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Table 4 ADME properties of Cajanus cajan derived compounds that showed inhibitory activity HDACs

From: In silico profiling of histone deacetylase inhibitory activity of compounds isolated from Cajanus cajan

S/N

Compounds

Molecular Weight

H-bond acceptor

H-bond donor

MlogP

Rotatable bonds

Lipinski violation

1

Betulinic acid

456.7

2

3

5.82

2

1

2

Genistin

432.38

10

6

− 1.61

4

1

3

Orientin

448.38

11

8

− 2.51

3

2

4

Vitexin

432.38

10

7

− 2.02

3

1

  1. MLOGP: octanol/water partition coefficient