Glycoside
GD085535
Name:
NoneFormula:
C17H20O4N6SSmiles:
Cc1cccc(CSc2nc(N)nc3c2ncn3[C@H]2O[C@@H](CO)[C@@H](O)[C@H]2O)n1Aglycone:
Cc1cccc(CSc2nc(N)nc3c2N=C[N]3)n1Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 4 |
| HBD: | 5 | FractionCSP3: | 0.41 |
| AlogP: | 0.02 | Num_rotatable_bonds: | 5 |
| MolWt: | 404.45 | Num_heavy_atoms: | 28 |
| TPSA: | 152.43 | NumAromaticRings: | 3 |
Unique Aglycone
AD06474
Formula: C12H11N6S
Smiles:
Cc1cccc(CSc2nc(N)nc3c2N=C[N]3)n1| HBA: | 6 | RingCount: | 3 |
| HBD: | 2 | FractionCSP3: | 0.17 |
| AlogP: | 1.96 | Num_rotatable_bonds: | 3 |
| MolWt: | 271.33 | Num_heavy_atoms: | 19 |
| TPSA: | 91.15 | NumAromaticRings: | 2 |
