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Name | CHEMBL191411 |
---|---|
Molecular formula | C34H54NO6P |
IUPAC name | [(2S)-2-(octadecanoylamino)-3-(4-phenylmethoxyphenyl)propyl] dihydrogen phosphate |
Molecular weight | 603.781 |
Hydrogen bond acceptor | 6 |
Hydrogen bond donor | 3 |
XlogP | 9.7 |
Synonyms | BDBM50170841 Phosphoric acid mono-[(S)-3-(4-benzyloxy-phenyl)-2-octadecanoylamino-propyl] ester |
Inchi Key | HCYMVUMFVDONQB-YTTGMZPUSA-N |
Inchi ID | InChI=1S/C34H54NO6P/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-19-22-34(36)35-32(29-41-42(37,38)39)27-30-23-25-33(26-24-30)40-28-31-20-17-16-18-21-31/h16-18,20-21,23-26,32H,2-15,19,22,27-29H2,1H3,(H,35,36)(H2,37,38,39)/t32-/m0/s1 |
PubChem CID | 44397968 |
ChEMBL | CHEMBL191411 |
IUPHAR | N/A |
BindingDB | 50170841 |
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 |
---|---|---|---|---|---|
111766 | Lysophosphatidic acid receptor 3 | Q9UBY5 | LPAR3 | Homo sapiens (Human) | 353 |
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