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Name | CHEMBL2182031 |
---|---|
Molecular formula | C29H25F3N4O4 |
IUPAC name | 1-[4-[4-[4-methyl-5-[[(1R)-1-[2-(trifluoromethyl)phenyl]ethoxy]carbonylamino]triazol-1-yl]phenyl]phenyl]cyclopropane-1-carboxylic acid |
Molecular weight | 550.538 |
Hydrogen bond acceptor | 9 |
Hydrogen bond donor | 2 |
XlogP | 5.9 |
Synonyms | SCHEMBL16697485 BDBM50398121 |
Inchi Key | LDQIIGRTGGWHMN-GOSISDBHSA-N |
Inchi ID | InChI=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 CID | 71453959 |
ChEMBL | CHEMBL2182031 |
IUPHAR | N/A |
BindingDB | 50398121 |
DrugBank | N/A |
Structure | |
Lipinski's druglikeness | This ligand is heavier than 500 daltons. This ligand has a partition coefficient log P greater than 5. |
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GLASS ID | Name | UniProt | Gene | Species | Length |
---|---|---|---|---|---|
184848 | Lysophosphatidic acid receptor 1 | Q92633 | LPAR1 | Homo sapiens (Human) | 364 |
184849 | Lysophosphatidic acid receptor 3 | Q9UBY5 | LPAR3 | Homo sapiens (Human) | 353 |
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