• Drug Bank
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Records 421 to 440 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
DB00556 mol2, pdbqt 0 -3,182 188,017 2,6548 0 0 0 -61,866 0,263763387778771 BBB+ HIA+ Caco2+
DB00557 mol2, pdbqt 35,94 -2,409 374,91 3,0698 4 1 0 2,3067 0,627517155612538 BBB+ HIA+ Caco2-
DB00558 mol2, pdbqt 200,72 -0,982 332,312 -4,4784 11 7 2 0,65505 0,773267751953917 BBB- HIA- Caco2-
DB00559 mol2, pdbqt 154,03 -7,481 551,622 3,479 11 2 2 -0,35379 0,233717735693726 BBB- HIA+ Caco2-
DB00560 mol2, pdbqt 205,76 -2,613 585,656 -1,2251 13 7 3 7,3321 0,604366201771812 BBB- HIA+ Caco2-
DB00561 mol2, pdbqt 32,78 -2,03 378,514 3,2136 4 0 0 5,9517 0,655233657802509 BBB+ HIA+ Caco2+
DB00562 mol2, pdbqt 160,75 -4,555 431,944 1,8124 7 2 0 1,7747 0,619499131112103 BBB- HIA+ Caco2-
DB00563 mol2, pdbqt 210,54 -3,767 454,446 -1,2285 13 5 1 -7,5894 0,217256096188499 BBB- HIA+ Caco2-
DB00564 mol2, pdbqt 46,33 -5,267 236,273 3,1187 3 1 0 1,5571 0,21556219286021 BBB+ HIA+ Caco2+
DB00565 mol2, pdbqt 132,92 -5,756 929,157 5,8206 14 0 3 -2,378 0,117487023520653 BBB+ HIA- Caco2+
DB00566 mol2, pdbqt 152,2 -1,64 182,22 -0,897 4 2 0 -3,8875 0,297231976959576 BBB+ HIA+ Caco2-
DB00567 mol2, pdbqt 138,03 -1,683 347,394 -2,028 7 3 0 7,9062 0,914094773880749 BBB- HIA- Caco2-
DB00568 mol2, pdbqt 6,48 -3,799 368,522 5,256 2 0 1 6,5107 0,46427757304347 BBB+ HIA+ Caco2+
DB00569 mol2, pdbqt 872,52 9,351 1508,26 -23,414 52 19 3 -4,1341 0,25394248177606 BBB- HIA- Caco2-
DB00570 mol2, pdbqt 154,1 -5,079 810,986 3,2987 13 3 2 4,4843 0,347552967406004 BBB- HIA+ Caco2+
DB00571 mol2, pdbqt 41,49 -3,574 259,348 2,4155 3 2 0 7,0483 0,848107407693221 BBB- HIA+ Caco2+
DB00572 mol2, pdbqt 49,77 -2,612 289,374 1,9288 4 1 0 3,0135 0,880975564909142 BBB+ HIA+ Caco2+
DB00573 mol2, pdbqt 46,53 -4,259 242,273 2,9659 3 1 0 0,25323 0,604055807756121 BBB+ HIA+ Caco2+
DB00575 mol2, pdbqt 36,42 -3,811 230,097 2,2313 3 2 0 3,6242 0,29884019980906 BBB+ HIA+ Caco2+
DB00576 mol2, pdbqt 134,59 -2,576 270,336 0,4683 6 2 0 6,1259 0,591805188736985 BBB+ HIA+ Caco2-
Page 
 of 344
Records 421 to 440 of 6870
These data are only available for scientific research purposes.