Glycoside
GD040352
Name:
5'-[(1h-benzimidazol-2-ylacetyl)amino]-5'-deoxycytidineFormula:
C18H20O5N6Smiles:
Nc1ccn([C@H]2O[C@H](CNC(=O)Cc3nc4ccccc4[nH]3)[C@@H](O)[C@H]2O)c(=O)n1Aglycone:
CNC(=O)Cc1nc2ccccc2[nH]1.Nc1cc[nH]c(=O)n1Sugarmoiety:
OC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 4 |
| HBD: | 6 | FractionCSP3: | 0.33 |
| AlogP: | -1.32 | Num_rotatable_bonds: | 5 |
| MolWt: | 400.4 | Num_heavy_atoms: | 29 |
| TPSA: | 168.38 | 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 |
AD24732
Formula: C10H11ON3
Smiles:
CNC(=O)Cc1nc2ccccc2[nH]1| HBA: | 4 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.2 |
| AlogP: | 0.85 | Num_rotatable_bonds: | 2 |
| MolWt: | 189.22 | Num_heavy_atoms: | 14 |
| TPSA: | 57.78 | NumAromaticRings: | 2 |
