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Ligand

NameCHEMBL143029
Molecular formulaC29H31ClN2O2
IUPAC name5-[4-(4-chlorophenyl)-4-hydroxypiperidin-1-yl]-2-(2-phenylmethoxyphenyl)pentanenitrile
Molecular weight475.029
Hydrogen bond acceptor4
Hydrogen bond donor1
XlogP5.6
SynonymsSCHEMBL9107447
Inchi KeyADQMDQVZOSPWJP-UHFFFAOYSA-N
Inchi IDInChI=1S/C29H31ClN2O2/c30-26-14-12-25(13-15-26)29(33)16-19-32(20-17-29)18-6-9-24(21-31)27-10-4-5-11-28(27)34-22-23-7-2-1-3-8-23/h1-5,7-8,10-15,24,33H,6,9,16-20,22H2
PubChem CID10576513
ChEMBLCHEMBL143029
IUPHARN/A
BindingDBN/A
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: 1
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GLASS IDNameUniProtGeneSpeciesLength
2973C-C chemokine receptor type 1P32246CCR1Homo sapiens (Human)355

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