Glycoside
GD076230
Name:
NoneFormula:
C14H20O5N6SSmiles:
CO[C@@H]1[C@H](O)[C@@H](CO)O[C@H]1n1cnc2c(N)n(C(=O)CCS)c(=N)nc21Aglycone:
N=c1nc2c(c(N)n1C(=O)CCS)N=C[N]2Sugarmoiety:
COC1C(O)OC(CO)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.57 |
| AlogP: | -1.48 | Num_rotatable_bonds: | 5 |
| MolWt: | 384.42 | Num_heavy_atoms: | 26 |
| TPSA: | 161.5 | NumAromaticRings: | 2 |
Unique Aglycone
AD35189
Formula: C8H9ON6S
Smiles:
N=c1nc2c(c(N)n1C(=O)CCS)N=C[N]2| HBA: | 7 | RingCount: | 2 |
| HBD: | 3 | FractionCSP3: | 0.25 |
| AlogP: | -0.19 | Num_rotatable_bonds: | 2 |
| MolWt: | 237.27 | Num_heavy_atoms: | 16 |
| TPSA: | 111.22 | NumAromaticRings: | 1 |
