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Records 3141 to 3160 of 4258
 
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Total Surface Area
TPSA
cLogS
MW
cLogP
H-Acceptors
H-Donors
Ro5 violations
Druglikeness
DrugScore
50310989 BDB-kin50314327.mol2, BDB-kin50314327.pdbqt 351,95 93,07 -5,601 465,552 2,4865 9 1 0 1,9737 0,490136477701688
50312605 BDB-kin50314328.mol2, BDB-kin50314328.pdbqt 282,5 138,52 -4,709 386,479 1,6063 8 2 0 1,2826 0,619123261788586
50312606 BDB-kin50314329.mol2, BDB-kin50314329.pdbqt 345,7 167,29 -3,757 490,611 0,2524 11 1 1 6,015 0,67478590424527
50312613 BDB-kin50314330.mol2, BDB-kin50314330.pdbqt 270,24 138,52 -4,341 372,452 1,2084 8 2 0 1,2826 0,666259600818601
50312614 BDB-kin50314331.mol2, BDB-kin50314331.pdbqt 357,96 167,29 -4,125 504,638 0,6503 11 1 2 5,7195 0,628668743383337
50312615 BDB-kin50314332.mol2, BDB-kin50314332.pdbqt 287,13 115,4 -5,072 395,486 2,2899 7 2 0 3,1194 0,374826378155721
50313645 BDB-kin50314333.mol2, BDB-kin50314333.pdbqt 238,59 98,3 -5,225 319,371 2,006 7 2 0 0,22504 0,520165696615609
50314051 BDB-kin50314334.mol2, BDB-kin50314334.pdbqt 332,74 72,18 -6,489 459,43 4,0576 6 1 0 -2,8677 0,217156436463358
50314316 BDB-kin50314335.mol2, BDB-kin50314335.pdbqt 461,42 130,92 -6,779 633,707 3,2847 12 2 2 6,492 0,246633614652294
50314317 BDB-kin50314336.mol2, BDB-kin50314336.pdbqt 461,42 130,92 -6,779 633,707 3,2847 12 2 2 4,4855 0,306806097196284
50314318 BDB-kin50314337.mol2, BDB-kin50314337.pdbqt 449,92 130,92 -5,937 607,669 2,9285 12 2 2 6,6507 0,36739590716696
50314319 BDB-kin50314338.mol2, BDB-kin50314338.pdbqt 450,42 121,69 -6,47 593,686 3,7721 11 2 2 8,6061 0,327618005911302
50314320 BDB-kin50314339.mol2, BDB-kin50314339.pdbqt 422,9 121,69 -5,87 565,632 2,9595 11 2 2 7,7995 0,40053933183791
50314321 BDB-kin50314340.mol2, BDB-kin50314340.pdbqt 379,33 110,61 -6,558 522,563 2,9385 10 2 1 0,85013 0,337351088102791
50314322 BDB-kin50314341.mol2, BDB-kin50314341.pdbqt 379,33 110,61 -6,558 522,563 2,9385 10 2 1 3,8677 0,392682583791081
50314323 BDB-kin50314342.mol2, BDB-kin50314342.pdbqt 367,83 110,61 -5,716 496,526 2,5823 10 2 0 3,445 0,473604539995943
50314324 BDB-kin50314343.mol2, BDB-kin50314343.pdbqt 441,17 123,08 -7,186 607,669 2,9589 12 2 2 2,8947 0,307078589451135
50314325 BDB-kin50314345.mol2, BDB-kin50314345.pdbqt 379,33 110,61 -6,558 522,563 2,9385 10 2 1 3,6794 0,391861607164165
50314326 BDB-kin50314346.mol2, BDB-kin50314346.pdbqt 380,57 97,72 -7,353 521,575 3,9394 9 2 1 3,6794 0,335725736418147
50314327 BDB-kin50314347.mol2, BDB-kin50314347.pdbqt 383,15 100,96 -5,269 516,6 1,9305 10 2 1 5,8984 0,507421299653863
These data are only available for scientific research purposes.