Glycoside
GD100829
Name:
NoneFormula:
C17H20O5N6S2Smiles:
CSC[C@H]1O[C@@H](n2cnc3c(NS(=O)(=O)Cc4ccccn4)ncnc32)[C@H](O)[C@@H]1OAglycone:
O=S(=O)(Cc1ccccn1)Nc1ncnc2c1N=C[N]2Sugarmoiety:
CSCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 4 |
| HBD: | 3 | FractionCSP3: | 0.41 |
| AlogP: | 0.15 | Num_rotatable_bonds: | 7 |
| MolWt: | 452.52 | Num_heavy_atoms: | 30 |
| TPSA: | 152.35 | NumAromaticRings: | 3 |
Unique Aglycone
AD42595
Formula: C11H9O2N6S
Smiles:
O=S(=O)(Cc1ccccn1)Nc1ncnc2c1N=C[N]2| HBA: | 8 | RingCount: | 3 |
| HBD: | 1 | FractionCSP3: | 0.09 |
| AlogP: | 0.72 | Num_rotatable_bonds: | 4 |
| MolWt: | 289.3 | Num_heavy_atoms: | 20 |
| TPSA: | 111.3 | NumAromaticRings: | 2 |
