• Drug Bank
Page 
 of 344
Records 4541 to 4560 of 6870
 
Molecule Name
Download
TPSA
cLogS
MW
cLogP
HBA
HBD
Ro5 violations
Druglikeness
DrugScore
Blood-Brain Barrier
Human Intestinal Absorption
Caco-2 Permeability
DB06858 mol2, pdbqt 333,93 -2,811 413,564 1,8168 7 4 0 2,7628 0,784938145851561 BBB+ HIA+ Caco2-
DB06859 mol2, pdbqt 310,64 -3,893 394,901 2,4479 7 3 0 -1,5816 0,439520690969494 BBB+ HIA+ Caco2-
DB06860 mol2, pdbqt 191,76 -3,518 272,69 2,5352 4 0 0 1,4075 0,45722729525601 BBB+ HIA+ Caco2+
DB06861 mol2, pdbqt 188,54 -1,59 226,319 0,4054 4 3 0 -10,309 0,288430763640757 BBB+ HIA+ Caco2-
DB06862 mol2, pdbqt 187,13 -1,843 277,32 0,2635 6 3 0 -4,3884 0,477695963764695 BBB- HIA+ Caco2-
DB06864 mol2, pdbqt 176,03 -0,991 240,21 -0,8838 6 3 0 0,17833 0,478775319761095 BBB- HIA+ Caco2-
DB06865 mol2, pdbqt 291,45 -3,913 382,458 3,3381 6 5 0 -7,7896 0,217690874447415 BBB+ HIA+ Caco2-
DB06866 mol2, pdbqt 307,36 -4,227 396,485 3,6138 6 4 0 -7,6267 0,201988416784734 BBB+ HIA+ Caco2-
DB06867 mol2, pdbqt 263,14 -0,51 294,386 0,4222 6 0 0 -15,061 0,171129546576433 BBB+ HIA+ Caco2+
DB06868 mol2, pdbqt 264,52 -3,649 336,861 3,3198 4 1 0 6,5931 0,775020285650647 BBB+ HIA+ Caco2-
DB06869 mol2, pdbqt 367,79 -4,037 479,019 1,5372 8 3 0 2,2123 0,378261320988736 BBB- HIA+ Caco2-
DB06870 mol2, pdbqt 238,15 -4,005 312,451 4,1625 2 1 0 1,6981 0,387176181970208 BBB+ HIA+ Caco2+
DB06871 mol2, pdbqt 206,44 -4,789 282,382 4,4396 2 2 0 2,1501 0,348888321641347 BBB+ HIA+ Caco2+
DB06872 mol2, pdbqt 216,85 -3,135 294,33 0,4648 6 2 0 3,8036 0,882016180747903 BBB+ HIA+ Caco2-
DB06873 mol2, pdbqt 296,64 -3,733 382,415 1,8484 7 2 0 4,0198 0,779444983286708 BBB+ HIA+ Caco2-
DB06874 mol2, pdbqt 318,44 -8,259 450,295 4,2842 7 2 0 -7,18 0,17834870506032 BBB+ HIA+ Caco2-
DB06875 mol2, pdbqt 208,38 -5,803 279,269 3,7582 3 2 0 -7,3916 0,134992814541144 BBB+ HIA+ Caco2+
DB06876 mol2, pdbqt 318,08 -4,599 412,496 2,5652 7 2 0 8,3351 0,667739214177777 BBB+ HIA+ Caco2-
DB06877 mol2, pdbqt 223,25 -2,744 280,33 1,4444 5 2 0 5,3365 0,905781774432257 BBB+ HIA+ Caco2+
DB06878 mol2, pdbqt 247,02 -2,896 323,823 1,2275 5 2 0 5,5016 0,882854795924489 BBB+ HIA+ Caco2-
Page 
 of 344
Records 4541 to 4560 of 6870
These data are only available for scientific research purposes.