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Records 3641 to 3660 of 4258
 
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Total Surface Area
TPSA
cLogS
MW
cLogP
H-Acceptors
H-Donors
Ro5 violations
Druglikeness
DrugScore
50343760 BDB-kin50343779.mol2, BDB-kin50343779.pdbqt 296,85 88,61 -4,867 383,45 2,2206 8 2 0 -1,5756 0,392722916552583
50343761 BDB-kin50343780.mol2, BDB-kin50343780.pdbqt 296,85 88,61 -4,591 383,45 1,2621 8 2 0 0,40437 0,570132652104079
50343762 BDB-kin50343781.mol2, BDB-kin50343781.pdbqt 283,09 88,61 -4,479 369,424 0,5366 8 2 0 2,3536 0,707137025628206
50343763 BDB-kin50343782.mol2, BDB-kin50343782.pdbqt 315,26 88,61 -5,342 411,504 2,0882 8 2 0 0,44618 0,483599964407201
50343764 BDB-kin50343783.mol2, BDB-kin50343783.pdbqt 319,25 105,68 -5,471 425,487 2,2586 9 2 0 -1,8505 0,325872360709466
50343765 BDB-kin50343784.mol2, BDB-kin50343784.pdbqt 308,25 105,68 -5,093 411,461 1,9339 9 2 0 -2,2143 0,34559784823658
50343766 BDB-kin50346961.mol2, BDB-kin50346961.pdbqt 323,11 108,84 -4,835 427,503 1,1615 9 3 0 0,34521 0,329722420929919
50343767 BDB-kin50346962.mol2, BDB-kin50346962.pdbqt 338,47 112,4 -5,76 436,514 1,7882 9 2 0 -6,8642 0,272120779149847
50343768 BDB-kin50346963.mol2, BDB-kin50346963.pdbqt 325,76 97,84 -5,187 439,514 1,3896 9 2 0 0,19593 0,464799147957126
50343769 BDB-kin50346964.mol2, BDB-kin50346964.pdbqt 349,22 106,43 -5,316 463,54 1,4529 10 2 0 2,8809 0,548426285884141
50343770 BDB-kin50346965.mol2, BDB-kin50346965.pdbqt 341,96 129,07 -4,706 457,529 0,5941 10 4 0 1,5961 0,581548400457616
50343771 BDB-kin50346966.mol2, BDB-kin50346966.pdbqt 326,95 88,61 -6,498 433,51 2,0775 8 2 0 -0,64448 0,327191610551747
50343772 BDB-kin50346967.mol2, BDB-kin50346967.pdbqt 343,28 88,61 -6,128 451,569 2,8607 8 2 0 3,986 0,479366609965034
50343773 BDB-kin50346968.mol2, BDB-kin50346968.pdbqt 343,28 88,61 -6,128 451,569 2,8607 8 2 0 3,986 0,479366609965034
50343774 BDB-kin50346969.mol2, BDB-kin50346969.pdbqt 336,87 108,84 -5,105 441,53 1,6159 9 3 0 -0,27113 0,155932385660645
50343775 BDB-kin50346970.mol2, BDB-kin50346970.pdbqt 325,87 108,84 -4,727 427,503 1,2912 9 3 0 -0,60636 0,160770297117158
50343776 BDB-kin50346971.mol2, BDB-kin50346971.pdbqt 337,37 108,84 -5,569 453,541 1,6474 9 3 0 -0,70954 0,131014527059913
50343777 BDB-kin50346972.mol2, BDB-kin50346972.pdbqt 336,87 108,84 -5,105 441,53 1,6159 9 3 0 -0,27113 0,155932385660645
50343778 BDB-kin50346973.mol2, BDB-kin50346973.pdbqt 325,87 108,84 -4,727 427,503 1,2912 9 3 0 -0,60636 0,160770297117158
50343779 BDB-kin50346974.mol2, BDB-kin50346974.pdbqt 337,37 108,84 -5,569 453,541 1,6474 9 3 0 -0,70954 0,131014527059913
These data are only available for scientific research purposes.