Glycoside
GD017855
Name:
NoneFormula:
C16H24O4N6SSmiles:
CSc1nc(NN2CCCCC2)c2ncn([C@@H]3O[C@H](CO)[C@H](O)[C@H]3O)c2n1Aglycone:
CSc1nc2c(c(NN3CCCCC3)n1)N=C[N]2Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 4 |
| HBD: | 4 | FractionCSP3: | 0.69 |
| AlogP: | -0.03 | Num_rotatable_bonds: | 5 |
| MolWt: | 396.47 | Num_heavy_atoms: | 27 |
| TPSA: | 128.79 | NumAromaticRings: | 2 |
Unique Aglycone
AD12693
Formula: C11H15N6S
Smiles:
CSc1nc2c(c(NN3CCCCC3)n1)N=C[N]2| HBA: | 6 | RingCount: | 3 |
| HBD: | 1 | FractionCSP3: | 0.55 |
| AlogP: | 1.92 | Num_rotatable_bonds: | 3 |
| MolWt: | 263.35 | Num_heavy_atoms: | 18 |
| TPSA: | 67.51 | NumAromaticRings: | 1 |
