MRS2957
| SMILES | CO/N=c\1/ccn(c(=O)[nH]1)[C@@H]1O[C@@H]([C@@H]([C@@H]1O)O)COP(=O)(OP(=O)(OP(=O)(OC[C@H]1O[C@H]([C@H]([C@H]1O)O)n1ccc(=O)[nH]c1=O)O)O)O |
| InChIKey | SIKKMGJHOOQSAP-AOUMTEFLSA-N |
Chemical properties
| Hydrogen bond acceptors | 20 |
| Hydrogen bond donors | 9 |
| Rotatable bonds | 13 |
| Molecular weight (Da) | 739.1 |
Drug properties
| Molecular type | Small molecule |
| Physiological/Surrogate | Surrogate |
| Approved drug | No |