• Drug Bank
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 of 344
Records 5141 to 5160 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
DB07477 mol2, pdbqt 170,88 -3,68 212,247 2,802 2 1 0 -1,7208 0,289159161466789 BBB+ HIA+ Caco2+
DB07478 mol2, pdbqt 145,72 -3,11 186,209 2,6274 2 2 0 -2,12 0,489595517210171 BBB+ HIA+ Caco2+
DB07479 mol2, pdbqt 199,27 -4,574 280,322 2,775 3 3 0 -0,22966 0,191618106360118 BBB- HIA+ Caco2-
DB07480 mol2, pdbqt 239,72 -0,515 360,194 -3,7059 8 4 0 -20,956 0,458042700844144 BBB+ HIA- Caco2-
DB07481 mol2, pdbqt 210,19 -3,107 279,299 -0,0275 8 4 0 -45,457 0,450362648821586 BBB+ HIA+ Caco2-
DB07482 mol2, pdbqt 160,87 1,342 212,056 0,7334 5 3 0 -8,5023 0,488610968106226 BBB+ HIA+ Caco2-
DB07483 mol2, pdbqt 162,09 -3,537 218,275 1,277 2 1 0 -1,9965 0,492935329242393 BBB+ HIA+ Caco2+
DB07484 mol2, pdbqt 197,92 -1,768 269,252 0,0449 7 3 0 -6,1601 0,304232697023383 BBB+ HIA+ Caco2-
DB07485 mol2, pdbqt 211,43 -3,193 268,355 4,0925 2 2 0 -5,6608 0,232591958090383 BBB+ HIA+ Caco2+
DB07486 mol2, pdbqt 324,04 -5,114 476,44 4,5035 4 1 0 -5,3299 0,235315337740216 BBB+ HIA+ Caco2+
DB07487 mol2, pdbqt 163,64 -2,599 226,211 0,7387 3 1 0 -13,866 0,467310362505794 BBB+ HIA+ Caco2+
DB07488 mol2, pdbqt 265,15 -5,758 355,417 2,1275 6 2 0 2,3918 0,455106945216271 BBB+ HIA+ Caco2-
DB07489 mol2, pdbqt 250 -6,788 348,808 4,4084 4 3 0 1,0685 0,38105478180882 BBB+ HIA+ Caco2-
DB07490 mol2, pdbqt 226,89 -4,628 322,703 2,3638 7 1 0 -6,334 0,364855117808014 BBB+ HIA+ Caco2+
DB07491 mol2, pdbqt 185,87 -4,22 417,835 2,1281 5 3 0 -3,3311 0,219990298007251 BBB+ HIA+ Caco2+
DB07492 mol2, pdbqt 227,36 -2,651 412,033 -0,1628 7 3 0 -9,2933 5,38281710224154E-02 BBB+ HIA+ Caco2+
DB07493 mol2, pdbqt 205,99 -4,635 341,163 1,8926 4 2 0 1,3386 0,652162521344974 BBB+ HIA+ Caco2-
DB07494 mol2, pdbqt 276,65 -4,204 348,508 3,6347 2 0 0 2,9391 0,687955852008937 BBB+ HIA+ Caco2+
DB07495 mol2, pdbqt 286,72 -4,544 387,822 2,7063 7 4 0 5,4798 0,412953043846453 BBB- HIA+ Caco2-
DB07496 mol2, pdbqt 173,69 -3,644 212,251 2,801 3 2 0 -0,017949 0,627866577012272 BBB+ HIA+ Caco2+
Page 
 of 344
Records 5141 to 5160 of 6870
These data are only available for scientific research purposes.