Glycoside
GD095510
Name:
NoneFormula:
C12H15O4N6SISmiles:
CNC(=S)Nc1nc(I)nc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1OAglycone:
CNC(=S)Nc1nc(I)nc2c1N=C[N]2Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.5 |
| AlogP: | -1.04 | Num_rotatable_bonds: | 3 |
| MolWt: | 466.26 | Num_heavy_atoms: | 24 |
| TPSA: | 137.58 | NumAromaticRings: | 2 |
Unique Aglycone
AD40750
Formula: C7H6N6SI
Smiles:
CNC(=S)Nc1nc(I)nc2c1N=C[N]2| HBA: | 6 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.14 |
| AlogP: | 0.91 | Num_rotatable_bonds: | 1 |
| MolWt: | 333.14 | Num_heavy_atoms: | 15 |
| TPSA: | 76.3 | NumAromaticRings: | 1 |
