• UNII FDA
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 of 2794
Records 47261 to 47280 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
55212072 S2HYZ042S6 mol2, pdbqt 73,6 0,33288 29,1 -1,134 137,964 0,1206 2 1 0 -0,62274 0,660881065968266
55232737 23HOW335J0 mol2, pdbqt 196,19 0,23146 58,8 -1,597 249,313 0,7474 5 1 0 5,844 0,365811438722983
55250389 S2Q5GUH10H mol2, pdbqt 139,49 0,17564 29,1 -2,163 163,219 0,9171 2 1 0 2,5527 0,737123278217455
55252930 8F5RT94SS9 mol2, pdbqt 122,81 0,13558 23,47 0,29 136,189 -1,4633 2 1 0 2,9567 0,965988013044079
55253543 W98BOE73HH mol2, pdbqt 144,47 0,20253 41,81 -2,591 174,246 1,4933 2 2 0 -0,55811 0,638007494276632
55281424 944FJ0V9UD mol2, pdbqt 116,87 0,4659 80,39 -0,634 141,126 -0,66 4 2 0 -0,031821 0,735135836487582
55282112 Y0KR1217G0 mol2, pdbqt 93,96 0,6026 86,18 -0,683 136,538 -1,7353 4 2 0 -1,685 0,3422726757365
55287535 FGB5PQG5JU mol2, pdbqt 119,33 0,42437 66,4 -0,538 143,141 -0,5588 4 2 0 2,9991 0,962236184533142
55290147 982SQ392CR mol2, pdbqt 82,82 0,36875 52,04 -0,77 88,1533 -0,8581 2 2 0 -1,6875 0,571058174255919
55292123 5Y9S67DIZB mol2, pdbqt 130,64 0,2167 43,09 -1,883 167,182 0,4534 2 1 0 -5,9225 0,290228230741019
55292415 G41452WN2H mol2, pdbqt 130,64 0,2167 43,09 -1,883 167,182 0,4534 2 1 0 -5,9225 0,290228230741019
55295310 J1TNP083FF mol2, pdbqt 125,39 0,22625 46,25 -1,518 151,208 0,3838 2 2 0 -3,8375 0,496719105431948
55295881 6YRT6Z8A8J mol2, pdbqt 159,78 0,19608 41,13 -2,559 183,318 3,3588 1 0 0 -0,4328 0,607827109415121
55296073 8JH55RFD78 mol2, pdbqt 147,52 0,21238 41,13 -2,413 169,291 3,0385 1 0 0 -8,1774 0,448683889586723
55298644 S3A1Q21H4K mol2, pdbqt 116,62 0,22415 37,3 -1,353 126,154 1,4685 2 1 0 -2,81 0,40912092912911
55300885 4XYZ60V8IP mol2, pdbqt 105,52 0,32752 41,49 -1,015 131,174 -0,1365 3 2 0 0,45055 0,474599679174916
56591871 1NE31CW68S mol2, pdbqt 395,78 0,2084 88,93 -1,194 499,654 2,1622 9 1 0 -1,829 0,410846893984185
56593985 G401M43GWQ mol2, pdbqt 499,56 0,19529 100,79 -7,035 691,618 4,6968 12 0 2 5,6689 8,61390057167634E-02
56594927 1494Q15E7Z mol2, pdbqt 599,23 0,31462 226,62 -8,299 869,832 5,8096 15 4 3 -31,044 0,085648143468628
56597779 7ZJP3FVN4I mol2, pdbqt 152,08 0,1515 26,3 -3,3 178,23 2,8064 2 0 0 -2,1817 0,382164471414248
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 of 2794
Records 47261 to 47280 of 55865
These data are only available for scientific research purposes.