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Name | CHEMBL46754 |
---|---|
Molecular formula | C37H56NO5PS |
IUPAC name | (2,5-ditert-butyl-4-dodecoxyphenyl) [3-[(5-methyl-1,3-thiazol-3-ium-3-yl)methyl]phenyl] phosphate |
Molecular weight | 657.891 |
Hydrogen bond acceptor | 6 |
Hydrogen bond donor | 0 |
XlogP | 12.6 |
Synonyms | BDBM50006082 3-{3-[(2,5-Di-tert-butyl-4-dodecyloxy-phenoxy)-hydroxy-phosphoryloxy]-benzyl}-5-methyl-thiazol-3-ium |
Inchi Key | ABJVOKFFSVZWAP-UHFFFAOYSA-N |
Inchi ID | InChI=1S/C37H56NO5PS/c1-9-10-11-12-13-14-15-16-17-18-22-41-34-24-33(37(6,7)8)35(25-32(34)36(3,4)5)43-44(39,40)42-31-21-19-20-30(23-31)27-38-26-29(2)45-28-38/h19-21,23-26,28H,9-18,22,27H2,1-8H3 |
PubChem CID | 14992453 |
ChEMBL | CHEMBL46754 |
IUPHAR | N/A |
BindingDB | 50006082 |
DrugBank | N/A |
Structure | |
Lipinski's druglikeness | This ligand is heavier than 500 daltons. This ligand has a partition coefficient log P greater than 5. |
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GLASS ID | Name | UniProt | Gene | Species | Length |
---|---|---|---|---|---|
916 | Platelet-activating factor receptor | P21556 | PTAFR | Cavia porcellus (Guinea pig) | 342 |
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