Table 1.
S. No. | Compound ID | Mol wt. (Da) | Rotatable bond | H-bond acceptor | H-bond donor | LogP | Lipinski Violation |
---|---|---|---|---|---|---|---|
1 | ZINC02123811 | 486.56 | 5 | 5 | 1 | 4.78 | 0 |
2 | ZINC02128147 | 488.49 | 6 | 7 | 3 | 4.01 | 0 |
3 | ZINC02161101 | 472.60 | 3 | 3 | 2 | 3.98 | 0 |
4 | N3-ILP | 680.79 | 17 | 9 | 5 | 2.08 | 2 |