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Records 2161 to 2180 of 4258
 
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Total Surface Area
TPSA
cLogS
MW
cLogP
H-Acceptors
H-Donors
Ro5 violations
Druglikeness
DrugScore
178375 BDB-kin21064.mol2, BDB-kin21064.pdbqt 406,94 134,7 -5,538 550,593 2,8241 12 2 2 1,0769 0,383453236109429
178376 BDB-kin21065.mol2, BDB-kin21065.pdbqt 420,44 121,81 -6,176 563,632 3,8715 11 2 2 1,0769 0,311980732211063
178377 BDB-kin21066.mol2, BDB-kin21066.pdbqt 440,03 118,15 -7,002 608,644 4,108 11 2 2 -0,036071 0,216298084782998
178378 BDB-kin21067.mol2, BDB-kin21067.pdbqt 430,44 131,04 -6,351 579,631 3,755 12 2 2 1,1436 0,300763213230648
178379 BDB-kin21068.mol2, BDB-kin21068.pdbqt 420,44 121,81 -6,677 563,632 4,1689 11 2 2 1,0769 0,282402071996938
178380 BDB-kin21069.mol2, BDB-kin21069.pdbqt 404,28 134,95 -6,719 547,614 3,5108 12 2 2 3,8567 0,211316876960905
178381 BDB-kin21070.mol2, BDB-kin21070.pdbqt 409,64 126,74 -5,895 552,609 2,8882 12 2 2 3,0175 0,401463717782192
178382 BDB-kin21079.mol2, BDB-kin21079.pdbqt 419,2 134,7 -5,906 564,62 3,222 12 2 2 1,0769 0,342950239811119
178383 BDB-kin213775.mol2, BDB-kin213775.pdbqt 414,09 121,81 -6,363 545,642 4,0681 11 2 2 2,4169 0,338652295179899
178385 BDB-kin213776.mol2, BDB-kin213776.pdbqt 408,89 147,84 -6,086 554,581 3,2595 13 2 2 1,9503 0,218743585594723
178386 BDB-kin213777.mol2, BDB-kin213777.pdbqt 482,58 128,29 -5,938 647,753 3,6034 13 2 2 4,8712 0,329188522222135
178387 BDB-kin213778.mol2, BDB-kin213778.pdbqt 415,78 144,18 -5,996 563,613 2,6681 13 2 2 2,5884 0,385862480360587
178388 BDB-kin213779.mol2, BDB-kin213779.pdbqt 424,09 131,04 -6,037 561,641 3,6542 12 2 2 2,4836 0,359826012939337
178389 BDB-kin213780.mol2, BDB-kin213780.pdbqt 476,23 128,29 -5,624 629,763 3,5026 13 2 2 6,2112 0,359363256331149
178390 BDB-kin213781.mol2, BDB-kin213781.pdbqt 436,85 131,04 -6,845 587,679 4,0296 12 2 2 2,7856 0,179726222914204
178391 BDB-kin213782.mol2, BDB-kin213782.pdbqt 506,22 132,47 -5,819 670,812 3,8103 13 2 2 3,6133 0,317089383836638
178392 BDB-kin213783.mol2, BDB-kin213783.pdbqt 520,48 132,47 -6,583 696,85 4,6116 13 2 2 4,89 0,252629844011564
178393 BDB-kin213784.mol2, BDB-kin213784.pdbqt 454,7 140,27 -6,436 621,668 3,2877 13 2 2 -0,036071 0,243878866534744
178394 BDB-kin213785.mol2, BDB-kin213785.pdbqt 422,13 144,18 -6,31 581,603 2,7689 13 2 2 1,2484 0,326237435031852
178395 BDB-kin213786.mol2, BDB-kin213786.pdbqt 415,28 144,18 -5,532 551,602 2,6366 13 2 2 2,3807 0,423763961638086
These data are only available for scientific research purposes.