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Name | BDBM50303332 |
---|---|
Molecular formula | C12H15N3O12P2-2 |
IUPAC name | [2-cyanoethoxy(oxido)phosphoryl] [(2R,3S,4R,5R)-5-(2,4-dioxopyrimidin-1-yl)-3,4-dihydroxyoxolan-2-yl]methyl phosphate |
Molecular weight | 455.209 |
Hydrogen bond acceptor | 13 |
Hydrogen bond donor | 3 |
XlogP | -4.7 |
Synonyms | Diphosphoric Acid 1-beta-(2-Cyanoethyl)Ester 2-(Uridine-5''-yl)ester, di ammonium Salt |
Inchi Key | WDMLAXZJWYFTMB-QCNRFFRDSA-L |
Inchi ID | InChI=1S/C12H17N3O12P2/c13-3-1-5-24-28(20,21)27-29(22,23)25-6-7-9(17)10(18)11(26-7)15-4-2-8(16)14-12(15)19/h2,4,7,9-11,17-18H,1,5-6H2,(H,20,21)(H,22,23)(H,14,16,19)/p-2/t7-,9-,10-,11-/m1/s1 |
PubChem CID | 91933946 |
ChEMBL | N/A |
IUPHAR | N/A |
BindingDB | 50303332 |
DrugBank | N/A |
Structure | |
Lipinski's druglikeness | This ligand has more than 10 hydrogen bond acceptor. |
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GLASS ID | Name | UniProt | Gene | Species | Length |
---|---|---|---|---|---|
370725 | P2Y purinoceptor 14 | Q15391 | P2RY14 | Homo sapiens (Human) | 338 |
370726 | P2Y purinoceptor 6 | Q15077 | P2RY6 | Homo sapiens (Human) | 328 |
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