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Name | CHEMBL92452 |
---|---|
Molecular formula | C24H34NO6P |
IUPAC name | [2-(octanoylamino)-3-(4-phenylmethoxyphenyl)propyl] dihydrogen phosphate |
Molecular weight | 463.511 |
Hydrogen bond acceptor | 6 |
Hydrogen bond donor | 3 |
XlogP | 4.2 |
Synonyms | BDBM50146228 Phosphoric acid mono-[3-(4-benzyloxy-phenyl)-2-octanoylamino-propyl] ester |
Inchi Key | KVCPOUHIDCPFLV-UHFFFAOYSA-N |
Inchi ID | InChI=1S/C24H34NO6P/c1-2-3-4-5-9-12-24(26)25-22(19-31-32(27,28)29)17-20-13-15-23(16-14-20)30-18-21-10-7-6-8-11-21/h6-8,10-11,13-16,22H,2-5,9,12,17-19H2,1H3,(H,25,26)(H2,27,28,29) |
PubChem CID | 44325214 |
ChEMBL | CHEMBL92452 |
IUPHAR | N/A |
BindingDB | 50146228 |
DrugBank | N/A |
Structure | |
Lipinski's druglikeness | This ligand satisfies Lipinski's rule of five. |
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GLASS ID | Name | UniProt | Gene | Species | Length |
---|---|---|---|---|---|
179006 | Lysophosphatidic acid receptor 1 | Q92633 | LPAR1 | Homo sapiens (Human) | 364 |
179007 | Lysophosphatidic acid receptor 3 | Q9UBY5 | LPAR3 | Homo sapiens (Human) | 353 |
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