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Records 3161 to 3180 of 4258
 
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Total Surface Area
TPSA
cLogS
MW
cLogP
H-Acceptors
H-Donors
Ro5 violations
Druglikeness
DrugScore
50314328 BDB-kin50314348.mol2, BDB-kin50314348.pdbqt 346,83 97,72 -6,146 473,531 2,637 9 2 0 4,2068 0,465378231491126
50314329 BDB-kin50314349.mol2, BDB-kin50314349.pdbqt 333,07 97,72 -5,846 459,505 2,2307 9 2 0 4,5128 0,508034742877043
50314330 BDB-kin50314350.mol2, BDB-kin50314350.pdbqt 319,49 85,25 -6,987 424,459 3,8647 7 2 0 3,6038 0,415776187034239
50314331 BDB-kin50314351.mol2, BDB-kin50314351.pdbqt 319,49 85,25 -6,987 424,459 3,8647 7 2 0 3,6038 0,415776187034239
50314332 BDB-kin50314352.mol2, BDB-kin50314352.pdbqt 272,91 64,35 -6,17 368,391 4,0863 5 1 0 1,8485 0,45167018939149
50314333 BDB-kin50314353.mol2, BDB-kin50314353.pdbqt 469,16 134,58 -6,92 628,691 3,6502 12 2 2 7,2945 0,297330322947188
50314334 BDB-kin50314354.mol2, BDB-kin50314354.pdbqt 484,16 121,69 -7,193 641,73 4,3776 11 2 2 8,0637 0,262067574897341
50314335 BDB-kin50314355.mol2, BDB-kin50314355.pdbqt 482,92 134,58 -6,422 642,718 3,4307 12 2 2 8,0637 0,314511829452376
50314336 BDB-kin50314356.mol2, BDB-kin50314356.pdbqt 482,92 134,58 -6,398 642,718 3,3767 12 2 2 8,0637 0,316814761993234
50314337 BDB-kin50314357.mol2, BDB-kin50314357.pdbqt 482,92 134,58 -6,398 642,718 3,3767 12 2 2 8,0637 0,316814761993234
50314338 BDB-kin50314358.mol2, BDB-kin50314358.pdbqt 471,82 143,37 -6,76 628,691 3,1102 12 3 2 7,3246 0,314900302872005
50314339 BDB-kin50314359.mol2, BDB-kin50314359.pdbqt 460,92 130,92 -6,285 621,696 3,3263 12 2 2 7,9386 0,332881431854262
50314340 BDB-kin50314360.mol2, BDB-kin50314360.pdbqt 473,48 124,93 -5,787 634,739 3,1186 12 2 2 8,5858 0,357239630040186
50314341 BDB-kin50314361.mol2, BDB-kin50314361.pdbqt 453,68 121,69 -6,826 605,697 4,0925 11 2 2 5,1969 0,296449889379933
50314342 BDB-kin50314362.mol2, BDB-kin50314362.pdbqt 439,92 121,69 -6,556 591,67 3,7505 11 2 2 7,185 0,325875794521855
50314343 BDB-kin50314363.mol2, BDB-kin50314363.pdbqt 462,48 124,93 -5,439 620,712 3,0379 12 2 2 10,733 0,388665634407401
50314345 BDB-kin50314364.mol2, BDB-kin50314364.pdbqt 325,48 84,66 -5,813 439,47 3,7916 7 1 0 3,8676 0,479218024702668
50314346 BDB-kin50314365.mol2, BDB-kin50314365.pdbqt 303,76 110,68 -4,787 418,452 1,8553 8 2 0 6,8005 0,656251110725529
50314347 BDB-kin50314366.mol2, BDB-kin50314366.pdbqt 299,77 93,61 -4,805 404,469 2,2049 7 2 0 5,1064 0,659337715783899
50314348 BDB-kin50314367.mol2, BDB-kin50314367.pdbqt 286,01 93,61 -4,753 390,442 2,0102 7 2 0 4,7237 0,678364623153978
These data are only available for scientific research purposes.