Page 
 of 213
Records 3121 to 3140 of 4258
 
Download
Total Surface Area
TPSA
cLogS
MW
cLogP
H-Acceptors
H-Donors
Ro5 violations
Druglikeness
DrugScore
50308774 BDB-kin50309910.mol2, BDB-kin50309910.pdbqt 339,41 122,98 -5,621 457,497 2,1483 11 2 1 -1,3523 0,321402931389896
50308775 BDB-kin50310989.mol2, BDB-kin50310989.pdbqt 322,33 138,33 -6,46 436,499 2,3054 10 2 0 -0,77494 0,318247304273049
50308776 BDB-kin50312605.mol2, BDB-kin50312605.pdbqt 336,09 138,33 -6,465 450,526 2,5614 10 2 0 -0,8031 0,30679226823003
50308777 BDB-kin50312606.mol2, BDB-kin50312606.pdbqt 336,59 138,33 -6,466 462,537 3,1232 10 2 0 -0,56186 0,304254001563231
50308778 BDB-kin50312613.mol2, BDB-kin50312613.pdbqt 351,17 122,98 -5,988 459,513 1,9844 11 2 1 -1,5989 0,17612420438459
50308779 BDB-kin50312614.mol2, BDB-kin50312614.pdbqt 385,97 113,33 -6,366 501,593 2,9712 11 2 2 -0,9783 9,70931325373093E-02
50308780 BDB-kin50312615.mol2, BDB-kin50312615.pdbqt 371,26 130,32 -6,214 488,55 2,4775 11 3 1 -1,769 0,260008078416054
50308781 BDB-kin50313645.mol2, BDB-kin50313645.pdbqt 366,42 153,18 -6,504 487,523 1,6747 12 3 1 -1,187 0,27534680710297
50308782 BDB-kin50314051.mol2, BDB-kin50314051.pdbqt 377,42 153,18 -6,419 501,549 2,1621 12 3 2 -1,2727 0,26467128257875
50308783 BDB-kin50314316.mol2, BDB-kin50314316.pdbqt 380,16 136,39 -6,556 502,533 2,5004 12 2 2 -3,8896 0,214963717050255
50308784 BDB-kin50314317.mol2, BDB-kin50314317.pdbqt 412,99 122,56 -6,433 543,63 2,7438 12 2 2 -1,7143 8,08476595745129E-02
50308785 BDB-kin50314318.mol2, BDB-kin50314318.pdbqt 395,38 139,19 -6,72 515,576 2,4325 12 3 2 -0,39384 0,283099309574263
50308786 BDB-kin50314319.mol2, BDB-kin50314319.pdbqt 392,72 130,4 -6,058 515,576 2,2927 12 2 2 0,37199 0,3523710026432
50308787 BDB-kin50314320.mol2, BDB-kin50314320.pdbqt 422,9 139,19 -7,26 543,63 3,3413 12 3 2 -2,5724 0,184947616149097
50308788 BDB-kin50314321.mol2, BDB-kin50314321.pdbqt 431,7 142,43 -5,843 558,645 1,726 13 3 2 1,4154 0,38345927115405
50308789 BDB-kin50314322.mol2, BDB-kin50314322.pdbqt 455,4 152,08 -7,084 592,662 2,9275 13 3 2 -0,76573 0,215413304199519
50308790 BDB-kin50314323.mol2, BDB-kin50314323.pdbqt 471,28 145,67 -5,412 613,725 1,8044 14 3 2 4,1084 0,409136766197679
50308791 BDB-kin50314324.mol2, BDB-kin50314324.pdbqt 445,46 142,43 -6,113 572,672 2,1804 13 3 2 1,8566 0,365895277965736
50308792 BDB-kin50314325.mol2, BDB-kin50314325.pdbqt 371,67 92,43 -5,018 485,59 2,8 9 1 0 1,2235 0,485856035420392
50309910 BDB-kin50314326.mol2, BDB-kin50314326.pdbqt 268,46 79,9 -4,686 366,807 3,0955 6 2 0 0,78403 0,569844097368145
These data are only available for scientific research purposes.