• Drug Bank
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 of 344
Records 6361 to 6380 of 6870
 
Molecule Name
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TPSA
cLogS
MW
cLogP
HBA
HBD
Ro5 violations
Druglikeness
DrugScore
Blood-Brain Barrier
Human Intestinal Absorption
Caco-2 Permeability
DB08767 mol2, pdbqt 135,55 -1,688 165,191 0,675 3 1 0 -0,49889 0,666427172436572 BBB+ HIA+ Caco2+
DB08768 mol2, pdbqt 168,16 -2,989 203,248 1,6466 5 2 0 0,41398 0,730772222256695 BBB+ HIA+ Caco2-
DB08770 mol2, pdbqt 256,61 -3,021 337,342 1,2155 9 3 0 3,7716 0,516783067793848 BBB+ HIA+ Caco2-
DB08771 mol2, pdbqt 185,3 -3,822 252,312 2,3904 3 1 0 1,6425 0,763930616814384 BBB+ HIA+ Caco2+
DB08772 mol2, pdbqt 280,92 -4,6 419,382 2,9351 6 1 0 -2,3584 0,353343572591704 BBB+ HIA+ Caco2-
DB08773 mol2, pdbqt 176,26 -4,37 242,297 3,7055 2 2 0 0,54794 0,353544706087804 BBB+ HIA+ Caco2+
DB08774 mol2, pdbqt 237,57 -3,876 309,372 0,4805 6 2 0 5,0573 0,82979441286565 BBB+ HIA+ Caco2-
DB08775 mol2, pdbqt 310,65 -3,876 402,421 2,1019 7 3 0 0,52166 0,613034410015638 BBB+ HIA+ Caco2-
DB08776 mol2, pdbqt 166,42 -2,449 225,271 1,103 5 2 0 1,8474 0,873392423980987 BBB+ HIA+ Caco2-
DB08777 mol2, pdbqt 151,21 -3,456 206,268 1,774 3 1 0 -0,49913 0,607450542303721 BBB+ HIA+ Caco2-
DB08778 mol2, pdbqt 212,64 -5,007 275,375 2,9644 4 2 0 2,6152 0,660240998928399 BBB+ HIA+ Caco2-
DB08779 mol2, pdbqt 167,15 -3,022 226,323 2,2813 3 2 0 3,5278 0,880987003567539 BBB+ HIA- Caco2-
DB08780 mol2, pdbqt 155,55 -2,296 205,22 -0,0007 6 1 0 1,8019 0,884354031416998 BBB+ HIA+ Caco2+
DB08781 mol2, pdbqt 196,44 -2,624 312,17 -0,4535 6 2 0 3,2673 0,893356391108142 BBB+ HIA+ Caco2-
DB08782 mol2, pdbqt 146,4 -1,587 200,261 -0,1414 4 2 0 -0,57038 0,658867362050923 BBB+ HIA+ Caco2-
DB08783 mol2, pdbqt 259,08 -3,31 404,32 0,5106 7 2 0 -60,811 0,145183592934922 BBB+ HIA+ Caco2-
DB08784 mol2, pdbqt 182,76 -3,673 248,668 2,6316 4 2 0 -0,75006 0,552653151099441 BBB+ HIA+ Caco2+
DB08785 mol2, pdbqt 124,48 -2,099 160,172 1,5756 2 0 0 -7,2087 0,475652974163898 BBB+ HIA+ Caco2+
DB08786 mol2, pdbqt 151,34 -1,791 183,21 0,3754 5 1 0 -6,7281 0,483158469414662 BBB+ HIA+ Caco2+
DB08787 mol2, pdbqt 252,68 -6,701 344,204 4,953 5 1 0 -5,6911 8,36596449505827E-02 BBB+ HIA+ Caco2+
Page 
 of 344
Records 6361 to 6380 of 6870
These data are only available for scientific research purposes.