Glycoside
GD028017
Name:
NoneFormula:
C25H24O5N4Smiles:
OCC(O)C(O)C(O)C(O)c1nc2cc(Nc3c4ccccc4nc4ccccc34)ccc2[nH]1Aglycone:
c1ccc2c(Nc3ccc4[nH]cnc4c3)c3ccccc3nc2c1Sugarmoiety:
OCC(O)C(O)C(O)C(O)OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 5 |
| HBD: | 7 | FractionCSP3: | 0.2 |
| AlogP: | 2.12 | Num_rotatable_bonds: | 7 |
| MolWt: | 460.49 | Num_heavy_atoms: | 34 |
| TPSA: | 154.75 | NumAromaticRings: | 5 |
Unique Aglycone
AD18347
Formula: C20H14N4
Smiles:
c1ccc2c(Nc3ccc4[nH]cnc4c3)c3ccccc3nc2c1| HBA: | 4 | RingCount: | 5 |
| HBD: | 2 | FractionCSP3: | 0.0 |
| AlogP: | 5.01 | Num_rotatable_bonds: | 2 |
| MolWt: | 310.36 | Num_heavy_atoms: | 24 |
| TPSA: | 53.6 | NumAromaticRings: | 5 |
