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Ligand

NameCHEMBL3930966
Molecular formulaC24H23ClN2O5S
IUPAC name2-[4-chloro-2-[(4R)-5-[(2,4-dimethylphenyl)methoxycarbonyl]-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-4-yl]phenoxy]acetic acid
Molecular weight486.967
Hydrogen bond acceptor7
Hydrogen bond donor1
XlogP4.9
SynonymsUS9169270, 63
BDBM189191
SCHEMBL15544182
Inchi KeyASGKCKOWDMEKAL-JOCHJYFZSA-N
Inchi IDInChI=1S/C24H23ClN2O5S/c1-14-3-4-16(15(2)9-14)11-32-24(30)27-8-7-19-23(33-13-26-19)22(27)18-10-17(25)5-6-20(18)31-12-21(28)29/h3-6,9-10,13,22H,7-8,11-12H2,1-2H3,(H,28,29)/t22-/m1/s1
PubChem CID90021802
ChEMBLCHEMBL3930966
IUPHARN/A
BindingDB189191
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
517387Prostaglandin D2 receptor 2Q9Y5Y4PTGDR2Homo sapiens (Human)395

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