• Drug Bank
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Records 5861 to 5880 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
DB08232 mol2, pdbqt 292,11 -5,848 404,381 1,9496 9 4 0 -4,5955 0,282144807671548 BBB+ HIA+ Caco2-
DB08233 mol2, pdbqt 262,84 -5,39 339,398 3,5649 7 3 0 -4,7189 0,239730857270438 BBB+ HIA+ Caco2-
DB08234 mol2, pdbqt 261,68 -4,553 312,372 2,5994 6 2 0 -5,9015 0,106096309083914 BBB+ HIA+ Caco2+
DB08235 mol2, pdbqt 222,12 -3,959 284,382 3,2505 3 2 0 4,775 0,773717812933925 BBB+ HIA+ Caco2-
DB08236 mol2, pdbqt 231,72 -4,72 384,68 3,7384 3 1 0 1,0571 0,547221806961025 BBB+ HIA+ Caco2+
DB08237 mol2, pdbqt 333,82 -3,382 487,408 -2,1544 12 5 1 -17,304 0,211488506815788 BBB+ HIA+ Caco2-
DB08238 mol2, pdbqt 151,31 -1,904 223,251 -0,0526 4 2 0 -2,6035 0,11062391864355 BBB+ HIA+ Caco2-
DB08239 mol2, pdbqt 299,3 -3,592 397,468 3,6534 4 1 0 2,1794 0,680789894115103 BBB+ HIA+ Caco2-
DB08240 mol2, pdbqt 258,72 -4,064 377,719 1,0168 6 3 0 -17,831 0,38577459678598 BBB+ HIA+ Caco2-
DB08241 mol2, pdbqt 282,76 -5,775 366,424 2,9979 8 3 0 -4,0255 0,1730054009662 BBB+ HIA+ Caco2-
DB08242 mol2, pdbqt 278,05 -5,145 358,404 2,5295 7 2 0 4,7236 0,646159686632632 BBB+ HIA+ Caco2+
DB08244 mol2, pdbqt 258,78 -3,689 354,399 2,7626 3 1 0 1,8067 0,732072455065918 BBB+ HIA+ Caco2-
DB08245 mol2, pdbqt 235,07 -1,476 358,242 -3,0069 10 3 0 -24,119 0,454736879601905 BBB+ HIA+ Caco2-
DB08246 mol2, pdbqt 246,06 -3,043 328,361 3,4052 3 0 0 1,4693 0,73461187018609 BBB+ HIA+ Caco2+
DB08247 mol2, pdbqt 230,81 -4,339 289,382 2,7794 6 2 0 -4,6588 0,383536965939186 BBB+ HIA+ Caco2-
DB08248 mol2, pdbqt 293,59 -5,585 402,478 2,6746 9 3 0 -8,2959 0,137281199043225 BBB+ HIA+ Caco2-
DB08249 mol2, pdbqt 316,03 -1,702 350,494 2,3144 6 1 0 -42,505 0,211932558300638 BBB+ HIA+ Caco2+
DB08250 mol2, pdbqt 294,69 -5,246 386,445 3,5422 5 2 0 1,3323 0,524022821772136 BBB+ HIA+ Caco2-
DB08251 mol2, pdbqt 254,99 -3,056 342,306 0,0465 8 3 0 -0,96224 0,5571206553923 BBB+ HIA+ Caco2-
DB08252 mol2, pdbqt 221,09 -5,431 292,293 4,1956 5 2 0 -5,7173 6,14076111369187E-02 BBB+ HIA+ Caco2+
Page 
 of 344
Records 5861 to 5880 of 6870
These data are only available for scientific research purposes.