Glycoside
GD043217
Name:
NoneFormula:
C10H12O4N4SSmiles:
OC[C@@H]1O[C@H](c2[nH]nc3c(=S)[nH]cnc23)[C@H](O)[C@@H]1OAglycone:
S=c1[nH]cnc2c[nH]nc12Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 8 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.5 |
| AlogP: | -0.83 | Num_rotatable_bonds: | 2 |
| MolWt: | 284.3 | Num_heavy_atoms: | 19 |
| TPSA: | 127.28 | NumAromaticRings: | 2 |
Unique Aglycone
AD24911
Formula: C5H4N4S
Smiles:
S=c1[nH]cnc2c[nH]nc12| HBA: | 4 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.0 |
| AlogP: | 1.02 | Num_rotatable_bonds: | 0 |
| MolWt: | 152.18 | Num_heavy_atoms: | 10 |
| TPSA: | 57.36 | NumAromaticRings: | 2 |
