Page 
 of 6265
Records 124681 to 124700 of 125298
 
Download
Total Surface Area
TPSA
cLogS
MW
cLogP
H-Acceptors
H-Donors
Ro5 violations
Druglikeness
DrugScore
50446304 50446304.mol2, BDB-kin50446304.pdbqt 330,76 69,91 -5,762 436,486 2,624 7 1 0 -2,2792 0,289984358357083
50446305 50446305.mol2, BDB-kin50446305.pdbqt 330,76 69,91 -5,762 436,486 2,624 7 1 0 -2,2792 0,289984358357083
50446306 50446306.mol2, BDB-kin50446306.pdbqt 325,67 69,91 -5,579 418,495 2,775 7 1 0 -1,7132 0,321682390720345
50446307 50446307.mol2, BDB-kin50446307.pdbqt 296,21 83,9 -4,899 378,431 1,6086 7 1 0 -4,1207 0,345144504529137
50446308 50446308.mol2, BDB-kin50446308.pdbqt 322,02 86,56 -5,192 415,452 2,1591 8 1 0 -2,2698 0,334721831300042
50446309 50446309.mol2, BDB-kin50446309.pdbqt 350,66 96,21 -5,29 462,504 1,9093 9 1 0 -2,4886 0,302806501197798
50446310 50446310.mol2, BDB-kin50446310.pdbqt 350,66 96,21 -5,29 462,504 1,9093 9 1 0 -2,4886 0,302806501197798
50446311 50446311.mol2, BDB-kin50446311.pdbqt 332,91 79,14 -5,038 434,494 2,0088 8 1 0 -0,92334 0,394005124886629
50446312 50446312.mol2, BDB-kin50446312.pdbqt 325,67 69,91 -5,361 418,495 2,6277 7 1 0 -1,1004 0,364279682909489
50446313 50446313.mol2, BDB-kin50446313.pdbqt 335,67 79,14 -4,96 434,494 1,8611 8 1 0 -1,0256 0,394104058638793
50446314 50446314.mol2, BDB-kin50446314.pdbqt 335,23 83,9 -6,281 432,522 2,8326 7 1 0 -4,9339 0,246005768924694
50446315 50446315.mol2, BDB-kin50446315.pdbqt 330,76 90,14 -5,18 434,494 1,9229 8 2 0 0,56309 0,491291393017033
50446316 50446316.mol2, BDB-kin50446316.pdbqt 330,76 90,14 -5,18 434,494 1,9229 8 2 0 0,56309 0,491291393017033
50446317 50446317.mol2, BDB-kin50446317.pdbqt 325,67 69,91 -5,579 418,495 2,775 7 1 0 -2,0447 0,311033557673393
50446318 50446318.mol2, BDB-kin50446318.pdbqt 325,67 69,91 -5,579 418,495 2,775 7 1 0 -2,0447 0,311033557673393
50446319 50446319.mol2, BDB-kin50446319.pdbqt 343,69 69,91 -5,763 450,512 2,8474 7 1 0 -3,0954 0,267909277870809
50446320 50446320.mol2, BDB-kin50446320.pdbqt 339,43 69,91 -5,631 432,522 2,9697 7 1 0 -1,7554 0,307980438534432
50446321 50446321.mol2, BDB-kin50446321.pdbqt 336,77 61,12 -5,217 432,522 3,0279 7 0 0 2,7667 0,55731475831122
50446322 50446322.mol2, BDB-kin50446322.pdbqt 331,14 83,9 -5,506 420,511 2,8471 7 1 0 -7,4234 0,168570212234548
50446392 50446392.mol2, BDB-kin50446392.pdbqt 288,79 70,25 -5,374 392,38 4,9534 6 2 0 2,8551 0,461680564112883
These data are only available for scientific research purposes.