Glycoside
GD017485
Name:
NoneFormula:
C12H15O4N3S2Smiles:
CCSc1ncnc2c(C3OC(CO)C(O)C3O)nsc12Aglycone:
CCSc1ncnc2cnsc12Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 7 | RingCount: | 3 |
| HBD: | 3 | FractionCSP3: | 0.58 |
| AlogP: | 0.35 | Num_rotatable_bonds: | 4 |
| MolWt: | 329.4 | Num_heavy_atoms: | 21 |
| TPSA: | 108.59 | NumAromaticRings: | 2 |
Unique Aglycone
AD12469
Formula: C7H7N3S2
Smiles:
CCSc1ncnc2cnsc12| HBA: | 3 | RingCount: | 2 |
| HBD: | 0 | FractionCSP3: | 0.29 |
| AlogP: | 2.2 | Num_rotatable_bonds: | 2 |
| MolWt: | 197.29 | Num_heavy_atoms: | 12 |
| TPSA: | 38.67 | NumAromaticRings: | 2 |
