Glycoside
GD004607
Name:
NoneFormula:
C16H22O4N7ClSmiles:
CN1CCN(Nc2nc(Cl)nc3c2ncn3[C@@H]2O[C@H](CO)[C@H](O)[C@H]2O)CC1Aglycone:
CN1CCN(Nc2nc(Cl)nc3c2N=C[N]3)CC1Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 4 |
| HBD: | 4 | FractionCSP3: | 0.67 |
| AlogP: | -1.33 | Num_rotatable_bonds: | 4 |
| MolWt: | 399.84 | Num_heavy_atoms: | 27 |
| TPSA: | 132.03 | NumAromaticRings: | 2 |
Unique Aglycone
AD04000
Formula: C11H13N7Cl
Smiles:
CN1CCN(Nc2nc(Cl)nc3c2N=C[N]3)CC1| HBA: | 7 | RingCount: | 3 |
| HBD: | 1 | FractionCSP3: | 0.5 |
| AlogP: | 0.61 | Num_rotatable_bonds: | 2 |
| MolWt: | 266.72 | Num_heavy_atoms: | 18 |
| TPSA: | 70.75 | NumAromaticRings: | 1 |
