• Drug Bank
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 of 344
Records 1241 to 1260 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
DB01480 mol2, pdbqt 286,5 -4,003 423,551 2,8278 5 2 0 3,7547 0,695747544684022 BBB+ HIA+ Caco2+
DB01481 mol2, pdbqt 214,26 -4,097 288,429 3,3253 2 1 0 1,9133 0,710585320269387 BBB+ HIA+ Caco2+
DB01482 mol2, pdbqt 70,47 -2,447 341,414 1,3121 7 1 0 7,1692 0,534001555562291 BBB+ HIA+ Caco2-
DB01484 mol2, pdbqt 183,45 -2,936 274,157 2,0391 3 1 0 -3,0039 0,466938988368931 BBB+ HIA+ Caco2+
DB01485 mol2, pdbqt 218,29 -3,992 304,428 2,9964 3 2 0 1,1097 0,409601396566376 BBB+ HIA+ Caco2+
DB01486 mol2, pdbqt 125,39 -1,518 151,208 0,3838 2 2 0 0,19006 0,752732169508559 BBB+ HIA+ Caco2+
DB01487 mol2, pdbqt 248,57 -3,134 293,405 3,1461 4 2 0 -2,8311 0,441370376022062 BBB+ HIA+ Caco2-
DB01488 mol2, pdbqt 159,77 -1,767 188,273 1,752 2 1 0 3,799 0,941102938878204 BBB+ HIA+ Caco2+
DB01489 mol2, pdbqt 62,21 -4,713 371,823 3,1142 6 0 0 1,0003 0,347439907214532 BBB+ HIA+ Caco2+
DB01490 mol2, pdbqt 127,51 -2,146 162,191 0,6188 3 1 0 1,0509 0,834354129872827 BBB+ HIA+ Caco2-
DB01491 mol2, pdbqt 291,32 -3,808 349,516 4,6529 2 0 0 4,1476 0,387664328786678 BBB+ HIA+ Caco2+
DB01496 mol2, pdbqt 256,06 -4,627 368,334 2,519 5 2 0 -3,2125 0,130876265606608 BBB+ HIA+ Caco2-
DB01498 mol2, pdbqt 261,64 -2,801 311,467 3,5511 2 1 0 3,7014 0,485604843372593 BBB+ HIA+ Caco2+
DB01499 mol2, pdbqt 226,3 -2,604 275,39 3,3921 3 0 0 6,4172 0,849833607985406 BBB+ HIA+ Caco2+
DB01500 mol2, pdbqt 208,12 -3,815 290,401 2,6649 3 2 0 0,92487 0,418229757238725 BBB+ HIA+ Caco2+
DB01501 mol2, pdbqt 64,33 -4,383 424,542 2,997 4 1 0 3,0133 0,648515253752313 BBB+ HIA+ Caco2+
DB01502 mol2, pdbqt 275,69 -3,44 324,466 3,9744 3 0 0 8,1845 0,749568690923491 BBB+ HIA+ Caco2+
DB01503 mol2, pdbqt 215,36 -4,046 290,445 3,1816 2 2 0 0,95882 0,664074693884451 BBB+ HIA+ Caco2+
DB01505 mol2, pdbqt 260,67 -1,902 321,415 1,4588 5 1 0 2,1636 0,693512632507933 BBB+ HIA+ Caco2-
DB01506 mol2, pdbqt 147,49 -2,957 175,274 2,3862 1 1 0 -7,9509 0,270511872303124 BBB+ HIA+ Caco2+
Page 
 of 344
Records 1241 to 1260 of 6870
These data are only available for scientific research purposes.