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Ligand

NameCHEMBL590399
Molecular formulaC25H20ClNO3S
IUPAC name2-[2-benzhydryl-4-(5-chloro-2-methoxyphenyl)-1,3-thiazol-5-yl]acetic acid
Molecular weight449.949
Hydrogen bond acceptor5
Hydrogen bond donor1
XlogP6.1
SynonymsBDBM50309289
SCHEMBL5060666
2-(2-benzhydryl-4-(5-chloro-2-methoxyphenyl)thiazol-5-yl)acetic acid
Inchi KeyAIXRYCLEZGOJML-UHFFFAOYSA-N
Inchi IDInChI=1S/C25H20ClNO3S/c1-30-20-13-12-18(26)14-19(20)24-21(15-22(28)29)31-25(27-24)23(16-8-4-2-5-9-16)17-10-6-3-7-11-17/h2-14,23H,15H2,1H3,(H,28,29)
PubChem CID46230284
ChEMBLCHEMBL590399
IUPHARN/A
BindingDB50309289
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
6636Prostaglandin D2 receptor 2Q9Y5Y4PTGDR2Homo sapiens (Human)395

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