• Drug Bank
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Records 6521 to 6540 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
DB09014 mol2, pdbqt 53,84 -6,114 359,6 5,1482 1 0 1 0,88162 0,358893766560796 BBB+ HIA+ Caco2+
DB09015 mol2, pdbqt 74,6 -3,957 358,476 3,1513 4 2 0 1,5357 0,408973905619956 BBB+ HIA+ Caco2+
DB09016 mol2, pdbqt 3,24 -3,643 293,452 4,2218 1 0 0 2,9648 0,425578308039394 BBB+ HIA+ Caco2+
DB09017 mol2, pdbqt 71,31 -7,349 393,695 3,6849 4 0 0 0,77283 0,233355038802549 BBB+ HIA+ Caco2+
DB09018 mol2, pdbqt 71,08 -2,636 344,252 1,7614 5 2 0 4,6665 0,523277373247676 BBB+ HIA+ Caco2+
DB09019 mol2, pdbqt 29,26 -4,448 376,135 3,6113 2 1 0 -3,427 0,344440692736573 BBB+ HIA+ Caco2+
DB09020 mol2, pdbqt 65,49 -3,689 361,396 3,3834 5 0 0 -1,3869 0,162956547206458 BBB+ HIA+ Caco2+
DB09021 mol2, pdbqt 12,03 -3,026 249,356 2,7941 1 1 0 0,58616 0,429391544014838 BBB+ HIA+ Caco2+
DB09026 mol2, pdbqt 146,13 -4,349 551,766 3,3561 9 4 1 -1,92 0,289772523678462 BBB- HIA+ Caco2-
DB09027 mol2, pdbqt 181,62 -9,555 889,014 7,914 14 4 3 0,32198 0,038115212197712 BBB- HIA+ Caco2-
DB09028 mol2, pdbqt 32,34 -1,304 190,245 0,3843 3 1 0 3,1571 0,951563986865999 BBB+ HIA+ Caco2+
DB09030 mol2, pdbqt 81,01 -7,126 492,589 4,9592 6 1 0 -3,7369 0,162693994997107 BBB+ HIA+ Caco2-
DB09031 mol2, pdbqt 68,81 -2,39 408,581 3,3198 5 1 0 -49,835 0,389267948188837 BBB+ HIA- Caco2-
DB09034 mol2, pdbqt 80,29 -5,042 450,929 4,1733 8 0 0 7,3683 0,518580809153137 BBB+ HIA+ Caco2-
DB09038 mol2, pdbqt 108,61 -3,909 450,913 1,6475 7 4 0 -4,4144 0,357294206399109 BBB+ HIA+ Caco2-
DB09039 mol2, pdbqt 74,52 -3,391 404,549 3,7544 6 2 0 -20,272 0,357986115788711 BBB+ HIA+ Caco2-
DB09040 mol2, pdbqt 54,18 -2,914 348,396 2,043 5 1 0 3,8153 0,847909383210704 BBB+ HIA+ Caco2+
DB09041 mol2, pdbqt 29,46 -0,029 151,932 0,7234 2 1 0 -13,867 0,392900204051207 BBB+ HIA+ Caco2+
DB09042 mol2, pdbqt 162,6 -2,584 450,322 -1,8369 12 2 1 -24,91 0,394130693401841 BBB+ HIA- Caco2-
DB09047 mol2, pdbqt 105,9 -4,316 398,393 -2,1566 8 2 0 -1,7702 0,422190893195542 BBB- HIA+ Caco2-
Page 
 of 344
Records 6521 to 6540 of 6870
These data are only available for scientific research purposes.