• UNII FDA
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Records 55641 to 55660 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
121491428 Q6IXN49NCA mol2, pdbqt 10 1 9,23 -0,53 18,0149 0 1 1 0 -1 0,135605826048597
121491632 4HMK55688N mol2, pdbqt 138,23 0,28619 44,7 -2,81 179,222 0,8096 4 1 0 3,2617 0,915551965989074
121491673 SZS2G4CVBN mol2, pdbqt 168,29 0,10488 12,53 -6,009 242,276 4,2648 1 0 0 -0,69389 0,124641884877749
121491706 XL240RV14F mol2, pdbqt 316,74 0,32273 117,59 -4,773 484,843 3,2339 9 1 0 -2,1814 0,110514911121384
121491724 Z53JDF7582 mol2, pdbqt 292,67 0,20221 72,83 -4,471 438,509 2,3085 5 1 0 -1,4889 0,234875532001059
121491893 C70D7B74QF mol2, pdbqt 274,08 0,39831 147,62 -1,371 355,437 -2,0438 9 4 0 -0,030771 0,680979650128501
121491977 EH6323C6VM mol2, pdbqt 238,43 0,19964 58,56 -5,921 329,729 3,3726 4 2 0 -11,021 0,277912323974827
121492109 X951SA25PA mol2, pdbqt 215,15 0,3683 94,45 -2,816 330,291 0,6388 7 2 0 1,2717 0,227993981223874
121492235 T3UU01KR2Y mol2, pdbqt 241,42 0,1248 45,53 -5,424 347,437 4,1062 3 0 0 -8,3795 0,079979558211854
121492536 85J6JHT779 mol2, pdbqt 284,88 0,39501 137,47 -2,715 419,389 0,6829 11 1 1 1,3418 0,210931697167371
121492632 EA18JIE48O mol2, pdbqt 195,09 0,31462 54,27 -5,401 265,267 3,025 4 2 0 -3,3246 0,119070511009353
121492700 H9AFN5YD9R mol2, pdbqt 207,63 0,12619 40,46 -5,302 398,927 3,6433 2 2 0 -0,18692 7,11108804712124E-02
121492796 EB209588AV mol2, pdbqt 677,45 0,18105 170,77 -11,084 860,149 6,2408 10 4 2 -28,993 2,79710571237414E-02
121492864 Z894KE4P3E mol2, pdbqt 4302,1 0,59369 3158,8 -42,176 6604,45 -31,928 176 47 3 -18,576 2,88000002465687E-02
121493125 H7150TB7TY mol2, pdbqt 220,35 0,23245 63,33 -5,688 301,728 3,8311 4 1 0 1,1606 0,496044057993306
121493126 3R7PEG83LG mol2, pdbqt 220,35 0,23245 63,33 -5,688 301,728 3,8311 4 1 0 1,1606 0,496044057993306
121493386 L83HR8M9QX mol2, pdbqt 234,7 0,35028 102,42 -2,647 317,348 0,2173 8 2 0 2,6396 0,874608673409767
121493436 950736UC77 mol2, pdbqt 4779,6 0,55326 3187,7 -36,438 7183,18 -26,659 190 43 3 -23,997 2,16000000008181E-02
121493493 3VT396246L mol2, pdbqt 149,79 0,19107 25,42 -2,948 197,236 2,1087 2 0 0 -1,164 0,269313194114922
121493507 76G65QY945 mol2, pdbqt 285,71 0,31105 113,37 -1,292 383,439 0,3621 8 2 0 9,6792 0,708730065851374
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 of 2794
Records 55641 to 55660 of 55865
These data are only available for scientific research purposes.