• Drug Bank
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Records 6501 to 6520 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
DB08984 mol2, pdbqt 67,79 -3,827 369,338 3,3384 5 2 0 -25,604 0,106776018090145 BBB+ HIA+ Caco2-
DB08987 mol2, pdbqt 35,83 -3,006 276,422 3,2034 3 1 0 5,0092 0,505483084672315 BBB+ HIA+ Caco2+
DB08990 mol2, pdbqt 32,78 -2,737 380,53 3,1877 4 0 0 4,5127 0,796373023429817 BBB+ HIA+ Caco2+
DB08991 mol2, pdbqt 62,06 0,187 234,258 1,2611 6 0 0 2,8069 0,93861924576657 BBB+ HIA+ Caco2+
DB08992 mol2, pdbqt 20,31 -3,312 259,392 3,3895 2 0 0 2,4355 0,789784986090878 BBB+ HIA+ Caco2+
DB08993 mol2, pdbqt 412,29 0,373 685,697 -8,6571 23 17 3 5,3481 0,546053027030785 BBB- HIA+ Caco2-
DB08994 mol2, pdbqt 69,73 -4,514 324,379 2,9575 5 2 0 2,6011 0,200687360665673 BBB+ HIA+ Caco2-
DB08995 mol2, pdbqt 234,29 -2,967 608,547 -0,634 15 8 3 2,463 0,548318170050959 BBB- HIA+ Caco2-
DB08996 mol2, pdbqt 6,48 -3,552 294,44 4,15 2 0 0 3,7442 0,730741404655002 BBB+ HIA+ Caco2+
DB08998 mol2, pdbqt 33,62 -4,93 278,354 3,8549 3 1 0 2,6783 0,624620733255509 BBB+ HIA+ Caco2+
DB09000 mol2, pdbqt 55,57 -4,998 323,463 4,0548 3 0 0 1,1756 0,193909606937562 BBB+ HIA+ Caco2+
DB09001 mol2, pdbqt 172,58 -2,93 232,238 0,4437 5 2 0 0,57789 0,604333119285305 BBB+ HIA+ Caco2-
DB09002 mol2, pdbqt 12,47 -4,003 329,87 4,6448 2 0 0 2,4681 0,622183522667192 BBB+ HIA+ Caco2+
DB09003 mol2, pdbqt 53,8 -4,56 481,082 4,7537 5 2 0 7,0078 0,292988156662353 BBB+ HIA+ Caco2-
DB09006 mol2, pdbqt 93,06 -4,885 468,588 5,2925 6 2 1 -4,1947 7,93795183343268E-02 BBB+ HIA+ Caco2-
DB09008 mol2, pdbqt 148,67 -1,734 416,501 1,2763 7 2 0 10,222 0,839781694558863 BBB- HIA- Caco2-
DB09009 mol2, pdbqt 99,16 -2,605 284,379 1,5119 5 2 0 3,3707 0,895865114021681 BBB+ HIA- Caco2-
DB09011 mol2, pdbqt 159,17 -2,445 197,664 1,7564 2 1 0 -0,62842 0,181207813165536 BBB+ HIA+ Caco2+
DB09012 mol2, pdbqt 108,02 -1,274 236,23 -1,1139 7 3 0 8,4385 0,967056403813397 BBB+ HIA+ Caco2-
DB09013 mol2, pdbqt 232,41 -3,835 291,346 1,5979 5 2 0 7,3142 0,833878441707227 BBB- HIA+ Caco2-
Page 
 of 344
Records 6501 to 6520 of 6870
These data are only available for scientific research purposes.