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Records 2581 to 2600 of 4258
 
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Total Surface Area
TPSA
cLogS
MW
cLogP
H-Acceptors
H-Donors
Ro5 violations
Druglikeness
DrugScore
25118 BDB-kin111698.mol2, BDB-kin111698.pdbqt 283,85 90,28 -2,392 392,437 0,7906 7 3 0 7,3504 0,854946007860399
25121 BDB-kin111699.mol2, BDB-kin111699.pdbqt 399,74 102,93 -5,348 521,664 3,239 10 2 1 7,9566 0,470068226837186
251578 BDB-kin251661.mol2, BDB-kin251661.pdbqt 301,32 105,79 -5,41 428,512 1,5059 8 1 0 1,8938 0,548173450456832
251579 BDB-kin251662.mol2, BDB-kin251662.pdbqt 328,34 115,02 -5,417 470,548 1,0747 9 1 0 0,14189 0,421580873550704
251580 BDB-kin251663.mol2, BDB-kin251663.pdbqt 328,34 115,02 -5,417 470,548 1,0747 9 1 0 0,14189 0,421580873550704
251581 BDB-kin251664.mol2, BDB-kin251664.pdbqt 315,58 105,79 -5,924 454,549 2,1074 8 1 0 1,9149 0,477724119291235
251582 BDB-kin25617.mol2, BDB-kin25617.pdbqt 297,35 105,79 -5,57 454,428 2,724 8 1 0 -20,939 0,264989900846551
251583 BDB-kin25628.mol2, BDB-kin25628.pdbqt 290,82 105,79 -5,496 426,496 1,2127 8 1 0 2,1729 0,552099556713993
251584 BDB-kin2579.mol2, BDB-kin2579.pdbqt 280,15 105,79 -4,711 400,458 0,66 8 1 0 -1,3605 0,415474988122236
251585 BDB-kin25919.mol2, BDB-kin25919.pdbqt 323,43 119,85 -4,215 458,541 1,5393 10 1 0 3,2596 0,396635311907055
251586 BDB-kin26300.mol2, BDB-kin26300.pdbqt 327,1 127,91 -4,622 471,537 0,0738 10 1 0 0,10385 0,479859207272555
251587 BDB-kin26474.mol2, BDB-kin26474.pdbqt 328,34 115,02 -5,417 470,548 1,0747 9 1 0 0,14189 0,421580873550704
251588 BDB-kin27817.mol2, BDB-kin27817.pdbqt 323,43 119,85 -4,215 458,541 1,5393 10 1 0 3,2596 0,396635311907055
251589 BDB-kin31085.mol2, BDB-kin31085.pdbqt 350,45 129,08 -4,222 500,578 1,1081 11 1 2 1,5183 0,341263532772649
251590 BDB-kin31088.mol2, BDB-kin31088.pdbqt 334,69 115,02 -5,731 488,539 1,1755 9 1 0 -1,2734 0,30638012248995
251591 BDB-kin31093.mol2, BDB-kin31093.pdbqt 307,67 105,79 -5,724 446,502 1,6067 8 1 0 0,47949 0,436751042565648
251592 BDB-kin31095.mol2, BDB-kin31095.pdbqt 301,32 105,79 -5,41 428,512 1,5059 8 1 0 1,8938 0,548173450456832
251593 BDB-kin32362.mol2, BDB-kin32362.pdbqt 300,08 118,68 -5,46 429,5 0,7879 9 1 0 1,8551 0,545499431445991
251594 BDB-kin35572.mol2, BDB-kin35572.pdbqt 334,69 115,02 -5,731 488,539 1,1755 9 1 0 -1,1725 0,310836914227705
251595 BDB-kin35573.mol2, BDB-kin35573.pdbqt 327,1 127,91 -5,467 471,537 0,3567 10 1 0 0,10385 0,416711182634848
These data are only available for scientific research purposes.