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Records 3021 to 3040 of 4258
 
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Total Surface Area
TPSA
cLogS
MW
cLogP
H-Acceptors
H-Donors
Ro5 violations
Druglikeness
DrugScore
50304683 BDB-kin50305299.mol2, BDB-kin50305299.pdbqt 240,46 118,29 -4,704 340,41 1,2065 7 1 0 1,9135 0,681300108759932
50304684 BDB-kin50305300.mol2, BDB-kin50305300.pdbqt 240,77 86,72 -5,065 339,418 2,7318 5 1 0 1,94 0,620557773262224
50304685 BDB-kin50305301.mol2, BDB-kin50305301.pdbqt 241,7 105,4 -5,167 339,422 1,7507 6 1 0 1,9135 0,627002820786534
50304686 BDB-kin50305302.mol2, BDB-kin50305302.pdbqt 242,94 92,51 -5,437 338,434 2,4002 5 1 0 1,9135 0,58938566824375
50304687 BDB-kin50305303.mol2, BDB-kin50305303.pdbqt 258,59 82,28 -5,886 362,456 3,1169 5 1 0 2,0949 0,314607775348618
50304688 BDB-kin50305304.mol2, BDB-kin50305304.pdbqt 275,89 95,59 -5,703 380,471 2,7812 6 1 0 2,9645 0,558009346905669
50304689 BDB-kin50305305.mol2, BDB-kin50305305.pdbqt 228,96 118,29 -3,862 314,372 0,8503 7 1 0 1,4805 0,752551720746158
50305287 BDB-kin50305306.mol2, BDB-kin50305306.pdbqt 329,4 96,61 -3,699 436,514 2,0237 9 1 0 4,4253 0,72835737587497
50305288 BDB-kin50305307.mol2, BDB-kin50305307.pdbqt 371,67 92,43 -3,969 485,59 2,4382 9 1 0 5,5081 0,644835165748944
50305289 BDB-kin50305546.mol2, BDB-kin50305546.pdbqt 379,26 79,54 -5,054 502,592 3,4859 8 1 1 4,1681 0,500701654978125
50305290 BDB-kin50305547.mol2, BDB-kin50305547.pdbqt 379,26 79,54 -5,054 502,592 3,4859 8 1 1 4,1681 0,500701654978125
50305291 BDB-kin50305548.mol2, BDB-kin50305548.pdbqt 431,43 92,43 -6,031 561,688 4,0434 9 1 1 5,5081 0,358992280770786
50305292 BDB-kin50305549.mol2, BDB-kin50305549.pdbqt 371,85 79,54 -5,89 506,555 3,6638 8 1 1 3,1839 0,419582151093992
50305293 BDB-kin50305550.mol2, BDB-kin50305550.pdbqt 459,01 92,01 -4,451 585,75 3,4693 10 1 1 7,61 0,470004579491654
50305294 BDB-kin50305551.mol2, BDB-kin50305551.pdbqt 220,42 100,05 -3,35 298,305 0,2957 8 2 0 1,7835 0,140797782298215
50305295 BDB-kin50305552.mol2, BDB-kin50305552.pdbqt 285,55 101,22 -2,804 381,439 0,9648 9 2 0 2,381 0,81425897977045
50305296 BDB-kin50305553.mol2, BDB-kin50305553.pdbqt 373,33 92,43 -4,501 506,008 3,2418 9 1 1 5,6298 0,555851464014279
50305297 BDB-kin50305554.mol2, BDB-kin50305554.pdbqt 370,17 92,43 -4,109 485,59 2,9797 9 1 0 5,5402 0,619522503968254
50305298 BDB-kin50305555.mol2, BDB-kin50305555.pdbqt 363,02 105,32 -3,809 490,541 2,0871 10 1 0 4,281 0,653239898037972
50305299 BDB-kin50305645.mol2, BDB-kin50305645.pdbqt 221,66 87,16 -4,145 297,317 1,2966 7 2 0 1,7835 0,129360343632923
These data are only available for scientific research purposes.