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Records 1801 to 1820 of 4258
 
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Total Surface Area
TPSA
cLogS
MW
cLogP
H-Acceptors
H-Donors
Ro5 violations
Druglikeness
DrugScore
174530 BDB-kin174695.mol2, BDB-kin174695.pdbqt 364,81 92,71 -5,857 476,579 2,5669 9 1 0 2,93 0,476449050939484
174531 BDB-kin174696.mol2, BDB-kin174696.pdbqt 388,57 101,94 -5,478 506,605 2,0681 10 1 1 2,6288 0,481946235386323
174532 BDB-kin174697.mol2, BDB-kin174697.pdbqt 379,07 92,71 -6,373 502,617 2,885 9 1 1 4,194 0,421151816323945
174533 BDB-kin174698.mol2, BDB-kin174698.pdbqt 389,57 92,71 -6,287 504,633 3,2396 9 1 1 2,53 0,403305077783359
174534 BDB-kin174699.mol2, BDB-kin174699.pdbqt 392,83 92,71 -6,643 516,644 3,227 9 1 1 2,9088 0,380628187410622
174535 BDB-kin174700.mol2, BDB-kin174700.pdbqt 403,33 92,71 -6,557 518,66 3,694 9 1 1 2,547 0,364982381159538
174536 BDB-kin174701.mol2, BDB-kin174701.pdbqt 382,01 92,71 -6,597 530,549 3,0512 9 1 1 -24,877 0,193005706870861
174537 BDB-kin174702.mol2, BDB-kin174702.pdbqt 375,91 83,92 -5,495 490,606 2,8334 9 0 0 4,0347 0,495308384381507
174538 BDB-kin174703.mol2, BDB-kin174703.pdbqt 399,67 93,15 -5,116 520,632 2,3346 10 0 1 4,2134 0,508054590056148
174539 BDB-kin174704.mol2, BDB-kin174704.pdbqt 390,17 83,92 -6,011 516,644 3,1515 9 0 1 5,3693 0,427048482140795
174540 BDB-kin174705.mol2, BDB-kin174705.pdbqt 400,67 83,92 -5,925 518,66 3,5061 9 0 1 4,032 0,417417824706872
174541 BDB-kin174706.mol2, BDB-kin174706.pdbqt 403,93 83,92 -6,281 530,671 3,4935 9 0 1 4,0993 0,386738234581546
174542 BDB-kin174707.mol2, BDB-kin174707.pdbqt 414,43 83,92 -6,195 532,687 3,9605 9 0 1 4,0882 0,372738272529653
174543 BDB-kin174708.mol2, BDB-kin174708.pdbqt 393,11 83,92 -6,235 544,576 3,3177 9 0 1 -27,39 0,193295212496845
174544 BDB-kin174709.mol2, BDB-kin174709.pdbqt 386,74 109,37 -5,915 526,66 2,5401 10 0 1 4,2798 0,43577270457376
174545 BDB-kin174710.mol2, BDB-kin174710.pdbqt 400,5 109,37 -6,147 540,687 3,0371 10 0 1 3,7039 0,397053121736307
174546 BDB-kin174711.mol2, BDB-kin174711.pdbqt 364,81 92,71 -5,857 476,579 2,5669 9 1 0 2,93 0,476449050939484
174547 BDB-kin174712.mol2, BDB-kin174712.pdbqt 375,91 83,92 -5,495 490,606 2,8334 9 0 0 4,0347 0,495308384381507
174548 BDB-kin174713.mol2, BDB-kin174713.pdbqt 399,67 93,15 -5,116 520,632 2,3346 10 0 1 4,2134 0,508054590056148
174549 BDB-kin174714.mol2, BDB-kin174714.pdbqt 371,16 92,71 -6,171 494,569 2,6677 9 1 0 1,59 0,410102361701294
These data are only available for scientific research purposes.