• UNII FDA
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 of 2794
Records 49021 to 49040 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
71586918 BX3848OLVZ mol2, pdbqt 240,44 0,11674 28,6 -2,146 285,39 1,9544 4 0 0 4,9657 0,548324762184232
71586919 C67VEP630W mol2, pdbqt 61,35 0,63863 54,37 0,252 84,4579 -2,3424 3 1 0 -2,5375 0,153575891873727
71586923 B7GL20SC7W mol2, pdbqt 10 1 9,23 -0,53 18,0149 0 1 1 0 -1 0,135605826048597
71586925 L4R7J9QTKI mol2, pdbqt 88,36 1 117,97 0,578 218,001 1,3268 7 2 0 -2,5375 0,520316864578313
71586927 CXZ70G71TW mol2, pdbqt 68,71 0,5711 57,53 -0,33 90,0776 -0,8665 3 2 0 -2,02 0,553167729283894
71586929 6QT214X4XU mol2, pdbqt 137,37 0,35801 63,6 -1,929 180,159 1,1314 4 1 0 -1,6343 0,120307897384524
71586930 FR42YK1I2F mol2, pdbqt 340,03 0,36611 167,13 -2,426 482,559 -1,275 9 4 0 9,4242 0,747848227752623
71586933 AH2W0VV8AX mol2, pdbqt 56,32 1 87,57 1,958 97,9938 -5,0393 4 3 0 -8,3432 0,179236265133173
71586934 14LW216L8O mol2, pdbqt 10 1 9,23 -0,53 18,0149 0 1 1 0 -1 0,135605826048597
71586935 E3I220KCKJ mol2, pdbqt 96,44 1 143,91 3,034 177,973 -7,497 7 4 0 -15,717 0,494782420202021
71586937 EGW0N9ZC85 mol2, pdbqt 326,25 0,010881 3,24 -4,234 324,614 6,7072 1 0 1 -18,089 0,137665995678266
71586938 V98ORR8KV5 mol2, pdbqt 433,27 0,32181 186,06 -5,453 562,621 3,0863 11 4 2 0,6819 0,214157735915691
71586939 3IU44Z17D7 mol2, pdbqt 337,86 0,26171 121,13 -3,911 478,555 2,0148 7 3 0 -2,8862 0,280938634737388
71586940 ZP5C14RDAO mol2, pdbqt 338,79 0,18643 82,64 -3,826 390,499 5,3213 5 1 1 -63,519 0,279998804893192
71586941 9R6Z7M2000 mol2, pdbqt 238,32 0,10465 24,3 -2,159 304,824 1,9545 4 0 0 9,9578 0,908654116260342
71586942 B3LI1S3ZJV mol2, pdbqt 391 0,47069 256,29 -2,155 594,52 -2,0673 15 10 3 -3,2535 0,313418531866015
71586943 4PVB1EA20Q mol2, pdbqt 602,31 0,27406 199,98 -4,357 785,965 2,5739 15 4 2 1,384 0,221080170618868
71586945 KSG13J9T4L mol2, pdbqt 522,96 0,49648 330,79 -3,63 713,659 -3,3762 21 9 3 -16,472 0,240708383911516
71586946 HPN8MZW13M mol2, pdbqt 10 1 9,23 -0,53 18,0149 0 1 1 0 -1 0,135605826048597
71586947 V20H6W39QI mol2, pdbqt 52,4 1 80,92 4,55 96,1138 0 4 4 0 -2,5375 0,532736451627414
Page 
 of 2794
Records 49021 to 49040 of 55865
These data are only available for scientific research purposes.