Glycoside
GD012383
Name:
NoneFormula:
C24H21O3N4ClSmiles:
C[C@@H]1O[C@H](n2cc(-c3ccc(Cl)cc3)c3c(Nc4ccccc4)ncnc32)[C@H](O)[C@H]1OAglycone:
Clc1ccc(C2=C[N]c3ncnc(Nc4ccccc4)c32)cc1Sugarmoiety:
CC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 7 | RingCount: | 5 |
| HBD: | 3 | FractionCSP3: | 0.22 |
| AlogP: | 4.13 | Num_rotatable_bonds: | 4 |
| MolWt: | 436.9 | Num_heavy_atoms: | 31 |
| TPSA: | 92.43 | NumAromaticRings: | 4 |
Unique Aglycone
AD09349
Formula: C19H12N4Cl
Smiles:
Clc1ccc(C2=C[N]c3ncnc(Nc4ccccc4)c32)cc1| HBA: | 4 | RingCount: | 4 |
| HBD: | 1 | FractionCSP3: | 0.0 |
| AlogP: | 4.51 | Num_rotatable_bonds: | 3 |
| MolWt: | 319.78 | Num_heavy_atoms: | 23 |
| TPSA: | 51.91 | NumAromaticRings: | 3 |
