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Records 124881 to 124900 of 125298
 
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Total Surface Area
TPSA
cLogS
MW
cLogP
H-Acceptors
H-Donors
Ro5 violations
Druglikeness
DrugScore
50447273 50447273.mol2, BDB-kin50447273.pdbqt 330,3 108,14 -5,648 468,499 2,6061 7 2 0 -8,7063 0,256431088255895
50447274 50447274.mol2, BDB-kin50447274.pdbqt 347,5 108,14 -6,388 522,469 3,0904 7 2 1 -16,913 0,201037036066151
50447275 50447275.mol2, BDB-kin50447275.pdbqt 347,5 108,14 -6,388 522,469 3,0904 7 2 1 -16,913 0,201037036066151
50447276 50447276.mol2, BDB-kin50447276.pdbqt 364 109,94 -3,605 545,645 2,9997 7 1 1 -7,8489 0,289454604814318
50447277 50447277.mol2, BDB-kin50447277.pdbqt 382,43 108,14 -6,995 564,549 4,3289 7 2 1 -21,007 0,15298369846984
50447278 50447278.mol2, BDB-kin50447278.pdbqt 361,76 108,14 -6,904 548,507 3,4085 7 2 1 -17,351 0,175597528786918
50447279 50447279.mol2, BDB-kin50447279.pdbqt 347,5 108,14 -6,388 522,469 3,0904 7 2 1 -16,913 0,201037036066151
50447280 50447280.mol2, BDB-kin50447280.pdbqt 307,94 95,25 -4,094 483,432 2,8742 6 2 0 -18,814 0,188374908518297
50447281 50447281.mol2, BDB-kin50447281.pdbqt 307,94 95,25 -4,094 483,432 2,8742 6 2 0 -15,587 0,313958232143034
50447282 50447282.mol2, BDB-kin50447282.pdbqt 303,88 123,49 -4,011 489,46 2,8633 6 2 0 -14,501 0,313518310843329
50447283 50447283.mol2, BDB-kin50447283.pdbqt 303,88 123,49 -4,161 489,46 3,0529 6 2 0 -13,333 0,304827416102967
50447284 50447284.mol2, BDB-kin50447284.pdbqt 299,42 69,23 -4,018 468,417 3,5515 5 1 0 -20,665 0,311393702884143
50447285 50447285.mol2, BDB-kin50447285.pdbqt 349,41 109,94 -2,916 531,618 2,6091 7 1 1 -5,5946 0,31936596356083
50447286 50447286.mol2, BDB-kin50447286.pdbqt 295,36 97,47 -3,935 474,445 3,5406 5 1 0 -13,128 0,311127593968634
50447287 50447287.mol2, BDB-kin50447287.pdbqt 306,7 108,14 -3,824 484,42 2,2247 7 2 0 -13,687 0,331064760321659
50447288 50447288.mol2, BDB-kin50447288.pdbqt 307,94 95,25 -4,094 483,432 2,8742 6 2 0 -11,68 0,313960835236784
50447289 50447289.mol2, BDB-kin50447289.pdbqt 365,61 100,71 -4,1 553,615 3,9467 6 1 1 -6,4938 0,250742852371121
50447290 50447290.mol2, BDB-kin50447290.pdbqt 371,08 143,23 -2,892 567,672 1,9575 8 1 1 -8,1113 0,302210269761646
50447291 50447291.mol2, BDB-kin50447291.pdbqt 305,46 121,03 -3,361 485,408 1,6805 8 2 0 -13,405 0,348353243223722
50447292 50447292.mol2, BDB-kin50447292.pdbqt 363,5 109,94 -3,141 533,634 2,9682 7 1 1 -5,9093 0,308421082053778
These data are only available for scientific research purposes.