM
- ANALGESICS
- OTHER ANALGESICS AND ANTIPYRETICS
Synthesis Plan
FORMULA:C17H32N4O6

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

BIRTHDAY: 2018-11-30T03:40:52.042860
ATC: D07A
- DERMATOLOGICALS
- CORTICOSTEROIDS, DERMATOLOGICAL PREPARATIONS
- CORTICOSTEROIDS, PLAIN
Synthesis Plan
FORMULA:C27H33N3O6

SMILES: C=C(C(=O)OCC(=O)N[C@H](C)C(=O)N[C@H](C)C(=O)N[C@H](C)c1ccccc1C)c1ccccc1OC

BIRTHDAY: 2018-11-30T03:40:52.053614
ATC: C03C
- CARDIOVASCULAR SYSTEM
- DIURETICS
- HIGH-CEILING DIURETICS
Synthesis Plan
FORMULA:C17H32N4O6

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

BIRTHDAY: 2018-11-30T03:40:52.072487
ATC: J01E
- ANTIINFECTIVES FOR SYSTEMIC USE
- ANTIBACTERIALS FOR SYSTEMIC USE
- SULFONAMIDES AND TRIMETHOPRIM
Synthesis Plan
FORMULA:C25H25N3O

SMILES: CN(C)CCCNC(=O)c1ccc2c(c1)nc(-c1ccccc1)c1ccccc12

BIRTHDAY: 2018-11-30T03:40:52.080636
ATC: G03D
- GENITO URINARY SYSTEM AND SEX HORMONES
- SEX HORMONES AND MODULATORS OF THE GENITAL SYSTEM
- PROGESTOGENS
Synthesis Plan
FORMULA:C15H26F3N5O3

SMILES: CC(C)CC(=O)N[C@H](C)C(=O)N[C@H](CCCNC(=N)N)C(=O)C(F)(F)F

BIRTHDAY: 2018-11-30T03:40:52.091873
ATC: A16A
- ALIMENTARY TRACT AND METABOLISM
- OTHER ALIMENTARY TRACT AND METABOLISM PRODUCTS
- OTHER ALIMENTARY TRACT AND METABOLISM PRODUCTS
Synthesis Plan
FORMULA:C23H36N6O6

SMILES: CC(C)CC(=O)N[C@H](C)C(=O)N[C@H](C)C(=O)N[C@H](CO)C(=O)N[C@H](C(N)=O)[C@@H](C)c1ccncc1

BIRTHDAY: 2018-11-30T03:40:52.108702
ATC: A09A
- ALIMENTARY TRACT AND METABOLISM
- DIGESTIVES, INCL. ENZYMES
- DIGESTIVES, INCL. ENZYMES
Synthesis Plan
FORMULA:C26H26N2O3

SMILES: COc1ccc(/C=C\C(=O)Nc2ccccc2C(=O)Nc2cccc(C(C)C)c2)cc1

BIRTHDAY: 2018-11-30T03:40:52.121146
ATC: D11A
- DERMATOLOGICALS
- OTHER DERMATOLOGICAL PREPARATIONS
- OTHER DERMATOLOGICAL PREPARATIONS
Synthesis Plan
FORMULA:C21H26N6O4S

SMILES: CC(C)C[C@@H](CO)NC1=C[C@@]23C=NC=C[C@@]2(NC=N3)ON1[C@@H]1NS(=O)(=O)c2ccccc21

BIRTHDAY: 2018-11-30T03:40:52.137686
ATC: A10B
- ALIMENTARY TRACT AND METABOLISM
- DRUGS USED IN DIABETES
- BLOOD GLUCOSE LOWERING DRUGS, EXCL. INSULINS
Synthesis Plan
FORMULA:C27H23ClN4O3

SMILES: Oc1c2ccnc1OCCC=CCOCc1cc(ccc1-c1ccc(Cl)cc1)Nc1nccc-2n1

BIRTHDAY: 2018-11-19T08:16:20.722298
ATC: G01A
- GENITO URINARY SYSTEM AND SEX HORMONES
- GYNECOLOGICAL ANTIINFECTIVES AND ANTISEPTICS
- ANTIINFECTIVES AND ANTISEPTICS, EXCL. COMBINATIONS WITH CORTICOSTEROIDS
Synthesis Plan
FORMULA:C24H31N3O2

SMILES: CC(C)[C@@]1(C)[C@@H]2C[C@@]3(N=CC4=C3[C@H](O[C@@H](C)c3ccncc3)CC=C4)[C@H]1NCO2

BIRTHDAY: 2018-11-19T08:16:20.731846
ATC: P03A
- ANTIPARASITIC PRODUCTS, INSECTICIDES AND REPELLENTS
- ECTOPARASITICIDES, INCL. SCABICIDES, INSECTICIDES AND REPELLENTS
- ECTOPARASITICIDES, INCL. SCABICIDES
Synthesis Plan
FORMULA:C17H12N2O3

SMILES: O=C1Nc2ccccc2/C1=C/C=C\c1ccc([N+](=O)[O-])cc1

BIRTHDAY: 2018-11-19T08:16:20.739934
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C20H38N8O7

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

BIRTHDAY: 2018-11-19T08:16:20.752716
ATC: G02A
- GENITO URINARY SYSTEM AND SEX HORMONES
- OTHER GYNECOLOGICALS
- UTEROTONICS
Synthesis Plan
FORMULA:C17H15BrN2O

SMILES: O=C1C=C2C=CC=C[C@H]2[C@]2(Cc3ccc(Br)cc3N2)NC1

BIRTHDAY: 2018-11-19T08:16:20.760502
ATC: A11D
- ALIMENTARY TRACT AND METABOLISM
- VITAMINS
- VITAMIN B1, PLAIN AND IN COMBINATION WITH VITAMIN B6 AND B12
Synthesis Plan
FORMULA:C17H15BrN2O

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

BIRTHDAY: 2018-11-19T08:16:20.768392
ATC: D01A
- DERMATOLOGICALS
- ANTIFUNGALS FOR DERMATOLOGICAL USE
- ANTIFUNGALS FOR TOPICAL USE
Synthesis Plan
FORMULA:C33H38N8O2

SMILES: CC(C)[C@@H](CO)Nc1nc(NCc2ccncc2)c2c(n1)nc1n2CCc2cccc(c2)OCCNCc2cccc-1c2

BIRTHDAY: 2018-11-19T08:16:20.781588
ATC: N06A
- NERVOUS SYSTEM
- PSYCHOANALEPTICS
- ANTIDEPRESSANTS
Synthesis Plan
FORMULA:C26H24N4O5

SMILES: O=CNc1ccc(C(=O)Nc2cccc(C(=O)Nc3ccc(C(=O)N4CCOCC4)cc3)c2)cc1

BIRTHDAY: 2018-11-19T08:16:20.792369
ATC: N02B
- NERVOUS SYSTEM
- ANALGESICS
- OTHER ANALGESICS AND ANTIPYRETICS
Synthesis Plan
FORMULA:C11H21N3O

SMILES: CC(C)CC(=O)N[C@@]12CN[C@@H](CCN1)C2

BIRTHDAY: 2018-11-19T08:16:20.799035
ATC: A02B
- ALIMENTARY TRACT AND METABOLISM
- DRUGS FOR ACID RELATED DISORDERS
- DRUGS FOR PEPTIC ULCER AND GASTRO-OESOPHAGEAL REFLUX DISEASE (GORD)
Synthesis Plan
FORMULA:C27H33N3O6

SMILES: COc1ccc(/C=C/C(=O)OCC(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)N[C@@H](C)c2cccc(C)c2)cc1

BIRTHDAY: 2018-11-19T08:16:20.809990
ATC: B02A
- BLOOD AND BLOOD FORMING ORGANS
- ANTIHEMORRHAGICS
- ANTIFIBRINOLYTICS
Synthesis Plan
FORMULA:C27H33N3O2

SMILES: CN(C)CCCNC(=O)c1cccc2c1[C@@]13C[C@@]45C=CC(O)=C[C@@H]4[C@@H]1N1C[C@H](C2)[C@H]3[C@H]1C5

BIRTHDAY: 2018-11-19T08:16:20.820153
ATC: G01A
- GENITO URINARY SYSTEM AND SEX HORMONES
- GYNECOLOGICAL ANTIINFECTIVES AND ANTISEPTICS
- ANTIINFECTIVES AND ANTISEPTICS, EXCL. COMBINATIONS WITH CORTICOSTEROIDS
Synthesis Plan
FORMULA:C22H30N2O7

SMILES: C=C(C(=O)OCC(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)C(C)(C)C)c1ccc(OC)cc1O

BIRTHDAY: 2018-11-19T08:16:20.830293
ATC: C03C
- CARDIOVASCULAR SYSTEM
- DIURETICS
- HIGH-CEILING DIURETICS
Synthesis Plan
FORMULA:C19H27N7O

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

BIRTHDAY: 2018-11-19T08:16:20.840082
ATC: L01A
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- ALKYLATING AGENTS
Synthesis Plan
FORMULA:C20H29N7O

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

BIRTHDAY: 2018-11-19T08:16:20.850129
ATC: D06A
- DERMATOLOGICALS
- ANTIBIOTICS AND CHEMOTHERAPEUTICS FOR DERMATOLOGICAL USE
- ANTIBIOTICS FOR TOPICAL USE
Synthesis Plan
FORMULA:C22H18F3N3O2

SMILES: O=C(Nc1cccc(C(F)(F)F)c1)Nc1ccccc1C(=O)NCc1ccccc1

BIRTHDAY: 2018-11-19T08:16:20.859990
ATC: N03A
- NERVOUS SYSTEM
- ANTIEPILEPTICS
- ANTIEPILEPTICS
Synthesis Plan
FORMULA:C16H18N4O4

SMILES: N[C@H]1CNC(=O)c2cccc(c2)OCC=CC(O)(O)n2cnc1c2

BIRTHDAY: 2018-11-19T08:16:20.869836
ATC: A10B
- ALIMENTARY TRACT AND METABOLISM
- DRUGS USED IN DIABETES
- BLOOD GLUCOSE LOWERING DRUGS, EXCL. INSULINS
Synthesis Plan
FORMULA:C23H20N2O3

SMILES: COc1cccc(-c2cncc3c2N(c2ccccc2C(C)C)C(=O)C3=O)c1

BIRTHDAY: 2018-11-19T08:16:20.879381
ATC: C03B
- CARDIOVASCULAR SYSTEM
- DIURETICS
- LOW-CEILING DIURETICS, EXCL. THIAZIDES
Synthesis Plan
FORMULA:C10H19N

SMILES: CC1(C)C[C@@H]2CCCC[C@@H]1N2

BIRTHDAY: 2018-11-19T08:16:20.897604
ATC: J04A
- ANTIINFECTIVES FOR SYSTEMIC USE
- ANTIMYCOBACTERIALS
- DRUGS FOR TREATMENT OF TUBERCULOSIS
Synthesis Plan
FORMULA:C19H14F3N3O2

SMILES: O=C(/C=C\c1cccc(OC(F)(F)F)c1)Nc1ccc(-c2cc[nH]n2)cc1

BIRTHDAY: 2018-11-19T08:16:20.907255
ATC: C10A
- CARDIOVASCULAR SYSTEM
- LIPID MODIFYING AGENTS
- LIPID MODIFYING AGENTS, PLAIN
Synthesis Plan
FORMULA:C19H25Cl2N7

SMILES: CC(C)n1cnc2nc(Nc3ccc(Cl)cc3Cl)nc(NC(C)(C)N(C)C)c21

BIRTHDAY: 2018-11-19T08:16:20.917463
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C20H23N5O2

SMILES: CC(C)[C@@]1(C)C(=O)N=NN[C@@]1(N)C(=O)Nc1ccccc1-c1ccccc1

BIRTHDAY: 2018-11-19T08:16:20.927463
ATC: L01B
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- ANTIMETABOLITES
Synthesis Plan
FORMULA:C18H34N4O6

SMILES: CC(C)CC(=O)N[C@H](C)C(=O)N[C@@H](CCCCO)C(=O)N[C@@H](CCO)C(N)=O

BIRTHDAY: 2018-11-19T08:16:20.937487
ATC: L03A
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- IMMUNOSTIMULANTS
- IMMUNOSTIMULANTS
Synthesis Plan
FORMULA:C18H30N6O2

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

BIRTHDAY: 2018-11-19T08:16:20.947280
ATC: L01C
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- PLANT ALKALOIDS AND OTHER NATURAL PRODUCTS
Synthesis Plan
FORMULA:C20H40N8O5

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

BIRTHDAY: 2018-11-19T08:16:20.958844
ATC: S01E
- SENSORY ORGANS
- OPHTHALMOLOGICALS
- ANTIGLAUCOMA PREPARATIONS AND MIOTICS
Synthesis Plan
FORMULA:C25H31N7O2

SMILES: CC(C)N1C=N[C@]2(NCc3cccc(-c4cccnc4)c3)N=CN=C[C@@]12N1CCC[C@@]1(O)CO

BIRTHDAY: 2018-11-19T08:16:20.980315
ATC: L01D
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- CYTOTOXIC ANTIBIOTICS AND RELATED SUBSTANCES
Synthesis Plan
FORMULA:C25H44N6O4

SMILES: CC(C)CC(=O)N[C@@H](C)C(=O)N[C@H](CCCCO)C(=O)N[C@H](CCCNc1cncnc1)C(C)C

BIRTHDAY: 2018-11-19T08:16:20.991180
ATC: L01D
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- CYTOTOXIC ANTIBIOTICS AND RELATED SUBSTANCES
Synthesis Plan
FORMULA:C20H38N8O7

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

BIRTHDAY: 2018-11-19T08:16:21.003575
ATC: V04C
- VARIOUS
- DIAGNOSTIC AGENTS
- OTHER DIAGNOSTIC AGENTS
Synthesis Plan
FORMULA:C20H38N8O7

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

BIRTHDAY: 2018-11-19T08:16:21.015937
ATC: V04C
- VARIOUS
- DIAGNOSTIC AGENTS
- OTHER DIAGNOSTIC AGENTS
Synthesis Plan
FORMULA:C26H33N7O

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

BIRTHDAY: 2018-11-19T08:16:21.027956
ATC: C08D
- CARDIOVASCULAR SYSTEM
- CALCIUM CHANNEL BLOCKERS
- SELECTIVE CALCIUM CHANNEL BLOCKERS WITH DIRECT CARDIAC EFFECTS
Synthesis Plan
FORMULA:C17H32N4O6

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

BIRTHDAY: 2018-11-19T08:16:21.047234
ATC: J01E
- ANTIINFECTIVES FOR SYSTEMIC USE
- ANTIBACTERIALS FOR SYSTEMIC USE
- SULFONAMIDES AND TRIMETHOPRIM
Synthesis Plan
FORMULA:C20H38N8O7

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

BIRTHDAY: 2018-11-19T08:16:21.059476
ATC: V04C
- VARIOUS
- DIAGNOSTIC AGENTS
- OTHER DIAGNOSTIC AGENTS
Synthesis Plan
FORMULA:C23H23N5O2

SMILES: CN(C)CCCNC(=O)c1ccc2c(c1)-c1[nH]c3ccc(C#N)cc3c1CC(=O)N2

BIRTHDAY: 2018-11-19T08:16:21.068798
ATC: A03F
- ALIMENTARY TRACT AND METABOLISM
- DRUGS FOR FUNCTIONAL GASTROINTESTINAL DISORDERS
- PROPULSIVES
Synthesis Plan
FORMULA:C20H17N3O2

SMILES: Cc1nc(NCc2ccccc2O)c2cc(-c3ccco3)ccc2n1

BIRTHDAY: 2018-11-19T08:16:21.077461
ATC: C08E
- CARDIOVASCULAR SYSTEM
- CALCIUM CHANNEL BLOCKERS
- NON-SELECTIVE CALCIUM CHANNEL BLOCKERS
Synthesis Plan
FORMULA:C21H18N2O2

SMILES: COc1ccc(/C=C\C(=O)Nc2ccc3c(c2)[C@H]2C[C@@H]3[C@H]2C#N)cc1

BIRTHDAY: 2018-11-19T08:16:21.095241
ATC: M04A
- MUSCULO-SKELETAL SYSTEM
- ANTIGOUT PREPARATIONS
- ANTIGOUT PREPARATIONS
Synthesis Plan
FORMULA:C26H26N2O4

SMILES: COc1cc(/C=C/C(=O)Nc2ccccc2C(=O)Nc2cccc(C(C)C)c2)ccc1O

BIRTHDAY: 2018-11-19T08:16:21.105047
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C19H36N4O6

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

BIRTHDAY: 2018-11-19T08:16:21.115153
ATC: J05A
- ANTIINFECTIVES FOR SYSTEMIC USE
- ANTIVIRALS FOR SYSTEMIC USE
- DIRECT ACTING ANTIVIRALS
Synthesis Plan
FORMULA:C18H30N6O2

SMILES: CC(C)CC(=O)Nc1n[nH]c2c1N(C(=O)[C@@]1(N)CCCNC1)C(C)(C)C2

BIRTHDAY: 2018-11-19T08:16:21.134319
ATC: L01C
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- PLANT ALKALOIDS AND OTHER NATURAL PRODUCTS
Synthesis Plan
FORMULA:C24H28FN3O2

SMILES: COc1cccc(CC(=O)Nc2c(C(C)C)cnn2C(C)(C)c2cccc(F)c2)c1

BIRTHDAY: 2018-11-19T08:16:21.165196
ATC: M01C
- MUSCULO-SKELETAL SYSTEM
- ANTIINFLAMMATORY AND ANTIRHEUMATIC PRODUCTS
- SPECIFIC ANTIRHEUMATIC AGENTS
Synthesis Plan
FORMULA:C25H31N7O2

SMILES: CC(C)N1C=N[C@@]2(NCc3ccccc3-c3cccnc3)N=CN=C[C@@]12N1CCC[C@@]1(O)CO

BIRTHDAY: 2018-11-19T08:16:21.177009
ATC: L01D
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- CYTOTOXIC ANTIBIOTICS AND RELATED SUBSTANCES
Synthesis Plan
FORMULA:C20H26ClN5O3S

SMILES: CC(C)CC(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)N[C@]1(c2cccc(Cl)c2)C=NN=CS1

BIRTHDAY: 2018-11-19T08:16:21.196902
ATC: C03C
- CARDIOVASCULAR SYSTEM
- DIURETICS
- HIGH-CEILING DIURETICS
Synthesis Plan
FORMULA:C18H34N4O6

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

BIRTHDAY: 2018-11-19T08:16:21.217893
ATC: D07A
- DERMATOLOGICALS
- CORTICOSTEROIDS, DERMATOLOGICAL PREPARATIONS
- CORTICOSTEROIDS, PLAIN
Synthesis Plan
FORMULA:C22H30N2O7

SMILES: C=C(C(=O)OCC(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)C(C)(C)C)c1cccc(O)c1OC

BIRTHDAY: 2018-11-19T08:16:21.227817
ATC: C03C
- CARDIOVASCULAR SYSTEM
- DIURETICS
- HIGH-CEILING DIURETICS
Synthesis Plan
FORMULA:C18H34N4O6

SMILES: CC(C)CC(=O)N[C@H](C)C(=O)N[C@H](CCCCO)C(=O)N[C@H](CCO)C(N)=O

BIRTHDAY: 2018-11-19T08:16:21.237492
ATC: L03A
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- IMMUNOSTIMULANTS
- IMMUNOSTIMULANTS
Synthesis Plan
FORMULA:C16H14O5

SMILES: C=C(C(=O)c1cc(O)ccc1O)c1c(O)cccc1OC

BIRTHDAY: 2018-11-19T08:16:21.245343
ATC: N02B
- NERVOUS SYSTEM
- ANALGESICS
- OTHER ANALGESICS AND ANTIPYRETICS
Synthesis Plan
FORMULA:C24H37N7O7

SMILES: CC(C)CC(=O)N[C@@H](C)C(=O)N[C@@H](C(=O)N[C@@H](C(=O)O)[C@@H](C)c1ccccc1)C(C)(C)N/C(N)=N/[N+](=O)[O-]

BIRTHDAY: 2018-11-19T08:16:21.257827
ATC: R03D
- RESPIRATORY SYSTEM
- DRUGS FOR OBSTRUCTIVE AIRWAY DISEASES
- OTHER SYSTEMIC DRUGS FOR OBSTRUCTIVE AIRWAY DISEASES
Synthesis Plan
FORMULA:C16H14O5

SMILES: COc1cc(/C=C\C(=O)c2c(O)cccc2O)ccc1O

BIRTHDAY: 2018-11-19T08:16:21.265470
ATC: M04A
- MUSCULO-SKELETAL SYSTEM
- ANTIGOUT PREPARATIONS
- ANTIGOUT PREPARATIONS
Synthesis Plan
FORMULA:C26H33N7O

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

BIRTHDAY: 2018-11-19T08:16:21.277495
ATC: C08D
- CARDIOVASCULAR SYSTEM
- CALCIUM CHANNEL BLOCKERS
- SELECTIVE CALCIUM CHANNEL BLOCKERS WITH DIRECT CARDIAC EFFECTS
Synthesis Plan
FORMULA:C20H29N7O

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

BIRTHDAY: 2018-11-19T08:16:21.287023
ATC: C08D
- CARDIOVASCULAR SYSTEM
- CALCIUM CHANNEL BLOCKERS
- SELECTIVE CALCIUM CHANNEL BLOCKERS WITH DIRECT CARDIAC EFFECTS
Synthesis Plan
FORMULA:C17H22N6O4S

SMILES: COc1ccc(S(=O)(=O)NCC(C)(C)O)cc1-c1nnc2c(n1)c(C)nn2C

BIRTHDAY: 2018-11-19T08:16:21.297324
ATC: C05B
- CARDIOVASCULAR SYSTEM
- VASOPROTECTIVES
- ANTIVARICOSE THERAPY
Synthesis Plan
FORMULA:C15H26BN3O4

SMILES: CC(C)CC(=O)Nc1cnn2c1C[C@]1(C2)C[C@@](C)(CO)O[BH2-][OH+]1

BIRTHDAY: 2018-11-19T08:16:21.306114
ATC: J01D
- ANTIINFECTIVES FOR SYSTEMIC USE
- ANTIBACTERIALS FOR SYSTEMIC USE
- OTHER BETA-LACTAM ANTIBACTERIALS
Synthesis Plan
FORMULA:C24H36O7

SMILES: COc1cc(/C=C\C(=O)OCCCCCCCCCCC(=O)OC[C@@H](C)O)ccc1O

BIRTHDAY: 2018-11-19T08:16:21.315044
ATC: P03B
- ANTIPARASITIC PRODUCTS, INSECTICIDES AND REPELLENTS
- ECTOPARASITICIDES, INCL. SCABICIDES, INSECTICIDES AND REPELLENTS
- INSECTICIDES AND REPELLENTS
Synthesis Plan
FORMULA:C20H38N8O7

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

BIRTHDAY: 2018-11-19T08:16:21.327449
ATC: V04C
- VARIOUS
- DIAGNOSTIC AGENTS
- OTHER DIAGNOSTIC AGENTS
Synthesis Plan
FORMULA:C26H34N8

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

BIRTHDAY: 2018-11-19T08:16:21.339471
ATC: G02A
- GENITO URINARY SYSTEM AND SEX HORMONES
- OTHER GYNECOLOGICALS
- UTEROTONICS
Synthesis Plan
FORMULA:C27H46N8O4

SMILES: CC(C)CC(=O)N[C@H](C)C(=O)N[C@H](C(=O)N[C@@H]([C@@H]1C2CNC1NC2)C(C)(C)Nc1cncnc1)C(C)(C)CO

BIRTHDAY: 2018-11-19T08:16:21.351809
ATC: J05A
- ANTIINFECTIVES FOR SYSTEMIC USE
- ANTIVIRALS FOR SYSTEMIC USE
- DIRECT ACTING ANTIVIRALS
Synthesis Plan
FORMULA:C11H10ClN7

SMILES: NNc1nc(Nc2ccc(Cl)cc2)nc2nc[nH]c12

BIRTHDAY: 2018-11-19T08:16:21.360277
ATC: P01B
- ANTIPARASITIC PRODUCTS, INSECTICIDES AND REPELLENTS
- ANTIPROTOZOALS
- ANTIMALARIALS
Synthesis Plan
FORMULA:C26H26N2O3

SMILES: COc1ccc(/C=C\C(=O)Nc2ccccc2C(=O)Nc2ccc(C(C)C)cc2)cc1

BIRTHDAY: 2018-11-19T08:16:21.369142
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C21H37N5O5

SMILES: CC(C)CC(=O)N[C@H](C)C(=O)N[C@H](CCCCO)C(=O)N[C@H](CCCO)C1=NC=NC1

BIRTHDAY: 2018-11-19T08:16:21.379638
ATC: L03A
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- IMMUNOSTIMULANTS
- IMMUNOSTIMULANTS
Synthesis Plan
FORMULA:C20H37N7O6

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

BIRTHDAY: 2018-11-19T08:16:21.403407
ATC: L01D
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- CYTOTOXIC ANTIBIOTICS AND RELATED SUBSTANCES
Synthesis Plan
FORMULA:C16H14O5

SMILES: COc1cc(/C=C\C(=O)c2ccc(O)c(O)c2)ccc1O

BIRTHDAY: 2018-11-19T08:16:21.410905
ATC: P03B
- ANTIPARASITIC PRODUCTS, INSECTICIDES AND REPELLENTS
- ECTOPARASITICIDES, INCL. SCABICIDES, INSECTICIDES AND REPELLENTS
- INSECTICIDES AND REPELLENTS
Synthesis Plan
FORMULA:C40H68N8O7

SMILES: CC(C)CC(=O)N[C@@H](C)C(=O)N[C@@H](C(=O)N[C@H](CO)C(=O)N[C@@H](CC(C)C)[C@H]1CCOCC(=O)CCCCCCCNc2ccc1cc2)C(C)(C)NC(=N)N

BIRTHDAY: 2018-11-19T08:16:21.429221
ATC: H01B
- SYSTEMIC HORMONAL PREPARATIONS, EXCL. SEX HORMONES AND INSULINS
- PITUITARY AND HYPOTHALAMIC HORMONES AND ANALOGUES
- POSTERIOR PITUITARY LOBE HORMONES
Synthesis Plan
FORMULA:C22H32O7

SMILES: C=C(C(=O)OC(C)(C)C(C)(C)[C@H](C)C(=O)OC[C@H](C)O)c1cccc(O)c1OC

BIRTHDAY: 2018-11-19T08:16:21.447843
ATC: N06A
- NERVOUS SYSTEM
- PSYCHOANALEPTICS
- ANTIDEPRESSANTS
Synthesis Plan
FORMULA:C22H34N4O6

SMILES: CC(C)CC(=O)N[C@@H](C)C(=O)N[C@@H](C(=O)N[C@H](CO)C(N)=O)C(C)(C)Oc1ccccc1

BIRTHDAY: 2018-11-19T08:16:21.467494
ATC: A09A
- ALIMENTARY TRACT AND METABOLISM
- DIGESTIVES, INCL. ENZYMES
- DIGESTIVES, INCL. ENZYMES
Synthesis Plan
FORMULA:C27H29N5O4

SMILES: CN(C)C(C)(C)NC(=O)c1ccc(NC(=O)c2cccc(NC(=O)c3cccc(NC=O)c3)c2)cc1

BIRTHDAY: 2018-11-19T08:16:21.478329
ATC: L02A
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ENDOCRINE THERAPY
- HORMONES AND RELATED AGENTS
Synthesis Plan
FORMULA:C20H29N7O

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

BIRTHDAY: 2018-11-19T08:16:21.488013
ATC: C03C
- CARDIOVASCULAR SYSTEM
- DIURETICS
- HIGH-CEILING DIURETICS
Synthesis Plan
FORMULA:C20H40N8O5

SMILES: CC(C)CC(=O)N[C@@H](C)C(=O)N[C@@H](CCCN/C(N)=N\N)C(=O)N[C@@H](CCCCO)C(N)=O

BIRTHDAY: 2018-11-19T08:16:21.499315
ATC: A10B
- ALIMENTARY TRACT AND METABOLISM
- DRUGS USED IN DIABETES
- BLOOD GLUCOSE LOWERING DRUGS, EXCL. INSULINS
Synthesis Plan
FORMULA:C26H29F3N2O2

SMILES: Cc1cc(C(=O)N2[C@H]3CCC[C@H]2CC(C)(C)C3)ccc1NC(=O)c1ccc(C(F)(F)F)cc1

BIRTHDAY: 2018-11-19T08:16:21.509254
ATC: N06A
- NERVOUS SYSTEM
- PSYCHOANALEPTICS
- ANTIDEPRESSANTS
Synthesis Plan
FORMULA:C19H25N7O4S

SMILES: COc1ccc(S(=O)(=O)NCCN2CCOCC2)cc1-c1nnc2c(n1)c(C)nn2C

BIRTHDAY: 2018-11-19T08:16:21.520303
ATC: C05B
- CARDIOVASCULAR SYSTEM
- VASOPROTECTIVES
- ANTIVARICOSE THERAPY
Synthesis Plan
FORMULA:C26H49N9O6

SMILES: CC(C)CC(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CO)C(=O)N[C@@H](C(N)=O)C1CCCNCCC1

BIRTHDAY: 2018-11-19T08:16:21.533590
ATC: A02B
- ALIMENTARY TRACT AND METABOLISM
- DRUGS FOR ACID RELATED DISORDERS
- DRUGS FOR PEPTIC ULCER AND GASTRO-OESOPHAGEAL REFLUX DISEASE (GORD)
Synthesis Plan
FORMULA:C21H24ClN7O2

SMILES: CC(C)n1cnc2nc(Cl)nc(NCc3cccc([C@H]4C=CN([C@@H](C)O)C(=O)N4)c3)c21

BIRTHDAY: 2018-11-30T17:23:13.530671
ATC: V06D
- VARIOUS
- GENERAL NUTRIENTS
- OTHER NUTRIENTS
Synthesis Plan
FORMULA:C17H32N4O6

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

BIRTHDAY: 2018-11-30T17:23:13.540196
ATC: J01E
- ANTIINFECTIVES FOR SYSTEMIC USE
- ANTIBACTERIALS FOR SYSTEMIC USE
- SULFONAMIDES AND TRIMETHOPRIM
Synthesis Plan
FORMULA:C27H28N2O4

SMILES: C=C(C(=O)Nc1ccc(C(=O)Nc2ccccc2C(C)C)cc1)c1cccc(OC)c1OC

BIRTHDAY: 2018-11-30T17:23:13.549781
ATC: C10A
- CARDIOVASCULAR SYSTEM
- LIPID MODIFYING AGENTS
- LIPID MODIFYING AGENTS, PLAIN
Synthesis Plan
FORMULA:C39H39N3O5

SMILES: COc1ccc(/C=C/C(=O)OCCCCc2nn(CCCCC(=O)Nc3ccc(-c4ccccc4)cc3)c(=O)c3ccccc23)cc1

BIRTHDAY: 2018-11-30T17:23:13.570873
ATC: L04A
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- IMMUNOSUPPRESSANTS
- IMMUNOSUPPRESSANTS
Synthesis Plan
FORMULA:C21H38N4O6

SMILES: CC(C)CC(=O)N[C@H](C)C(=O)N[C@H](C)C(=O)N[C@@H](CO)C(=O)N1CCC[C@H]1CCCO

BIRTHDAY: 2018-11-30T17:23:13.591855
ATC: C02B
- CARDIOVASCULAR SYSTEM
- ANTIHYPERTENSIVES
- ANTIADRENERGIC AGENTS, GANGLION-BLOCKING
Synthesis Plan
FORMULA:C21H37N5O3

SMILES: CC(C)CC(=O)Nc1n[nH]c2c1CN([C@@H]1COCCNCCOCCC[C@H]1C)C2

BIRTHDAY: 2018-11-30T17:23:13.601997
ATC: C02B
- CARDIOVASCULAR SYSTEM
- ANTIHYPERTENSIVES
- ANTIADRENERGIC AGENTS, GANGLION-BLOCKING
Synthesis Plan
FORMULA:C38H56N10O7

SMILES: CC(C)CC(=O)N[C@@H](C)C(=O)N[C@H](C(=O)N[C@H](CO)C(=O)N[C@@]1(C)c2cccc(c2)Oc2cccc(c2)CNCCN2CCN1CC2=O)C(C)(C)NC(=N)N

BIRTHDAY: 2018-11-30T17:23:13.618622
ATC: D07A
- DERMATOLOGICALS
- CORTICOSTEROIDS, DERMATOLOGICAL PREPARATIONS
- CORTICOSTEROIDS, PLAIN
Synthesis Plan
FORMULA:C26H42N4O2

SMILES: COc1cccc(CC(=O)Nc2cnn(C(C)(C)C(C)(C)CNC(C)C)c2C(C)(C)C)c1

BIRTHDAY: 2018-11-30T17:23:13.628252
ATC: C03D
- CARDIOVASCULAR SYSTEM
- DIURETICS
- POTASSIUM-SPARING AGENTS
Synthesis Plan
FORMULA:C19H18FN5O

SMILES: COc1ccccc1[C@H]1N(Cc2cccc(F)c2)N=C2N=CN=C[C@@]21N

BIRTHDAY: 2018-11-30T17:23:13.638222
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C24H24N2O3

SMILES: COc1ccc(C(=O)Nc2ccccc2C(=O)Nc2ccc(C(C)C)cc2)cc1

BIRTHDAY: 2018-11-30T17:23:13.647109
ATC: D11A
- DERMATOLOGICALS
- OTHER DERMATOLOGICAL PREPARATIONS
- OTHER DERMATOLOGICAL PREPARATIONS
Synthesis Plan
FORMULA:C17H19FN6O3

SMILES: O=C(Nc1cc(-c2nnc(NCCCCCO)o2)[nH]n1)c1ccc(F)cc1

BIRTHDAY: 2018-11-30T17:23:13.667245
ATC: N06B
- NERVOUS SYSTEM
- PSYCHOANALEPTICS
- PSYCHOSTIMULANTS, AGENTS USED FOR ADHD AND NOOTROPICS
Synthesis Plan
FORMULA:C19H27N7O

SMILES: CC(C)[C@H](CO)Nc1nc(NCc2cccnc2)c2c(ncn2C(C)C)n1

BIRTHDAY: 2018-11-30T17:23:13.676611
ATC: L01A
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- ALKYLATING AGENTS
Synthesis Plan
FORMULA:C30H30N2O5S

SMILES: COc1ccc2c(c1)CCC1=C(NC(C)=O)[C@H]3C=C(S(=O)(=O)c4ccccc4)C=C[C@@]3(C(C)C)N=C1C2=O

BIRTHDAY: 2018-11-30T17:23:13.687569
ATC: A16A
- ALIMENTARY TRACT AND METABOLISM
- OTHER ALIMENTARY TRACT AND METABOLISM PRODUCTS
- OTHER ALIMENTARY TRACT AND METABOLISM PRODUCTS
Synthesis Plan
FORMULA:C40H57N5O4

SMILES: CC(C)CC(=O)N[C@H](C)C(=O)N[C@H](C)C(=O)NC1=CC2=NC1=Cc1ccc([nH]1)CCCCC=CCCCCCCCCCCc1ccc2o1

BIRTHDAY: 2018-11-30T17:23:13.700602
ATC: M01A
- MUSCULO-SKELETAL SYSTEM
- ANTIINFLAMMATORY AND ANTIRHEUMATIC PRODUCTS
- ANTIINFLAMMATORY AND ANTIRHEUMATIC PRODUCTS, NON-STEROIDS
Synthesis Plan
FORMULA:C20H27N7O4S

SMILES: COc1ccc(S(=O)(=O)NCC(C)(C)C(=O)N(C)C)cc1-c1nnc2c(n1)c(C)nn2C

BIRTHDAY: 2018-11-30T17:23:13.711618
ATC: M01C
- MUSCULO-SKELETAL SYSTEM
- ANTIINFLAMMATORY AND ANTIRHEUMATIC PRODUCTS
- SPECIFIC ANTIRHEUMATIC AGENTS
Synthesis Plan
FORMULA:C24H38N4O5

SMILES: CC(C)CC(=O)N[C@H](C)C(=O)N[C@H](CCCCO)C(=O)N[C@H](CCc1ccccc1)C(N)=O

BIRTHDAY: 2018-11-30T17:23:13.721890
ATC: J05A
- ANTIINFECTIVES FOR SYSTEMIC USE
- ANTIVIRALS FOR SYSTEMIC USE
- DIRECT ACTING ANTIVIRALS
Synthesis Plan
FORMULA:C25H40N4O5

SMILES: CC(C)CC(=O)N[C@H](C)C(=O)N[C@H](CCCCCO)C(=O)N[C@@H](CCc1ccccc1)C(N)=O

BIRTHDAY: 2018-12-02T16:06:21.860494
ATC: J05A
- ANTIINFECTIVES FOR SYSTEMIC USE
- ANTIVIRALS FOR SYSTEMIC USE
- DIRECT ACTING ANTIVIRALS
Synthesis Plan
FORMULA:C26H26N2O3

SMILES: COc1ccc(/C=C/C(=O)Nc2ccccc2C(=O)Nc2cccc(C(C)C)c2)cc1

BIRTHDAY: 2018-12-02T16:06:21.888513
ATC: D11A
- DERMATOLOGICALS
- OTHER DERMATOLOGICAL PREPARATIONS
- OTHER DERMATOLOGICAL PREPARATIONS
Synthesis Plan
FORMULA:C28H26ClF3N2O2

SMILES: O=C(Nc1cccc(C2(C(F)(F)F)CCCCCC2)c1)c1cccc(NC(=O)c2ccccc2Cl)c1

BIRTHDAY: 2018-12-02T16:06:21.919217
ATC: N03A
- NERVOUS SYSTEM
- ANTIEPILEPTICS
- ANTIEPILEPTICS
Synthesis Plan
FORMULA:C21H39N3O6

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

BIRTHDAY: 2018-12-02T16:06:21.928807
ATC: J05A
- ANTIINFECTIVES FOR SYSTEMIC USE
- ANTIVIRALS FOR SYSTEMIC USE
- DIRECT ACTING ANTIVIRALS
Synthesis Plan
FORMULA:C19H33N3O4

SMILES: CC(C)CC(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)N[C@@H](CO)[C@@H]1C=CCCC1

BIRTHDAY: 2018-12-02T16:06:21.959751
ATC: J05A
- ANTIINFECTIVES FOR SYSTEMIC USE
- ANTIVIRALS FOR SYSTEMIC USE
- DIRECT ACTING ANTIVIRALS
Synthesis Plan
FORMULA:C23H34O7

SMILES: COc1cc(/C=C\C(=O)OCCCCCCCCCC(=O)OC[C@H](C)O)ccc1O

BIRTHDAY: 2018-12-02T16:06:21.968626
ATC: P03B
- ANTIPARASITIC PRODUCTS, INSECTICIDES AND REPELLENTS
- ECTOPARASITICIDES, INCL. SCABICIDES, INSECTICIDES AND REPELLENTS
- INSECTICIDES AND REPELLENTS
Synthesis Plan
FORMULA:C27H28N2O4

SMILES: COc1ccc(/C=C\C(=O)Nc2ccccc2C(=O)Nc2ccc(C(C)C)cc2)cc1OC

BIRTHDAY: 2018-12-02T16:06:21.987518
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C19H25N7O4S

SMILES: COc1cccc(S(=O)(=O)N[C@H](C)N2CCOCC2)c1-c1nnc2c(C)nn(C)c2n1

BIRTHDAY: 2018-12-02T16:06:22.008197
ATC: N02B
- NERVOUS SYSTEM
- ANALGESICS
- OTHER ANALGESICS AND ANTIPYRETICS
Synthesis Plan
FORMULA:C21H40N4O6

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

BIRTHDAY: 2018-12-02T16:06:22.028138
ATC: D07A
- DERMATOLOGICALS
- CORTICOSTEROIDS, DERMATOLOGICAL PREPARATIONS
- CORTICOSTEROIDS, PLAIN
Synthesis Plan
FORMULA:C21H36N6O2

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

BIRTHDAY: 2018-12-03T10:42:43.458346
ATC: C02B
- CARDIOVASCULAR SYSTEM
- ANTIHYPERTENSIVES
- ANTIADRENERGIC AGENTS, GANGLION-BLOCKING
Synthesis Plan
FORMULA:C19H27N7O

SMILES: CC(C)[C@@H](CO)Nc1nc(NCc2ccccn2)c2c(ncn2C(C)C)n1

BIRTHDAY: 2018-12-03T10:42:43.476887
ATC: L01A
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- ALKYLATING AGENTS
Synthesis Plan
FORMULA:C23H44N8O6

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

BIRTHDAY: 2018-12-03T10:42:43.489117
ATC: G02A
- GENITO URINARY SYSTEM AND SEX HORMONES
- OTHER GYNECOLOGICALS
- UTEROTONICS
Synthesis Plan
FORMULA:C18H30N4O6

SMILES: CC(C)CC(=O)N[C@@H](C)C(=O)N[C@@H](CCCCO)C(=O)NC1=CNC(=O)OC1

BIRTHDAY: 2018-12-03T10:42:43.499020
ATC: J05A
- ANTIINFECTIVES FOR SYSTEMIC USE
- ANTIVIRALS FOR SYSTEMIC USE
- DIRECT ACTING ANTIVIRALS
Synthesis Plan
FORMULA:C22H20N2O2

SMILES: COC1=CC=C[C@]2(C=CC3=C[C@](C#N)(c4ccccc4OC)C=CN32)C1

BIRTHDAY: 2018-12-03T10:42:43.507349
ATC: M03A
- MUSCULO-SKELETAL SYSTEM
- MUSCLE RELAXANTS
- MUSCLE RELAXANTS, PERIPHERALLY ACTING AGENTS
Synthesis Plan
FORMULA:C26H37NO2

SMILES: CC(C)C[C@@]1(CO)C[C@H]2C[C@@H]3C[C@@H]2[C@](C(=O)Nc2ccccc2C2CCC2)(C3)C1

BIRTHDAY: 2018-12-03T10:42:43.516253
ATC: M03A
- MUSCULO-SKELETAL SYSTEM
- MUSCLE RELAXANTS
- MUSCLE RELAXANTS, PERIPHERALLY ACTING AGENTS
Synthesis Plan
FORMULA:C18H34N2O2Se

SMILES: CC(C)CC(=O)N[C@@H](C)C(=O)N[C@H](CC(C)C)[C@@]1(C)CCC[Se]1

BIRTHDAY: 2018-12-03T10:42:43.533453
ATC: D07A
- DERMATOLOGICALS
- CORTICOSTEROIDS, DERMATOLOGICAL PREPARATIONS
- CORTICOSTEROIDS, PLAIN
Synthesis Plan
FORMULA:C27H28N2O4

SMILES: COc1ccc(/C=C/C(=O)Nc2ccccc2C(=O)Nc2ccc(C(C)C)cc2)cc1OC

BIRTHDAY: 2018-12-03T10:42:43.543396
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C20H29N7O

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

BIRTHDAY: 2018-12-03T10:42:43.552997
ATC: D06A
- DERMATOLOGICALS
- ANTIBIOTICS AND CHEMOTHERAPEUTICS FOR DERMATOLOGICAL USE
- ANTIBIOTICS FOR TOPICAL USE
Synthesis Plan
FORMULA:C21H17N3O3

SMILES: O=CNc1ccc(C(=O)Nc2ccccc2C(=O)Nc2ccccc2)cc1

BIRTHDAY: 2018-12-03T10:42:43.570426
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C20H38N8O7

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

BIRTHDAY: 2018-12-03T10:42:43.591752
ATC: G02A
- GENITO URINARY SYSTEM AND SEX HORMONES
- OTHER GYNECOLOGICALS
- UTEROTONICS
Synthesis Plan
FORMULA:C19H36N4O6

SMILES: CC(C)CC(=O)N[C@@H](C)C(=O)N[C@@H](CCCCO)C(=O)N[C@@H](CCCO)C(N)=O

BIRTHDAY: 2018-12-03T19:11:08.598466
ATC: L03A
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- IMMUNOSTIMULANTS
- IMMUNOSTIMULANTS
Synthesis Plan
FORMULA:C8H17N5O

SMILES: CC(C)CC(=O)N[C@H](C)C1=NNNN1

BIRTHDAY: 2018-12-03T19:11:08.605535
ATC: D01A
- DERMATOLOGICALS
- ANTIFUNGALS FOR DERMATOLOGICAL USE
- ANTIFUNGALS FOR TOPICAL USE
Synthesis Plan
FORMULA:C20H21ClFN5O

SMILES: CN(C)C(C)(C)NC(=O)c1cccc2nc(Nc3c(F)cccc3Cl)ncc12

BIRTHDAY: 2018-12-03T19:11:08.624518
ATC: C09C
- CARDIOVASCULAR SYSTEM
- AGENTS ACTING ON THE RENIN-ANGIOTENSIN SYSTEM
- ANGIOTENSIN II ANTAGONISTS, PLAIN
Synthesis Plan
FORMULA:C18H30N6O2

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

BIRTHDAY: 2018-12-03T19:11:08.634121
ATC: L01C
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- PLANT ALKALOIDS AND OTHER NATURAL PRODUCTS
Synthesis Plan
FORMULA:C18H23ClN4O3S

SMILES: CC(C)CC(=O)N[C@H](C)C(=O)N[C@]1(c2cccc(Cl)c2)N[N-][CH+]C(=O)[C@H]1S

BIRTHDAY: 2018-12-03T19:11:08.645238
ATC: S01A
- SENSORY ORGANS
- OPHTHALMOLOGICALS
- ANTIINFECTIVES
Synthesis Plan
FORMULA:C17H24N6O3

SMILES: CC(C)CC(=O)Nc1n[nH]c2c1C1=CO[C@H]1N2C(=O)[C@H]1CC[C@H](N)NC1

BIRTHDAY: 2018-12-03T19:11:08.654699
ATC: N02B
- NERVOUS SYSTEM
- ANALGESICS
- OTHER ANALGESICS AND ANTIPYRETICS
Synthesis Plan
FORMULA:C26H42N4O2

SMILES: COc1ccc(CC(=O)Nc2cc(C(C)(C)C)nn2CCCCCCCNC(C)C)cc1

BIRTHDAY: 2018-12-03T19:11:08.663718
ATC: C01E
- CARDIOVASCULAR SYSTEM
- CARDIAC THERAPY
- OTHER CARDIAC PREPARATIONS
Synthesis Plan
FORMULA:C21H16F3N3O2

SMILES: O=C(Nc1cccc(C(=O)Nc2ccccc2)c1)Nc1ccccc1C(F)(F)F

BIRTHDAY: 2018-12-03T19:11:08.673256
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C20H38N8O7

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

BIRTHDAY: 2018-12-03T19:11:08.685510
ATC: V04C
- VARIOUS
- DIAGNOSTIC AGENTS
- OTHER DIAGNOSTIC AGENTS
Synthesis Plan
FORMULA:C22H32N4O4

SMILES: COc1ccccc1CC(=O)Nc1cnn(C(C)(C)C(C)(C)C(=O)NO)c1C(C)C

BIRTHDAY: 2018-12-03T19:11:08.694739
ATC: J05A
- ANTIINFECTIVES FOR SYSTEMIC USE
- ANTIVIRALS FOR SYSTEMIC USE
- DIRECT ACTING ANTIVIRALS
Synthesis Plan
FORMULA:C22H22N2O2S

SMILES: Cc1nc2cc(n1)-c1cccc(c1)OCCCCCOc1cccc(c1)S2

BIRTHDAY: 2018-12-03T19:11:08.712747
ATC: A10B
- ALIMENTARY TRACT AND METABOLISM
- DRUGS USED IN DIABETES
- BLOOD GLUCOSE LOWERING DRUGS, EXCL. INSULINS
Synthesis Plan
FORMULA:C17H32N4O6

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

BIRTHDAY: 2018-12-03T19:11:08.722690
ATC: D07A
- DERMATOLOGICALS
- CORTICOSTEROIDS, DERMATOLOGICAL PREPARATIONS
- CORTICOSTEROIDS, PLAIN
Synthesis Plan
FORMULA:C20H29N7O

SMILES: CC(C)C[C@H](CO)Nc1nc(NCc2ccccn2)c2c(ncn2C(C)C)n1

BIRTHDAY: 2018-12-03T19:11:08.741057
ATC: C09D
- CARDIOVASCULAR SYSTEM
- AGENTS ACTING ON THE RENIN-ANGIOTENSIN SYSTEM
- ANGIOTENSIN II ANTAGONISTS, COMBINATIONS
Synthesis Plan
FORMULA:C19H31N5O2

SMILES: CC(C)CC(=O)Nc1[nH]nc2c1CN(C(=O)[C@@H]1CCCN(C)C1)C2(C)C

BIRTHDAY: 2018-12-03T19:11:08.761728
ATC: R07A
- RESPIRATORY SYSTEM
- OTHER RESPIRATORY SYSTEM PRODUCTS
- OTHER RESPIRATORY SYSTEM PRODUCTS
Synthesis Plan
FORMULA:C23H34O7

SMILES: C=C(C(=O)OC(C)(C)C(C)(C)C(C)(C)C(=O)OC[C@H](C)O)c1cccc(O)c1OC

BIRTHDAY: 2018-12-01T22:30:13.493133
ATC: N02A
- NERVOUS SYSTEM
- ANALGESICS
- OPIOIDS
Synthesis Plan
FORMULA:C20H38N8O7

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

BIRTHDAY: 2018-12-01T22:30:13.505710
ATC: G02A
- GENITO URINARY SYSTEM AND SEX HORMONES
- OTHER GYNECOLOGICALS
- UTEROTONICS
Synthesis Plan
FORMULA:C26H24N4O5

SMILES: O=CNc1ccc(C(=O)Nc2cccc(C(=O)Nc3cccc(C(=O)N4CCOCC4)c3)c2)cc1

BIRTHDAY: 2018-12-01T22:30:13.516400
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C17H32N4O6

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

BIRTHDAY: 2018-12-01T22:30:13.535846
ATC: D07A
- DERMATOLOGICALS
- CORTICOSTEROIDS, DERMATOLOGICAL PREPARATIONS
- CORTICOSTEROIDS, PLAIN
Synthesis Plan
FORMULA:C19H25N9O2

SMILES: CC(C)CC(=O)Nc1n[nH]c2c3c(n(C(=O)[C@@]4(N)CCCCN4)c12)=CN[C@@H](C#N)N=3

BIRTHDAY: 2018-12-01T22:30:13.546667
ATC: V09C
- VARIOUS
- DIAGNOSTIC RADIOPHARMACEUTICALS
- RENAL SYSTEM
Synthesis Plan
FORMULA:C22H18F3N3O2

SMILES: O=C(Nc1ccc(C(=O)NCc2ccccc2)cc1)Nc1ccc(C(F)(F)F)cc1

BIRTHDAY: 2018-12-01T22:30:13.556086
ATC: N03A
- NERVOUS SYSTEM
- ANTIEPILEPTICS
- ANTIEPILEPTICS
Synthesis Plan
FORMULA:C27H33N3O6

SMILES: C=C(C(=O)OCC(=O)N[C@H](C)C(=O)N[C@H](C)C(=O)Nc1ccccc1C(C)C)c1ccccc1OC

BIRTHDAY: 2018-12-01T22:30:13.585672
ATC: P02B
- ANTIPARASITIC PRODUCTS, INSECTICIDES AND REPELLENTS
- ANTHELMINTICS
- ANTITREMATODALS
Synthesis Plan
FORMULA:C15H13ClN4

SMILES: C[C@H](Nc1nnnc2ccccc12)c1ccccc1Cl

BIRTHDAY: 2018-12-01T22:30:13.593595
ATC: M01A
- MUSCULO-SKELETAL SYSTEM
- ANTIINFLAMMATORY AND ANTIRHEUMATIC PRODUCTS
- ANTIINFLAMMATORY AND ANTIRHEUMATIC PRODUCTS, NON-STEROIDS
Synthesis Plan
FORMULA:C22H30N2O7

SMILES: COc1cc(/C=C/C(=O)OCC(=O)N[C@H](C)C(=O)N[C@H](C)C(=O)C(C)(C)C)ccc1O

BIRTHDAY: 2018-12-01T22:30:13.603681
ATC: P02C
- ANTIPARASITIC PRODUCTS, INSECTICIDES AND REPELLENTS
- ANTHELMINTICS
- ANTINEMATODAL AGENTS
Synthesis Plan
FORMULA:C23H36N6O6

SMILES: CC(C)CC(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)N[C@H](CO)C(=O)N[C@@H](C(N)=O)[C@@H](C)c1ccncc1

BIRTHDAY: 2018-12-01T22:30:13.638349
ATC: A09A
- ALIMENTARY TRACT AND METABOLISM
- DIGESTIVES, INCL. ENZYMES
- DIGESTIVES, INCL. ENZYMES
Synthesis Plan