Glycoside
GD028690
Name:
NoneFormula:
C17H25O4N7Smiles:
CNC(=O)[C@@H]1O[C@H](n2cnc3c(NC4CCCC4)nc(NC)nc32)[C@H](O)[C@H]1OAglycone:
CNc1nc2c(c(NC3CCCC3)n1)N=C[N]2Sugarmoiety:
CNC(=O)C1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 4 |
| HBD: | 5 | FractionCSP3: | 0.65 |
| AlogP: | -0.41 | Num_rotatable_bonds: | 5 |
| MolWt: | 391.43 | Num_heavy_atoms: | 28 |
| TPSA: | 146.45 | NumAromaticRings: | 2 |
Unique Aglycone
AD18720
Formula: C11H15N6
Smiles:
CNc1nc2c(c(NC3CCCC3)n1)N=C[N]2| HBA: | 6 | RingCount: | 3 |
| HBD: | 2 | FractionCSP3: | 0.55 |
| AlogP: | 1.78 | Num_rotatable_bonds: | 3 |
| MolWt: | 231.28 | Num_heavy_atoms: | 17 |
| TPSA: | 76.3 | NumAromaticRings: | 1 |
