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Records 3941 to 3960 of 4258
 
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Total Surface Area
TPSA
cLogS
MW
cLogP
H-Acceptors
H-Donors
Ro5 violations
Druglikeness
DrugScore
50394841 BDB-kin50394860.mol2, BDB-kin50394860.pdbqt 346,26 157,49 -4,109 470,556 0,8488 11 2 1 4,2183 0,400875372205537
50394842 BDB-kin50394861.mol2, BDB-kin50394861.pdbqt 371,58 160,73 -4,22 499,598 1,3646 12 2 1 4,4663 0,372577968323101
50394843 BDB-kin50394862.mol2, BDB-kin50394862.pdbqt 360,02 157,49 -5,309 484,583 2,3703 11 2 1 4,2208 0,316693856843668
50394844 BDB-kin50394863.mol2, BDB-kin50394863.pdbqt 360,02 157,49 -4,379 484,583 1,1908 11 2 1 5,1813 0,37755968601592
50394845 BDB-kin50394864.mol2, BDB-kin50394864.pdbqt 380,38 163,97 -2,983 514,613 0,8803 13 2 2 4,9589 0,406520767279279
50394846 BDB-kin50394865.mol2, BDB-kin50394865.pdbqt 357,82 160,73 -3,95 485,571 1,0226 12 2 1 5,596 0,398505660775416
50394847 BDB-kin50394866.mol2, BDB-kin50394866.pdbqt 369,55 138,52 -3,347 478,559 1,4562 12 2 1 5,607 0,42465190781223
50394848 BDB-kin50394867.mol2, BDB-kin50394867.pdbqt 356,99 144,51 -3,845 465,516 1,6639 12 2 1 3,3254 0,408547998613422
50394849 BDB-kin50394868.mol2, BDB-kin50394868.pdbqt 329,24 118,21 -3,248 421,507 1,404 10 2 0 7,8373 0,47125539376773
50394850 BDB-kin50394869.mol2, BDB-kin50394869.pdbqt 318,14 127 -3,61 407,481 1,1511 10 3 0 2,5113 0,450728544366543
50394851 BDB-kin50394870.mol2, BDB-kin50394870.pdbqt 325,53 135,2 -4,018 422,491 1,4592 10 3 0 -0,2095 0,317561204448283
50394852 BDB-kin50394871.mol2, BDB-kin50394871.pdbqt 325,53 135,2 -4,236 422,491 1,6065 10 3 0 4,5546 0,424021627250389
50394853 BDB-kin50394872.mol2, BDB-kin50394872.pdbqt 316,68 124,2 -3,746 408,465 1,2946 10 2 0 1,4905 0,418725540579175
50394854 BDB-kin50394873.mol2, BDB-kin50394873.pdbqt 320,44 114,97 -4,635 406,492 2,4586 9 2 0 1,0994 0,35283746676652
50394855 BDB-kin50394874.mol2, BDB-kin50394874.pdbqt 306,68 114,97 -4,365 392,466 2,1166 9 2 0 2,3289 0,41171929413379
50394856 BDB-kin50394875.mol2, BDB-kin50394875.pdbqt 292,92 114,97 -4,095 378,439 1,7746 9 2 0 2,0851 0,431035734118413
50394857 BDB-kin50394876.mol2, BDB-kin50394876.pdbqt 301,06 129,55 -5,018 389,422 1,4242 10 2 0 3,4477 0,390040278450344
50394858 BDB-kin50394877.mol2, BDB-kin50394877.pdbqt 311,86 124,62 -5,824 400,445 2,7589 9 2 0 -0,92606 0,211398812764295
50394859 BDB-kin50394878.mol2, BDB-kin50394878.pdbqt 315,48 118,21 -3,77 407,481 1,4811 10 2 0 6,9227 0,459270562089641
50394860 BDB-kin50394879.mol2, BDB-kin50394879.pdbqt 303,57 120,96 -4,539 391,434 1,9109 9 2 0 -3,3604 0,218519226123986
These data are only available for scientific research purposes.