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Ligand

NameCHEMBL543970
Molecular formulaC20H28BrN3OS
IUPAC name2-(3-isothiocyanatophenyl)-N-methyl-N-[(1S,2S)-2-pyrrolidin-1-ylcyclohexyl]acetamide;hydrobromide
Molecular weight438.428
Hydrogen bond acceptor4
Hydrogen bond donor1
XlogPNone
SynonymsN/A
Inchi KeyDEKFHJMGOPKPKQ-HLRBRJAUSA-N
Inchi IDInChI=1S/C20H27N3OS.BrH/c1-22(18-9-2-3-10-19(18)23-11-4-5-12-23)20(24)14-16-7-6-8-17(13-16)21-15-25;/h6-8,13,18-19H,2-5,9-12,14H2,1H3;1H/t18-,19-;/m0./s1
PubChem CID14632725
ChEMBLCHEMBL543970
IUPHARN/A
BindingDBN/A
DrugBankN/A

Structure

SDF download

2D structure
Lipinski's druglikenessPartition coefficient log P of this ligand is not available.

Known GPCRs

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Total entries: 4
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
57840Delta-type opioid receptorP33533Oprd1Rattus norvegicus (Rat)372
57839Kappa-type opioid receptorP41144OPRK1Cavia porcellus (Guinea pig)380
57841Kappa-type opioid receptorP34975Oprk1Rattus norvegicus (Rat)380
57838Mu-type opioid receptorP33535Oprm1Rattus norvegicus (Rat)398

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