• Drug Bank
Page 
 of 344
Records 5661 to 5680 of 6870
 
Molecule Name
Download
TPSA
cLogS
MW
cLogP
HBA
HBD
Ro5 violations
Druglikeness
DrugScore
Blood-Brain Barrier
Human Intestinal Absorption
Caco-2 Permeability
DB08025 mol2, pdbqt 326,12 -6,451 420,487 4,2746 6 2 0 0,25945 0,335328228918449 BBB+ HIA+ Caco2-
DB08026 mol2, pdbqt 285,58 -3,648 365,44 0,4814 8 2 0 8,6082 0,818275453421487 BBB+ HIA+ Caco2-
DB08027 mol2, pdbqt 298,41 -4,693 381,927 2,9475 5 2 0 4,4229 0,400042025945911 BBB+ HIA+ Caco2-
DB08028 mol2, pdbqt 215,89 -5,068 279,794 3,3815 3 1 0 -0,017937 0,393366243629086 BBB+ HIA+ Caco2+
DB08029 mol2, pdbqt 255,09 -2,684 350,394 0,6326 7 3 0 3,7558 0,871454877322673 BBB+ HIA+ Caco2-
DB08030 mol2, pdbqt 227,81 -4,813 282,298 2,1544 5 2 0 -4,7496 0,366304799281427 BBB+ HIA+ Caco2-
DB08031 mol2, pdbqt 336,88 -5,485 446,545 5,6517 6 2 1 -2,5554 0,123377850222184 BBB- HIA+ Caco2-
DB08032 mol2, pdbqt 275,74 -4,633 362,517 4,4046 4 1 0 2,0896 0,568230166502215 BBB+ HIA+ Caco2-
DB08033 mol2, pdbqt 286,74 -4,793 376,544 4,6739 4 1 0 6,3773 0,55592841003278 BBB+ HIA+ Caco2-
DB08034 mol2, pdbqt 256,55 -4,753 336,346 3,6346 6 3 0 4,3145 0,235382751199709 BBB- HIA+ Caco2-
DB08035 mol2, pdbqt 247,09 -5,65 309,416 2,8571 5 1 0 1,5908 0,555543919649381 BBB+ HIA+ Caco2+
DB08036 mol2, pdbqt 220,27 -5,91 311,343 3,2829 4 3 0 1,295 0,505622036774573 BBB+ HIA+ Caco2-
DB08037 mol2, pdbqt 333,51 -3,32 459,51 3,2212 5 1 0 4,3921 0,687869283227466 BBB+ HIA+ Caco2-
DB08038 mol2, pdbqt 247,09 -2,227 307,392 -0,2275 6 4 0 0,5515 0,755422126346001 BBB+ HIA+ Caco2-
DB08039 mol2, pdbqt 267,95 -2,672 371,46 1,4716 6 2 0 -0,88499 0,554966912509525 BBB+ HIA+ Caco2-
DB08040 mol2, pdbqt 226,91 -2,189 294,306 -0,0778 7 4 0 -0,49077 0,642114701629239 BBB+ HIA+ Caco2-
DB08041 mol2, pdbqt 255,2 -3,248 329,351 1,6397 6 3 0 -12,42 0,429269186610098 BBB- HIA+ Caco2-
DB08042 mol2, pdbqt 326,29 -5,538 420,472 2,3015 9 2 0 2,5528 0,550011886341357 BBB+ HIA+ Caco2+
DB08043 mol2, pdbqt 271,67 -5,924 373,333 4,044 5 2 0 -7,1827 0,251847142508585 BBB+ HIA+ Caco2-
DB08044 mol2, pdbqt 296,33 -2,136 445,366 2,3999 6 1 0 -7,8724 0,389587822884956 BBB+ HIA+ Caco2-
Page 
 of 344
Records 5661 to 5680 of 6870
These data are only available for scientific research purposes.