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Ligand

NameCHEMBL2113273
Molecular formulaC24H41N3O
IUPAC name(3aR,7aR)-1-[1-(1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalen-2-yl)piperidin-4-yl]-3-ethyl-3a,4,5,6,7,7a-hexahydrobenzimidazol-2-one
Molecular weight387.612
Hydrogen bond acceptor2
Hydrogen bond donor0
XlogP5.2
SynonymsBDBM50404326
Inchi KeyAEGKEQPSPQTHKK-HSJBNPAXSA-N
Inchi IDInChI=1S/C24H41N3O/c1-2-26-22-9-5-6-10-23(22)27(24(26)28)20-13-15-25(16-14-20)21-12-11-18-7-3-4-8-19(18)17-21/h18-23H,2-17H2,1H3/t18?,19?,21?,22-,23-/m1/s1
PubChem CID10178311
ChEMBLCHEMBL2113273
IUPHARN/A
BindingDB50404326
DrugBankN/A

Structure

SDF download

2D structure
Lipinski's druglikenessThis ligand has a partition coefficient log P greater than 5.

Known GPCRs

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Total entries: 3
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
3437Kappa-type opioid receptorP41145OPRK1Homo sapiens (Human)380
3439Mu-type opioid receptorP35372OPRM1Homo sapiens (Human)400
3438Nociceptin receptorP41146OPRL1Homo sapiens (Human)370

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