Research Article

Chemical Constituents from Uapaca guineensis (Phyllanthaceae), and the Computational Validation of Their Antileishmanial and Anti-inflammatory Potencies

Table 2

Docked scores of isolated compounds.

CompoundsAntileishmanialAnti-inflammatory
1QCC (kcal/mol)2XOX (kcal/mol)6Y3C (kcal/mol)1CX2 (kcal/mol)

1−7.0−6.6−8.0−7.9
2−6.3−6.0−7.7−7.4
3−6.6−5.9−7.5−7.3
4−7.3−5.8−8.5−8.3
5−6.6−7.8−8.5−8.2
6−7.4−7.7−8.7−8.8
7−7.7−8.3−8.9−9.4
8−5.7−6.4−6.7−7.5
9−7.3−5.2−8.6−8.5
Miltefosine−4.3−5.0−6.5−7.1
Aspirin−5.3−5.7−6.6−6.9