Research Article
Molecular-Field-Based Three-Dimensional Similarity Studies on Quinoline-Based CNS Active Agents
Table 4
Similarity of test compounds with respect to chlorpromazine and template.
| Compd. no. | Similarity | Field similarity | Field score | Vol. similarity | Volume score | Shape similarity | Shape score | | CPZ | Temp | CPZ | Temp | CPZ | Temp | CPZ | Temp | CPZ | Temp | CPZ | Temp | CPZ | Temp |
| 7 | 0.613 | 0.603 | 0.535 | 0.466 | −48.258 | −47.987 | 0.628 | 0.620 | 141.826 | 141.337 | 0.690 | 0.740 | 164.092 | 185.972 | 8 | 0.565 | 0.579 | 0.487 | 0.469 | −41.443 | −46.261 | 0.641 | 0.649 | 147.210 | 147.078 | 0.643 | 0.689 | 151.980 | 172.277 | 9 | 0.557 | 0.575 | 0.532 | 0.451 | −49.327 | −45.631 | 0.572 | 0.589 | 135.325 | 134.285 | 0.583 | 0.699 | 137.385 | 174.194 | 10 | 0.561 | 0.576 | 0.517 | 0.425 | −46.640 | −41.811 | 0.588 | 0.586 | 138.021 | 132.880 | 0.606 | 0.728 | 143.205 | 181.874 | 11 | 0.543 | 0.596 | 0.493 | 0.456 | −46.066 | −44.811 | 0.630 | 0.624 | 141.855 | 147.619 | 0.592 | 0.736 | 145.862 | 191.305 | 12 | 0.581 | 0.582 | 0.500 | 0.436 | −43.990 | −44.166 | 0.578 | 0.569 | 136.276 | 133.575 | 0.662 | 0.728 | 162.107 | 188.021 | 13 | 0.599 | 0.635 | 0.520 | 0.543 | −48.090 | −54.255 | 0.616 | 0.615 | 145.549 | 145.517 | 0.679 | 0.726 | 167.193 | 188.809 | 14 | 0.591 | 0.618 | 0.538 | 0.489 | −51.045 | −49.919 | 0.630 | 0.654 | 142.092 | 153.728 | 0.644 | 0.748 | 157.594 | 193.364 | Average | 0.576 | 0.596 | 0.515 | 0.467 | −46.857 | −46.855 | 0.610 | 0.613 | 141.019 | 142.002 | 0.637 | 0.724 | 153.677 | 184.477 |
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