Glycoside
GD038509
Name:
5'-deoxy-5'-[(imidazo[2,1-b][1,3]thiazol-5-ylcarbonyl)amino]cytidineFormula:
C15H16O5N6SSmiles:
Nc1ccn([C@H]2O[C@H](CNC(=O)c3cnc4sccn34)[C@@H](O)[C@H]2O)c(=O)n1Aglycone:
CNC(=O)c1cnc2sccn12.Nc1cc[nH]c(=O)n1Sugarmoiety:
OC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 4 |
| HBD: | 5 | FractionCSP3: | 0.33 |
| AlogP: | -1.42 | Num_rotatable_bonds: | 4 |
| MolWt: | 392.4 | Num_heavy_atoms: | 27 |
| TPSA: | 157.0 | NumAromaticRings: | 3 |
Unique Aglycone
AD00115
Formula: C4H5ON3
Smiles:
Nc1cc[nH]c(=O)n1| HBA: | 4 | RingCount: | 1 |
| HBD: | 3 | FractionCSP3: | 0.0 |
| AlogP: | -0.65 | Num_rotatable_bonds: | 0 |
| MolWt: | 111.1 | Num_heavy_atoms: | 8 |
| TPSA: | 71.77 | NumAromaticRings: | 1 |
AD24041
Formula: C7H7ON3S
Smiles:
CNC(=O)c1cnc2sccn12| HBA: | 4 | RingCount: | 2 |
| HBD: | 1 | FractionCSP3: | 0.14 |
| AlogP: | 0.76 | Num_rotatable_bonds: | 1 |
| MolWt: | 181.22 | Num_heavy_atoms: | 12 |
| TPSA: | 46.4 | NumAromaticRings: | 2 |
