Glycoside
GD025659
Name:
NoneFormula:
C24H25O4N5SSmiles:
OC[C@@H]1O[C@H](n2cnc3c(NCCc4ccccc4)nc(Sc4ccccc4)nc32)[C@H](O)[C@H]1OAglycone:
C1=Nc2c(nc(Sc3ccccc3)nc2NCCc2ccccc2)[N]1Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 5 |
| HBD: | 4 | FractionCSP3: | 0.29 |
| AlogP: | 2.24 | Num_rotatable_bonds: | 8 |
| MolWt: | 479.56 | Num_heavy_atoms: | 34 |
| TPSA: | 125.55 | NumAromaticRings: | 4 |
Unique Aglycone
AD16991
Formula: C19H16N5S
Smiles:
C1=Nc2c(nc(Sc3ccccc3)nc2NCCc2ccccc2)[N]1| HBA: | 5 | RingCount: | 4 |
| HBD: | 1 | FractionCSP3: | 0.11 |
| AlogP: | 4.19 | Num_rotatable_bonds: | 6 |
| MolWt: | 346.44 | Num_heavy_atoms: | 25 |
| TPSA: | 64.27 | NumAromaticRings: | 3 |
