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Ligand

NameCHEMBL2115372
Molecular formulaC16H17NO2S
IUPAC name(1R,10S)-15-methyl-14-thia-11-azatetracyclo[8.7.0.02,7.013,17]heptadeca-2,4,6,13(17),15-pentaene-4,5-diol
Molecular weight287.377
Hydrogen bond acceptor4
Hydrogen bond donor3
XlogP2.6
SynonymsCHEMBL289283
BDBM50408141
SCHEMBL7005940
2-Methyl-4,5,5aalpha,6,7,11bbeta-hexahydro-3-thia-5-aza-3H-cyclopenta[c]phenanthrene-9,10-diol
Inchi KeyOHQFGIVFMUFZJP-BLLLJJGKSA-N
Inchi IDInChI=1S/C16H17NO2S/c1-8-4-11-15(20-8)7-17-12-3-2-9-5-13(18)14(19)6-10(9)16(11)12/h4-6,12,16-19H,2-3,7H2,1H3/t12-,16+/m0/s1
PubChem CID10684714
ChEMBLN/A
IUPHARN/A
BindingDB50408141
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
241611D(1) dopamine receptorP35406Carassius auratus (Goldfish)363
241612D(1A) dopamine receptorP18901Drd1Rattus norvegicus (Rat)446
241613D(2) dopamine receptorP61169Drd2Rattus norvegicus (Rat)444

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