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Ligand

NameCHEMBL40950
Molecular formulaC15H15NO2S
IUPAC name(1R,10S)-14-thia-11-azatetracyclo[8.7.0.02,7.013,17]heptadeca-2,4,6,13(17),15-pentaene-4,5-diol
Molecular weight273.35
Hydrogen bond acceptor4
Hydrogen bond donor3
XlogP2.2
Synonyms(5aS,11bR)-4,5,5a,6,7,11b-Hexahydro-3-thia-5-aza-cyclopenta[c]phenanthrene-9,10-diol
BDBM50057843
SCHEMBL7010208
4,5,5aalpha,6,7,11bbeta-Hexahydro-3-thia-5-aza-3H-cyclopenta[c]phenanthrene-9,10-diol
Inchi KeyUUGICWXWTLQAGO-NHYWBVRUSA-N
Inchi IDInChI=1S/C15H15NO2S/c17-12-5-8-1-2-11-15(10(8)6-13(12)18)9-3-4-19-14(9)7-16-11/h3-6,11,15-18H,1-2,7H2/t11-,15-/m0/s1
PubChem CID10588326
ChEMBLCHEMBL40950
IUPHARN/A
BindingDB50057843
DrugBankN/A

Structure

SDF download

2D structure
Lipinski's druglikenessThis ligand satisfies Lipinski's rule of five.

Known GPCRs

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Total entries: 3
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
345780D(1) dopamine receptorP35406Carassius auratus (Goldfish)363
345782D(1A) dopamine receptorP18901Drd1Rattus norvegicus (Rat)446
345781D(2) dopamine receptorP61169Drd2Rattus norvegicus (Rat)444

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