• Drug Bank
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 of 344
Records 4641 to 4660 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
DB06960 mol2, pdbqt 310,31 -4,045 341,534 5,0355 4 3 1 -21,043 0,30013447305123 BBB+ HIA+ Caco2-
DB06961 mol2, pdbqt 340,18 -4,631 457,913 2,8849 8 3 0 6,0376 0,366242175492063 BBB- HIA+ Caco2-
DB06962 mol2, pdbqt 324,81 -4,303 412,488 3,9467 5 1 0 2,3658 0,604762622710274 BBB+ HIA+ Caco2-
DB06963 mol2, pdbqt 316,37 -4,728 399,497 2,7853 6 2 0 2,7304 0,639186887937501 BBB+ HIA+ Caco2-
DB06964 mol2, pdbqt 286,84 -5,068 388,806 3,223 7 3 0 5,1928 0,368683178934879 BBB- HIA+ Caco2-
DB06965 mol2, pdbqt 246,72 -3,329 298,361 2,8998 3 1 0 -37,542 0,417536739506958 BBB+ HIA+ Caco2+
DB06966 mol2, pdbqt 246,72 -3,329 298,361 2,8998 3 1 0 -37,542 0,417536739506958 BBB+ HIA+ Caco2+
DB06967 mol2, pdbqt 295,54 -5,758 375,475 3,6361 6 2 0 0,84411 0,131677505217664 BBB+ HIA+ Caco2-
DB06968 mol2, pdbqt 191,5 -0,294 218,303 1,2576 4 0 0 -1,7041 0,558389049335694 BBB+ HIA+ Caco2+
DB06969 mol2, pdbqt 345,03 -6,717 480,419 4,1343 7 2 0 5,7468 6,59846307178205E-02 BBB+ HIA+ Caco2+
DB06970 mol2, pdbqt 314 -5,358 437,971 4,1509 6 1 0 -1,8437 0,286075222645302 BBB+ HIA+ Caco2-
DB06971 mol2, pdbqt 250,37 -4,66 311,34 2,1018 6 2 0 -1,8866 0,415925186732232 BBB+ HIA+ Caco2-
DB06972 mol2, pdbqt 296,7 -5,729 408,287 4,072 4 0 0 0,10667 0,380000358905392 BBB+ HIA+ Caco2+
DB06973 mol2, pdbqt 180,65 -2,297 228,29 2,8655 2 2 0 -3,2442 6,05372980249462E-02 BBB+ HIA+ Caco2+
DB06974 mol2, pdbqt 336,12 -3,936 468,533 1,9909 9 2 0 5,3638 0,541242623810543 BBB- HIA+ Caco2+
DB06976 mol2, pdbqt 268,59 -3,436 366,424 1,562 8 4 0 3,5058 0,811892845209406 BBB+ HIA+ Caco2-
DB06977 mol2, pdbqt 299,43 -4,234 383,454 1,6649 6 2 0 2,5827 0,43128755269381 BBB+ HIA+ Caco2-
DB06978 mol2, pdbqt 259,21 -4,815 444,078 3,8906 6 3 0 2,5245 0,325084618799605 BBB+ HIA+ Caco2-
DB06979 mol2, pdbqt 265,56 -3,758 313,464 4,3535 5 2 0 -19,856 0,349950390596623 BBB+ HIA+ Caco2-
DB06980 mol2, pdbqt 187,57 -3,297 231,294 2,9729 3 2 0 -5,7375 0,342146022139699 BBB+ HIA+ Caco2-
Page 
 of 344
Records 4641 to 4660 of 6870
These data are only available for scientific research purposes.