• Drug Bank
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 of 344
Records 1221 to 1240 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
DB01459 mol2, pdbqt 385,38 -5,872 492,621 4,9661 6 0 0 4,344 0,369250134507334 BBB+ HIA+ Caco2-
DB01460 mol2, pdbqt 187,29 -2,367 216,327 2,5646 2 1 0 5,7714 0,546740633951702 BBB+ HIA+ Caco2+
DB01461 mol2, pdbqt 269,54 -2,314 327,423 2,3869 4 0 0 1,987 0,829480687586105 BBB+ HIA+ Caco2+
DB01462 mol2, pdbqt 318,89 -2,991 396,489 1,59 7 0 0 -0,44358 0,343034988545649 BBB+ HIA+ Caco2-
DB01463 mol2, pdbqt 12,03 -3,412 215,339 3,2077 1 1 0 -0,1526 0,611314906417596 BBB+ HIA+ Caco2+
DB01464 mol2, pdbqt 290,84 -2,794 361,48 2,279 5 0 0 2,0588 0,799655291946071 BBB+ HIA+ Caco2+
DB01465 mol2, pdbqt 164,82 -2,102 195,261 1,3139 3 1 0 -1,2139 0,583695579831946 BBB+ HIA+ Caco2+
DB01466 mol2, pdbqt 41,93 -3,161 313,396 1,9387 4 1 0 3,6915 0,856204108384131 BBB+ HIA+ Caco2+
DB01467 mol2, pdbqt 190,84 -2,605 223,315 2,0734 3 1 0 -1,395 0,5499042984523 BBB+ HIA+ Caco2+
DB01468 mol2, pdbqt 222,95 -3,55 277,455 3,0912 1 0 0 7,2954 0,655116350269676 BBB+ HIA+ Caco2+
DB01469 mol2, pdbqt 319,66 -4,323 453,577 3,3446 6 1 0 4,4021 0,373067205234262 BBB+ HIA+ Caco2+
DB01471 mol2, pdbqt 234,9 -4,33 316,483 4,0635 2 1 0 3,3569 0,400098535447824 BBB+ HIA+ Caco2+
DB01472 mol2, pdbqt 142,56 -2,084 165,235 1,3839 2 1 0 -1,2139 0,58565955455487 BBB+ HIA+ Caco2+
DB01473 mol2, pdbqt 212,54 -2,334 261,364 2,9377 3 0 0 6,5878 0,887670035467694 BBB+ HIA+ Caco2+
DB01474 mol2, pdbqt 225 -4,119 304,472 3,6505 2 2 0 2,72 0,425733599599032 BBB+ HIA+ Caco2+
DB01475 mol2, pdbqt 286,56 -2,252 353,46 2,8317 4 0 0 -1,3343 0,515105874985102 BBB+ HIA+ Caco2+
DB01476 mol2, pdbqt 232,2 -3,712 377,212 3,0693 4 1 0 0,83535 0,385776900110305 BBB+ HIA+ Caco2+
DB01477 mol2, pdbqt 227,63 -2,596 314,404 0,4566 4 1 0 6,4973 0,906431433137381 BBB+ HIA+ Caco2+
DB01478 mol2, pdbqt 201,54 -2,174 247,337 2,6684 3 0 0 7,2933 0,90732397163318 BBB+ HIA+ Caco2+
DB01479 mol2, pdbqt 226,55 -4,383 306,488 3,755 2 2 0 2,464 0,67241935754695 BBB+ HIA+ Caco2+
Page 
 of 344
Records 1221 to 1240 of 6870
These data are only available for scientific research purposes.