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Records 123461 to 123480 of 125298
 
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Total Surface Area
TPSA
cLogS
MW
cLogP
H-Acceptors
H-Donors
Ro5 violations
Druglikeness
DrugScore
50439903 50439903.mol2, BDB-kin50439903.pdbqt 457,51 111,38 -8,564 610,777 5,3899 8 2 2 5,5109 7,83337737495532E-02
50439904 50439904.mol2, BDB-kin50439904.pdbqt 456,51 120,61 -7,597 612,749 4,1951 9 2 1 4,4968 9,75436444815093E-02
50439905 50439905.mol2, BDB-kin50439905.pdbqt 442,75 120,61 -7,327 598,722 3,7407 9 2 1 4,6956 0,107097274679998
50439906 50439906.mol2, BDB-kin50439906.pdbqt 350,45 122,13 -7,921 485,563 3,7204 7 2 0 3,2915 0,127771000558874
50439907 50439907.mol2, BDB-kin50439907.pdbqt 418,03 99,35 -8,345 555,697 5,6054 7 1 2 6,3233 3,03207865406884E-02
50439908 50439908.mol2, BDB-kin50439908.pdbqt 439,43 121,03 -8,635 590,702 4,9435 8 2 1 3,7235 0,086460967700123
50439909 50439909.mol2, BDB-kin50439909.pdbqt 435,05 99,35 -8,971 581,735 6,2678 7 1 2 -0,62239 4,79954543682795E-02
50439910 50439910.mol2, BDB-kin50439910.pdbqt 403,06 139,64 -7,284 557,625 3,3536 9 1 1 6,1936 0,334480153256626
50439911 50439911.mol2, BDB-kin50439911.pdbqt 480,17 105,83 -6,737 639,819 4,571 9 1 1 9,4761 9,61395948582908E-02
50439912 50439912.mol2, BDB-kin50439912.pdbqt 420,32 88,71 -8,274 570,708 5,5894 7 0 2 3,2598 0,22424889870007
50439913 50439913.mol2, BDB-kin50439913.pdbqt 424,21 118,23 -8,323 577,659 4,7721 8 1 1 3,6937 0,255118621334149
50439914 50439914.mol2, BDB-kin50439914.pdbqt 439,53 108,58 -8,568 597,734 5,4112 8 1 2 4,6379 7,95652699599328E-02
50439915 50439915.mol2, BDB-kin50439915.pdbqt 441,09 102,59 -7,722 596,75 5,1824 8 1 2 6,7278 5,16075477999739E-02
50439916 50439916.mol2, BDB-kin50439916.pdbqt 470,27 120,61 -7,867 626,776 4,6495 9 2 1 4,4068 8,82000181478978E-02
50439917 50439917.mol2, BDB-kin50439917.pdbqt 462,93 117,37 -9,448 619,74 5,8744 8 2 2 3,7931 6,94595329585587E-02
50439918 50439918.mol2, BDB-kin50439918.pdbqt 404,27 99,35 -8,075 541,67 5,151 7 1 2 6,1685 5,67305626910431E-02
50439919 50439919.mol2, BDB-kin50439919.pdbqt 398,32 88,71 -7,518 542,654 4,94 7 0 1 3,2938 0,274762042618428
50439920 50439920.mol2, BDB-kin50439920.pdbqt 450,53 112,24 -8,303 604,729 5,1619 8 1 2 5,0705 4,96920462751858E-02
50439921 50439921.mol2, BDB-kin50439921.pdbqt 387,26 128,37 -7,63 529,615 3,5515 8 3 1 3,8311 0,121428168501538
50439922 50439922.mol2, BDB-kin50439922.pdbqt 371,3 79,48 -7,451 500,617 4,971 6 0 1 5,6224 0,304113422332809
These data are only available for scientific research purposes.