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Ligand

NameMLS000392370
Molecular formulaC22H17Cl2NO3
IUPAC name[2-(3-chloro-4-methylanilino)-2-oxo-1-phenylethyl] 2-chlorobenzoate
Molecular weight414.282
Hydrogen bond acceptor3
Hydrogen bond donor1
XlogP6.0
Synonyms2-chlorobenzoic acid [2-(3-chloro-4-methyl-anilino)-2-keto-1-phenyl-ethyl] ester
cid_3513763
AC1MR7TE
[2-(3-chloro-4-methylanilino)-2-oxo-1-phenylethyl] 2-chlorobenzoate
2-chlorobenzoic acid [2-(3-chloro-4-methylanilino)-2-oxo-1-phenylethyl] ester
[ Show all ]
Inchi KeyFVHMFLPNHMJOMS-UHFFFAOYSA-N
Inchi IDInChI=1S/C22H17Cl2NO3/c1-14-11-12-16(13-19(14)24)25-21(26)20(15-7-3-2-4-8-15)28-22(27)17-9-5-6-10-18(17)23/h2-13,20H,1H3,(H,25,26)
PubChem CID3513763
ChEMBLCHEMBL1330917
IUPHARN/A
BindingDB31362
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: 3
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
881505-hydroxytryptamine receptor 1EP28566HTR1EHomo sapiens (Human)365
88148Glucagon-like peptide 1 receptorP43220GLP1RHomo sapiens (Human)463
88149Sphingosine 1-phosphate receptor 3Q99500S1PR3Homo sapiens (Human)378

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