• UNII FDA
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Records 141 to 160 of 55865
 
PUBCHEM ID
UNII
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Total Surface Area
Relative PSA
TPSA
cLogS
MW
cLogP
H-Acceptors
H-Donors
Ro5 violations
Druglikeness
DrugScore
546 N919E46723 mol2, pdbqt 87,83 0,78971 104,64 0,696 140,031 -4,1547 5 3 0 -14,227 0,49586004676031
547 KEX5N0R4N5 mol2, pdbqt 123,82 0,42271 77,76 -1,002 168,148 0,4514 4 3 0 -1,7208 0,337506980787441
563 F523ALI47D mol2, pdbqt 94,87 0,45989 62,6 -1,104 120,172 0,3045 2 1 0 -1,5901 0,573252349309854
568 8U54U639VI mol2, pdbqt 132,15 0,10677 13,14 -4,276 168,195 3,4281 1 0 0 -2,1607 0,250833438159929
572 5829E3D9I9 mol2, pdbqt 127,44 0,57211 107,88 0,187 183,099 -4,1422 6 3 0 -11,478 0,493149157776888
586 MU72812GK0 mol2, pdbqt 102,75 0,58939 90,41 0,693 131,134 -1,388 5 3 0 -0,53335 0,679107986489822
588 AYI8EX34EU mol2, pdbqt 85,56 0,5069 58,69 -0,536 113,12 -1,3542 4 1 0 3,6385 0,976040496581186
594 5CM45Q5YAF mol2, pdbqt 88,24 0,72552 102,12 -1,063 121,16 -3,0583 3 2 0 -11,18 0,492546363101923
597 8J337D1HZY mol2, pdbqt 87,2 0,58807 67,48 -2,616 111,104 -0,5667 4 2 0 1,2294 0,540073410583945
598 VHD28S0H7F mol2, pdbqt 91,81 0,70025 101,55 -0,865 142,199 -1,3903 3 1 0 -11,851 0,492311852862301
602 1FU7983T0U mol2, pdbqt 70,88 0,58423 63,32 -0,406 89,0936 -2,9911 3 2 0 -3,896 0,505502316312034
611 61LJO5I15S mol2, pdbqt 110,24 0,61275 100,62 -0,421 147,129 -3,3586 5 3 0 -18,651 0,493849850756486
612 3B8D35Y7S4 mol2, pdbqt 68,71 0,5711 57,53 -0,33 90,0776 -0,8665 3 2 0 -2,02 0,553167729283894
614 DCS9E77JPQ mol2, pdbqt 89,34 0,42086 49,33 -0,708 115,131 -2,6125 3 2 0 -4,0386 0,502634137046988
617 00PAR1C66F mol2, pdbqt 78,73 0,69237 83,55 0,101 105,093 -3,9178 4 3 0 -10,074 0,496312662572931
648 39LRK7UX5B mol2, pdbqt 108,78 0,69075 95,5 -0,881 158,113 -1,7253 6 3 0 -8,2906 0,491795782772341
649 016FR52RU5 mol2, pdbqt 85,94 0,57017 58,2 -1,028 114,104 -0,7737 4 2 0 2,8231 0,956838522749234
650 K324J5K4HM mol2, pdbqt 73,52 0,35473 34,14 -0,828 86,0896 -0,22 2 0 0 -3,8923 0,108651460881329
660 NM5K1Y1BT2 mol2, pdbqt 115,03 0,2003 26,3 -2,235 148,161 1,6612 2 0 0 -4,9403 0,171645024102204
668 T7KF2T6W95 mol2, pdbqt 111,59 0,71117 113,87 1,688 170,057 -4,7186 6 3 0 -17,939 0,494997208385433
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Records 141 to 160 of 55865
These data are only available for scientific research purposes.