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Ligand

NameCHEMBL312173
Molecular formulaC34H40ClN3O5
IUPAC name1-[2-[3-(4-chlorophenyl)-1-(3,4,5-trimethoxybenzoyl)pyrrolidin-3-yl]ethyl]-4-phenylpiperidine-4-carboxamide
Molecular weight606.16
Hydrogen bond acceptor6
Hydrogen bond donor1
XlogP5.1
Synonyms1-{2-[3-(4-Chloro-phenyl)-1-(3,4,5-trimethoxy-benzoyl)-pyrrolidin-3-yl]-ethyl}-4-phenyl-piperidine-4-carboxylic acid amide
SIJRUMGCKUFQJL-UHFFFAOYSA-N
1-[2-[3-(4-chloro-phenyl)-1-(3,4,5-trimethoxy-benzoyl)-pyrrolidin-3-yl]-ethyl]-4-phenyl-piperidine-4-carboxylic acid amide
BDBM50290311
SCHEMBL8636991
Inchi KeySIJRUMGCKUFQJL-UHFFFAOYSA-N
Inchi IDInChI=1S/C34H40ClN3O5/c1-41-28-21-24(22-29(42-2)30(28)43-3)31(39)38-20-14-33(23-38,25-9-11-27(35)12-10-25)13-17-37-18-15-34(16-19-37,32(36)40)26-7-5-4-6-8-26/h4-12,21-22H,13-20,23H2,1-3H3,(H2,36,40)
PubChem CID44319355
ChEMBLCHEMBL312173
IUPHARN/A
BindingDB50290311
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: 2
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
315122Substance-K receptorP30549Tacr2Mus musculus (Mouse)384
315121Substance-P receptorP30547TACR1Cavia porcellus (Guinea pig)407

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