Glycoside
GD070794
Name:
NoneFormula:
C16H18O4N4SSmiles:
Cc1sccc1Nc1ncnc2c1ccn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1OAglycone:
Cc1sccc1Nc1ncnc2c1C=C[N]2Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 8 | RingCount: | 4 |
| HBD: | 4 | FractionCSP3: | 0.38 |
| AlogP: | 1.16 | Num_rotatable_bonds: | 4 |
| MolWt: | 362.41 | Num_heavy_atoms: | 25 |
| TPSA: | 112.66 | NumAromaticRings: | 3 |
Unique Aglycone
AD33505
Formula: C11H9N4S
Smiles:
Cc1sccc1Nc1ncnc2c1C=C[N]2| HBA: | 4 | RingCount: | 3 |
| HBD: | 1 | FractionCSP3: | 0.09 |
| AlogP: | 2.81 | Num_rotatable_bonds: | 2 |
| MolWt: | 229.29 | Num_heavy_atoms: | 16 |
| TPSA: | 51.91 | NumAromaticRings: | 2 |
