Glycoside
GD071597
Name:
NoneFormula:
C17H24O4N6Smiles:
OC[C@H]1O[C@@H](n2cnc3c(N4CCN(C5CC5)CC4)ncnc32)[C@H](O)[C@@H]1OAglycone:
C1=Nc2c(ncnc2N2CCN(C3CC3)CC2)[N]1Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 5 |
| HBD: | 3 | FractionCSP3: | 0.71 |
| AlogP: | -1.28 | Num_rotatable_bonds: | 4 |
| MolWt: | 376.42 | Num_heavy_atoms: | 27 |
| TPSA: | 120.0 | NumAromaticRings: | 2 |
Unique Aglycone
AD33640
Formula: C12H15N6
Smiles:
C1=Nc2c(ncnc2N2CCN(C3CC3)CC2)[N]1| HBA: | 6 | RingCount: | 4 |
| HBD: | 0 | FractionCSP3: | 0.58 |
| AlogP: | 0.67 | Num_rotatable_bonds: | 2 |
| MolWt: | 243.29 | Num_heavy_atoms: | 18 |
| TPSA: | 58.72 | NumAromaticRings: | 1 |
