Glycoside
GD078131
Name:
NoneFormula:
C18H20O4N6Smiles:
OC[C@H]1O[C@@H](n2ccc3c(Nc4cnc(C5CC5)nc4)ncnc32)[C@H](O)[C@@H]1OAglycone:
C1=Cc2c(ncnc2Nc2cnc(C3CC3)nc2)[N]1Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 5 |
| HBD: | 4 | FractionCSP3: | 0.44 |
| AlogP: | 0.45 | Num_rotatable_bonds: | 5 |
| MolWt: | 384.4 | Num_heavy_atoms: | 28 |
| TPSA: | 138.44 | NumAromaticRings: | 3 |
Unique Aglycone
AD35825
Formula: C13H11N6
Smiles:
C1=Cc2c(ncnc2Nc2cnc(C3CC3)nc2)[N]1| HBA: | 6 | RingCount: | 4 |
| HBD: | 1 | FractionCSP3: | 0.23 |
| AlogP: | 2.11 | Num_rotatable_bonds: | 3 |
| MolWt: | 251.27 | Num_heavy_atoms: | 19 |
| TPSA: | 77.69 | NumAromaticRings: | 2 |
