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 of 2794
Records 54401 to 54420 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
92135813 3Y635KQT1J mol2, pdbqt 746,6 0,45054 450,13 -4,289 1007,2 -4,061 24 12 3 8,316 0,418527465842467
92135815 3M841OTN9F mol2, pdbqt 96,76 0,14675 12,96 -1,688 140,189 0,7196 4 0 0 1,5849 0,114936704683002
92135816 IZP83XSR30 mol2, pdbqt 96,76 0,14675 12,96 -1,688 140,189 0,7196 4 0 0 1,5849 0,114936704683002
92135818 00KFR5UA0Z mol2, pdbqt 226,91 0,1152 37,3 -4,053 318,43 3,7096 2 1 0 -1,9829 0,408288065837617
92135819 43KI824L19 mol2, pdbqt 351,84 0,25398 97,4 -5,838 471,919 3,3689 8 3 0 -1,7299 0,272241918889267
92135823 OAZ24MRG73 mol2, pdbqt 104,89 0,38536 60,36 -1,333 137,114 -0,779 3 1 0 -1,758 0,561916148760064
92135828 C867UOE0YR mol2, pdbqt 301,92 0,25169 83,83 -4,16 390,454 1,9846 7 0 0 3,8189 0,225368623019753
92135829 MAR81EAO7F mol2, pdbqt 543,35 0,0065335 3,24 -7,87 542,997 13,221 1 0 2 -15,258 5,42962240459326E-02
92135841 9RL8157HTG mol2, pdbqt 148,76 0,31722 75,51 0,927 162,256 -3,4804 4 3 0 -0,9395 0,634122283065156
92135893 IL4WRG4H2X mol2, pdbqt 247,17 0,25404 79,23 -3,21 371,432 1,5068 6 2 0 4,6558 0,830280913039801
92135897 E0RKE8A64V mol2, pdbqt 217,86 0,062196 12,47 -2,311 255,36 2,9058 2 0 0 4,6945 0,319676377792448
92135905 66587E8T1C mol2, pdbqt 599,94 0,10943 81,67 -7,029 639,082 10,059 6 3 2 -14,827 8,13335867630398E-02
92135907 Q3LVH22497 mol2, pdbqt 240,07 0,4165 138,03 -1,683 347,394 -2,028 7 3 0 7,9062 0,914094773880749
92135909 9D3738GEUV mol2, pdbqt 239,44 0,21884 80,92 -3,453 354,46 1,824 4 4 0 1,38 0,446646162334287
92135911 1XDH81LZ8T mol2, pdbqt 210,09 0,18849 42,16 -2,745 245,325 2,3443 4 0 0 6,2448 0,539819231430724
92135913 PO4530PU2A mol2, pdbqt 324,74 0,20216 81,67 -1,599 358,545 1,0193 6 3 0 -13,625 0,44969977768179
92135915 78MY6551EU mol2, pdbqt 213,63 0,1313 32,34 -1,764 228,378 2,5352 3 1 0 -16,188 0,46260489058555
92135917 18BZ96H4K3 mol2, pdbqt 413,47 0,11145 52,6 -7,274 520,751 8,031 4 0 2 -13,139 3,70042661361733E-02
92135919 5DY91Y7601 mol2, pdbqt 1040,3 0,51956 721,6 -1,519 1440,58 -10,877 40 22 3 5,6719 0,491697126666889
92135932 12T09LV21O mol2, pdbqt 435,9 0,227 120,16 -3,512 562,716 2,54 11 2 2 3,0165 0,129553313864402
These data are only available for scientific research purposes.