• Drug Bank
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Records 6421 to 6440 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
DB08838 mol2, pdbqt 117,35 -0,303 130,194 -1,3763 4 4 0 0,87918 0,843788702180273 BBB+ HIA+ Caco2+
DB08842 mol2, pdbqt 66,84 0,132 204,245 -1,622 5 1 0 0,60742 0,809244098240706 BBB+ HIA- Caco2+
DB08844 mol2, pdbqt 108,51 -2,98 168,112 -1,208 7 4 0 2,923 0,326921437772241 BBB+ HIA+ Caco2-
DB08847 mol2, pdbqt 69,56 -0,309 131,13 -3,4646 4 3 0 0,90746 0,847221889862465 BBB+ HIA+ Caco2-
DB08847 mol2, pdbqt 94,43 -0,309 131,13 -3,4646 4 3 0 0,90746 0,847221889862465 BBB+ HIA+ Caco2-
DB08848 mol2, pdbqt 101,55 -0,496 127,142 -2,4304 3 2 0 2,0238 0,93093134213487 BBB+ HIA+ Caco2-
DB08860 mol2, pdbqt 90,65 -6,368 421,467 4,4887 5 3 0 0,38378 0,335068374827261 BBB+ HIA+ Caco2+
DB08864 mol2, pdbqt 97,42 -7,081 366,427 4,7377 6 2 0 -5,0142 0,200460689855967 BBB+ HIA+ Caco2+
DB08865 mol2, pdbqt 77,99 -5,264 450,344 3,5382 6 2 0 3,1708 0,523528594869751 BBB+ HIA+ Caco2-
DB08867 mol2, pdbqt 57,61 -4,884 433,59 4,5713 4 1 0 3,1009 0,182597218957973 BBB+ HIA+ Caco2+
DB08868 mol2, pdbqt 66,48 -3,554 307,476 3,9214 3 3 0 -25,107 0,377122488477002 BBB+ HIA+ Caco2-
DB08869 mol2, pdbqt 2304,1 -12,055 5005,74 -30,365 135 81 3 -0,084935 0,185006776608257 BBB- HIA+ Caco2-
DB08871 mol2, pdbqt 146,39 -6,523 729,904 1,5381 12 2 2 -2,9568 0,161384161644507 BBB- HIA+ Caco2-
DB08872 mol2, pdbqt 101,93 -3,268 329,391 1,9737 7 2 0 -20,958 0,425901663894567 BBB+ HIA+ Caco2+
DB08873 mol2, pdbqt 150,7 -4,018 519,684 1,3825 10 4 1 -8,7582 0,110589850512146 BBB- HIA+ Caco2-
DB08874 mol2, pdbqt 266,66 -7,667 1058,05 8,3037 18 7 4 -2,7125 2,63873680415863E-02 BBB- HIA- Caco2-
DB08875 mol2, pdbqt 98,78 -6,978 501,513 4,0714 8 2 1 0,15767 0,277024249045356 BBB+ HIA+ Caco2-
DB08877 mol2, pdbqt 83,18 -3,921 306,372 1,6767 6 1 0 -5,579 0,411394880061658 BBB+ HIA+ Caco2-
DB08880 mol2, pdbqt 73,12 -3,251 270,209 2,5535 4 2 0 -9,2555 0,431289440360368 BBB+ HIA+ Caco2+
DB08881 mol2, pdbqt 100,3 -9,33 489,929 4,5779 6 2 0 -1,1096 0,116352776309013 BBB+ HIA+ Caco2-
Page 
 of 344
Records 6421 to 6440 of 6870
These data are only available for scientific research purposes.