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Ligand

NameCHEMBL575161
Molecular formulaC25H20N2O4S
IUPAC name2-[[2-(1-benzothiophene-2-carbonylamino)benzoyl]amino]-3-phenylpropanoic acid
Molecular weight444.505
Hydrogen bond acceptor5
Hydrogen bond donor3
XlogP5.5
SynonymsBDBM50298596
(+/-)-2-(2-(benzo[b]thiophene-2-carboxamido)benzamido)-3-phenylpropanoic acid
Inchi KeyAFTWTNFGJVGUOC-UHFFFAOYSA-N
Inchi IDInChI=1S/C25H20N2O4S/c28-23(27-20(25(30)31)14-16-8-2-1-3-9-16)18-11-5-6-12-19(18)26-24(29)22-15-17-10-4-7-13-21(17)32-22/h1-13,15,20H,14H2,(H,26,29)(H,27,28)(H,30,31)
PubChem CID11442153
ChEMBLCHEMBL575161
IUPHARN/A
BindingDB50298596
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: 1
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
4491Cholecystokinin receptor type AP30551CckarRattus norvegicus (Rat)444

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