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Ligand

NameCHEMBL3966602
Molecular formulaC30H41N3O2
IUPAC name1-[[3-[(4-tert-butylbenzoyl)amino]phenyl]methyl]-N-cyclohexylpiperidine-4-carboxamide
Molecular weight475.677
Hydrogen bond acceptor3
Hydrogen bond donor2
XlogP5.8
SynonymsBDBM243513
US9428456, 1.032
Inchi KeyBQDTVUPBSBGUGJ-UHFFFAOYSA-N
Inchi IDInChI=1S/C30H41N3O2/c1-30(2,3)25-14-12-23(13-15-25)28(34)32-27-11-7-8-22(20-27)21-33-18-16-24(17-19-33)29(35)31-26-9-5-4-6-10-26/h7-8,11-15,20,24,26H,4-6,9-10,16-19,21H2,1-3H3,(H,31,35)(H,32,34)
PubChem CID129625958
ChEMBLCHEMBL3966602
IUPHARN/A
BindingDB243513
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
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
534021Atypical chemokine receptor 3P25106ACKR3Homo sapiens (Human)362

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