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Name | CHEMBL119256 |
---|---|
Molecular formula | C18H32NO3P |
IUPAC name | 3-[(4-octylphenyl)methylamino]propylphosphonic acid |
Molecular weight | 341.432 |
Hydrogen bond acceptor | 4 |
Hydrogen bond donor | 3 |
XlogP | 1.6 |
Synonyms | BDBM50148418 SCHEMBL14195630 [3-(4-Octyl-benzylamino)-propyl]-phosphonic acid |
Inchi Key | HXDPHSXYLHIVSE-UHFFFAOYSA-N |
Inchi ID | InChI=1S/C18H32NO3P/c1-2-3-4-5-6-7-9-17-10-12-18(13-11-17)16-19-14-8-15-23(20,21)22/h10-13,19H,2-9,14-16H2,1H3,(H2,20,21,22) |
PubChem CID | 10149985 |
ChEMBL | CHEMBL119256 |
IUPHAR | N/A |
BindingDB | 50148418 |
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 |
---|---|---|---|---|---|
126104 | Lysophosphatidic acid receptor 2 | Q9HBW0 | LPAR2 | Homo sapiens (Human) | 351 |
126105 | Sphingosine 1-phosphate receptor 1 | P21453 | S1PR1 | Homo sapiens (Human) | 382 |
126103 | Sphingosine 1-phosphate receptor 2 | O95136 | S1PR2 | Homo sapiens (Human) | 353 |
126106 | Sphingosine 1-phosphate receptor 3 | Q99500 | S1PR3 | Homo sapiens (Human) | 378 |
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