Glycoside
GD027687
Name:
NoneFormula:
C17H19O6N5SSmiles:
NC(=O)c1ncn(C2OC(CO)C(O)C2O)c1NC(=S)NC(=O)c1ccccc1Aglycone:
NC(=O)C1=C(NC(=S)NC(=O)c2ccccc2)[N]C=N1Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 3 |
| HBD: | 7 | FractionCSP3: | 0.29 |
| AlogP: | -1.28 | Num_rotatable_bonds: | 5 |
| MolWt: | 421.44 | Num_heavy_atoms: | 29 |
| TPSA: | 171.96 | NumAromaticRings: | 2 |
Unique Aglycone
AD18167
Formula: C12H10O2N5S
Smiles:
NC(=O)C1=C(NC(=S)NC(=O)c2ccccc2)[N]C=N1| HBA: | 7 | RingCount: | 2 |
| HBD: | 4 | FractionCSP3: | 0.0 |
| AlogP: | -0.41 | Num_rotatable_bonds: | 3 |
| MolWt: | 288.31 | Num_heavy_atoms: | 20 |
| TPSA: | 110.68 | NumAromaticRings: | 1 |
