• Drug Bank
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Records 5121 to 5140 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
DB07456 mol2, pdbqt 327,73 -3,38 438,529 2,43 6 2 0 7,1448 0,741372233727871 BBB+ HIA+ Caco2-
DB07457 mol2, pdbqt 287,17 -3,062 384,438 1,1026 6 3 0 3,3751 0,821193140573306 BBB+ HIA+ Caco2-
DB07458 mol2, pdbqt 327,73 -3,38 438,529 2,43 6 2 0 7,1448 0,741372233727871 BBB+ HIA+ Caco2-
DB07459 mol2, pdbqt 244,51 -4,47 304,348 2,9652 4 1 0 1,2342 0,651408293316819 BBB+ HIA+ Caco2+
DB07460 mol2, pdbqt 354,21 -5,426 468,944 3,5219 9 3 0 3,0041 0,188858598512039 BBB+ HIA+ Caco2+
DB07461 mol2, pdbqt 204,38 -1,487 273,335 -1,3911 5 1 0 -0,08695 0,70533982991213 BBB+ HIA+ Caco2-
DB07462 mol2, pdbqt 187,14 -3,584 259,216 1,1766 6 2 0 -6,2807 0,435408410168187 BBB- HIA+ Caco2-
DB07463 mol2, pdbqt 257,69 -2,741 335,475 1,3185 6 3 0 1,6672 0,650785441488311 BBB+ HIA+ Caco2-
DB07464 mol2, pdbqt 198,74 0,763 267,044 1,0054 7 5 0 -11,098 0,307501472737927 BBB+ HIA- Caco2-
DB07465 mol2, pdbqt 216,53 -3,307 315,415 0,3497 5 2 0 -2,4644 0,470597024379113 BBB+ HIA+ Caco2-
DB07466 mol2, pdbqt 253,65 -0,668 327,143 2,793 6 4 0 -9,325 0,44582651990003 BBB+ HIA- Caco2-
DB07467 mol2, pdbqt 250,07 -3,93 365,84 1,9173 6 2 0 5,9392 0,46865165190262 BBB+ HIA+ Caco2-
DB07468 mol2, pdbqt 213,58 -3,822 292,337 2,038 4 1 0 3,9866 0,49210445004493 BBB+ HIA+ Caco2+
DB07469 mol2, pdbqt 213,58 -3,822 292,337 2,038 4 1 0 3,9866 0,656139266726573 BBB+ HIA+ Caco2+
DB07470 mol2, pdbqt 201,32 -3,478 278,31 1,6941 4 1 0 4,0318 0,686039960315956 BBB+ HIA+ Caco2+
DB07471 mol2, pdbqt 332,25 -8,101 457,937 4,1274 7 1 0 3,7489 0,356835520190632 BBB+ HIA+ Caco2+
DB07472 mol2, pdbqt 201,75 -5,451 281,378 3,6577 2 0 0 3,9468 0,595870135885598 BBB+ HIA+ Caco2+
DB07473 mol2, pdbqt 228,24 -5,088 325,387 2,7901 4 0 0 1,1258 0,582679475093964 BBB+ HIA+ Caco2+
DB07474 mol2, pdbqt 305,04 -4,478 397,441 0,2713 8 3 0 4,7082 0,715449631118359 BBB+ HIA+ Caco2+
DB07476 mol2, pdbqt 215,19 -4,133 308,381 1,5121 5 2 0 1,5433 0,730635276349902 BBB+ HIA+ Caco2-
Page 
 of 344
Records 5121 to 5140 of 6870
These data are only available for scientific research purposes.