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Ligand

NameCHEMBL2182031
Molecular formulaC29H25F3N4O4
IUPAC name1-[4-[4-[4-methyl-5-[[(1R)-1-[2-(trifluoromethyl)phenyl]ethoxy]carbonylamino]triazol-1-yl]phenyl]phenyl]cyclopropane-1-carboxylic acid
Molecular weight550.538
Hydrogen bond acceptor9
Hydrogen bond donor2
XlogP5.9
SynonymsSCHEMBL16697485
BDBM50398121
Inchi KeyLDQIIGRTGGWHMN-GOSISDBHSA-N
Inchi IDInChI=1S/C29H25F3N4O4/c1-17-25(33-27(39)40-18(2)23-5-3-4-6-24(23)29(30,31)32)36(35-34-17)22-13-9-20(10-14-22)19-7-11-21(12-8-19)28(15-16-28)26(37)38/h3-14,18H,15-16H2,1-2H3,(H,33,39)(H,37,38)/t18-/m1/s1
PubChem CID71453959
ChEMBLCHEMBL2182031
IUPHARN/A
BindingDB50398121
DrugBankN/A

Structure

SDF download

2D structure
Lipinski's druglikenessThis ligand is heavier than 500 daltons.
This ligand has a partition coefficient log P greater than 5.

Known GPCRs

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Total entries: 2
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
184848Lysophosphatidic acid receptor 1Q92633LPAR1Homo sapiens (Human)364
184849Lysophosphatidic acid receptor 3Q9UBY5LPAR3Homo sapiens (Human)353

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