Glycoside
GD019680
Name:
NoneFormula:
C15H16O4N4Smiles:
OC[C@@H]1O[C@H](n2ccc3c(-c4ccc[nH]4)ncnc32)[C@H](O)[C@H]1OAglycone:
C1=Cc2c(ncnc2-c2ccc[nH]2)[N]1Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 8 | RingCount: | 4 |
| HBD: | 4 | FractionCSP3: | 0.33 |
| AlogP: | 0.04 | Num_rotatable_bonds: | 3 |
| MolWt: | 316.32 | Num_heavy_atoms: | 23 |
| TPSA: | 116.42 | NumAromaticRings: | 3 |
Unique Aglycone
AD13709
Formula: C10H7N4
Smiles:
C1=Cc2c(ncnc2-c2ccc[nH]2)[N]1| HBA: | 4 | RingCount: | 3 |
| HBD: | 1 | FractionCSP3: | 0.0 |
| AlogP: | 1.69 | Num_rotatable_bonds: | 1 |
| MolWt: | 183.19 | Num_heavy_atoms: | 14 |
| TPSA: | 55.67 | NumAromaticRings: | 2 |
