Glycoside
GD070347
Name:
NoneFormula:
C17H22O4N6Smiles:
CCCn1cc(Nc2ncnc3c2ccn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)cn1Aglycone:
CCCn1cc(Nc2ncnc3c2C=C[N]3)cn1Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 4 |
| HBD: | 4 | FractionCSP3: | 0.47 |
| AlogP: | 0.39 | Num_rotatable_bonds: | 6 |
| MolWt: | 374.4 | Num_heavy_atoms: | 27 |
| TPSA: | 130.48 | NumAromaticRings: | 3 |
Unique Aglycone
AD33317
Formula: C12H13N6
Smiles:
CCCn1cc(Nc2ncnc3c2C=C[N]3)cn1| HBA: | 6 | RingCount: | 3 |
| HBD: | 1 | FractionCSP3: | 0.25 |
| AlogP: | 2.05 | Num_rotatable_bonds: | 4 |
| MolWt: | 241.28 | Num_heavy_atoms: | 18 |
| TPSA: | 69.73 | NumAromaticRings: | 2 |
