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Ligand

NameCHEMBL2182030
Molecular formulaC28H25FN4O4
IUPAC name1-[4-[4-[5-[[(1R)-1-(2-fluorophenyl)ethoxy]carbonylamino]-4-methyltriazol-1-yl]phenyl]phenyl]cyclopropane-1-carboxylic acid
Molecular weight500.53
Hydrogen bond acceptor7
Hydrogen bond donor2
XlogP5.1
SynonymsSCHEMBL16697769
BDBM50398122
DHWSJRFMKGNOLK-GOSISDBHSA-N
1-(4'-{5-[(R)-1-(2-fluoro-phenyl)ethoxycarbonylamino]-4-methyl-[1,2,3]triazol-1-yl}-biphenyl-4-yl)-cyclopropanecarboxylic acid
Inchi KeyDHWSJRFMKGNOLK-GOSISDBHSA-N
Inchi IDInChI=1S/C28H25FN4O4/c1-17-25(30-27(36)37-18(2)23-5-3-4-6-24(23)29)33(32-31-17)22-13-9-20(10-14-22)19-7-11-21(12-8-19)28(15-16-28)26(34)35/h3-14,18H,15-16H2,1-2H3,(H,30,36)(H,34,35)/t18-/m1/s1
PubChem CID71461120
ChEMBLCHEMBL2182030
IUPHARN/A
BindingDB50398122
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
60441Lysophosphatidic acid receptor 1Q92633LPAR1Homo sapiens (Human)364
60442Lysophosphatidic acid receptor 3Q9UBY5LPAR3Homo sapiens (Human)353

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