matter.farm

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

These compounds may interact with:

Gamma-aminobutyric acid receptor subunit alpha-6

Potentially involved in: breast cancer; doid:2627; kidney cancer; carcinoma; alcohol dependence; canavan disease; epilepsy; heroin dependence; alcoholic intoxication, chronic; mental depression; depressive disorder; schizophrenia; mood disorders; infarction, middle cerebral artery; ependymoma; subependymal giant cell astrocytoma; general anesthesia; benzodiazepine toxicity; insomnia; tonic-clonic epilepsy

Disease data sourced from Pharos.

Antagonist

FORMULA:C24H23FN4O4

SMILES: CN1Cc2c(C(=O)OC(C)(C)C)ncn2-c2ccc(NC(=O)c3ccc(F)cc3)cc2C1=O

BIRTHDAY: 2018-12-01T14:11:45.089738
ATC: N02C
- NERVOUS SYSTEM
- ANALGESICS
- ANTIMIGRAINE PREPARATIONS
Synthesis Plan
FORMULA:C19H13FN2O2

SMILES: COc1ccccc1C(=O)c1cncc2c1[nH]c1cc(F)ccc12

BIRTHDAY: 2018-12-01T14:11:45.097843
ATC: M01A
- MUSCULO-SKELETAL SYSTEM
- ANTIINFLAMMATORY AND ANTIRHEUMATIC PRODUCTS
- ANTIINFLAMMATORY AND ANTIRHEUMATIC PRODUCTS, NON-STEROIDS
Synthesis Plan
FORMULA:C19H18N2O2

SMILES: C#Cc1ccc2[nH]c3cnc(C(=O)OC(C)(C)CC)cc3c2c1

BIRTHDAY: 2018-12-01T14:11:45.105364
ATC: C10A
- CARDIOVASCULAR SYSTEM
- LIPID MODIFYING AGENTS
- LIPID MODIFYING AGENTS, PLAIN
Synthesis Plan
FORMULA:C21H17FN4O2

SMILES: COc1cccc(C(=O)c2c(N)cnc3c2ncn3Cc2ccccc2F)c1

BIRTHDAY: 2018-12-01T14:11:45.114420
ATC: C02A
- CARDIOVASCULAR SYSTEM
- ANTIHYPERTENSIVES
- ANTIADRENERGIC AGENTS, CENTRALLY ACTING
Synthesis Plan
FORMULA:C20H21N3O4

SMILES: CCOC(=O)c1ncn2c1CN(C)C(=O)c1cc(C#CC(C)(C)O)ccc1-2

BIRTHDAY: 2018-12-01T14:11:45.140911
ATC: C01C
- CARDIOVASCULAR SYSTEM
- CARDIAC THERAPY
- CARDIAC STIMULANTS EXCL. CARDIAC GLYCOSIDES
Synthesis Plan
FORMULA:C22H13F6NO2

SMILES: O=C(Nc1ccccc1C(F)(F)F)c1ccccc1C(=O)c1cccc(C(F)(F)F)c1

BIRTHDAY: 2018-12-01T14:11:45.151564
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C19H18N2O2

SMILES: C#Cc1ccc2c(c1)[nH]c1c(C(=O)OC(C)(C)CC)cncc12

BIRTHDAY: 2018-12-01T14:11:45.159121
ATC: C10A
- CARDIOVASCULAR SYSTEM
- LIPID MODIFYING AGENTS
- LIPID MODIFYING AGENTS, PLAIN
Synthesis Plan
FORMULA:C19H14F3N3O

SMILES: O=C(c1ccncc1NCc1ccccn1)c1ccccc1C(F)(F)F

BIRTHDAY: 2018-12-01T14:11:45.175863
ATC: C03C
- CARDIOVASCULAR SYSTEM
- DIURETICS
- HIGH-CEILING DIURETICS
Synthesis Plan
FORMULA:C21H22N2O5

SMILES: COc1ccc(C(=O)c2cncc(C(=O)OC3CCN(C(C)=O)CC3)c2)cc1

BIRTHDAY: 2018-12-01T14:11:45.184597
ATC: N06D
- NERVOUS SYSTEM
- PSYCHOANALEPTICS
- ANTI-DEMENTIA DRUGS
Synthesis Plan
FORMULA:C22H26ClN3O4

SMILES: N[C@@H](c1ccccc1)N1c2c(Cl)cccc2C=N[C@@H]2OCCOCCOCCO[C@H]21

BIRTHDAY: 2018-12-01T14:11:45.211620
ATC: N06A
- NERVOUS SYSTEM
- PSYCHOANALEPTICS
- ANTIDEPRESSANTS
Synthesis Plan
FORMULA:C21H17FN4O2

SMILES: COc1ccccc1C(=O)c1cnc(N)c2ncn(Cc3ccc(F)cc3)c12

BIRTHDAY: 2018-12-01T14:11:45.231536
ATC: C08E
- CARDIOVASCULAR SYSTEM
- CALCIUM CHANNEL BLOCKERS
- NON-SELECTIVE CALCIUM CHANNEL BLOCKERS
Synthesis Plan
FORMULA:C21H17FN4O2

SMILES: COc1cccc(C(=O)c2c(N)cnc3c2ncn3Cc2cccc(F)c2)c1

BIRTHDAY: 2018-12-01T14:11:45.240603
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C14H14F3N5O3

SMILES: CCOC(=O)c1nc2c([nH]1)N[C@]1(C(F)(F)F)C=CC=C[C@]1(N)NC2=O

BIRTHDAY: 2018-12-01T14:11:45.250819
ATC: J05A
- ANTIINFECTIVES FOR SYSTEMIC USE
- ANTIVIRALS FOR SYSTEMIC USE
- DIRECT ACTING ANTIVIRALS
Synthesis Plan
FORMULA:C19H13FN2O2

SMILES: COc1ccc(C(=O)c2cc3c(cn2)[nH]c2ccc(F)cc23)cc1

BIRTHDAY: 2018-12-01T14:11:45.258827
ATC: A02B
- ALIMENTARY TRACT AND METABOLISM
- DRUGS FOR ACID RELATED DISORDERS
- DRUGS FOR PEPTIC ULCER AND GASTRO-OESOPHAGEAL REFLUX DISEASE (GORD)
Synthesis Plan
FORMULA:C16H22O4

SMILES: CCOC(=O)c1c(C[C@H](C)CC)cccc1C(=O)OC

BIRTHDAY: 2018-12-25T02:03:46.789398
ATC: D01A
- DERMATOLOGICALS
- ANTIFUNGALS FOR DERMATOLOGICAL USE
- ANTIFUNGALS FOR TOPICAL USE
Synthesis Plan
FORMULA:C13H16O3

SMILES: CC[C@H](C)C(=O)c1ccc(C(=O)OC)cc1

BIRTHDAY: 2018-12-25T02:03:46.795809
ATC: D01A
- DERMATOLOGICALS
- ANTIFUNGALS FOR DERMATOLOGICAL USE
- ANTIFUNGALS FOR TOPICAL USE
Synthesis Plan
FORMULA:C20H15BrN6O

SMILES: O=C1C(c2ccccc2)=CC2=N[C@@H]3CNc4cccc(Br)c4N4N=CN[C@]34N12

BIRTHDAY: 2018-12-25T02:03:46.805825
ATC: D01A
- DERMATOLOGICALS
- ANTIFUNGALS FOR DERMATOLOGICAL USE
- ANTIFUNGALS FOR TOPICAL USE
Synthesis Plan
FORMULA:C17H17FN2O2

SMILES: CCC(C)(C)OC(=O)c1cncc2c1[nH]c1cc(F)ccc12

BIRTHDAY: 2018-12-25T02:03:46.813622
ATC: C10A
- CARDIOVASCULAR SYSTEM
- LIPID MODIFYING AGENTS
- LIPID MODIFYING AGENTS, PLAIN
Synthesis Plan
FORMULA:C20H18ClN3

SMILES: N[C@H](c1ccccc1)N1c2cccc(Cl)c2C=N[C@H]2C=CC=C[C@H]21

BIRTHDAY: 2018-12-25T02:03:46.821903
ATC: N06B
- NERVOUS SYSTEM
- PSYCHOANALEPTICS
- PSYCHOSTIMULANTS, AGENTS USED FOR ADHD AND NOOTROPICS
Synthesis Plan
FORMULA:C20H23NO2

SMILES: COc1ccc(C(=O)c2cnc3c(c2C(C)C)CCCC3)cc1

BIRTHDAY: 2018-12-25T02:03:46.829122
ATC: C02K
- CARDIOVASCULAR SYSTEM
- ANTIHYPERTENSIVES
- OTHER ANTIHYPERTENSIVES
Synthesis Plan
FORMULA:C20H22O3

SMILES: CCC(C)(C)c1ccc(C(=O)c2ccc(C(=O)OC)cc2)cc1

BIRTHDAY: 2018-12-25T02:03:46.836016
ATC: C02K
- CARDIOVASCULAR SYSTEM
- ANTIHYPERTENSIVES
- OTHER ANTIHYPERTENSIVES
Synthesis Plan
FORMULA:C18H21N5O4

SMILES: CCOC(=O)c1nc2c([nH]1)N[C@]1(N)C=CC=C(C#CC(C)(C)O)[C@@H]1NC2=O

BIRTHDAY: 2018-12-25T02:03:46.853713
ATC: V09A
- VARIOUS
- DIAGNOSTIC RADIOPHARMACEUTICALS
- CENTRAL NERVOUS SYSTEM
Synthesis Plan
FORMULA:C14H14F3N5O3

SMILES: CCOC(=O)c1nc2c([nH]1)N[C@]1(N)C=CC(C(F)(F)F)=C[C@H]1NC2=O

BIRTHDAY: 2018-12-25T02:03:46.882889
ATC: J05A
- ANTIINFECTIVES FOR SYSTEMIC USE
- ANTIVIRALS FOR SYSTEMIC USE
- DIRECT ACTING ANTIVIRALS
Synthesis Plan
FORMULA:C16H21ClN4O

SMILES: CCC(C)(C)c1cnc2n1C(=O)[C@@]1(N)C=CC=C[C@@]1(Cl)NC2

BIRTHDAY: 2018-12-25T02:03:46.899492
ATC: J05A
- ANTIINFECTIVES FOR SYSTEMIC USE
- ANTIVIRALS FOR SYSTEMIC USE
- DIRECT ACTING ANTIVIRALS
Synthesis Plan
FORMULA:C15H17N5O5

SMILES: CCOC(=O)c1nc2c([nH]1)N[C@]1(N)C=CC=C(C(=O)OC)[C@H]1NC2=O

BIRTHDAY: 2018-12-25T02:03:46.909647
ATC: C08C
- CARDIOVASCULAR SYSTEM
- CALCIUM CHANNEL BLOCKERS
- SELECTIVE CALCIUM CHANNEL BLOCKERS WITH MAINLY VASCULAR EFFECTS
Synthesis Plan
FORMULA:C23H20ClN3O4

SMILES: COc1cc(OC)cc(C(=O)c2nc3c(n2C)C=CN[C@@H]3C(=O)c2cccc(Cl)c2)c1

BIRTHDAY: 2018-12-25T02:03:46.920423
ATC: N02C
- NERVOUS SYSTEM
- ANALGESICS
- ANTIMIGRAINE PREPARATIONS
Synthesis Plan
FORMULA:C22H26N2O3

SMILES: COc1ccccc1C(=O)c1c(NC(C)C)cnc2c1CC(=O)CC2(C)C

BIRTHDAY: 2018-12-25T02:03:46.929755
ATC: A02B
- ALIMENTARY TRACT AND METABOLISM
- DRUGS FOR ACID RELATED DISORDERS
- DRUGS FOR PEPTIC ULCER AND GASTRO-OESOPHAGEAL REFLUX DISEASE (GORD)
Synthesis Plan
FORMULA:C17H17F3N6

SMILES: FC(F)(F)c1cccc2c1C(c1cnn(C3CCNCC3)c1)=NC=NN2

BIRTHDAY: 2018-12-03T02:39:53.043590
ATC: A03A
- ALIMENTARY TRACT AND METABOLISM
- DRUGS FOR FUNCTIONAL GASTROINTESTINAL DISORDERS
- DRUGS FOR FUNCTIONAL GASTROINTESTINAL DISORDERS
Synthesis Plan
FORMULA:C25H28N2

SMILES: CC[C@@H](C)CCCc1c2nc3ccccc3c-2ccn1Cc1ccccc1

BIRTHDAY: 2018-12-03T02:39:53.051637
ATC: R05D
- RESPIRATORY SYSTEM
- COUGH AND COLD PREPARATIONS
- COUGH SUPPRESSANTS, EXCL. COMBINATIONS WITH EXPECTORANTS
Synthesis Plan
FORMULA:C15H20ClN5O

SMILES: CCC(C)(C)c1nc2c([nH]1)N[C@@]1(N)C=CC(Cl)=C[C@H]1NC2=O

BIRTHDAY: 2018-12-03T02:39:53.060098
ATC: J05A
- ANTIINFECTIVES FOR SYSTEMIC USE
- ANTIVIRALS FOR SYSTEMIC USE
- DIRECT ACTING ANTIVIRALS
Synthesis Plan
FORMULA:C23H27N3O3

SMILES: CC[C@@H](C)CC(=O)Oc1cccc2c1[C@](N)(c1ccccc1)N[C@]21NCCC1=O

BIRTHDAY: 2018-12-03T02:39:53.069821
ATC: N06A
- NERVOUS SYSTEM
- PSYCHOANALEPTICS
- ANTIDEPRESSANTS
Synthesis Plan
FORMULA:C19H20F2N4O4

SMILES: CN1Cc2c(C(=O)OC(C)(C)C)ncn2-c2ccc(NC(=O)C(F)F)cc2C1=O

BIRTHDAY: 2018-12-03T02:39:53.079784
ATC: C01C
- CARDIOVASCULAR SYSTEM
- CARDIAC THERAPY
- CARDIAC STIMULANTS EXCL. CARDIAC GLYCOSIDES
Synthesis Plan
FORMULA:C5H10OSe

SMILES: CC(C)(C)OC=[Se]

BIRTHDAY: 2018-12-03T02:39:53.092032
ATC: M05B
- MUSCULO-SKELETAL SYSTEM
- DRUGS FOR TREATMENT OF BONE DISEASES
- DRUGS AFFECTING BONE STRUCTURE AND MINERALIZATION
Synthesis Plan
FORMULA:C22H23FN2O

SMILES: CC[C@H](C)Cc1ccc(C(=O)c2nc(-c3ccc(F)cc3)cn2C)cc1

BIRTHDAY: 2018-12-03T02:39:53.099810
ATC: N05A
- NERVOUS SYSTEM
- PSYCHOLEPTICS
- ANTIPSYCHOTICS
Synthesis Plan
FORMULA:C20H20N2O4

SMILES: Cc1ccccc1-c1cc(O)ccc1-c1nc(C(=O)OC(C)(C)C)[n-][o+]1

BIRTHDAY: 2018-12-03T02:39:53.108328
ATC: B03B
- BLOOD AND BLOOD FORMING ORGANS
- ANTIANEMIC PREPARATIONS
- VITAMIN B12 AND FOLIC ACID
Synthesis Plan
FORMULA:C19H25N5O3Si

SMILES: CCOC(=O)c1nc2c([nH]1)N[C@]1(N)C=CC(C#CC[Si](C)(C)C)=C[C@@H]1NC2=O

BIRTHDAY: 2018-12-03T02:39:53.117854
ATC: J01D
- ANTIINFECTIVES FOR SYSTEMIC USE
- ANTIBACTERIALS FOR SYSTEMIC USE
- OTHER BETA-LACTAM ANTIBACTERIALS
Synthesis Plan
FORMULA:C35H44N4O6

SMILES: COc1ccccc1[C@]1([C@H](C)CC(=O)N[C@H](C(=O)NC(=O)[C@@]23C=CC=C[C@H]2ONN3)c2ccccc2)CCCCCCCOC1

BIRTHDAY: 2018-12-03T02:39:53.132929
ATC: C03C
- CARDIOVASCULAR SYSTEM
- DIURETICS
- HIGH-CEILING DIURETICS
Synthesis Plan
FORMULA:C18H12ClN5

SMILES: Clc1ccc2c(c1)-c1nncn1Cc1c(-c3ccccc3)ncn1-2

BIRTHDAY: 2018-12-03T02:39:53.141516
ATC: N06A
- NERVOUS SYSTEM
- PSYCHOANALEPTICS
- ANTIDEPRESSANTS
Synthesis Plan
FORMULA:C21H31NO8

SMILES: CCOC(=O)C1=C(C(=O)OC)C(C(=O)OC)(C(=O)OC)C=C(C(C)(C)[C@H](C)CC)N1

BIRTHDAY: 2018-12-03T02:39:53.176735
ATC: B03B
- BLOOD AND BLOOD FORMING ORGANS
- ANTIANEMIC PREPARATIONS
- VITAMIN B12 AND FOLIC ACID
Synthesis Plan
FORMULA:C21H24N2O2Si

SMILES: CC(C)(C)OC(=O)c1ccnc2[nH]c3cc(C#C[Si](C)(C)C)ccc3c12

BIRTHDAY: 2018-12-03T02:39:53.184824
ATC: G01A
- GENITO URINARY SYSTEM AND SEX HORMONES
- GYNECOLOGICAL ANTIINFECTIVES AND ANTISEPTICS
- ANTIINFECTIVES AND ANTISEPTICS, EXCL. COMBINATIONS WITH CORTICOSTEROIDS
Synthesis Plan
FORMULA:C19H13FN2O2

SMILES: COc1cccc(C(=O)c2ccnc3[nH]c4cc(F)ccc4c23)c1

BIRTHDAY: 2018-12-03T02:39:53.201717
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C37H33F3N6O3

SMILES: N[C@]12C=CC=C(C(=O)c3ccccc3C(F)(F)F)[C@@H]1NCC(=O)[C@@]13N=C(C=CN12)c1cccc(c1)OCCC=CCNc1cccc(c1)N3

BIRTHDAY: 2018-11-30T03:41:48.742853
ATC: C09D
- CARDIOVASCULAR SYSTEM
- AGENTS ACTING ON THE RENIN-ANGIOTENSIN SYSTEM
- ANGIOTENSIN II ANTAGONISTS, COMBINATIONS
Synthesis plan pending
FORMULA:C16H22O3

SMILES: CCC(=O)c1cccc(C(=O)OC)c1C(C)(C)CC

BIRTHDAY: 2018-11-30T03:41:48.749455
ATC: L01C
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- PLANT ALKALOIDS AND OTHER NATURAL PRODUCTS
Synthesis plan pending
FORMULA:C17H18N2O2

SMILES: CCC(C)(C)OC(=O)c1cncc2c1[nH]c1ccccc12

BIRTHDAY: 2018-11-30T03:41:48.778430
ATC: L01C
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- PLANT ALKALOIDS AND OTHER NATURAL PRODUCTS
Synthesis plan pending
FORMULA:C32H32N6O2

SMILES: C[C@@]1(N2CCOCC2)C=CCNCc2cccc(c2)Nc2nccc(n2)-c2cc(c3ccc(C#N)cc3c2)OC1

BIRTHDAY: 2018-11-30T03:41:48.790429
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis plan pending
FORMULA:C19H25N5O3Si

SMILES: CCOC(=O)c1nc2c([nH]1)N[C@@]1(N)C=CC(C#CC[Si](C)(C)C)=C[C@H]1NC2=O

BIRTHDAY: 2018-11-30T03:41:48.800126
ATC: J01D
- ANTIINFECTIVES FOR SYSTEMIC USE
- ANTIBACTERIALS FOR SYSTEMIC USE
- OTHER BETA-LACTAM ANTIBACTERIALS
Synthesis plan pending
FORMULA:C19H13FN2O2

SMILES: COc1ccccc1C(=O)c1ccnc2[nH]c3cc(F)ccc3c12

BIRTHDAY: 2018-11-30T03:41:48.808642
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis plan pending
FORMULA:C19H25N5O3Si

SMILES: CCOC(=O)c1nc2c([nH]1)N[C@]1(N)C=CC=C(C#CC[Si](C)(C)C)[C@@H]1NC2=O

BIRTHDAY: 2018-11-30T03:41:48.818390
ATC: A10B
- ALIMENTARY TRACT AND METABOLISM
- DRUGS USED IN DIABETES
- BLOOD GLUCOSE LOWERING DRUGS, EXCL. INSULINS
Synthesis plan pending
FORMULA:C18H21N5O4

SMILES: CCOC(=O)c1nc2c([nH]1)N[C@]1(N)C=CC(C#CC(C)(C)O)=C[C@H]1NC2=O

BIRTHDAY: 2018-11-30T03:41:48.827927
ATC: J05A
- ANTIINFECTIVES FOR SYSTEMIC USE
- ANTIVIRALS FOR SYSTEMIC USE
- DIRECT ACTING ANTIVIRALS
Synthesis plan pending
FORMULA:C20H16ClN3

SMILES: Clc1ccc2c(c1)C(NCc1ccccc1)=Nc1ccccc1N2

BIRTHDAY: 2018-11-30T03:41:48.836058
ATC: A03F
- ALIMENTARY TRACT AND METABOLISM
- DRUGS FOR FUNCTIONAL GASTROINTESTINAL DISORDERS
- PROPULSIVES
Synthesis plan pending
FORMULA:C19H24FN5O

SMILES: C[C@H]1[C@H]2CC[C@@H](CN1c1nc3n(n1)CC(C)(C)Nc1ccc(F)cc1-3)O2

BIRTHDAY: 2018-11-30T03:41:48.845573
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis plan pending
FORMULA:C15H20ClN5O

SMILES: CCC(C)(C)c1nc2c([nH]1)N[C@@]1(N)C=CC=C(Cl)[C@@H]1NC2=O

BIRTHDAY: 2018-11-30T03:41:48.854029
ATC: A10B
- ALIMENTARY TRACT AND METABOLISM
- DRUGS USED IN DIABETES
- BLOOD GLUCOSE LOWERING DRUGS, EXCL. INSULINS
Synthesis plan pending
FORMULA:C17H15F3O5

SMILES: COc1ccc(OC)c(C(=O)c2ccccc2OC(F)(F)F)c1OC

BIRTHDAY: 2018-11-30T03:41:48.878607
ATC: C08E
- CARDIOVASCULAR SYSTEM
- CALCIUM CHANNEL BLOCKERS
- NON-SELECTIVE CALCIUM CHANNEL BLOCKERS
Synthesis plan pending
FORMULA:C21H24N2O5

SMILES: CC[C@@H](C)CC(=O)Oc1ccc2c(c1)C(=O)C1=C(C(=O)OC)C(C)=N[C@@H](C)N12

BIRTHDAY: 2018-11-30T03:41:48.896058
ATC: M04A
- MUSCULO-SKELETAL SYSTEM
- ANTIGOUT PREPARATIONS
- ANTIGOUT PREPARATIONS
Synthesis plan pending
FORMULA:C17H17N3O5

SMILES: CCOC(=O)c1ncc2n1-c1ccc(C(=O)OC)cc1CN(C)C2=O

BIRTHDAY: 2018-11-19T08:15:21.979442
ATC: C01B
- CARDIOVASCULAR SYSTEM
- CARDIAC THERAPY
- ANTIARRHYTHMICS, CLASS I AND III
Synthesis plan pending
FORMULA:C17H18N2O2

SMILES: CCC(C)(C)OC(=O)c1ccnc2[nH]c3ccccc3c12

BIRTHDAY: 2018-11-19T08:15:21.987167
ATC: C10A
- CARDIOVASCULAR SYSTEM
- LIPID MODIFYING AGENTS
- LIPID MODIFYING AGENTS, PLAIN
Synthesis plan pending
FORMULA:C23H22N6O4

SMILES: CCOC(=O)c1nc2c([nH]1)C(=O)N[C@@H]1C=C(C#C[C@@]34C=CC=C[C@H]3OC=CN4)C=C[C@]1(N)N2

BIRTHDAY: 2018-11-19T08:15:21.998071
ATC: D08A
- DERMATOLOGICALS
- ANTISEPTICS AND DISINFECTANTS
- ANTISEPTICS AND DISINFECTANTS
Synthesis plan pending
FORMULA:C21H28N2O4

SMILES: CC[C@@H](C)C(C)(C)C1=C[C@]2(C=C(C(=O)OC)N1)N=CC1=C2C(O)(O)CC=C1

BIRTHDAY: 2018-11-19T08:15:22.007081
ATC: C10A
- CARDIOVASCULAR SYSTEM
- LIPID MODIFYING AGENTS
- LIPID MODIFYING AGENTS, PLAIN
Synthesis plan pending
FORMULA:C17H17N3O5

SMILES: CCOC(=O)c1ncn2c1CN(C)C(=O)c1cc(C(=O)OC)ccc1-2

BIRTHDAY: 2018-11-19T08:15:22.016003
ATC: J01F
- ANTIINFECTIVES FOR SYSTEMIC USE
- ANTIBACTERIALS FOR SYSTEMIC USE
- MACROLIDES, LINCOSAMIDES AND STREPTOGRAMINS
Synthesis plan pending
FORMULA:C17H17FN2O2

SMILES: CCC(C)(C)OC(=O)c1cc2c(cn1)[nH]c1ccc(F)cc12

BIRTHDAY: 2018-11-19T08:15:22.023657
ATC: C10A
- CARDIOVASCULAR SYSTEM
- LIPID MODIFYING AGENTS
- LIPID MODIFYING AGENTS, PLAIN
Synthesis plan pending
FORMULA:C20H22O3

SMILES: CCC(C)(C)c1ccccc1C(=O)c1cccc(C(=O)OC)c1

BIRTHDAY: 2018-11-19T08:15:22.030978
ATC: P03B
- ANTIPARASITIC PRODUCTS, INSECTICIDES AND REPELLENTS
- ECTOPARASITICIDES, INCL. SCABICIDES, INSECTICIDES AND REPELLENTS
- INSECTICIDES AND REPELLENTS
Synthesis plan pending
FORMULA:C21H26ClN3O3

SMILES: CC[C@@H](C)CCCCOC(=O)c1ncn2c1CN(C)C(=O)c1cc(Cl)ccc1-2

BIRTHDAY: 2018-11-19T08:15:22.047306
ATC: S01E
- SENSORY ORGANS
- OPHTHALMOLOGICALS
- ANTIGLAUCOMA PREPARATIONS AND MIOTICS
Synthesis plan pending
FORMULA:C26H46N8O3

SMILES: CC[C@H](C)C(C)(C)COC(=O)c1cnc2n1[C@H]1C[C@H]3CNCCNCCNCCN[C@@]1(C3)N[C@H](N)C2=O

BIRTHDAY: 2018-11-19T08:15:22.059012
ATC: J05A
- ANTIINFECTIVES FOR SYSTEMIC USE
- ANTIVIRALS FOR SYSTEMIC USE
- DIRECT ACTING ANTIVIRALS
Synthesis plan pending
FORMULA:C21H17N3O2

SMILES: COc1ccccc1C(=O)c1nc2[nH]cc(-c3ccccc3)c2cc1N

BIRTHDAY: 2018-11-19T08:15:22.067338
ATC: A02B
- ALIMENTARY TRACT AND METABOLISM
- DRUGS FOR ACID RELATED DISORDERS
- DRUGS FOR PEPTIC ULCER AND GASTRO-OESOPHAGEAL REFLUX DISEASE (GORD)
Synthesis plan pending
FORMULA:C22H25FN6O4

SMILES: CC(C)(C)OC(=O)C1=N[C@]23C=C(NC(=O)c4ccccc4F)C=C[C@@]2(CNC(=O)[C@H](N)N3)N1

BIRTHDAY: 2018-11-19T08:15:22.078549
ATC: H05B
- SYSTEMIC HORMONAL PREPARATIONS, EXCL. SEX HORMONES AND INSULINS
- CALCIUM HOMEOSTASIS
- ANTI-PARATHYROID AGENTS
Synthesis plan pending
FORMULA:C21H17FN4O2

SMILES: COc1ccc(C(=O)c2cc3c(ncn3Cc3ccc(F)cc3)nc2N)cc1

BIRTHDAY: 2018-11-19T08:15:22.087630
ATC: R06A
- RESPIRATORY SYSTEM
- ANTIHISTAMINES FOR SYSTEMIC USE
- ANTIHISTAMINES FOR SYSTEMIC USE
Synthesis plan pending
FORMULA:C20H23NO2

SMILES: COc1ccc(C(=O)c2cnc(C(C)C)c3c2CCCC3)cc1

BIRTHDAY: 2018-11-19T08:15:22.102471
ATC: D11A
- DERMATOLOGICALS
- OTHER DERMATOLOGICAL PREPARATIONS
- OTHER DERMATOLOGICAL PREPARATIONS
Synthesis plan pending
FORMULA:C17H18N2O2

SMILES: CCC(C)(C)OC(=O)c1cc2c(cn1)[nH]c1ccccc12

BIRTHDAY: 2018-11-19T08:15:22.109689
ATC: L01C
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- PLANT ALKALOIDS AND OTHER NATURAL PRODUCTS
Synthesis plan pending
FORMULA:C16H22O4

SMILES: CCOC(=O)c1ccc(C(=O)OC)cc1C[C@H](C)CC

BIRTHDAY: 2018-11-19T08:15:22.116948
ATC: M04A
- MUSCULO-SKELETAL SYSTEM
- ANTIGOUT PREPARATIONS
- ANTIGOUT PREPARATIONS
Synthesis plan pending
FORMULA:C10H15N3O

SMILES: NCCO[C@H]1C=CN=CN=CC=CC1

BIRTHDAY: 2018-11-19T08:15:22.123385
ATC: C10A
- CARDIOVASCULAR SYSTEM
- LIPID MODIFYING AGENTS
- LIPID MODIFYING AGENTS, PLAIN
Synthesis plan pending
FORMULA:C14H14F3N5O3

SMILES: CCOC(=O)c1nc2c([nH]1)N[C@]1(N)C=CC=C(C(F)(F)F)[C@@H]1NC2=O

BIRTHDAY: 2018-11-19T08:15:22.133278
ATC: J05A
- ANTIINFECTIVES FOR SYSTEMIC USE
- ANTIVIRALS FOR SYSTEMIC USE
- DIRECT ACTING ANTIVIRALS
Synthesis plan pending
FORMULA:C14H18O3

SMILES: CC[C@H](C)CC(=O)c1ccccc1C(=O)OC

BIRTHDAY: 2018-11-19T08:15:22.147752
ATC: P03B
- ANTIPARASITIC PRODUCTS, INSECTICIDES AND REPELLENTS
- ECTOPARASITICIDES, INCL. SCABICIDES, INSECTICIDES AND REPELLENTS
- INSECTICIDES AND REPELLENTS
Synthesis plan pending
FORMULA:C19H28O3S

SMILES: CCO[C@@H]1CC(=O)c2cc(C(C)C)ccc2OCCCCCS1

BIRTHDAY: 2018-11-19T08:15:22.155304
ATC: C03C
- CARDIOVASCULAR SYSTEM
- DIURETICS
- HIGH-CEILING DIURETICS
Synthesis plan pending
FORMULA:C18H17N3O2S

SMILES: COc1ccc(C(=O)c2cc3c4c([nH]c3nc2N)CCCS4)cc1

BIRTHDAY: 2018-11-19T08:15:22.164038
ATC: J01M
- ANTIINFECTIVES FOR SYSTEMIC USE
- ANTIBACTERIALS FOR SYSTEMIC USE
- QUINOLONE ANTIBACTERIALS
Synthesis plan pending
FORMULA:C21H26N2O3

SMILES: CC[C@@H](C)CCCc1[nH]cc(C(=O)OC)c2c3cc(OC)ccc3nc1-2

BIRTHDAY: 2018-11-19T08:15:22.172233
ATC: C03C
- CARDIOVASCULAR SYSTEM
- DIURETICS
- HIGH-CEILING DIURETICS
Synthesis plan pending
FORMULA:C15H15N5O4S

SMILES: CCOC(=O)c1nc2c([nH]1)N[C@@]1(N)C=CC3=C(CC(=O)S3)[C@@H]1NC2=O

BIRTHDAY: 2018-11-19T08:15:22.181878
ATC: C08C
- CARDIOVASCULAR SYSTEM
- CALCIUM CHANNEL BLOCKERS
- SELECTIVE CALCIUM CHANNEL BLOCKERS WITH MAINLY VASCULAR EFFECTS
Synthesis plan pending
FORMULA:C25H24N2O

SMILES: CCC(C)(C)c1nc(C(=O)c2ccccc2)cn1-c1ccc2ccccc2c1

BIRTHDAY: 2018-11-19T08:15:22.189879
ATC: L01D
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- CYTOTOXIC ANTIBIOTICS AND RELATED SUBSTANCES
Synthesis plan pending
FORMULA:C14H14F3N5O3

SMILES: CCOC(=O)c1nc2c([nH]1)N[C@@]1(N)C=CC(C(F)(F)F)=C[C@@H]1NC2=O

BIRTHDAY: 2018-11-19T08:15:22.199686
ATC: J05A
- ANTIINFECTIVES FOR SYSTEMIC USE
- ANTIVIRALS FOR SYSTEMIC USE
- DIRECT ACTING ANTIVIRALS
Synthesis plan pending
FORMULA:C24H22ClN5O2

SMILES: COc1ccc2c(c1)CCN(C)Cc1cn(-c3ccccc3Cl)nc1-c1cncc(n1)O2

BIRTHDAY: 2018-11-19T08:15:22.209897
ATC: C02C
- CARDIOVASCULAR SYSTEM
- ANTIHYPERTENSIVES
- ANTIADRENERGIC AGENTS, PERIPHERALLY ACTING
Synthesis plan pending
FORMULA:C24H33N5O4

SMILES: CC[C@H](C)C(C)(C)COC(=O)c1nc2c([nH]1)N[C@]1(N)C=CC=C(C#CC(C)(C)O)[C@H]1NC2=O

BIRTHDAY: 2018-11-19T08:15:22.220267
ATC: V09A
- VARIOUS
- DIAGNOSTIC RADIOPHARMACEUTICALS
- CENTRAL NERVOUS SYSTEM
Synthesis plan pending
FORMULA:C14H14F3N5O3

SMILES: CCOC(=O)c1nc2c([nH]1)N[C@]1(N)C=CC=C(C(F)(F)F)[C@H]1NC2=O

BIRTHDAY: 2018-11-19T08:15:22.250089
ATC: J05A
- ANTIINFECTIVES FOR SYSTEMIC USE
- ANTIVIRALS FOR SYSTEMIC USE
- DIRECT ACTING ANTIVIRALS
Synthesis plan pending
FORMULA:C18H15N7

SMILES: N#Cc1cccc2c1N1N=CN[C@@]13NC=N[C@@]3(c1ccccc1)CN2

BIRTHDAY: 2018-11-19T08:15:22.268780
ATC: J01F
- ANTIINFECTIVES FOR SYSTEMIC USE
- ANTIBACTERIALS FOR SYSTEMIC USE
- MACROLIDES, LINCOSAMIDES AND STREPTOGRAMINS
Synthesis plan pending
FORMULA:C21H28N2O4

SMILES: CC[C@H](C)C(C)(C)C1=C(C(=O)OC)NC=C[C@@]12N=CC1=C2C=CCC1(O)O

BIRTHDAY: 2018-11-19T08:15:22.277822
ATC: C10A
- CARDIOVASCULAR SYSTEM
- LIPID MODIFYING AGENTS
- LIPID MODIFYING AGENTS, PLAIN
Synthesis plan pending
FORMULA:C18H21N5O4

SMILES: CCOC(=O)c1nc2c([nH]1)N[C@@]1(N)C=CC(C#CC(C)(C)O)=C[C@H]1NC2=O

BIRTHDAY: 2018-11-19T08:15:22.287225
ATC: J05A
- ANTIINFECTIVES FOR SYSTEMIC USE
- ANTIVIRALS FOR SYSTEMIC USE
- DIRECT ACTING ANTIVIRALS
Synthesis plan pending
FORMULA:C21H17N3O2

SMILES: COc1ccccc1C(=O)c1cc(N)nc2c(-c3ccccc3)c[nH]c12

BIRTHDAY: 2018-11-19T08:15:22.295565
ATC: G04B
- GENITO URINARY SYSTEM AND SEX HORMONES
- UROLOGICALS
- UROLOGICALS
Synthesis plan pending
FORMULA:C18H21N5O4

SMILES: CCOC(=O)c1nc2c([nH]1)N[C@]1(N)C=CC=C(C#CC(C)(C)O)[C@H]1NC2=O

BIRTHDAY: 2018-11-19T08:15:22.305182
ATC: V09A
- VARIOUS
- DIAGNOSTIC RADIOPHARMACEUTICALS
- CENTRAL NERVOUS SYSTEM
Synthesis plan pending
FORMULA:C17H15ClN6

SMILES: Clc1cccc2c1N1N=CN[C@@]13NC(c1ccccc1)=N[C@H]3CN2

BIRTHDAY: 2018-11-19T08:15:22.314193
ATC: D01A
- DERMATOLOGICALS
- ANTIFUNGALS FOR DERMATOLOGICAL USE
- ANTIFUNGALS FOR TOPICAL USE
Synthesis plan pending
FORMULA:C19H14F3N3O

SMILES: O=C(c1cccc(C(F)(F)F)c1)c1cnccc1NCc1ccncc1

BIRTHDAY: 2018-11-19T08:15:22.323000
ATC: N03A
- NERVOUS SYSTEM
- ANTIEPILEPTICS
- ANTIEPILEPTICS
Synthesis plan pending
FORMULA:C25H30O5

SMILES: CCOC(=O)[C@@H](C)C(=O)c1cccc(OCC(=O)c2ccccc2)c1C(C)(C)CC

BIRTHDAY: 2018-11-19T08:15:22.331620
ATC: D01A
- DERMATOLOGICALS
- ANTIFUNGALS FOR DERMATOLOGICAL USE
- ANTIFUNGALS FOR TOPICAL USE
Synthesis plan pending
FORMULA:C17H24O3

SMILES: CCOC(=O)CCC(=O)c1ccc(C(C)(C)CC)cc1

BIRTHDAY: 2018-11-19T08:15:22.338153
ATC: D01A
- DERMATOLOGICALS
- ANTIFUNGALS FOR DERMATOLOGICAL USE
- ANTIFUNGALS FOR TOPICAL USE
Synthesis plan pending
FORMULA:C22H28N2O2

SMILES: COc1cccc(C(=O)c2c(NC(C)C)cnc3c2C(C)(C)CCC3)c1

BIRTHDAY: 2018-11-19T08:15:22.346142
ATC: M01A
- MUSCULO-SKELETAL SYSTEM
- ANTIINFLAMMATORY AND ANTIRHEUMATIC PRODUCTS
- ANTIINFLAMMATORY AND ANTIRHEUMATIC PRODUCTS, NON-STEROIDS
Synthesis plan pending
FORMULA:C18H23N5O3Si

SMILES: CCOC(=O)c1nc2c([nH]1)N[C@]1(N)C=CC(C#C[Si](C)(C)C)=C[C@H]1NC2=O

BIRTHDAY: 2018-11-19T08:15:22.364383
ATC: J01D
- ANTIINFECTIVES FOR SYSTEMIC USE
- ANTIBACTERIALS FOR SYSTEMIC USE
- OTHER BETA-LACTAM ANTIBACTERIALS
Synthesis plan pending
FORMULA:C44H48N6O7

SMILES: CN1Cc2c(C(=O)OC(C)(C)C)ncn2-c2ccc(NC(=O)c3cccc4c3-c3cn(c5ccccc35)CCOCCOCCOCCN3C=C4CC3)cc2C1=O

BIRTHDAY: 2018-11-19T08:15:22.382836
ATC: G03B
- GENITO URINARY SYSTEM AND SEX HORMONES
- SEX HORMONES AND MODULATORS OF THE GENITAL SYSTEM
- ANDROGENS
Synthesis plan pending
FORMULA:C19H14F3N3O

SMILES: O=C(c1cccc(C(F)(F)F)c1)c1cccnc1NCc1ccncc1

BIRTHDAY: 2018-11-19T08:15:22.391667
ATC: M01A
- MUSCULO-SKELETAL SYSTEM
- ANTIINFLAMMATORY AND ANTIRHEUMATIC PRODUCTS
- ANTIINFLAMMATORY AND ANTIRHEUMATIC PRODUCTS, NON-STEROIDS
Synthesis plan pending
FORMULA:C17H15ClN6

SMILES: Clc1cccc2c1N1N=CN[C@]13NC=N[C@@]3(c1ccccc1)CN2

BIRTHDAY: 2018-11-19T08:15:22.401004
ATC: N02B
- NERVOUS SYSTEM
- ANALGESICS
- OTHER ANALGESICS AND ANTIPYRETICS
Synthesis plan pending
FORMULA:C13H16O3

SMILES: CC[C@@H](C)C(=O)c1ccccc1C(=O)OC

BIRTHDAY: 2018-11-19T08:15:22.424270
ATC: P03B
- ANTIPARASITIC PRODUCTS, INSECTICIDES AND REPELLENTS
- ECTOPARASITICIDES, INCL. SCABICIDES, INSECTICIDES AND REPELLENTS
- INSECTICIDES AND REPELLENTS
Synthesis plan pending
FORMULA:C19H18O4

SMILES: CC[C@@H](C)C(=O)OC(=O)c1ccc(C(=O)c2ccccc2)cc1

BIRTHDAY: 2018-11-19T08:15:22.431683
ATC: N03A
- NERVOUS SYSTEM
- ANTIEPILEPTICS
- ANTIEPILEPTICS
Synthesis plan pending
FORMULA:C29H38FN3O

SMILES: CC(C)(C)C(C)(C)O[C@]12NC[C@H](N)c3ccc(F)cc3[C@]1(c1ccccc1)[C@H]1C=CCN2CC1

BIRTHDAY: 2018-11-19T08:15:22.442283
ATC: S01E
- SENSORY ORGANS
- OPHTHALMOLOGICALS
- ANTIGLAUCOMA PREPARATIONS AND MIOTICS
Synthesis plan pending
FORMULA:C22H25FN6O4

SMILES: CC(C)(C)OC(=O)C1=N[C@@]23C=C(NC(=O)c4ccccc4F)C=C[C@]2(CNC(=O)[C@@H](N)N3)N1

BIRTHDAY: 2018-11-19T08:15:22.453519
ATC: H05B
- SYSTEMIC HORMONAL PREPARATIONS, EXCL. SEX HORMONES AND INSULINS
- CALCIUM HOMEOSTASIS
- ANTI-PARATHYROID AGENTS
Synthesis plan pending
FORMULA:C20H10F3N3O

SMILES: N#Cc1ccc2c(c1)[nH]c1c(C(=O)c3cccc(C(F)(F)F)c3)ccnc12

BIRTHDAY: 2018-11-19T08:15:22.462452
ATC: A07A
- ALIMENTARY TRACT AND METABOLISM
- ANTIDIARRHEALS, INTESTINAL ANTIINFLAMMATORY/ANTIINFECTIVE AGENTS
- INTESTINAL ANTIINFECTIVES
Synthesis plan pending
FORMULA:C20H27ClN4O3

SMILES: CC[C@@H](C)C(C)(C)COC(=O)c1cnc2n1[C@]1(Cl)C=CC=C[C@@H]1N[C@@H](N)C2=O

BIRTHDAY: 2018-11-19T08:15:22.479282
ATC: J05A
- ANTIINFECTIVES FOR SYSTEMIC USE
- ANTIVIRALS FOR SYSTEMIC USE
- DIRECT ACTING ANTIVIRALS
Synthesis plan pending
FORMULA:C23H30N6O3

SMILES: CCO[C@]1(C#N)Cc2cccc(c2)CCCCC[C@@]23NC=N[C@]2(N1)N(C)C(=O)N(C)C3=O

BIRTHDAY: 2018-11-19T08:15:22.490344
ATC: C03B
- CARDIOVASCULAR SYSTEM
- DIURETICS
- LOW-CEILING DIURETICS, EXCL. THIAZIDES
Synthesis plan pending
FORMULA:C19H18N2O2

SMILES: C#Cc1ccc2c(c1)[nH]c1cc(C(=O)OC(C)(C)CC)ncc12

BIRTHDAY: 2018-11-19T08:15:22.497635
ATC: L02B
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ENDOCRINE THERAPY
- HORMONE ANTAGONISTS AND RELATED AGENTS
Synthesis plan pending
FORMULA:C21H24N2O5

SMILES: COC(=O)c1ncc(C(=O)c2cccc(OC)c2)cc1OC[C@H]1CCCNC1

BIRTHDAY: 2018-11-19T08:15:22.506908
ATC: L01C
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- PLANT ALKALOIDS AND OTHER NATURAL PRODUCTS
Synthesis plan pending
FORMULA:C27H34N2

SMILES: CC[C@H](C)C(C)(C)[C@@]1(C)C=CN(Cc2ccccc2)C2=C1C=N[C@@]21C=CC=CC1

BIRTHDAY: 2018-11-19T08:15:22.524362
ATC: B01A
- BLOOD AND BLOOD FORMING ORGANS
- ANTITHROMBOTIC AGENTS
- ANTITHROMBOTIC AGENTS
Synthesis plan pending
FORMULA:C18H20O6

SMILES: COc1ccc(OC)c(C(=O)c2c(OC)ccc(OC)c2OC)c1

BIRTHDAY: 2018-11-19T08:15:22.532643
ATC: V06D
- VARIOUS
- GENERAL NUTRIENTS
- OTHER NUTRIENTS
Synthesis plan pending
FORMULA:C27H34N2

SMILES: CC[C@@H](C)C(C)(C)[C@]1(C)C=CN(Cc2ccccc2)C2=C1[C@]1(C=CC=CC1)N=C2

BIRTHDAY: 2018-11-19T08:15:22.540864
ATC: N06A
- NERVOUS SYSTEM
- PSYCHOANALEPTICS
- ANTIDEPRESSANTS
Synthesis plan pending
FORMULA:C21H17N3O2

SMILES: COc1ccccc1C(=O)c1ncc2cc(-c3ccccc3)[nH]c2c1N

BIRTHDAY: 2018-11-19T08:15:22.549158
ATC: D01A
- DERMATOLOGICALS
- ANTIFUNGALS FOR DERMATOLOGICAL USE
- ANTIFUNGALS FOR TOPICAL USE
Synthesis plan pending
FORMULA:C18H23N5O

SMILES: N[C@]12NC=C([C@@H]3C[C@H]4C=CN3CC4)N1C[C@H]1C=CC=C[C@H]1NC2=O

BIRTHDAY: 2018-11-19T08:15:22.558334
ATC: J01D
- ANTIINFECTIVES FOR SYSTEMIC USE
- ANTIBACTERIALS FOR SYSTEMIC USE
- OTHER BETA-LACTAM ANTIBACTERIALS
Synthesis plan pending
FORMULA:C18H20O

SMILES: CC[C@@H](C)Cc1ccccc1C(=O)c1ccccc1

BIRTHDAY: 2018-11-19T08:15:22.564602
ATC: M04A
- MUSCULO-SKELETAL SYSTEM
- ANTIGOUT PREPARATIONS
- ANTIGOUT PREPARATIONS
Synthesis plan pending
FORMULA:C29H28N6O7

SMILES: CCOC(=O)c1ncn2c1CN(C)C(=O)c1cc(C#CC3=C(C)NC4=C(C(=O)OC4)[C@@H]4C[C@@H](O)CNC(=O)N34)ccc1-2

BIRTHDAY: 2018-11-30T17:24:10.271545
ATC: C07A
- CARDIOVASCULAR SYSTEM
- BETA BLOCKING AGENTS
- BETA BLOCKING AGENTS
Synthesis Plan
FORMULA:C19H18N2O2

SMILES: C#Cc1ccc2c(c1)[nH]c1nccc(C(=O)OC(C)(C)CC)c12

BIRTHDAY: 2018-11-30T17:24:10.279288
ATC: P01B
- ANTIPARASITIC PRODUCTS, INSECTICIDES AND REPELLENTS
- ANTIPROTOZOALS
- ANTIMALARIALS
Synthesis Plan
FORMULA:C18H26O6

SMILES: COc1ccc(OC)c(C(=O)C[C@@H](C)C(=O)OC(C)(C)C)c1OC

BIRTHDAY: 2018-11-30T17:24:10.303594
ATC: D06B
- DERMATOLOGICALS
- ANTIBIOTICS AND CHEMOTHERAPEUTICS FOR DERMATOLOGICAL USE
- CHEMOTHERAPEUTICS FOR TOPICAL USE
Synthesis Plan
FORMULA:C19H18N2O2

SMILES: C#Cc1ccc2[nH]c3cc(C(=O)OC(C)(C)CC)ncc3c2c1

BIRTHDAY: 2018-11-30T17:24:10.335108
ATC: C10A
- CARDIOVASCULAR SYSTEM
- LIPID MODIFYING AGENTS
- LIPID MODIFYING AGENTS, PLAIN
Synthesis Plan
FORMULA:C23H27N3O2

SMILES: COc1ccc(C2=NN=C3CC[C@@H]4C5C[C@@H]6C[C@@H](C5)CC4(C6)NC(=O)[C@@H]32)cc1

BIRTHDAY: 2018-11-30T17:24:10.344026
ATC: C10A
- CARDIOVASCULAR SYSTEM
- LIPID MODIFYING AGENTS
- LIPID MODIFYING AGENTS, PLAIN
Synthesis Plan
FORMULA:C25H27NO5

SMILES: CC[C@@H](C)C(=O)OCCCOC(=O)c1ccc2c(c1)c(C(=O)c1ccccc1)cn2C

BIRTHDAY: 2018-11-30T17:24:10.359389
ATC: A01A
- ALIMENTARY TRACT AND METABOLISM
- STOMATOLOGICAL PREPARATIONS
- STOMATOLOGICAL PREPARATIONS
Synthesis Plan
FORMULA:C14H18O3

SMILES: CC[C@H](C)CC(=O)c1ccc(C(=O)OC)cc1

BIRTHDAY: 2018-11-30T17:24:10.365555
ATC: C02K
- CARDIOVASCULAR SYSTEM
- ANTIHYPERTENSIVES
- OTHER ANTIHYPERTENSIVES
Synthesis Plan
FORMULA:C24H25N5O5

SMILES: COc1cccc(C(=O)Nc2ccc3c(c2)C(=O)N(C)Cc2c(C(=O)OC(C)(C)C)ncn2-3)n1

BIRTHDAY: 2018-11-30T17:24:10.376087
ATC: N02C
- NERVOUS SYSTEM
- ANALGESICS
- ANTIMIGRAINE PREPARATIONS
Synthesis Plan
FORMULA:C19H13F3N2O4

SMILES: C=C(C(=O)C1=NC2=C[C@@]3(C(=O)c4cccc(OC)c4)C=C[C@@]2(N1)O3)C(F)(F)F

BIRTHDAY: 2018-11-30T17:24:10.393861
ATC: C10A
- CARDIOVASCULAR SYSTEM
- LIPID MODIFYING AGENTS
- LIPID MODIFYING AGENTS, PLAIN
Synthesis Plan
FORMULA:C21H18N4O2S2

SMILES: O=C(c1ccc(OCCc2ccccn2)cc1)c1ccc(NC2=NSSC2)nc1

BIRTHDAY: 2018-11-30T17:24:10.410843
ATC: J05A
- ANTIINFECTIVES FOR SYSTEMIC USE
- ANTIVIRALS FOR SYSTEMIC USE
- DIRECT ACTING ANTIVIRALS
Synthesis Plan
FORMULA:C21H17N3O2

SMILES: COc1ccccc1C(=O)c1c(N)cnc2cc(-c3ccccc3)[nH]c12

BIRTHDAY: 2018-12-02T16:07:18.800431
ATC: N05B
- NERVOUS SYSTEM
- PSYCHOLEPTICS
- ANXIOLYTICS
Synthesis Plan
FORMULA:C16H14N4O3

SMILES: CCOC(=O)c1cnc2n1-c1ccc(C#N)cc1C(=O)N(C)C2

BIRTHDAY: 2018-12-02T16:07:18.809360
ATC: G03C
- GENITO URINARY SYSTEM AND SEX HORMONES
- SEX HORMONES AND MODULATORS OF THE GENITAL SYSTEM
- ESTROGENS
Synthesis Plan
FORMULA:C19H18N2O2

SMILES: C#Cc1cccc2c1[nH]c1c(C(=O)OC(C)(C)CC)cncc12

BIRTHDAY: 2018-12-02T16:07:18.833167
ATC: A10X
- ALIMENTARY TRACT AND METABOLISM
- DRUGS USED IN DIABETES
- OTHER DRUGS USED IN DIABETES
Synthesis Plan
FORMULA:C20H18ClN3

SMILES: N[C@@H](c1ccccc1)N1c2cccc(Cl)c2C=N[C@@H]2C=CC=C[C@@H]21

BIRTHDAY: 2018-12-02T16:07:18.841355
ATC: N06B
- NERVOUS SYSTEM
- PSYCHOANALEPTICS
- PSYCHOSTIMULANTS, AGENTS USED FOR ADHD AND NOOTROPICS
Synthesis Plan
FORMULA:C15H17N5O5

SMILES: CCOC(=O)c1nc2c([nH]1)N[C@@]1(N)C=CC(C(=O)OC)=C[C@@H]1NC2=O

BIRTHDAY: 2018-12-02T16:07:18.850829
ATC: J05A
- ANTIINFECTIVES FOR SYSTEMIC USE
- ANTIVIRALS FOR SYSTEMIC USE
- DIRECT ACTING ANTIVIRALS
Synthesis Plan
FORMULA:C19H13FN2O2

SMILES: COc1cccc(C(=O)c2cncc3c2[nH]c2cc(F)ccc23)c1

BIRTHDAY: 2018-12-02T16:07:18.858867
ATC: M01A
- MUSCULO-SKELETAL SYSTEM
- ANTIINFLAMMATORY AND ANTIRHEUMATIC PRODUCTS
- ANTIINFLAMMATORY AND ANTIRHEUMATIC PRODUCTS, NON-STEROIDS
Synthesis Plan
FORMULA:C17H20ClN3O

SMILES: CCC(C)(C)c1ncn2c1CN(C)C(=O)c1cc(Cl)ccc1-2

BIRTHDAY: 2018-12-02T16:07:18.866641
ATC: C01C
- CARDIOVASCULAR SYSTEM
- CARDIAC THERAPY
- CARDIAC STIMULANTS EXCL. CARDIAC GLYCOSIDES
Synthesis Plan
FORMULA:C24H31N5O2

SMILES: C[C@@H]1C=C[C@@H]2NCCCN[C@@]2(N)OCC=CCCC(=O)c2n[nH]c(-c3ccccc3)c21

BIRTHDAY: 2018-12-02T16:07:18.908747
ATC: C02K
- CARDIOVASCULAR SYSTEM
- ANTIHYPERTENSIVES
- OTHER ANTIHYPERTENSIVES
Synthesis Plan
FORMULA:C22H25FN6O4

SMILES: CC(C)(C)OC(=O)C1=N[C@]23C=CC(NC(=O)c4ccccc4F)=C[C@]2(CNC(=O)[C@H](N)N3)N1

BIRTHDAY: 2018-12-02T16:07:18.919885
ATC: H05B
- SYSTEMIC HORMONAL PREPARATIONS, EXCL. SEX HORMONES AND INSULINS
- CALCIUM HOMEOSTASIS
- ANTI-PARATHYROID AGENTS
Synthesis Plan
FORMULA:C20H21F3N2O3

SMILES: CC[C@@H](C)CC(=O)Oc1ccc2c(c1)C(=O)C1=C(C(F)(F)F)C(C)=N[C@H](C)N12

BIRTHDAY: 2018-12-02T16:07:18.946054
ATC: V09I
- VARIOUS
- DIAGNOSTIC RADIOPHARMACEUTICALS
- TUMOUR DETECTION
Synthesis Plan
FORMULA:C22H28N2O2

SMILES: COc1ccc(C(=O)c2cnc3c(c2NC(C)C)CCC(C)(C)C3)cc1

BIRTHDAY: 2018-12-02T16:07:18.954040
ATC: A10B
- ALIMENTARY TRACT AND METABOLISM
- DRUGS USED IN DIABETES
- BLOOD GLUCOSE LOWERING DRUGS, EXCL. INSULINS
Synthesis Plan
FORMULA:C21H22N2O3

SMILES: CC(C)(O)C#Cc1ccc2c(c1)[nH]c1c(C(=O)OC(C)(C)C)cncc12

BIRTHDAY: 2018-12-03T10:43:40.259610
ATC: R06A
- RESPIRATORY SYSTEM
- ANTIHISTAMINES FOR SYSTEMIC USE
- ANTIHISTAMINES FOR SYSTEMIC USE
Synthesis Plan
FORMULA:C21H24F3NO3S

SMILES: CCC(C)(C)c1sc(C(=O)OC(=O)C(C)(C)C)nc1-c1ccccc1C(F)(F)F

BIRTHDAY: 2018-12-03T10:43:40.269389
ATC: R06A
- RESPIRATORY SYSTEM
- ANTIHISTAMINES FOR SYSTEMIC USE
- ANTIHISTAMINES FOR SYSTEMIC USE
Synthesis Plan
FORMULA:C21H17N3O2

SMILES: COc1ccc(C(=O)c2cnc3[nH]c(-c4ccccc4)cc3c2N)cc1

BIRTHDAY: 2018-12-03T10:43:40.296443
ATC: L01C
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- PLANT ALKALOIDS AND OTHER NATURAL PRODUCTS
Synthesis Plan
FORMULA:C25H29N3O4

SMILES: CC[C@@H](C)CCCCCOC(=O)C1=C(C(=O)OC)[C@@H](c2ccccc2)C(C#N)=C(C#N)N1

BIRTHDAY: 2018-12-03T10:43:40.352558
ATC: J01F
- ANTIINFECTIVES FOR SYSTEMIC USE
- ANTIBACTERIALS FOR SYSTEMIC USE
- MACROLIDES, LINCOSAMIDES AND STREPTOGRAMINS
Synthesis Plan
FORMULA:C14H14N6O3

SMILES: CCOC(=O)c1nc2c([nH]1)N[C@@]1(N)C=CC=C(C#N)[C@@H]1NC2=O

BIRTHDAY: 2018-12-03T10:43:40.379617
ATC: A10B
- ALIMENTARY TRACT AND METABOLISM
- DRUGS USED IN DIABETES
- BLOOD GLUCOSE LOWERING DRUGS, EXCL. INSULINS
Synthesis Plan
FORMULA:C25H33N5O4

SMILES: CCC(C)(C)OC(=O)c1ccnc2c1N[C@@]13C(=CC=C[C@H]21)OC=N[C@]3(N)C(=O)N[C@@H](C)C(C)C

BIRTHDAY: 2018-12-03T10:43:40.391373
ATC: M03A
- MUSCULO-SKELETAL SYSTEM
- MUSCLE RELAXANTS
- MUSCLE RELAXANTS, PERIPHERALLY ACTING AGENTS
Synthesis Plan
FORMULA:C14H14F3N5O3

SMILES: CCOC(=O)c1nc2c([nH]1)N[C@@]1(N)C=CC=C(C(F)(F)F)[C@H]1NC2=O

BIRTHDAY: 2018-12-03T19:12:05.112159
ATC: J05A
- ANTIINFECTIVES FOR SYSTEMIC USE
- ANTIVIRALS FOR SYSTEMIC USE
- DIRECT ACTING ANTIVIRALS
Synthesis Plan
FORMULA:C24H33N5O4

SMILES: CC[C@H](C)C(C)(C)COC(=O)c1nc2c([nH]1)N[C@@]1(N)C=CC=C(C#CC(C)(C)O)[C@H]1NC2=O

BIRTHDAY: 2018-12-03T19:12:05.122638
ATC: V09A
- VARIOUS
- DIAGNOSTIC RADIOPHARMACEUTICALS
- CENTRAL NERVOUS SYSTEM
Synthesis Plan
FORMULA:C18H20O

SMILES: CCC(C)(C)c1cccc(C(=O)c2ccccc2)c1

BIRTHDAY: 2018-12-03T19:12:05.128914
ATC: N07C
- NERVOUS SYSTEM
- OTHER NERVOUS SYSTEM DRUGS
- ANTIVERTIGO PREPARATIONS
Synthesis Plan
FORMULA:C12H13NO4

SMILES: COc1ccc(-c2o[nH]c(=O)c2C)cc1OC

BIRTHDAY: 2018-12-03T19:12:05.195617
ATC: N05B
- NERVOUS SYSTEM
- PSYCHOLEPTICS
- ANXIOLYTICS
Synthesis Plan
FORMULA:C22H19N3O3

SMILES: COC1=CC=C[C@@]2(C1)N=CC1=C2NC=C[C@@]1(C#N)C(=O)c1ccccc1OC

BIRTHDAY: 2018-12-03T19:12:05.204703
ATC: A07A
- ALIMENTARY TRACT AND METABOLISM
- ANTIDIARRHEALS, INTESTINAL ANTIINFLAMMATORY/ANTIINFECTIVE AGENTS
- INTESTINAL ANTIINFECTIVES
Synthesis Plan
FORMULA:C21H25NO4

SMILES: CC(C)C[C@@H](C)C(=O)c1ccc(C2=C3OCCC(=O)N3CC=CO2)cc1

BIRTHDAY: 2018-12-03T19:12:05.212992
ATC: A08A
- ALIMENTARY TRACT AND METABOLISM
- ANTIOBESITY PREPARATIONS, EXCL. DIET PRODUCTS
- ANTIOBESITY PREPARATIONS, EXCL. DIET PRODUCTS
Synthesis Plan
FORMULA:C16H21N3O3

SMILES: CCOC(=O)c1ncn2c1CN(C)C(=O)[C@H]1CCC=CC[C@H]12

BIRTHDAY: 2018-12-03T19:12:05.229271
ATC: J05A
- ANTIINFECTIVES FOR SYSTEMIC USE
- ANTIVIRALS FOR SYSTEMIC USE
- DIRECT ACTING ANTIVIRALS
Synthesis Plan
FORMULA:C22H25FN6O4

SMILES: CC(C)(C)OC(=O)C1=N[C@]23C=CC=C(NC(=O)c4ccccc4F)[C@@]2(CNC(=O)[C@@H](N)N3)N1

BIRTHDAY: 2018-12-01T22:31:11.134886
ATC: J01X
- ANTIINFECTIVES FOR SYSTEMIC USE
- ANTIBACTERIALS FOR SYSTEMIC USE
- OTHER ANTIBACTERIALS
Synthesis Plan
FORMULA:C23H32N4O3

SMILES: CCOC(=O)c1nc2c([nH]1)C(=O)N[C@@H](c1ccccc1)CNCCCCCCCC2

BIRTHDAY: 2018-12-01T22:31:11.164149
ATC: H01B
- SYSTEMIC HORMONAL PREPARATIONS, EXCL. SEX HORMONES AND INSULINS
- PITUITARY AND HYPOTHALAMIC HORMONES AND ANALOGUES
- POSTERIOR PITUITARY LOBE HORMONES
Synthesis Plan
FORMULA:C17H18O2

SMILES: CCC(C)(C)c1ccccc1C1=CC(=O)C=CC1=O

BIRTHDAY: 2018-12-01T22:31:11.170642
ATC: V08A
- VARIOUS
- CONTRAST MEDIA
- X-RAY CONTRAST MEDIA, IODINATED
Synthesis Plan
FORMULA:C14H14F3N5O3

SMILES: CCOC(=O)c1nc2c([nH]1)N[C@@]1(N)C=CC(C(F)(F)F)=C[C@H]1NC2=O

BIRTHDAY: 2018-12-01T22:31:11.180269
ATC: J05A
- ANTIINFECTIVES FOR SYSTEMIC USE
- ANTIVIRALS FOR SYSTEMIC USE
- DIRECT ACTING ANTIVIRALS
Synthesis Plan
FORMULA:C17H28O5

SMILES: CCC(C)(C)OC1=COC(=O)C[C@@H](C)OC[C@@H]2CCC[C@H]1O2

BIRTHDAY: 2018-12-01T22:31:11.188065
ATC: J05A
- ANTIINFECTIVES FOR SYSTEMIC USE
- ANTIVIRALS FOR SYSTEMIC USE
- DIRECT ACTING ANTIVIRALS
Synthesis Plan
FORMULA:C17H15ClN6

SMILES: Clc1cccc2c1N1N=CN[C@@]13NC=N[C@]3(c1ccccc1)CN2

BIRTHDAY: 2018-12-01T22:31:11.197228
ATC: N02B
- NERVOUS SYSTEM
- ANALGESICS
- OTHER ANALGESICS AND ANTIPYRETICS
Synthesis Plan
FORMULA:C22H24N2O2

SMILES: CCC(C)(C)c1nc(C(=O)c2ccccc2)cn1-c1ccc(OC)cc1

BIRTHDAY: 2018-12-01T22:31:11.236684
ATC: N05A
- NERVOUS SYSTEM
- PSYCHOLEPTICS
- ANTIPSYCHOTICS
Synthesis Plan