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Records 2201 to 2220 of 4258
 
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Total Surface Area
TPSA
cLogS
MW
cLogP
H-Acceptors
H-Donors
Ro5 violations
Druglikeness
DrugScore
178416 BDB-kin222562.mol2, BDB-kin222562.pdbqt 427,05 135,97 -4,677 564,645 1,9372 13 2 2 3,9442 0,503109004522376
178417 BDB-kin222563.mol2, BDB-kin222563.pdbqt 409,42 108,92 -6,603 548,617 4,4745 10 2 1 1,0769 0,281772643399776
178418 BDB-kin222564.mol2, BDB-kin222564.pdbqt 482,93 112,16 -7,223 639,798 5,1611 11 2 3 2,4052 0,222241191095746
178419 BDB-kin222565.mol2, BDB-kin222565.pdbqt 438,27 118,15 -6,911 596,633 4,5431 11 2 2 -0,41033 0,197110497219272
178420 BDB-kin222566.mol2, BDB-kin222566.pdbqt 477,97 115,4 -6,358 640,786 4,1836 12 2 2 6,3456 0,106008843157742
178421 BDB-kin222567.mol2, BDB-kin222567.pdbqt 348,66 108,92 -5,29 484,53 2,4553 10 2 0 3,3523 0,522938451577297
178422 BDB-kin222568.mol2, BDB-kin222568.pdbqt 362,42 108,92 -5,56 498,557 2,7973 10 2 0 0,22693 0,379232424581303
178423 BDB-kin222569.mol2, BDB-kin222569.pdbqt 438,03 118,15 -6,935 596,633 4,5053 11 2 2 1,1436 0,248552527596677
178424 BDB-kin222570.mol2, BDB-kin222570.pdbqt 382,07 126,35 -5,025 517,556 2,7196 11 2 2 -8,0031 0,123758849396564
178425 BDB-kin222571.mol2, BDB-kin222571.pdbqt 386,18 118,15 -5,181 528,583 2,2985 11 2 2 0,95545 0,429267686002283
178426 BDB-kin222572.mol2, BDB-kin222572.pdbqt 399,94 118,15 -5,481 542,61 2,7048 11 2 2 0,51227 0,36837516960637
178427 BDB-kin222573.mol2, BDB-kin222573.pdbqt 450,53 118,15 -7,317 610,66 4,8042 11 2 2 1,0769 0,222750571076194
178428 BDB-kin222574.mol2, BDB-kin222574.pdbqt 431,68 118,15 -6,621 578,643 4,4045 11 2 2 1,1436 0,269564025045119
178429 BDB-kin222575.mol2, BDB-kin222575.pdbqt 396,89 126,35 -5,198 527,62 3,3587 11 2 2 -8,5914 0,236290700596784
178430 BDB-kin222576.mol2, BDB-kin222576.pdbqt 505,72 132,47 -5,355 658,801 3,7788 13 2 2 3,2739 0,346904961962845
178431 BDB-kin222577.mol2, BDB-kin222577.pdbqt 462,03 127,38 -6,532 626,659 4,0443 12 2 2 -1,6826 0,172958817678608
178432 BDB-kin222578.mol2, BDB-kin222578.pdbqt 393,59 118,15 -5,167 524,62 2,604 11 2 2 1,8523 0,464640742819795
178433 BDB-kin222579.mol2, BDB-kin222579.pdbqt 476,23 128,29 -5,624 629,763 3,5026 13 2 2 6,2112 0,359363256331149
178434 BDB-kin222580.mol2, BDB-kin222580.pdbqt 487,32 158,25 -6,574 645,758 4,032 13 4 2 2,2343 0,275996045349778
178435 BDB-kin222581.mol2, BDB-kin222581.pdbqt 474,79 127,38 -7,402 652,697 4,3369 12 2 2 -0,036071 0,190639043666746
These data are only available for scientific research purposes.