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Records 1641 to 1660 of 4258
 
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Total Surface Area
TPSA
cLogS
MW
cLogP
H-Acceptors
H-Donors
Ro5 violations
Druglikeness
DrugScore
174344 BDB-kin174508.mol2, BDB-kin174508.pdbqt 355,19 118,07 -6,981 473,539 2,4202 11 1 1 0,99077 0,369134850357055
174345 BDB-kin174509.mol2, BDB-kin174509.pdbqt 361,54 118,07 -7,295 491,529 2,521 11 1 1 -0,34923 0,282825666400994
174346 BDB-kin174510.mol2, BDB-kin174510.pdbqt 368,23 118,16 -7,1 516,596 2,3033 10 1 1 1,3019 0,347809118889449
174347 BDB-kin174511.mol2, BDB-kin174511.pdbqt 331,29 87,4 -6,472 430,51 2,9894 8 0 0 -2,8455 0,249884974922634
174348 BDB-kin174512.mol2, BDB-kin174512.pdbqt 333,75 79,4 -6,224 444,537 3,1932 8 1 0 1,6861 0,436530085747401
174349 BDB-kin174513.mol2, BDB-kin174513.pdbqt 333,25 109,43 -6,159 450,497 1,8914 10 0 0 -3,6649 0,255406813562904
174350 BDB-kin174514.mol2, BDB-kin174514.pdbqt 331,84 72,84 -5,717 435,526 3,0838 8 0 0 1,4746 0,474611349891643
174351 BDB-kin174515.mol2, BDB-kin174515.pdbqt 325 63,61 -6,435 439,945 3,7598 7 0 0 1,4844 0,401774896626761
174352 BDB-kin174516.mol2, BDB-kin174516.pdbqt 321,84 63,61 -6,043 419,527 3,4977 7 0 0 1,4345 0,446402125789492
174353 BDB-kin174517.mol2, BDB-kin174517.pdbqt 321,84 63,61 -6,043 419,527 3,4977 7 0 0 1,4345 0,446402125789492
174354 BDB-kin174518.mol2, BDB-kin174518.pdbqt 338,19 72,84 -6,031 453,516 3,1846 8 0 0 0,13461 0,368335030639242
174355 BDB-kin174519.mol2, BDB-kin174519.pdbqt 331,84 72,84 -5,717 435,526 3,0838 8 0 0 1,4746 0,474611349891643
174356 BDB-kin174520.mol2, BDB-kin174520.pdbqt 308,34 76,5 -4,904 406,488 2,1529 8 0 0 1,4345 0,58755007501187
174357 BDB-kin174521.mol2, BDB-kin174521.pdbqt 299,27 76,75 -5,357 395,462 2,2885 8 0 0 1,4556 0,550476237389155
174358 BDB-kin174522.mol2, BDB-kin174522.pdbqt 342,29 87,4 -6,85 444,537 3,3141 8 0 0 -1,6808 0,251458633687228
174359 BDB-kin174523.mol2, BDB-kin174523.pdbqt 340,69 83,84 -5,961 449,553 2,8812 8 1 0 2,545 0,479341264627171
174360 BDB-kin174524.mol2, BDB-kin174524.pdbqt 340,69 83,84 -5,961 449,553 2,8812 8 1 0 2,545 0,479341264627171
174361 BDB-kin174530.mol2, BDB-kin174530.pdbqt 326,93 83,84 -5,781 435,526 3,1328 8 1 0 2,6109 0,49863754380926
174362 BDB-kin174531.mol2, BDB-kin174531.pdbqt 332,84 63,61 -6,421 433,554 3,8224 7 0 0 2,5992 0,429702210970641
174363 BDB-kin174532.mol2, BDB-kin174532.pdbqt 332,84 63,61 -6,421 433,554 3,8224 7 0 0 2,5992 0,429702210970641
These data are only available for scientific research purposes.