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Records 1561 to 1580 of 4258
 
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Total Surface Area
TPSA
cLogS
MW
cLogP
H-Acceptors
H-Donors
Ro5 violations
Druglikeness
DrugScore
172291 BDB-kin174424.mol2, BDB-kin174424.pdbqt 352,84 81,34 -4,668 444,509 4,1616 6 1 0 -2,552 0,299018533995327
172292 BDB-kin174425.mol2, BDB-kin174425.pdbqt 365,4 75,35 -4,17 457,551 4,271 6 1 0 3,0471 0,563816827791962
172293 BDB-kin174426.mol2, BDB-kin174426.pdbqt 269,1 64,69 -4,124 354,334 3,4744 4 1 0 -12,799 0,359604417341871
172294 BDB-kin174427.mol2, BDB-kin174427.pdbqt 266,16 64,69 -4,303 326,402 3,7369 4 1 0 -3,9416 0,357066858409543
172295 BDB-kin174428.mol2, BDB-kin174428.pdbqt 342,84 72,11 -5,287 428,51 4,9836 5 1 0 -1,7146 0,263506323486013
172296 BDB-kin174429.mol2, BDB-kin174429.pdbqt 379,66 75,35 -4,934 483,589 4,8007 6 1 0 1,7374 0,421002873934845
172297 BDB-kin174430.mol2, BDB-kin174430.pdbqt 351,64 75,35 -4,011 443,524 3,8554 6 1 0 3,2671 0,620483400414796
172298 BDB-kin174431.mol2, BDB-kin174431.pdbqt 403,42 84,58 -4,696 513,615 4,2471 7 1 1 -1,9225 0,272153272106558
172299 BDB-kin174432.mol2, BDB-kin174432.pdbqt 389,16 84,58 -3,932 487,577 3,7629 7 1 0 2,2933 0,567642477799809
172300 BDB-kin174433.mol2, BDB-kin174433.pdbqt 386,57 75,35 -4,798 485,605 5,0016 6 1 1 0,78333 0,378117786809317
172301 BDB-kin174434.mol2, BDB-kin174434.pdbqt 365,4 75,35 -4,311 457,551 4,2617 6 1 0 3,3014 0,557101418813492
172302 BDB-kin174435.mol2, BDB-kin174435.pdbqt 403,27 61,36 -4,573 499,632 5,3436 6 1 1 0,95243 0,366841192699685
172303 BDB-kin174436.mol2, BDB-kin174436.pdbqt 396,36 61,36 -4,602 497,616 4,9218 6 1 0 3,9093 0,453024616578277
172304 BDB-kin174437.mol2, BDB-kin174437.pdbqt 393,1 61,36 -4,464 485,605 4,963 6 1 0 2,175 0,450550222624626
172305 BDB-kin174438.mol2, BDB-kin174438.pdbqt 405,86 70,59 -3,707 501,604 4,1049 7 1 1 2,4688 0,548084873928557
172306 BDB-kin174439.mol2, BDB-kin174439.pdbqt 356,6 72,11 -5,446 442,536 5,3992 5 1 1 -1,7146 0,233827050729274
172307 BDB-kin174440.mol2, BDB-kin174440.pdbqt 366,6 81,34 -4,827 458,535 4,5772 6 1 0 -2,552 0,269070765205837
172308 BDB-kin174441.mol2, BDB-kin174441.pdbqt 393,42 75,35 -5,093 497,616 5,2163 6 1 1 1,7374 0,372231435534092
172309 BDB-kin174442.mol2, BDB-kin174442.pdbqt 291,68 64,69 -4,376 342,445 4,1991 4 1 0 -5,953 0,326801626214414
172310 BDB-kin174443.mol2, BDB-kin174443.pdbqt 290,18 64,69 -4,585 342,445 4,1814 4 1 0 -5,953 0,317842379128125
These data are only available for scientific research purposes.