• Drug Bank
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Records 681 to 700 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
DB00825 mol2, pdbqt 20,23 -2,501 156,268 2,4112 1 1 0 -10,47 0,460535598300054 BBB+ HIA+ Caco2+
DB00826 mol2, pdbqt 230,99 -3,651 665,73 -1,3276 14 7 3 -0,56419 0,342032135852606 BBB- HIA- Caco2-
DB00827 mol2, pdbqt 88,43 -2,661 262,22 0,9582 7 1 0 2,2721 0,527317782170384 BBB+ HIA+ Caco2-
DB00828 mol2, pdbqt 79,87 0,188 138,059 -2,8214 4 2 0 -11,514 0,49531975030366 BBB+ HIA- Caco2-
DB00829 mol2, pdbqt 32,67 -4,672 284,745 2,9846 3 0 0 3,8838 0,15352818861289 BBB+ HIA+ Caco2+
DB00830 mol2, pdbqt 21,26 -1,708 177,246 1,4214 2 1 0 3,5531 0,945527613689037 BBB+ HIA+ Caco2+
DB00831 mol2, pdbqt 35,02 -4,412 407,503 4,9276 3 0 0 3,104 0,192424958498315 BBB+ HIA+ Caco2+
DB00832 mol2, pdbqt 37,38 -1,69 189,213 1,2674 3 0 0 3,6225 0,947040973011506 BBB+ HIA+ Caco2+
DB00833 mol2, pdbqt 138,03 -2,25 367,812 -2,0489 7 3 0 8,0424 0,887025755937053 BBB- HIA- Caco2-
DB00834 mol2, pdbqt 40,54 -7,148 429,602 5,7109 3 1 1 -0,0082281 0,140174396594981 BBB+ HIA+ Caco2+
DB00835 mol2, pdbqt 16,13 -2,724 319,245 3,4729 2 0 0 1,7906 0,764942919935655 BBB+ HIA+ Caco2+
DB00836 mol2, pdbqt 43,78 -3,81 477,046 4,7197 4 1 0 10,356 0,54367029121487 BBB+ HIA+ Caco2+
DB00837 mol2, pdbqt 76,67 -4,021 334,777 2,9169 4 3 0 -1,0023 0,388807671335876 BBB+ HIA+ Caco2+
DB00838 mol2, pdbqt 74,6 -4,1 410,911 2,6566 4 2 0 2,8617 0,416509657951549 BBB+ HIA+ Caco2+
DB00839 mol2, pdbqt 86,89 -2,932 311,405 1,2297 6 2 0 -2,3822 0,138882194868068 BBB+ HIA+ Caco2-
DB00841 mol2, pdbqt 72,72 -2,799 301,385 3,0709 4 4 0 4,1054 0,84541854174573 BBB- HIA+ Caco2+
DB00842 mol2, pdbqt 61,69 -4,51 286,717 2,2758 4 2 0 2,2844 0,721955502780126 BBB+ HIA+ Caco2+
DB00843 mol2, pdbqt 38,77 -4,347 379,498 4,2149 4 0 0 5,6409 0,631295559532766 BBB+ HIA+ Caco2+
DB00844 mol2, pdbqt 73,16 -3,411 357,448 1,7751 5 3 0 3,6567 0,818592094905173 BBB+ HIA+ Caco2+
DB00845 mol2, pdbqt 39,99 -8,192 473,406 6,2781 4 1 1 1,9723 0,234622129597512 BBB+ HIA+ Caco2+
Page 
 of 344
Records 681 to 700 of 6870
These data are only available for scientific research purposes.