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Ligand

NameCHEMBL1257733
Molecular formulaC24H23BrN2O2S
IUPAC name2-(4-bromophenyl)-N-[(6,7-dimethoxy-2-thiophen-3-ylquinolin-3-yl)methyl]ethanamine
Molecular weight483.424
Hydrogen bond acceptor5
Hydrogen bond donor1
XlogP5.5
SynonymsBDBM50327542
SCHEMBL4743290
2-(4-bromophenyl)-n-((6,7-dimethoxy-2-(thiophen-3-yl)quinolin-3-yl)methyl)ethanamine
Inchi KeyASQJSLCJOKTDDN-UHFFFAOYSA-N
Inchi IDInChI=1S/C24H23BrN2O2S/c1-28-22-12-18-11-19(14-26-9-7-16-3-5-20(25)6-4-16)24(17-8-10-30-15-17)27-21(18)13-23(22)29-2/h3-6,8,10-13,15,26H,7,9,14H2,1-2H3
PubChem CID52945575
ChEMBLCHEMBL1257733
IUPHARN/A
BindingDB50327542
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: 2
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
13427G-protein coupled bile acid receptor 1Q80SS6Gpbar1Mus musculus (Mouse)329
13428G-protein coupled bile acid receptor 1Q8TDU6GPBAR1Homo sapiens (Human)330

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