• Drug Bank
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 of 344
Records 6221 to 6240 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
DB08617 mol2, pdbqt 175,36 -2,784 247,215 -0,3054 3 2 0 -23,115 0,463351859682928 BBB+ HIA+ Caco2+
DB08618 mol2, pdbqt 240,23 -1,363 339,327 -1,2966 6 1 0 -25,293 0,166257808920755 BBB+ HIA- Caco2+
DB08619 mol2, pdbqt 286,75 -4,486 388,502 3,6133 5 1 0 -1,2697 0,239806616561237 BBB+ HIA+ Caco2+
DB08620 mol2, pdbqt 187,69 -2,392 252,728 1,1055 4 0 0 0,44339 0,600289536773108 BBB+ HIA+ Caco2+
DB08621 mol2, pdbqt 238,11 -2,324 356,225 -0,5012 6 3 0 5,4 0,115449177547372 BBB+ HIA+ Caco2-
DB08622 mol2, pdbqt 324,08 -5,719 452,056 5,5459 2 1 1 3,1678 0,364478369642274 BBB+ HIA+ Caco2+
DB08623 mol2, pdbqt 248,84 -1,594 354,406 -0,8216 7 3 0 -3,8273 0,46448249596691 BBB- HIA- Caco2-
DB08624 mol2, pdbqt 222,9 -2,261 291,378 -0,4562 6 4 0 -0,059418 0,691338038659056 BBB+ HIA+ Caco2-
DB08626 mol2, pdbqt 196,21 -2,448 253,321 0,832 4 2 0 -6,3498 0,467287346598588 BBB+ HIA+ Caco2-
DB08627 mol2, pdbqt 175,17 -1,78 224,323 3,1085 2 1 0 -0,16532 0,656690802385628 BBB+ HIA+ Caco2+
DB08628 mol2, pdbqt 150,48 -1,553 196,269 2,1144 2 1 0 -1,5266 0,334576278949601 BBB+ HIA+ Caco2+
DB08629 mol2, pdbqt 187,72 -1,3 225,378 1,5423 3 1 0 1,0285 0,829648348871561 BBB+ HIA+ Caco2-
DB08631 mol2, pdbqt 227,72 -3,91 322,815 2,0305 4 2 0 2,6829 0,781571668049177 BBB+ HIA+ Caco2-
DB08632 mol2, pdbqt 145,56 -1,655 210,141 0,1149 6 3 0 -1,8442 0,328905106816037 BBB+ HIA+ Caco2+
DB08634 mol2, pdbqt 288 -4,608 364,444 3,7806 5 1 0 4,348 0,645100975140455 BBB+ HIA+ Caco2-
DB08635 mol2, pdbqt 284,89 -4,833 354,405 3,3346 6 1 0 -6,1206 7,10986696255382E-02 BBB+ HIA+ Caco2-
DB08636 mol2, pdbqt 147,96 -1,625 192,17 0,5296 4 2 0 -6,7296 0,483590207264468 BBB+ HIA+ Caco2+
DB08637 mol2, pdbqt 163,87 -1,939 206,196 0,8053 4 1 0 -6,5962 0,478900166982047 BBB+ HIA+ Caco2+
DB08638 mol2, pdbqt 172,29 -4,434 236,226 -1,6658 6 3 0 -10,087 0,069280926422441 BBB+ HIA+ Caco2-
DB08640 mol2, pdbqt 233,98 -2,126 313,373 0,9197 6 2 0 -5,903 0,368493616331214 BBB+ HIA+ Caco2-
Page 
 of 344
Records 6221 to 6240 of 6870
These data are only available for scientific research purposes.