• Drug Bank
Page 
 of 344
Records 6821 to 6840 of 6870
 
Molecule Name
Download
TPSA
cLogS
MW
cLogP
HBA
HBD
Ro5 violations
Druglikeness
DrugScore
Blood-Brain Barrier
Human Intestinal Absorption
Caco-2 Permeability
DB11614 mol2, pdbqt 29,02 -4,751 415,966 5,0723 3 0 1 3,3685 0,492986513853265 BBB+ HIA+ Caco2+
DB11618 mol2, pdbqt 454,96 -6,895 645,663 3,8385 13 6 3 6,7592 0,171440489803693 BBB- HIA- Caco2-
DB11619 mol2, pdbqt 37,3 -4,059 308,42 3,329 2 1 0 1,5606 0,689948608078617 BBB+ HIA+ Caco2+
DB11620 mol2, pdbqt 180,52 0,919 277,149 -8,3105 8 6 1 -18,496 0,483222976890158 BBB+ HIA- Caco2-
DB11622 mol2, pdbqt 293,29 -4,633 402,529 3,6105 5 1 0 -0,30551 0,269694331566043 BBB+ HIA+ Caco2+
DB11623 mol2, pdbqt 309,2 -2,61 399,482 0,7964 8 3 0 -9,8076 0,252445818392057 BBB+ HIA+ Caco2-
DB11699 mol2, pdbqt 45,33 -3,311 284,358 2,4693 4 1 0 3,1433 0,839279646533296 BBB+ HIA+ Caco2+
DB11730 mol2, pdbqt 91,21 -3,404 434,546 2,5885 9 2 0 3,6929 0,731572239221166 BBB+ HIA+ Caco2-
DB11737 mol2, pdbqt 74,73 -3,673 391,426 2,9067 7 1 0 -12,415 0,226698282064995 BBB+ HIA+ Caco2+
DB11793 mol2, pdbqt 72,94 -3,683 320,395 2,0619 5 2 0 4,2674 0,492520437178485 BBB+ HIA+ Caco2-
DB11915 mol2, pdbqt 74,02 -3,49 418,576 3,356 6 1 0 -13,849 0,129887825510848 BBB+ HIA+ Caco2+
DB11921 mol2, pdbqt 102,26 -3,788 441,522 1,2218 7 1 0 5,1015 0,728150921234292 BBB+ HIA+ Caco2-
DB11943 mol2, pdbqt 119,99 -6,357 440,764 1,257 8 3 0 1,5876 0,364100938523877 BBB- HIA+ Caco2-
DB11994 mol2, pdbqt 124,04 -5,343 368,296 2,4919 8 1 0 -1,0845 0,140422767620668 BBB+ HIA+ Caco2+
DB12095 mol2, pdbqt 142,17 -6,178 546,936 0,9732 9 3 1 -16,684 0,208609002468591 BBB+ HIA+ Caco2-
DB12161 mol2, pdbqt 38,77 -2,754 317,427 3,3076 4 0 0 3,9995 0,297532466002799 BBB+ HIA+ Caco2+
DB12243 mol2, pdbqt 32,67 -2,043 174,202 1,8166 3 0 0 2,863 0,119353167110497 BBB+ HIA+ Caco2+
DB12332 mol2, pdbqt 56,92 -4,463 323,37 2,5426 4 3 0 1,6734 0,409698722612886 BBB+ HIA+ Caco2-
DB12598 mol2, pdbqt 138,07 -3,746 347,377 1,655 7 5 0 0,9605 0,700948982756801 BBB+ HIA+ Caco2-
DB12843 mol2, pdbqt 410,54 -5,013 576,724 2,9245 9 2 1 2,3045 0,433361336724305 BBB- HIA+ Caco2-
Page 
 of 344
Records 6821 to 6840 of 6870
These data are only available for scientific research purposes.