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Name | CHEMBL245895 |
---|---|
Molecular formula | C25H24ClNO4S |
IUPAC name | 3-[[4-[2-[1-(2-chlorophenyl)ethoxycarbonylamino]phenyl]phenyl]methylsulfanyl]propanoic acid |
Molecular weight | 469.98 |
Hydrogen bond acceptor | 5 |
Hydrogen bond donor | 2 |
XlogP | 5.6 |
Synonyms | BDBM50211652 3-{2''-[1-(2-chloro-phenyl)-ethoxycarbonylamino]-biphenyl-4-ylmethylsulfanyl}-propionic acid |
Inchi Key | AVXXLUPPYOJIOV-UHFFFAOYSA-N |
Inchi ID | InChI=1S/C25H24ClNO4S/c1-17(20-6-2-4-8-22(20)26)31-25(30)27-23-9-5-3-7-21(23)19-12-10-18(11-13-19)16-32-15-14-24(28)29/h2-13,17H,14-16H2,1H3,(H,27,30)(H,28,29) |
PubChem CID | 44441086 |
ChEMBL | CHEMBL245895 |
IUPHAR | N/A |
BindingDB | 50211652 |
DrugBank | N/A |
Structure | |
Lipinski's druglikeness | This ligand has a partition coefficient log P greater than 5. |
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GLASS ID | Name | UniProt | Gene | Species | Length |
---|---|---|---|---|---|
15755 | Lysophosphatidic acid receptor 1 | P61794 | Lpar1 | Rattus norvegicus (Rat) | 364 |
15756 | Lysophosphatidic acid receptor 1 | Q92633 | LPAR1 | Homo sapiens (Human) | 364 |
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