• Drug Bank
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Records 701 to 720 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
DB00846 mol2, pdbqt 93,06 -3,94 436,518 1,5787 6 2 0 -0,97859 0,275424722231779 BBB+ HIA+ Caco2+
DB00847 mol2, pdbqt 64,82 -1,21 77,1506 -0,4145 1 1 0 -6,1884 0,177427517791066 BBB+ HIA+ Caco2+
DB00849 mol2, pdbqt 66,48 -2,44 246,265 0,8838 5 1 0 4,2398 0,267269198444502 BBB+ HIA+ Caco2+
DB00850 mol2, pdbqt 55,25 -4,163 403,976 4,1649 4 1 0 9,5612 0,38038941959232 BBB+ HIA+ Caco2-
DB00851 mol2, pdbqt 99,73 -1,236 182,186 -0,0523 7 2 0 -1,3889 0,126301674891753 BBB+ HIA+ Caco2+
DB00852 mol2, pdbqt 32,26 -1,434 165,235 0,7353 2 2 0 2,7661 0,942031644885126 BBB+ HIA+ Caco2+
DB00853 mol2, pdbqt 105,94 -1,895 194,154 -0,5014 8 1 0 -1,8034 0,118890590832157 BBB+ HIA+ Caco2+
DB00854 mol2, pdbqt 23,47 -3,202 257,376 2,9007 2 1 0 -0,25467 0,491684202806716 BBB+ HIA+ Caco2+
DB00855 mol2, pdbqt 80,39 -0,49 131,13 -3,0402 4 2 0 -1,656 0,573492986002326 BBB+ HIA+ Caco2-
DB00856 mol2, pdbqt 49,69 -2,034 202,636 1,1078 3 2 0 -1,1244 0,355818940018626 BBB+ HIA+ Caco2-
DB00857 mol2, pdbqt 3,24 -6,141 291,437 5,3193 1 0 1 -3,4681 0,131209165306227 BBB+ HIA+ Caco2+
DB00858 mol2, pdbqt 37,3 -4,485 304,472 3,87 2 1 0 1,2572 0,364190759344576 BBB+ HIA+ Caco2+
DB00859 mol2, pdbqt 102,12 -1,441 149,213 -2,2662 3 2 0 -19,312 0,293580374100281 BBB+ HIA+ Caco2-
DB00860 mol2, pdbqt 94,83 -2,958 360,448 1,1414 5 3 0 4,0984 0,85221170335106 BBB+ HIA+ Caco2-
DB00861 mol2, pdbqt 57,53 -4,047 250,2 2,6598 3 2 0 -3,1842 0,15037839336419 BBB+ HIA+ Caco2+
DB00862 mol2, pdbqt 117,51 -4,217 488,611 2,0144 10 1 0 5,4018 0,629789494335399 BBB+ HIA+ Caco2+
DB00863 mol2, pdbqt 111,56 -3,524 314,409 -2,0197 7 2 0 -0,50349 0,593679063156695 BBB- HIA+ Caco2-
DB00864 mol2, pdbqt 178,36 -5,676 804,027 5,1075 13 3 3 -0,8866 0,163076175359034 BBB- HIA- Caco2-
DB00865 mol2, pdbqt 3,24 -2,943 239,361 3,49 1 0 0 5,8809 0,838805656278472 BBB+ HIA+ Caco2+
DB00866 mol2, pdbqt 41,49 -2,68 249,353 2,2495 3 2 0 4,2607 0,898469034714253 BBB- HIA+ Caco2+
Page 
 of 344
Records 701 to 720 of 6870
These data are only available for scientific research purposes.