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Ligand

NameCHEMBL17463
Molecular formulaC21H23ClN2O4S
IUPAC name4-[5-chloro-1-[(4-methylsulfonylphenyl)methyl]benzimidazol-2-yl]-3,3-dimethylbutanoic acid
Molecular weight434.935
Hydrogen bond acceptor5
Hydrogen bond donor1
XlogP3.9
Synonyms5-Chloro-1-(4-methylsulfonylbenzyl)-beta,beta-dimethyl-1H-benzimidazole-2-butanoic acid
SCHEMBL9683468
Inchi KeyBCEPEEWOCMSYSV-UHFFFAOYSA-N
Inchi IDInChI=1S/C21H23ClN2O4S/c1-21(2,12-20(25)26)11-19-23-17-10-15(22)6-9-18(17)24(19)13-14-4-7-16(8-5-14)29(3,27)28/h4-10H,11-13H2,1-3H3,(H,25,26)
PubChem CID14953099
ChEMBLCHEMBL17463
IUPHARN/A
BindingDBN/A
DrugBankN/A

Structure

SDF download

2D structure
Lipinski's druglikenessThis ligand satisfies Lipinski's rule of five.

Known GPCRs

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Total entries: 1
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
20100Thromboxane A2 receptorP21731TBXA2RHomo sapiens (Human)343

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