• Drug Bank
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Records 521 to 540 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
DB00658 mol2, pdbqt 12,53 -1,23 92,5247 0,416 1 0 0 -5,9345 0,063675669264067 BBB+ HIA+ Caco2+
DB00659 mol2, pdbqt 91,85 -0,245 181,211 -1,785 5 2 0 -6,9884 0,492728896111536 BBB+ HIA+ Caco2-
DB00660 mol2, pdbqt 47,56 -2,928 221,255 1,6252 4 1 0 -9,0995 0,456372409164912 BBB+ HIA+ Caco2+
DB00661 mol2, pdbqt 63,95 -4,524 454,609 4,9303 6 0 0 -2,2645 0,273944220207863 BBB+ HIA+ Caco2+
DB00662 mol2, pdbqt 69,26 -2,439 388,462 1,9363 7 1 0 5,4951 0,842988775745372 BBB+ HIA+ Caco2+
DB00663 mol2, pdbqt 94,83 -3,433 410,455 1,1374 5 3 0 4,2291 0,470113945296789 BBB+ HIA+ Caco2+
DB00664 mol2, pdbqt 115,58 -2,503 280,307 -0,0876 7 2 0 3,3552 0,328080480753817 BBB+ HIA+ Caco2-
DB00665 mol2, pdbqt 95,23 -3,966 317,222 1,1818 7 1 0 -7,509 0,408414294726737 BBB+ HIA+ Caco2-
DB00666 mol2, pdbqt 474,63 -7,834 1322,49 -2,0536 30 16 3 11,123 0,263776327163487 BBB- HIA+ Caco2-
DB00668 mol2, pdbqt 72,72 -0,464 183,206 -0,3154 4 4 0 2,574 0,946668732441679 BBB- HIA+ Caco2-
DB00669 mol2, pdbqt 73,58 -2,655 295,406 1,1112 5 2 0 -0,57433 0,371040131022756 BBB+ HIA+ Caco2-
DB00670 mol2, pdbqt 68,78 -2,802 351,409 1,1634 7 1 0 9,3552 0,418716060095229 BBB+ HIA+ Caco2-
DB00671 mol2, pdbqt 238,05 -2,532 453,455 -0,6664 12 4 1 13,189 0,784742934638908 BBB- HIA- Caco2-
DB00672 mol2, pdbqt 83,65 -2,936 276,743 2,0374 5 2 0 7,6319 0,192394841081545 BBB+ HIA+ Caco2-
DB00673 mol2, pdbqt 75,19 -5,092 534,431 3,9633 7 2 1 -1,3949 0,268909681943812 BBB+ HIA+ Caco2-
DB00674 mol2, pdbqt 41,93 -2,665 287,358 1,1901 4 1 0 5,3857 0,909246196996608 BBB+ HIA+ Caco2+
DB00675 mol2, pdbqt 12,47 -4,397 371,522 4,7199 2 0 0 4,791 0,351987854727424 BBB+ HIA+ Caco2+
DB00676 mol2, pdbqt 26,3 -3,08 212,247 2,9907 2 0 0 -1,5588 0,305389091432421 BBB+ HIA+ Caco2+
DB00677 mol2, pdbqt 45,34 -0,317 184,146 1,6783 3 0 0 -20,148 0,174109707972499 BBB+ HIA+ Caco2-
DB00678 mol2, pdbqt 92,51 -4,986 422,919 3,9536 7 2 0 -6,6313 0,280967335435801 BBB- HIA+ Caco2-
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 of 344
Records 521 to 540 of 6870
These data are only available for scientific research purposes.