• Drug Bank
Page 
 of 344
Records 3821 to 3840 of 6870
 
Molecule Name
Download
TPSA
cLogS
MW
cLogP
HBA
HBD
Ro5 violations
Druglikeness
DrugScore
Blood-Brain Barrier
Human Intestinal Absorption
Caco-2 Permeability
DB04293 mol2, pdbqt 239,5 -2,423 349,773 -2,431 7 3 0 3,611 0,884366346501528 BBB- HIA- Caco2-
DB04294 mol2, pdbqt 223,28 2,193 388,094 -10,23 13 7 2 -30,559 0,448072035680265 BBB+ HIA- Caco2-
DB04295 mol2, pdbqt 230,06 -1,782 326,304 -1,0355 9 6 1 -1,9665 0,519502689288073 BBB+ HIA- Caco2-
DB04296 mol2, pdbqt 116,15 -0,868 145,157 -2,6809 4 2 0 -19,893 0,295486045532855 BBB+ HIA+ Caco2-
DB04297 mol2, pdbqt 249,62 -3,264 302,373 2,2288 5 2 0 1,9952 0,484844912400554 BBB+ HIA+ Caco2-
DB04298 mol2, pdbqt 374,08 -7,18 495,682 5,8171 5 3 1 -3,6315 0,139586291499288 BBB+ HIA+ Caco2-
DB04299 mol2, pdbqt 88,2 -0,246 116,072 -0,9188 4 2 0 1,9085 0,333210514900947 BBB+ HIA+ Caco2-
DB04300 mol2, pdbqt 273,58 6,564 500,071 -16,036 18 10 3 -19,05 0,374944959691656 BBB+ HIA- Caco2-
DB04301 mol2, pdbqt 244,05 -0,00000032969 366,384 -0,8102 10 8 1 0,86308 0,776549450854476 BBB+ HIA+ Caco2-
DB04302 mol2, pdbqt 160,95 -1,677 210,296 2,7208 2 1 0 -1,7761 0,528279679453332 BBB+ HIA+ Caco2+
DB04303 mol2, pdbqt 137,91 0,141 208,165 -2,5425 7 4 0 -1,9827 0,550564254942977 BBB- HIA- Caco2-
DB04304 mol2, pdbqt 133,11 0,564 196,154 -3,4954 7 6 1 2,049 0,929062536144093 BBB+ HIA+ Caco2-
DB04306 mol2, pdbqt 211,93 -5,191 282,37 2,9446 4 2 0 -1,1818 0,408421701409154 BBB+ HIA+ Caco2+
DB04307 mol2, pdbqt 155,16 -2,21 187,241 1,3836 2 2 0 -0,13379 0,694715192618946 BBB+ HIA+ Caco2-
DB04308 mol2, pdbqt 124,73 -0,826 167,163 -2,3976 4 3 0 -6,9543 0,492040242607638 BBB- HIA+ Caco2-
DB04310 mol2, pdbqt 309,79 -2,751 385,503 1,3798 8 4 0 -5,1812 0,424835473472101 BBB- HIA+ Caco2-
DB04311 mol2, pdbqt 136,82 -2,228 149,236 2,0034 1 1 0 -5,5908 0,47202157407344 BBB+ HIA+ Caco2+
DB04312 mol2, pdbqt 106,07 -2,128 144,12 1,2639 1 1 0 -3,5856 0,490513028679228 BBB+ HIA+ Caco2+
DB04313 mol2, pdbqt 107,48 -0,311 147,129 -3,5947 5 3 0 -10,097 0,494142668308195 BBB- HIA+ Caco2-
DB04314 mol2, pdbqt 98,3 -1,03 125,131 -1,2797 4 1 0 -4,7784 0,496287247000342 BBB+ HIA+ Caco2+
Page 
 of 344
Records 3821 to 3840 of 6870
These data are only available for scientific research purposes.