MRS2782
SMILES | O[C@@H]1[C@@H](COP(=O)(CP(=O)(O)O)O)O[C@H]([C@@H]1O)n1ccc(=O)[nH]c1=O |
InChIKey | PDEGDTTUBZXACY-ZOQUXTDFSA-N |
Chemical properties
Hydrogen bond acceptors | 9 |
Hydrogen bond donors | 6 |
Rotatable bonds | 6 |
Molecular weight (Da) | 402.0 |
Drug properties
Molecular type | Small molecule |
Physiological/Surrogate | Surrogate |
Approved drug | No |