• Drug Bank
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Records 6561 to 6580 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
DB09079 mol2, pdbqt 97,71 -3,271 539,634 2,4829 9 2 1 7,0961 7,97549753745052E-02 BBB- HIA- Caco2-
DB09080 mol2, pdbqt 100,05 -2,906 386,446 1,4107 7 4 0 6,857 0,669596932692556 BBB- HIA+ Caco2-
DB09081 mol2, pdbqt 72,83 -3,827 366,496 4,8927 5 1 0 -16,234 0,185025827052691 BBB+ HIA+ Caco2+
DB09082 mol2, pdbqt 91,18 -4,361 486,434 3,6957 6 4 0 -18,519 0,170771168995917 BBB- HIA+ Caco2-
DB09083 mol2, pdbqt 60,47 -3,19 468,592 3,6523 7 0 0 7,003 0,663879128510051 BBB+ HIA+ Caco2+
DB09084 mol2, pdbqt 30,29 -2,91 309,412 2,8319 4 0 0 5,3685 0,511890979228132 BBB+ HIA+ Caco2+
DB09085 mol2, pdbqt 41,57 -2,08 264,368 2,2345 4 1 0 4,0409 0,546729596426013 BBB+ HIA+ Caco2+
DB09086 mol2, pdbqt 29,46 -2,05 164,203 2,2723 2 1 0 -4,6405 0,102158947867344 BBB+ HIA+ Caco2+
DB09087 mol2, pdbqt 82,98 1,524 98,0779 -3,4103 4 2 0 -2,0209 7,20337002000834E-02 BBB+ HIA- Caco2-
DB09089 mol2, pdbqt 57,23 -3,012 387,474 3,4018 6 0 0 2,309 0,353878382856859 BBB+ HIA+ Caco2+
DB09090 mol2, pdbqt 40,16 -4,092 511,519 3,3774 5 0 1 -4,8486 0,290105661824255 BBB+ HIA- Caco2+
DB09091 mol2, pdbqt 113,4 -4,35 378,531 2,2763 4 2 0 -1,7058 0,151011172475983 BBB+ HIA+ Caco2+
DB09092 mol2, pdbqt 102,14 0,064 311,341 -1,7167 9 2 0 6,0082 0,948190909521736 BBB- HIA+ Caco2-
DB09093 mol2, pdbqt 182,61 -1,669 478,884 -0,727 10 7 1 4,4765 0,762457840944869 BBB- HIA- Caco2+
DB09094 mol2, pdbqt 123,91 -3,362 432,424 1,2712 9 3 0 -0,4575 0,319775056356519 BBB- HIA+ Caco2+
DB09095 mol2, pdbqt 74,6 -3,883 394,456 1,9608 4 2 0 2,82 0,592855765623697 BBB+ HIA+ Caco2+
DB09096 mol2, pdbqt 52,6 -3,41 242,229 3,0506 4 0 0 -2,9842 0,095048864925073 BBB+ HIA+ Caco2+
DB09097 mol2, pdbqt 81,26 -2,739 395,566 2,9702 6 2 0 5,5845 0,79630481473441 BBB+ HIA+ Caco2-
DB09099 mol2, pdbqt 663,83 -7,642 1637,9 -11,007 37 22 3 -3,5795 0,136927728218048 BBB- HIA+ Caco2-
DB09101 mol2, pdbqt 87,07 -5,655 447,889 3,3453 6 2 0 0,11231 0,18686700748372 BBB- HIA+ Caco2+
Page 
 of 344
Records 6561 to 6580 of 6870
These data are only available for scientific research purposes.