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Name | CHEMBL1086170 |
---|---|
Molecular formula | C19H34NO4P |
IUPAC name | [(3S)-3-amino-5-(4-heptoxyphenyl)-3-methylpentyl]phosphonic acid |
Molecular weight | 371.458 |
Hydrogen bond acceptor | 5 |
Hydrogen bond donor | 3 |
XlogP | 0.9 |
Synonyms | BDBM50313501 (S)-3-amino-5-(4-(heptyloxy)phenyl)-3-methylpentylphosphonic acid |
Inchi Key | CKQNWRXINGQZFU-IBGZPJMESA-N |
Inchi ID | InChI=1S/C19H34NO4P/c1-3-4-5-6-7-15-24-18-10-8-17(9-11-18)12-13-19(2,20)14-16-25(21,22)23/h8-11H,3-7,12-16,20H2,1-2H3,(H2,21,22,23)/t19-/m0/s1 |
PubChem CID | 46881875 |
ChEMBL | CHEMBL1086170 |
IUPHAR | N/A |
BindingDB | 50313501 |
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 |
---|---|---|---|---|---|
44331 | Sphingosine 1-phosphate receptor 1 | P21453 | S1PR1 | Homo sapiens (Human) | 382 |
44328 | Sphingosine 1-phosphate receptor 2 | O95136 | S1PR2 | Homo sapiens (Human) | 353 |
44330 | Sphingosine 1-phosphate receptor 3 | Q99500 | S1PR3 | Homo sapiens (Human) | 378 |
44329 | Sphingosine 1-phosphate receptor 4 | O95977 | S1PR4 | Homo sapiens (Human) | 384 |
44327 | Sphingosine 1-phosphate receptor 5 | Q9H228 | S1PR5 | Homo sapiens (Human) | 398 |
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