• Drug Bank
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 of 344
Records 6341 to 6360 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
DB08746 mol2, pdbqt 342,52 -3,779 461,028 3,1338 6 0 0 7,4365 0,667340235808853 BBB+ HIA+ Caco2-
DB08747 mol2, pdbqt 310,6 -5,899 445,345 4,8023 5 2 0 2,0214 0,38982701957809 BBB- HIA+ Caco2-
DB08748 mol2, pdbqt 132,18 -1,665 165,191 1,0411 3 1 0 0,17776 0,447080681313367 BBB+ HIA+ Caco2+
DB08749 mol2, pdbqt 328,45 -5,156 418,539 2,7089 6 1 0 -0,13435 0,441195119846829 BBB+ HIA+ Caco2-
DB08750 mol2, pdbqt 271,1 -3,77 367,427 1,0401 6 3 0 2,6063 0,776615790099311 BBB+ HIA+ Caco2-
DB08751 mol2, pdbqt 221,39 -1,456 293,282 0,3416 9 0 0 0,15269 0,435328153987518 BBB+ HIA+ Caco2-
DB08752 mol2, pdbqt 324,04 -2,52 405,541 0,9053 8 2 0 0,11192 0,639747532605472 BBB+ HIA+ Caco2-
DB08753 mol2, pdbqt 296,27 -4,026 367,4 3,2492 6 1 0 0,17984 0,565033054802219 BBB+ HIA+ Caco2+
DB08754 mol2, pdbqt 235,3 -2,538 299,325 2,2387 5 4 0 0,26453 0,699640297722988 BBB+ HIA+ Caco2-
DB08755 mol2, pdbqt 369,48 -3,955 456,585 2,1717 8 2 0 -4,6261 0,208425778210251 BBB- HIA+ Caco2-
DB08756 mol2, pdbqt 201,05 -2,596 247,341 1,0106 4 2 0 1,5482 0,846644910356385 BBB+ HIA+ Caco2+
DB08757 mol2, pdbqt 175,86 -4,178 236,657 1,5277 4 2 0 -3,6435 0,251530694069117 BBB+ HIA+ Caco2+
DB08758 mol2, pdbqt 169,6 -4,893 226,238 0,1737 5 2 0 -3,2896 0,185624266614056 BBB+ HIA+ Caco2+
DB08759 mol2, pdbqt 199,85 -1,454 266,273 -0,8003 5 3 0 -16,24 0,478202230445729 BBB+ HIA+ Caco2-
DB08760 mol2, pdbqt 208,8 -3,658 276,718 3,1268 3 1 0 -1,8685 0,220356708226361 BBB+ HIA+ Caco2+
DB08761 mol2, pdbqt 243,16 -2,498 326,351 1,1464 6 4 0 4,2817 0,893328971924635 BBB- HIA+ Caco2-
DB08762 mol2, pdbqt 355,2 -3,36 478,436 -0,2937 10 4 0 -38,753 0,3584167290778 BBB+ HIA- Caco2-
DB08763 mol2, pdbqt 263,79 -1,562 363,309 -1,195 8 5 0 -23,618 0,451783235591299 BBB+ HIA- Caco2-
DB08765 mol2, pdbqt 146,01 -2,055 230,268 0,5798 5 2 0 0,75339 0,184023694799617 BBB+ HIA+ Caco2-
DB08766 mol2, pdbqt 236,3 -3,353 325,452 2,0783 4 1 0 -0,33984 0,599371847431046 BBB+ HIA+ Caco2+
Page 
 of 344
Records 6341 to 6360 of 6870
These data are only available for scientific research purposes.