• UNII FDA
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Records 53061 to 53080 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
90478543 KTH80B73TG mol2, pdbqt 124,54 0,34358 60,77 0,318 160,192 -2,2241 4 2 0 3,7716 0,977765024805154
90478544 D3X27H19O1 mol2, pdbqt 52,28 1 74,6 0,642 144,972 -3,6332 4 2 0 -5,8375 0,298223686565396
90478545 264NHM5029 mol2, pdbqt 226,17 0 0 -7,872 548,692 6,9448 0 0 2 -3,9741 2,95087051992215E-02
90478546 247041VJ40 mol2, pdbqt 244,8 0 0 -8,706 627,588 7,67 0 0 2 -3,9741 4,90462033146282E-02
90478547 C6V9EU8UWS mol2, pdbqt 226,17 0 0 -7,872 548,692 6,9448 0 0 2 -3,9741 3,93449402656287E-02
90478548 39014AKA3O mol2, pdbqt 226,17 0 0 -7,872 548,692 6,9448 0 0 2 -3,9741 3,93449402656287E-02
90478549 7N8MMW23AL mol2, pdbqt 133,11 0,68845 138,45 0,564 196,154 -3,4954 7 6 1 2,049 0,929062536144093
90478560 X45P3WDJ1R mol2, pdbqt 263,43 0 0 -9,54 706,484 8,3952 0 0 2 -3,9741 2,74769734207401E-02
90478568 T8FDZ9V6PR mol2, pdbqt 268,88 0,32583 113,55 -3,929 401,364 1,8594 7 2 0 -8,4806 0,377169533937015
90478570 1V5N49QUH2 mol2, pdbqt 210,16 0,30386 92,95 -1,863 287,314 2,0188 5 5 0 1,2519 0,818620562656335
90478571 1X22T0CMC5 mol2, pdbqt 942,69 0,26104 284,38 -7,252 1226,46 5,7137 22 6 4 2,4317 0,174587148976224
90478576 5M531I923W mol2, pdbqt 226,17 0,34806 99,59 -3,126 389,05 1,5084 6 4 0 -2,2394 0,451440458383842
90478578 C7P1SCF11U mol2, pdbqt 262,54 0,68553 275,84 1,918 436,123 -17,124 14 8 2 -21,614 0,420484134544035
90478579 FVI93ET7ZH mol2, pdbqt 323,79 0,33679 141,31 -1,026 499,599 -1,8687 10 5 0 4,6283 0,739694152531868
90478580 QFS1PEH62Q mol2, pdbqt 146,49 0,52536 113,18 0,554 195,214 -3,1921 6 6 1 3,6685 0,973126312267861
90478581 950XPW1NO8 mol2, pdbqt 266,39 0,21243 57,23 -5,088 367,4 3,4345 6 0 0 5,1987 0,616316121002457
90478582 YJO0ZG7U5Q mol2, pdbqt 158,41 0,44012 106,41 -2,068 208,216 -2,6604 5 3 0 -12,407 0,480107429595979
90478590 4D99DC90FC mol2, pdbqt 226,17 0 0 -7,872 548,692 6,9448 0 0 2 -3,9741 8,19686255533931E-02
90478598 7IQR2S803B mol2, pdbqt 375,66 0,14644 52,19 -4,066 480,647 4,9095 6 1 0 3,8313 0,18141542095977
90478599 H58L525C36 mol2, pdbqt 234,11 0,12007 35,5 -3,127 313,463 0,9433 3 2 0 6,4555 0,880187310614294
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Records 53061 to 53080 of 55865
These data are only available for scientific research purposes.