• Drug Bank
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Records 1561 to 1580 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
DB01850 mol2, pdbqt 279,89 -3,148 331,454 1,5763 4 2 0 -0,13227 0,633635920877258 BBB- HIA+ Caco2+
DB01851 mol2, pdbqt 244,71 -2,902 242,469 4,1368 1 0 0 0,58168 0,646413320096251 BBB+ HIA+ Caco2+
DB01852 mol2, pdbqt 195,59 -2,787 286,238 1,8359 6 4 0 -0,082832 0,398602315166479 BBB+ HIA+ Caco2-
DB01853 mol2, pdbqt 714,41 -11,207 889,23 11,801 10 2 2 -8,3541 2,27850847919525E-02 BBB- HIA+ Caco2-
DB01854 mol2, pdbqt 116,92 -1,744 201,023 0,4712 3 1 0 -2,4697 0,519097226048989 BBB+ HIA+ Caco2+
DB01855 mol2, pdbqt 127,99 -0,452 174,199 -3,1711 5 3 0 3,7361 0,973377182882727 BBB+ HIA+ Caco2-
DB01856 mol2, pdbqt 130,5 -1,284 160,168 0,6966 4 2 0 -12,715 0,486679346742793 BBB+ HIA+ Caco2-
DB01857 mol2, pdbqt 136,6 1,429 213,082 -7,0568 8 4 0 -31,894 0,491857491247495 BBB+ HIA- Caco2-
DB01858 mol2, pdbqt 345,62 -4,96 444,505 2,9597 8 3 0 -18,42 0,295408452499271 BBB+ HIA+ Caco2-
DB01859 mol2, pdbqt 371,49 4,202 601,286 -11,293 20 10 3 -32,634 0,307169828235266 BBB+ HIA- Caco2-
DB01860 mol2, pdbqt 296,44 1,008 491,182 -9,2171 17 6 2 -27,212 0,381139167741582 BBB+ HIA- Caco2-
DB01861 mol2, pdbqt 345,12 1,938 566,301 -9,07 19 9 3 -38,193 0,327582256253431 BBB+ HIA- Caco2-
DB01862 mol2, pdbqt 166,17 -0,876 238,303 -0,3702 5 4 0 -1,5734 0,567831976784216 BBB- HIA- Caco2-
DB01863 mol2, pdbqt 273,58 6,564 500,071 -16,036 18 10 3 -19,05 0,374944959691656 BBB+ HIA- Caco2-
DB01864 mol2, pdbqt 323,44 0,727 539,247 -8,7751 18 9 3 -27,894 0,106148376192504 BBB+ HIA- Caco2-
DB01865 mol2, pdbqt 256,93 -2,97 320,395 2,0116 5 1 0 3,2487 0,855348711547105 BBB+ HIA+ Caco2+
DB01866 mol2, pdbqt 144,79 -0,809 216,213 -0,7405 5 2 0 -2,3651 0,529384844642649 BBB+ HIA+ Caco2-
DB01868 mol2, pdbqt 248,47 -0,131 338,276 -8,5265 10 5 0 -19,219 0,466820640468262 BBB+ HIA- Caco2-
DB01870 mol2, pdbqt 137,03 -1,712 212,289 -0,6494 4 3 0 -5,5955 0,484406662336836 BBB+ HIA- Caco2-
DB01871 mol2, pdbqt 365,34 -4,597 460,528 2,843 7 3 0 -8,9606 0,306418964988187 BBB- HIA+ Caco2-
Page 
 of 344
Records 1561 to 1580 of 6870
These data are only available for scientific research purposes.