Glycoside
GD001991
Name:
NoneFormula:
C20H22O5N5ClSmiles:
C[C@H](COc1ccccc1)Nc1nc(Cl)nc2c1ncn2[C@@H]1O[C@H](CO)[C@H](O)[C@H]1OAglycone:
CC(COc1ccccc1)Nc1nc(Cl)nc2c1N=C[N]2Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 4 |
| HBD: | 4 | FractionCSP3: | 0.42 |
| AlogP: | 0.97 | Num_rotatable_bonds: | 7 |
| MolWt: | 435.87 | Num_heavy_atoms: | 30 |
| TPSA: | 134.78 | NumAromaticRings: | 3 |
Unique Aglycone
AD01938
Formula: C15H13ON5Cl
Smiles:
CC(COc1ccccc1)Nc1nc(Cl)nc2c1N=C[N]2| HBA: | 6 | RingCount: | 3 |
| HBD: | 1 | FractionCSP3: | 0.21 |
| AlogP: | 2.92 | Num_rotatable_bonds: | 5 |
| MolWt: | 302.75 | Num_heavy_atoms: | 21 |
| TPSA: | 73.5 | NumAromaticRings: | 2 |
