• Drug Bank
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 of 344
Records 1301 to 1320 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
DB01562 mol2, pdbqt 262,8 -3,339 323,435 4,0622 3 0 0 6,48 0,598200754250035 BBB+ HIA+ Caco2+
DB01563 mol2, pdbqt 40,46 -1,492 165,403 0,7873 2 2 0 -0,87764 0,081281254971841 BBB+ HIA+ Caco2-
DB01564 mol2, pdbqt 234,9 -4,33 316,483 4,0635 2 1 0 3,3569 0,400098535447824 BBB+ HIA+ Caco2+
DB01565 mol2, pdbqt 193,73 -2,775 287,358 1,5321 4 2 0 4,2386 0,896559343445217 BBB+ HIA+ Caco2+
DB01566 mol2, pdbqt 169,52 -2,993 207,272 2,3231 3 1 0 2,916 0,874268671555577 BBB+ HIA+ Caco2+
DB01567 mol2, pdbqt 32,67 -4,986 302,735 3,0854 3 0 0 2,5438 0,389275663740196 BBB+ HIA+ Caco2+
DB01568 mol2, pdbqt 210,49 -0,692 315,368 0,559 5 1 0 -2,1689 0,517663576279723 BBB+ HIA+ Caco2+
DB01569 mol2, pdbqt 245,72 -3,375 344,449 1,9679 4 2 0 1,5865 0,459318914285862 BBB+ HIA+ Caco2+
DB01573 mol2, pdbqt 269,88 -4,184 375,467 2,9505 4 1 0 4,9127 0,722584051413802 BBB+ HIA+ Caco2+
DB01575 mol2, pdbqt 147,59 5,658 168,165 0 7 0 0 -17,568 0,296255803052427 BBB+ HIA+ Caco2-
DB01576 mol2, pdbqt 26,02 -2,066 135,209 1,4539 1 1 0 -1,4507 0,340951407222986 BBB+ HIA+ Caco2+
DB01577 mol2, pdbqt 12,03 -1,982 149,236 1,8054 1 1 0 3,0028 0,475124341481324 BBB+ HIA+ Caco2+
DB01578 mol2, pdbqt 183,48 -4,604 789,086 -0,985 11 6 3 1,4819 0,372935915202219 BBB- HIA- Caco2-
DB01579 mol2, pdbqt 12,47 -1,346 191,273 1,6743 2 0 0 6,2 0,957630313694975 BBB+ HIA+ Caco2+
DB01580 mol2, pdbqt 50,72 -2,495 265,352 1,8263 4 2 0 1,7183 0,507968221448157 BBB- HIA+ Caco2+
DB01581 mol2, pdbqt 106,35 -2,66 264,308 0,4856 6 2 0 3,3111 0,544853239760527 BBB+ HIA+ Caco2+
DB01582 mol2, pdbqt 106,35 -3,028 278,335 0,8835 6 2 0 3,3111 0,318630401848968 BBB+ HIA+ Caco2+
DB01583 mol2, pdbqt 92,78 -7,606 776,855 1,2491 5 3 1 -10,339 0,136662851737734 BBB- HIA+ Caco2-
DB01586 mol2, pdbqt 77,76 -4,879 392,578 4,0315 4 3 0 -0,29665 0,419761051312015 BBB+ HIA+ Caco2+
DB01587 mol2, pdbqt 49,85 -4,008 368,819 3,385 5 0 0 -3,3071 0,225172621899522 BBB+ HIA+ Caco2+
Page 
 of 344
Records 1301 to 1320 of 6870
These data are only available for scientific research purposes.