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Records 3701 to 3720 of 4258
 
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Total Surface Area
TPSA
cLogS
MW
cLogP
H-Acceptors
H-Donors
Ro5 violations
Druglikeness
DrugScore
50351948 BDB-kin50355497.mol2, BDB-kin50355497.pdbqt 282,65 108,57 -5,28 419,887 3,3756 5 1 0 -0,41499 0,189727125715105
50351949 BDB-kin50355499.mol2, BDB-kin50355499.pdbqt 317,59 126,73 -5,434 460,876 1,47 9 2 0 2,8728 0,539736942070011
50351950 BDB-kin50355500.mol2, BDB-kin50355500.pdbqt 284,64 123,65 -5,168 418,839 1,089 8 2 0 1,8788 0,581680370306875
50351951 BDB-kin50355501.mol2, BDB-kin50355501.pdbqt 276,12 97,63 -4,567 403,824 1,4149 7 1 0 1,5477 0,636290798903152
50351952 BDB-kin50355504.mol2, BDB-kin50355504.pdbqt 318,83 113,84 -7,201 459,888 2,4188 8 2 0 1,9298 0,401977652747147
50351953 BDB-kin50357645.mol2, BDB-kin50357645.pdbqt 285,88 110,76 -6,935 417,851 2,0378 7 2 0 0,83253 0,402695952301103
50351954 BDB-kin50357650.mol2, BDB-kin50357650.pdbqt 277,36 84,74 -6,334 402,836 2,3637 6 1 0 0,46099 0,415148975768561
50351955 BDB-kin50357651.mol2, BDB-kin50357651.pdbqt 317,75 125,22 -5,877 459,888 3,094 8 3 0 1,7588 0,272118117600185
50351956 BDB-kin50357652.mol2, BDB-kin50357652.pdbqt 284,8 122,14 -5,611 417,851 2,713 7 3 0 0,39373 0,444934292164329
50351957 BDB-kin50357653.mol2, BDB-kin50357653.pdbqt 276,28 96,12 -5,264 402,836 3,0208 6 2 0 0,51461 0,482587790584934
50351958 BDB-kin50357658.mol2, BDB-kin50357658.pdbqt 317,87 122,57 -6,511 460,872 3,5062 8 2 0 -2,0244 0,241820256936228
50351959 BDB-kin50357672.mol2, BDB-kin50357672.pdbqt 284,92 119,49 -6,245 418,835 3,1252 7 2 0 -3,2305 0,255790985520308
50351960 BDB-kin50358204.mol2, BDB-kin50358204.pdbqt 276,4 93,47 -5,898 403,82 3,433 6 1 0 -3,3068 0,268394251881668
50351961 BDB-kin50358205.mol2, BDB-kin50358205.pdbqt 276,12 97,63 -6,469 403,824 1,9734 7 1 0 1,6118 0,467878517681275
50351962 BDB-kin50358206.mol2, BDB-kin50358206.pdbqt 282,65 108,57 -4,632 419,887 3,7515 5 1 0 -0,4495 0,42313344162136
50355393 BDB-kin50358207.mol2, BDB-kin50358207.pdbqt 417,05 95,09 -6,657 560,484 4,9771 10 2 1 5,647 4,99500971784165E-02
50355494 BDB-kin50358208.mol2, BDB-kin50358208.pdbqt 363,05 132,07 -5,618 480,544 3,1288 9 2 0 3,4783 0,483523161411468
50355495 BDB-kin50358209.mol2, BDB-kin50358209.pdbqt 387,09 101,63 -4,849 498,653 4,7573 7 2 0 9,496 0,451075185856792
50355496 BDB-kin50360024.mol2, BDB-kin50360024.pdbqt 263,5 61,02 -3,424 332,406 2,6619 5 2 0 5,2601 0,82036780875209
50355497 BDB-kin50360063.mol2, BDB-kin50360063.pdbqt 292,78 88,41 -5,037 457,686 3,008 7 3 0 -0,8691 0,132682776688268
These data are only available for scientific research purposes.