Glycoside
GD002124
Name:
NoneFormula:
C14H14O4N4SSmiles:
OC[C@@H]1O[C@H](n2cnc3c(-c4cccs4)ncnc32)[C@H](O)[C@H]1OAglycone:
C1=Nc2c(ncnc2-c2cccs2)[N]1Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 8 | RingCount: | 4 |
| HBD: | 3 | FractionCSP3: | 0.36 |
| AlogP: | 0.17 | Num_rotatable_bonds: | 3 |
| MolWt: | 334.36 | Num_heavy_atoms: | 23 |
| TPSA: | 113.52 | NumAromaticRings: | 3 |
Unique Aglycone
AD02057
Formula: C9H5N4S
Smiles:
C1=Nc2c(ncnc2-c2cccs2)[N]1| HBA: | 4 | RingCount: | 3 |
| HBD: | 0 | FractionCSP3: | 0.0 |
| AlogP: | 2.11 | Num_rotatable_bonds: | 1 |
| MolWt: | 201.23 | Num_heavy_atoms: | 14 |
| TPSA: | 52.24 | NumAromaticRings: | 2 |
