Glycoside
GD033141
Name:
NoneFormula:
C18H14O4N2Cl2Smiles:
OC[C@@H]1OC(n2cnc3cc4cc(Cl)c(Cl)cc4cc32)[C@H](O)[C@H]1OAglycone:
Clc1cc2cc3c(cc2cc1Cl)N=C[N]3Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 6 | RingCount: | 4 |
| HBD: | 3 | FractionCSP3: | 0.31 |
| AlogP: | 2.11 | Num_rotatable_bonds: | 2 |
| MolWt: | 369.2 | Num_heavy_atoms: | 24 |
| TPSA: | 87.74 | NumAromaticRings: | 3 |
Unique Aglycone
AD21178
Formula: C13H5N2Cl2
Smiles:
Clc1cc2cc3c(cc2cc1Cl)N=C[N]3| HBA: | 2 | RingCount: | 3 |
| HBD: | 0 | FractionCSP3: | 0.0 |
| AlogP: | 4.06 | Num_rotatable_bonds: | 0 |
| MolWt: | 236.08 | Num_heavy_atoms: | 15 |
| TPSA: | 26.46 | NumAromaticRings: | 2 |
