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Table 2 Physicochemical properties of compounds calculated based on the Lipinski’s rule of 5

From: In silico studies of bioactive compounds from selected African plants with inhibitory activity against nitric oxide synthase and arginase implicated in asthma

S/N Plant source Ligands Molecular weight LogP No of HB donor No of HB acceptor No of violations
1. Azadirachta indica Nimbin 540.24 1.276 0 9 1
Nimbandiol 456.21 − 0.311 2 7 0
Nimbinene 482.23 0.928 0 7 0
Quercetin 302.04 1.834 5 7 0
Rutin 610.15 − 0.735 10 16 3
2. Crinum glaucum Crinamine 301.342 0.613 1 5 0
Lycorine 287.315 − 0.285 2 5 0
3. Mangifera indica Catechin 290.08 0.852 5 6 0
Ellagic acid 302.01 1.366 4 8 0
Epicatechin 290.08 0.852 5 6 0
Gallic acid 170.02 0.964 4 5 0
Kaempferol 286.05 1.486 4 6 0
Mangiferin 422.08 − 0.631 8 11 2
4. Synthetic Drug Cromolyn Sodium 512.03 0.992 1 11 2