| 
      
        | Com. | pIC50 | 2D QSAR Model-1 | 2D  QSAR model-2 | 2D  QSAR model-3 |  
        | Pred. | Res. | Pred. | Res. | Pred. | Res. |  
        | 1 | 4.5142 | 4.5025 | 0.0117 | 4.5760 | -0.0618 | 4.5071 | 0.0071 |  
        | 2 | 3.8827 | 3.7289 | 0.1538 | 3.5602 | 0.3225 | 3.8565 | 0.0262 |  
        | 3 | 5.3914 | 5.3884 | 0.003 | 5.4473 | -0.0559 | 5.4269 | -0.0355 |  
        | 4 | 6.3381 | 6.2834 | 0.0547 | 6.3064 | 0.0317 | 6.3004 | 0.0377 |  
        | 5 | 5.7878 | 5.7266 | 0.0612 | 5.6906 | 0.0972 | 5.5156 | 0.2722 |  
        | 6 | 5.7544 | 5.7311 | 0.0233 | 5.3742 | 0.3802 | 5.6645 | 0.0899 |  
        | 7 | 4.585 | 4.3007 | 0.2843 | 4.2214 | 0.3636 | 4.2154 | 0.3696 |  
        | 8 | 4.0423 | 4.198 | -0.1557 | 4.1349 | -0.0926 | 4.0298 | 0.0125 |  
        | 9 | 4.5436 | 4.5063 | 0.0373 | 4.4956 | 0.048 | 4.5016 | 0.042 |  
        | 10 | 5.4294 | 5.4625 | -0.0331 | 5.3463 | 0.0831 | 5.3545 | 0.0749 |  
        | 11 | 5.0118 | 5.167 | -0.1552 | 5.1459 | -0.1341 | 5.1551 | -0.1433 |  
        | 12 | 4.7904 | 4.7947 | -0.0043 | 4.7327 | 0.0577 | 4.7427 | 0.0477 |  
        | 13 | 4.5199 | 4.4922 | 0.0277 | 4.3954 | 0.1245 | 4.4066 | 0.1133 |  
        | 14 | 4.91 | 4.8786 | 0.0314 | 4.8533 | 0.0567 | 4.8641 | 0.0459 |  
        | 15 | 4.4294 | 4.4415 | -0.0121 | 4.3402 | 0.0892 | 4.3485 | 0.0809 |  
        | 16 | 4.6716 | 4.6075 | 0.0641 | 4.6685 | 0.0031 | 4.6838 | -0.0122 |  
        | 17 | 5.4814 | 5.318 | 0.1634 | 5.2743 | 0.2071 | 5.2891 | 0.1923 |  
        | 18 | 4.4236 | 4.4157 | 0.0079 | 4.4208 | 0.0028 | 4.296 | 0.1276 |  
        | 19 | 4.8728 | 4.8718 | 0.001 | 4.8432 | 0.0296 | 4.8571 | 0.0157 |  
        | 20 | 4.5968 | 4.3168 | 0.28 | 4.2768 | 0.32 | 4.2922 | 0.3046 |  
        | 21 | 4.6401 | 4.6168 | 0.0233 | 4.6745 | -0.0344 | 4.6896 | -0.0495 |  
        | 22 | 4.7904 | 4.713 | 0.0774 | 4.777 | 0.0134 | 4.7922 | -0.0018 |  
        | 23 | 5.4559 | 5.3027 | 0.1532 | 5.2753 | 0.1806 | 5.2891 | 0.1668 |  
        | 24 | 4.7644 | 4.7937 | -0.0293 | 4.6479 | 0.1165 | 4.6622 | 0.1022 |  
        | 25 | 6.1549 | 6.2882 | -0.1333 | 6.2505 | -0.0956 | 6.2649 | -0.11 |  
        | 26 | 4.7351 | 4.7429 | -0.0078 | 4.7058 | 0.0293 | 4.7216 | 0.0135 |  
        | 27 | 5.0087 | 5.1679 | -0.1592 | 5.042 | -0.0333 | 5.055 | -0.0463 |  
        | 28 | 5.3251 | 5.3506 | -0.0255 | 5.1184 | 0.2067 | 5.2311 | 0.094 |  
        | 29 | 4.7099 | 4.7151 | -0.0052 | 4.6927 | 0.0172 | 4.6025 | 0.1074 |  
        | 30 | 4.7281 | 4.6212 | 0.1069 | 4.675 | 0.0531 | 4.6914 | 0.0367 |  
        | 31 | 4.7594 | 4.7977 | -0.0383 | 4.7604 | -0.001 | 4.7762 | -0.0168 |  
        | 32 | 4.7721 | 4.7702 | 0.0019 | 4.4842 | 0.2879 | 4.6009 | 0.1712 |  |