• Drug Bank
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Records 2221 to 2240 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
DB02566 mol2, pdbqt 172,84 -1,516 235,238 0,2082 5 3 0 -2,467 0,518305064302675 BBB+ HIA+ Caco2+
DB02567 mol2, pdbqt 313,87 -7,035 443,357 4,9379 5 1 0 3,93 0,348205867893443 BBB+ HIA+ Caco2+
DB02568 mol2, pdbqt 182,31 -2,607 241,253 -0,3879 6 3 0 2,6895 0,905713324895204 BBB+ HIA+ Caco2-
DB02569 mol2, pdbqt 242,58 1,371 384,173 -6,3757 12 4 1 -25,902 0,449758128511302 BBB+ HIA- Caco2-
DB02570 mol2, pdbqt 165,76 -3,463 308,134 1,9191 2 1 0 -4,3251 0,258626577229339 BBB+ HIA+ Caco2+
DB02571 mol2, pdbqt 119,44 -0,924 145,157 -2,7669 4 2 0 -20,104 0,106329031681007 BBB+ HIA+ Caco2-
DB02572 mol2, pdbqt 1342,8 -3,891 1794,92 -11,327 47 17 3 -17,51 0,131395718441873 BBB- HIA- Caco2-
DB02573 mol2, pdbqt 360,65 -1,756 540,429 -4,1665 17 6 3 -31,237 0,338760551740295 BBB+ HIA- Caco2-
DB02574 mol2, pdbqt 871,9 -2,989 1198,24 -9,4278 33 13 3 -1,905 0,265778618398465 BBB- HIA- Caco2-
DB02576 mol2, pdbqt 51,62 -0,424 76,1184 -0,9147 2 2 0 -4,613 0,300073719553212 BBB+ HIA+ Caco2-
DB02577 mol2, pdbqt 410,56 -11,571 616,497 4,6915 8 2 1 -2,3777 0,12825633258905 BBB+ HIA- Caco2-
DB02578 mol2, pdbqt 289 -1,21 374,392 -3,962 11 6 2 -5,4001 0,451634385320398 BBB+ HIA- Caco2-
DB02579 mol2, pdbqt 62,14 -0,668 72,0628 -0,0302 2 1 0 -8,8242 0,063992347788691 BBB+ HIA+ Caco2+
DB02580 mol2, pdbqt 235,62 0,09 266,332 -0,3904 6 0 0 -13,748 0,289882892307795 BBB+ HIA+ Caco2+
DB02581 mol2, pdbqt 490,02 -5,434 662,573 3,1676 13 5 2 9,4118 0,131260268065072 BBB- HIA+ Caco2-
DB02582 mol2, pdbqt 272,27 -2,099 361,418 -2,8647 9 5 0 -30,569 0,448085399722775 BBB+ HIA- Caco2-
DB02583 mol2, pdbqt 261,78 -4,506 340,386 1,2361 8 2 0 2,4989 0,721428466540794 BBB+ HIA+ Caco2+
DB02585 mol2, pdbqt 122,2 -0,769 150,18 -0,2494 3 3 0 -1,3564 0,592118860636776 BBB+ HIA+ Caco2-
DB02586 mol2, pdbqt 164,5 -3,716 208,263 2,9794 2 0 0 -1,995 0,463058833850527 BBB+ HIA+ Caco2-
DB02587 mol2, pdbqt 288,98 -3,105 410,505 1,3206 7 3 0 -4,6773 0,195129913125944 BBB+ HIA+ Caco2-
Page 
 of 344
Records 2221 to 2240 of 6870
These data are only available for scientific research purposes.