Glycoside
GD002791
Name:
NoneFormula:
C17H24O4N4Smiles:
OC[C@@H]1O[C@H](n2cnc3c(NC4CCCCC4)ccnc32)[C@H](O)[C@H]1OAglycone:
C1=Nc2c(NC3CCCCC3)ccnc2[N]1Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 8 | RingCount: | 4 |
| HBD: | 4 | FractionCSP3: | 0.65 |
| AlogP: | 0.79 | Num_rotatable_bonds: | 4 |
| MolWt: | 348.4 | Num_heavy_atoms: | 25 |
| TPSA: | 112.66 | NumAromaticRings: | 2 |
Unique Aglycone
AD02622
Formula: C12H15N4
Smiles:
C1=Nc2c(NC3CCCCC3)ccnc2[N]1| HBA: | 4 | RingCount: | 3 |
| HBD: | 1 | FractionCSP3: | 0.5 |
| AlogP: | 2.74 | Num_rotatable_bonds: | 2 |
| MolWt: | 215.28 | Num_heavy_atoms: | 16 |
| TPSA: | 51.38 | NumAromaticRings: | 1 |
