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Ligand

NameICIG 864
Molecular formulaC21H22N2O
IUPAC name1-benzyl-3-(1H-indol-3-ylmethyl)piperidin-4-one
Molecular weight318.42
Hydrogen bond acceptor2
Hydrogen bond donor1
XlogP3.3
SynonymsBDBM50283960
1-benzyl-3-(1H-indol-3-ylmethyl)piperidin-4-one
CHEMBL151990
52336-92-2
LS-117216
[ Show all ]
Inchi KeyYDRMUTOHCRZGCL-UHFFFAOYSA-N
Inchi IDInChI=1S/C21H22N2O/c24-21-10-11-23(14-16-6-2-1-3-7-16)15-18(21)12-17-13-22-20-9-5-4-8-19(17)20/h1-9,13,18,22H,10-12,14-15H2
PubChem CID3040489
ChEMBLCHEMBL151990
IUPHARN/A
BindingDB50283960
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
407614Cholecystokinin receptor type AP30551CckarRattus norvegicus (Rat)444
407616Neuromedin-K receptorP30098TACR3Cavia porcellus (Guinea pig)440
407615Substance-K receptorP51144TACR2Mesocricetus auratus (Golden hamster)384

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