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Ligand

NameCHEMBL358863
Molecular formulaC21H24N2O
IUPAC name(3S)-1-benzyl-3-(1H-indol-3-ylmethyl)piperidin-4-ol
Molecular weight320.436
Hydrogen bond acceptor2
Hydrogen bond donor2
XlogP3.6
SynonymsBDBM50283966
(S)-1-Benzyl-3-(1H-indol-3-ylmethyl)-piperidin-4-ol
Inchi KeyPJLJATQPGLLHMM-YMXDCFFPSA-N
Inchi IDInChI=1S/C21H24N2O/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/h1-9,13,18,21-22,24H,10-12,14-15H2/t18-,21?/m0/s1
PubChem CID44366589
ChEMBLCHEMBL358863
IUPHARN/A
BindingDB50283966
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: 1
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GLASS IDNameUniProtGeneSpeciesLength
261244Neuromedin-K receptorP30098TACR3Cavia porcellus (Guinea pig)440

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