• Drug Bank
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 of 344
Records 1261 to 1280 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
DB01509 mol2, pdbqt 140,56 -2,777 179,218 1,5653 3 1 0 -1,3456 0,558974946919601 BBB+ HIA+ Caco2+
DB01511 mol2, pdbqt 41,46 -5,432 305,163 3,2323 3 1 0 2,7971 0,359900886721345 BBB+ HIA+ Caco2+
DB01512 mol2, pdbqt 197,99 -2,325 303,357 0,7087 5 3 0 4,5961 0,915164126264922 BBB+ HIA+ Caco2+
DB01513 mol2, pdbqt 226,55 -4,383 306,488 3,755 2 2 0 2,464 0,67241935754695 BBB+ HIA+ Caco2+
DB01515 mol2, pdbqt 211,95 -2,421 289,33 0,4964 5 1 0 1,4683 0,837520352013863 BBB+ HIA+ Caco2+
DB01516 mol2, pdbqt 187,08 -2,12 225,287 1,2439 4 1 0 -1,2139 0,580791228172007 BBB+ HIA+ Caco2+
DB01518 mol2, pdbqt 300,32 -3,432 367,487 3,3973 4 0 0 4,0147 0,759489618280096 BBB+ HIA+ Caco2+
DB01520 mol2, pdbqt 200,51 -3,477 249,421 4,0038 1 0 0 1,0062 0,399718902021524 BBB+ HIA+ Caco2+
DB01521 mol2, pdbqt 227,36 -4,752 322,874 3,9155 2 1 0 0,11958 0,296406258758453 BBB+ HIA+ Caco2+
DB01522 mol2, pdbqt 295,3 -3,211 353,504 4,0357 3 0 0 5,688 0,444110570702636 BBB+ HIA+ Caco2+
DB01523 mol2, pdbqt 298,29 -3,409 386,882 1,8597 6 0 0 1,0839 0,421781924717379 BBB+ HIA+ Caco2-
DB01524 mol2, pdbqt 214,83 -4,01 290,445 3,3525 2 2 0 0,7731 0,515373532447354 BBB+ HIA+ Caco2+
DB01525 mol2, pdbqt 130,79 -0,841 185,222 -1,432 4 2 0 1,8158 0,911821225794586 BBB+ HIA+ Caco2+
DB01526 mol2, pdbqt 214,83 -4,01 290,445 3,3525 2 2 0 0,59117 0,377221991467425 BBB+ HIA+ Caco2+
DB01527 mol2, pdbqt 145,89 -2,911 183,681 2,4405 1 1 0 -0,91538 0,579290936821723 BBB+ HIA+ Caco2+
DB01528 mol2, pdbqt 177,08 -2,446 209,288 1,6578 3 1 0 -1,2139 0,573591972858904 BBB+ HIA+ Caco2+
DB01529 mol2, pdbqt 313,38 -2,3 392,541 3,227 4 0 0 4,8899 0,798244542893122 BBB+ HIA+ Caco2+
DB01530 mol2, pdbqt 216,38 -4,274 292,461 3,457 2 2 0 0,24997 0,573365132732773 BBB+ HIA+ Caco2+
DB01531 mol2, pdbqt 188,64 -3,174 271,359 2,3842 3 1 0 2,0446 0,821820687804395 BBB+ HIA+ Caco2+
DB01533 mol2, pdbqt 236,71 -3,85 291,482 3,4975 1 0 0 6,7662 0,615170298137253 BBB+ HIA+ Caco2+
Page 
 of 344
Records 1261 to 1280 of 6870
These data are only available for scientific research purposes.