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Records 2501 to 2520 of 4258
 
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Total Surface Area
TPSA
cLogS
MW
cLogP
H-Acceptors
H-Donors
Ro5 violations
Druglikeness
DrugScore
245473 BDB-kin251591.mol2, BDB-kin251591.pdbqt 252,94 65,12 -6,641 355,4 3,0942 6 1 0 1,3249 0,27000422204473
245474 BDB-kin251592.mol2, BDB-kin251592.pdbqt 352,39 71,03 -5,428 461,564 3,0695 8 0 0 0,41425 0,25322049922184
245475 BDB-kin251593.mol2, BDB-kin251593.pdbqt 349,63 71,03 -5,506 461,564 3,1253 8 0 0 2,6007 0,300133160217243
245476 BDB-kin251594.mol2, BDB-kin251594.pdbqt 368,91 71,03 -5,851 493,581 3,4683 8 0 0 -0,48211 0,186373177867185
245477 BDB-kin251595.mol2, BDB-kin251595.pdbqt 324,87 71,03 -4,888 433,51 2,3855 8 0 0 3,3235 0,367520941792196
245478 BDB-kin251596.mol2, BDB-kin251596.pdbqt 333,72 82,03 -5,378 447,537 2,6974 8 1 0 2,7229 0,322536866677797
245479 BDB-kin251597.mol2, BDB-kin251597.pdbqt 355,98 71,03 -5,82 479,554 3,2261 8 0 0 1,2607 0,252260793693194
245480 BDB-kin251598.mol2, BDB-kin251598.pdbqt 362,56 71,03 -5,537 475,591 3,3675 8 0 0 0,85789 0,252380526242067
245481 BDB-kin251599.mol2, BDB-kin251599.pdbqt 358,74 71,03 -5,742 479,554 3,1703 8 0 0 -0,92575 0,185041767417823
245482 BDB-kin251600.mol2, BDB-kin251600.pdbqt 331,22 71,03 -5,202 451,5 2,4863 8 0 0 1,9835 0,322805275074374
245483 BDB-kin251601.mol2, BDB-kin251601.pdbqt 358,74 71,03 -5,742 479,554 3,1703 8 0 0 -4,5009 0,145719573904629
245484 BDB-kin251602.mol2, BDB-kin251602.pdbqt 358,74 71,03 -5,742 479,554 3,1703 8 0 0 -4,5009 0,145719573904629
245485 BDB-kin251603.mol2, BDB-kin251603.pdbqt 338,53 79,82 -5,53 447,537 2,767 8 1 0 4,3596 0,321208359886163
245486 BDB-kin251604.mol2, BDB-kin251604.pdbqt 341,29 79,82 -5,452 447,537 2,7112 8 1 0 2,1689 0,311558549783047
245487 BDB-kin251605.mol2, BDB-kin251605.pdbqt 336,98 82,03 -5,794 459,548 3,1464 8 1 0 1,2859 0,26474421156391
245488 BDB-kin251606.mol2, BDB-kin251606.pdbqt 350,74 82,03 -6,064 473,575 3,4884 8 1 0 1,2658 0,240888421755008
245489 BDB-kin251607.mol2, BDB-kin251607.pdbqt 352,39 71,03 -5,428 461,564 3,0695 8 0 0 -3,1609 0,164481847840092
245490 BDB-kin251608.mol2, BDB-kin251608.pdbqt 352,39 71,03 -5,428 461,564 3,0695 8 0 0 -3,1609 0,164481847840092
245491 BDB-kin251609.mol2, BDB-kin251609.pdbqt 355,98 71,03 -6,345 479,554 3,5775 8 0 0 1,2607 0,226935816775702
245492 BDB-kin251610.mol2, BDB-kin251610.pdbqt 362,33 71,03 -6,659 497,544 3,6783 8 0 0 1,2607 0,208739365136067
These data are only available for scientific research purposes.