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Ligand

NameCHEMBL71397
Molecular formulaC29H32Cl2N2O2
IUPAC nameN-[2-(3,4-dichlorophenyl)-4-(4-hydroxy-4-phenylpiperidin-1-yl)butyl]-N-methylbenzamide
Molecular weight511.487
Hydrogen bond acceptor3
Hydrogen bond donor1
XlogP5.9
SynonymsN-[2-(3,4-Dichloro-phenyl)-4-(4-hydroxy-4-phenyl-piperidin-1-yl)-butyl]-N-methyl-benzamide
N-[2-(3,4-Dichlorophenyl)-4-(4-hydroxy-4-phenylpiperidino)butyl]-N-methylbenzamide
BDBM50129513
KBIKENJDJYPBNS-UHFFFAOYSA-N
SCHEMBL8870973
Inchi KeyKBIKENJDJYPBNS-UHFFFAOYSA-N
Inchi IDInChI=1S/C29H32Cl2N2O2/c1-32(28(34)22-8-4-2-5-9-22)21-24(23-12-13-26(30)27(31)20-23)14-17-33-18-15-29(35,16-19-33)25-10-6-3-7-11-25/h2-13,20,24,35H,14-19,21H2,1H3
PubChem CID18964186
ChEMBLCHEMBL71397
IUPHARN/A
BindingDB50129513
DrugBankN/A

Structure

SDF download

2D structure
Lipinski's druglikenessThis ligand is heavier than 500 daltons.
This ligand has a partition coefficient log P greater than 5.

Known GPCRs

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Total entries: 4
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
165087Substance-K receptorP05363TACR2Bos taurus (Bovine)384
165088Substance-K receptorP21452TACR2Homo sapiens (Human)398
165089Substance-K receptorP16610Tacr2Rattus norvegicus (Rat)390
165086Substance-P receptorP25103TACR1Homo sapiens (Human)407

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