• UNII FDA
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Records 52241 to 52260 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
76971091 V44KH870YH mol2, pdbqt 191,59 0,14667 32,67 -4,096 279,126 2,4152 3 0 0 2,1668 0,290918763880028
76971113 J5SP65N1HL mol2, pdbqt 211,59 0,24935 69,78 -3,32 267,392 2,2469 3 1 0 0,23376 0,676262678730865
76971117 GAP082Q6UF mol2, pdbqt 101,76 0,79442 120,72 0,324 148,07 -6,8622 6 2 0 -0,34366 0,700646712078529
76971122 9OF9A68GVK mol2, pdbqt 270,14 0,31395 101,16 -4,238 361,393 2,1262 7 3 0 2,0902 0,341650783757691
76971123 6V78047753 mol2, pdbqt 270,14 0,31395 101,16 -4,238 361,393 2,1262 7 3 0 2,0902 0,341650783757691
76971131 68V98AVZ4Y mol2, pdbqt 186,58 0,36161 87,66 -3,992 249,289 2,5912 4 1 0 1,5299 0,73885502904685
76971132 268321GWWU mol2, pdbqt 186,58 0,36161 87,66 -3,992 249,289 2,5912 4 1 0 1,5299 0,73885502904685
76971159 Y5K0W7P26N mol2, pdbqt 294,11 0,12288 46,53 -6,13 390,521 5,9967 3 1 1 0,31499 0,2228676837231
76971169 MO8EO075MI mol2, pdbqt 284,3 0,093528 29,54 -3,353 339,477 4,2826 3 0 0 5,3569 0,717951106960563
76971184 QFK6AN3PUE mol2, pdbqt 279,91 0,23157 72,17 -4,042 451,11 4,1324 6 1 0 -0,49301 0,415702266534099
76971191 A03Q1432ZC mol2, pdbqt 341,39 0,088286 32,78 -4,596 429,002 5,3098 4 0 1 6,419 0,483654593981015
76971192 93JQ2WEJ6M mol2, pdbqt 341,39 0,088286 32,78 -4,596 429,002 5,3098 4 0 1 6,419 0,483654593981015
76971202 Z6D3IEM9Q2 mol2, pdbqt 426,19 0,21195 116,17 -3,665 486,691 3,6785 8 3 0 -21,49 0,185131231498379
76971216 WKN6D744OP mol2, pdbqt 130,08 0,70357 132,13 0,071 192,123 -2,1297 7 4 0 3,5617 0,582485462367696
76971242 M575VKV19N mol2, pdbqt 153,31 0,27428 64,4 -3,193 275,088 0,6622 3 2 0 0,81668 0,757346090802133
76971272 8TRC43A870 mol2, pdbqt 252,88 0,067621 15,71 -2,878 310,867 3,4849 3 0 0 2,6201 0,475829792785555
76971273 596D3EGM6M mol2, pdbqt 200,84 0,2254 53,71 -2,42 239,314 1,6502 4 1 0 -2,1287 0,308180826537374
76971274 C324J3XG8S mol2, pdbqt 158,13 0,73117 166,72 1,831 260,134 -5,8646 9 6 1 -22,924 0,48642484273903
76971303 Z82YP691V7 mol2, pdbqt 335,69 0,40028 145,06 -3,647 462,453 0,6089 11 4 1 1,3088 0,641877604509264
76971311 L3PZV0QTF5 mol2, pdbqt 231,11 0,12137 32,34 -3,373 274,406 3,2567 3 1 0 3,4549 0,486224039836754
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 of 2794
Records 52241 to 52260 of 55865
These data are only available for scientific research purposes.