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Name | CHEMBL115970 |
---|---|
Molecular formula | C19H32NO4P |
IUPAC name | 3-[(4-nonanoylphenyl)methylamino]propylphosphonic acid |
Molecular weight | 369.442 |
Hydrogen bond acceptor | 5 |
Hydrogen bond donor | 3 |
XlogP | 0.8 |
Synonyms | [3-(4-Nonanoyl-benzylamino)-propyl]-phosphonic acid BDBM50148416 SCHEMBL14195668 |
Inchi Key | NSEVTFLGGHULPD-UHFFFAOYSA-N |
Inchi ID | InChI=1S/C19H32NO4P/c1-2-3-4-5-6-7-9-19(21)18-12-10-17(11-13-18)16-20-14-8-15-25(22,23)24/h10-13,20H,2-9,14-16H2,1H3,(H2,22,23,24) |
PubChem CID | 10172513 |
ChEMBL | CHEMBL115970 |
IUPHAR | N/A |
BindingDB | 50148416 |
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 |
---|---|---|---|---|---|
230720 | Lysophosphatidic acid receptor 2 | Q9HBW0 | LPAR2 | Homo sapiens (Human) | 351 |
230719 | Sphingosine 1-phosphate receptor 1 | P21453 | S1PR1 | Homo sapiens (Human) | 382 |
230721 | Sphingosine 1-phosphate receptor 2 | O95136 | S1PR2 | Homo sapiens (Human) | 353 |
230722 | Sphingosine 1-phosphate receptor 3 | Q99500 | S1PR3 | Homo sapiens (Human) | 378 |
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