• Drug Bank
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 of 344
Records 2601 to 2620 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
DB02976 mol2, pdbqt 345,23 1,292 568,292 -8,4625 18 8 3 -32,81 0,326165416136003 BBB+ HIA- Caco2-
DB02977 mol2, pdbqt 472,92 -3,664 605,726 -2,7959 12 8 3 -15,7 0,27308119706667 BBB- HIA+ Caco2-
DB02978 mol2, pdbqt 114,49 -0,707 147,173 -2,8858 4 3 0 -6,2954 0,493897184056424 BBB- HIA+ Caco2-
DB02979 mol2, pdbqt 328,62 -5,654 374,66 5,3686 4 2 1 -4,4445 0,217362268706603 BBB+ HIA+ Caco2-
DB02980 mol2, pdbqt 233,15 2,698 354,343 -1,5681 8 3 0 -8,0961 0,106590597327822 BBB+ HIA+ Caco2-
DB02981 mol2, pdbqt 266,22 -0,036 362,318 -4,3124 9 5 0 -24,65 0,458181133921072 BBB- HIA- Caco2-
DB02982 mol2, pdbqt 236,47 -3,801 238,413 5,9077 1 1 1 -26,359 0,167206851371532 BBB+ HIA+ Caco2+
DB02983 mol2, pdbqt 101,44 -0,041 357,759 -0,8463 3 1 0 -2,7452 0,149625168424752 BBB+ HIA+ Caco2-
DB02984 mol2, pdbqt 250,87 -5,1 327,407 3,6323 5 1 0 -0,62153 0,422081639947542 BBB+ HIA+ Caco2+
DB02985 mol2, pdbqt 135,46 -1,896 277,021 -0,7358 6 4 0 2,8205 0,918906116036203 BBB+ HIA+ Caco2-
DB02986 mol2, pdbqt 215,8 -2,335 338,452 1,0275 6 2 0 4,0218 0,890325973460841 BBB+ HIA+ Caco2-
DB02987 mol2, pdbqt 129,9 -0,564 178,211 -4,019 5 3 0 -5,5285 0,493869462118247 BBB+ HIA+ Caco2-
DB02988 mol2, pdbqt 155,6 -1,221 202,212 0,1846 4 3 0 -0,47447 0,672006976592847 BBB+ HIA+ Caco2-
DB02989 mol2, pdbqt 267,33 -4,429 358,828 2,8598 6 4 0 -0,031701 0,534243551295285 BBB+ HIA+ Caco2-
DB02990 mol2, pdbqt 322,63 -4,288 357,601 5,945 3 1 1 -20,297 0,246819905828126 BBB+ HIA+ Caco2+
DB02991 mol2, pdbqt 177,72 -3,571 248,271 2,6996 2 1 0 -7,6789 0,421286173490995 BBB+ HIA+ Caco2+
DB02992 mol2, pdbqt 224,58 2,421 355,172 -11,442 12 9 2 -26,098 0,462467798007898 BBB- HIA- Caco2-
DB02993 mol2, pdbqt 121,17 -1,924 166,14 -0,6527 6 2 0 2,1538 0,917212200194119 BBB+ HIA+ Caco2-
DB02994 mol2, pdbqt 64,16 0,36 137,998 1,7251 2 1 0 -1,8737 0,127037023441248 BBB+ HIA+ Caco2+
DB02995 mol2, pdbqt 74,55 -1,827 100,184 0,8021 1 1 0 -11,738 0,198385369867436 BBB+ HIA+ Caco2+
Page 
 of 344
Records 2601 to 2620 of 6870
These data are only available for scientific research purposes.