Glycoside
GD032628
Name:
NoneFormula:
C18H16O4N4Smiles:
C#C[C@@]1(O)[C@H](CO)O[C@H](n2cnc3c(-c4ccccc4)ncnc32)[C@H]1OAglycone:
C1=Nc2c(ncnc2-c2ccccc2)[N]1Sugarmoiety:
C#CC1(O)C(CO)OC(O)C1OOther Identifiers
Properties
| HBA: | 8 | RingCount: | 4 |
| HBD: | 3 | FractionCSP3: | 0.28 |
| AlogP: | 0.11 | Num_rotatable_bonds: | 3 |
| MolWt: | 352.35 | Num_heavy_atoms: | 26 |
| TPSA: | 113.52 | NumAromaticRings: | 3 |
Unique Aglycone
AD05457
Formula: C11H7N4
Smiles:
C1=Nc2c(ncnc2-c2ccccc2)[N]1| HBA: | 4 | RingCount: | 3 |
| HBD: | 0 | FractionCSP3: | 0.0 |
| AlogP: | 2.05 | Num_rotatable_bonds: | 1 |
| MolWt: | 195.21 | Num_heavy_atoms: | 15 |
| TPSA: | 52.24 | NumAromaticRings: | 2 |
