Glycoside
GD012984
Name:
NoneFormula:
C24H20O4N4Smiles:
OC[C@@H]1O[C@H](n2cnc3c(C#Cc4ccc(-c5ccccc5)cc4)ncnc32)[C@H](O)[C@H]1OAglycone:
C(#Cc1ncnc2c1N=C[N]2)c1ccc(-c2ccccc2)cc1Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 8 | RingCount: | 5 |
| HBD: | 3 | FractionCSP3: | 0.21 |
| AlogP: | 1.5 | Num_rotatable_bonds: | 3 |
| MolWt: | 428.45 | Num_heavy_atoms: | 32 |
| TPSA: | 113.52 | NumAromaticRings: | 4 |
Unique Aglycone
AD09749
Formula: C19H11N4
Smiles:
C(#Cc1ncnc2c1N=C[N]2)c1ccc(-c2ccccc2)cc1| HBA: | 4 | RingCount: | 4 |
| HBD: | 0 | FractionCSP3: | 0.0 |
| AlogP: | 3.45 | Num_rotatable_bonds: | 1 |
| MolWt: | 295.33 | Num_heavy_atoms: | 23 |
| TPSA: | 52.24 | NumAromaticRings: | 3 |
