Glycoside
GD035267
Name:
MOLNUPIRAVIRFormula:
C13H19O7N3Smiles:
CC(C)C(=O)OC[C@@H]1O[C@H](n2ccc(=NO)[nH]c2=O)[C@H](O)[C@H]1OAglycone:
COC(=O)C(C)C.O=c1[nH]ccc(=NO)[nH]1Sugarmoiety:
OC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 2 |
| HBD: | 4 | FractionCSP3: | 0.62 |
| AlogP: | -1.72 | Num_rotatable_bonds: | 4 |
| MolWt: | 329.31 | Num_heavy_atoms: | 23 |
| TPSA: | 146.37 | NumAromaticRings: | 1 |
Unique Aglycone
AD01210
Formula: C5H10O2
Smiles:
COC(=O)C(C)C| HBA: | 2 | RingCount: | 0 |
| HBD: | 0 | FractionCSP3: | 0.8 |
| AlogP: | 0.82 | Num_rotatable_bonds: | 1 |
| MolWt: | 102.13 | Num_heavy_atoms: | 7 |
| TPSA: | 26.3 | NumAromaticRings: | 0 |
AD22323
Formula: C4H5O2N3
Smiles:
O=c1[nH]ccc(=NO)[nH]1| HBA: | 5 | RingCount: | 1 |
| HBD: | 3 | FractionCSP3: | 0.0 |
| AlogP: | -1.01 | Num_rotatable_bonds: | 0 |
| MolWt: | 127.1 | Num_heavy_atoms: | 9 |
| TPSA: | 81.24 | NumAromaticRings: | 1 |
