matter.farm

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

These compounds may interact with:

Histamine H3 receptor

Potentially involved in: narcolepsy; attention deficit hyperactivity disorder; schizophrenia; alzheimer's disease; migraine; amnesia; hypertensive disease; memory disorders; adult high grade glioma; astrocytoma; astrocytoma, pilocytic; atypical teratoid / rhabdoid tumor; ependymoma; glioblastoma; group 3 medulloblastoma; osteosarcoma; ovarian cancer; pituitary cancer; psoriasis; hypertension

Disease data sourced from Pharos.

Inverse Agonist

FORMULA:C25H25FN2O

SMILES: O=C(Nc1cccc(C2CCN(Cc3ccccc3)CC2)c1)c1ccc(F)cc1

BIRTHDAY: 2018-12-01T14:10:45.609965
ATC: N05A
- NERVOUS SYSTEM
- PSYCHOLEPTICS
- ANTIPSYCHOTICS
Synthesis Plan
FORMULA:C35H71NO2

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

BIRTHDAY: 2018-12-01T14:10:45.618092
ATC: N05A
- NERVOUS SYSTEM
- PSYCHOLEPTICS
- ANTIPSYCHOTICS
Synthesis Plan
FORMULA:C23H37N3O2

SMILES: CC(C)(C)C(=O)Nc1cccc(C2CCN(CCCN3CCOCC3)CC2)c1

BIRTHDAY: 2018-12-01T14:10:45.626057
ATC: N06A
- NERVOUS SYSTEM
- PSYCHOANALEPTICS
- ANTIDEPRESSANTS
Synthesis Plan
FORMULA:C14H22N2O3S3

SMILES: CCCCCCCOC(=O)C1=C(CCC2=NNCO2)SSS1

BIRTHDAY: 2018-12-01T14:10:45.634244
ATC: N01A
- NERVOUS SYSTEM
- ANESTHETICS
- ANESTHETICS, GENERAL
Synthesis Plan
FORMULA:C21H22F3N3O2

SMILES: CCN1CCN(C(=O)c2ccc(C(=O)Nc3ccc(C(F)(F)F)cc3)cc2)CC1

BIRTHDAY: 2018-12-01T14:10:45.643252
ATC: N06A
- NERVOUS SYSTEM
- PSYCHOANALEPTICS
- ANTIDEPRESSANTS
Synthesis Plan
FORMULA:C34H70

SMILES: CC(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(C)(C)C(C)(C)C

BIRTHDAY: 2018-12-01T14:10:45.649599
ATC: L02A
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ENDOCRINE THERAPY
- HORMONES AND RELATED AGENTS
Synthesis Plan
FORMULA:C29H43N3O2

SMILES: C[C@H](Oc1ccccc1C(=O)c1ccccc1C(C)(C)C)C(C)(C)C(C)(C)N1CCNC[C@@H]1N

BIRTHDAY: 2018-12-01T14:10:45.658704
ATC: N06A
- NERVOUS SYSTEM
- PSYCHOANALEPTICS
- ANTIDEPRESSANTS
Synthesis Plan
FORMULA:C26H32N4O

SMILES: CC1=C(c2ccc(NC(=O)c3ccc(N4CCN(C)CC4)cc3)cc2)N2CCC[C@H]1C2

BIRTHDAY: 2018-12-01T14:10:45.667368
ATC: D01A
- DERMATOLOGICALS
- ANTIFUNGALS FOR DERMATOLOGICAL USE
- ANTIFUNGALS FOR TOPICAL USE
Synthesis Plan
FORMULA:C36H73NO2

SMILES: CCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCC(=O)NCCO

BIRTHDAY: 2018-12-01T14:10:45.675351
ATC: S01A
- SENSORY ORGANS
- OPHTHALMOLOGICALS
- ANTIINFECTIVES
Synthesis Plan
FORMULA:C31H49NO

SMILES: C[C@H](Oc1ccccc1[C@H](C)[C@@H](C)NC(C)(C)C(C)(C)C(C)(C)C(C)(C)C)c1ccccc1

BIRTHDAY: 2018-12-01T14:10:45.683502
ATC: N05A
- NERVOUS SYSTEM
- PSYCHOLEPTICS
- ANTIPSYCHOTICS
Synthesis Plan
FORMULA:C35H71NO2

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

BIRTHDAY: 2018-12-01T14:10:45.691581
ATC: N05A
- NERVOUS SYSTEM
- PSYCHOLEPTICS
- ANTIPSYCHOTICS
Synthesis Plan
FORMULA:C36H64O

SMILES: CCCCCCCCCCCCCCCCCCCCCCCCCCCCCC(=O)c1ccccc1

BIRTHDAY: 2018-12-01T14:10:45.698917
ATC: M01A
- MUSCULO-SKELETAL SYSTEM
- ANTIINFLAMMATORY AND ANTIRHEUMATIC PRODUCTS
- ANTIINFLAMMATORY AND ANTIRHEUMATIC PRODUCTS, NON-STEROIDS
Synthesis Plan
FORMULA:C27H36N4O3

SMILES: CN1CCN(C(=O)c2ccc(C(=O)Nc3ccc(OCCCN4CCCCC4)cc3)cc2)CC1

BIRTHDAY: 2018-12-01T14:10:45.708409
ATC: N06A
- NERVOUS SYSTEM
- PSYCHOANALEPTICS
- ANTIDEPRESSANTS
Synthesis Plan
FORMULA:C40H72O

SMILES: C[C@H](C(=O)c1ccccc1)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)(C)C(C)(C)C

BIRTHDAY: 2018-12-01T14:10:45.716670
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:C30H62

SMILES: CCC(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)C

BIRTHDAY: 2018-12-01T14:10:45.730792
ATC: L01D
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- CYTOTOXIC ANTIBIOTICS AND RELATED SUBSTANCES
Synthesis Plan
FORMULA:C25H26FN3O

SMILES: N[C@]1(Cc2ccccc2)CCCN[C@@H]1c1ccccc1NC(=O)c1cccc(F)c1

BIRTHDAY: 2018-12-01T14:10:45.739684
ATC: C02K
- CARDIOVASCULAR SYSTEM
- ANTIHYPERTENSIVES
- OTHER ANTIHYPERTENSIVES
Synthesis Plan
FORMULA:C23H45N3O2

SMILES: CCCCCCCCCCCCCCCCCCCCC1NC(=O)NC(=O)N1

BIRTHDAY: 2018-12-25T02:02:48.425161
ATC: V03A
- VARIOUS
- ALL OTHER THERAPEUTIC PRODUCTS
- ALL OTHER THERAPEUTIC PRODUCTS
Synthesis Plan
FORMULA:C39H70O

SMILES: CC(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)C(C)(C)CC(=O)c1ccccc1

BIRTHDAY: 2018-12-25T02:02:48.433267
ATC: N07B
- NERVOUS SYSTEM
- OTHER NERVOUS SYSTEM DRUGS
- DRUGS USED IN ADDICTIVE DISORDERS
Synthesis Plan
FORMULA:C28H56N2

SMILES: C[C@H](C1N=N1)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: 2018-12-25T02:02:48.440404
ATC: N07B
- NERVOUS SYSTEM
- OTHER NERVOUS SYSTEM DRUGS
- DRUGS USED IN ADDICTIVE DISORDERS
Synthesis Plan
FORMULA:C27H39N3O2

SMILES: CC(C)(C)c1ccccc1C(=O)c1ccccc1OC(C)(C)C(C)(C)N1CCN[C@@H](N)C1

BIRTHDAY: 2018-12-25T02:02:48.457048
ATC: C01C
- CARDIOVASCULAR SYSTEM
- CARDIAC THERAPY
- CARDIAC STIMULANTS EXCL. CARDIAC GLYCOSIDES
Synthesis Plan
FORMULA:C41H74O

SMILES: CC(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)C(C)(C)C(C)(C)C(=O)c1ccccc1

BIRTHDAY: 2018-12-25T02:02:48.465503
ATC: M04A
- MUSCULO-SKELETAL SYSTEM
- ANTIGOUT PREPARATIONS
- ANTIGOUT PREPARATIONS
Synthesis Plan
FORMULA:C27H46ClN3O

SMILES: CN1CCN(CCCCCCCCCCCN2CCC(Oc3ccc(Cl)cc3)CC2)CC1

BIRTHDAY: 2018-12-25T02:02:48.474139
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C25H28F4N2O4

SMILES: CCC[C@H](Cc1ccc(OC)c(C(=O)NCc2ccc(F)cc2)c1)C(=O)N[C@H](C)C(=O)C(F)(F)F

BIRTHDAY: 2018-12-25T02:02:48.484984
ATC: L01C
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- PLANT ALKALOIDS AND OTHER NATURAL PRODUCTS
Synthesis Plan
FORMULA:C27H35FN2O5

SMILES: COc1ccc(C(=O)NCc2cccc(F)c2)c(C[C@H](C(=O)N[C@H](C)C(=O)C(C)(C)O)C(C)C)c1

BIRTHDAY: 2018-12-25T02:02:48.495222
ATC: C10A
- CARDIOVASCULAR SYSTEM
- LIPID MODIFYING AGENTS
- LIPID MODIFYING AGENTS, PLAIN
Synthesis Plan
FORMULA:C41H74O

SMILES: C[C@@H](CCCCCCCCCCCC(=O)c1ccccc1)C(C)(C)CCCCCCCCCCCCCCC(C)(C)C

BIRTHDAY: 2018-12-25T02:02:48.504188
ATC: N05A
- NERVOUS SYSTEM
- PSYCHOLEPTICS
- ANTIPSYCHOTICS
Synthesis Plan
FORMULA:C28H31N3O2

SMILES: CC(C)c1ccc(NC(=O)c2ccc(C(=O)N3CCN(Cc4ccccc4)CC3)cc2)cc1

BIRTHDAY: 2018-12-25T02:02:48.513258
ATC: R06A
- RESPIRATORY SYSTEM
- ANTIHISTAMINES FOR SYSTEMIC USE
- ANTIHISTAMINES FOR SYSTEMIC USE
Synthesis Plan
FORMULA:C46H78N6O2

SMILES: CC(C)[C@H](C)NC(=O)c1c(C(C)(C)C(C)(C)C(C)(C)C(C)(C)C(C)(C)C(C)(C)C(C)(C)C)cc2c3c1CN(CCN1CC[C@@H](C1)OC=C1CNCC2=N1)N3

BIRTHDAY: 2018-12-25T02:02:48.526937
ATC: R06A
- RESPIRATORY SYSTEM
- ANTIHISTAMINES FOR SYSTEMIC USE
- ANTIHISTAMINES FOR SYSTEMIC USE
Synthesis Plan
FORMULA:C29H59N3O

SMILES: CCCCCCCCCCCCCCCCCCCCC[C@@H]1NC(=O)N(CCCC(C)C)N1

BIRTHDAY: 2018-12-25T02:02:48.535089
ATC: A16A
- ALIMENTARY TRACT AND METABOLISM
- OTHER ALIMENTARY TRACT AND METABOLISM PRODUCTS
- OTHER ALIMENTARY TRACT AND METABOLISM PRODUCTS
Synthesis Plan
FORMULA:C29H43NO3

SMILES: CC(C)C(C(C)C)C(C)(C)[C@@]12C=CC=C[C@@H]1CCNCc1cccc(c1)OCCC(=O)CO2

BIRTHDAY: 2018-12-25T02:02:48.544465
ATC: L04A
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- IMMUNOSUPPRESSANTS
- IMMUNOSUPPRESSANTS
Synthesis Plan
FORMULA:C39H70O

SMILES: CCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCC(=O)c1ccccc1

BIRTHDAY: 2018-12-25T02:02:48.552461
ATC: M01A
- MUSCULO-SKELETAL SYSTEM
- ANTIINFLAMMATORY AND ANTIRHEUMATIC PRODUCTS
- ANTIINFLAMMATORY AND ANTIRHEUMATIC PRODUCTS, NON-STEROIDS
Synthesis Plan
FORMULA:C34H70

SMILES: CC(C)CCCCCCCCCCCCCCCCCCCCCCCCCCCCC(C)C

BIRTHDAY: 2018-12-25T02:02:48.558976
ATC: R01A
- RESPIRATORY SYSTEM
- NASAL PREPARATIONS
- DECONGESTANTS AND OTHER NASAL PREPARATIONS FOR TOPICAL USE
Synthesis Plan
FORMULA:C25H44O3

SMILES: COc1ccc(OC)c(C(C)(C)C(C)(C)C(C)(C)C(C)(C)C(C)(C)C)c1OC

BIRTHDAY: 2018-12-25T02:02:48.566257
ATC: N05A
- NERVOUS SYSTEM
- PSYCHOLEPTICS
- ANTIPSYCHOTICS
Synthesis Plan
FORMULA:C37H66O2

SMILES: COc1ccccc1C(=O)CC(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)C

BIRTHDAY: 2018-12-03T02:38:52.450355
ATC: A02B
- ALIMENTARY TRACT AND METABOLISM
- DRUGS FOR ACID RELATED DISORDERS
- DRUGS FOR PEPTIC ULCER AND GASTRO-OESOPHAGEAL REFLUX DISEASE (GORD)
Synthesis Plan
FORMULA:C29H35N3O

SMILES: O=C(NCCCN1CCCCC1)c1ccc(-c2ccc(CNCc3ccccc3)cc2)cc1

BIRTHDAY: 2018-12-03T02:38:52.459129
ATC: N06A
- NERVOUS SYSTEM
- PSYCHOANALEPTICS
- ANTIDEPRESSANTS
Synthesis Plan
FORMULA:C37H74N2O

SMILES: C[C@H]1CCNC([C@@H](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)=CN[C@H](O)C1(C)C

BIRTHDAY: 2018-12-03T02:38:52.468180
ATC: P03B
- ANTIPARASITIC PRODUCTS, INSECTICIDES AND REPELLENTS
- ECTOPARASITICIDES, INCL. SCABICIDES, INSECTICIDES AND REPELLENTS
- INSECTICIDES AND REPELLENTS
Synthesis Plan
FORMULA:C34H64

SMILES: CCCCCCCCCCCCCCCCCCCCCCCC1=C[C@@]2(C)CCC[C@@]1(C)CC2

BIRTHDAY: 2018-12-03T02:38:52.475292
ATC: M03A
- MUSCULO-SKELETAL SYSTEM
- MUSCLE RELAXANTS
- MUSCLE RELAXANTS, PERIPHERALLY ACTING AGENTS
Synthesis Plan
FORMULA:C25H26FN3O

SMILES: N[C@]1(Cc2ccccc2)NCCC[C@H]1c1ccccc1NC(=O)c1cccc(F)c1

BIRTHDAY: 2018-12-03T02:38:52.484244
ATC: H05A
- SYSTEMIC HORMONAL PREPARATIONS, EXCL. SEX HORMONES AND INSULINS
- CALCIUM HOMEOSTASIS
- PARATHYROID HORMONES AND ANALOGUES
Synthesis Plan
FORMULA:C40H72O

SMILES: C[C@@H](C(=O)c1ccccc1)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)(C)C(C)(C)C

BIRTHDAY: 2018-12-03T02:38:52.492750
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:C22H39ClN2OS

SMILES: C[C@@H](N[C@H](C)C(C)(C)C(C)(C)C(C)(C)N(C)C)[C@H]1O[C@@]2(Cl)C=CC=C[C@@H]2S1

BIRTHDAY: 2018-12-03T02:38:52.501002
ATC: J05A
- ANTIINFECTIVES FOR SYSTEMIC USE
- ANTIVIRALS FOR SYSTEMIC USE
- DIRECT ACTING ANTIVIRALS
Synthesis Plan
FORMULA:C40H72O

SMILES: C[C@@H](CCCCCCCCCC(C)(C)C(C)(C)CCCCCCCCCC[C@H](C)C(C)(C)C)C(=O)c1ccccc1

BIRTHDAY: 2018-12-03T02:38:52.509470
ATC: N06A
- NERVOUS SYSTEM
- PSYCHOANALEPTICS
- ANTIDEPRESSANTS
Synthesis Plan
FORMULA:C27H25FN2O3

SMILES: O=C(c1ccccc1-c1ccc(F)cc1)N1C[C@@H]2CN(Cc3ccc4c(c3)OCO4)C[C@@H]2C1

BIRTHDAY: 2018-12-03T02:38:52.527556
ATC: N04B
- NERVOUS SYSTEM
- ANTI-PARKINSON DRUGS
- DOPAMINERGIC AGENTS
Synthesis Plan
FORMULA:C20H20N2

SMILES: N#Cc1ccc([C@H]2C[C@@H]3CC[C@@H]2N3Cc2ccccc2)cc1

BIRTHDAY: 2018-12-03T02:38:52.534953
ATC: S01F
- SENSORY ORGANS
- OPHTHALMOLOGICALS
- MYDRIATICS AND CYCLOPLEGICS
Synthesis Plan
FORMULA:C36H64O

SMILES: CC(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)CC(=O)c1ccccc1

BIRTHDAY: 2018-12-03T02:38:52.542526
ATC: N07B
- NERVOUS SYSTEM
- OTHER NERVOUS SYSTEM DRUGS
- DRUGS USED IN ADDICTIVE DISORDERS
Synthesis Plan
FORMULA:C21H20F3N3O2

SMILES: O=C(Nc1cccc(C(=O)N2CCC[C@@H]3CN[C@@H]32)c1)c1ccccc1C(F)(F)F

BIRTHDAY: 2018-12-03T02:38:52.552234
ATC: N02B
- NERVOUS SYSTEM
- ANALGESICS
- OTHER ANALGESICS AND ANTIPYRETICS
Synthesis Plan
FORMULA:C27H31N5O2

SMILES: N[C@@]1(c2ccccc2)CCCN[C@H]1c1ccc(NC(=O)c2ccncc2N2CCOCC2)cc1

BIRTHDAY: 2018-12-03T02:38:52.562572
ATC: C03X
- CARDIOVASCULAR SYSTEM
- DIURETICS
- OTHER DIURETICS
Synthesis Plan
FORMULA:C22H24ClNOTe

SMILES: Clc1ccc(-c2cc3ccc(OCCCN4CCCCC4)cc3[te]2)cc1

BIRTHDAY: 2018-12-03T02:38:52.570271
ATC: A02B
- ALIMENTARY TRACT AND METABOLISM
- DRUGS FOR ACID RELATED DISORDERS
- DRUGS FOR PEPTIC ULCER AND GASTRO-OESOPHAGEAL REFLUX DISEASE (GORD)
Synthesis Plan
FORMULA:C38H77NO2

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

BIRTHDAY: 2018-12-03T02:38:52.579112
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C27H30N4O2

SMILES: CC(C)c1cccc(NC(=O)c2ccccc2C(=O)N2CCN[C@](N)(c3ccccc3)C2)c1

BIRTHDAY: 2018-12-03T02:38:52.589131
ATC: L04A
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- IMMUNOSUPPRESSANTS
- IMMUNOSUPPRESSANTS
Synthesis Plan
FORMULA:C27H25F3N2O2

SMILES: C[C@@]1(c2ccccc2)CCCN(C(=O)c2cccc(NC(=O)c3cccc(C(F)(F)F)c3)c2)C1

BIRTHDAY: 2018-11-30T03:40:49.415162
ATC: D11A
- DERMATOLOGICALS
- OTHER DERMATOLOGICAL PREPARATIONS
- OTHER DERMATOLOGICAL PREPARATIONS
Synthesis Plan
FORMULA:C22H25F3N2O

SMILES: O=C(NCCCN1CCCCC1)c1ccc(-c2ccc(C(F)(F)F)cc2)cc1

BIRTHDAY: 2018-11-30T03:40:49.423765
ATC: N06A
- NERVOUS SYSTEM
- PSYCHOANALEPTICS
- ANTIDEPRESSANTS
Synthesis Plan
FORMULA:C41H74O

SMILES: CCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCC(=O)c1ccccc1

BIRTHDAY: 2018-11-30T03:40:49.431974
ATC: M01A
- MUSCULO-SKELETAL SYSTEM
- ANTIINFLAMMATORY AND ANTIRHEUMATIC PRODUCTS
- ANTIINFLAMMATORY AND ANTIRHEUMATIC PRODUCTS, NON-STEROIDS
Synthesis Plan
FORMULA:C27H30N2O

SMILES: O=C(NCC1CCN(CCc2ccccc2)CC1)c1ccc(-c2ccccc2)cc1

BIRTHDAY: 2018-11-30T03:40:49.439933
ATC: N05C
- NERVOUS SYSTEM
- PSYCHOLEPTICS
- HYPNOTICS AND SEDATIVES
Synthesis Plan
FORMULA:C26H44N4O3

SMILES: CCOC(=O)[C@]1(N)C[C@@H]2NC[C@]([C@@H](C)C(C)(C)C(C)(C)C)(C1)N[C@@]2(N)c1cccc(OC)c1

BIRTHDAY: 2018-11-30T03:40:49.458894
ATC: S01E
- SENSORY ORGANS
- OPHTHALMOLOGICALS
- ANTIGLAUCOMA PREPARATIONS AND MIOTICS
Synthesis Plan
FORMULA:C25H35FN4O

SMILES: CC(C)[C@H](c1ccccc1F)C(C)(C)[C@]1(N)CCNC[C@@H]1N1C(=O)N[C@H]2C=CC=C[C@@H]21

BIRTHDAY: 2018-11-30T03:40:49.468695
ATC: S01F
- SENSORY ORGANS
- OPHTHALMOLOGICALS
- MYDRIATICS AND CYCLOPLEGICS
Synthesis Plan
FORMULA:C31H39N3O2S

SMILES: Cc1c2cccc1Sc1cc(ncn1)-c1ccc(C(C)(C)C(C)(C)C(C)(C)C)c(c1)CNCC(=O)CO2

BIRTHDAY: 2018-11-30T03:40:49.478869
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C20H31NO3

SMILES: CCCCCCC[C@@H]1OCCCCCOc2ccccc2NC1=O

BIRTHDAY: 2018-11-30T03:40:49.486377
ATC: H01B
- SYSTEMIC HORMONAL PREPARATIONS, EXCL. SEX HORMONES AND INSULINS
- PITUITARY AND HYPOTHALAMIC HORMONES AND ANALOGUES
- POSTERIOR PITUITARY LOBE HORMONES
Synthesis Plan
FORMULA:C30H49N5O3

SMILES: CCCCCCCCCCCCCCCCCc1ncc2nc1OCCC=CCOC[C@H](C#N)NC(=O)N2

BIRTHDAY: 2018-11-30T03:40:49.496578
ATC: P01B
- ANTIPARASITIC PRODUCTS, INSECTICIDES AND REPELLENTS
- ANTIPROTOZOALS
- ANTIMALARIALS
Synthesis Plan
FORMULA:C28H32N4O2

SMILES: CC(C)c1ccccc1NC(=O)c1ccccc1C(=O)N1CCNC[C@@]1(N)Cc1ccccc1

BIRTHDAY: 2018-11-30T03:40:49.506443
ATC: P03B
- ANTIPARASITIC PRODUCTS, INSECTICIDES AND REPELLENTS
- ECTOPARASITICIDES, INCL. SCABICIDES, INSECTICIDES AND REPELLENTS
- INSECTICIDES AND REPELLENTS
Synthesis Plan
FORMULA:C50H77N3O2S

SMILES: CC(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)[C@]1(C)COc2cccc(c2)Sc2cc(ncn2)-c2cccc(c2)CNCC1=O

BIRTHDAY: 2018-11-30T03:40:49.529388
ATC: D08A
- DERMATOLOGICALS
- ANTISEPTICS AND DISINFECTANTS
- ANTISEPTICS AND DISINFECTANTS
Synthesis Plan
FORMULA:C26H35N3O

SMILES: CCC[C@@H](CCCCN1CCC(n2c(=O)[nH]c3ccccc32)CC1)c1ccccc1

BIRTHDAY: 2018-11-30T03:40:49.537816
ATC: N05A
- NERVOUS SYSTEM
- PSYCHOLEPTICS
- ANTIPSYCHOTICS
Synthesis Plan
FORMULA:C18H17F3N4O2S

SMILES: N[C@]1(c2ccncc2)C=CC(NC(=O)c2ccccc2OCC(F)(F)F)=[SH]N1

BIRTHDAY: 2018-11-30T03:40:49.547978
ATC: J04A
- ANTIINFECTIVES FOR SYSTEMIC USE
- ANTIMYCOBACTERIALS
- DRUGS FOR TREATMENT OF TUBERCULOSIS
Synthesis Plan
FORMULA:C32H49NO2

SMILES: CC(C)(Oc1cccc(C(=O)[C@@]2(C(C)(C)C(C)(C)C)[C@H]3C[C@H]4CCC[C@@H]2[C@@H]4C3)c1)N1CCCCC1

BIRTHDAY: 2018-11-30T03:40:49.558384
ATC: V09X
- VARIOUS
- DIAGNOSTIC RADIOPHARMACEUTICALS
- OTHER DIAGNOSTIC RADIOPHARMACEUTICALS
Synthesis Plan
FORMULA:C22H26FNO4

SMILES: COC(=O)[C@H](Cc1c(OC)cccc1C(=O)NCc1cccc(F)c1)C(C)C

BIRTHDAY: 2018-11-30T03:40:49.568334
ATC: P03A
- ANTIPARASITIC PRODUCTS, INSECTICIDES AND REPELLENTS
- ECTOPARASITICIDES, INCL. SCABICIDES, INSECTICIDES AND REPELLENTS
- ECTOPARASITICIDES, INCL. SCABICIDES
Synthesis Plan
FORMULA:C30H44N6O2

SMILES: CC(C)[C@H](C(C)(C)[C@]1(N)CCN[C@@H](N2C(=O)N[C@H]3C=CC=C[C@H]32)C1)[C@@]12C=CC=C[C@H]1CNC=CNCC2=O

BIRTHDAY: 2018-11-19T08:17:10.121795
ATC: V08C
- VARIOUS
- CONTRAST MEDIA
- MAGNETIC RESONANCE IMAGING CONTRAST MEDIA
Synthesis Plan
FORMULA:C41H60N2O2

SMILES: CCCCCCCCCCCCCCCCCCC[C@H]1[C@@H](c2ccc(C(=O)Nc3ccc(C(N)=O)cc3)cc2)[C@H]2CC=C[C@@H]1C2

BIRTHDAY: 2018-11-19T08:17:10.132811
ATC: C10A
- CARDIOVASCULAR SYSTEM
- LIPID MODIFYING AGENTS
- LIPID MODIFYING AGENTS, PLAIN
Synthesis Plan
FORMULA:C30H43N3

SMILES: CCCCCCCCC1=CC2=NC1=Cc1ccc([nH]1)CCCCCCCCCc1ccc2[nH]1

BIRTHDAY: 2018-11-19T08:17:10.141452
ATC: C02C
- CARDIOVASCULAR SYSTEM
- ANTIHYPERTENSIVES
- ANTIADRENERGIC AGENTS, PERIPHERALLY ACTING
Synthesis Plan
FORMULA:C38H44O

SMILES: CCCCCCCCCCc1ccc2cc1CCc1ccc(cc1)CCc1ccccc1-c1ccc(cc1)O2

BIRTHDAY: 2018-11-19T08:17:10.150659
ATC: J01X
- ANTIINFECTIVES FOR SYSTEMIC USE
- ANTIBACTERIALS FOR SYSTEMIC USE
- OTHER ANTIBACTERIALS
Synthesis Plan
FORMULA:C18H23N3O4

SMILES: COc1ccc(CNC(=O)[C@]2(C(C)C)[C@H]3C=CO[C@H]2NC(=O)N3)cc1

BIRTHDAY: 2018-11-19T08:17:10.159580
ATC: N05C
- NERVOUS SYSTEM
- PSYCHOLEPTICS
- HYPNOTICS AND SEDATIVES
Synthesis Plan
FORMULA:C42H76O

SMILES: CC(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)C(C)(C)C(C)(C)CC(=O)c1ccccc1

BIRTHDAY: 2018-11-19T08:17:10.168061
ATC: N07B
- NERVOUS SYSTEM
- OTHER NERVOUS SYSTEM DRUGS
- DRUGS USED IN ADDICTIVE DISORDERS
Synthesis Plan
FORMULA:C28H37N3O3

SMILES: COc1ccccc1C(C)(C)C(C)(C)[C@H](C)N1CCCC[C@@H]1OC(=O)Nc1ccccc1C#N

BIRTHDAY: 2018-11-19T08:17:10.186333
ATC: C01B
- CARDIOVASCULAR SYSTEM
- CARDIAC THERAPY
- ANTIARRHYTHMICS, CLASS I AND III
Synthesis Plan
FORMULA:C29H56O

SMILES: CCCCCCCCCCCCCCCCCCCCCCC[C@H]1C=CCOCC1

BIRTHDAY: 2018-11-19T08:17:10.193045
ATC: J04A
- ANTIINFECTIVES FOR SYSTEMIC USE
- ANTIMYCOBACTERIALS
- DRUGS FOR TREATMENT OF TUBERCULOSIS
Synthesis Plan
FORMULA:C28H32N4O2

SMILES: CC(C)c1ccccc1NC(=O)c1ccccc1C(=O)N1CCN[C@@](N)(Cc2ccccc2)C1

BIRTHDAY: 2018-11-19T08:17:10.203010
ATC: J01F
- ANTIINFECTIVES FOR SYSTEMIC USE
- ANTIBACTERIALS FOR SYSTEMIC USE
- MACROLIDES, LINCOSAMIDES AND STREPTOGRAMINS
Synthesis Plan
FORMULA:C12H15N3

SMILES: N#Cc1ccccc1[C@@]1(N)CCCCN1

BIRTHDAY: 2018-11-19T08:17:10.209464
ATC: L02B
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ENDOCRINE THERAPY
- HORMONE ANTAGONISTS AND RELATED AGENTS
Synthesis Plan
FORMULA:C25H43NS

SMILES: C[C@@H](C(C)(C)C(C)(C)C(C)(C)C(C)(C)C(C)(C)C)[C@@]12C=CC=C[C@@H]1C=NS2

BIRTHDAY: 2018-11-19T08:17:10.216688
ATC: J01D
- ANTIINFECTIVES FOR SYSTEMIC USE
- ANTIBACTERIALS FOR SYSTEMIC USE
- OTHER BETA-LACTAM ANTIBACTERIALS
Synthesis Plan
FORMULA:C26H37N3O

SMILES: CC(C)[C@@H]1CCCCN[C@@]2(N=Cc3cc4ccccc4cc32)OCCCCCCN1

BIRTHDAY: 2018-11-19T08:17:10.225409
ATC: H05A
- SYSTEMIC HORMONAL PREPARATIONS, EXCL. SEX HORMONES AND INSULINS
- CALCIUM HOMEOSTASIS
- PARATHYROID HORMONES AND ANALOGUES
Synthesis Plan
FORMULA:C26H27FN2O

SMILES: O=C(Nc1cccc(C2CCN(CCc3ccccc3)CC2)c1)c1ccc(F)cc1

BIRTHDAY: 2018-11-19T08:17:10.233783
ATC: N06A
- NERVOUS SYSTEM
- PSYCHOANALEPTICS
- ANTIDEPRESSANTS
Synthesis Plan
FORMULA:C24H28N2O

SMILES: CC1=CCCCc2ccc(o2)C2=NC(=C(C)c3ccc([nH]3)CCCC1)C=C2

BIRTHDAY: 2018-11-19T08:17:10.241936
ATC: N02B
- NERVOUS SYSTEM
- ANALGESICS
- OTHER ANALGESICS AND ANTIPYRETICS
Synthesis Plan
FORMULA:C27H31F3N4O2

SMILES: O=C(NCCC(F)(F)F)c1ccc2c(c1)C=Nc1cc(N3CCC(N4CCCCC4)CC3)ccc1O2

BIRTHDAY: 2018-11-19T08:17:10.252580
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:C40H73NO

SMILES: CCCCCCCCCCCCCCCCCCCCCCCCCCCC[C@]12CC[C@@H]3[C@H](C1)C(C)=CCCN3C2=O

BIRTHDAY: 2018-11-19T08:17:10.261751
ATC: A05A
- ALIMENTARY TRACT AND METABOLISM
- BILE AND LIVER THERAPY
- BILE THERAPY
Synthesis Plan
FORMULA:C36H73NO2

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

BIRTHDAY: 2018-11-19T08:17:10.270443
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:C28H40N2O2

SMILES: CN1CCN(CCCCCCOc2ccc(C(=O)c3ccc(C(C)(C)C)cc3)cc2)CC1

BIRTHDAY: 2018-11-19T08:17:10.287167
ATC: R06A
- RESPIRATORY SYSTEM
- ANTIHISTAMINES FOR SYSTEMIC USE
- ANTIHISTAMINES FOR SYSTEMIC USE
Synthesis Plan
FORMULA:C21H37N3O2

SMILES: CO[C@@]12C=CC=C[C@@]1(N)[C@@H](CC(C)(C)C(C)(C)C(C)(C)N(C)C)N=CO2

BIRTHDAY: 2018-11-19T08:17:10.295261
ATC: V08C
- VARIOUS
- CONTRAST MEDIA
- MAGNETIC RESONANCE IMAGING CONTRAST MEDIA
Synthesis Plan
FORMULA:C22H25F3N2O

SMILES: CC(C)(NC(=O)c1ccccc1-c1ccccc1C(F)(F)F)N1CCCCC1

BIRTHDAY: 2018-11-19T08:17:10.304045
ATC: M01A
- MUSCULO-SKELETAL SYSTEM
- ANTIINFLAMMATORY AND ANTIRHEUMATIC PRODUCTS
- ANTIINFLAMMATORY AND ANTIRHEUMATIC PRODUCTS, NON-STEROIDS
Synthesis Plan
FORMULA:C28H49N

SMILES: CC(C)(C)C(C)(C)C(C)(C)C(C)(C)C(C)(C)C(C)(C)C1=NC[C@]2(C)C=CC=C[C@@H]12

BIRTHDAY: 2018-11-19T08:17:10.311077
ATC: N05C
- NERVOUS SYSTEM
- PSYCHOLEPTICS
- HYPNOTICS AND SEDATIVES
Synthesis Plan
FORMULA:C39H70N2O2

SMILES: CCCCCCCCCCCCCCCCCCCCCCCCCCCCC[C@@H]1C(c2ccccc2OC)=NON1C

BIRTHDAY: 2018-11-19T08:17:10.321456
ATC: V03A
- VARIOUS
- ALL OTHER THERAPEUTIC PRODUCTS
- ALL OTHER THERAPEUTIC PRODUCTS
Synthesis Plan
FORMULA:C12H24S2

SMILES: CC(C)(C)C(C)(C)C1(C)CSCSC1

BIRTHDAY: 2018-11-19T08:17:10.327222
ATC: A07A
- ALIMENTARY TRACT AND METABOLISM
- ANTIDIARRHEALS, INTESTINAL ANTIINFLAMMATORY/ANTIINFECTIVE AGENTS
- INTESTINAL ANTIINFECTIVES
Synthesis Plan
FORMULA:C39H73N3O

SMILES: CCCCCCCCCCCCCCCCCCCCC[C@@H](C)[C@@H](C)CCCC[C@H]1Cn2cnc(n2)CCC=CCCO1

BIRTHDAY: 2018-11-19T08:17:10.346355
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:C26H37N3O

SMILES: CC(C)[C@@H](c1ccccc1)[C@@H](C)[C@@H](C)N1CCC[C@@H](N2C(=O)N[C@@H]3C=CC=C[C@@H]32)C1

BIRTHDAY: 2018-11-19T08:17:10.356007
ATC: S01F
- SENSORY ORGANS
- OPHTHALMOLOGICALS
- MYDRIATICS AND CYCLOPLEGICS
Synthesis Plan
FORMULA:C24H29FN2O5

SMILES: CCC[C@@H](Cc1ccc(OC)c(C(=O)NCc2ccc(F)cc2)c1)C(=O)OCC(=O)NC

BIRTHDAY: 2018-11-19T08:17:10.366381
ATC: N03A
- NERVOUS SYSTEM
- ANTIEPILEPTICS
- ANTIEPILEPTICS
Synthesis Plan
FORMULA:C38H77NO2

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

BIRTHDAY: 2018-11-19T08:17:10.375713
ATC: N05A
- NERVOUS SYSTEM
- PSYCHOLEPTICS
- ANTIPSYCHOTICS
Synthesis Plan
FORMULA:C27H31N5O2

SMILES: N[C@@]1(c2ccccc2)CCCN[C@H]1c1ccccc1NC(=O)c1ccncc1N1CCOCC1

BIRTHDAY: 2018-11-19T08:17:10.387232
ATC: V08A
- VARIOUS
- CONTRAST MEDIA
- X-RAY CONTRAST MEDIA, IODINATED
Synthesis Plan
FORMULA:C32H66

SMILES: CC(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)C(C)(C)C

BIRTHDAY: 2018-11-19T08:17:10.393735
ATC: L01D
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- CYTOTOXIC ANTIBIOTICS AND RELATED SUBSTANCES
Synthesis Plan
FORMULA:C38H77NO2

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

BIRTHDAY: 2018-11-19T08:17:10.403042
ATC: N05A
- NERVOUS SYSTEM
- PSYCHOLEPTICS
- ANTIPSYCHOTICS
Synthesis Plan
FORMULA:C37H75NO2

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

BIRTHDAY: 2018-11-19T08:17:10.412206
ATC: A07B
- ALIMENTARY TRACT AND METABOLISM
- ANTIDIARRHEALS, INTESTINAL ANTIINFLAMMATORY/ANTIINFECTIVE AGENTS
- INTESTINAL ADSORBENTS
Synthesis Plan
FORMULA:C32H39N5O2

SMILES: CC(C)(NC(=O)c1ccccc1-c1ccccc1C(=O)N1CCNC[C@]1(N)c1ccccc1)N1CCCCC1

BIRTHDAY: 2018-11-19T08:17:10.427365
ATC: N06A
- NERVOUS SYSTEM
- PSYCHOANALEPTICS
- ANTIDEPRESSANTS
Synthesis Plan
FORMULA:C21H24F3N3O

SMILES: C[C@@H](NC(=O)c1cccc(-c2cccc(C(F)(F)F)c2)c1)[C@]1(N)CCCNC1

BIRTHDAY: 2018-11-19T08:17:10.454024
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C30H38F3N5O3

SMILES: O=C(Nc1cccc(C(F)(F)F)c1)c1cccc(N2CCN[C@H](N3CC=COCCOCCN4CCC3CC4)C2)c1

BIRTHDAY: 2018-11-19T08:17:10.466857
ATC: V09C
- VARIOUS
- DIAGNOSTIC RADIOPHARMACEUTICALS
- RENAL SYSTEM
Synthesis Plan
FORMULA:C48H87N

SMILES: c1ccc(CCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCC[C@@H]2[C@@H]3CCCCN2CCC3)cc1

BIRTHDAY: 2018-11-19T08:17:10.477172
ATC: R03D
- RESPIRATORY SYSTEM
- DRUGS FOR OBSTRUCTIVE AIRWAY DISEASES
- OTHER SYSTEMIC DRUGS FOR OBSTRUCTIVE AIRWAY DISEASES
Synthesis Plan
FORMULA:C25H48N4O3

SMILES: CCN1CCN(CCCCC[C@H]2C[C@@H](C)CN[C@@H](C)C(=O)C[C@@H](C)NCCC(=O)O2)CC1

BIRTHDAY: 2018-11-19T08:17:10.486581
ATC: D11A
- DERMATOLOGICALS
- OTHER DERMATOLOGICAL PREPARATIONS
- OTHER DERMATOLOGICAL PREPARATIONS
Synthesis Plan
FORMULA:C38H66N4O7

SMILES: C[C@H](C(C)(C)C(C)(C)C(C)(C)C(C)(C)C)[C@@]1(C(=O)OC(C)(C)C(C)(C)C(C)(C)C(=O)O)CCOCCNCNc2cncc(n2)OCC1=O

BIRTHDAY: 2018-11-19T08:17:10.502561
ATC: D01A
- DERMATOLOGICALS
- ANTIFUNGALS FOR DERMATOLOGICAL USE
- ANTIFUNGALS FOR TOPICAL USE
Synthesis Plan
FORMULA:C23H29FN2O3

SMILES: CCC[C@@H](Cc1ccc(OC)c(C(=O)NCc2ccc(F)cc2)c1)C(=O)N(C)C

BIRTHDAY: 2018-11-19T08:17:10.511508
ATC: C02C
- CARDIOVASCULAR SYSTEM
- ANTIHYPERTENSIVES
- ANTIADRENERGIC AGENTS, PERIPHERALLY ACTING
Synthesis Plan
FORMULA:C23H27N3OS

SMILES: O=C(Nc1ccc([C@@H]2CC[C@@H]3SCCC[C@H]3N2)cc1)N1Cc2ccccc2C1

BIRTHDAY: 2018-11-19T08:17:10.520137
ATC: J01F
- ANTIINFECTIVES FOR SYSTEMIC USE
- ANTIBACTERIALS FOR SYSTEMIC USE
- MACROLIDES, LINCOSAMIDES AND STREPTOGRAMINS
Synthesis Plan
FORMULA:C37H75NO2

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

BIRTHDAY: 2018-11-19T08:17:10.528711
ATC: A07B
- ALIMENTARY TRACT AND METABOLISM
- ANTIDIARRHEALS, INTESTINAL ANTIINFLAMMATORY/ANTIINFECTIVE AGENTS
- INTESTINAL ADSORBENTS
Synthesis Plan
FORMULA:C19H19F3N4O2

SMILES: N[C@H]1CNCCN1C(=O)c1ccccc1C(=O)Nc1ccccc1C(F)(F)F

BIRTHDAY: 2018-11-19T08:17:10.539266
ATC: N06A
- NERVOUS SYSTEM
- PSYCHOANALEPTICS
- ANTIDEPRESSANTS
Synthesis Plan
FORMULA:C22H26N6O

SMILES: O=C(NCC1CCN(CCc2ccccc2)CC1)c1ccc(-n2cnnn2)cc1

BIRTHDAY: 2018-11-19T08:17:10.548317
ATC: N05C
- NERVOUS SYSTEM
- PSYCHOLEPTICS
- HYPNOTICS AND SEDATIVES
Synthesis Plan
FORMULA:C19H27NO

SMILES: O[C@]12C=CC=C[C@@]13C=CC=C[C@@H]3CCCCCCCCN2

BIRTHDAY: 2018-11-19T08:17:10.561244
ATC: A11D
- ALIMENTARY TRACT AND METABOLISM
- VITAMINS
- VITAMIN B1, PLAIN AND IN COMBINATION WITH VITAMIN B6 AND B12
Synthesis Plan
FORMULA:C31H64

SMILES: CCC(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)CC

BIRTHDAY: 2018-11-19T08:17:10.567320
ATC: N03A
- NERVOUS SYSTEM
- ANTIEPILEPTICS
- ANTIEPILEPTICS
Synthesis Plan
FORMULA:C21H21FN2O

SMILES: O=C(Nc1ccccc1[C@@H]1[C@H]2C=CC[C@H]1CNC2)c1cccc(F)c1

BIRTHDAY: 2018-11-19T08:17:10.575676
ATC: C10A
- CARDIOVASCULAR SYSTEM
- LIPID MODIFYING AGENTS
- LIPID MODIFYING AGENTS, PLAIN
Synthesis Plan
FORMULA:C18H30N6O

SMILES: CCCCCCCCCCCCC1=NN(C2=NN[C@H](C#N)O2)CC=N1

BIRTHDAY: 2018-11-19T08:17:10.584056
ATC: N03A
- NERVOUS SYSTEM
- ANTIEPILEPTICS
- ANTIEPILEPTICS
Synthesis Plan
FORMULA:C29H34N4O2

SMILES: CN1CCN(c2ccccc2C(=O)Nc2ccccc2C(=O)Nc2ccc(C(C)(C)C)cc2)CC1

BIRTHDAY: 2018-11-19T08:17:10.611961
ATC: P02D
- ANTIPARASITIC PRODUCTS, INSECTICIDES AND REPELLENTS
- ANTHELMINTICS
- ANTICESTODALS
Synthesis Plan
FORMULA:C19H22FN3

SMILES: CN(C)C(C)(C)c1ncccc(-c2ccccc2F)cccn1

BIRTHDAY: 2018-11-19T08:17:10.619299
ATC: C01D
- CARDIOVASCULAR SYSTEM
- CARDIAC THERAPY
- VASODILATORS USED IN CARDIAC DISEASES
Synthesis Plan
FORMULA:C22H35NO3

SMILES: COc1ccccc1C(C)(C)C(C)(C)[C@H](C)N1CCCC[C@@H]1OC(C)=O

BIRTHDAY: 2018-11-19T08:17:10.627236
ATC: A07X
- ALIMENTARY TRACT AND METABOLISM
- ANTIDIARRHEALS, INTESTINAL ANTIINFLAMMATORY/ANTIINFECTIVE AGENTS
- OTHER ANTIDIARRHEALS
Synthesis Plan
FORMULA:C33H58

SMILES: CC(C)(C)C(C)(C)C(C)(C)C(C)(C)C(C)(C)C(C)(C)C(C)(C)C1[C@H]2[C@H]3[C@H]4C[C@H]2[C@H]2[C@H]4C[C@H]3[C@@H]12

BIRTHDAY: 2018-11-19T08:17:10.635023
ATC: R02A
- RESPIRATORY SYSTEM
- THROAT PREPARATIONS
- THROAT PREPARATIONS
Synthesis Plan
FORMULA:C21H20F3N3O2

SMILES: O=C(Nc1cccc(C(=O)N2CCC[C@@H]3CN[C@H]32)c1)c1ccccc1C(F)(F)F

BIRTHDAY: 2018-11-19T08:17:10.644827
ATC: N02B
- NERVOUS SYSTEM
- ANALGESICS
- OTHER ANALGESICS AND ANTIPYRETICS
Synthesis Plan
FORMULA:C34H48ClN5O3

SMILES: O=c1onc(CCCCCCCCN2CCN(c3ccc(Cl)cc3)CC2)n1-c1ccc(OCCCN2CCCCC2)cc1

BIRTHDAY: 2018-11-19T08:17:10.656926
ATC: V08A
- VARIOUS
- CONTRAST MEDIA
- X-RAY CONTRAST MEDIA, IODINATED
Synthesis Plan
FORMULA:C48H64O

SMILES: CC(C)(C)C(C)(C)C(C)(C)C(C)(C)C(C)(C)C(C)(C)[C@@]1(C)CCCc2ccc(cc2)-c2ccccc2-c2cccc(c2)Oc2ccc1cc2

BIRTHDAY: 2018-11-19T08:17:10.668053
ATC: N05A
- NERVOUS SYSTEM
- PSYCHOLEPTICS
- ANTIPSYCHOTICS
Synthesis Plan
FORMULA:C33H58O

SMILES: CCCCCCCCCCCCCCCCCCCCCCCCCCC(=O)c1ccccc1

BIRTHDAY: 2018-11-19T08:17:10.683728
ATC: M01A
- MUSCULO-SKELETAL SYSTEM
- ANTIINFLAMMATORY AND ANTIRHEUMATIC PRODUCTS
- ANTIINFLAMMATORY AND ANTIRHEUMATIC PRODUCTS, NON-STEROIDS
Synthesis Plan
FORMULA:C33H68

SMILES: CCC(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)C(C)(C)C

BIRTHDAY: 2018-11-19T08:17:10.690094
ATC: L01D
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- CYTOTOXIC ANTIBIOTICS AND RELATED SUBSTANCES
Synthesis Plan
FORMULA:C24H33N3O

SMILES: CCC(C)(C)[C@H](C)[C@]1(N[C@H](C)c2cccc(OC)c2)N=CN=C2C=CC=C[C@@H]21

BIRTHDAY: 2018-11-19T08:17:10.708025
ATC: C09D
- CARDIOVASCULAR SYSTEM
- AGENTS ACTING ON THE RENIN-ANGIOTENSIN SYSTEM
- ANGIOTENSIN II ANTAGONISTS, COMBINATIONS
Synthesis Plan
FORMULA:C19H19N3

SMILES: N#Cc1ccccc1[C@@]12CC[C@H](N1)[C@@](N)(c1ccccc1)C2

BIRTHDAY: 2018-11-19T08:17:10.724295
ATC: A10B
- ALIMENTARY TRACT AND METABOLISM
- DRUGS USED IN DIABETES
- BLOOD GLUCOSE LOWERING DRUGS, EXCL. INSULINS
Synthesis Plan
FORMULA:C38H68O

SMILES: CC(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)C(C)(C)C(=O)c1ccccc1

BIRTHDAY: 2018-11-19T08:17:10.732277
ATC: M04A
- MUSCULO-SKELETAL SYSTEM
- ANTIGOUT PREPARATIONS
- ANTIGOUT PREPARATIONS
Synthesis Plan
FORMULA:C29H33N3O2

SMILES: CC(C)c1ccc(NC(=O)c2ccc(C(=O)N3CCN(CCc4ccccc4)CC3)cc2)cc1

BIRTHDAY: 2018-11-19T08:17:10.741463
ATC: C01C
- CARDIOVASCULAR SYSTEM
- CARDIAC THERAPY
- CARDIAC STIMULANTS EXCL. CARDIAC GLYCOSIDES
Synthesis Plan
FORMULA:C27H25F3N2O4

SMILES: C[C@H](C(=O)O)C(C)(C)c1ccccc1C(=O)Nc1cccc(C(=O)Nc2ccccc2C(F)(F)F)c1

BIRTHDAY: 2018-11-19T08:17:10.752633
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C39H70O

SMILES: CCC(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)C(C)(C)C(=O)c1ccccc1

BIRTHDAY: 2018-11-19T08:17:10.760729
ATC: M04A
- MUSCULO-SKELETAL SYSTEM
- ANTIGOUT PREPARATIONS
- ANTIGOUT PREPARATIONS
Synthesis Plan
FORMULA:C26H38N4O2

SMILES: C[C@@H](Oc1ccccc1C(=O)c1ccccc1C(C)(C)C)C(C)(C)[C@@]1(N)CNC[C@@H](N)N1

BIRTHDAY: 2018-11-19T08:17:10.770707
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:C40H72O

SMILES: CCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCC(=O)c1ccccc1

BIRTHDAY: 2018-11-19T08:17:10.779327
ATC: M01A
- MUSCULO-SKELETAL SYSTEM
- ANTIINFLAMMATORY AND ANTIRHEUMATIC PRODUCTS
- ANTIINFLAMMATORY AND ANTIRHEUMATIC PRODUCTS, NON-STEROIDS
Synthesis Plan
FORMULA:C41H75NO2

SMILES: COc1ccccc1CNC(=O)CC(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)C(C)(C)C

BIRTHDAY: 2018-11-19T08:17:10.788894
ATC: N05A
- NERVOUS SYSTEM
- PSYCHOLEPTICS
- ANTIPSYCHOTICS
Synthesis Plan
FORMULA:C34H67NO2

SMILES: CCCCCCCCCC1CC(CCCCCCCCCCCCCCCCCCC(=O)NCCO)C1

BIRTHDAY: 2018-11-19T08:17:10.796938
ATC: J04A
- ANTIINFECTIVES FOR SYSTEMIC USE
- ANTIMYCOBACTERIALS
- DRUGS FOR TREATMENT OF TUBERCULOSIS
Synthesis Plan
FORMULA:C25H32N2O2

SMILES: N[C@H]1C=Cc2ccccc2O[C@H](c2ccc(OCCCN3CCCCC3)cc2)C1

BIRTHDAY: 2018-11-19T08:17:10.805366
ATC: G03A
- GENITO URINARY SYSTEM AND SEX HORMONES
- SEX HORMONES AND MODULATORS OF THE GENITAL SYSTEM
- HORMONAL CONTRACEPTIVES FOR SYSTEMIC USE
Synthesis Plan
FORMULA:C17H21N5O

SMILES: CC(C)(C)CC(=O)N1CN=N[C@]2(C1)NC=C1C=CC=C[C@]12C#N

BIRTHDAY: 2018-11-30T17:23:11.073135
ATC: A16A
- ALIMENTARY TRACT AND METABOLISM
- OTHER ALIMENTARY TRACT AND METABOLISM PRODUCTS
- OTHER ALIMENTARY TRACT AND METABOLISM PRODUCTS
Synthesis Plan
FORMULA:C27H37N3O

SMILES: O=C(NCCCN1CCCCC1)c1ccc(-c2ccc(CN3CCCCC3)cc2)cc1

BIRTHDAY: 2018-11-30T17:23:11.090140
ATC: A08A
- ALIMENTARY TRACT AND METABOLISM
- ANTIOBESITY PREPARATIONS, EXCL. DIET PRODUCTS
- ANTIOBESITY PREPARATIONS, EXCL. DIET PRODUCTS
Synthesis Plan
FORMULA:C27H31N5O2

SMILES: N[C@]1(c2ccccc2)CCCN[C@@H]1c1ccccc1NC(=O)c1ncccc1N1CCOCC1

BIRTHDAY: 2018-11-30T17:23:11.100852
ATC: N06A
- NERVOUS SYSTEM
- PSYCHOANALEPTICS
- ANTIDEPRESSANTS
Synthesis Plan
FORMULA:C17H30ClF2N3

SMILES: CCCCCCCC[C@@H]1[C@@H](C(F)(F)Cl)N2C[C@@H]3CN(C2)CN1C3

BIRTHDAY: 2018-11-30T17:23:11.117578
ATC: N01A
- NERVOUS SYSTEM
- ANESTHETICS
- ANESTHETICS, GENERAL
Synthesis Plan
FORMULA:C26H36N4O

SMILES: CC(C)(NC(=O)c1ccccc1-c1ccccc1[C@]1(N)CCCCN1)N1CCCCC1

BIRTHDAY: 2018-11-30T17:23:11.126492
ATC: N07B
- NERVOUS SYSTEM
- OTHER NERVOUS SYSTEM DRUGS
- DRUGS USED IN ADDICTIVE DISORDERS
Synthesis Plan
FORMULA:C27H31N5O2

SMILES: N[C@@]1(c2ccccc2)CCCN[C@H]1c1cccc(NC(=O)c2ccncc2N2CCOCC2)c1

BIRTHDAY: 2018-11-30T17:23:11.136872
ATC: C03X
- CARDIOVASCULAR SYSTEM
- DIURETICS
- OTHER DIURETICS
Synthesis Plan
FORMULA:C21H36N6O5

SMILES: CCCC(C)(C)C(=O)N[C@@H](C)C(=O)N1CC[C@]2(C)N=NN[C@H](C(=O)NCCC(=O)O)[C@H]2C1

BIRTHDAY: 2018-11-30T17:23:11.147345
ATC: J04A
- ANTIINFECTIVES FOR SYSTEMIC USE
- ANTIMYCOBACTERIALS
- DRUGS FOR TREATMENT OF TUBERCULOSIS
Synthesis Plan
FORMULA:C27H25FN2O3

SMILES: O=C(c1ccccc1-c1ccc(F)cc1)N1C[C@@H]2CN(Cc3ccc4c(c3)OCO4)C[C@H]2C1

BIRTHDAY: 2018-11-30T17:23:11.165560
ATC: N04B
- NERVOUS SYSTEM
- ANTI-PARKINSON DRUGS
- DOPAMINERGIC AGENTS
Synthesis Plan
FORMULA:C37H46N4O4

SMILES: COc1ccc(C(=O)N[C@]2(C)NCCNCCNCc3cccc4ccc(cc34)Oc3cccc2c3)c(C[C@@H](OC)C(C)C)c1

BIRTHDAY: 2018-11-30T17:23:11.177684
ATC: A10B
- ALIMENTARY TRACT AND METABOLISM
- DRUGS USED IN DIABETES
- BLOOD GLUCOSE LOWERING DRUGS, EXCL. INSULINS
Synthesis Plan
FORMULA:C23H42N2O2

SMILES: CCCCCCCCCCCCCCCCCCCc1nc(=O)cc(N)o1

BIRTHDAY: 2018-11-30T17:23:11.194788
ATC: B02A
- BLOOD AND BLOOD FORMING ORGANS
- ANTIHEMORRHAGICS
- ANTIFIBRINOLYTICS
Synthesis Plan
FORMULA:C21H41NO

SMILES: O=CCCCCCCCCCCCCCCCN1CCCCC1

BIRTHDAY: 2018-11-30T17:23:11.200754
ATC: A07X
- ALIMENTARY TRACT AND METABOLISM
- ANTIDIARRHEALS, INTESTINAL ANTIINFLAMMATORY/ANTIINFECTIVE AGENTS
- OTHER ANTIDIARRHEALS
Synthesis Plan
FORMULA:C25H24F2N2O

SMILES: O=C(Nc1cccc(C2CCN(Cc3ccc(F)cc3)CC2)c1)c1ccccc1F

BIRTHDAY: 2018-11-30T17:23:11.209321
ATC: A03F
- ALIMENTARY TRACT AND METABOLISM
- DRUGS FOR FUNCTIONAL GASTROINTESTINAL DISORDERS
- PROPULSIVES
Synthesis Plan
FORMULA:C25H26FN3O

SMILES: N[C@@]1(Cc2ccccc2)CCCN[C@H]1c1ccccc1NC(=O)c1cccc(F)c1

BIRTHDAY: 2018-11-30T17:23:11.218131
ATC: C02K
- CARDIOVASCULAR SYSTEM
- ANTIHYPERTENSIVES
- OTHER ANTIHYPERTENSIVES
Synthesis Plan
FORMULA:C41H73NO

SMILES: CC(C)(C)C(=O)[C@@H]1[C@@]2(CC(C)(C)C(C)(C)C(C)(C)C(C)(C)C(C)(C)C(C)(C)C(C)(C)C)C[C@@H]3[C@@H]4[C@@H]5CCC[C@]41[C@@H](C2)N3C5

BIRTHDAY: 2018-11-30T17:23:11.228914
ATC: J05A
- ANTIINFECTIVES FOR SYSTEMIC USE
- ANTIVIRALS FOR SYSTEMIC USE
- DIRECT ACTING ANTIVIRALS
Synthesis Plan
FORMULA:C27H30N4O2

SMILES: CC(C)c1cccc(NC(=O)c2ccccc2C(=O)N2CCNC[C@]2(N)c2ccccc2)c1

BIRTHDAY: 2018-11-30T17:23:11.240291
ATC: N02C
- NERVOUS SYSTEM
- ANALGESICS
- ANTIMIGRAINE PREPARATIONS
Synthesis Plan
FORMULA:C30H44N2O2

SMILES: CN1CCN(CCCCCCCCOc2ccc(C(=O)c3ccc(C(C)(C)C)cc3)cc2)CC1

BIRTHDAY: 2018-12-02T16:06:19.387478
ATC: R06A
- RESPIRATORY SYSTEM
- ANTIHISTAMINES FOR SYSTEMIC USE
- ANTIHISTAMINES FOR SYSTEMIC USE
Synthesis Plan
FORMULA:C23H31NO3

SMILES: COc1ccc(C(=O)c2ccc(OCCCCCCCN(C)C)cc2)cc1

BIRTHDAY: 2018-12-02T16:06:19.395207
ATC: N02A
- NERVOUS SYSTEM
- ANALGESICS
- OPIOIDS
Synthesis Plan
FORMULA:C27H39NO2

SMILES: COc1ccc(CCCCCCCCN2CCC(OCc3ccccc3)CC2)cc1

BIRTHDAY: 2018-12-02T16:06:19.402835
ATC: C02K
- CARDIOVASCULAR SYSTEM
- ANTIHYPERTENSIVES
- OTHER ANTIHYPERTENSIVES
Synthesis Plan
FORMULA:C19H19F3N4O2

SMILES: N[C@@H]1CNCCN1C(=O)c1ccccc1C(=O)Nc1ccccc1C(F)(F)F

BIRTHDAY: 2018-12-02T16:06:19.413289
ATC: N06A
- NERVOUS SYSTEM
- PSYCHOANALEPTICS
- ANTIDEPRESSANTS
Synthesis Plan
FORMULA:C31H50N4O3

SMILES: CCCCCCCCCCc1cc2cc(OCCCCCCCCC(=O)NCCC(=O)NC)ccc2nn1

BIRTHDAY: 2018-12-02T16:06:19.423088
ATC: V09I
- VARIOUS
- DIAGNOSTIC RADIOPHARMACEUTICALS
- TUMOUR DETECTION
Synthesis Plan
FORMULA:C40H72O

SMILES: CCC(C)(C)C(C)(C)[C@@H](C)[C@@H](C)C(C)(C)C(C)(C)C(C)(C)C(C)(C)C(C)(C)C(C)(C)C(C)(C)C(=O)c1ccccc1

BIRTHDAY: 2018-12-02T16:06:19.440525
ATC: M04A
- MUSCULO-SKELETAL SYSTEM
- ANTIGOUT PREPARATIONS
- ANTIGOUT PREPARATIONS
Synthesis Plan
FORMULA:C32H65NO2

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

BIRTHDAY: 2018-12-02T16:06:19.465797
ATC: N05A
- NERVOUS SYSTEM
- PSYCHOLEPTICS
- ANTIPSYCHOTICS
Synthesis Plan
FORMULA:C28H28F3N3O3

SMILES: C[C@H](Oc1cccc(C(=O)Nc2ccc(C(=O)Nc3ccccc3C(F)(F)F)cc2)c1)N1CCCCC1

BIRTHDAY: 2018-12-02T16:06:19.477129
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C40H72O2

SMILES: CCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCC(=O)c1ccc(OC)cc1

BIRTHDAY: 2018-12-02T16:06:19.492053
ATC: D09A
- DERMATOLOGICALS
- MEDICATED DRESSINGS
- MEDICATED DRESSINGS
Synthesis Plan
FORMULA:C25H30N4O2

SMILES: CC1(C)C[NH2+][C@H](c2ccc(C(=O)N3CCN(C(=O)/C=C/c4ccccc4)CC3)cc2)[N-]1

BIRTHDAY: 2018-12-02T16:06:19.501453
ATC: D05B
- DERMATOLOGICALS
- ANTIPSORIATICS
- ANTIPSORIATICS FOR SYSTEMIC USE
Synthesis Plan
FORMULA:C21H22FN3O2

SMILES: O=C(Nc1ccc(C(=O)N2CCC3(CC2)CNC3)cc1)c1ccc(F)cc1

BIRTHDAY: 2018-12-02T16:06:19.510009
ATC: D01A
- DERMATOLOGICALS
- ANTIFUNGALS FOR DERMATOLOGICAL USE
- ANTIFUNGALS FOR TOPICAL USE
Synthesis Plan
FORMULA:C18H34N2O2

SMILES: CCC[C@@H]1CCCCN1C(=O)[C@H](C)NC(=O)C(C)(C)CCC

BIRTHDAY: 2018-12-02T16:06:19.525640
ATC: A16A
- ALIMENTARY TRACT AND METABOLISM
- OTHER ALIMENTARY TRACT AND METABOLISM PRODUCTS
- OTHER ALIMENTARY TRACT AND METABOLISM PRODUCTS
Synthesis Plan
FORMULA:C30H52ClN3

SMILES: Clc1ccccc1N1CCN(CCCCCCCCCCCCCCCN2CCCCC2)CC1

BIRTHDAY: 2018-12-02T16:06:19.542744
ATC: N06A
- NERVOUS SYSTEM
- PSYCHOANALEPTICS
- ANTIDEPRESSANTS
Synthesis Plan
FORMULA:C30H50N4O4S2

SMILES: C[C@H](C(C)(C)C(C)(C)C(C)(C)C(C)(C)C)[C@@]1([C@@H](O)CO)CNCc2csc(n2)-c2csc(n2)CNCC(=O)CO1

BIRTHDAY: 2018-12-03T10:42:40.966145
ATC: D08A
- DERMATOLOGICALS
- ANTISEPTICS AND DISINFECTANTS
- ANTISEPTICS AND DISINFECTANTS
Synthesis Plan
FORMULA:C36H74

SMILES: CCC(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)C(C)(C)C(C)(C)C

BIRTHDAY: 2018-12-03T10:42:40.972847
ATC: L01D
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- CYTOTOXIC ANTIBIOTICS AND RELATED SUBSTANCES
Synthesis Plan
FORMULA:C25H32ClN5O

SMILES: CN1C(=O)[C@@]2(CNCc3ccc(Cl)cc3)CCCN3CC[C@@H](CNc4cccc(c4)N12)C3

BIRTHDAY: 2018-12-03T10:42:40.982972
ATC: L01C
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- PLANT ALKALOIDS AND OTHER NATURAL PRODUCTS
Synthesis Plan
FORMULA:C26H46O3

SMILES: CCC(C)(C)C(C)(C)C(C)(C)C(C)(C)C(C)(C)c1c(OC)ccc(OC)c1OC

BIRTHDAY: 2018-12-03T10:42:40.990366
ATC: L01D
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- CYTOTOXIC ANTIBIOTICS AND RELATED SUBSTANCES
Synthesis Plan
FORMULA:C37H75NO2

SMILES: CCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCC(=O)NCCO

BIRTHDAY: 2018-12-03T10:42:40.998636
ATC: S01A
- SENSORY ORGANS
- OPHTHALMOLOGICALS
- ANTIINFECTIVES
Synthesis Plan
FORMULA:C29H41N5O2

SMILES: CN(C)C1=C[C@H](N2CCc3cn(cn3)CCCCOc3cccc(c3)[C@@H]2C(C)(C)C)N2CC[C@H]1C2=O

BIRTHDAY: 2018-12-03T10:42:41.009489
ATC: C08D
- CARDIOVASCULAR SYSTEM
- CALCIUM CHANNEL BLOCKERS
- SELECTIVE CALCIUM CHANNEL BLOCKERS WITH DIRECT CARDIAC EFFECTS
Synthesis Plan
FORMULA:C29H47N5O3

SMILES: CC(C)C(C)(C)C(=O)N[C@H](C)C(=O)N1CCCC[C@@H]1C(=O)NC(C)(C)N1CCN(c2ccccc2)CC1

BIRTHDAY: 2018-12-03T10:42:41.019890
ATC: R07A
- RESPIRATORY SYSTEM
- OTHER RESPIRATORY SYSTEM PRODUCTS
- OTHER RESPIRATORY SYSTEM PRODUCTS
Synthesis Plan
FORMULA:C30H35N3O3

SMILES: CC(C)(Oc1ccccc1C(=O)c1ccccc1C(=O)c1ccccc1)C(C)(C)N1CCN[C@H](N)C1

BIRTHDAY: 2018-12-03T10:42:41.030041
ATC: N06A
- NERVOUS SYSTEM
- PSYCHOANALEPTICS
- ANTIDEPRESSANTS
Synthesis Plan
FORMULA:C20H29NO2

SMILES: CCCC12C[C@@H]3CC4(C=CC=C[C@H]4N1)C[C@H](C2)C3C(=O)OCC

BIRTHDAY: 2018-12-03T10:42:41.047912
ATC: A11D
- ALIMENTARY TRACT AND METABOLISM
- VITAMINS
- VITAMIN B1, PLAIN AND IN COMBINATION WITH VITAMIN B6 AND B12
Synthesis Plan
FORMULA:C29H61N

SMILES: CC(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)N(C)C

BIRTHDAY: 2018-12-03T10:42:41.064250
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:C26H38N4O2

SMILES: C[C@@H](Oc1ccccc1C(=O)c1cccc(C(C)(C)C)c1)C(C)(C)[C@@]1(N)CNC[C@@H](N)N1

BIRTHDAY: 2018-12-03T10:42:41.098303
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:C27H30N4O2

SMILES: CC(C)c1cccc(NC(=O)c2cccc(C(=O)N3CCN[C@@](N)(c4ccccc4)C3)c2)c1

BIRTHDAY: 2018-12-03T10:42:41.107927
ATC: L01B
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- ANTIMETABOLITES
Synthesis Plan
FORMULA:C42H61N3O2

SMILES: CCCCCCCCCCCCCCCCCCCCc1ccc2cc1COCC=CCOCc1cccc(c1)-c1ccnc(n1)N2

BIRTHDAY: 2018-12-03T19:11:06.014195
ATC: J01F
- ANTIINFECTIVES FOR SYSTEMIC USE
- ANTIBACTERIALS FOR SYSTEMIC USE
- MACROLIDES, LINCOSAMIDES AND STREPTOGRAMINS
Synthesis Plan
FORMULA:C22H32N2O2

SMILES: COc1ccccc1[C@@]12CN3CN(C[C@@](C(C)(C)C(C)(C)C)(C3)C1)C2=O

BIRTHDAY: 2018-12-03T19:11:06.023037
ATC: B03A
- BLOOD AND BLOOD FORMING ORGANS
- ANTIANEMIC PREPARATIONS
- IRON PREPARATIONS
Synthesis Plan
FORMULA:C38H77NO2

SMILES: CCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCC(=O)NCCO

BIRTHDAY: 2018-12-03T19:11:06.040781
ATC: S01A
- SENSORY ORGANS
- OPHTHALMOLOGICALS
- ANTIINFECTIVES
Synthesis Plan
FORMULA:C28H26ClFN4O2

SMILES: N[C@@H]1CN(C(=O)c2ccccc2[C@H]2C=C(c3cccc(Cl)c3)C(=O)N2Cc2cccc(F)c2)CCN1

BIRTHDAY: 2018-12-03T19:11:06.051840
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C23H37N3O2

SMILES: CCCC(CCC)C(=O)Nc1ccc(C(=O)NCCCN2CCCCC2)cc1

BIRTHDAY: 2018-12-03T19:11:06.059796
ATC: N06A
- NERVOUS SYSTEM
- PSYCHOANALEPTICS
- ANTIDEPRESSANTS
Synthesis Plan
FORMULA:C48H88N2O3

SMILES: CC(C)[C@@H](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(C)(C)[C@H]1CC(=O)NCCc2ccc(N)c(c2)OCC[C@H](C)CO1

BIRTHDAY: 2018-12-03T19:11:06.080289
ATC: A02B
- ALIMENTARY TRACT AND METABOLISM
- DRUGS FOR ACID RELATED DISORDERS
- DRUGS FOR PEPTIC ULCER AND GASTRO-OESOPHAGEAL REFLUX DISEASE (GORD)
Synthesis Plan
FORMULA:C26H46O3

SMILES: CCCCCCCCCCCCCCCCCc1cc(OC)c(OC)c(OC)c1

BIRTHDAY: 2018-12-03T19:11:06.094117
ATC: A01A
- ALIMENTARY TRACT AND METABOLISM
- STOMATOLOGICAL PREPARATIONS
- STOMATOLOGICAL PREPARATIONS
Synthesis Plan
FORMULA:C28H32N4O2

SMILES: O=C(Nc1cccc(C2CCN(Cc3ccccc3)CC2)c1)c1ccc(N2CCOCC2)nc1

BIRTHDAY: 2018-12-03T19:11:06.103782
ATC: N04B
- NERVOUS SYSTEM
- ANTI-PARKINSON DRUGS
- DOPAMINERGIC AGENTS
Synthesis Plan
FORMULA:C35H71NO2

SMILES: CCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCC(=O)NCCO

BIRTHDAY: 2018-12-03T19:11:06.111834
ATC: S01A
- SENSORY ORGANS
- OPHTHALMOLOGICALS
- ANTIINFECTIVES
Synthesis Plan
FORMULA:C23H33ClN2O2

SMILES: CC(C)(N1CCN(c2ccccc2Cl)CC1)[C@]1(C)C=CCOC2(CCCC2)O1

BIRTHDAY: 2018-12-03T19:11:06.120217
ATC: L02B
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ENDOCRINE THERAPY
- HORMONE ANTAGONISTS AND RELATED AGENTS
Synthesis Plan
FORMULA:C27H43N3O

SMILES: CC(C)C(C)(C)C(=O)Nc1ccccc1[C@]1(N2CCC[C@@H]3CCC[C@H]2C3)CCCCN1

BIRTHDAY: 2018-12-03T19:11:06.137533
ATC: M04A
- MUSCULO-SKELETAL SYSTEM
- ANTIGOUT PREPARATIONS
- ANTIGOUT PREPARATIONS
Synthesis Plan
FORMULA:C25H23F3N4O2

SMILES: N[C@]1(c2ccccc2)CNCCN1C(=O)c1ccccc1C(=O)Nc1ccccc1C(F)(F)F

BIRTHDAY: 2018-12-03T19:11:06.148756
ATC: N02B
- NERVOUS SYSTEM
- ANALGESICS
- OTHER ANALGESICS AND ANTIPYRETICS
Synthesis Plan
FORMULA:C40H72O

SMILES: CC[C@H](C)[C@H](C)[C@H](C)[C@H](C)[C@H](C)[C@H](C)[C@H](C)[C@H](C)CCCCC(C)(C)C(C)(C)C(C)(C)CCC(=O)c1ccccc1

BIRTHDAY: 2018-12-03T19:11:06.157927
ATC: P01B
- ANTIPARASITIC PRODUCTS, INSECTICIDES AND REPELLENTS
- ANTIPROTOZOALS
- ANTIMALARIALS
Synthesis Plan
FORMULA:C36H68

SMILES: CC1(C)[C@@H]2C=C[C@@H](CC2)C[C@H]1C(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: 2018-12-01T22:30:10.880951
ATC: J05A
- ANTIINFECTIVES FOR SYSTEMIC USE
- ANTIVIRALS FOR SYSTEMIC USE
- DIRECT ACTING ANTIVIRALS
Synthesis Plan
FORMULA:C25H38N2O2

SMILES: CN(C)C(C)(C)C(C)(C)C[C@]12CCN3C[C@H]1CC[C@]2(C(=O)c1ccccc1O)C3

BIRTHDAY: 2018-12-01T22:30:10.905869
ATC: C05C
- CARDIOVASCULAR SYSTEM
- VASOPROTECTIVES
- CAPILLARY STABILIZING AGENTS
Synthesis Plan
FORMULA:C40H60N4O3

SMILES: CCCCCCCCCCCCCCCCCCCCc1cc(O)c2cc1Nc1nccc(n1)-c1ccc(o1)COCC=CCNC2

BIRTHDAY: 2018-12-01T22:30:10.934690
ATC: L01B
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- ANTIMETABOLITES
Synthesis Plan
FORMULA:C30H49N5O

SMILES: CC(C)([C@]12CCCC=C1CNCCNCCC(=O)CCCCC2)[C@]1(N)CNCCN1c1ccccc1

BIRTHDAY: 2018-12-01T22:30:10.955077
ATC: A03A
- ALIMENTARY TRACT AND METABOLISM
- DRUGS FOR FUNCTIONAL GASTROINTESTINAL DISORDERS
- DRUGS FOR FUNCTIONAL GASTROINTESTINAL DISORDERS
Synthesis Plan
FORMULA:C25H36N4O

SMILES: CC(C)[C@@H](c1ccccc1)C(C)(C)[C@@]1(N)CCNC[C@H]1N1C(=O)N[C@@H]2C=CC=C[C@@H]21

BIRTHDAY: 2018-12-01T22:30:10.972802
ATC: C01C
- CARDIOVASCULAR SYSTEM
- CARDIAC THERAPY
- CARDIAC STIMULANTS EXCL. CARDIAC GLYCOSIDES
Synthesis Plan
FORMULA:C31H53NO2

SMILES: CCCCCCCCCCCCCCCc1ccc2c(C(=O)OC)c1CCCCCCNCC2

BIRTHDAY: 2018-12-01T22:30:10.980748
ATC: D11A
- DERMATOLOGICALS
- OTHER DERMATOLOGICAL PREPARATIONS
- OTHER DERMATOLOGICAL PREPARATIONS
Synthesis Plan
FORMULA:C28H30N4O2

SMILES: CN1CCN(C(=O)c2ccc(C(=O)Nc3ccc(C4=N[C@@H]5C[C@H]6C=C[C@H]5[C@@H]4C6)cc3)cc2)CC1

BIRTHDAY: 2018-12-01T22:30:10.998780
ATC: J05A
- ANTIINFECTIVES FOR SYSTEMIC USE
- ANTIVIRALS FOR SYSTEMIC USE
- DIRECT ACTING ANTIVIRALS
Synthesis Plan