Glycoside
GD060611
Name:
NoneFormula:
C13H14O4N5ClSmiles:
C=CNc1nc(Cl)nc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1OAglycone:
C=CNc1nc(Cl)nc2c1N=C[N]2Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 3 |
| HBD: | 4 | FractionCSP3: | 0.42 |
| AlogP: | -0.35 | Num_rotatable_bonds: | 4 |
| MolWt: | 327.73 | Num_heavy_atoms: | 22 |
| TPSA: | 125.55 | NumAromaticRings: | 2 |
Unique Aglycone
AD29921
Formula: C8H5N5Cl
Smiles:
C=CNc1nc(Cl)nc2c1N=C[N]2| HBA: | 5 | RingCount: | 2 |
| HBD: | 1 | FractionCSP3: | 0.0 |
| AlogP: | 1.59 | Num_rotatable_bonds: | 2 |
| MolWt: | 194.61 | Num_heavy_atoms: | 13 |
| TPSA: | 64.27 | NumAromaticRings: | 1 |
