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Ligand

NameCHEMBL182410
Molecular formulaC25H32ClN3O3
IUPAC name3-[1-[3-(2-chloro-5-methylphenoxy)-2-hydroxyhexyl]piperidin-4-yl]-1H-benzimidazol-2-one
Molecular weight457.999
Hydrogen bond acceptor4
Hydrogen bond donor2
XlogP4.7
SynonymsBDBM50159915
1-{1-[3-(2-Chloro-5-methyl-phenoxy)-2-hydroxy-hexyl]-piperidin-4-yl}-1,3-dihydro-benzoimidazol-2-one
Inchi KeyAZPDSENEWXRPQS-UHFFFAOYSA-N
Inchi IDInChI=1S/C25H32ClN3O3/c1-3-6-23(32-24-15-17(2)9-10-19(24)26)22(30)16-28-13-11-18(12-14-28)29-21-8-5-4-7-20(21)27-25(29)31/h4-5,7-10,15,18,22-23,30H,3,6,11-14,16H2,1-2H3,(H,27,31)
PubChem CID44391133
ChEMBLCHEMBL182410
IUPHARN/A
BindingDB50159915
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: 2
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
18390Mu-type opioid receptorP35372OPRM1Homo sapiens (Human)400
18389Nociceptin receptorP41146OPRL1Homo sapiens (Human)370

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