Glycoside
GD028646
Name:
NoneFormula:
C18H22O5N4SSmiles:
O=C(Nc1nnc([C@@H]2O[C@H](CO)[C@H](O)[C@H]2O)s1)Nc1cccc2c1CCCC2Aglycone:
O=C(Nc1nncs1)Nc1cccc2c1CCCC2Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 4 |
| HBD: | 5 | FractionCSP3: | 0.5 |
| AlogP: | 1.21 | Num_rotatable_bonds: | 4 |
| MolWt: | 406.46 | Num_heavy_atoms: | 28 |
| TPSA: | 136.83 | NumAromaticRings: | 2 |
Unique Aglycone
AD18694
Formula: C13H14ON4S
Smiles:
O=C(Nc1nncs1)Nc1cccc2c1CCCC2| HBA: | 5 | RingCount: | 3 |
| HBD: | 2 | FractionCSP3: | 0.31 |
| AlogP: | 3.06 | Num_rotatable_bonds: | 2 |
| MolWt: | 274.35 | Num_heavy_atoms: | 19 |
| TPSA: | 66.91 | NumAromaticRings: | 2 |
