Glycoside
GD070357
Name:
NoneFormula:
C18H21O4N5Smiles:
Cc1ccc(Nc2ncnc3c2ccn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)c(C)n1Aglycone:
Cc1ccc(Nc2ncnc3c2C=C[N]3)c(C)n1Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 4 |
| HBD: | 4 | FractionCSP3: | 0.39 |
| AlogP: | 0.8 | Num_rotatable_bonds: | 4 |
| MolWt: | 371.4 | Num_heavy_atoms: | 27 |
| TPSA: | 125.55 | NumAromaticRings: | 3 |
Unique Aglycone
AD33325
Formula: C13H12N5
Smiles:
Cc1ccc(Nc2ncnc3c2C=C[N]3)c(C)n1| HBA: | 5 | RingCount: | 3 |
| HBD: | 1 | FractionCSP3: | 0.15 |
| AlogP: | 2.45 | Num_rotatable_bonds: | 2 |
| MolWt: | 238.27 | Num_heavy_atoms: | 18 |
| TPSA: | 64.8 | NumAromaticRings: | 2 |
