Table 5. Data of QSAR.
Entry | Chiv5 | (bcutm1) | (MRVSA9) | (MRVSA6) | (PEOEVSA5) | GATSv4 | PIC50 |
---|---|---|---|---|---|---|---|
1 | 0.534 | 2.074 | 0.000 | 0.00 | 0.00 | 0.91 | 3.78 |
2 | 1.002 | 3.284 | 4.274 | 0.00 | 63.232 | 0.97 | 3.22 |
3 | 2.510 | 4.521 | 18.101 | 84.35 | 75.007 | 1.01 | 3.88 |
4 | 2.857 | 4.803 | 27.252 | 92.40 | 83.851 | 1.13 | 4.64 |
5 | 4.642 | 4.251 | 29.319 | 101.27 | 83.851 | 1.37 | 5.08 |
6 | 6.204 | 3.658 | 45.297 | 100.09 | 103.659 | 1.42 | 5.32 |
7 | 5.541 | 5.270 | 38.231 | 105.53 | 159.668 | 1.55 | 6.00 |
8 | 0.357 | 1.287 | 5.312 | 0.00 | 61.522 | 0.87 | 3.56 |
9 | 3.714 | 3.280 | 23.051 | 90.91 | 120.474 | 1.00 | 4.99 |
10 | 5.916 | 4.281 | 31.594 | 100.73 | 131.976 | 1.19 | 5.37 |
11 | 5.284 | 4.005 | 36.024 | 107.87 | 139.817 | 1.33 | 5.86 |
12 | 7.251 | 5.299 | 42.981 | 103.61 | 139.817 | 1.37 | 6.28 |
13 | 6.200 | 3.274 | 49.993 | 97.39 | 169.210 | 1.46 | 4.11 |
14 | 6.842 | 4.257 | 25.147 | 109.11 | 124.568 | 1.53 | 4.57 |
15 | 5.107 | 3.022 | 32.247 | 92.24 | 111.027 | 1.41 | 5.78 |