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Name | CHEMBL115131 |
---|---|
Molecular formula | C19H33NO3S |
IUPAC name | 3-amino-5-(4-octylphenyl)pentane-1-sulfonic acid |
Molecular weight | 355.537 |
Hydrogen bond acceptor | 4 |
Hydrogen bond donor | 2 |
XlogP | 2.7 |
Synonyms | SCHEMBL5472113 3-Amino-5-(4-octyl-phenyl)-pentane-1-sulfonic acid BDBM50147705 |
Inchi Key | ATISRFOLHJLTMH-UHFFFAOYSA-N |
Inchi ID | InChI=1S/C19H33NO3S/c1-2-3-4-5-6-7-8-17-9-11-18(12-10-17)13-14-19(20)15-16-24(21,22)23/h9-12,19H,2-8,13-16,20H2,1H3,(H,21,22,23) |
PubChem CID | 10309022 |
ChEMBL | CHEMBL115131 |
IUPHAR | N/A |
BindingDB | 50147705 |
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 |
---|---|---|---|---|---|
13989 | Sphingosine 1-phosphate receptor 1 | P21453 | S1PR1 | Homo sapiens (Human) | 382 |
13990 | Sphingosine 1-phosphate receptor 2 | O95136 | S1PR2 | Homo sapiens (Human) | 353 |
13988 | Sphingosine 1-phosphate receptor 3 | Q99500 | S1PR3 | Homo sapiens (Human) | 378 |
13991 | Sphingosine 1-phosphate receptor 4 | O95977 | S1PR4 | Homo sapiens (Human) | 384 |
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