• Drug Bank
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 of 344
Records 5341 to 5360 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
DB07684 mol2, pdbqt 177,61 -1,864 251,305 0,5211 4 1 0 -0,98429 0,174060776084651 BBB+ HIA+ Caco2-
DB07685 mol2, pdbqt 294,67 -3,503 402,478 1,9369 9 2 0 0,50567 0,635796929642295 BBB+ HIA+ Caco2-
DB07686 mol2, pdbqt 282,37 -3,493 387,467 1,4592 9 3 0 0,45484 0,648138117204005 BBB+ HIA+ Caco2-
DB07687 mol2, pdbqt 289,63 -3,17 402,482 0,2093 10 4 0 3,157 0,800597653768035 BBB+ HIA+ Caco2-
DB07688 mol2, pdbqt 280,91 -3,451 388,451 1,7422 9 2 0 0,48407 0,649481563723519 BBB+ HIA+ Caco2-
DB07689 mol2, pdbqt 327,02 -3,98 436,475 0,5615 11 3 1 2,1349 0,686886510189176 BBB+ HIA+ Caco2-
DB07691 mol2, pdbqt 312,75 -3,952 436,487 2,8799 7 2 0 -0,62553 0,466960219942031 BBB- HIA+ Caco2-
DB07692 mol2, pdbqt 299,04 -2,082 460,477 1,8612 8 0 0 -7,5599 0,385763369419032 BBB+ HIA+ Caco2-
DB07693 mol2, pdbqt 230,36 -5,188 399,081 4,5996 3 2 0 -1,1139 0,192369335323523 BBB+ HIA+ Caco2+
DB07694 mol2, pdbqt 236,68 -5,972 439,918 5,1238 3 2 1 -0,97707 8,97438265118253E-02 BBB+ HIA+ Caco2+
DB07695 mol2, pdbqt 236,71 -4,892 415,08 4,2539 4 3 0 -1,1139 0,346538186004303 BBB+ HIA+ Caco2+
DB07696 mol2, pdbqt 196,18 -2,026 245,274 0,777 6 1 0 -64,564 0,284066069123162 BBB+ HIA+ Caco2-
DB07697 mol2, pdbqt 308,6 -1,472 454,523 1,5896 9 0 0 -4,1061 0,402446223450375 BBB+ HIA+ Caco2-
DB07698 mol2, pdbqt 250,95 -6,439 335,797 3,032 5 2 0 4,097 0,520816020136329 BBB+ HIA+ Caco2+
DB07700 mol2, pdbqt 288,87 -5,617 395,541 4,3878 4 1 0 -0,3044 0,211423881756266 BBB+ HIA+ Caco2+
DB07701 mol2, pdbqt 299,91 -4,347 379,498 4,2149 4 0 0 5,6409 0,631295559532766 BBB+ HIA+ Caco2+
DB07702 mol2, pdbqt 205,78 -3,621 288,386 3,0245 3 3 0 -0,31086 0,347367013034937 BBB+ HIA+ Caco2+
DB07703 mol2, pdbqt 242,17 -3,176 296,405 3,0074 4 1 0 4,469 0,834980532289704 BBB+ HIA+ Caco2+
DB07704 mol2, pdbqt 252,93 -4,165 335,366 1,8671 7 3 0 0,56065 0,510867932262104 BBB+ HIA+ Caco2-
DB07705 mol2, pdbqt 277,02 -4,345 381,689 4,2444 3 0 0 4,7237 0,626000746873784 BBB+ HIA+ Caco2+
Page 
 of 344
Records 5341 to 5360 of 6870
These data are only available for scientific research purposes.