Glycoside
GD016570
Name:
NoneFormula:
C24H21O3N4ClSmiles:
Cc1ccc(OC2CC(n3cnc4ncnc(Cl)c43)OC2Oc2ccc(C)cc2)cc1Aglycone:
Cc1ccc(O)cc1.Cc1ccc(O)cc1.Clc1ncnc2c1[N]C=N2Sugarmoiety:
OC1CC(O)C(O)O1Other Identifiers
Properties
| HBA: | 7 | RingCount: | 5 |
| HBD: | 0 | FractionCSP3: | 0.26 |
| AlogP: | 4.87 | Num_rotatable_bonds: | 5 |
| MolWt: | 436.9 | Num_heavy_atoms: | 31 |
| TPSA: | 71.29 | NumAromaticRings: | 4 |
Unique Aglycone
AD00732
Formula: C7H8O
Smiles:
Cc1ccc(O)cc1| HBA: | 1 | RingCount: | 1 |
| HBD: | 1 | FractionCSP3: | 0.14 |
| AlogP: | 1.7 | Num_rotatable_bonds: | 0 |
| MolWt: | 108.14 | Num_heavy_atoms: | 8 |
| TPSA: | 20.23 | NumAromaticRings: | 1 |
AD11915
Formula: C6H2N4Cl
Smiles:
Clc1ncnc2c1[N]C=N2| HBA: | 4 | RingCount: | 2 |
| HBD: | 0 | FractionCSP3: | 0.0 |
| AlogP: | 1.04 | Num_rotatable_bonds: | 0 |
| MolWt: | 153.55 | Num_heavy_atoms: | 10 |
| TPSA: | 52.24 | NumAromaticRings: | 1 |
