Glycoside
GD100262
Name:
NoneFormula:
C20H21O6N4ClSSmiles:
O=S(=O)(CCc1ccc(Cl)cc1)Nc1ncnc2c1ccn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1OAglycone:
O=S(=O)(CCc1ccc(Cl)cc1)Nc1ncnc2c1C=C[N]2Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 4 |
| HBD: | 4 | FractionCSP3: | 0.37 |
| AlogP: | 0.68 | Num_rotatable_bonds: | 7 |
| MolWt: | 468.92 | Num_heavy_atoms: | 31 |
| TPSA: | 146.8 | NumAromaticRings: | 3 |
Unique Aglycone
AD42362
Formula: C15H12O2N4ClS
Smiles:
O=S(=O)(CCc1ccc(Cl)cc1)Nc1ncnc2c1C=C[N]2| HBA: | 6 | RingCount: | 3 |
| HBD: | 1 | FractionCSP3: | 0.14 |
| AlogP: | 2.33 | Num_rotatable_bonds: | 5 |
| MolWt: | 335.8 | Num_heavy_atoms: | 22 |
| TPSA: | 86.05 | NumAromaticRings: | 2 |
