matter.farm

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

These compounds may interact with:

Nitric oxide synthase, inducible

Potentially involved in: carcinoma; psoriasis; vascular disease; arthritis; colitis; leishmaniasis; asthma; gastritis; cancer; diabetes mellitus; multiple sclerosis; tuberculosis; myocarditis; salmonellosis; lung disease; kidney disease; arthritis, psoriatic; asbestosis; atherosclerosis; autistic disorder

Disease data sourced from Pharos.

Agonist

FORMULA:C16H15N3O3

SMILES: C/C(N)=N/c1ccccc1C(=O)Nc1ccccc1C(=O)O

BIRTHDAY: 2018-12-01T14:10:22.984489
ATC: P03B
- ANTIPARASITIC PRODUCTS, INSECTICIDES AND REPELLENTS
- ECTOPARASITICIDES, INCL. SCABICIDES, INSECTICIDES AND REPELLENTS
- INSECTICIDES AND REPELLENTS
Synthesis Plan
FORMULA:C14H30N4O2

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

BIRTHDAY: 2018-12-01T14:10:22.991665
ATC: C02C
- CARDIOVASCULAR SYSTEM
- ANTIHYPERTENSIVES
- ANTIADRENERGIC AGENTS, PERIPHERALLY ACTING
Synthesis Plan
FORMULA:C16H15N3O3

SMILES: C/C(N)=N\c1ccccc1C(=O)Nc1ccccc1C(=O)O

BIRTHDAY: 2018-12-01T14:10:22.999992
ATC: P03B
- ANTIPARASITIC PRODUCTS, INSECTICIDES AND REPELLENTS
- ECTOPARASITICIDES, INCL. SCABICIDES, INSECTICIDES AND REPELLENTS
- INSECTICIDES AND REPELLENTS
Synthesis Plan
FORMULA:C16H19FN4

SMILES: C[C@@H](NCc1ccccc1F)c1ccccc1N=C(N)N

BIRTHDAY: 2018-12-01T14:10:23.007804
ATC: M03C
- MUSCULO-SKELETAL SYSTEM
- MUSCLE RELAXANTS
- MUSCLE RELAXANTS, DIRECTLY ACTING AGENTS
Synthesis Plan
FORMULA:C16H15N3O3

SMILES: C/C(N)=N/c1cccc(C(=O)Nc2cccc(C(=O)O)c2)c1

BIRTHDAY: 2018-12-01T14:10:23.015645
ATC: D11A
- DERMATOLOGICALS
- OTHER DERMATOLOGICAL PREPARATIONS
- OTHER DERMATOLOGICAL PREPARATIONS
Synthesis Plan
FORMULA:C16H17N5O

SMILES: C/C(N)=N/c1ccccc1C(=O)Nc1ccccc1C(=N)N

BIRTHDAY: 2018-12-01T14:10:23.024002
ATC: N01B
- NERVOUS SYSTEM
- ANESTHETICS
- ANESTHETICS, LOCAL
Synthesis Plan
FORMULA:C17H22N2O3

SMILES: Cc1o[nH]c(=O)c1C1CCN(CCc2ccc(O)cc2)CC1

BIRTHDAY: 2018-12-01T14:10:23.031459
ATC: D01A
- DERMATOLOGICALS
- ANTIFUNGALS FOR DERMATOLOGICAL USE
- ANTIFUNGALS FOR TOPICAL USE
Synthesis Plan
FORMULA:C16H17N5O

SMILES: C/C(N)=N\c1ccc(C(=O)Nc2cccc(C(=N)N)c2)cc1

BIRTHDAY: 2018-12-01T14:10:23.039297
ATC: A10B
- ALIMENTARY TRACT AND METABOLISM
- DRUGS USED IN DIABETES
- BLOOD GLUCOSE LOWERING DRUGS, EXCL. INSULINS
Synthesis Plan
FORMULA:C29H27N5O3S

SMILES: C/C(N)=N\c1ccc(C(=O)Nc2nc3cc(n2)-c2cccc(c2)OCCCCOc2cccc(c2)S3)cc1

BIRTHDAY: 2018-12-01T14:10:23.050777
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:C20H22FN3O

SMILES: C[C@@]1(c2ccncc2)CC2(NC(=O)c3ccccc3F)CCN1CC2

BIRTHDAY: 2018-12-01T14:10:23.059053
ATC: P03A
- ANTIPARASITIC PRODUCTS, INSECTICIDES AND REPELLENTS
- ECTOPARASITICIDES, INCL. SCABICIDES, INSECTICIDES AND REPELLENTS
- ECTOPARASITICIDES, INCL. SCABICIDES
Synthesis Plan
FORMULA:C24H29FN4O2

SMILES: O=C(NCCCCN1CCC2(CC1)C(=O)NCN2c1ccccc1)c1ccc(F)cc1

BIRTHDAY: 2018-12-01T14:10:23.068321
ATC: N05A
- NERVOUS SYSTEM
- PSYCHOLEPTICS
- ANTIPSYCHOTICS
Synthesis Plan
FORMULA:C23H23FN4O3

SMILES: O=C(Nc1cc(C2CCN(Cc3ccc4c(c3)OCO4)CC2)[nH]n1)c1ccc(F)cc1

BIRTHDAY: 2018-12-01T14:10:23.078183
ATC: N04B
- NERVOUS SYSTEM
- ANTI-PARKINSON DRUGS
- DOPAMINERGIC AGENTS
Synthesis Plan
FORMULA:C18H27N5O5

SMILES: N=C(N)NCCCC[C@@H](NC(=O)[C@@H](Cc1ccccc1)NCC(=O)O)C(=O)O

BIRTHDAY: 2018-12-01T14:10:23.087812
ATC: H05B
- SYSTEMIC HORMONAL PREPARATIONS, EXCL. SEX HORMONES AND INSULINS
- CALCIUM HOMEOSTASIS
- ANTI-PARATHYROID AGENTS
Synthesis Plan
FORMULA:C13H23N3O7

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

BIRTHDAY: 2018-12-01T14:10:23.113524
ATC: V08D
- VARIOUS
- CONTRAST MEDIA
- ULTRASOUND CONTRAST MEDIA
Synthesis Plan
FORMULA:C4H8S5

SMILES: CC1(C)CSSSSS1

BIRTHDAY: 2018-12-01T14:10:23.119520
ATC: J01C
- ANTIINFECTIVES FOR SYSTEMIC USE
- ANTIBACTERIALS FOR SYSTEMIC USE
- BETA-LACTAM ANTIBACTERIALS, PENICILLINS
Synthesis Plan
FORMULA:C5H10N2

SMILES: N[C@H]1CCCC=N1

BIRTHDAY: 2018-12-25T02:02:25.381081
ATC: J05A
- ANTIINFECTIVES FOR SYSTEMIC USE
- ANTIVIRALS FOR SYSTEMIC USE
- DIRECT ACTING ANTIVIRALS
Synthesis Plan
FORMULA:C16H15N3O3

SMILES: C/C(N)=N\c1cccc(C(=O)Nc2cccc(C(=O)O)c2)c1

BIRTHDAY: 2018-12-25T02:02:25.394001
ATC: D11A
- DERMATOLOGICALS
- OTHER DERMATOLOGICAL PREPARATIONS
- OTHER DERMATOLOGICAL PREPARATIONS
Synthesis Plan
FORMULA:C15H15FN4O

SMILES: NC(N)=Nc1ccccc1CNC(=O)c1cccc(F)c1

BIRTHDAY: 2018-12-25T02:02:25.401902
ATC: N04B
- NERVOUS SYSTEM
- ANTI-PARKINSON DRUGS
- DOPAMINERGIC AGENTS
Synthesis Plan
FORMULA:C23H23F2N3O

SMILES: CC(C)(CN(Cc1ccccc1F)c1ccncc1)NC(=O)c1cccc(F)c1

BIRTHDAY: 2018-12-25T02:02:25.411131
ATC: A10B
- ALIMENTARY TRACT AND METABOLISM
- DRUGS USED IN DIABETES
- BLOOD GLUCOSE LOWERING DRUGS, EXCL. INSULINS
Synthesis Plan
FORMULA:C9H9F3N2S

SMILES: CS/C(N)=N/c1ccccc1C(F)(F)F

BIRTHDAY: 2018-12-25T02:02:25.418377
ATC: R02A
- RESPIRATORY SYSTEM
- THROAT PREPARATIONS
- THROAT PREPARATIONS
Synthesis Plan
FORMULA:C16H15F3N4O

SMILES: NC(N)=Nc1ccccc1CNC(=O)c1cccc(C(F)(F)F)c1

BIRTHDAY: 2018-12-25T02:02:25.427130
ATC: C02C
- CARDIOVASCULAR SYSTEM
- ANTIHYPERTENSIVES
- ANTIADRENERGIC AGENTS, PERIPHERALLY ACTING
Synthesis Plan
FORMULA:C23H22FN5O3S

SMILES: O=C1CN[C@H](NC(=O)c2ccccc2F)OCCNCc2cccc(c2)-c2cc(ncn2)S1

BIRTHDAY: 2018-12-25T02:02:25.438129
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C18H15ClN4O2

SMILES: N/C(=N\c1ccccc1C(=O)N[C@@H]1C=NC=CO1)c1cccc(Cl)c1

BIRTHDAY: 2018-12-25T02:02:25.454970
ATC: N02B
- NERVOUS SYSTEM
- ANALGESICS
- OTHER ANALGESICS AND ANTIPYRETICS
Synthesis Plan
FORMULA:C25H30FN3O

SMILES: C[C@@H](N[C@@]12C=CC=C[C@@H]1N=C1CCCCC1=C2)C(C)(C)NC(=O)c1ccccc1F

BIRTHDAY: 2018-12-25T02:02:25.472296
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:C27H38N4O2

SMILES: C/C(N)=N/c1ccc(C(=O)Nc2cccc([C@]3(N)CCCCCCCCCOCC3)c2)cc1

BIRTHDAY: 2018-12-25T02:02:25.490695
ATC: N03A
- NERVOUS SYSTEM
- ANTIEPILEPTICS
- ANTIEPILEPTICS
Synthesis Plan
FORMULA:C29H28N6O2

SMILES: C/C(N)=N\c1ccccc1[C@H]1C=CCOCc2cccc(c2)Nc2nccc(n2)-c2ccnc(c2)OC1

BIRTHDAY: 2018-12-25T02:02:25.510670
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C21H22N6O3

SMILES: C/C(N)=N/c1cccc2c1[C@@H]1NC=C(C(N)=O)N[C@]2(C(=O)NCc2ccccc2)O1

BIRTHDAY: 2018-12-25T02:02:25.521100
ATC: A07X
- ALIMENTARY TRACT AND METABOLISM
- ANTIDIARRHEALS, INTESTINAL ANTIINFLAMMATORY/ANTIINFECTIVE AGENTS
- OTHER ANTIDIARRHEALS
Synthesis Plan
FORMULA:C26H28F2N4O

SMILES: O=C(CN(Cc1ccccc1F)[C@@H]1CCCCN1)N(Cc1cccc(F)c1)c1ccncc1

BIRTHDAY: 2018-12-03T02:38:29.519931
ATC: C09X
- CARDIOVASCULAR SYSTEM
- AGENTS ACTING ON THE RENIN-ANGIOTENSIN SYSTEM
- OTHER AGENTS ACTING ON THE RENIN-ANGIOTENSIN SYSTEM
Synthesis Plan
FORMULA:C16H17N5O

SMILES: C/C(N)=N/c1ccc(C(=O)Nc2ccc(C(=N)N)cc2)cc1

BIRTHDAY: 2018-12-03T02:38:29.535647
ATC: A07A
- ALIMENTARY TRACT AND METABOLISM
- ANTIDIARRHEALS, INTESTINAL ANTIINFLAMMATORY/ANTIINFECTIVE AGENTS
- INTESTINAL ANTIINFECTIVES
Synthesis Plan
FORMULA:C16H17N5O

SMILES: C/C(N)=N/c1ccc(C(=O)Nc2cccc(C(=N)N)c2)cc1

BIRTHDAY: 2018-12-03T02:38:29.543484
ATC: A10B
- ALIMENTARY TRACT AND METABOLISM
- DRUGS USED IN DIABETES
- BLOOD GLUCOSE LOWERING DRUGS, EXCL. INSULINS
Synthesis Plan
FORMULA:C22H27ClFN3O

SMILES: O=C(NCCCCCN1CCN(c2cccc(Cl)c2)CC1)c1ccc(F)cc1

BIRTHDAY: 2018-12-03T02:38:29.551920
ATC: N06A
- NERVOUS SYSTEM
- PSYCHOANALEPTICS
- ANTIDEPRESSANTS
Synthesis Plan
FORMULA:C16H15N3O3

SMILES: C/C(N)=N/c1ccc(C(=O)Nc2ccc(C(=O)O)cc2)cc1

BIRTHDAY: 2018-12-03T02:38:29.559582
ATC: D11A
- DERMATOLOGICALS
- OTHER DERMATOLOGICAL PREPARATIONS
- OTHER DERMATOLOGICAL PREPARATIONS
Synthesis Plan
FORMULA:C29H21FN8OS

SMILES: O=C(Nc1cc(C2=NN3C4=NC(=C[C@@H]3S2)Nc2cccc(c2)C=Cc2cccc(c2)N4)n[nH]1)c1ccc(F)cc1

BIRTHDAY: 2018-12-03T02:38:29.600686
ATC: J01X
- ANTIINFECTIVES FOR SYSTEMIC USE
- ANTIBACTERIALS FOR SYSTEMIC USE
- OTHER ANTIBACTERIALS
Synthesis Plan
FORMULA:C23H24FN5O

SMILES: C/C(N)=N\c1cccc(C(=O)Nc2ccccc2C(N)(N)Cc2cccc(F)c2)c1

BIRTHDAY: 2018-12-03T02:38:29.610367
ATC: R03D
- RESPIRATORY SYSTEM
- DRUGS FOR OBSTRUCTIVE AIRWAY DISEASES
- OTHER SYSTEMIC DRUGS FOR OBSTRUCTIVE AIRWAY DISEASES
Synthesis Plan
FORMULA:C15H15FN4O

SMILES: NC(N)=Nc1ccc(CNC(=O)c2ccc(F)cc2)cc1

BIRTHDAY: 2018-12-03T02:38:29.617847
ATC: B02A
- BLOOD AND BLOOD FORMING ORGANS
- ANTIHEMORRHAGICS
- ANTIFIBRINOLYTICS
Synthesis Plan
FORMULA:C18H21F2N5O2

SMILES: Nc1ncc(-c2ccc(F)cc2F)nc1C(=O)NCCCN1CCOCC1

BIRTHDAY: 2018-12-03T02:38:29.627254
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C20H22FN3O

SMILES: O=C(N[C@H]1C2CCN(CC2)[C@H]1Cc1cccnc1)c1ccc(F)cc1

BIRTHDAY: 2018-12-03T02:38:29.659119
ATC: D05B
- DERMATOLOGICALS
- ANTIPSORIATICS
- ANTIPSORIATICS FOR SYSTEMIC USE
Synthesis Plan
FORMULA:C16H17N5O

SMILES: C/C(N)=N\c1ccccc1C(=O)Nc1ccccc1C(=N)N

BIRTHDAY: 2018-11-30T03:40:25.773615
ATC: N01B
- NERVOUS SYSTEM
- ANESTHETICS
- ANESTHETICS, LOCAL
Synthesis Plan
FORMULA:C16H15F3N4O

SMILES: NC(N)=Nc1cccc(CNC(=O)c2ccc(C(F)(F)F)cc2)c1

BIRTHDAY: 2018-11-30T03:40:25.782339
ATC: B02A
- BLOOD AND BLOOD FORMING ORGANS
- ANTIHEMORRHAGICS
- ANTIFIBRINOLYTICS
Synthesis Plan
FORMULA:C16H15N3O3

SMILES: C/C(N)=N/c1ccccc1C(=O)Nc1cccc(C(=O)O)c1

BIRTHDAY: 2018-11-30T03:40:25.790398
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C22H22FN5O3

SMILES: N[C@@]1(c2cccc3c2OCO3)CCCN[C@@H]1c1[nH]ncc1NC(=O)c1cccc(F)c1

BIRTHDAY: 2018-11-30T03:40:25.801143
ATC: C10A
- CARDIOVASCULAR SYSTEM
- LIPID MODIFYING AGENTS
- LIPID MODIFYING AGENTS, PLAIN
Synthesis Plan
FORMULA:C25H30FN3O

SMILES: C[C@@H](C[C@H](C)N[C@]12CCCC[C@@H]1C=c1ccccc1=N2)NC(=O)c1ccc(F)cc1

BIRTHDAY: 2018-11-30T03:40:25.810235
ATC: C09C
- CARDIOVASCULAR SYSTEM
- AGENTS ACTING ON THE RENIN-ANGIOTENSIN SYSTEM
- ANGIOTENSIN II ANTAGONISTS, PLAIN
Synthesis Plan
FORMULA:C17H22N2O3

SMILES: Cc1o[nH]c(=O)c1C1CCN(CCc2cccc(O)c2)CC1

BIRTHDAY: 2018-11-30T03:40:25.841785
ATC: C01C
- CARDIOVASCULAR SYSTEM
- CARDIAC THERAPY
- CARDIAC STIMULANTS EXCL. CARDIAC GLYCOSIDES
Synthesis Plan
FORMULA:C22H24FN3O2

SMILES: N[C@@]1(Cc2ccccc2F)CCCN[C@H]1c1c(Cc2ccccc2)o[nH]c1=O

BIRTHDAY: 2018-11-30T03:40:25.858623
ATC: A10B
- ALIMENTARY TRACT AND METABOLISM
- DRUGS USED IN DIABETES
- BLOOD GLUCOSE LOWERING DRUGS, EXCL. INSULINS
Synthesis Plan
FORMULA:C17H18N4O3

SMILES: COc1ccc(C(=O)NCC(=O)Nc2ccc(C(=N)N)cc2)cc1

BIRTHDAY: 2018-11-30T03:40:25.882469
ATC: V04C
- VARIOUS
- DIAGNOSTIC AGENTS
- OTHER DIAGNOSTIC AGENTS
Synthesis Plan
FORMULA:C20H22FN3O

SMILES: C[C@@]1(c2ccccn2)CC2(NC(=O)c3ccccc3F)CCN1CC2

BIRTHDAY: 2018-11-30T03:40:25.890691
ATC: J05A
- ANTIINFECTIVES FOR SYSTEMIC USE
- ANTIVIRALS FOR SYSTEMIC USE
- DIRECT ACTING ANTIVIRALS
Synthesis Plan
FORMULA:C16H14F3N3O

SMILES: C/C(N)=N\c1ccccc1C(=O)Nc1cccc(C(F)(F)F)c1

BIRTHDAY: 2018-11-30T03:40:25.916836
ATC: P03B
- ANTIPARASITIC PRODUCTS, INSECTICIDES AND REPELLENTS
- ECTOPARASITICIDES, INCL. SCABICIDES, INSECTICIDES AND REPELLENTS
- INSECTICIDES AND REPELLENTS
Synthesis Plan
FORMULA:C14H15ClN4

SMILES: NC(N)=Nc1ccc(CNc2ccc(Cl)cc2)cc1

BIRTHDAY: 2018-11-30T03:40:25.923851
ATC: B02A
- BLOOD AND BLOOD FORMING ORGANS
- ANTIHEMORRHAGICS
- ANTIFIBRINOLYTICS
Synthesis Plan
FORMULA:C21H24N4O3

SMILES: C/C(N)=N/c1ccc(C(=O)Nc2ccc([C@@]3(N)C[C@H]4CO[C@@H](C4)O3)cc2)cc1

BIRTHDAY: 2018-11-19T08:16:27.338688
ATC: A16A
- ALIMENTARY TRACT AND METABOLISM
- OTHER ALIMENTARY TRACT AND METABOLISM PRODUCTS
- OTHER ALIMENTARY TRACT AND METABOLISM PRODUCTS
Synthesis Plan
FORMULA:C16H15N3O3

SMILES: C/C(N)=N/c1ccc(C(=O)Nc2cccc(C(=O)O)c2)cc1

BIRTHDAY: 2018-11-19T08:16:27.346706
ATC: D11A
- DERMATOLOGICALS
- OTHER DERMATOLOGICAL PREPARATIONS
- OTHER DERMATOLOGICAL PREPARATIONS
Synthesis Plan
FORMULA:C6H10S2

SMILES: C[C@H]1CCSC=CS1

BIRTHDAY: 2018-11-19T08:16:27.351926
ATC: J01A
- ANTIINFECTIVES FOR SYSTEMIC USE
- ANTIBACTERIALS FOR SYSTEMIC USE
- TETRACYCLINES
Synthesis Plan
FORMULA:C5H10N2

SMILES: N[C@@H]1CCCC=N1

BIRTHDAY: 2018-11-19T08:16:27.356894
ATC: J05A
- ANTIINFECTIVES FOR SYSTEMIC USE
- ANTIVIRALS FOR SYSTEMIC USE
- DIRECT ACTING ANTIVIRALS
Synthesis Plan
FORMULA:C16H15N3O3

SMILES: C/C(N)=N\c1ccc(C(=O)Nc2cccc(C(=O)O)c2)cc1

BIRTHDAY: 2018-11-19T08:16:27.364846
ATC: D11A
- DERMATOLOGICALS
- OTHER DERMATOLOGICAL PREPARATIONS
- OTHER DERMATOLOGICAL PREPARATIONS
Synthesis Plan
FORMULA:C16H16HgN3O

SMILES: C/C(N)=N/c1ccccc1C(=O)Nc1ccccc1C[Hg]

BIRTHDAY: 2018-11-19T08:16:27.372715
ATC: P03B
- ANTIPARASITIC PRODUCTS, INSECTICIDES AND REPELLENTS
- ECTOPARASITICIDES, INCL. SCABICIDES, INSECTICIDES AND REPELLENTS
- INSECTICIDES AND REPELLENTS
Synthesis Plan
FORMULA:C18H27N5O5

SMILES: N=C(N)NCCCC[C@H](NC(=O)[C@@H](Cc1ccccc1)NCC(=O)O)C(=O)O

BIRTHDAY: 2018-11-19T08:16:27.382473
ATC: H05B
- SYSTEMIC HORMONAL PREPARATIONS, EXCL. SEX HORMONES AND INSULINS
- CALCIUM HOMEOSTASIS
- ANTI-PARATHYROID AGENTS
Synthesis Plan
FORMULA:C23H27F2N3O2

SMILES: CC(C)(CN(Cc1cccc(F)c1)[C@H]1NCCCC1=O)NC(=O)c1cccc(F)c1

BIRTHDAY: 2018-11-19T08:16:27.392103
ATC: A10B
- ALIMENTARY TRACT AND METABOLISM
- DRUGS USED IN DIABETES
- BLOOD GLUCOSE LOWERING DRUGS, EXCL. INSULINS
Synthesis Plan
FORMULA:C37H34N6O3

SMILES: C/C(N)=N\c1ccccc1C(=O)Nc1ccccc1-c1c2cccc1Nc1nccc(n1)-c1cccc(c1)COCC=CCOC2

BIRTHDAY: 2018-11-19T08:16:27.405522
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C13H14FN

SMILES: Fc1ccc(C2=CN3CCC2CC3)cc1

BIRTHDAY: 2018-11-19T08:16:27.416517
ATC: H03B
- SYSTEMIC HORMONAL PREPARATIONS, EXCL. SEX HORMONES AND INSULINS
- THYROID THERAPY
- ANTITHYROID PREPARATIONS
Synthesis Plan
FORMULA:C21H27N5O2

SMILES: CC(C)(NC(=N)N)C(=O)N(CC(=O)NCc1ccccc1)Cc1ccccc1

BIRTHDAY: 2018-11-19T08:16:27.425444
ATC: N03A
- NERVOUS SYSTEM
- ANTIEPILEPTICS
- ANTIEPILEPTICS
Synthesis Plan
FORMULA:C23H23F2N3O

SMILES: O=C(NCCCCN(Cc1ccc(F)cc1)c1ccccn1)c1ccc(F)cc1

BIRTHDAY: 2018-11-19T08:16:27.434186
ATC: N05A
- NERVOUS SYSTEM
- PSYCHOLEPTICS
- ANTIPSYCHOTICS
Synthesis Plan
FORMULA:C22H36N4O4

SMILES: N=C(N)NCCCCCCCCCCC[C@H](NC(=O)OCc1ccccc1)C(=O)O

BIRTHDAY: 2018-11-19T08:16:27.443301
ATC: M01A
- MUSCULO-SKELETAL SYSTEM
- ANTIINFLAMMATORY AND ANTIRHEUMATIC PRODUCTS
- ANTIINFLAMMATORY AND ANTIRHEUMATIC PRODUCTS, NON-STEROIDS
Synthesis Plan
FORMULA:C20H21N5O2S

SMILES: C/C(N)=N\c1ccccc1CNc1cccc2c1[C@]1(C(=O)O)C=CNN1SC2

BIRTHDAY: 2018-11-19T08:16:27.470212
ATC: P01A
- ANTIPARASITIC PRODUCTS, INSECTICIDES AND REPELLENTS
- ANTIPROTOZOALS
- AGENTS AGAINST AMOEBIASIS AND OTHER PROTOZOAL DISEASES
Synthesis Plan
FORMULA:C23H33FN6

SMILES: CC(C)(NC(=N)N)[C@@]1(C)C=c2[nH]c3cccc(F)c3c2=CN[C@@]1(N)C1CCCCC1

BIRTHDAY: 2018-11-19T08:16:27.480753
ATC: G03D
- GENITO URINARY SYSTEM AND SEX HORMONES
- SEX HORMONES AND MODULATORS OF THE GENITAL SYSTEM
- PROGESTOGENS
Synthesis Plan
FORMULA:C5H10N2

SMILES: N[C@@H]1C=NCCC1

BIRTHDAY: 2018-11-19T08:16:27.494145
ATC: B01A
- BLOOD AND BLOOD FORMING ORGANS
- ANTITHROMBOTIC AGENTS
- ANTITHROMBOTIC AGENTS
Synthesis Plan
FORMULA:C16H14F3N3O

SMILES: C/C(N)=N/c1ccccc1C(=O)Nc1ccccc1C(F)(F)F

BIRTHDAY: 2018-11-19T08:16:27.511017
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C21H27FN8O4

SMILES: NC(=O)c1nc(/N=C(/N)C(=O)Nc2ccccc2F)c2nc1NCNCCOCCCCCO2

BIRTHDAY: 2018-11-19T08:16:27.522782
ATC: C08D
- CARDIOVASCULAR SYSTEM
- CALCIUM CHANNEL BLOCKERS
- SELECTIVE CALCIUM CHANNEL BLOCKERS WITH DIRECT CARDIAC EFFECTS
Synthesis Plan
FORMULA:C23H20ClN3O2

SMILES: C/C(N)=N\c1ccccc1C(=O)Nc1cccc2c1COC=C1C=CC=C[C@]12Cl

BIRTHDAY: 2018-11-19T08:16:27.539721
ATC: A10X
- ALIMENTARY TRACT AND METABOLISM
- DRUGS USED IN DIABETES
- OTHER DRUGS USED IN DIABETES
Synthesis Plan
FORMULA:C33H33N3O2

SMILES: C/C(N)=N/c1ccc(C(=O)N[C@H]2CCc3ccc(cc3)Oc3cccc(c3)CCc3ccc(cc3)C2)cc1

BIRTHDAY: 2018-11-19T08:16:27.550353
ATC: N01A
- NERVOUS SYSTEM
- ANESTHETICS
- ANESTHETICS, GENERAL
Synthesis Plan
FORMULA:C16H19FN4

SMILES: C[C@H](NCc1ccccc1F)c1ccccc1N=C(N)N

BIRTHDAY: 2018-11-19T08:16:27.558377
ATC: M03C
- MUSCULO-SKELETAL SYSTEM
- MUSCLE RELAXANTS
- MUSCLE RELAXANTS, DIRECTLY ACTING AGENTS
Synthesis Plan
FORMULA:C21H21N5O3

SMILES: C/C(N)=N\c1ccccc1C(=O)Nc1ccccc1-c1cn[nH]c1[C@@H](C)C(=O)O

BIRTHDAY: 2018-11-19T08:16:27.568732
ATC: J01F
- ANTIINFECTIVES FOR SYSTEMIC USE
- ANTIBACTERIALS FOR SYSTEMIC USE
- MACROLIDES, LINCOSAMIDES AND STREPTOGRAMINS
Synthesis Plan
FORMULA:C22H16INO3

SMILES: O=C(Nc1ccccc1[C@H]1O[C@H]2C=CC=CC2=CC1=O)c1ccccc1I

BIRTHDAY: 2018-11-19T08:16:27.578021
ATC: P03B
- ANTIPARASITIC PRODUCTS, INSECTICIDES AND REPELLENTS
- ECTOPARASITICIDES, INCL. SCABICIDES, INSECTICIDES AND REPELLENTS
- INSECTICIDES AND REPELLENTS
Synthesis Plan
FORMULA:C16H15N3O3

SMILES: C/C(N)=N/c1cccc(C(=O)Nc2ccccc2C(=O)O)c1

BIRTHDAY: 2018-11-19T08:16:27.594165
ATC: D07A
- DERMATOLOGICALS
- CORTICOSTEROIDS, DERMATOLOGICAL PREPARATIONS
- CORTICOSTEROIDS, PLAIN
Synthesis Plan
FORMULA:C20H33N7O4

SMILES: CC(C)C[C@@H](N)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@H](CCc1ccc(N)nc1)C(N)=O

BIRTHDAY: 2018-11-19T08:16:27.613346
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C25H23FN6O

SMILES: N#CC(C#N)CN1CCC(c2cc(NC(=O)c3ccc(F)cc3)n(-c3ccccc3)n2)CC1

BIRTHDAY: 2018-11-19T08:16:27.623863
ATC: M01A
- MUSCULO-SKELETAL SYSTEM
- ANTIINFLAMMATORY AND ANTIRHEUMATIC PRODUCTS
- ANTIINFLAMMATORY AND ANTIRHEUMATIC PRODUCTS, NON-STEROIDS
Synthesis Plan
FORMULA:C16H15N3O3

SMILES: C/C(N)=N/c1ccccc1C(=O)Nc1ccc(C(=O)O)cc1

BIRTHDAY: 2018-11-19T08:16:27.631974
ATC: P03B
- ANTIPARASITIC PRODUCTS, INSECTICIDES AND REPELLENTS
- ECTOPARASITICIDES, INCL. SCABICIDES, INSECTICIDES AND REPELLENTS
- INSECTICIDES AND REPELLENTS
Synthesis Plan
FORMULA:C20H29FN4O6

SMILES: CC(C)[C@H](N)C(=O)N[C@H](C(=O)N[C@@H](CO)C(=O)NCc1cccc(F)c1)[C@@H](C)C(=O)O

BIRTHDAY: 2018-11-19T08:16:27.642716
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:C22H25N3O3

SMILES: COc1cccc(C(=O)NC(C)(C)C(C)(C)NC(=O)c2ccccc2C#N)c1

BIRTHDAY: 2018-11-19T08:16:27.651232
ATC: A02B
- ALIMENTARY TRACT AND METABOLISM
- DRUGS FOR ACID RELATED DISORDERS
- DRUGS FOR PEPTIC ULCER AND GASTRO-OESOPHAGEAL REFLUX DISEASE (GORD)
Synthesis Plan
FORMULA:C18H33N3

SMILES: CC(C)(NC(=N)N)C(C)(C)C1(C)C2CC3CC(C2)CC1C3

BIRTHDAY: 2018-11-19T08:16:27.658180
ATC: A16A
- ALIMENTARY TRACT AND METABOLISM
- OTHER ALIMENTARY TRACT AND METABOLISM PRODUCTS
- OTHER ALIMENTARY TRACT AND METABOLISM PRODUCTS
Synthesis Plan
FORMULA:C23H22N4O3

SMILES: C/C(N)=N/c1ccccc1C(=O)Nc1ccccc1CNc1ccccc1C(=O)O

BIRTHDAY: 2018-11-19T08:16:27.668000
ATC: P03B
- ANTIPARASITIC PRODUCTS, INSECTICIDES AND REPELLENTS
- ECTOPARASITICIDES, INCL. SCABICIDES, INSECTICIDES AND REPELLENTS
- INSECTICIDES AND REPELLENTS
Synthesis Plan
FORMULA:C16H14F3N3O

SMILES: C/C(N)=N\c1ccc(C(=O)Nc2cccc(C(F)(F)F)c2)cc1

BIRTHDAY: 2018-11-19T08:16:27.676383
ATC: D11A
- DERMATOLOGICALS
- OTHER DERMATOLOGICAL PREPARATIONS
- OTHER DERMATOLOGICAL PREPARATIONS
Synthesis Plan
FORMULA:C12H16N2

SMILES: NC1=N[C@@H](Cc2ccccc2)CCC1

BIRTHDAY: 2018-11-19T08:16:27.682256
ATC: J01E
- ANTIINFECTIVES FOR SYSTEMIC USE
- ANTIBACTERIALS FOR SYSTEMIC USE
- SULFONAMIDES AND TRIMETHOPRIM
Synthesis Plan
FORMULA:C23H27F2N3O2

SMILES: CC(C)(CN(Cc1ccccc1F)[C@H]1NCCCC1=O)NC(=O)c1cccc(F)c1

BIRTHDAY: 2018-11-19T08:16:27.692055
ATC: A10B
- ALIMENTARY TRACT AND METABOLISM
- DRUGS USED IN DIABETES
- BLOOD GLUCOSE LOWERING DRUGS, EXCL. INSULINS
Synthesis Plan
FORMULA:C16H15N3O3

SMILES: C/C(N)=N/c1ccc(C(=O)Nc2ccccc2C(=O)O)cc1

BIRTHDAY: 2018-11-19T08:16:27.716518
ATC: D11A
- DERMATOLOGICALS
- OTHER DERMATOLOGICAL PREPARATIONS
- OTHER DERMATOLOGICAL PREPARATIONS
Synthesis Plan
FORMULA:C24H21F2N7O

SMILES: N#CC(C#N)[C@]1(N)CCCN[C@@H]1c1c(NC(=O)c2ccccc2F)cnn1-c1cccc(F)c1

BIRTHDAY: 2018-11-19T08:16:27.728513
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C23H23F2N3O

SMILES: CC(C)(CN(Cc1cccc(F)c1)c1ccncc1)NC(=O)c1cccc(F)c1

BIRTHDAY: 2018-11-19T08:16:27.737428
ATC: A02B
- ALIMENTARY TRACT AND METABOLISM
- DRUGS FOR ACID RELATED DISORDERS
- DRUGS FOR PEPTIC ULCER AND GASTRO-OESOPHAGEAL REFLUX DISEASE (GORD)
Synthesis Plan
FORMULA:C18H17N3O3

SMILES: C/C(N)=N\c1cccc(C(=O)Nc2cccc(/C=C/C(=O)O)c2)c1

BIRTHDAY: 2018-11-30T17:22:47.435659
ATC: D11A
- DERMATOLOGICALS
- OTHER DERMATOLOGICAL PREPARATIONS
- OTHER DERMATOLOGICAL PREPARATIONS
Synthesis Plan
FORMULA:C26H28F2N4O

SMILES: O=C(CN(Cc1ccc(F)cc1)C1CCNCC1)N(Cc1ccc(F)cc1)c1ccccn1

BIRTHDAY: 2018-11-30T17:22:47.445263
ATC: G04B
- GENITO URINARY SYSTEM AND SEX HORMONES
- UROLOGICALS
- UROLOGICALS
Synthesis Plan
FORMULA:C26H32FeN2O5

SMILES: COc1ccccc1[CH-]NC(=O)C(=O)N(CCCCCCC(C)C(=O)[O-])Cc1ccccc1.[Fe+2]

BIRTHDAY: 2018-11-30T17:22:47.463356
ATC: B03A
- BLOOD AND BLOOD FORMING ORGANS
- ANTIANEMIC PREPARATIONS
- IRON PREPARATIONS
Synthesis Plan
FORMULA:C16H16N4O2

SMILES: C/C(N)=N\c1ccccc1C(=O)Nc1ccc(C(N)=O)cc1

BIRTHDAY: 2018-11-30T17:22:47.496009
ATC: N02B
- NERVOUS SYSTEM
- ANALGESICS
- OTHER ANALGESICS AND ANTIPYRETICS
Synthesis Plan
FORMULA:C16H14F3N3O

SMILES: C/C(N)=N\c1cccc(C(=O)Nc2cccc(C(F)(F)F)c2)c1

BIRTHDAY: 2018-11-30T17:22:47.504239
ATC: A09A
- ALIMENTARY TRACT AND METABOLISM
- DIGESTIVES, INCL. ENZYMES
- DIGESTIVES, INCL. ENZYMES
Synthesis Plan
FORMULA:C24H35N5

SMILES: CN1CCCCc2c(cccc2CNCCc2ccc(N=C(N)N)cc2)CCC1

BIRTHDAY: 2018-11-30T17:22:47.512480
ATC: H05B
- SYSTEMIC HORMONAL PREPARATIONS, EXCL. SEX HORMONES AND INSULINS
- CALCIUM HOMEOSTASIS
- ANTI-PARATHYROID AGENTS
Synthesis Plan
FORMULA:C16H21F2N3O

SMILES: NC1=N[C@@H](CCCCC(=O)Nc2c(F)cccc2F)CCC1

BIRTHDAY: 2018-11-30T17:22:47.527936
ATC: N05C
- NERVOUS SYSTEM
- PSYCHOLEPTICS
- HYPNOTICS AND SEDATIVES
Synthesis Plan
FORMULA:C23H27F2N3O2

SMILES: O=C1C[C@H](N(CCCCNC(=O)c2ccc(F)cc2)Cc2ccc(F)cc2)CCN1

BIRTHDAY: 2018-12-02T16:05:55.991231
ATC: G03A
- GENITO URINARY SYSTEM AND SEX HORMONES
- SEX HORMONES AND MODULATORS OF THE GENITAL SYSTEM
- HORMONAL CONTRACEPTIVES FOR SYSTEMIC USE
Synthesis Plan
FORMULA:C19H19F3N2O2

SMILES: C[C@@H](NC(=O)c1cccc(F)c1F)C(C)(C)NC(=O)c1cccc(F)c1

BIRTHDAY: 2018-12-02T16:05:55.999957
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C23H22F2N4O

SMILES: O=C(Nc1cc([C@H]2CC[C@@H]3CN3C2)nn1Cc1ccc(F)cc1)c1ccc(F)cc1

BIRTHDAY: 2018-12-02T16:05:56.009833
ATC: D01A
- DERMATOLOGICALS
- ANTIFUNGALS FOR DERMATOLOGICAL USE
- ANTIFUNGALS FOR TOPICAL USE
Synthesis Plan
FORMULA:C20H18ClN3O

SMILES: C/C(N)=N/c1ccc(C(=O)N2C=CCC(c3ccc(Cl)cc3)=C2)cc1

BIRTHDAY: 2018-12-02T16:05:56.017881
ATC: N06A
- NERVOUS SYSTEM
- PSYCHOANALEPTICS
- ANTIDEPRESSANTS
Synthesis Plan
FORMULA:C28H29FN4O2

SMILES: C/C(N)=N\c1ccc(C(=O)Nc2ccc([C@]3(c4ccccc4F)C[C@@H]4CN(CCO4)C3)cc2)cc1

BIRTHDAY: 2018-12-02T16:05:56.036627
ATC: L02B
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ENDOCRINE THERAPY
- HORMONE ANTAGONISTS AND RELATED AGENTS
Synthesis Plan
FORMULA:C23H23FN4O3

SMILES: O=C(Nc1cn[nH]c1[C@@H]1CCCCN1Cc1cccc2c1OCO2)c1cccc(F)c1

BIRTHDAY: 2018-12-02T16:05:56.079787
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C20H23FN2O

SMILES: O=C(c1ccc(F)cc1)N1CCC2(CC1)C[C@H]1[C@@H]3C=C[C@H](C3)CN12

BIRTHDAY: 2018-12-02T16:05:56.087789
ATC: C08C
- CARDIOVASCULAR SYSTEM
- CALCIUM CHANNEL BLOCKERS
- SELECTIVE CALCIUM CHANNEL BLOCKERS WITH MAINLY VASCULAR EFFECTS
Synthesis Plan
FORMULA:C17H18N4O3

SMILES: COc1cccc(C(=O)NCC(=O)Nc2ccccc2C(=N)N)c1

BIRTHDAY: 2018-12-03T10:42:17.592455
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:C14H32N4

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

BIRTHDAY: 2018-12-03T10:42:17.631014
ATC: N05A
- NERVOUS SYSTEM
- PSYCHOLEPTICS
- ANTIPSYCHOTICS
Synthesis Plan
FORMULA:C23H23FN4O3

SMILES: O=C(Nc1cn[nH]c1[C@H]1CCCCN1Cc1cccc2c1OCO2)c1cccc(F)c1

BIRTHDAY: 2018-12-03T10:42:17.670819
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C16H14F3N3O

SMILES: C/C(N)=N\c1cccc(C(=O)Nc2ccc(C(F)(F)F)cc2)c1

BIRTHDAY: 2018-12-03T10:42:17.679013
ATC: C03D
- CARDIOVASCULAR SYSTEM
- DIURETICS
- POTASSIUM-SPARING AGENTS
Synthesis Plan
FORMULA:C14H30N4O2

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

BIRTHDAY: 2018-12-03T10:42:17.694405
ATC: N05C
- NERVOUS SYSTEM
- PSYCHOLEPTICS
- HYPNOTICS AND SEDATIVES
Synthesis Plan
FORMULA:C14H15ClN4

SMILES: NC(N)=Nc1ccc(CNc2cccc(Cl)c2)cc1

BIRTHDAY: 2018-12-03T10:42:17.717249
ATC: N03A
- NERVOUS SYSTEM
- ANTIEPILEPTICS
- ANTIEPILEPTICS
Synthesis Plan
FORMULA:C23H28FN5O2

SMILES: COc1ccc(C(=O)NC(C)(C)C(C)(C)N)c2cnc(NCc3ccccc3F)nc12

BIRTHDAY: 2018-12-03T19:10:43.241213
ATC: C08C
- CARDIOVASCULAR SYSTEM
- CALCIUM CHANNEL BLOCKERS
- SELECTIVE CALCIUM CHANNEL BLOCKERS WITH MAINLY VASCULAR EFFECTS
Synthesis Plan
FORMULA:C23H24F5N3O

SMILES: N[C@@]1(C(=O)Nc2c(F)cccc2F)NC[C@H]2CC[C@@H](c3cccc(C(F)(F)F)c3)[C@H]1CC2

BIRTHDAY: 2018-12-03T19:10:43.251957
ATC: B03X
- BLOOD AND BLOOD FORMING ORGANS
- ANTIANEMIC PREPARATIONS
- OTHER ANTIANEMIC PREPARATIONS
Synthesis Plan
FORMULA:C16H13F3N2O2

SMILES: O=C(CNC(=O)c1cccc(F)c1)NCc1cccc(F)c1F

BIRTHDAY: 2018-12-03T19:10:43.265144
ATC: H05A
- SYSTEMIC HORMONAL PREPARATIONS, EXCL. SEX HORMONES AND INSULINS
- CALCIUM HOMEOSTASIS
- PARATHYROID HORMONES AND ANALOGUES
Synthesis Plan
FORMULA:C16H17N5O

SMILES: C/C(N)=N\c1ccc(C(=O)Nc2ccc(C(=N)N)cc2)cc1

BIRTHDAY: 2018-12-03T19:10:43.272948
ATC: A07A
- ALIMENTARY TRACT AND METABOLISM
- ANTIDIARRHEALS, INTESTINAL ANTIINFLAMMATORY/ANTIINFECTIVE AGENTS
- INTESTINAL ANTIINFECTIVES
Synthesis Plan
FORMULA:C22H27F3N4O2

SMILES: COc1cc(C(=O)NCCCCCCN)ccc1/C(N)=N\c1ccc(C(F)(F)F)cc1

BIRTHDAY: 2018-12-03T19:10:43.299379
ATC: A10B
- ALIMENTARY TRACT AND METABOLISM
- DRUGS USED IN DIABETES
- BLOOD GLUCOSE LOWERING DRUGS, EXCL. INSULINS
Synthesis Plan
FORMULA:C14H25N3O7

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

BIRTHDAY: 2018-12-03T19:10:43.308674
ATC: A16A
- ALIMENTARY TRACT AND METABOLISM
- OTHER ALIMENTARY TRACT AND METABOLISM PRODUCTS
- OTHER ALIMENTARY TRACT AND METABOLISM PRODUCTS
Synthesis Plan
FORMULA:C6H12BNO3

SMILES: C[C@]1(O)COBC(=O)[C@]1(C)N

BIRTHDAY: 2018-12-03T19:10:43.315075
ATC: J04A
- ANTIINFECTIVES FOR SYSTEMIC USE
- ANTIMYCOBACTERIALS
- DRUGS FOR TREATMENT OF TUBERCULOSIS
Synthesis Plan
FORMULA:C22H25N3O3

SMILES: COc1ccc(C(=O)NCCCCCCNC(=O)c2ccc(C#N)cc2)cc1

BIRTHDAY: 2018-12-03T19:10:43.323426
ATC: B05X
- BLOOD AND BLOOD FORMING ORGANS
- BLOOD SUBSTITUTES AND PERFUSION SOLUTIONS
- I.V. SOLUTION ADDITIVES
Synthesis Plan
FORMULA:C17H35N5O3

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

BIRTHDAY: 2018-12-03T19:10:43.331992
ATC: D05A
- DERMATOLOGICALS
- ANTIPSORIATICS
- ANTIPSORIATICS FOR TOPICAL USE
Synthesis Plan
FORMULA:C18H27N3O3

SMILES: CC/C(N)=N/c1ccc2c(c1)C[C@H](CO)N(C)C(=O)[C@@H](C(C)C)O2

BIRTHDAY: 2018-12-03T19:10:43.356058
ATC: D08A
- DERMATOLOGICALS
- ANTISEPTICS AND DISINFECTANTS
- ANTISEPTICS AND DISINFECTANTS
Synthesis Plan
FORMULA:C25H22F2N6O

SMILES: N#CC(C#N)CN1CCC(c2cc(NC(=O)c3ccc(F)cc3)n(-c3ccc(F)cc3)n2)CC1

BIRTHDAY: 2018-12-03T19:10:43.367084
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C16H21F2N3O

SMILES: NC1=N[C@H](CCCCC(=O)Nc2ccc(F)cc2F)CCC1

BIRTHDAY: 2018-12-01T22:29:47.764378
ATC: V08C
- VARIOUS
- CONTRAST MEDIA
- MAGNETIC RESONANCE IMAGING CONTRAST MEDIA
Synthesis Plan
FORMULA:C16H15N3O3

SMILES: C/C(N)=N\c1cccc(C(=O)Nc2ccc(C(=O)O)cc2)c1

BIRTHDAY: 2018-12-01T22:29:47.772463
ATC: A09A
- ALIMENTARY TRACT AND METABOLISM
- DIGESTIVES, INCL. ENZYMES
- DIGESTIVES, INCL. ENZYMES
Synthesis Plan
FORMULA:C16H16N4O2

SMILES: C/C(N)=N/c1ccccc1C(=O)Nc1ccccc1C(N)=O

BIRTHDAY: 2018-12-01T22:29:47.781117
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C15H23N3O3

SMILES: CC(C)[C@@H](N)C(=O)N[C@@H](CCC(=O)O)C1=CC=CC=CN1

BIRTHDAY: 2018-12-01T22:29:47.789281
ATC: V08C
- VARIOUS
- CONTRAST MEDIA
- MAGNETIC RESONANCE IMAGING CONTRAST MEDIA
Synthesis Plan
FORMULA:C26H26N6O2

SMILES: C/C(N)=N/c1cccc2c1CNCc1cccc(c1)Nc1nccc(n1)-c1ccc(o1)COC2

BIRTHDAY: 2018-12-01T22:29:47.799982
ATC: P01A
- ANTIPARASITIC PRODUCTS, INSECTICIDES AND REPELLENTS
- ANTIPROTOZOALS
- AGENTS AGAINST AMOEBIASIS AND OTHER PROTOZOAL DISEASES
Synthesis Plan
FORMULA:C23H23F2N3O

SMILES: CC(C)(CN(Cc1ccccc1F)c1cccnc1)NC(=O)c1cccc(F)c1

BIRTHDAY: 2018-12-01T22:29:47.814220
ATC: C10A
- CARDIOVASCULAR SYSTEM
- LIPID MODIFYING AGENTS
- LIPID MODIFYING AGENTS, PLAIN
Synthesis Plan
FORMULA:C24H21F2N7O

SMILES: N#CC(C#N)[C@@]1(N)CCC[C@H](c2c(NC(=O)c3cccc(F)c3)cnn2-c2cccc(F)c2)N1

BIRTHDAY: 2018-12-01T22:29:47.833779
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C40H67N3O6

SMILES: CC(C)C[C@H](N)C(=O)N[C@@H](CCC(=O)O)C(=O)N1CCOCCCCC=CCCCCCCC=CC=CC=CCC[C@H]2CCC[C@H](CC1)O2

BIRTHDAY: 2018-12-01T22:29:47.846517
ATC: A05A
- ALIMENTARY TRACT AND METABOLISM
- BILE AND LIVER THERAPY
- BILE THERAPY
Synthesis Plan
FORMULA:C16H18F3N3O3

SMILES: COc1ccc(-c2noc(C(F)(F)F)n2)cc1CNC(=O)C(C)(C)C

BIRTHDAY: 2018-12-01T22:29:47.865327
ATC: C02A
- CARDIOVASCULAR SYSTEM
- ANTIHYPERTENSIVES
- ANTIADRENERGIC AGENTS, CENTRALLY ACTING
Synthesis Plan
FORMULA:C16H14F3N3O

SMILES: C/C(N)=N/c1cccc(C(=O)Nc2cccc(C(F)(F)F)c2)c1

BIRTHDAY: 2018-12-01T22:29:47.890538
ATC: A09A
- ALIMENTARY TRACT AND METABOLISM
- DIGESTIVES, INCL. ENZYMES
- DIGESTIVES, INCL. ENZYMES
Synthesis Plan
FORMULA:C21H31FN4O6

SMILES: CC(C)C[C@H](N)C(=O)N[C@H](CCC(=O)O)C(=O)N[C@H](CO)C(=O)NCc1ccc(F)cc1

BIRTHDAY: 2018-12-01T22:29:47.922937
ATC: A12B
- ALIMENTARY TRACT AND METABOLISM
- MINERAL SUPPLEMENTS
- POTASSIUM
Synthesis Plan