• Drug Bank
Page 
 of 344
Records 5221 to 5240 of 6870
 
Molecule Name
Download
TPSA
cLogS
MW
cLogP
HBA
HBD
Ro5 violations
Druglikeness
DrugScore
Blood-Brain Barrier
Human Intestinal Absorption
Caco-2 Permeability
DB07559 mol2, pdbqt 256,31 -6,031 347,2 4,5764 4 2 0 -1,9995 9,50164805293533E-02 BBB+ HIA+ Caco2+
DB07560 mol2, pdbqt 247,76 -3,064 303,405 1,8222 5 2 0 -1,1127 0,547951361329601 BBB+ HIA+ Caco2-
DB07561 mol2, pdbqt 261,49 -4,877 322,363 3,7007 5 2 0 -3,4506 0,07203771436547 BBB- HIA+ Caco2+
DB07562 mol2, pdbqt 255,8 -4,038 325,439 3,4539 5 1 0 3,1912 0,262196040569189 BBB+ HIA+ Caco2+
DB07563 mol2, pdbqt 332,58 -3,045 418,587 2,938 6 1 0 2,1218 0,723164781513962 BBB+ HIA+ Caco2+
DB07564 mol2, pdbqt 244,21 -2,33 329,363 -0,579 9 4 0 4,209 0,433890403289819 BBB+ HIA+ Caco2-
DB07565 mol2, pdbqt 293,96 -2,792 423,204 -0,3077 10 3 0 -6,7346 5,27579561069183E-02 BBB+ HIA+ Caco2-
DB07567 mol2, pdbqt 341,1 -4,483 445,557 5,8964 5 2 1 3,2753 0,256069547070463 BBB+ HIA+ Caco2-
DB07568 mol2, pdbqt 301,35 0,626 425,492 2,3916 8 2 0 7,3668 0,823803450928993 BBB+ HIA+ Caco2-
DB07569 mol2, pdbqt 279,01 -3,439 349,497 2,0224 5 2 0 3,073 0,809930185105363 BBB+ HIA+ Caco2-
DB07570 mol2, pdbqt 342,07 -4,539 446,545 4,3728 6 1 0 -0,91217 0,212791182202774 BBB+ HIA+ Caco2-
DB07571 mol2, pdbqt 342,2 -4,322 428,527 3,1404 7 4 0 -12,986 0,330058445715862 BBB- HIA+ Caco2-
DB07572 mol2, pdbqt 264,57 -2,877 349,41 1,9843 7 2 0 -13,136 0,429639540860469 BBB+ HIA+ Caco2-
DB07573 mol2, pdbqt 215,99 -1,683 265,352 1,3788 4 1 0 3,386 0,926897671623743 BBB+ HIA+ Caco2+
DB07574 mol2, pdbqt 326,03 -3,703 431,508 1,7958 7 1 0 -1,5577 0,156716191861353 BBB+ HIA+ Caco2-
DB07575 mol2, pdbqt 221,43 -3,019 270,375 1,3632 3 3 0 0,2504 0,702730322589225 BBB+ HIA+ Caco2+
DB07577 mol2, pdbqt 173,6 -4,173 214,271 1,9354 4 2 0 -2,223 0,128974839556748 BBB+ HIA+ Caco2+
DB07578 mol2, pdbqt 272,16 -6,649 372,451 2,7355 5 0 0 3,0911 0,493125966781788 BBB+ HIA+ Caco2+
DB07579 mol2, pdbqt 306,24 -1,494 436,369 -2,0196 14 4 1 1,1186 0,726428744328397 BBB+ HIA- Caco2-
DB07580 mol2, pdbqt 317,72 -0,788 462,406 -1,4534 14 2 1 0,36009 0,634786646927204 BBB+ HIA- Caco2-
Page 
 of 344
Records 5221 to 5240 of 6870
These data are only available for scientific research purposes.