• Drug Bank
Page 
 of 344
Records 6801 to 6820 of 6870
 
Molecule Name
Download
TPSA
cLogS
MW
cLogP
HBA
HBD
Ro5 violations
Druglikeness
DrugScore
Blood-Brain Barrier
Human Intestinal Absorption
Caco-2 Permeability
DB11367 mol2, pdbqt 147,26 -1,736 365,409 -2,5151 8 3 0 7,1174 0,719650120112159 BBB- HIA- Caco2-
DB11560 mol2, pdbqt 93,31 -7,345 404,287 4,1044 5 1 0 0,95783 0,126805492941113 BBB+ HIA+ Caco2-
DB11561 mol2, pdbqt 149,74 -3,899 194,236 2,6152 2 1 0 -1,9084 0,168268585437525 BBB+ HIA+ Caco2+
DB11562 mol2, pdbqt 249,37 -4,053 367,356 3,0063 7 0 0 4,2904 0,735303719924374 BBB+ HIA+ Caco2+
DB11574 mol2, pdbqt 188,8 -8,329 882,032 7,0411 16 4 3 -7,1562 5,83043601228222E-02 BBB- HIA+ Caco2-
DB11575 mol2, pdbqt 214,07 -7,376 766,914 4,8528 15 3 2 -8,0585 6,49895702058089E-02 BBB- HIA+ Caco2-
DB11581 mol2, pdbqt 183,09 -9,747 868,453 5,2741 14 3 3 -7,7184 7,31009007775268E-02 BBB- HIA+ Caco2-
DB11582 mol2, pdbqt 189,31 -3,224 563,622 0,0091002 11 5 2 -2,0586 0,203437988133868 BBB- HIA- Caco2-
DB11588 mol2, pdbqt 17,07 -0,53 29,0179 0 1 0 0 -2,3891 0,536193479320896 BBB+ HIA+ Caco2+
DB11590 mol2, pdbqt 62,6 -4,531 382,832 2,0955 2 1 0 -1,5855 0,169932887926018 BBB+ HIA+ Caco2+
DB11591 mol2, pdbqt 67,59 -3,15 463,62 3,5841 6 1 0 3,8278 0,668767372792821 BBB+ HIA+ Caco2-
DB11592 mol2, pdbqt 350,09 -4,625 516,51 0,9631 12 2 2 7,3172 0,572393606885751 BBB- HIA- Caco2-
DB11593 mol2, pdbqt 116,72 -2,639 163,132 0,6555 4 1 0 -18,335 0,135730237845362 BBB+ HIA+ Caco2-
DB11594 mol2, pdbqt 315,97 -3,792 334,566 5,2517 2 0 1 -12,51 0,179288711985732 BBB+ HIA+ Caco2+
DB11596 mol2, pdbqt 215,55 -4,076 473,445 -2,2121 14 7 2 -6,7653 0,338931760095599 BBB- HIA- Caco2-
DB11602 mol2, pdbqt 263,37 -1,841 806,933 -2,3235 19 8 3 -7,1815 0,120490655200444 BBB+ HIA+ Caco2-
DB11609 mol2, pdbqt 20,31 -2,474 295,425 3,1606 2 0 0 5,1626 0,515418754103497 BBB+ HIA+ Caco2+
DB11610 mol2, pdbqt 52,49 -1,138 181,234 0,3896 3 3 0 2,7661 0,945485095365448 BBB- HIA+ Caco2+
DB11611 mol2, pdbqt 142,37 -7,272 615,489 3,9144 9 2 1 -10,022 0,143331526731247 BBB- HIA+ Caco2-
DB11613 mol2, pdbqt 200,08 -7,794 883,016 5,7848 16 4 3 5,7708 6,30311280164179E-02 BBB- HIA+ Caco2-
Page 
 of 344
Records 6801 to 6820 of 6870
These data are only available for scientific research purposes.