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Records 2121 to 2140 of 4258
 
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Total Surface Area
TPSA
cLogS
MW
cLogP
H-Acceptors
H-Donors
Ro5 violations
Druglikeness
DrugScore
178335 BDB-kin200300.mol2, BDB-kin200300.pdbqt 446,27 135,22 -6,206 594,71 3,855 12 2 2 -21,086 0,168094309102965
178336 BDB-kin21.mol2, BDB-kin21.pdbqt 380,08 133,84 -5,854 521,644 3,9811 10 1 1 4,5297 0,402051607828973
178337 BDB-kin21026.mol2, BDB-kin21026.pdbqt 403,79 126,74 -6,045 546,63 2,8189 12 2 2 4,6827 0,405948980570458
178338 BDB-kin21027.mol2, BDB-kin21027.pdbqt 377,68 108,92 -5,621 512,584 2,8772 10 2 1 1,6835 0,430425495704742
178339 BDB-kin21028.mol2, BDB-kin21028.pdbqt 430,94 131,04 -6,815 591,642 3,7865 12 2 2 1,4456 0,285332267508347
178340 BDB-kin21029.mol2, BDB-kin21029.pdbqt 401,09 134,7 -5,688 544,614 2,7548 12 2 2 2,7195 0,421493823563599
178341 BDB-kin21030.mol2, BDB-kin21030.pdbqt 403,79 126,74 -5,52 546,63 2,4675 12 2 2 5,4202 0,449803171420584
178342 BDB-kin21031.mol2, BDB-kin21031.pdbqt 425,83 118,15 -6,771 572,664 4,3352 11 2 2 2,7856 0,298870809162011
178343 BDB-kin21032.mol2, BDB-kin21032.pdbqt 414,2 118,15 -6,245 568,648 3,0971 11 2 2 0,66358 0,309829841303532
178344 BDB-kin21033.mol2, BDB-kin21033.pdbqt 432,78 151,44 -6,156 616,713 2,3557 12 2 2 -0,8625 0,232651840852389
178345 BDB-kin21034.mol2, BDB-kin21034.pdbqt 440,52 112,16 -5,799 595,717 3,4931 11 2 2 4,8664 0,368144070639226
178346 BDB-kin21035.mol2, BDB-kin21035.pdbqt 399,94 118,15 -5,481 542,61 2,7048 11 2 2 0,54695 0,370208551686403
178347 BDB-kin21036.mol2, BDB-kin21036.pdbqt 420,41 112,16 -5,433 563,701 3,1976 11 2 2 6,064 0,42603639452062
178348 BDB-kin21037.mol2, BDB-kin21037.pdbqt 376,68 108,92 -6,324 524,595 3,327 10 2 1 1,9689 0,298551537353475
178349 BDB-kin21038.mol2, BDB-kin21038.pdbqt 427,96 118,15 -6,297 582,675 3,3837 11 2 2 -1,8347 0,20127914057325
178350 BDB-kin21039.mol2, BDB-kin21039.pdbqt 398,37 134,95 -6,689 551,577 3,2677 12 2 2 2,5167 0,347334085802809
178351 BDB-kin21040.mol2, BDB-kin21040.pdbqt 429,7 143,93 -6,352 592,63 3,2423 13 2 2 1,4456 0,315140222524004
178352 BDB-kin21041.mol2, BDB-kin21041.pdbqt 386,68 118,15 -5,705 540,594 2,505 11 2 2 1,3892 0,39770640158447
178353 BDB-kin21042.mol2, BDB-kin21042.pdbqt 438,53 118,15 -7,399 608,644 4,5368 11 2 2 1,4456 0,239894183905498
178354 BDB-kin21043.mol2, BDB-kin21043.pdbqt 429,7 143,93 -6,545 592,63 3,137 13 2 2 1,4456 0,309478324082301
These data are only available for scientific research purposes.