Table 3:
Description and fit value of pharmacophore mapping of compounds
8a–h.
Compounds
R
R1
R2
R3
Fit value
8a
H
2-OH
4-OH
H
3.2
8b
H
2-OH
5-CH3
H
3.0
8c
H
2-OH
5-OCH3
H
3.3
8d
H
2-Cl
3-NO2
6-Cl
2.6
8e
CH3
2-Cl
3-NO2
6-Cl
2.8
8f
CH3
2-OH
5-CH3
H
2.7
8g
CH3
2-OH
5-OCH3
H
3.1
8h
CH3
2-NO2
H
H
2.7
Fit value represents a good match of features of the pharmacophore model with the ligand.