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Name | BrP-LPA |
---|---|
Molecular formula | C20H40BrO6P |
IUPAC name | [(3S)-1-bromo-4-hexadecanoyloxy-3-hydroxybutyl]phosphonic acid |
Molecular weight | 487.412 |
Hydrogen bond acceptor | 6 |
Hydrogen bond donor | 3 |
XlogP | 6.3 |
Synonyms | GTPL6985 CHEMBL3621357 SCHEMBL3055845 alpha-bromomethylene phosphonate D06IXI [ Show all ] |
Inchi Key | HLVKVWDSLLFMSX-OYKVQYDMSA-N |
Inchi ID | InChI=1S/C20H40BrO6P/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-20(23)27-17-18(22)16-19(21)28(24,25)26/h18-19,22H,2-17H2,1H3,(H2,24,25,26)/t18-,19?/m0/s1 |
PubChem CID | 16725999 |
ChEMBL | N/A |
IUPHAR | 6985 |
BindingDB | N/A |
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 |
---|---|---|---|---|---|
553868 | Lysophosphatidic acid receptor 1 | Q92633 | LPAR1 | Homo sapiens (Human) | 364 |
553867 | Lysophosphatidic acid receptor 2 | Q9JL06 | Lpar2 | Mus musculus (Mouse) | 348 |
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