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Records 3661 to 3680 of 4258
 
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Total Surface Area
TPSA
cLogS
MW
cLogP
H-Acceptors
H-Donors
Ro5 violations
Druglikeness
DrugScore
50343780 BDB-kin50346975.mol2, BDB-kin50346975.pdbqt 352,23 112,4 -6,03 450,541 2,2426 9 2 0 -7,1146 0,252050290666481
50343781 BDB-kin50347076.mol2, BDB-kin50347076.pdbqt 352,23 112,4 -6,03 450,541 2,2426 9 2 0 -7,1146 0,252050290666481
50343782 BDB-kin50348452.mol2, BDB-kin50348452.pdbqt 365,34 91,85 -4,735 468,6 1,8361 9 2 0 5,7507 0,610033210726142
50343783 BDB-kin50349619.mol2, BDB-kin50349619.pdbqt 365,34 91,85 -4,735 468,6 1,8361 9 2 0 5,7507 0,610033210726142
50343784 BDB-kin50349620.mol2, BDB-kin50349620.pdbqt 352,78 97,84 -5,233 455,557 2,0438 9 2 0 3,5027 0,564804144451589
50346961 BDB-kin50349621.mol2, BDB-kin50349621.pdbqt 495,58 78,43 -10,962 683,732 7,8605 7 1 2 0,17503 4,03522465496932E-02
50346962 BDB-kin50349622.mol2, BDB-kin50349622.pdbqt 431,24 75,19 -10,775 600,599 7,3594 6 1 2 -5,6673 3,02657783043845E-02
50346963 BDB-kin50349623.mol2, BDB-kin50349623.pdbqt 477,57 64,55 -11,68 657,69 8,6445 6 0 2 -12,087 2,09025138264717E-02
50346964 BDB-kin50349624.mol2, BDB-kin50349624.pdbqt 409,88 66,32 -10,654 573,573 7,3233 5 1 2 -6,935 3,18191456610069E-02
50346965 BDB-kin50349625.mol2, BDB-kin50349625.pdbqt 413,87 83,39 -10,783 587,556 7,4057 6 1 2 -6,9663 3,07967888364295E-02
50346966 BDB-kin50349626.mol2, BDB-kin50349626.pdbqt 429,78 72,39 -10,911 601,583 7,8336 6 0 2 -9,201 2,92488929774858E-02
50346967 BDB-kin50349627.mol2, BDB-kin50349627.pdbqt 416,04 89,18 -10,859 586,572 7,0079 6 1 2 -6,3762 3,18848143850151E-02
50346968 BDB-kin50349628.mol2, BDB-kin50349628.pdbqt 468,26 117,34 -9,599 649,675 5,6735 9 2 2 0,13932 0,053294838753109
50346969 BDB-kin50349629.mol2, BDB-kin50349629.pdbqt 450,55 94,22 -8,829 622,649 5,4381 8 2 2 1,6893 7,00075341483905E-02
50346970 BDB-kin50349630.mol2, BDB-kin50349630.pdbqt 478,38 78,43 -10,528 629,762 7,3561 7 1 2 7,3074 5,76148286911803E-02
50346971 BDB-kin50349631.mol2, BDB-kin50349631.pdbqt 433,35 94,22 -8,395 568,679 4,9337 8 2 1 8,8255 9,19357681359061E-02
50346972 BDB-kin50349632.mol2, BDB-kin50349632.pdbqt 445,24 83,36 -8,589 582,706 5,1024 8 1 2 9,1441 8,65527827962659E-02
50346973 BDB-kin50349633.mol2, BDB-kin50349633.pdbqt 467,95 94,22 -10,397 618,739 6,3615 8 2 2 7,3074 6,49552393304575E-02
50346974 BDB-kin50349634.mol2, BDB-kin50349634.pdbqt 385,26 65,54 -7,736 502,616 5,3809 6 1 2 7,3074 0,100116319342729
50346975 BDB-kin50349635.mol2, BDB-kin50349635.pdbqt 452,3 104,45 -9,628 594,717 5,7133 8 2 2 7,275 7,50205126215377E-02
These data are only available for scientific research purposes.