• UNII FDA
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Records 50421 to 50440 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
72941618 2XK617Q62V mol2, pdbqt 282,01 0,17265 50,3 -4,678 380,53 1,8994 3 0 0 3,7641 0,690572231573159
72941619 80I503HFPJ mol2, pdbqt 207,23 0,49274 142,11 -1,258 300,31 -2,5395 8 5 0 1,3335 0,84816907138901
72941620 61HNS4NTK7 mol2, pdbqt 235,54 0,042456 9,23 -8,329 376,881 6,6912 1 0 1 -2,0981 1,94890453000377E-02
72941621 DUA4F30QF8 mol2, pdbqt 154,47 0,27818 42,85 -1,845 204,228 0,5979 4 1 0 3,1366 0,940042676795103
72941622 6X3Z572A6Z mol2, pdbqt 340,13 0,2634 119,8 -4,442 384,563 3,667 7 3 0 -20,087 0,329662601478981
72941623 M165J40MMT mol2, pdbqt 600,37 0,038376 26,3 -10,691 617,095 17,298 2 0 2 -33,967 7,50646880076203E-02
72941624 1AFC80AP6F mol2, pdbqt 228,06 0,14549 40,62 -3,272 314,771 2,5411 4 0 0 1,6215 0,775064791837893
72941626 229AJM856B mol2, pdbqt 150,87 0,43866 91,85 -0,671 207,249 -1,2306 5 2 0 -17,839 0,150244716862902
72941627 2U7EB0P3O8 mol2, pdbqt 164,45 0,41271 87,79 -1,673 220,231 -0,2618 6 2 0 8,414 0,963534706975715
72941628 52T7SJ3G23 mol2, pdbqt 303,36 0,21183 91,52 -5,266 434,579 2,5055 6 0 0 4,4905 0,124930815676234
72941629 2AY78S427U mol2, pdbqt 719,83 0,36204 342,44 -5,088 931,105 -2,9719 21 11 3 -6,4188 0,186063067364245
72941630 YX8L2UX7SG mol2, pdbqt 138,18 0,051382 6,48 0,23 144,261 0,473 2 0 0 2,325 0,941280375884843
72941631 NH1YSJ4P7E mol2, pdbqt 1007,1 0,045757 52,6 -17,681 1053,86 29 4 0 2 -31,821 6,25812638841306E-02
72941632 YYG0UZI3A0 mol2, pdbqt 728,69 0,19396 168,8 -9,292 837,14 12,605 12 1 3 -29,199 6,44646888146307E-02
72941633 Y84I4RE3W0 mol2, pdbqt 185,52 0,16958 30,49 -2,521 231,294 1,5749 3 1 0 0,022277 0,558915129743793
72941634 LOS6YV3B9N mol2, pdbqt 613,81 0,2149 158,13 -5,847 786,012 5,8771 12 2 3 -0,62519 0,14620952233238
72941635 MM86H25K82 mol2, pdbqt 273,76 0,4851 175,09 -1,939 416,413 0,5701 10 3 0 10,635 0,50487828717947
72941636 3O886C86WZ mol2, pdbqt 272,68 0,33171 114,04 -2,979 373,412 0,7698 9 2 0 5,3268 0,848743990038566
72941637 0WF0NM23D2 mol2, pdbqt 271,97 0,33614 109,49 -2,98 373,412 -0,3506 9 2 0 6,9527 0,854467106726992
72941638 TQH4QXO4CV mol2, pdbqt 147,85 0,088197 17,07 -2,535 154,252 3,2038 1 0 0 -14,962 0,265657223231982
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 of 2794
Records 50421 to 50440 of 55865
These data are only available for scientific research purposes.