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Records 3341 to 3360 of 4258
 
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Total Surface Area
TPSA
cLogS
MW
cLogP
H-Acceptors
H-Donors
Ro5 violations
Druglikeness
DrugScore
50315912 BDB-kin50316267.mol2, BDB-kin50316267.pdbqt 307,55 138,6 -4,112 413,505 0,956 9 1 0 4,932 0,733495938593438
50315913 BDB-kin50316268.mol2, BDB-kin50316268.pdbqt 380,87 141,84 -5,181 516,628 2,5323 10 1 1 8,0476 0,506799798193358
50315914 BDB-kin50316269.mol2, BDB-kin50316269.pdbqt 393,13 141,84 -5,525 530,655 2,8762 10 1 1 7,7711 0,457295285971202
50315915 BDB-kin50316270.mol2, BDB-kin50316270.pdbqt 341,82 160,81 -6,73 482,588 2,0945 9 1 0 -0,62294 0,293337801512625
50316252 BDB-kin50316271.mol2, BDB-kin50316271.pdbqt 327,81 111,63 -4,6 437,502 1,7937 10 1 0 2,2866 0,627706245990707
50316253 BDB-kin50316272.mol2, BDB-kin50316272.pdbqt 362,74 111,63 -5,387 479,583 2,9399 10 1 0 -31,099 0,258544178417966
50316254 BDB-kin50316273.mol2, BDB-kin50316273.pdbqt 453,59 146,97 -6,548 600,678 3,4452 13 3 2 0,77452 0,177840284869085
50316255 BDB-kin50316274.mol2, BDB-kin50316274.pdbqt 396,98 126,74 -5,723 522,608 2,6693 12 2 2 -4,778 0,228950726893721
50316256 BDB-kin50316275.mol2, BDB-kin50316275.pdbqt 418,59 126,74 -6,098 554,625 2,85 12 2 2 -6,7126 0,198971691977157
50316257 BDB-kin50316276.mol2, BDB-kin50316276.pdbqt 427,34 120,67 -5,564 556,669 2,5415 11 3 2 7,7697 0,279789511724474
50316258 BDB-kin50316277.mol2, BDB-kin50316277.pdbqt 419,72 126,74 -6,552 556,625 3,6124 12 2 2 2,6508 0,341635989126621
50316259 BDB-kin50316278.mol2, BDB-kin50316278.pdbqt 411,24 126,74 -6,487 548,646 3,199 12 2 2 -5,244 0,150232538581003
50316260 BDB-kin50316279.mol2, BDB-kin50316279.pdbqt 428,76 126,74 -6,207 568,652 3,2306 12 2 2 -31,769 0,186063562734078
50316261 BDB-kin50316280.mol2, BDB-kin50316280.pdbqt 509,08 139,21 -6,245 669,784 3,6344 14 2 2 2,9998 0,299216071863948
50316262 BDB-kin50316281.mol2, BDB-kin50316281.pdbqt 421,41 126,74 -6,596 562,673 3,5796 12 2 2 -30,299 0,139278213210805
50316263 BDB-kin50316282.mol2, BDB-kin50316282.pdbqt 441,56 129,12 -6,364 578,679 3,3003 12 3 2 8,0139 0,355354266920492
50316264 BDB-kin50316283.mol2, BDB-kin50316283.pdbqt 407,15 126,74 -5,832 536,635 3,0499 12 2 2 -29,832 0,212614287792086
50316265 BDB-kin50316284.mol2, BDB-kin50316284.pdbqt 499,08 129,98 -6,864 653,785 4,4564 13 2 2 2,4168 0,252280540970353
50316266 BDB-kin50316285.mol2, BDB-kin50316285.pdbqt 521,64 133,22 -5,747 682,827 3,7438 14 2 2 7,4313 0,323126817837451
50316267 BDB-kin50316286.mol2, BDB-kin50316286.pdbqt 451,99 113,33 -6,483 589,702 3,7697 11 2 2 7,585 0,329451805294398
These data are only available for scientific research purposes.