Glycoside
GD077925
Name:
NoneFormula:
C14H15O4N5S2Smiles:
OC[C@H]1O[C@@H](n2cnc3c(Nc4ccsc4)[nH]c(=S)nc32)[C@H](O)[C@@H]1OAglycone:
S=c1nc2c(c(Nc3ccsc3)[nH]1)N=C[N]2Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 4 |
| HBD: | 5 | FractionCSP3: | 0.36 |
| AlogP: | 0.91 | Num_rotatable_bonds: | 4 |
| MolWt: | 381.44 | Num_heavy_atoms: | 25 |
| TPSA: | 128.45 | NumAromaticRings: | 3 |
Unique Aglycone
AD35705
Formula: C9H6N5S2
Smiles:
S=c1nc2c(c(Nc3ccsc3)[nH]1)N=C[N]2| HBA: | 5 | RingCount: | 3 |
| HBD: | 2 | FractionCSP3: | 0.0 |
| AlogP: | 2.85 | Num_rotatable_bonds: | 2 |
| MolWt: | 248.32 | Num_heavy_atoms: | 16 |
| TPSA: | 67.17 | NumAromaticRings: | 2 |
