• UNII FDA
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Records 53041 to 53060 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
90478449 275180LIWM mol2, pdbqt 395,57 0,18242 86,74 -5,823 553,521 5,4537 6 0 2 -2,3785 6,76754124797814E-02
90478450 Y88099PUGV mol2, pdbqt 10 1 9,23 -0,53 18,0149 0 1 1 0 -1 0,135605826048597
90478459 39TZ02I46Y mol2, pdbqt 348,32 0,2492 104,44 -3,966 435,563 3,456 8 2 0 -23,652 0,200188340954233
90478460 H4Y723QRFR mol2, pdbqt 381,04 0,22376 106,97 -5,079 583,489 3,5824 7 1 1 -1,1391 0,094753643098387
90478464 2J402604TU mol2, pdbqt 308,31 0,13898 63,93 -4,56 431,658 3,5872 4 3 0 4,1725 0,609850362005695
90478465 06X561055P mol2, pdbqt 404,85 0,2184 121,13 -5,962 579,171 4,7585 7 3 1 -1,2922 5,57197965600533E-02
90478475 4UQT405S4M mol2, pdbqt 244,8 0 0 -8,706 627,588 7,67 0 0 2 -3,9741 3,13895701213621E-02
90478476 XZ1387049S mol2, pdbqt 10 1 9,23 -0,53 18,0149 0 1 1 0 -1 0,135605826048597
90478482 8LTL397M2E mol2, pdbqt 61,7 0,84733 74,6 0,066 90,0339 -1,5754 4 2 0 -6,1289 0,107429690172953
90478486 073SBV429N mol2, pdbqt 1457,9 0,3318 620,71 -11,873 1906,32 1,1451 39 23 3 2,8077 0,240616615836276
90478487 AOT5JSF2UI mol2, pdbqt 263,43 0 0 -9,54 706,484 8,3952 0 0 2 -3,9741 2,06077300655551E-02
90478490 25E2W9OO15 mol2, pdbqt 244,8 0 0 -8,706 627,588 7,67 0 0 2 -3,9741 2,35421775910215E-02
90478509 922M84335M mol2, pdbqt 282,06 0 0 -10,374 785,38 9,1204 0 0 2 -3,9741 1,93010295867986E-02
90478510 HK547YXJ1W mol2, pdbqt 282,06 0 0 -10,374 785,38 9,1204 0 0 2 -3,9741 1,93010295867986E-02
90478514 20D04M9OLN mol2, pdbqt 137,37 0,35801 63,6 -1,929 180,159 1,1314 4 1 0 -1,6343 0,120307897384524
90478519 XOI483BPTB mol2, pdbqt 218,22 0,57162 177,14 -0,441 332,26 -1,7295 10 7 1 -4,3275 0,473912971834335
90478523 1OA214846O mol2, pdbqt 54,78 1 82,98 1,524 98,0779 -3,4103 4 2 0 -2,0209 7,20337002000834E-02
90478526 WI56BPJ20A mol2, pdbqt 155,82 0,49313 106,86 -0,45 205,209 -2,421 6 4 0 -3,446 0,505351870943368
90478527 4N9535CHEK mol2, pdbqt 359,06 0,25728 132,31 -4,395 499,71 2,0912 7 4 0 -5,295 0,302466676542275
90478528 19KK440S5J mol2, pdbqt 236,33 0,1682 52,93 -2,846 312,388 1,7824 4 2 0 6,135 0,88453809002751
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 of 2794
Records 53041 to 53060 of 55865
These data are only available for scientific research purposes.