• Drug Bank
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 of 344
Records 5981 to 6000 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
DB08358 mol2, pdbqt 257,7 -4,485 340,385 2,8878 5 2 0 3,6089 0,710263327888265 BBB+ HIA+ Caco2-
DB08359 mol2, pdbqt 181,45 -4,089 232,306 3,1666 3 1 0 1,8706 0,729936725990671 BBB+ HIA+ Caco2+
DB08360 mol2, pdbqt 275,88 -4,613 348,413 1,7283 8 1 0 4,8835 0,725814599599549 BBB+ HIA+ Caco2+
DB08361 mol2, pdbqt 267,05 -4,73 340,43 1,7317 7 4 0 -7,8291 0,360034347026388 BBB+ HIA+ Caco2-
DB08362 mol2, pdbqt 300,41 -6,628 384,402 2,7777 9 3 0 0,50562 0,404547470906095 BBB+ HIA+ Caco2+
DB08363 mol2, pdbqt 195,16 -3,186 238,333 2,7611 2 1 0 2,4053 0,8309089391815 BBB+ HIA+ Caco2+
DB08364 mol2, pdbqt 325,55 -2,887 416,453 0,2485 8 4 0 -27,986 0,407795358558164 BBB+ HIA- Caco2-
DB08365 mol2, pdbqt 299,67 -5,653 476,713 2,8757 7 3 0 -0,67893 0,199892737482782 BBB- HIA+ Caco2-
DB08366 mol2, pdbqt 302,59 -4,235 443,494 2,4182 8 4 0 1,377 0,607001816328426 BBB- HIA+ Caco2-
DB08367 mol2, pdbqt 210,82 -0,06 284,2 -2,7258 8 2 0 -26,839 0,38458184663952 BBB+ HIA- Caco2-
DB08368 mol2, pdbqt 214,7 -1,254 290,267 -0,2923 8 4 0 -1,159 0,587939943591885 BBB+ HIA+ Caco2+
DB08369 mol2, pdbqt 194,5 -2,97 234,301 2,9693 2 0 0 3,2632 0,853715613740242 BBB+ HIA+ Caco2+
DB08370 mol2, pdbqt 182,02 -3,196 290,18 -0,6325 3 2 0 -8,0748 0,44666426259777 BBB+ HIA+ Caco2+
DB08371 mol2, pdbqt 209,65 -3,641 269,299 -0,4192 4 2 0 -10,83 0,434692120817977 BBB+ HIA+ Caco2+
DB08372 mol2, pdbqt 268,32 -3,591 334,418 2,5218 5 2 0 -2,8926 0,428712647578153 BBB+ HIA+ Caco2-
DB08373 mol2, pdbqt 276,38 -7,48 448,173 3,7468 4 0 0 -0,4225 0,035745640880519 BBB+ HIA+ Caco2+
DB08374 mol2, pdbqt 154,97 -2,389 197,664 1,0846 2 1 0 -3,3427 0,140571774454107 BBB+ HIA+ Caco2+
DB08375 mol2, pdbqt 280,63 -1,766 397,435 -0,5801 10 4 0 -0,11676 0,638736830137626 BBB- HIA- Caco2-
DB08376 mol2, pdbqt 317,61 -1,781 396,415 0,8258 8 2 0 -41,379 0,432184704147003 BBB+ HIA- Caco2-
DB08377 mol2, pdbqt 256,51 -2,681 360,258 -1,4436 10 3 0 -31,486 0,439647064034148 BBB+ HIA- Caco2-
Page 
 of 344
Records 5981 to 6000 of 6870
These data are only available for scientific research purposes.