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Name | CHEMBL119382 |
---|---|
Molecular formula | C18H30N5O3P |
IUPAC name | 3-[[4-(2-heptyltetrazol-5-yl)phenyl]methylamino]propylphosphonic acid |
Molecular weight | 395.444 |
Hydrogen bond acceptor | 7 |
Hydrogen bond donor | 3 |
XlogP | 0.2 |
Synonyms | {3-[4-(2-Heptyl-2H-tetrazol-5-yl)-benzylamino]-propyl}-phosphonic acid BDBM50148436 |
Inchi Key | JNAQEIPNFVZKSC-UHFFFAOYSA-N |
Inchi ID | InChI=1S/C18H30N5O3P/c1-2-3-4-5-6-13-23-21-18(20-22-23)17-10-8-16(9-11-17)15-19-12-7-14-27(24,25)26/h8-11,19H,2-7,12-15H2,1H3,(H2,24,25,26) |
PubChem CID | 44344298 |
ChEMBL | CHEMBL119382 |
IUPHAR | N/A |
BindingDB | 50148436 |
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 |
---|---|---|---|---|---|
154929 | Lysophosphatidic acid receptor 2 | Q9HBW0 | LPAR2 | Homo sapiens (Human) | 351 |
154927 | Sphingosine 1-phosphate receptor 1 | P21453 | S1PR1 | Homo sapiens (Human) | 382 |
154928 | Sphingosine 1-phosphate receptor 2 | O95136 | S1PR2 | Homo sapiens (Human) | 353 |
154926 | Sphingosine 1-phosphate receptor 3 | Q99500 | S1PR3 | Homo sapiens (Human) | 378 |
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