Glycoside
GD021647
Name:
NoneFormula:
C18H21O4N3Smiles:
CC1OC(Nc2ccc(N=Nc3ccccc3)cc2)C(O)C(O)C1OAglycone:
Nc1ccc(N=Nc2ccccc2)cc1Sugarmoiety:
CC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 7 | RingCount: | 3 |
| HBD: | 4 | FractionCSP3: | 0.33 |
| AlogP: | 2.34 | Num_rotatable_bonds: | 4 |
| MolWt: | 343.38 | Num_heavy_atoms: | 25 |
| TPSA: | 106.67 | NumAromaticRings: | 2 |
Unique Aglycone
AD04138
Formula: C12H11N3
Smiles:
Nc1ccc(N=Nc2ccccc2)cc1| HBA: | 3 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.0 |
| AlogP: | 3.68 | Num_rotatable_bonds: | 2 |
| MolWt: | 197.24 | Num_heavy_atoms: | 15 |
| TPSA: | 50.74 | NumAromaticRings: | 2 |
