matter.farm

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

These compounds may interact with:

ATP-binding cassette sub-family G member 2

Potentially involved in: gout; dental caries; carcinoma; cancer; hyperuricemia; adenoma; rheumatoid arthritis; colorectal neoplasms; biliary cirrhosis; mammary neoplasms, experimental; nervous system disorder; adverse reaction to drug; diffuse large b-cell lymphoma; squamous cell carcinoma of the head and neck; mammary neoplasms; precursor t-cell lymphoblastic leukemia-lymphoma; active crohn's disease; adrenocortical adenoma; adrenocortical carcinoma; astrocytoma, pilocytic

Disease data sourced from Pharos.

Inhibitor

FORMULA:C19H22O4

SMILES: C=C(C(=O)c1c(OC)cccc1OC)[C@@]12C=C(C)[C@@H](CCC1)O2

BIRTHDAY: 2018-12-01T14:10:15.174011
ATC: V09A
- VARIOUS
- DIAGNOSTIC RADIOPHARMACEUTICALS
- CENTRAL NERVOUS SYSTEM
Synthesis Plan
FORMULA:C24H49NO3

SMILES: CC(C)(C)C(C)(C)C(C)(C)C(C)(C)C(C)(C)C(C)(C)C(=O)NCC(CO)CO

BIRTHDAY: 2018-12-01T14:10:15.181347
ATC: A03A
- ALIMENTARY TRACT AND METABOLISM
- DRUGS FOR FUNCTIONAL GASTROINTESTINAL DISORDERS
- DRUGS FOR FUNCTIONAL GASTROINTESTINAL DISORDERS
Synthesis Plan
FORMULA:C21H24O7

SMILES: C=C(C(=O)c1c(OC)ccc(OC)c1OC)c1c(OC)ccc(OC)c1OC

BIRTHDAY: 2018-12-01T14:10:15.190532
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C21H24O7

SMILES: C=C(C(=O)c1ccc(OC)c(OC)c1OC)c1c(OC)ccc(OC)c1OC

BIRTHDAY: 2018-12-01T14:10:15.199624
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C20H22O6

SMILES: C=C(C(=O)c1cc(OC)cc(OC)c1)c1c(OC)ccc(OC)c1OC

BIRTHDAY: 2018-12-01T14:10:15.208189
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C30H49NO3

SMILES: CCCCCCCCCCCCCCCCCCC(=O)Nc1ccc(C(=O)C(=O)C(C)C)cc1

BIRTHDAY: 2018-12-01T14:10:15.234070
ATC: A07A
- ALIMENTARY TRACT AND METABOLISM
- ANTIDIARRHEALS, INTESTINAL ANTIINFLAMMATORY/ANTIINFECTIVE AGENTS
- INTESTINAL ANTIINFECTIVES
Synthesis Plan
FORMULA:C20H22O6

SMILES: COc1ccc(C(=O)/C=C\c2cc(OC)c(OC)c(OC)c2)cc1OC

BIRTHDAY: 2018-12-01T14:10:15.242499
ATC: C02A
- CARDIOVASCULAR SYSTEM
- ANTIHYPERTENSIVES
- ANTIADRENERGIC AGENTS, CENTRALLY ACTING
Synthesis Plan
FORMULA:C34H28N4O4

SMILES: COc1cccc(C(=O)/C=C/c2cc(OC)c3c(c2)-c2cccc(c2)Nc2nccc(n2)NCc2cccc(c2)O3)c1

BIRTHDAY: 2018-12-01T14:10:15.254336
ATC: C02A
- CARDIOVASCULAR SYSTEM
- ANTIHYPERTENSIVES
- ANTIADRENERGIC AGENTS, CENTRALLY ACTING
Synthesis Plan
FORMULA:C31H51NO3

SMILES: CCCCCCCCCCCCCCCCCCCC(=O)Nc1ccc(C(=O)C(=O)C(C)C)cc1

BIRTHDAY: 2018-12-01T14:10:15.262496
ATC: A07A
- ALIMENTARY TRACT AND METABOLISM
- ANTIDIARRHEALS, INTESTINAL ANTIINFLAMMATORY/ANTIINFECTIVE AGENTS
- INTESTINAL ANTIINFECTIVES
Synthesis Plan
FORMULA:C19H20O5

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

BIRTHDAY: 2018-12-01T14:10:15.279270
ATC: N02B
- NERVOUS SYSTEM
- ANALGESICS
- OTHER ANALGESICS AND ANTIPYRETICS
Synthesis Plan
FORMULA:C22H25NO5S

SMILES: C[C@@H](C(=O)c1cccc(O)c1)N1C(=O)[C@@H](C)O[C@@H]2C=CC=C[C@@H]2SC(=O)C1(C)C

BIRTHDAY: 2018-12-01T14:10:15.289165
ATC: M01A
- MUSCULO-SKELETAL SYSTEM
- ANTIINFLAMMATORY AND ANTIRHEUMATIC PRODUCTS
- ANTIINFLAMMATORY AND ANTIRHEUMATIC PRODUCTS, NON-STEROIDS
Synthesis Plan
FORMULA:C19H22O3

SMILES: CC(C)(C(=O)c1cccc(O)c1O)C(C)(C)c1ccccc1

BIRTHDAY: 2018-12-01T14:10:15.305072
ATC: D08A
- DERMATOLOGICALS
- ANTISEPTICS AND DISINFECTANTS
- ANTISEPTICS AND DISINFECTANTS
Synthesis Plan
FORMULA:C32H53NO3

SMILES: CC(C)C(=O)C(=O)c1ccccc1NC(=O)CC(C)(C)C(C)(C)C(C)(C)C(C)(C)C(C)(C)C(C)(C)C

BIRTHDAY: 2018-12-01T14:10:15.314115
ATC: D01A
- DERMATOLOGICALS
- ANTIFUNGALS FOR DERMATOLOGICAL USE
- ANTIFUNGALS FOR TOPICAL USE
Synthesis Plan
FORMULA:C30H53N3O3

SMILES: C[C@@H](O)O/N=C(\N)c1ccccc1NC(=O)CC(C)(C)C(C)(C)C(C)(C)C(C)(C)C(C)(C)C(C)(C)C

BIRTHDAY: 2018-12-01T14:10:15.333654
ATC: A01A
- ALIMENTARY TRACT AND METABOLISM
- STOMATOLOGICAL PREPARATIONS
- STOMATOLOGICAL PREPARATIONS
Synthesis Plan
FORMULA:C28H49NO3

SMILES: CCCCCCCCCCCCCCCCCCC(=O)NCc1ccc(OC)c(OC)c1

BIRTHDAY: 2018-12-25T02:02:17.379021
ATC: N06A
- NERVOUS SYSTEM
- PSYCHOANALEPTICS
- ANTIDEPRESSANTS
Synthesis Plan
FORMULA:C27H47N3O2

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

BIRTHDAY: 2018-12-25T02:02:17.397211
ATC: N02B
- NERVOUS SYSTEM
- ANALGESICS
- OTHER ANALGESICS AND ANTIPYRETICS
Synthesis Plan
FORMULA:C32H55NO2

SMILES: CC(C)CC(=O)c1ccccc1NC(=O)CC(C)(C)C(C)(C)C(C)(C)C(C)(C)C(C)(C)C(C)(C)C

BIRTHDAY: 2018-12-25T02:02:17.414915
ATC: C02K
- CARDIOVASCULAR SYSTEM
- ANTIHYPERTENSIVES
- OTHER ANTIHYPERTENSIVES
Synthesis Plan
FORMULA:C18H21N3O6

SMILES: O=C1CNCc2cccc(c2)OCC(O)(O)C(O)(O)CNc2cccc1n2

BIRTHDAY: 2018-12-25T02:02:17.424962
ATC: C02D
- CARDIOVASCULAR SYSTEM
- ANTIHYPERTENSIVES
- ARTERIOLAR SMOOTH MUSCLE, AGENTS ACTING ON
Synthesis Plan
FORMULA:C31H51NO3

SMILES: CC(C)C(=O)C(=O)c1ccccc1NC(=O)C(C)(C)C(C)(C)C(C)(C)C(C)(C)C(C)(C)C(C)(C)C

BIRTHDAY: 2018-12-25T02:02:17.461048
ATC: R03D
- RESPIRATORY SYSTEM
- DRUGS FOR OBSTRUCTIVE AIRWAY DISEASES
- OTHER SYSTEMIC DRUGS FOR OBSTRUCTIVE AIRWAY DISEASES
Synthesis Plan
FORMULA:C24H26FN5O2

SMILES: CC1(C)c2cncc(n2)NCCC(=O)C[C@H]2CN[C@](O)(c3ccccc3F)c3cc1[nH]c32

BIRTHDAY: 2018-12-25T02:02:17.471769
ATC: R05D
- RESPIRATORY SYSTEM
- COUGH AND COLD PREPARATIONS
- COUGH SUPPRESSANTS, EXCL. COMBINATIONS WITH EXPECTORANTS
Synthesis Plan
FORMULA:C19H20O5

SMILES: C=C(C(=O)c1cc(OC)cc(OC)c1)c1c(OC)cccc1OC

BIRTHDAY: 2018-12-25T02:02:17.479999
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C32H53NO3

SMILES: CCCCCCCCCCCCCCCCCCCCC(=O)Nc1ccc(C(=O)C(=O)C(C)C)cc1

BIRTHDAY: 2018-12-25T02:02:17.488591
ATC: A07A
- ALIMENTARY TRACT AND METABOLISM
- ANTIDIARRHEALS, INTESTINAL ANTIINFLAMMATORY/ANTIINFECTIVE AGENTS
- INTESTINAL ANTIINFECTIVES
Synthesis Plan
FORMULA:C25H51NO3

SMILES: CC(C)(C)C(C)(C)C(C)(C)C(C)(C)C(C)(C)C(C)(C)CC(=O)NCC(CO)CO

BIRTHDAY: 2018-12-25T02:02:17.495987
ATC: L01D
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- CYTOTOXIC ANTIBIOTICS AND RELATED SUBSTANCES
Synthesis Plan
FORMULA:C28H49N3O2

SMILES: CCCC(C)(C)C(C)(C)C(C)(C)C(C)(C)CCCCCC(=O)Nc1ccccc1/C(N)=N\O

BIRTHDAY: 2018-12-03T02:38:21.830801
ATC: C03D
- CARDIOVASCULAR SYSTEM
- DIURETICS
- POTASSIUM-SPARING AGENTS
Synthesis Plan
FORMULA:C32H54N2O

SMILES: N[C@H]1CN2C[C@@H]1C=C(CO)[C@H]2CCCCCCCCCCCCCCCCCCc1ccccc1

BIRTHDAY: 2018-12-03T02:38:21.848119
ATC: J05A
- ANTIINFECTIVES FOR SYSTEMIC USE
- ANTIVIRALS FOR SYSTEMIC USE
- DIRECT ACTING ANTIVIRALS
Synthesis Plan
FORMULA:C30H53N3O3

SMILES: C[C@@H](O)O/N=C(/N)c1ccccc1NC(=O)CC(C)(C)C(C)(C)C(C)(C)C(C)(C)C(C)(C)C(C)(C)C

BIRTHDAY: 2018-12-03T02:38:21.857558
ATC: A01A
- ALIMENTARY TRACT AND METABOLISM
- STOMATOLOGICAL PREPARATIONS
- STOMATOLOGICAL PREPARATIONS
Synthesis Plan
FORMULA:C14H15N3O2

SMILES: C=C(C(=O)c1ccccc1OC)[C@]1(N)N=CC(C)=N1

BIRTHDAY: 2018-12-03T02:38:21.865180
ATC: C02K
- CARDIOVASCULAR SYSTEM
- ANTIHYPERTENSIVES
- OTHER ANTIHYPERTENSIVES
Synthesis Plan
FORMULA:C19H20O5

SMILES: COc1ccc(OC)c(C(=O)/C=C/c2c(OC)cccc2OC)c1

BIRTHDAY: 2018-12-03T02:38:21.881909
ATC: J01F
- ANTIINFECTIVES FOR SYSTEMIC USE
- ANTIBACTERIALS FOR SYSTEMIC USE
- MACROLIDES, LINCOSAMIDES AND STREPTOGRAMINS
Synthesis Plan
FORMULA:C16H12N2O5

SMILES: C=C(C(=O)c1cc(OC)cc2[n-][o+]nc12)c1cccc(O)c1O

BIRTHDAY: 2018-12-03T02:38:21.916327
ATC: D06A
- DERMATOLOGICALS
- ANTIBIOTICS AND CHEMOTHERAPEUTICS FOR DERMATOLOGICAL USE
- ANTIBIOTICS FOR TOPICAL USE
Synthesis Plan
FORMULA:C61H92N6O3

SMILES: CCCCCCCCCCCCCCCCCCCC(=O)N[C@H]1COc2cccc(c2)CNc2nc(ncc2-c2cc3ccc2CCCOCCCCCCCCCCCCN3)Nc2cccc(c2)C1

BIRTHDAY: 2018-11-30T03:40:18.008863
ATC: J01F
- ANTIINFECTIVES FOR SYSTEMIC USE
- ANTIBACTERIALS FOR SYSTEMIC USE
- MACROLIDES, LINCOSAMIDES AND STREPTOGRAMINS
Synthesis Plan
FORMULA:C23H28N4O6

SMILES: COc1cccc(C(=O)[C@@]23C(=O)CNCCNCCN[C@H]4CC(=O)C(=O)[C@@H](CC2=O)N3C4)c1

BIRTHDAY: 2018-11-30T03:40:18.020630
ATC: D07A
- DERMATOLOGICALS
- CORTICOSTEROIDS, DERMATOLOGICAL PREPARATIONS
- CORTICOSTEROIDS, PLAIN
Synthesis Plan
FORMULA:C25H24O7S

SMILES: COc1ccccc1C(=O)/C=C1\CO[C@]2(c3ccccc3OC)C=CC=C[C@]2(OC)S1(=O)=O

BIRTHDAY: 2018-11-30T03:40:18.031030
ATC: R05C
- RESPIRATORY SYSTEM
- COUGH AND COLD PREPARATIONS
- EXPECTORANTS, EXCL. COMBINATIONS WITH COUGH SUPPRESSANTS
Synthesis Plan
FORMULA:C19H20O5

SMILES: C=C(C(=O)c1c(OC)cccc1OC)c1c(OC)cccc1OC

BIRTHDAY: 2018-11-30T03:40:18.039296
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C29H51NO3

SMILES: COc1cccc(OC)c1CNC(=O)C(C)(C)C(C)(C)C(C)(C)C(C)(C)C(C)(C)C(C)(C)C

BIRTHDAY: 2018-11-30T03:40:18.047409
ATC: N07B
- NERVOUS SYSTEM
- OTHER NERVOUS SYSTEM DRUGS
- DRUGS USED IN ADDICTIVE DISORDERS
Synthesis Plan
FORMULA:C29H57NO3

SMILES: CCCCCCCCCCCCCCCCCCCC(=O)NCC(C)(C)OC(=O)C(C)(C)C

BIRTHDAY: 2018-11-30T03:40:18.073080
ATC: B02A
- BLOOD AND BLOOD FORMING ORGANS
- ANTIHEMORRHAGICS
- ANTIFIBRINOLYTICS
Synthesis Plan
FORMULA:C32H55NO2

SMILES: CCCCCCCCCCCCCCCCCCCCC(=O)Nc1ccc(C(=O)CC(C)C)cc1

BIRTHDAY: 2018-11-30T03:40:18.099349
ATC: A07A
- ALIMENTARY TRACT AND METABOLISM
- ANTIDIARRHEALS, INTESTINAL ANTIINFLAMMATORY/ANTIINFECTIVE AGENTS
- INTESTINAL ANTIINFECTIVES
Synthesis Plan
FORMULA:C20H22O6

SMILES: C=C(C(=O)c1c(OC)cccc1OC)c1c(OC)cc(OC)cc1OC

BIRTHDAY: 2018-11-30T03:40:18.117148
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C30H50N6O2S

SMILES: CC(C)(C)C(C)(C)C(C)(C)C(C)(C)C(C)(C)C(C)(C)C(=O)Nc1ccccc1/C(N)=N\OCc1n[nH]c(=S)[nH]1

BIRTHDAY: 2018-11-19T08:18:03.004102
ATC: C07A
- CARDIOVASCULAR SYSTEM
- BETA BLOCKING AGENTS
- BETA BLOCKING AGENTS
Synthesis Plan
FORMULA:C27H48N4O3

SMILES: CC(C)(C)C(C)(C)C(C)(C)C(C)(C)C(C)(C)C(C)(C)C(=O)NC1=C(CO)C=NNC=C1C(N)=O

BIRTHDAY: 2018-11-19T08:18:03.023159
ATC: M04A
- MUSCULO-SKELETAL SYSTEM
- ANTIGOUT PREPARATIONS
- ANTIGOUT PREPARATIONS
Synthesis Plan
FORMULA:C10H9N3O

SMILES: COc1ccc(-c2cnnnc2)cc1

BIRTHDAY: 2018-11-19T08:18:03.038202
ATC: M01A
- MUSCULO-SKELETAL SYSTEM
- ANTIINFLAMMATORY AND ANTIRHEUMATIC PRODUCTS
- ANTIINFLAMMATORY AND ANTIRHEUMATIC PRODUCTS, NON-STEROIDS
Synthesis Plan
FORMULA:C26H52O4

SMILES: CCCCCCCCCCCCCCCCCCCCC(=O)OC[C@H](CO)COC

BIRTHDAY: 2018-11-19T08:18:03.063075
ATC: B02A
- BLOOD AND BLOOD FORMING ORGANS
- ANTIHEMORRHAGICS
- ANTIFIBRINOLYTICS
Synthesis Plan
FORMULA:C31H53NO2

SMILES: CC(C)CC(=O)c1ccccc1NC(=O)C(C)(C)C(C)(C)C(C)(C)C(C)(C)C(C)(C)C(C)(C)C

BIRTHDAY: 2018-11-19T08:18:03.071217
ATC: R03D
- RESPIRATORY SYSTEM
- DRUGS FOR OBSTRUCTIVE AIRWAY DISEASES
- OTHER SYSTEMIC DRUGS FOR OBSTRUCTIVE AIRWAY DISEASES
Synthesis Plan
FORMULA:C30H49NO3

SMILES: CC(C)C(=O)C(=O)c1ccccc1NC(=O)[C@H](C)C(C)(C)C(C)(C)C(C)(C)C(C)(C)C(C)(C)C

BIRTHDAY: 2018-11-19T08:18:03.088497
ATC: J01D
- ANTIINFECTIVES FOR SYSTEMIC USE
- ANTIBACTERIALS FOR SYSTEMIC USE
- OTHER BETA-LACTAM ANTIBACTERIALS
Synthesis Plan
FORMULA:C30H53N3O

SMILES: CC(C)C(C)(C)C(C)(C)C(C)(C)C(C)(C)C(C)(C)C(=O)Nc1ccccc1/C(N)=N/C(C)(C)C

BIRTHDAY: 2018-11-19T08:18:03.097069
ATC: M03A
- MUSCULO-SKELETAL SYSTEM
- MUSCLE RELAXANTS
- MUSCLE RELAXANTS, PERIPHERALLY ACTING AGENTS
Synthesis Plan
FORMULA:C31H53NO2

SMILES: CCCCCCCCCCCCCCCCCCCC(=O)Nc1ccc(C(=O)CC(C)C)cc1

BIRTHDAY: 2018-11-19T08:18:03.104859
ATC: A07A
- ALIMENTARY TRACT AND METABOLISM
- ANTIDIARRHEALS, INTESTINAL ANTIINFLAMMATORY/ANTIINFECTIVE AGENTS
- INTESTINAL ANTIINFECTIVES
Synthesis Plan
FORMULA:C21H26N2O2S

SMILES: COC1=CC=C[C@@]2(C#N)[C@H]1S[C@@H]1N=CC[C@]2(C(C)C)C12CCC(=O)CC2

BIRTHDAY: 2018-11-19T08:18:03.114999
ATC: L01C
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- PLANT ALKALOIDS AND OTHER NATURAL PRODUCTS
Synthesis Plan
FORMULA:C15H18N2O2

SMILES: O=c1[nH]occ1[C@]1(Cc2ccccc2)CCCCN1

BIRTHDAY: 2018-11-19T08:18:03.122393
ATC: C04A
- CARDIOVASCULAR SYSTEM
- PERIPHERAL VASODILATORS
- PERIPHERAL VASODILATORS
Synthesis Plan
FORMULA:C50H56N8O2

SMILES: CC(C)(C)C(C)(C)[C@@]1(C)C=C[C@H]([C@@H]2NCC=C3C=CC=C[C@H]3CNc3cccc(c3)-c3ccnc(n3)Nc3cccc2c3)Oc2ccc(cc2)CNCC(=O)c2cn1cn2

BIRTHDAY: 2018-11-19T08:18:03.139127
ATC: P01A
- ANTIPARASITIC PRODUCTS, INSECTICIDES AND REPELLENTS
- ANTIPROTOZOALS
- AGENTS AGAINST AMOEBIASIS AND OTHER PROTOZOAL DISEASES
Synthesis Plan
FORMULA:C29H51N3O3

SMILES: C[C@@H](O)O/N=C(\N)c1ccccc1NC(=O)C(C)(C)C(C)(C)C(C)(C)C(C)(C)C(C)(C)C(C)(C)C

BIRTHDAY: 2018-11-19T08:18:03.148505
ATC: R03D
- RESPIRATORY SYSTEM
- DRUGS FOR OBSTRUCTIVE AIRWAY DISEASES
- OTHER SYSTEMIC DRUGS FOR OBSTRUCTIVE AIRWAY DISEASES
Synthesis Plan
FORMULA:C28H49N3O2

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

BIRTHDAY: 2018-11-19T08:18:03.156968
ATC: N02B
- NERVOUS SYSTEM
- ANALGESICS
- OTHER ANALGESICS AND ANTIPYRETICS
Synthesis Plan
FORMULA:C32H54N2O4

SMILES: CC(C)(C)C(C)(C)C(C)(C)C(C)(C)C(C)(C)C(C)(C)C(=O)Nc1ccccc1[C@H]1CON=CC1(CO)CO

BIRTHDAY: 2018-11-19T08:18:03.166855
ATC: R03D
- RESPIRATORY SYSTEM
- DRUGS FOR OBSTRUCTIVE AIRWAY DISEASES
- OTHER SYSTEMIC DRUGS FOR OBSTRUCTIVE AIRWAY DISEASES
Synthesis Plan
FORMULA:C21H24O7

SMILES: C=C(C(=O)c1cc(OC)cc(OC)c1OC)c1c(OC)ccc(OC)c1OC

BIRTHDAY: 2018-11-19T08:18:03.176044
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C26H52O5

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

BIRTHDAY: 2018-11-19T08:18:03.184406
ATC: N02A
- NERVOUS SYSTEM
- ANALGESICS
- OPIOIDS
Synthesis Plan
FORMULA:C30H31N3O4S

SMILES: COc1cccc(Nc2ccc3cc2OCCC(C)(C)COc2cccc(c2)Sc2cc-3ncn2)c1OC

BIRTHDAY: 2018-11-19T08:18:03.203686
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:C19H20O5

SMILES: C=C(C(=O)c1cc(OC)ccc1OC)c1c(OC)cccc1OC

BIRTHDAY: 2018-11-19T08:18:03.211906
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C25H50O5

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

BIRTHDAY: 2018-11-19T08:18:03.219889
ATC: N02A
- NERVOUS SYSTEM
- ANALGESICS
- OPIOIDS
Synthesis Plan
FORMULA:C28H49N3O

SMILES: CC(C)(C)C(C)(C)C(C)(C)C(C)(C)C(C)(C)C(C)(C)CC(=O)Nc1ccccc1C(=N)N

BIRTHDAY: 2018-11-19T08:18:03.228013
ATC: D08A
- DERMATOLOGICALS
- ANTISEPTICS AND DISINFECTANTS
- ANTISEPTICS AND DISINFECTANTS
Synthesis Plan
FORMULA:C23H23NO6

SMILES: C=C(C(=O)c1ccc(OC)c2c1[C@@H]1N[C@@H]2CC1=O)c1c(OC)ccc(OC)c1OC

BIRTHDAY: 2018-11-19T08:18:03.237840
ATC: A01A
- ALIMENTARY TRACT AND METABOLISM
- STOMATOLOGICAL PREPARATIONS
- STOMATOLOGICAL PREPARATIONS
Synthesis Plan
FORMULA:C26H35NO4

SMILES: COc1ccc([C@@]2(C(C)C)C(=O)N(Cc3ccc(OC)c(OC)c3)[C@@]2(C)C(C)C)cc1

BIRTHDAY: 2018-11-19T08:18:03.246999
ATC: M01C
- MUSCULO-SKELETAL SYSTEM
- ANTIINFLAMMATORY AND ANTIRHEUMATIC PRODUCTS
- SPECIFIC ANTIRHEUMATIC AGENTS
Synthesis Plan
FORMULA:C21H24N4O5

SMILES: COc1ccc2c(c1)NCCNC(=O)C(=O)NCCN[C@@H]2C(=O)c1cccc(O)c1

BIRTHDAY: 2018-11-19T08:18:03.257190
ATC: G03C
- GENITO URINARY SYSTEM AND SEX HORMONES
- SEX HORMONES AND MODULATORS OF THE GENITAL SYSTEM
- ESTROGENS
Synthesis Plan
FORMULA:C27H47N3O2

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

BIRTHDAY: 2018-11-19T08:18:03.273681
ATC: N02B
- NERVOUS SYSTEM
- ANALGESICS
- OTHER ANALGESICS AND ANTIPYRETICS
Synthesis Plan
FORMULA:C38H55N5O2

SMILES: CCCCCCCCCCCCCCCCCCCC(=O)N1Cc2cc(ccc2O)CCc2cncc(c2)Nc2nccc1n2

BIRTHDAY: 2018-11-19T08:18:03.310564
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C22H17NO4

SMILES: C=C(C(=O)c1ccccc1[N+](=O)[O-])c1ccccc1OCc1ccccc1

BIRTHDAY: 2018-11-19T08:18:03.319316
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C20H22O6

SMILES: C=C(C(=O)c1c(OC)cccc1OC)c1ccc(OC)c(OC)c1OC

BIRTHDAY: 2018-11-19T08:18:03.327934
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C40H60N4O4S

SMILES: C[C@@H](c1ccccc1)[C@@]1(CO)OCCNC[C@@H]2CSC(=N2)c2cc(C(C)(C)C(C)(C)C(C)(C)C(C)(C)C(C)(C)C)cc(n2)CNC(=O)C1=O

BIRTHDAY: 2018-11-19T08:18:03.343172
ATC: N02A
- NERVOUS SYSTEM
- ANALGESICS
- OPIOIDS
Synthesis Plan
FORMULA:C32H47NO3

SMILES: CCCCCCCCCCCCCCCCCCCC(=O)Nc1cccc2c1[C@@H]1C=CC(=O)[C@H]2C1=O

BIRTHDAY: 2018-11-19T08:18:03.352127
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C24H17F3N2O2

SMILES: C=C(C(=O)c1cccc(OC)c1)c1nc2ccccn2c1-c1ccccc1C(F)(F)F

BIRTHDAY: 2018-11-19T08:18:03.361846
ATC: N05A
- NERVOUS SYSTEM
- PSYCHOLEPTICS
- ANTIPSYCHOTICS
Synthesis Plan
FORMULA:C32H32N2O4

SMILES: COc1ccc(C(=O)/C=C\c2cc3c(c(OC)c2)C(=O)NCCCc2cn(c4ccccc24)CCC3)cc1

BIRTHDAY: 2018-11-19T08:18:03.372282
ATC: D11A
- DERMATOLOGICALS
- OTHER DERMATOLOGICAL PREPARATIONS
- OTHER DERMATOLOGICAL PREPARATIONS
Synthesis Plan
FORMULA:C19H22O3

SMILES: C[C@@H](c1ccccc1)C(C)(C)CC(=O)c1ccc(O)c(O)c1

BIRTHDAY: 2018-11-19T08:18:03.379263
ATC: G03C
- GENITO URINARY SYSTEM AND SEX HORMONES
- SEX HORMONES AND MODULATORS OF THE GENITAL SYSTEM
- ESTROGENS
Synthesis Plan
FORMULA:C31H50N2O5

SMILES: COC(=O)[C@@]1(C(C)(C)C(C)(C)C(C)(C)C(C)(C)C(C)(C)C)CC=Cc2cncc(c2)OCC(=O)[C@H](N)OC1

BIRTHDAY: 2018-11-19T08:18:03.390731
ATC: N07B
- NERVOUS SYSTEM
- OTHER NERVOUS SYSTEM DRUGS
- DRUGS USED IN ADDICTIVE DISORDERS
Synthesis Plan
FORMULA:C27H47N3O2

SMILES: CC(C)(C)C(C)(C)C(C)(C)C(C)(C)C(C)(C)C(C)(C)C(=O)Nc1ccccc1/C(N)=N\O

BIRTHDAY: 2018-11-19T08:18:03.399254
ATC: N02B
- NERVOUS SYSTEM
- ANALGESICS
- OTHER ANALGESICS AND ANTIPYRETICS
Synthesis Plan
FORMULA:C23H38N2O2

SMILES: COC1=CC=C[C@@]2(C(C)(C)C(C)(C)C(C)(C)C(C)(C)C)C=CN=N[C@]12OC

BIRTHDAY: 2018-11-30T17:22:39.538512
ATC: V03A
- VARIOUS
- ALL OTHER THERAPEUTIC PRODUCTS
- ALL OTHER THERAPEUTIC PRODUCTS
Synthesis Plan
FORMULA:C37H30N4O3

SMILES: COc1ccc(C(=O)/C=C\c2ccc3c(c2)Cn2ccc4ccc(cc42)-c2ccnc(n2)Nc2cccc(c2)COC3)cc1

BIRTHDAY: 2018-11-30T17:22:39.577271
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C21H19F3O4S

SMILES: O=C(c1ccc(O)cc1)[C@]12CCC(O)(O)[C@](c3ccc(C(F)(F)F)cc3)(CC1)S2

BIRTHDAY: 2018-11-30T17:22:39.595361
ATC: B02A
- BLOOD AND BLOOD FORMING ORGANS
- ANTIHEMORRHAGICS
- ANTIFIBRINOLYTICS
Synthesis Plan
FORMULA:C28H33N3O3

SMILES: CCCCCCc1ccc2cc1COCC=CCOCc1cc(ccc1O)-c1ccnc(n1)N2

BIRTHDAY: 2018-11-30T17:22:39.613635
ATC: G01A
- GENITO URINARY SYSTEM AND SEX HORMONES
- GYNECOLOGICAL ANTIINFECTIVES AND ANTISEPTICS
- ANTIINFECTIVES AND ANTISEPTICS, EXCL. COMBINATIONS WITH CORTICOSTEROIDS
Synthesis Plan
FORMULA:C23H23F2N3O2

SMILES: COc1ccccc1[C@@]1(c2ccccc2C)NNCO[C@@]1(N)c1cc(F)cc(F)c1

BIRTHDAY: 2018-11-30T17:22:39.653328
ATC: C01D
- CARDIOVASCULAR SYSTEM
- CARDIAC THERAPY
- VASODILATORS USED IN CARDIAC DISEASES
Synthesis Plan
FORMULA:C28H46O4

SMILES: CCCCCCCCCCCCCCCCCCCC(=O)OCC(=O)c1ccc(O)cc1

BIRTHDAY: 2018-12-02T16:05:48.127278
ATC: D11A
- DERMATOLOGICALS
- OTHER DERMATOLOGICAL PREPARATIONS
- OTHER DERMATOLOGICAL PREPARATIONS
Synthesis Plan
FORMULA:C21H22O4

SMILES: COc1cc(/C=C\C(=O)c2ccc(C(=O)CC(C)C)cc2)ccc1O

BIRTHDAY: 2018-12-02T16:05:48.134782
ATC: A11D
- ALIMENTARY TRACT AND METABOLISM
- VITAMINS
- VITAMIN B1, PLAIN AND IN COMBINATION WITH VITAMIN B6 AND B12
Synthesis Plan
FORMULA:C26H29NO8

SMILES: CO/N=C1\C=Cc2cc(OC)c(OC)c(C(=O)/C=C\c3cc(OC)c(OC)c(OC)c3)c2OCC1

BIRTHDAY: 2018-12-02T16:05:48.145725
ATC: G01A
- GENITO URINARY SYSTEM AND SEX HORMONES
- GYNECOLOGICAL ANTIINFECTIVES AND ANTISEPTICS
- ANTIINFECTIVES AND ANTISEPTICS, EXCL. COMBINATIONS WITH CORTICOSTEROIDS
Synthesis Plan
FORMULA:C20H27N3O3

SMILES: COc1ccccc1[C@@]12CCN(CCOCCOC=CCN1)C[C@@H]2C#N

BIRTHDAY: 2018-12-02T16:05:48.154517
ATC: V03A
- VARIOUS
- ALL OTHER THERAPEUTIC PRODUCTS
- ALL OTHER THERAPEUTIC PRODUCTS
Synthesis Plan
FORMULA:C31H35N2O7P

SMILES: COc1cccc(C2=CO[P@@](=O)(OC(C)(C)C(=O)Nc3cccc(C(=O)Nc4cccc(C(C)(C)C)c4)c3)OC2)c1

BIRTHDAY: 2018-12-02T16:05:48.220778
ATC: D10A
- DERMATOLOGICALS
- ANTI-ACNE PREPARATIONS
- ANTI-ACNE PREPARATIONS FOR TOPICAL USE
Synthesis Plan
FORMULA:C21H24O7

SMILES: C=C(C(=O)c1c(OC)cc(OC)cc1OC)c1c(OC)cc(OC)cc1OC

BIRTHDAY: 2018-12-02T16:05:48.246609
ATC: C10A
- CARDIOVASCULAR SYSTEM
- LIPID MODIFYING AGENTS
- LIPID MODIFYING AGENTS, PLAIN
Synthesis Plan
FORMULA:C21H28F3NO2

SMILES: CC(C)(C)[C@H]1C[C@H]2CCC[C@@](C(=O)Nc3ccc(OC(F)(F)F)cc3)(C1)C2

BIRTHDAY: 2018-12-03T10:42:09.770624
ATC: A03F
- ALIMENTARY TRACT AND METABOLISM
- DRUGS FOR FUNCTIONAL GASTROINTESTINAL DISORDERS
- PROPULSIVES
Synthesis Plan
FORMULA:C30H53N3O3

SMILES: C[C@H](O)O/N=C(/N)c1ccccc1NC(=O)CC(C)(C)C(C)(C)C(C)(C)C(C)(C)C(C)(C)C(C)(C)C

BIRTHDAY: 2018-12-03T10:42:09.797882
ATC: A01A
- ALIMENTARY TRACT AND METABOLISM
- STOMATOLOGICAL PREPARATIONS
- STOMATOLOGICAL PREPARATIONS
Synthesis Plan
FORMULA:C29H51N3O3

SMILES: C[C@H](O)O/N=C(/N)c1cccc(NC(=O)C(C)(C)C(C)(C)C(C)(C)C(C)(C)C(C)(C)C(C)(C)C)c1

BIRTHDAY: 2018-12-03T10:42:09.833583
ATC: C07A
- CARDIOVASCULAR SYSTEM
- BETA BLOCKING AGENTS
- BETA BLOCKING AGENTS
Synthesis Plan
FORMULA:C22H23NO3

SMILES: C=C(C(=O)c1ccccc1OC)c1ccc2c(c1)N[C@@H](C(=O)C(C)C)C2

BIRTHDAY: 2018-12-03T10:42:09.866652
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C29H51N3O3

SMILES: C[C@H](O)O/N=C(\N)c1ccccc1NC(=O)C(C)(C)C(C)(C)C(C)(C)C(C)(C)C(C)(C)C(C)(C)C

BIRTHDAY: 2018-12-03T19:10:34.565561
ATC: R03D
- RESPIRATORY SYSTEM
- DRUGS FOR OBSTRUCTIVE AIRWAY DISEASES
- OTHER SYSTEMIC DRUGS FOR OBSTRUCTIVE AIRWAY DISEASES
Synthesis Plan
FORMULA:C22H21NO4S

SMILES: COC(=O)c1ccc(N2C[C@]3(C=CCO3)[C@H](Cc3ccccc3)SC2=O)cc1

BIRTHDAY: 2018-12-03T19:10:34.618804
ATC: G04C
- GENITO URINARY SYSTEM AND SEX HORMONES
- UROLOGICALS
- DRUGS USED IN BENIGN PROSTATIC HYPERTROPHY
Synthesis Plan
FORMULA:C8H6HgN

SMILES: N#Cc1ccccc1C[Hg]

BIRTHDAY: 2018-12-03T19:10:34.633544
ATC: C08C
- CARDIOVASCULAR SYSTEM
- CALCIUM CHANNEL BLOCKERS
- SELECTIVE CALCIUM CHANNEL BLOCKERS WITH MAINLY VASCULAR EFFECTS
Synthesis Plan
FORMULA:C38H35N5O5

SMILES: COc1cc(OC)cc(-c2c3cccc2-c2ccnc(n2)Nc2cccc(c2)COCC=C2N(c4ccccc4)NC(=O)[C@@]2(C)OC3)c1

BIRTHDAY: 2018-12-01T22:29:39.766386
ATC: B05A
- BLOOD AND BLOOD FORMING ORGANS
- BLOOD SUBSTITUTES AND PERFUSION SOLUTIONS
- BLOOD AND RELATED PRODUCTS
Synthesis Plan
FORMULA:C20H22O6

SMILES: C=C(C(=O)c1c(OC)cccc1OC)c1c(OC)ccc(OC)c1OC

BIRTHDAY: 2018-12-01T22:29:39.783404
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C28H24N6O5S

SMILES: C=C(C(=O)c1ccccc1OC)c1cccc2c1[C@H](C1=NN=CCS1)Oc1cncc(n1)NCNC=COC2=O

BIRTHDAY: 2018-12-01T22:29:39.797001
ATC: A03F
- ALIMENTARY TRACT AND METABOLISM
- DRUGS FOR FUNCTIONAL GASTROINTESTINAL DISORDERS
- PROPULSIVES
Synthesis Plan
FORMULA:C28H49N3O2

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

BIRTHDAY: 2018-12-01T22:29:39.805397
ATC: N02B
- NERVOUS SYSTEM
- ANALGESICS
- OTHER ANALGESICS AND ANTIPYRETICS
Synthesis Plan
FORMULA:C20H22O3

SMILES: O=C(CCCCCCC(=O)c1ccc(O)cc1)c1ccccc1

BIRTHDAY: 2018-12-01T22:29:39.812245
ATC: N05A
- NERVOUS SYSTEM
- PSYCHOLEPTICS
- ANTIPSYCHOTICS
Synthesis Plan
FORMULA:C20H22O6

SMILES: C=C(C(=O)c1cc(OC)ccc1OC)c1c(OC)ccc(OC)c1OC

BIRTHDAY: 2018-12-01T22:29:39.829902
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C31H51NO3

SMILES: CC(C)C(=O)C(=O)c1ccccc1NC(=O)CC(C)(C)C[C@@H](C)CCC(C)(C)CCCC(C)(C)C

BIRTHDAY: 2018-12-01T22:29:39.855837
ATC: M05B
- MUSCULO-SKELETAL SYSTEM
- DRUGS FOR TREATMENT OF BONE DISEASES
- DRUGS AFFECTING BONE STRUCTURE AND MINERALIZATION
Synthesis Plan
FORMULA:C20H22O6

SMILES: C=C(C(=O)c1cccc(OC)c1OC)c1c(OC)ccc(OC)c1OC

BIRTHDAY: 2018-12-01T22:29:39.873738
ATC: M01A
- MUSCULO-SKELETAL SYSTEM
- ANTIINFLAMMATORY AND ANTIRHEUMATIC PRODUCTS
- ANTIINFLAMMATORY AND ANTIRHEUMATIC PRODUCTS, NON-STEROIDS
Synthesis Plan
FORMULA:C27H47N3O

SMILES: CC(C)(C)C(C)(C)C(C)(C)C(C)(C)C(C)(C)C(C)(C)C(=O)Nc1ccccc1C(=N)N

BIRTHDAY: 2018-12-01T22:29:39.881650
ATC: C01D
- CARDIOVASCULAR SYSTEM
- CARDIAC THERAPY
- VASODILATORS USED IN CARDIAC DISEASES
Synthesis Plan