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Name | CHEMBL3814527 |
---|---|
Molecular formula | C31H36NO11P |
IUPAC name | (2S)-2-amino-3-[hydroxy-[[(2R,3R)-3-[3-[3-[(3-phenoxyphenyl)methoxy]phenyl]propanoyloxy]oxan-2-yl]methoxy]phosphoryl]oxypropanoic acid |
Molecular weight | 629.599 |
Hydrogen bond acceptor | 12 |
Hydrogen bond donor | 3 |
XlogP | 0.6 |
Synonyms | BDBM50177135 |
Inchi Key | NIXMIJJLVYWVJI-ZGIBFIJWSA-N |
Inchi ID | InChI=1S/C31H36NO11P/c32-27(31(34)35)20-40-44(36,37)41-21-29-28(13-6-16-38-29)43-30(33)15-14-22-7-4-11-25(17-22)39-19-23-8-5-12-26(18-23)42-24-9-2-1-3-10-24/h1-5,7-12,17-18,27-29H,6,13-16,19-21,32H2,(H,34,35)(H,36,37)/t27-,28+,29+/m0/s1 |
PubChem CID | 127050879 |
ChEMBL | CHEMBL3814527 |
IUPHAR | N/A |
BindingDB | N/A |
DrugBank | N/A |
Structure | |
Lipinski's druglikeness | This ligand has more than 10 hydrogen bond acceptor. This ligand is heavier than 500 daltons. |
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GLASS ID | Name | UniProt | Gene | Species | Length |
---|---|---|---|---|---|
527951 | Putative P2Y purinoceptor 10 | Q8BFU7 | P2ry10 | Mus musculus (Mouse) | 328 |
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