• UNII FDA
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 of 2794
Records 52221 to 52240 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
76970798 F9JTI39APT mol2, pdbqt 287,07 0,091058 37,3 -5,87 368,559 6,7446 2 1 1 -8,2804 0,1020669841896
76970819 5RZZ0Z1GJT mol2, pdbqt 430,79 0,241 121,11 -3,849 552,721 2,094 11 3 2 5,5882 0,221221376352978
76970846 E2D29764DY mol2, pdbqt 401,85 0,098619 46,61 -6,828 546,519 7,6351 4 0 2 -21,05 0,103546203114787
76970877 4856TKA3LY mol2, pdbqt 282,77 0,1735 61,36 -3,909 352,476 2,8698 4 3 0 5,7456 0,459845667488
76970878 0Z81U1B19O mol2, pdbqt 282,77 0,1735 61,36 -3,909 352,476 2,8698 4 3 0 5,7456 0,459845667488
76970882 N79W32A66Q mol2, pdbqt 151,96 0,23783 46,53 -2,881 221,039 1,9316 3 1 0 -1,03 7,44508413239783E-02
76970888 NNV80I68DM mol2, pdbqt 300,11 0,40409 175,83 -1,237 459,45 -1,0368 10 6 1 3,3577 0,471638868309506
76970904 P967G05657 mol2, pdbqt 203,33 0,13795 32,34 -2,329 234,342 2,2831 3 1 0 5,42 0,73364439422215
76970905 U4VT538P4V mol2, pdbqt 203,33 0,13795 32,34 -2,329 234,342 2,2831 3 1 0 5,42 0,73364439422215
76970913 AQ36775D27 mol2, pdbqt 1307,9 0,43304 737,07 -11,19 1954,26 -6,9198 47 26 3 -0,69529 6,01010749499352E-02
76970915 M0V9VB0B7E mol2, pdbqt 307,4 0,11968 47,02 -4,774 415,551 3,3503 5 1 0 -2,1964 0,20466879982508
76970961 D9QT7K3188 mol2, pdbqt 149,06 0,43459 92,21 -0,288 218,228 -0,6415 5 2 0 -3,3978 0,504540212618273
76970979 T7Y820X70C mol2, pdbqt 59,88 0,69155 63,32 -0,028 75,0667 -3,3504 3 2 0 -1,6721 0,345157131760071
76970981 O70J1GE4YB mol2, pdbqt 301,44 0,31572 113,48 -2,411 433,527 2,1843 8 1 0 9,8381 0,792192095124012
76971004 46CO4UPI6L mol2, pdbqt 241,29 0,23872 67,79 -3,175 305,373 1,7834 5 2 0 6,0748 0,31369972072427
76971006 C09TUL72DF mol2, pdbqt 241,29 0,23872 67,79 -3,175 305,373 1,7834 5 2 0 6,0748 0,31369972072427
76971023 1FRO6431IR mol2, pdbqt 277,49 0,40899 148,79 -0,318 365,401 -2,7299 10 5 0 -7,5366 0,45657190687232
76971050 F7KUL1KEYI mol2, pdbqt 56,32 1 87,57 1,958 97,9938 -5,0393 4 3 0 -8,3432 0,179236265133173
76971052 8IOX5K751D mol2, pdbqt 341,39 0,088286 32,78 -4,596 429,002 5,3098 4 0 1 6,419 0,483654593981015
76971053 8XV28P533A mol2, pdbqt 341,39 0,088286 32,78 -4,596 429,002 5,3098 4 0 1 6,419 0,483654593981015
Page 
 of 2794
Records 52221 to 52240 of 55865
These data are only available for scientific research purposes.