Table 4 Lipinski’s profiles of prioritized lead candidates along with control molecule (M.W. molecular weight, clogP Consensus log P octanol-water partition coefficient, LogP lipophilicity, HBA Hydrogen Bond Acceptor, HBD HydrogenBond Donor
S.No | Molecule name | M.W. (Da) | Consensus LogP | Aqueous solubility (AS) | HBA | HBD |
|---|---|---|---|---|---|---|
1 | CNP0056520 | 394.47 | 1.28 | Very soluble | 2 | 2 |
2 | CNP0126952 | 427.53 | 1.83 | Very soluble | 5 | 3 |
3 | CNP0248480 | 463.57 | 1.23 | Very soluble | 5 | 2 |
4 | Control | 358.29 | -1.88 | Highly Soluble | 9 | 4 |