Glycoside
GD125595
Name:
3-({[4-(dimethylamino)phenyl]methylidene}amino)-6-(hydroxymethyl)oxane-2,4,5-triolFormula:
C15H22O5N2Smiles:
CN(C)c1ccc(C=NC2C(O)OC(CO)C(O)C2O)cc1Aglycone:
CN(C)c1ccc(C=N)cc1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 7 | RingCount: | 2 |
| HBD: | 4 | FractionCSP3: | 0.53 |
| AlogP: | -1.03 | Num_rotatable_bonds: | 4 |
| MolWt: | 310.35 | Num_heavy_atoms: | 22 |
| TPSA: | 105.75 | NumAromaticRings: | 1 |
Unique Aglycone
AD50798
Formula: C9H12N2
Smiles:
CN(C)c1ccc(C=N)cc1| HBA: | 2 | RingCount: | 1 |
| HBD: | 1 | FractionCSP3: | 0.22 |
| AlogP: | 1.75 | Num_rotatable_bonds: | 2 |
| MolWt: | 148.21 | Num_heavy_atoms: | 11 |
| TPSA: | 27.09 | NumAromaticRings: | 1 |
