• Drug Bank
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 of 344
Records 6061 to 6080 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
DB08445 mol2, pdbqt 288,21 -5,237 401,391 2,7664 6 1 0 1,8374 0,563701843145552 BBB+ HIA+ Caco2+
DB08446 mol2, pdbqt 299,1 -7,978 458,677 3,8563 6 1 0 -6,1825 0,18721259353984 BBB+ HIA+ Caco2-
DB08447 mol2, pdbqt 193,64 -1,921 232,326 1,6091 3 2 0 -2,8502 0,497516870216345 BBB+ HIA+ Caco2-
DB08448 mol2, pdbqt 287,08 -4,994 385,43 1,4685 8 3 0 1,1451 0,585082413834593 BBB+ HIA+ Caco2+
DB08449 mol2, pdbqt 255,55 -4,251 377,345 2,219 5 1 0 -3,6524 0,378798573521812 BBB+ HIA+ Caco2+
DB08450 mol2, pdbqt 270,31 -5,7 352,4 3,6366 6 2 0 2,3781 0,531077097976004 BBB+ HIA+ Caco2+
DB08451 mol2, pdbqt 158,92 -3,409 222,267 1,0243 4 1 0 1,9075 0,833712574964599 BBB+ HIA+ Caco2+
DB08453 mol2, pdbqt 238,6 -6,827 287,402 5,1487 3 1 1 -21,56 0,200673982853945 BBB+ HIA+ Caco2+
DB08454 mol2, pdbqt 236,95 -5,827 301,352 3,581 5 2 0 1,7892 0,314047653848134 BBB+ HIA+ Caco2+
DB08455 mol2, pdbqt 267,43 -3,919 312,408 5,3425 3 2 1 -1,1186 0,220045983880774 BBB- HIA+ Caco2+
DB08456 mol2, pdbqt 241,28 -2,459 341,495 1,7127 4 1 0 -2,3682 0,480226286685381 BBB+ HIA+ Caco2-
DB08457 mol2, pdbqt 302,33 -5,611 481,349 4,5029 4 1 0 3,0231 0,41644965916114 BBB+ HIA+ Caco2+
DB08458 mol2, pdbqt 282,5 -5,067 400,315 4,3309 3 0 0 1,8381 0,50715297763627 BBB+ HIA+ Caco2+
DB08459 mol2, pdbqt 300,78 -7,647 411,247 3,9974 6 1 0 -3,5468 0,206825931488062 BBB+ HIA+ Caco2-
DB08460 mol2, pdbqt 309,3 -8,248 426,262 3,6715 7 2 0 -3,5572 0,203772051717356 BBB+ HIA+ Caco2-
DB08461 mol2, pdbqt 228,92 -4,666 297,361 1,8236 6 2 0 1,5296 0,6779349440529 BBB+ HIA+ Caco2-
DB08462 mol2, pdbqt 230,35 -4,767 290,325 3,2677 5 2 0 -8,3224 0,106552491590161 BBB+ HIA+ Caco2+
DB08463 mol2, pdbqt 343,95 -4,914 431,542 3,3307 8 3 0 3,3898 0,350276974651019 BBB- HIA+ Caco2-
DB08464 mol2, pdbqt 292,84 -3,074 411,793 2,3258 9 5 0 -2,3015 0,258396506577838 BBB- HIA- Caco2-
DB08465 mol2, pdbqt 291,71 -3,466 397,81 2,4481 8 3 0 -1,0025 0,493891874569222 BBB- HIA- Caco2-
Page 
 of 344
Records 6061 to 6080 of 6870
These data are only available for scientific research purposes.