matter.farm

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

These compounds may interact with:

Tyrosine-protein kinase SYK

Potentially involved in: prostate cancer; melanoma; multiple sclerosis; carcinoma; vascular dementia; type 2 diabetes mellitus; cancer; arthritis; cherubism; asthma; allergic hypersensitivity disease; systemic lupus erythematosus; primary immunodeficiency disease; chromoblastomycosis; allergic rhinitis; mesothelioma; adult high grade glioma; astrocytoma, pilocytic; diabetes mellitus; glioblastoma

Disease data sourced from Pharos.

Inhibitor

FORMULA:C19H24N8O2

SMILES: CNCCNc1nc(-c2ccc(N3CCOCC3)nc2)cc2nc(N)[nH]c(=O)c12

BIRTHDAY: 2018-12-01T14:10:55.611670
ATC: C10A
- CARDIOVASCULAR SYSTEM
- LIPID MODIFYING AGENTS
- LIPID MODIFYING AGENTS, PLAIN
Synthesis Plan
FORMULA:C16H18F3N3O

SMILES: C[C@H](Nc1ccnc([C@H](O)CN)c1)c1ccccc1C(F)(F)F

BIRTHDAY: 2018-12-01T14:10:55.620332
ATC: P01B
- ANTIPARASITIC PRODUCTS, INSECTICIDES AND REPELLENTS
- ANTIPROTOZOALS
- ANTIMALARIALS
Synthesis Plan
FORMULA:C18H25N7O2

SMILES: CC(N)(N)NC1=CN2C=NCC(=O)[C@@]2(N)C=C1c1ncccc1C(C)(C)O

BIRTHDAY: 2018-12-01T14:10:55.630660
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C19H26N8O2

SMILES: CNCCNC1=C[C@]2(N)C(=O)NC=N[C@@]2(c2ccnc(N3CCOCC3)c2)N=C1

BIRTHDAY: 2018-12-01T14:10:55.640816
ATC: L04A
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- IMMUNOSUPPRESSANTS
- IMMUNOSUPPRESSANTS
Synthesis Plan
FORMULA:C25H23F6N3O2

SMILES: Cc1cc(-c2nccc(NC(C)C)c2[C@@H](O)C(F)(F)F)ccc1NC(=O)c1cccc(C(F)(F)F)c1

BIRTHDAY: 2018-12-01T14:10:55.651945
ATC: N05A
- NERVOUS SYSTEM
- PSYCHOLEPTICS
- ANTIPSYCHOTICS
Synthesis Plan
FORMULA:C19H26N8O2

SMILES: CC(N)(N)NC1=C(c2ncccc2N2CCOCC2)[C@@]2(N)C(=O)CN=CN2C=C1

BIRTHDAY: 2018-12-01T14:10:55.664628
ATC: N05A
- NERVOUS SYSTEM
- PSYCHOLEPTICS
- ANTIPSYCHOTICS
Synthesis Plan
FORMULA:C26H24N6O2

SMILES: O=C(Nc1cccc(-c2ccnc(Nc3ccc(N4CCOCC4)cc3)n2)c1)c1cccnc1

BIRTHDAY: 2018-12-01T14:10:55.674938
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C27H37FN8O2

SMILES: CC(C)Nc1ncc(-n2ncc3cc([C@@H]4CN5CCN[C@H]4CC5)cnc32)cc1C(=O)NC[C@@H](F)C(C)(C)O

BIRTHDAY: 2018-12-01T14:10:55.686884
ATC: R03D
- RESPIRATORY SYSTEM
- DRUGS FOR OBSTRUCTIVE AIRWAY DISEASES
- OTHER SYSTEMIC DRUGS FOR OBSTRUCTIVE AIRWAY DISEASES
Synthesis Plan
FORMULA:C21H26N6O2

SMILES: CC(C)Nc1c(-c2ccccc2NC(=O)C(C)(C)C)cnc2c(=O)[nH]c(N)nc12

BIRTHDAY: 2018-12-01T14:10:55.696541
ATC: C09C
- CARDIOVASCULAR SYSTEM
- AGENTS ACTING ON THE RENIN-ANGIOTENSIN SYSTEM
- ANGIOTENSIN II ANTAGONISTS, PLAIN
Synthesis Plan
FORMULA:C22H19F3N6O2

SMILES: CCCCOc1cc(C(=O)Nc2ccc(C#N)cn2)ccc1Nc1nccc(C(F)(F)F)n1

BIRTHDAY: 2018-12-01T14:10:55.707464
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C23H21F6N5O

SMILES: CC(C)Nc1ccncc1-c1c(NC(=O)c2ccncc2NCC(F)(F)F)cccc1C(F)(F)F

BIRTHDAY: 2018-12-01T14:10:55.729460
ATC: L01A
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- ALKYLATING AGENTS
Synthesis Plan
FORMULA:C19H26N8O2

SMILES: CC(N)(N)NC1=C(c2ncccc2N2CCOCC2)C=CN2C=NCC(=O)[C@@]12N

BIRTHDAY: 2018-12-01T14:10:55.741251
ATC: N06A
- NERVOUS SYSTEM
- PSYCHOANALEPTICS
- ANTIDEPRESSANTS
Synthesis Plan
FORMULA:C23H21F6N5O

SMILES: CC(C)Nc1cncc(-c2cc(NC(=O)c3cccc(NCC(F)(F)F)n3)cc(C(F)(F)F)c2)c1

BIRTHDAY: 2018-12-01T14:10:55.752513
ATC: C03B
- CARDIOVASCULAR SYSTEM
- DIURETICS
- LOW-CEILING DIURETICS, EXCL. THIAZIDES
Synthesis Plan
FORMULA:C25H31N7O

SMILES: C[C@H](NCc1ccccc1)NC1=N[C@]2(N)N=CNC(=O)[C@]2(c2ncccc2C(C)(C)C)C=C1

BIRTHDAY: 2018-12-01T14:10:55.774303
ATC: R07A
- RESPIRATORY SYSTEM
- OTHER RESPIRATORY SYSTEM PRODUCTS
- OTHER RESPIRATORY SYSTEM PRODUCTS
Synthesis Plan
FORMULA:C22H29N5O4S

SMILES: CC(C)Nc1nc(-c2ccc(NCC(C)(C)O)c(S(C)(=O)=O)c2)cc2ncn(C)c(=O)c12

BIRTHDAY: 2018-12-01T14:10:55.784581
ATC: G02A
- GENITO URINARY SYSTEM AND SEX HORMONES
- OTHER GYNECOLOGICALS
- UTEROTONICS
Synthesis Plan
FORMULA:C18H25N9O2

SMILES: CC(N)(N)NC1=C[C@]2(N)NC=NC(=O)[C@]2(c2ncccc2N2CCOCC2)N=C1

BIRTHDAY: 2018-12-01T14:10:55.796026
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C23H21F6N5O

SMILES: CC(C)Nc1ccc(-c2ccc(NC(=O)c3ccc(NCC(F)(F)F)nc3)cc2C(F)(F)F)cn1

BIRTHDAY: 2018-12-01T14:10:55.807123
ATC: C10A
- CARDIOVASCULAR SYSTEM
- LIPID MODIFYING AGENTS
- LIPID MODIFYING AGENTS, PLAIN
Synthesis Plan
FORMULA:C23H21F6N5O

SMILES: CC(C)Nc1ccc(-c2ccc(NC(=O)c3cccc(NCC(F)(F)F)n3)cc2C(F)(F)F)cn1

BIRTHDAY: 2018-12-25T02:02:58.787150
ATC: C03B
- CARDIOVASCULAR SYSTEM
- DIURETICS
- LOW-CEILING DIURETICS, EXCL. THIAZIDES
Synthesis Plan
FORMULA:C10H7F3N2OS3

SMILES: NC1=C(NC(=O)c2ccc(C(F)(F)F)cc2)SSS1

BIRTHDAY: 2018-12-25T02:02:58.795425
ATC: N07C
- NERVOUS SYSTEM
- OTHER NERVOUS SYSTEM DRUGS
- ANTIVERTIGO PREPARATIONS
Synthesis Plan
FORMULA:C21H20F3N5O

SMILES: Cc1cccc(-c2ncccc2N2CCOCC2)c1Nc1cncnc1C(F)(F)F

BIRTHDAY: 2018-12-25T02:02:58.805593
ATC: M01A
- MUSCULO-SKELETAL SYSTEM
- ANTIINFLAMMATORY AND ANTIRHEUMATIC PRODUCTS
- ANTIINFLAMMATORY AND ANTIRHEUMATIC PRODUCTS, NON-STEROIDS
Synthesis Plan
FORMULA:C21H22F3N5O2

SMILES: COc1cccc(Nc2cnc(C(F)(F)F)nc2)c1-c1ccc(NCC(C)(C)O)cn1

BIRTHDAY: 2018-12-25T02:02:58.816181
ATC: N06A
- NERVOUS SYSTEM
- PSYCHOANALEPTICS
- ANTIDEPRESSANTS
Synthesis Plan
FORMULA:C19H24FN7O2

SMILES: CC(C)Nc1cc(Nc2cnc(C#N)cn2)ncc1C(=O)NC[C@@H](F)C(C)(C)O

BIRTHDAY: 2018-12-25T02:02:58.826105
ATC: L01C
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- PLANT ALKALOIDS AND OTHER NATURAL PRODUCTS
Synthesis Plan
FORMULA:C26H24F3N5O4S

SMILES: CC(C)Nc1cnc2c(=O)n(C)cnc2c1-c1c(NC(=O)c2cccc(C(F)(F)F)c2)cccc1S(C)(=O)=O

BIRTHDAY: 2018-12-25T02:02:58.840701
ATC: A10B
- ALIMENTARY TRACT AND METABOLISM
- DRUGS USED IN DIABETES
- BLOOD GLUCOSE LOWERING DRUGS, EXCL. INSULINS
Synthesis Plan
FORMULA:C19H26N8O2

SMILES: CC(N)(N)NC1=C(c2ncccc2N2CCOCC2)N2C=NCC(=O)[C@]2(N)C=C1

BIRTHDAY: 2018-12-25T02:02:58.863888
ATC: C02A
- CARDIOVASCULAR SYSTEM
- ANTIHYPERTENSIVES
- ANTIADRENERGIC AGENTS, CENTRALLY ACTING
Synthesis Plan
FORMULA:C24H25F3N8O

SMILES: Nc1nc2cc(-c3cccnc3)nc(NCCNCCNCc3cccc(C(F)(F)F)c3)c2c(=O)[nH]1

BIRTHDAY: 2018-12-25T02:02:58.886089
ATC: C03C
- CARDIOVASCULAR SYSTEM
- DIURETICS
- HIGH-CEILING DIURETICS
Synthesis Plan
FORMULA:C28H29N5O4

SMILES: COc1cccc(C2=Nc3ncn(C)c(=O)c3[C@H](c3ccc(OCCN4CCOCC4)cc3)[C@@H]2C#N)c1

BIRTHDAY: 2018-12-25T02:02:58.897373
ATC: A10B
- ALIMENTARY TRACT AND METABOLISM
- DRUGS USED IN DIABETES
- BLOOD GLUCOSE LOWERING DRUGS, EXCL. INSULINS
Synthesis Plan
FORMULA:C21H22F3N5O2

SMILES: COc1cc(-c2ccc(NCC(C)(C)O)nc2)ccc1Nc1nccc(C(F)(F)F)n1

BIRTHDAY: 2018-12-25T02:02:58.907726
ATC: C10A
- CARDIOVASCULAR SYSTEM
- LIPID MODIFYING AGENTS
- LIPID MODIFYING AGENTS, PLAIN
Synthesis Plan
FORMULA:C19H26N8O2

SMILES: CC(N)(N)NC1=C[C@]2(N)C(=O)CN=CN2C=C1c1ncccc1N1CCOCC1

BIRTHDAY: 2018-12-25T02:02:58.918964
ATC: N02C
- NERVOUS SYSTEM
- ANALGESICS
- ANTIMIGRAINE PREPARATIONS
Synthesis Plan
FORMULA:C19H26N8O2

SMILES: CC(N)(N)NC1=C(c2ccncc2N2CCOCC2)C=C[C@@]2(N)C(=O)CN=CN12

BIRTHDAY: 2018-12-25T02:02:58.930458
ATC: A16A
- ALIMENTARY TRACT AND METABOLISM
- OTHER ALIMENTARY TRACT AND METABOLISM PRODUCTS
- OTHER ALIMENTARY TRACT AND METABOLISM PRODUCTS
Synthesis Plan
FORMULA:C23H24N4O

SMILES: COc1cccc(-c2cc3ccccc3c(CNCCc3cnn(C)c3)n2)c1

BIRTHDAY: 2018-12-25T02:02:58.939064
ATC: N06A
- NERVOUS SYSTEM
- PSYCHOANALEPTICS
- ANTIDEPRESSANTS
Synthesis Plan
FORMULA:C27H31F3N6O

SMILES: C[C@@H](NCc1ccccc1C(F)(F)F)NC1=C[C@]2(N)C(=O)CN=CN2C(c2ncccc2C(C)(C)C)=C1

BIRTHDAY: 2018-12-25T02:02:58.950781
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C26H24F3N5O4S

SMILES: CC(C)Nc1c(-c2c(NC(=O)c3ccccc3C(F)(F)F)cccc2S(C)(=O)=O)cnc2c(=O)n(C)cnc12

BIRTHDAY: 2018-12-25T02:02:58.964052
ATC: C09C
- CARDIOVASCULAR SYSTEM
- AGENTS ACTING ON THE RENIN-ANGIOTENSIN SYSTEM
- ANGIOTENSIN II ANTAGONISTS, PLAIN
Synthesis Plan
FORMULA:C36H65NO3

SMILES: CCCCCCCCCCCCCCCCCCCCCCCCCCCCN(C)C(=O)c1ccc(O)c(O)c1

BIRTHDAY: 2018-12-25T02:02:58.973069
ATC: N02B
- NERVOUS SYSTEM
- ANALGESICS
- OTHER ANALGESICS AND ANTIPYRETICS
Synthesis Plan
FORMULA:C17H21N5O

SMILES: N#Cc1cccc(CN2C=N[C@@H]3CCCCC(=O)CN[C@@]32N)c1

BIRTHDAY: 2018-12-25T02:02:58.981319
ATC: N07B
- NERVOUS SYSTEM
- OTHER NERVOUS SYSTEM DRUGS
- DRUGS USED IN ADDICTIVE DISORDERS
Synthesis Plan
FORMULA:C19H15F4N5O

SMILES: CNC(=O)c1cccc(Nc2nc(Nc3cccc(C(F)(F)F)c3)ncc2F)c1

BIRTHDAY: 2018-12-03T02:39:02.472306
ATC: M01A
- MUSCULO-SKELETAL SYSTEM
- ANTIINFLAMMATORY AND ANTIRHEUMATIC PRODUCTS
- ANTIINFLAMMATORY AND ANTIRHEUMATIC PRODUCTS, NON-STEROIDS
Synthesis Plan
FORMULA:C31H29N5O3

SMILES: COc1cccc(C2=NC=C[C@@](C#N)(c3ccccc3C(C)(C)O)[C@@]23CN=c2cccc(NC(C)=O)c2=N3)c1

BIRTHDAY: 2018-12-03T02:39:02.484987
ATC: C02K
- CARDIOVASCULAR SYSTEM
- ANTIHYPERTENSIVES
- OTHER ANTIHYPERTENSIVES
Synthesis Plan
FORMULA:C27H33N7O3

SMILES: C[C@H](NC(=O)[C@]12C=CC=C[C@@]1(Nc1cnc(-c3cccnc3C(C)(C)O)nc1)NC=C2)N1CCOCC1

BIRTHDAY: 2018-12-03T02:39:02.506858
ATC: C02A
- CARDIOVASCULAR SYSTEM
- ANTIHYPERTENSIVES
- ANTIADRENERGIC AGENTS, CENTRALLY ACTING
Synthesis Plan
FORMULA:C19H23N3O2

SMILES: COc1ccccc1[C@]1(NCC(C)(C)O)C=NC=C2C=CC=N[C@H]21

BIRTHDAY: 2018-12-03T02:39:02.515322
ATC: D01A
- DERMATOLOGICALS
- ANTIFUNGALS FOR DERMATOLOGICAL USE
- ANTIFUNGALS FOR TOPICAL USE
Synthesis Plan
FORMULA:C24H22F3N3O3

SMILES: Cc1cccc(-c2c(NC(C)C)ccnc2C(=O)O)c1NC(=O)c1ccccc1C(F)(F)F

BIRTHDAY: 2018-12-03T02:39:02.527306
ATC: V03A
- VARIOUS
- ALL OTHER THERAPEUTIC PRODUCTS
- ALL OTHER THERAPEUTIC PRODUCTS
Synthesis Plan
FORMULA:C14H22FeN6O

SMILES: CC(C)CC1=C(NC(C)([NH-])N)C=C[C@]2(N)C(=O)[CH-]N=CN12.[Fe+2]

BIRTHDAY: 2018-12-03T02:39:02.536505
ATC: J05A
- ANTIINFECTIVES FOR SYSTEMIC USE
- ANTIVIRALS FOR SYSTEMIC USE
- DIRECT ACTING ANTIVIRALS
Synthesis Plan
FORMULA:C24H29N5O2

SMILES: COc1cccc(NC(=O)c2ccncc2NC(C)C)c1-c1cnccc1NC(C)C

BIRTHDAY: 2018-12-03T02:39:02.545945
ATC: A07B
- ALIMENTARY TRACT AND METABOLISM
- ANTIDIARRHEALS, INTESTINAL ANTIINFLAMMATORY/ANTIINFECTIVE AGENTS
- INTESTINAL ADSORBENTS
Synthesis Plan
FORMULA:C20H24N6O5S

SMILES: CC(C)Nc1cc(-c2cccc(S(C)(=O)=O)c2NCCC(=O)O)nc2c(=O)[nH]c(N)nc12

BIRTHDAY: 2018-12-03T02:39:02.557107
ATC: C10A
- CARDIOVASCULAR SYSTEM
- LIPID MODIFYING AGENTS
- LIPID MODIFYING AGENTS, PLAIN
Synthesis Plan
FORMULA:C23H24F3N5O2

SMILES: CNc1cccc(C(=O)Nc2cccc(-c3cc(NC(C)C)ncc3[C@@H](O)C(F)(F)F)c2)n1

BIRTHDAY: 2018-12-03T02:39:02.578062
ATC: N01A
- NERVOUS SYSTEM
- ANESTHETICS
- ANESTHETICS, GENERAL
Synthesis Plan
FORMULA:C19H26N8O2

SMILES: CC(N)(N)NC1=CN2C=NCC(=O)[C@]2(N)C=C1c1ncccc1N1CCOCC1

BIRTHDAY: 2018-12-03T02:39:02.588882
ATC: A10B
- ALIMENTARY TRACT AND METABOLISM
- DRUGS USED IN DIABETES
- BLOOD GLUCOSE LOWERING DRUGS, EXCL. INSULINS
Synthesis Plan
FORMULA:C22H27N5O2

SMILES: CC(C)Nc1nc(-c2ccc(NC(=O)C(C)(C)C)cc2)cc2ncn(C)c(=O)c12

BIRTHDAY: 2018-12-03T02:39:02.619402
ATC: B02A
- BLOOD AND BLOOD FORMING ORGANS
- ANTIHEMORRHAGICS
- ANTIFIBRINOLYTICS
Synthesis Plan
FORMULA:C22H22F3N5O

SMILES: CC(C)Nc1ccncc1-c1ccccc1NC(=O)c1ccc(NCC(F)(F)F)cn1

BIRTHDAY: 2018-12-03T02:39:02.629270
ATC: L01D
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- CYTOTOXIC ANTIBIOTICS AND RELATED SUBSTANCES
Synthesis Plan
FORMULA:C20H23N9O4S

SMILES: CC(C)Nc1cccnc1-c1sc2nc1-c1nnn(n1)CCNC(=O)C(=O)OCC(=O)CNC2

BIRTHDAY: 2018-12-03T02:39:02.652452
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C19H27BN4O3

SMILES: CC(=O)N[C@]1(Nc2ccccc2-c2cnccc2NC(C)C)CCO[BH2-][OH+]1

BIRTHDAY: 2018-12-03T02:39:02.673195
ATC: P01B
- ANTIPARASITIC PRODUCTS, INSECTICIDES AND REPELLENTS
- ANTIPROTOZOALS
- ANTIMALARIALS
Synthesis Plan
FORMULA:C21H22F3N5O2

SMILES: COc1cccc(Nc2cncnc2C(F)(F)F)c1-c1ncccc1NCC(C)(C)O

BIRTHDAY: 2018-11-30T03:40:59.666797
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C23H27N7O

SMILES: CC(C)Nc1ccc(-c2ccc(NC(=O)c3ncnc(N4CCCCC4)n3)cc2)cn1

BIRTHDAY: 2018-11-30T03:40:59.676514
ATC: C02B
- CARDIOVASCULAR SYSTEM
- ANTIHYPERTENSIVES
- ANTIADRENERGIC AGENTS, GANGLION-BLOCKING
Synthesis Plan
FORMULA:C18H25N7O2

SMILES: CC(N)(N)NC1=C(c2ncccc2C(C)(C)O)[C@]2(N)C(=O)CN=CN2C=C1

BIRTHDAY: 2018-11-30T03:40:59.687343
ATC: A03F
- ALIMENTARY TRACT AND METABOLISM
- DRUGS FOR FUNCTIONAL GASTROINTESTINAL DISORDERS
- PROPULSIVES
Synthesis Plan
FORMULA:C18H12F3N3O2S

SMILES: O=C(Nc1cccc(C(=O)Nc2nccs2)c1)c1ccc(C(F)(F)F)cc1

BIRTHDAY: 2018-11-30T03:40:59.696779
ATC: N05B
- NERVOUS SYSTEM
- PSYCHOLEPTICS
- ANXIOLYTICS
Synthesis Plan
FORMULA:C34H63NO

SMILES: CCCCCCCCCCCCCCCCCCCCCCCCCN(C)Cc1ccc(OC)cc1

BIRTHDAY: 2018-11-30T03:40:59.704522
ATC: S01B
- SENSORY ORGANS
- OPHTHALMOLOGICALS
- ANTIINFLAMMATORY AGENTS
Synthesis Plan
FORMULA:C27H30N2O3

SMILES: COc1ccccc1C1=CN=C[C@](c2ccccc2C(C)(C)C(=O)O)(C(C)C)[C@]1(C)C#N

BIRTHDAY: 2018-11-30T03:40:59.723471
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C20H27N7O2

SMILES: CNCCNC1=C(c2cccc(N3CCOCC3)n2)C2=NC(=O)C[C@@H](N)N2C=C1

BIRTHDAY: 2018-11-30T03:40:59.733448
ATC: V08A
- VARIOUS
- CONTRAST MEDIA
- X-RAY CONTRAST MEDIA, IODINATED
Synthesis Plan
FORMULA:C22H22F3N5O

SMILES: CC(C)Nc1ccnc(-c2ccc(NC(=O)c3ccc(NCC(F)(F)F)cn3)cc2)c1

BIRTHDAY: 2018-11-30T03:40:59.753384
ATC: A16A
- ALIMENTARY TRACT AND METABOLISM
- OTHER ALIMENTARY TRACT AND METABOLISM PRODUCTS
- OTHER ALIMENTARY TRACT AND METABOLISM PRODUCTS
Synthesis Plan
FORMULA:C19H21N5S

SMILES: Cc1cccc([C@@H](C)Nc2ccnc3c2N2C=CC=C[C@]2(N)SN3)c1

BIRTHDAY: 2018-11-30T03:40:59.773837
ATC: L01C
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- PLANT ALKALOIDS AND OTHER NATURAL PRODUCTS
Synthesis Plan
FORMULA:C22H22F3N5O

SMILES: CC(C)Nc1cccc(-c2ccc(NC(=O)c3ccc(NCC(F)(F)F)nc3)cc2)n1

BIRTHDAY: 2018-11-30T03:40:59.783486
ATC: J05A
- ANTIINFECTIVES FOR SYSTEMIC USE
- ANTIVIRALS FOR SYSTEMIC USE
- DIRECT ACTING ANTIVIRALS
Synthesis Plan
FORMULA:C26H32N6O

SMILES: C[C@@H](NCc1ccccc1)NC1=CC(c2ncccc2C(C)(C)C)=CN2C=NCC(=O)[C@@]12N

BIRTHDAY: 2018-11-30T03:40:59.793675
ATC: H05A
- SYSTEMIC HORMONAL PREPARATIONS, EXCL. SEX HORMONES AND INSULINS
- CALCIUM HOMEOSTASIS
- PARATHYROID HORMONES AND ANALOGUES
Synthesis Plan
FORMULA:C19H23N5O3

SMILES: C[C@@H](Nc1ccc([C@@H](O)CN)cn1)c1cccc2c1c(=O)n(C)c(=O)n2C

BIRTHDAY: 2018-11-30T03:40:59.823443
ATC: C02A
- CARDIOVASCULAR SYSTEM
- ANTIHYPERTENSIVES
- ANTIADRENERGIC AGENTS, CENTRALLY ACTING
Synthesis Plan
FORMULA:C20H16N6S

SMILES: CSc1cncnc1-c1ccccc1Nc1cncnc1-c1ccncc1

BIRTHDAY: 2018-11-19T08:12:02.715703
ATC: N05A
- NERVOUS SYSTEM
- PSYCHOLEPTICS
- ANTIPSYCHOTICS
Synthesis Plan
FORMULA:C29H28N8O3

SMILES: N#C[C@H](CO)Nc1cncc(C(=O)Nc2ccccc2-c2cncnc2Nc2ccccc2N2CCOCC2)c1

BIRTHDAY: 2018-11-19T08:12:02.728322
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C22H22F3N5O

SMILES: CC(C)Nc1ccncc1-c1ccccc1NC(=O)c1cc(NCC(F)(F)F)ccn1

BIRTHDAY: 2018-11-19T08:12:02.738251
ATC: L01A
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- ALKYLATING AGENTS
Synthesis Plan
FORMULA:C28H33FN6O2

SMILES: COc1ccccc1-c1c(NCC(C)(C)O)ncc2cnc(Nc3ccc(CNC(C)C)cc3F)nc12

BIRTHDAY: 2018-11-19T08:12:02.749092
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C23H27N5O

SMILES: CC(C)Nc1cncc(-c2cccc(NC(=O)c3ccc(NC(C)C)nc3)c2)c1

BIRTHDAY: 2018-11-19T08:12:02.757758
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C22H19F3N6O2

SMILES: CC(C)COc1cc(Nc2ncc(C(F)(F)F)cn2)cc(C(=O)Nc2cccc(C#N)n2)c1

BIRTHDAY: 2018-11-19T08:12:02.768852
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:C25H28N4O5S

SMILES: Cc1cc(C(=O)Nc2ccc(C)c(-c3cc(NC(C)C)ncc3C(=O)O)c2)ccc1NS(C)(=O)=O

BIRTHDAY: 2018-11-19T08:12:02.779666
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C22H24FN5O

SMILES: CNC(=O)c1ccccc1Nc1c(F)ncnc1Nc1ccccc1C(C)(C)C

BIRTHDAY: 2018-11-19T08:12:02.798438
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C18H25N9O2

SMILES: CC(N)(N)NC1=CC=N[C@]2(N)NC=NC(=O)[C@@]12c1ccncc1N1CCOCC1

BIRTHDAY: 2018-11-19T08:12:02.810264
ATC: H03A
- SYSTEMIC HORMONAL PREPARATIONS, EXCL. SEX HORMONES AND INSULINS
- THYROID THERAPY
- THYROID PREPARATIONS
Synthesis Plan
FORMULA:C25H23F3N6O4S

SMILES: CC(C)Nc1c(-c2c(NC(=O)c3ccccc3C(F)(F)F)cccc2S(C)(=O)=O)cnc2c(=O)[nH]c(N)nc12

BIRTHDAY: 2018-11-19T08:12:02.823868
ATC: C09C
- CARDIOVASCULAR SYSTEM
- AGENTS ACTING ON THE RENIN-ANGIOTENSIN SYSTEM
- ANGIOTENSIN II ANTAGONISTS, PLAIN
Synthesis Plan
FORMULA:C23H22F3N3O2S

SMILES: CC(C)Nc1ccncc1-c1c(NC(=O)c2ccccc2C(F)(F)F)cccc1[S@@+](C)[O-]

BIRTHDAY: 2018-11-19T08:12:02.834770
ATC: R05D
- RESPIRATORY SYSTEM
- COUGH AND COLD PREPARATIONS
- COUGH SUPPRESSANTS, EXCL. COMBINATIONS WITH EXPECTORANTS
Synthesis Plan
FORMULA:C37H67NO3

SMILES: CCCCCCCCCCCCCCCCCCCCCCCCCCCCCN(C)C(=O)c1ccc(O)cc1O

BIRTHDAY: 2018-11-19T08:12:02.855801
ATC: P03B
- ANTIPARASITIC PRODUCTS, INSECTICIDES AND REPELLENTS
- ECTOPARASITICIDES, INCL. SCABICIDES, INSECTICIDES AND REPELLENTS
- INSECTICIDES AND REPELLENTS
Synthesis Plan
FORMULA:C21H25N5O

SMILES: CC1=NC=N[C@@]1(C)C(=O)Nc1cccc(-c2cnccc2NC(C)(C)C)c1

BIRTHDAY: 2018-11-19T08:12:02.864834
ATC: A03C
- ALIMENTARY TRACT AND METABOLISM
- DRUGS FOR FUNCTIONAL GASTROINTESTINAL DISORDERS
- ANTISPASMODICS IN COMBINATION WITH PSYCHOLEPTICS
Synthesis Plan
FORMULA:C19H26N8O2

SMILES: CC(N)(N)NC1=CC(c2ncccc2N2CCOCC2)=C[C@]2(N)C(=O)CN=CN12

BIRTHDAY: 2018-11-19T08:12:02.875616
ATC: N06A
- NERVOUS SYSTEM
- PSYCHOANALEPTICS
- ANTIDEPRESSANTS
Synthesis Plan
FORMULA:C19H18N2O3

SMILES: COc1ccc(-c2ncc(CNCC(=O)O)c3ccccc23)cc1

BIRTHDAY: 2018-11-19T08:12:02.883504
ATC: M01A
- MUSCULO-SKELETAL SYSTEM
- ANTIINFLAMMATORY AND ANTIRHEUMATIC PRODUCTS
- ANTIINFLAMMATORY AND ANTIRHEUMATIC PRODUCTS, NON-STEROIDS
Synthesis Plan
FORMULA:C21H26N6O2

SMILES: CC(C)Nc1cnc2c(=O)[nH]c(N)nc2c1-c1ccccc1NC(=O)C(C)(C)C

BIRTHDAY: 2018-11-19T08:12:02.893609
ATC: D11A
- DERMATOLOGICALS
- OTHER DERMATOLOGICAL PREPARATIONS
- OTHER DERMATOLOGICAL PREPARATIONS
Synthesis Plan
FORMULA:C19H24F4N6O2

SMILES: CC(C)Nc1c(Nc2nccnc2C(F)(F)F)ccnc1C(=O)NC[C@@H](F)C(C)(C)O

BIRTHDAY: 2018-11-19T08:12:02.904581
ATC: A11D
- ALIMENTARY TRACT AND METABOLISM
- VITAMINS
- VITAMIN B1, PLAIN AND IN COMBINATION WITH VITAMIN B6 AND B12
Synthesis Plan
FORMULA:C19H26N8O2

SMILES: NC(N)CNC1=CC2=NC(=O)[C@@H](N)CN2C(c2cccc(N3CCOCC3)n2)=C1

BIRTHDAY: 2018-11-19T08:12:02.914819
ATC: R05D
- RESPIRATORY SYSTEM
- COUGH AND COLD PREPARATIONS
- COUGH SUPPRESSANTS, EXCL. COMBINATIONS WITH EXPECTORANTS
Synthesis Plan
FORMULA:C24H29N5O2

SMILES: CC(C)Nc1cncc2c1COc1cccc(c1)CCN[C@H](N)c1ccc(nc1)OC2

BIRTHDAY: 2018-11-19T08:12:02.924807
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C35H65NO

SMILES: CCCCCCCCCCCCCCCCCCCCCCCCCCN(C)Cc1ccc(OC)cc1

BIRTHDAY: 2018-11-19T08:12:02.932758
ATC: S01B
- SENSORY ORGANS
- OPHTHALMOLOGICALS
- ANTIINFLAMMATORY AGENTS
Synthesis Plan
FORMULA:C32H57NO2

SMILES: CN(C)C(C)(C)C(C)(C)C(C)(C)C(C)(C)C(C)(C)C(C)(C)C(C)(C)C1=CO[C@H]2C=CC=C[C@H]2CO1

BIRTHDAY: 2018-11-19T08:12:02.941110
ATC: J05A
- ANTIINFECTIVES FOR SYSTEMIC USE
- ANTIVIRALS FOR SYSTEMIC USE
- DIRECT ACTING ANTIVIRALS
Synthesis Plan
FORMULA:C20H25N3S

SMILES: CC(C)Nc1ccncc1-c1ccccc1N[C@H]1CC=CCCS1

BIRTHDAY: 2018-11-19T08:12:02.949005
ATC: J05A
- ANTIINFECTIVES FOR SYSTEMIC USE
- ANTIVIRALS FOR SYSTEMIC USE
- DIRECT ACTING ANTIVIRALS
Synthesis Plan
FORMULA:C21H26N4O

SMILES: CC(C)Nc1c(-c2ccccc2C(C)(C)C)cnc2c(=O)n(C)cnc12

BIRTHDAY: 2018-11-19T08:12:02.967971
ATC: D06B
- DERMATOLOGICALS
- ANTIBIOTICS AND CHEMOTHERAPEUTICS FOR DERMATOLOGICAL USE
- CHEMOTHERAPEUTICS FOR TOPICAL USE
Synthesis Plan
FORMULA:C19H18FN5O2

SMILES: COc1ccccc1Nc1ncc(F)c(Nc2cccc(NC(C)=O)c2)n1

BIRTHDAY: 2018-11-19T08:12:02.977442
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C21H22F3N5O2

SMILES: COc1cccc(-c2ncccc2NCC(C)(C)O)c1Nc1cnc(C(F)(F)F)nc1

BIRTHDAY: 2018-11-19T08:12:02.987682
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C19H26N8O2

SMILES: CC(N)(N)NC1=CC=C(c2ncccc2N2CCOCC2)[C@@]2(N)C(=O)CN=CN12

BIRTHDAY: 2018-11-19T08:12:02.998460
ATC: N06A
- NERVOUS SYSTEM
- PSYCHOANALEPTICS
- ANTIDEPRESSANTS
Synthesis Plan
FORMULA:C30H26N4O3

SMILES: COc1ccccc1[C@@]1(C#N)C=NC=C(c2ccccc2C(C)(C)C(=O)O)[C@]12CN=c1ccccc1=N2

BIRTHDAY: 2018-11-19T08:12:03.009907
ATC: G03D
- GENITO URINARY SYSTEM AND SEX HORMONES
- SEX HORMONES AND MODULATORS OF THE GENITAL SYSTEM
- PROGESTOGENS
Synthesis Plan
FORMULA:C26H24F3N5O4S

SMILES: CC(C)Nc1nc(-c2ccc(NC(=O)c3ccc(C(F)(F)F)cc3)c(S(C)(=O)=O)c2)cc2ncn(C)c(=O)c12

BIRTHDAY: 2018-11-19T08:12:03.022345
ATC: A10B
- ALIMENTARY TRACT AND METABOLISM
- DRUGS USED IN DIABETES
- BLOOD GLUCOSE LOWERING DRUGS, EXCL. INSULINS
Synthesis Plan
FORMULA:C23H27N5O

SMILES: CC(C)Nc1ccnc(C(=O)Nc2ccccc2-c2cnccc2NC(C)C)c1

BIRTHDAY: 2018-11-19T08:12:03.031393
ATC: B03B
- BLOOD AND BLOOD FORMING ORGANS
- ANTIANEMIC PREPARATIONS
- VITAMIN B12 AND FOLIC ACID
Synthesis Plan
FORMULA:C19H15F4N5O

SMILES: CNC(=O)c1cccc(Nc2nc(Nc3ccc(C(F)(F)F)cc3)ncc2F)c1

BIRTHDAY: 2018-11-19T08:12:03.041787
ATC: A10B
- ALIMENTARY TRACT AND METABOLISM
- DRUGS USED IN DIABETES
- BLOOD GLUCOSE LOWERING DRUGS, EXCL. INSULINS
Synthesis Plan
FORMULA:C29H40FN5O2

SMILES: C[C@@H](NC1=CC(c2ccccc2F)=CN2C=NCC(=O)[C@]12N)NC(C)(C)C(C)(C)C1(O)[C@@H]2CCC[C@@H]1C2

BIRTHDAY: 2018-11-19T08:12:03.052808
ATC: C09C
- CARDIOVASCULAR SYSTEM
- AGENTS ACTING ON THE RENIN-ANGIOTENSIN SYSTEM
- ANGIOTENSIN II ANTAGONISTS, PLAIN
Synthesis Plan
FORMULA:C31H39N3O6

SMILES: CC(C)Nc1ccncc1-c1ccccc1NC(=O)c1ccccc1[C@H]1COCCOCCOCCOCCO1

BIRTHDAY: 2018-11-19T08:12:03.065220
ATC: P01B
- ANTIPARASITIC PRODUCTS, INSECTICIDES AND REPELLENTS
- ANTIPROTOZOALS
- ANTIMALARIALS
Synthesis Plan
FORMULA:C19H26N8O2

SMILES: CC(N)(N)NC1=C(c2cncc(N3CCOCC3)c2)N2C=NC(=O)C[C@]2(N)C=C1

BIRTHDAY: 2018-11-19T08:12:03.075774
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C29H35N5O

SMILES: CC(C)Nc1ccncc1-c1ccccc1NC(=O)c1cnccc1NC[C@@H]1CCC=CCCC1

BIRTHDAY: 2018-11-19T08:12:03.086070
ATC: M04A
- MUSCULO-SKELETAL SYSTEM
- ANTIGOUT PREPARATIONS
- ANTIGOUT PREPARATIONS
Synthesis Plan
FORMULA:C21H25N5O5S

SMILES: CC(C)Nc1c(-c2c(N[C@H](C)C(=O)O)cccc2S(C)(=O)=O)cnc2c(=O)n(C)cnc12

BIRTHDAY: 2018-11-19T08:12:03.097741
ATC: A10B
- ALIMENTARY TRACT AND METABOLISM
- DRUGS USED IN DIABETES
- BLOOD GLUCOSE LOWERING DRUGS, EXCL. INSULINS
Synthesis Plan
FORMULA:C20H25N7O2

SMILES: CNCCNc1nc(-c2ccc(N3CCOCC3)nc2)cc2ncn(C)c(=O)c12

BIRTHDAY: 2018-11-19T08:12:03.107697
ATC: B01A
- BLOOD AND BLOOD FORMING ORGANS
- ANTITHROMBOTIC AGENTS
- ANTITHROMBOTIC AGENTS
Synthesis Plan
FORMULA:C18H24N2O

SMILES: Cc1ccc(C2N3CC4(C)CN2CC(C)(C3)C4=O)cc1C

BIRTHDAY: 2018-11-19T08:12:03.114852
ATC: N03A
- NERVOUS SYSTEM
- ANTIEPILEPTICS
- ANTIEPILEPTICS
Synthesis Plan
FORMULA:C26H38N6O

SMILES: CC(C)Nc1ccncc1-c1ccccc1N1CCNCCNCCNC[C@H]2C[C@@H]1CC2=O

BIRTHDAY: 2018-11-19T08:12:03.124939
ATC: P01B
- ANTIPARASITIC PRODUCTS, INSECTICIDES AND REPELLENTS
- ANTIPROTOZOALS
- ANTIMALARIALS
Synthesis Plan
FORMULA:C19H26N8O2

SMILES: CC(N)(N)NC1=C[C@]2(N)C(=O)CN=CN2C(c2ncccc2N2CCOCC2)=C1

BIRTHDAY: 2018-11-19T08:12:03.136333
ATC: N02C
- NERVOUS SYSTEM
- ANALGESICS
- ANTIMIGRAINE PREPARATIONS
Synthesis Plan
FORMULA:C25H27N7O2

SMILES: CC(C)NC(=O)c1cc2cc(Nc3nccc(-c4cc(C(=O)N(C)C)ccn4)n3)ccc2n1C

BIRTHDAY: 2018-11-19T08:12:03.146833
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C22H22F3N5O

SMILES: CC(C)Nc1ccc(-c2ccc(NC(=O)c3ccc(NCC(F)(F)F)nc3)cc2)cn1

BIRTHDAY: 2018-11-19T08:12:03.156550
ATC: C03B
- CARDIOVASCULAR SYSTEM
- DIURETICS
- LOW-CEILING DIURETICS, EXCL. THIAZIDES
Synthesis Plan
FORMULA:C16H27N7O2S2

SMILES: CC(C)NCCN1[C@H]2C=CC=C[C@@]2(NC(C)C)N(c2nnc(N)s2)S1(=O)=O

BIRTHDAY: 2018-11-19T08:12:03.169485
ATC: N05A
- NERVOUS SYSTEM
- PSYCHOLEPTICS
- ANTIPSYCHOTICS
Synthesis Plan
FORMULA:C21H24N6O

SMILES: COc1ccc([C@@]2(C(N)(N)Cc3n[nH]cc3N)C=NC=C3C=CC=C[C@@H]32)cc1

BIRTHDAY: 2018-11-19T08:12:03.183785
ATC: J01F
- ANTIINFECTIVES FOR SYSTEMIC USE
- ANTIBACTERIALS FOR SYSTEMIC USE
- MACROLIDES, LINCOSAMIDES AND STREPTOGRAMINS
Synthesis Plan
FORMULA:C24H24N6O2

SMILES: CC(C)Nc1cnc2c(=O)[nH]c(N)nc2c1-c1ccccc1NC(=O)Cc1ccccc1

BIRTHDAY: 2018-11-19T08:12:03.198071
ATC: V04C
- VARIOUS
- DIAGNOSTIC AGENTS
- OTHER DIAGNOSTIC AGENTS
Synthesis Plan
FORMULA:C20H22N2O3

SMILES: COc1ccc(-c2nc(CNC[C@H](O)CO)cc3ccccc23)cc1

BIRTHDAY: 2018-11-19T08:12:03.209539
ATC: N01B
- NERVOUS SYSTEM
- ANESTHETICS
- ANESTHETICS, LOCAL
Synthesis Plan
FORMULA:C18H23N7O2

SMILES: CNCCNc1nc(-c2ccc(C(C)(C)O)nc2)cc2nc(N)[nH]c(=O)c12

BIRTHDAY: 2018-11-19T08:12:03.223176
ATC: C09C
- CARDIOVASCULAR SYSTEM
- AGENTS ACTING ON THE RENIN-ANGIOTENSIN SYSTEM
- ANGIOTENSIN II ANTAGONISTS, PLAIN
Synthesis Plan
FORMULA:C21H17F3N6O

SMILES: COc1cccc(Nc2cncnc2C(F)(F)F)c1-c1nccc(C#N)c1NC1CC1

BIRTHDAY: 2018-11-19T08:12:03.237650
ATC: C10A
- CARDIOVASCULAR SYSTEM
- LIPID MODIFYING AGENTS
- LIPID MODIFYING AGENTS, PLAIN
Synthesis Plan
FORMULA:C26H28N6O2

SMILES: COc1cccc(-c2cc3cnc(-c4ccc(N)nc4)cc3c(NCCN3CCOCC3)n2)c1

BIRTHDAY: 2018-11-19T08:12:03.248247
ATC: C02K
- CARDIOVASCULAR SYSTEM
- ANTIHYPERTENSIVES
- OTHER ANTIHYPERTENSIVES
Synthesis Plan
FORMULA:C21H22F3N5O2

SMILES: COc1ccc(-c2ccc(NCC(C)(C)O)cn2)c(Nc2cnc(C(F)(F)F)nc2)c1

BIRTHDAY: 2018-11-19T08:12:03.258678
ATC: A07A
- ALIMENTARY TRACT AND METABOLISM
- ANTIDIARRHEALS, INTESTINAL ANTIINFLAMMATORY/ANTIINFECTIVE AGENTS
- INTESTINAL ANTIINFECTIVES
Synthesis Plan
FORMULA:C10H18N4

SMILES: C[C@H]1NC(N)=N[C@@H]2C3CCN(CC3)[C@H]12

BIRTHDAY: 2018-11-19T08:12:03.265358
ATC: B02A
- BLOOD AND BLOOD FORMING ORGANS
- ANTIHEMORRHAGICS
- ANTIFIBRINOLYTICS
Synthesis Plan
FORMULA:C36H40N6O4

SMILES: Cc1ccc2cc1CN1CC[C@H](N[C@H](Nc3cccc(-c4ccc(NC(C)C)nc4)c3)CNCc3ccc(C(=O)O)c(c3)O2)C1=O

BIRTHDAY: 2018-11-19T08:12:03.278761
ATC: N03A
- NERVOUS SYSTEM
- ANTIEPILEPTICS
- ANTIEPILEPTICS
Synthesis Plan
FORMULA:C20H23N5O3

SMILES: CC(C)Nc1ccncc1-c1ccc2cc(N)c(=O)[nH]c2c1N[C@@H](C)C(=O)O

BIRTHDAY: 2018-11-19T08:12:03.288824
ATC: J05A
- ANTIINFECTIVES FOR SYSTEMIC USE
- ANTIVIRALS FOR SYSTEMIC USE
- DIRECT ACTING ANTIVIRALS
Synthesis Plan
FORMULA:C24H29N5O2

SMILES: CC(C)Nc1ccc(-c2ccc(NC(=O)c3ccnc(NCC(C)(C)O)c3)cc2)cn1

BIRTHDAY: 2018-11-19T08:12:03.298068
ATC: C01D
- CARDIOVASCULAR SYSTEM
- CARDIAC THERAPY
- VASODILATORS USED IN CARDIAC DISEASES
Synthesis Plan
FORMULA:C19H24F3N5O

SMILES: CN(C)CCCC[C@H](c1ccc(Nc2nccc(C(N)=O)n2)cc1)C(F)(F)F

BIRTHDAY: 2018-11-19T08:12:03.307488
ATC: A03F
- ALIMENTARY TRACT AND METABOLISM
- DRUGS FOR FUNCTIONAL GASTROINTESTINAL DISORDERS
- PROPULSIVES
Synthesis Plan
FORMULA:C22H29N5O4S

SMILES: CC(C)Nc1c(-c2c(NCC(C)(C)O)cccc2S(C)(=O)=O)cnc2c(=O)n(C)cnc12

BIRTHDAY: 2018-11-19T08:12:03.328394
ATC: J05A
- ANTIINFECTIVES FOR SYSTEMIC USE
- ANTIVIRALS FOR SYSTEMIC USE
- DIRECT ACTING ANTIVIRALS
Synthesis Plan
FORMULA:C37H42N6O7

SMILES: CC(C)N[C@H]1C[C@@H]2C=C(N3C(=O)CCC3=O)OCc3c4cc(cc3OC[C@@H](C1)O2)Nc1nccc(n1)-c1cncc(c1)COCC=CCOC4

BIRTHDAY: 2018-11-19T08:12:03.343464
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C21H22F3N5O2

SMILES: COc1cccc(-c2ncccc2NCC(C)(C)O)c1Nc1cncnc1C(F)(F)F

BIRTHDAY: 2018-11-19T08:12:03.353956
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C47H61FN8O3

SMILES: CC(C)Nc1nc(Nc2nccnc2C2=CCCCCCCCCCCc3ccc(o3)C3=NC(=Cc4ccc([nH]4)CCCC2)C=C3)ccc1C(=O)NC[C@H](F)C(C)(C)O

BIRTHDAY: 2018-11-19T08:12:03.380657
ATC: D06B
- DERMATOLOGICALS
- ANTIBIOTICS AND CHEMOTHERAPEUTICS FOR DERMATOLOGICAL USE
- CHEMOTHERAPEUTICS FOR TOPICAL USE
Synthesis Plan
FORMULA:C24H29N5O3S

SMILES: CC(C)Nc1cc(C(=O)Nc2cc(-c3ccnc(NC(C)C)c3)ccc2S(C)(=O)=O)ccn1

BIRTHDAY: 2018-11-19T08:12:03.391466
ATC: J05A
- ANTIINFECTIVES FOR SYSTEMIC USE
- ANTIVIRALS FOR SYSTEMIC USE
- DIRECT ACTING ANTIVIRALS
Synthesis Plan
FORMULA:C25H25N5O2

SMILES: CC(C)Nc1nc(-c2ccc(NC(=O)Cc3ccccc3)cc2)cc2ncn(C)c(=O)c12

BIRTHDAY: 2018-11-19T08:12:03.401182
ATC: A10B
- ALIMENTARY TRACT AND METABOLISM
- DRUGS USED IN DIABETES
- BLOOD GLUCOSE LOWERING DRUGS, EXCL. INSULINS
Synthesis Plan
FORMULA:C21H25N7O2

SMILES: COc1cc(N2CCN(C(C)=O)CC2)ccc1Nc1nccc(-c2cncn2C)n1

BIRTHDAY: 2018-11-19T08:12:03.411251
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C24H22F3N3O3

SMILES: Cc1ccc(NC(=O)c2ccc(C(F)(F)F)cc2)cc1-c1cnc(NC(C)C)c(C(=O)O)c1

BIRTHDAY: 2018-11-19T08:12:03.421507
ATC: L04A
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- IMMUNOSUPPRESSANTS
- IMMUNOSUPPRESSANTS
Synthesis Plan
FORMULA:C27H31F3N6O

SMILES: C[C@@H](NCc1ccccc1C(F)(F)F)NC1=C(c2ncccc2C(C)(C)C)[C@]2(N)C(=O)CN=CN2C=C1

BIRTHDAY: 2018-11-19T08:12:03.433842
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C42H41N9O2

SMILES: CC(C)Nc1ccnc(-c2ccccc2NC(=O)c2cc(N[C@H]3NCC=CCCOc4cccc(c4)-c4ccnc(n4)Nc4cccc3c4)ccn2)c1

BIRTHDAY: 2018-11-19T08:12:03.448962
ATC: V09X
- VARIOUS
- DIAGNOSTIC RADIOPHARMACEUTICALS
- OTHER DIAGNOSTIC RADIOPHARMACEUTICALS
Synthesis Plan
FORMULA:C19H15F4N5O

SMILES: CNC(=O)c1ccc(Nc2c(F)ncnc2Nc2ccccc2C(F)(F)F)cc1

BIRTHDAY: 2018-11-19T08:12:03.470882
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C22H28F2N6O2

SMILES: CC(C)Nc1c(Nc2cnc3c(n2)C=CC[C@H]3F)ccnc1C(=O)NC[C@@H](F)C(C)(C)O

BIRTHDAY: 2018-11-19T08:12:03.483217
ATC: C03C
- CARDIOVASCULAR SYSTEM
- DIURETICS
- HIGH-CEILING DIURETICS
Synthesis Plan
FORMULA:C19H15FN6O

SMILES: CNC(=O)c1cccc(Nc2nc(Nc3cccc(C#N)c3)ncc2F)c1

BIRTHDAY: 2018-11-19T08:12:03.492920
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C19H26N8O2

SMILES: CC(N)(N)NC1=C(c2ncccc2N2CCOCC2)[C@]2(N)C(=O)CN=CN2C=C1

BIRTHDAY: 2018-11-19T08:12:03.516120
ATC: N05A
- NERVOUS SYSTEM
- PSYCHOLEPTICS
- ANTIPSYCHOTICS
Synthesis Plan
FORMULA:C25H23F3N6O2

SMILES: Cc1cccc(NC(=O)c2ccccc2C(F)(F)F)c1-c1cnc2c(=O)[nH]c(N)nc2c1NC(C)C

BIRTHDAY: 2018-11-19T08:12:03.528219
ATC: C09C
- CARDIOVASCULAR SYSTEM
- AGENTS ACTING ON THE RENIN-ANGIOTENSIN SYSTEM
- ANGIOTENSIN II ANTAGONISTS, PLAIN
Synthesis Plan
FORMULA:C19H26N8O2

SMILES: CC(N)(N)NC1=C(c2ncccc2N2CCOCC2)C2=NCC(=O)[C@@H](N)N2C=C1

BIRTHDAY: 2018-11-19T08:12:03.539550
ATC: N02C
- NERVOUS SYSTEM
- ANALGESICS
- ANTIMIGRAINE PREPARATIONS
Synthesis Plan
FORMULA:C18H25N7O2

SMILES: CC(N)(N)NC1=C(c2ncccc2C(C)(C)O)C=C[C@@]2(N)C(=O)CN=CN12

BIRTHDAY: 2018-11-19T08:12:03.549652
ATC: C10A
- CARDIOVASCULAR SYSTEM
- LIPID MODIFYING AGENTS
- LIPID MODIFYING AGENTS, PLAIN
Synthesis Plan
FORMULA:C19H24FN7O2

SMILES: CC(C)Nc1ccc(C(=O)NC[C@@H](F)C(C)(C)O)nc1Nc1nccnc1C#N

BIRTHDAY: 2018-11-19T08:12:03.559813
ATC: J05A
- ANTIINFECTIVES FOR SYSTEMIC USE
- ANTIVIRALS FOR SYSTEMIC USE
- DIRECT ACTING ANTIVIRALS
Synthesis Plan
FORMULA:C22H25FN8OS

SMILES: CC(C)Nc1ccc(C(=O)NC[C@H](F)C2=CSCCN2)nc1N1C[C@@H]2C=CC(C#N)=NC2=N1

BIRTHDAY: 2018-11-30T17:23:21.465614
ATC: N01A
- NERVOUS SYSTEM
- ANESTHETICS
- ANESTHETICS, GENERAL
Synthesis Plan
FORMULA:C25H32N8O3

SMILES: Nc1nc2cc(-c3ccc(N4CCOCC4)nc3)nc(NCCNC[C@@H]3C[C@H]4CC[C@H]3O4)c2c(=O)[nH]1

BIRTHDAY: 2018-11-30T17:23:21.485562
ATC: C09C
- CARDIOVASCULAR SYSTEM
- AGENTS ACTING ON THE RENIN-ANGIOTENSIN SYSTEM
- ANGIOTENSIN II ANTAGONISTS, PLAIN
Synthesis Plan
FORMULA:C22H25N5O

SMILES: CNc1ncccc1C(=O)Nc1ccc(-c2cccc(NC(C)(C)C)n2)cc1

BIRTHDAY: 2018-11-30T17:23:21.494081
ATC: G04C
- GENITO URINARY SYSTEM AND SEX HORMONES
- UROLOGICALS
- DRUGS USED IN BENIGN PROSTATIC HYPERTROPHY
Synthesis Plan
FORMULA:C25H23F3N6O4S

SMILES: CC(C)Nc1cnc2c(=O)[nH]c(N)nc2c1-c1c(NC(=O)c2ccccc2C(F)(F)F)cccc1S(C)(=O)=O

BIRTHDAY: 2018-11-30T17:23:21.508898
ATC: C09C
- CARDIOVASCULAR SYSTEM
- AGENTS ACTING ON THE RENIN-ANGIOTENSIN SYSTEM
- ANGIOTENSIN II ANTAGONISTS, PLAIN
Synthesis Plan
FORMULA:C21H24F3N7O3S

SMILES: COc1cc(N2CCN(S(C)(=O)=O)CC2)ccc1Nc1nccc(-c2cnc(C(F)(F)F)n2C)n1

BIRTHDAY: 2018-11-30T17:23:21.521113
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C26H26FN7O3

SMILES: CC(C)Nc1cncc([C@H](O)CO)c1C(=O)Nc1cccc(F)c1Nc1cncnc1-c1ccccn1

BIRTHDAY: 2018-11-30T17:23:21.544622
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C21H17F3N6O

SMILES: COc1cc(Nc2nccc(C(F)(F)F)n2)cc(-c2cnc(NC3CC3)c(C#N)c2)c1

BIRTHDAY: 2018-11-30T17:23:21.555068
ATC: A10B
- ALIMENTARY TRACT AND METABOLISM
- DRUGS USED IN DIABETES
- BLOOD GLUCOSE LOWERING DRUGS, EXCL. INSULINS
Synthesis Plan
FORMULA:C19H26N8O2

SMILES: CC(N)(N)NC1=C(c2ncccc2N2CCOCC2)C=C[C@@]2(N)C(=O)CN=CN12

BIRTHDAY: 2018-11-30T17:23:21.565855
ATC: M01A
- MUSCULO-SKELETAL SYSTEM
- ANTIINFLAMMATORY AND ANTIRHEUMATIC PRODUCTS
- ANTIINFLAMMATORY AND ANTIRHEUMATIC PRODUCTS, NON-STEROIDS
Synthesis Plan
FORMULA:C20H18F3N5O

SMILES: COc1cc(-c2ccc(NC3CC3)nc2)ccc1Nc1nccc(C(F)(F)F)n1

BIRTHDAY: 2018-11-30T17:23:21.575724
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C19H26N8O2

SMILES: CNCCNC1=C[C@]2(N)C(=O)NC=N[C@]2(c2cc(N3CCOCC3)ccn2)N=C1

BIRTHDAY: 2018-11-30T17:23:21.596269
ATC: L04A
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- IMMUNOSUPPRESSANTS
- IMMUNOSUPPRESSANTS
Synthesis Plan
FORMULA:C21H17F3N6O

SMILES: COc1cccc(-c2nccc(C#N)c2NC2CC2)c1Nc1cnc(C(F)(F)F)nc1

BIRTHDAY: 2018-11-30T17:23:21.606489
ATC: N05A
- NERVOUS SYSTEM
- PSYCHOLEPTICS
- ANTIPSYCHOTICS
Synthesis Plan
FORMULA:C19H26N8O2

SMILES: CC(N)(N)NC1=C[C@@]2(N)C(=O)CN=CN2C(c2ncccc2N2CCOCC2)=C1

BIRTHDAY: 2018-11-30T17:23:21.630421
ATC: N02C
- NERVOUS SYSTEM
- ANALGESICS
- ANTIMIGRAINE PREPARATIONS
Synthesis Plan
FORMULA:C18H25N9O2

SMILES: CC(N)(N)NC1=N[C@@]2(N)N=CNC(=O)[C@@H]2C(c2cc(N3CCOCC3)ccn2)=C1

BIRTHDAY: 2018-11-30T17:23:21.641045
ATC: N06A
- NERVOUS SYSTEM
- PSYCHOANALEPTICS
- ANTIDEPRESSANTS
Synthesis Plan
FORMULA:C29H22N4O3

SMILES: COc1ccc(-c2nc(-c3ccc(C(C)(C)C(=O)O)cc3)c3nc4ccccc4nc3c2C#N)cc1

BIRTHDAY: 2018-11-30T17:23:21.651529
ATC: G03G
- GENITO URINARY SYSTEM AND SEX HORMONES
- SEX HORMONES AND MODULATORS OF THE GENITAL SYSTEM
- GONADOTROPINS AND OTHER OVULATION STIMULANTS
Synthesis Plan
FORMULA:C29H36N6O4

SMILES: C[C@]1(NC2=CC(c3ccncc3N3CCOCC3)=CN3C=NCC(=O)[C@@]23N)CC[C@H]2C=C3COCO[C@]31CC2

BIRTHDAY: 2018-12-02T16:06:29.647870
ATC: J01D
- ANTIINFECTIVES FOR SYSTEMIC USE
- ANTIBACTERIALS FOR SYSTEMIC USE
- OTHER BETA-LACTAM ANTIBACTERIALS
Synthesis Plan
FORMULA:C21H20F3N5O

SMILES: Cc1cc(Nc2nccc(C(F)(F)F)n2)cc(-c2ccc(N3CCOCC3)nc2)c1

BIRTHDAY: 2018-12-02T16:06:29.657835
ATC: G03B
- GENITO URINARY SYSTEM AND SEX HORMONES
- SEX HORMONES AND MODULATORS OF THE GENITAL SYSTEM
- ANDROGENS
Synthesis Plan
FORMULA:C28H33F3N4O2

SMILES: COc1cc2c(cc1Nc1nccc(C(F)(F)F)n1)CCCCCCCN(C)CCc1ccc(cc1)O2

BIRTHDAY: 2018-12-02T16:06:29.668803
ATC: S01L
- SENSORY ORGANS
- OPHTHALMOLOGICALS
- OCULAR VASCULAR DISORDER AGENTS
Synthesis Plan
FORMULA:C19H24F3N5O

SMILES: CN(C)C(C)(C)C[C@H](c1ccccc1Nc1cnc(C(N)=O)nc1)C(F)(F)F

BIRTHDAY: 2018-12-02T16:06:29.678530
ATC: C03B
- CARDIOVASCULAR SYSTEM
- DIURETICS
- LOW-CEILING DIURETICS, EXCL. THIAZIDES
Synthesis Plan
FORMULA:C16H18F3N3O

SMILES: C[C@H](Nc1cccnc1[C@@H](O)CN)c1ccccc1C(F)(F)F

BIRTHDAY: 2018-12-02T16:06:29.697702
ATC: C01C
- CARDIOVASCULAR SYSTEM
- CARDIAC THERAPY
- CARDIAC STIMULANTS EXCL. CARDIAC GLYCOSIDES
Synthesis Plan
FORMULA:C24H26N6O3S

SMILES: CC(C)Nc1ccc(-c2ccc(NC(=O)c3cccc(NC4=CNS(=O)(=O)CC4)n3)cc2)cn1

BIRTHDAY: 2018-12-02T16:06:29.708255
ATC: M01A
- MUSCULO-SKELETAL SYSTEM
- ANTIINFLAMMATORY AND ANTIRHEUMATIC PRODUCTS
- ANTIINFLAMMATORY AND ANTIRHEUMATIC PRODUCTS, NON-STEROIDS
Synthesis Plan
FORMULA:C21H22F3N5O2

SMILES: COc1c(Nc2nccc(C(F)(F)F)n2)cccc1-c1cccc(NCC(C)(C)O)n1

BIRTHDAY: 2018-12-02T16:06:29.718312
ATC: C01D
- CARDIOVASCULAR SYSTEM
- CARDIAC THERAPY
- VASODILATORS USED IN CARDIAC DISEASES
Synthesis Plan
FORMULA:C20H24N8O2

SMILES: COc1cccc(N2CCN(C(C)=O)CC2)c1Nc1ncncc1-c1nc[nH]c1N

BIRTHDAY: 2018-12-02T16:06:29.728939
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C26H32N6O

SMILES: C[C@@H](NCc1ccccc1)NC1=C(c2ncccc2C(C)(C)C)[C@]2(N)C(=O)CN=CN2C=C1

BIRTHDAY: 2018-12-02T16:06:29.760678
ATC: C10A
- CARDIOVASCULAR SYSTEM
- LIPID MODIFYING AGENTS
- LIPID MODIFYING AGENTS, PLAIN
Synthesis Plan
FORMULA:C34H63NO

SMILES: COc1ccccc1CN(C)C(C)(C)C(C)(C)C(C)(C)C(C)(C)C(C)(C)C(C)(C)C(C)(C)C(C)(C)C

BIRTHDAY: 2018-12-02T16:06:29.777672
ATC: C08C
- CARDIOVASCULAR SYSTEM
- CALCIUM CHANNEL BLOCKERS
- SELECTIVE CALCIUM CHANNEL BLOCKERS WITH MAINLY VASCULAR EFFECTS
Synthesis Plan
FORMULA:C26H24F3N5O4S

SMILES: CC(C)Nc1nc(-c2cc(NC(=O)c3ccc(C(F)(F)F)cc3)cc(S(C)(=O)=O)c2)cc2ncn(C)c(=O)c12

BIRTHDAY: 2018-12-02T16:06:29.800614
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:C22H24FN5O3

SMILES: CC(=O)Nc1ccccc1Nc1ncnc(F)c1Nc1ccccc1OCC(C)(C)O

BIRTHDAY: 2018-12-02T16:06:29.811033
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C23H26N6O2

SMILES: CC(C)Nc1ccncc1-c1cccc2c1NCCC(=O)COc1cnc(N)c(n1)C2

BIRTHDAY: 2018-12-02T16:06:29.821024
ATC: J01X
- ANTIINFECTIVES FOR SYSTEMIC USE
- ANTIBACTERIALS FOR SYSTEMIC USE
- OTHER ANTIBACTERIALS
Synthesis Plan
FORMULA:C19H26N8O2

SMILES: CC(N)(N)NC1=CC(c2ccncc2N2CCOCC2)=CN2C=NCC(=O)[C@]12N

BIRTHDAY: 2018-12-03T10:42:51.395178
ATC: A03F
- ALIMENTARY TRACT AND METABOLISM
- DRUGS FOR FUNCTIONAL GASTROINTESTINAL DISORDERS
- PROPULSIVES
Synthesis Plan
FORMULA:C26H32N6O

SMILES: C[C@H](NCc1ccccc1)NC1=C(c2ncccc2C(C)(C)C)C=CN2C=NCC(=O)[C@]12N

BIRTHDAY: 2018-12-03T10:42:51.416947
ATC: N07C
- NERVOUS SYSTEM
- OTHER NERVOUS SYSTEM DRUGS
- ANTIVERTIGO PREPARATIONS
Synthesis Plan
FORMULA:C25H29N7O

SMILES: CC(C)(C)c1ccc(-c2cc3nc(N)[nH]c(=O)c3c(NCCNCc3ccccc3)n2)cn1

BIRTHDAY: 2018-12-03T10:42:51.427417
ATC: C09C
- CARDIOVASCULAR SYSTEM
- AGENTS ACTING ON THE RENIN-ANGIOTENSIN SYSTEM
- ANGIOTENSIN II ANTAGONISTS, PLAIN
Synthesis Plan
FORMULA:C22H29N5O4S

SMILES: CC(C)Nc1nc(-c2cc(NCC(C)(C)O)cc(S(C)(=O)=O)c2)cc2ncn(C)c(=O)c12

BIRTHDAY: 2018-12-03T10:42:51.438121
ATC: L03A
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- IMMUNOSTIMULANTS
- IMMUNOSTIMULANTS
Synthesis Plan
FORMULA:C24H22N4O3

SMILES: COc1ccc([C@H]2c3c(nc[nH]c3=O)N=C(c3ccc(C(C)(C)O)cc3)[C@H]2C#N)cc1

BIRTHDAY: 2018-12-03T10:42:51.447894
ATC: N06D
- NERVOUS SYSTEM
- PSYCHOANALEPTICS
- ANTI-DEMENTIA DRUGS
Synthesis Plan
FORMULA:C22H23N9O

SMILES: CC(C)Nc1ccc(-c2cccc(NC(=O)c3ncnc(NCC4=NCN=C4)n3)c2)cn1

BIRTHDAY: 2018-12-03T10:42:51.468930
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C18H12F6N6O

SMILES: Nc1cccc(NC(=O)c2cc(Nc3nccc(C(F)(F)F)n3)cc(C(F)(F)F)c2)n1

BIRTHDAY: 2018-12-03T10:42:51.480401
ATC: C02A
- CARDIOVASCULAR SYSTEM
- ANTIHYPERTENSIVES
- ANTIADRENERGIC AGENTS, CENTRALLY ACTING
Synthesis Plan
FORMULA:C8H13NOS2

SMILES: CC(C)NC1=CSCC(=O)CS1

BIRTHDAY: 2018-12-03T10:42:51.486484
ATC: G01A
- GENITO URINARY SYSTEM AND SEX HORMONES
- GYNECOLOGICAL ANTIINFECTIVES AND ANTISEPTICS
- ANTIINFECTIVES AND ANTISEPTICS, EXCL. COMBINATIONS WITH CORTICOSTEROIDS
Synthesis Plan
FORMULA:C19H26N8O2

SMILES: CC(N)(N)NC1=C[C@@]2(N)C(=O)CN=CN2C=C1c1ccncc1N1CCOCC1

BIRTHDAY: 2018-12-03T10:42:51.497670
ATC: J05A
- ANTIINFECTIVES FOR SYSTEMIC USE
- ANTIVIRALS FOR SYSTEMIC USE
- DIRECT ACTING ANTIVIRALS
Synthesis Plan
FORMULA:C21H26FN7O2

SMILES: CC(C)Nc1nc(C(=O)NC[C@@H](F)C(C)(C)O)ccc1N1N=C[C@@H]2C=CC=N[C@]21C#N

BIRTHDAY: 2018-12-03T10:42:51.509225
ATC: N06B
- NERVOUS SYSTEM
- PSYCHOANALEPTICS
- PSYCHOSTIMULANTS, AGENTS USED FOR ADHD AND NOOTROPICS
Synthesis Plan
FORMULA:C18H25N7O2

SMILES: CC(N)(N)NC1=CN2C=NCC(=O)[C@@]2(N)C(c2ncccc2C(C)(C)O)=C1

BIRTHDAY: 2018-12-03T10:42:51.540935
ATC: N05A
- NERVOUS SYSTEM
- PSYCHOLEPTICS
- ANTIPSYCHOTICS
Synthesis Plan
FORMULA:C19H26N8O2

SMILES: CC(N)(N)NC1=CC=C(c2ncccc2N2CCOCC2)N2C=NCC(=O)[C@]12N

BIRTHDAY: 2018-12-03T10:42:51.563949
ATC: A10B
- ALIMENTARY TRACT AND METABOLISM
- DRUGS USED IN DIABETES
- BLOOD GLUCOSE LOWERING DRUGS, EXCL. INSULINS
Synthesis Plan
FORMULA:C26H32N6O

SMILES: C[C@@H](NCc1ccccc1)NC1=CC(c2ncccc2C(C)(C)C)=C[C@]2(N)C(=O)CN=CN12

BIRTHDAY: 2018-12-03T10:42:51.574861
ATC: G02C
- GENITO URINARY SYSTEM AND SEX HORMONES
- OTHER GYNECOLOGICALS
- OTHER GYNECOLOGICALS
Synthesis Plan
FORMULA:C21H26FN7O2

SMILES: CC(C)Nc1cnc(C(=O)NC[C@@H](F)C(C)(C)O)cc1N1N=C[C@@H]2C=CC=N[C@]21C#N

BIRTHDAY: 2018-12-03T10:42:51.587275
ATC: D06B
- DERMATOLOGICALS
- ANTIBIOTICS AND CHEMOTHERAPEUTICS FOR DERMATOLOGICAL USE
- CHEMOTHERAPEUTICS FOR TOPICAL USE
Synthesis Plan
FORMULA:C22H22F4N4O

SMILES: CC(C)Nc1ccnc(-c2cnccc2NCc2ccccc2F)c1[C@@H](O)C(F)(F)F

BIRTHDAY: 2018-12-03T19:11:16.426205
ATC: L01D
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- CYTOTOXIC ANTIBIOTICS AND RELATED SUBSTANCES
Synthesis Plan
FORMULA:C29H28N4O4

SMILES: COc1ccc2c(n1)NCc1cccc(c1)Oc1ccc3cccc(c3c1)NC(=O)CN(C(C)C)C2=O

BIRTHDAY: 2018-12-03T19:11:16.437302
ATC: B01A
- BLOOD AND BLOOD FORMING ORGANS
- ANTITHROMBOTIC AGENTS
- ANTITHROMBOTIC AGENTS
Synthesis Plan
FORMULA:C21H26FN7O2

SMILES: CC(C)Nc1ccc(C(=O)NC[C@@H](F)C(C)(C)O)nc1N1N=C[C@]2(C#N)C=CN=C[C@H]12

BIRTHDAY: 2018-12-03T19:11:16.448179
ATC: L04A
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- IMMUNOSUPPRESSANTS
- IMMUNOSUPPRESSANTS
Synthesis Plan
FORMULA:C22H22F3N5O

SMILES: CC(C)Nc1cc(-c2cccc(NC(=O)c3ccc(NCC(F)(F)F)nc3)c2)ccn1

BIRTHDAY: 2018-12-03T19:11:16.458029
ATC: C03C
- CARDIOVASCULAR SYSTEM
- DIURETICS
- HIGH-CEILING DIURETICS
Synthesis Plan
FORMULA:C21H22F3N5O2

SMILES: COc1cccc(Nc2cncnc2C(F)(F)F)c1-c1ccncc1NCC(C)(C)O

BIRTHDAY: 2018-12-03T19:11:16.476434
ATC: C10A
- CARDIOVASCULAR SYSTEM
- LIPID MODIFYING AGENTS
- LIPID MODIFYING AGENTS, PLAIN
Synthesis Plan
FORMULA:C33H29N5O2

SMILES: O=C(Nc1ccc(-c2c3ccc4ccn(c24)CC=CCOCc2cccc(c2)Nc2nccc-3n2)cc1)C1CC1

BIRTHDAY: 2018-12-03T19:11:16.498253
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C20H26N6O2

SMILES: Nc1nc2ncc(N3CCCC4=CN(CCCCCC3=O)CC4)cc2c(=O)[nH]1

BIRTHDAY: 2018-12-03T19:11:16.507622
ATC: A11H
- ALIMENTARY TRACT AND METABOLISM
- VITAMINS
- OTHER PLAIN VITAMIN PREPARATIONS
Synthesis Plan
FORMULA:C23H27N5O

SMILES: CC(C)Nc1cncc(-c2ccc(NC(=O)c3cccnc3NC(C)C)cc2)c1

BIRTHDAY: 2018-12-03T19:11:16.516501
ATC: G01A
- GENITO URINARY SYSTEM AND SEX HORMONES
- GYNECOLOGICAL ANTIINFECTIVES AND ANTISEPTICS
- ANTIINFECTIVES AND ANTISEPTICS, EXCL. COMBINATIONS WITH CORTICOSTEROIDS
Synthesis Plan
FORMULA:C21H26N4OS

SMILES: CC(C)Nc1cc(-c2ccc(NC(=O)C[C@@H]3C=CNCSC3)cc2)ccn1

BIRTHDAY: 2018-12-03T19:11:16.535629
ATC: C08C
- CARDIOVASCULAR SYSTEM
- CALCIUM CHANNEL BLOCKERS
- SELECTIVE CALCIUM CHANNEL BLOCKERS WITH MAINLY VASCULAR EFFECTS
Synthesis Plan
FORMULA:C27H26F3N5O4S

SMILES: CC(C)Nc1nc(-c2ccc(NC(=O)Cc3ccc(C(F)(F)F)cc3)c(S(C)(=O)=O)c2)cc2ncn(C)c(=O)c12

BIRTHDAY: 2018-12-03T19:11:16.548175
ATC: A10B
- ALIMENTARY TRACT AND METABOLISM
- DRUGS USED IN DIABETES
- BLOOD GLUCOSE LOWERING DRUGS, EXCL. INSULINS
Synthesis Plan
FORMULA:C29H31N11O2

SMILES: CC(N)(N)NC1=CN2C=NCC(=O)[C@@]2(N)C=C1[C@@]12CNCc3cc([nH]c31)-c1cccc3ncc(nc13)NCC=CC2=O

BIRTHDAY: 2018-12-03T19:11:16.564163
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C20H27F3N6O

SMILES: C[C@H](CC(C)(C)N(C)C)Nc1c(Nc2ccccc2C(F)(F)F)ncnc1C(N)=O

BIRTHDAY: 2018-12-03T19:11:16.575806
ATC: C03B
- CARDIOVASCULAR SYSTEM
- DIURETICS
- LOW-CEILING DIURETICS, EXCL. THIAZIDES
Synthesis Plan
FORMULA:C23H27N5O

SMILES: CC(C)Nc1cnccc1C(=O)Nc1ccccc1-c1cnccc1NC(C)C

BIRTHDAY: 2018-12-03T19:11:16.618046
ATC: N01A
- NERVOUS SYSTEM
- ANESTHETICS
- ANESTHETICS, GENERAL
Synthesis Plan
FORMULA:C22H25N5O

SMILES: CNc1cc(C(=O)Nc2cccc(-c3ccc(NC(C)(C)C)nc3)c2)ccn1

BIRTHDAY: 2018-12-03T19:11:16.626853
ATC: C10A
- CARDIOVASCULAR SYSTEM
- LIPID MODIFYING AGENTS
- LIPID MODIFYING AGENTS, PLAIN
Synthesis Plan
FORMULA:C22H27N5O2

SMILES: CC(C)Nc1cnc2c(=O)n(C)cnc2c1-c1ccccc1NC(=O)C(C)(C)C

BIRTHDAY: 2018-12-01T22:30:21.400648
ATC: L01D
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- CYTOTOXIC ANTIBIOTICS AND RELATED SUBSTANCES
Synthesis Plan
FORMULA:C22H22F3N5O

SMILES: CC(C)Nc1ccc(-c2cccc(NC(=O)c3ccc(NCC(F)(F)F)nc3)c2)cn1

BIRTHDAY: 2018-12-01T22:30:21.410352
ATC: C03C
- CARDIOVASCULAR SYSTEM
- DIURETICS
- HIGH-CEILING DIURETICS
Synthesis Plan
FORMULA:C22H23F2N7O

SMILES: Cc1nc(C23CCC(Nc4cnc(F)nc4[C@H]4NC=C5C=NC=C[C@]54F)(CC2)CC3)no1

BIRTHDAY: 2018-12-01T22:30:21.442024
ATC: R03D
- RESPIRATORY SYSTEM
- DRUGS FOR OBSTRUCTIVE AIRWAY DISEASES
- OTHER SYSTEMIC DRUGS FOR OBSTRUCTIVE AIRWAY DISEASES
Synthesis Plan
FORMULA:C29H37N5O2

SMILES: CC(C)Nc1c(-c2ccccc2NC(=O)[C@@H]2CNCCCC=CCCCCO2)ncc2ncccc12

BIRTHDAY: 2018-12-01T22:30:21.462970
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C22H27F3N4O2S2

SMILES: CC(C)(C)Oc1cccc(C(=O)NC2CSCCCSC2)c1Nc1cncnc1C(F)(F)F

BIRTHDAY: 2018-12-01T22:30:21.473814
ATC: C03C
- CARDIOVASCULAR SYSTEM
- DIURETICS
- HIGH-CEILING DIURETICS
Synthesis Plan
FORMULA:C20H25N7O2

SMILES: CNCCNc1nc(-c2ccnc(N3CCOCC3)c2)cc2ncn(C)c(=O)c12

BIRTHDAY: 2018-12-01T22:30:21.483782
ATC: C08D
- CARDIOVASCULAR SYSTEM
- CALCIUM CHANNEL BLOCKERS
- SELECTIVE CALCIUM CHANNEL BLOCKERS WITH DIRECT CARDIAC EFFECTS
Synthesis Plan
FORMULA:C23H27N5O

SMILES: CC(C)Nc1cncc(-c2cccc(NC(=O)c3cccnc3NC(C)C)c2)c1

BIRTHDAY: 2018-12-01T22:30:21.502364
ATC: C10A
- CARDIOVASCULAR SYSTEM
- LIPID MODIFYING AGENTS
- LIPID MODIFYING AGENTS, PLAIN
Synthesis Plan
FORMULA:C19H26N8O2

SMILES: CC(N)(N)NC1=CC(c2ncccc2N2CCOCC2)=CN2C=NCC(=O)[C@]12N

BIRTHDAY: 2018-12-01T22:30:21.522228
ATC: N06A
- NERVOUS SYSTEM
- PSYCHOANALEPTICS
- ANTIDEPRESSANTS
Synthesis Plan
FORMULA:C22H19F3N6O2

SMILES: CC(C)(C)Oc1cccc(C(=O)Nc2ccnc(C#N)c2)c1Nc1ncncc1C(F)(F)F

BIRTHDAY: 2018-12-01T22:30:21.543628
ATC: L02B
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ENDOCRINE THERAPY
- HORMONE ANTAGONISTS AND RELATED AGENTS
Synthesis Plan
FORMULA:C31H64FeN2Si

SMILES: CN(C)CCCCCCCCCCCCCCCCCCCCCCCCC[C-]1CC[SiH2][C@@H]1[NH-].[Fe+2]

BIRTHDAY: 2018-12-01T22:30:21.575975
ATC: A05B
- ALIMENTARY TRACT AND METABOLISM
- BILE AND LIVER THERAPY
- LIVER THERAPY, LIPOTROPICS
Synthesis Plan