• Drug Bank
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Records 761 to 780 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
DB00910 mol2, pdbqt 60,69 -5,015 416,643 5,6876 3 3 1 -1,5257 0,152783632250452 BBB+ HIA+ Caco2+
DB00911 mol2, pdbqt 106,16 -0,762 247,274 -0,9547 7 0 0 -1,561 0,341069944538284 BBB+ HIA+ Caco2-
DB00912 mol2, pdbqt 78,87 -5,003 452,593 4,5828 6 2 0 1,0932 0,430398452195436 BBB- HIA+ Caco2-
DB00913 mol2, pdbqt 55,56 -3,699 352,476 3,2426 4 1 0 6,0035 0,766179190657828 BBB+ HIA+ Caco2+
DB00914 mol2, pdbqt 97,78 -0,97 205,264 -0,132 5 5 0 3,4393 0,345324809574989 BBB+ HIA+ Caco2-
DB00915 mol2, pdbqt 26,02 -2,588 151,252 1,3216 1 1 0 -0,81751 0,613928069671306 BBB+ HIA+ Caco2+
DB00916 mol2, pdbqt 83,87 -0,205 171,155 -1,0549 6 1 0 0,96951 0,50989993822474 BBB+ HIA+ Caco2-
DB00917 mol2, pdbqt 94,83 -3,583 352,469 3,7928 5 3 0 -14,185 0,370235801199407 BBB+ HIA+ Caco2+
DB00918 mol2, pdbqt 64,79 -2,927 335,471 1,8506 5 1 0 -0,17414 0,632404498315642 BBB+ HIA+ Caco2-
DB00919 mol2, pdbqt 129,51 -0,561 332,352 -3,1536 9 5 0 4,0103 0,927061272514904 BBB- HIA- Caco2-
DB00920 mol2, pdbqt 48,55 -4,105 309,432 3,9679 2 0 0 7,5389 0,708237968744135 BBB+ HIA+ Caco2+
DB00921 mol2, pdbqt 62,16 -4,838 467,648 4,3417 5 2 0 2,5141 0,490663348231427 BBB+ HIA+ Caco2+
DB00922 mol2, pdbqt 113,43 -3,952 280,29 2,1411 7 2 0 -4,3769 0,414234971331074 BBB+ HIA+ Caco2+
DB00923 mol2, pdbqt 244,23 -2,407 519,562 -2,8847 13 4 2 7,2541 0,695334249466773 BBB- HIA+ Caco2-
DB00924 mol2, pdbqt 3,24 -4,172 275,394 4,3534 1 0 0 3,4998 0,40202533193414 BBB+ HIA+ Caco2+
DB00925 mol2, pdbqt 12,47 -3,459 303,832 3,7024 2 0 0 3,5631 0,165875759027226 BBB+ HIA+ Caco2+
DB00927 mol2, pdbqt 237,75 -3,557 337,452 -1,113 9 4 0 1,156 0,74581370527623 BBB+ HIA+ Caco2-
DB00928 mol2, pdbqt 140,97 -1,438 244,206 -2,8639 9 4 0 0,35335 0,313444293206392 BBB+ HIA+ Caco2-
DB00929 mol2, pdbqt 83,83 -4,048 382,539 4,8535 5 2 0 -23,368 0,298196972298698 BBB+ HIA+ Caco2-
DB00931 mol2, pdbqt 181,62 -1,595 442,423 -1,8578 10 6 1 1,9384 0,460635966088169 BBB- HIA+ Caco2-
Page 
 of 344
Records 761 to 780 of 6870
These data are only available for scientific research purposes.