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Name | CHEMBL3814440 |
---|---|
Molecular formula | C31H36NO11P |
IUPAC name | (2S)-2-amino-3-[hydroxy-[(2R,3R)-2-[3-[4-[(3-phenoxyphenyl)methoxy]phenyl]propanoyloxymethyl]oxan-3-yl]oxyphosphoryl]oxypropanoic acid |
Molecular weight | 629.599 |
Hydrogen bond acceptor | 12 |
Hydrogen bond donor | 3 |
XlogP | 0.6 |
Synonyms | BDBM50177134 |
Inchi Key | GMANHEODTFBTTG-ZGIBFIJWSA-N |
Inchi ID | InChI=1S/C31H36NO11P/c32-27(31(34)35)20-41-44(36,37)43-28-10-5-17-38-29(28)21-40-30(33)16-13-22-11-14-24(15-12-22)39-19-23-6-4-9-26(18-23)42-25-7-2-1-3-8-25/h1-4,6-9,11-12,14-15,18,27-29H,5,10,13,16-17,19-21,32H2,(H,34,35)(H,36,37)/t27-,28+,29+/m0/s1 |
PubChem CID | 127050878 |
ChEMBL | CHEMBL3814440 |
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 |
---|---|---|---|---|---|
524436 | Putative P2Y purinoceptor 10 | Q8BFU7 | P2ry10 | Mus musculus (Mouse) | 328 |
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