Glycoside
GD036696
Name:
NoneFormula:
C23H23O4N5Smiles:
OC[C@@H]1O[C@H](n2cnc3c(NCc4ccc(-c5ccccc5)cc4)ncnc32)[C@H](O)[C@H]1OAglycone:
C1=Nc2c(ncnc2NCc2ccc(-c3ccccc3)cc2)[N]1Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 5 |
| HBD: | 4 | FractionCSP3: | 0.26 |
| AlogP: | 1.72 | Num_rotatable_bonds: | 6 |
| MolWt: | 433.47 | Num_heavy_atoms: | 32 |
| TPSA: | 125.55 | NumAromaticRings: | 4 |
Unique Aglycone
AD23146
Formula: C18H14N5
Smiles:
C1=Nc2c(ncnc2NCc2ccc(-c3ccccc3)cc2)[N]1| HBA: | 5 | RingCount: | 4 |
| HBD: | 1 | FractionCSP3: | 0.06 |
| AlogP: | 3.67 | Num_rotatable_bonds: | 4 |
| MolWt: | 300.35 | Num_heavy_atoms: | 23 |
| TPSA: | 64.27 | NumAromaticRings: | 3 |
