Glycoside
GD005021
Name:
NoneFormula:
C15H21O4N5Smiles:
C[C@]1(O)[C@H](CO)O[C@H](n2cnc3c(NC4CCC4)ncnc32)[C@H]1OAglycone:
C1=Nc2c(ncnc2NC2CCC2)[N]1Sugarmoiety:
CC1(O)C(CO)OC(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 4 |
| HBD: | 4 | FractionCSP3: | 0.67 |
| AlogP: | -0.21 | Num_rotatable_bonds: | 4 |
| MolWt: | 335.36 | Num_heavy_atoms: | 24 |
| TPSA: | 125.55 | NumAromaticRings: | 2 |
Unique Aglycone
AD04305
Formula: C9H10N5
Smiles:
C1=Nc2c(ncnc2NC2CCC2)[N]1| HBA: | 5 | RingCount: | 3 |
| HBD: | 1 | FractionCSP3: | 0.44 |
| AlogP: | 1.35 | Num_rotatable_bonds: | 2 |
| MolWt: | 188.21 | Num_heavy_atoms: | 14 |
| TPSA: | 64.27 | NumAromaticRings: | 1 |
