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Records 2541 to 2560 of 4258
 
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Total Surface Area
TPSA
cLogS
MW
cLogP
H-Acceptors
H-Donors
Ro5 violations
Druglikeness
DrugScore
245513 BDB-kin251631.mol2, BDB-kin251631.pdbqt 341,29 79,82 -5,79 447,537 2,803 8 1 0 -4,9699 0,155548833613544
245514 BDB-kin251632.mol2, BDB-kin251632.pdbqt 338,53 79,82 -5,868 447,537 2,8588 8 1 0 0,86594 0,259212323157275
245515 BDB-kin251633.mol2, BDB-kin251633.pdbqt 341,29 79,82 -5,79 447,537 2,803 8 1 0 -4,9699 0,155548833613544
245516 BDB-kin251634.mol2, BDB-kin251634.pdbqt 338,63 71,03 -5,158 447,537 2,7275 8 0 0 2,1591 0,327249950585046
245517 BDB-kin251635.mol2, BDB-kin251635.pdbqt 338,63 71,03 -5,158 447,537 2,7275 8 0 0 2,1591 0,327249950585046
245519 BDB-kin251636.mol2, BDB-kin251636.pdbqt 389,52 71,03 -6,698 519,619 4,3033 8 0 1 -5,847 0,104376413794593
245520 BDB-kin251637.mol2, BDB-kin251637.pdbqt 365,09 71,03 -6,581 497,544 3,6225 8 0 0 -4,5009 0,120323998280461
245521 BDB-kin251638.mol2, BDB-kin251638.pdbqt 344,98 71,03 -5,997 465,527 3,1797 8 0 0 0,81915 0,240386532650329
245522 BDB-kin251639.mol2, BDB-kin251639.pdbqt 344,98 71,03 -5,997 465,527 3,1797 8 0 0 0,81915 0,240386532650329
245523 BDB-kin251640.mol2, BDB-kin251640.pdbqt 334,98 61,8 -6,616 449,528 4,0017 7 0 0 1,3042 0,22261833513624
245524 BDB-kin251641.mol2, BDB-kin251641.pdbqt 331,22 71,03 -5,727 451,5 2,8377 8 0 0 1,9835 0,290896534129995
245525 BDB-kin251642.mol2, BDB-kin251642.pdbqt 389,52 71,03 -6,698 519,619 4,3033 8 0 1 -3,3087 0,107747841163688
245526 BDB-kin251643.mol2, BDB-kin251643.pdbqt 369,41 71,03 -6,114 487,602 3,8605 8 0 0 -0,23696 0,182071800692608
245527 BDB-kin251644.mol2, BDB-kin251644.pdbqt 369,41 71,03 -6,114 487,602 3,8605 8 0 0 -0,23696 0,182071800692608
245528 BDB-kin251645.mol2, BDB-kin251645.pdbqt 355,65 71,03 -5,844 473,575 3,5185 8 0 0 0,94757 0,240435182474362
245529 BDB-kin251646.mol2, BDB-kin251646.pdbqt 359,41 61,8 -6,733 471,603 4,6825 7 0 0 1,3113 0,192872501110212
245530 BDB-kin251647.mol2, BDB-kin251647.pdbqt 345,65 61,8 -6,463 457,576 4,3405 7 0 0 2,2191 0,228391580571804
245531 BDB-kin251648.mol2, BDB-kin251648.pdbqt 369,41 71,03 -6,114 487,602 3,8605 8 0 0 -3,5793 0,12977673442922
245534 BDB-kin251649.mol2, BDB-kin251649.pdbqt 369,74 71,03 -6,09 493,581 3,5681 8 0 0 1,5407 0,234995108869132
245535 BDB-kin251650.mol2, BDB-kin251650.pdbqt 395,63 73,83 -6,774 514,672 4,3173 8 1 1 2,3001 0,198639963466037
These data are only available for scientific research purposes.