• Drug Bank
Page 
 of 344
Records 1521 to 1540 of 6870
 
Molecule Name
Download
TPSA
cLogS
MW
cLogP
HBA
HBD
Ro5 violations
Druglikeness
DrugScore
Blood-Brain Barrier
Human Intestinal Absorption
Caco-2 Permeability
DB01808 mol2, pdbqt 96,22 0,654 213,089 -2,9934 4 3 0 -6,5171 0,188942494620975 BBB+ HIA+ Caco2-
DB01809 mol2, pdbqt 221,07 -5,349 281,362 2,3935 5 1 0 1,4959 0,599094094015631 BBB+ HIA+ Caco2+
DB01810 mol2, pdbqt 330,01 -3,989 408,453 1,8454 7 2 0 -9,8522 0,297122536867283 BBB+ HIA+ Caco2-
DB01811 mol2, pdbqt 110,13 -1,549 149,149 1,0076 3 3 0 -0,73083 0,64168627609578 BBB+ HIA+ Caco2-
DB01812 mol2, pdbqt 261,41 0,835 427,202 -8,3976 15 6 2 -19,113 0,425750575692166 BBB+ HIA- Caco2-
DB01813 mol2, pdbqt 267,32 0,759 379,281 -6,0431 11 7 2 -20,224 0,451731858188733 BBB- HIA- Caco2-
DB01814 mol2, pdbqt 418,85 -6,95 454,733 10,069 4 1 1 -25,303 0,115460702580578 BBB+ HIA+ Caco2+
DB01815 mol2, pdbqt 185,82 -0,329 248,234 -5,779 8 5 0 -18,278 0,486110416508759 BBB- HIA- Caco2-
DB01816 mol2, pdbqt 125,98 0,069 189,21 -1,8813 5 4 0 4,2957 0,978066384611085 BBB- HIA+ Caco2-
DB01817 mol2, pdbqt 171,11 -0,211 236,223 -6,9459 8 5 0 -14,867 0,487854403294379 BBB- HIA- Caco2-
DB01818 mol2, pdbqt 156,59 1,397 260,218 -4,2356 9 5 0 -0,42588 0,678373490803017 BBB+ HIA- Caco2-
DB01819 mol2, pdbqt 106,82 0,981 168,041 -3,4407 6 3 0 -26,818 0,494752414631294 BBB+ HIA- Caco2-
DB01820 mol2, pdbqt 408,33 -6,401 533,579 2,6697 10 4 1 -5,3681 7,24741517100737E-02 BBB- HIA+ Caco2-
DB01821 mol2, pdbqt 247,22 -0,193 318,337 -7,436 12 8 2 -0,74617 0,624726120793023 BBB+ HIA- Caco2-
DB01822 mol2, pdbqt 100,2 -1,576 152,238 0,0538 2 2 0 -0,79049 0,638522055465112 BBB+ HIA+ Caco2-
DB01823 mol2, pdbqt 154,49 -0,277 248,19 -3,6146 9 6 1 0,15588 0,748195027428744 BBB+ HIA- Caco2-
DB01824 mol2, pdbqt 470,02 -5,571 629,751 3,4169 10 5 1 1,6967 0,337150108550171 BBB+ HIA+ Caco2-
DB01825 mol2, pdbqt 132,72 -2,987 175,19 0,3645 4 2 0 0,6192 0,458996498060723 BBB+ HIA+ Caco2+
DB01826 mol2, pdbqt 89,51 -1,123 84,1414 1,0342 1 0 0 -2,3677 0,254654850044214 BBB+ HIA+ Caco2+
DB01827 mol2, pdbqt 147,19 -2,979 223,125 1,0801 3 1 0 -1,9098 0,517143848804893 BBB+ HIA+ Caco2+
Page 
 of 344
Records 1521 to 1540 of 6870
These data are only available for scientific research purposes.