Glycoside
GD085746
Name:
NoneFormula:
C19H21O4N7Smiles:
C[C@H](Nc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O)c1nc2ccccc2[nH]1Aglycone:
CC(Nc1ncnc2c1N=C[N]2)c1nc2ccccc2[nH]1Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 5 |
| HBD: | 5 | FractionCSP3: | 0.37 |
| AlogP: | 0.49 | Num_rotatable_bonds: | 5 |
| MolWt: | 411.42 | Num_heavy_atoms: | 30 |
| TPSA: | 154.23 | NumAromaticRings: | 4 |
Unique Aglycone
AD38177
Formula: C14H12N7
Smiles:
CC(Nc1ncnc2c1N=C[N]2)c1nc2ccccc2[nH]1| HBA: | 7 | RingCount: | 4 |
| HBD: | 2 | FractionCSP3: | 0.14 |
| AlogP: | 2.44 | Num_rotatable_bonds: | 3 |
| MolWt: | 278.3 | Num_heavy_atoms: | 21 |
| TPSA: | 92.95 | NumAromaticRings: | 3 |
