• UNII FDA
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 of 2794
Records 48221 to 48240 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
67979346 X8SPJ492VF mol2, pdbqt 324,44 0,18265 72,86 -5,403 412,535 3,451 5 1 0 -4,4123 0,281381024425361
67998300 U55XHZ5X6P mol2, pdbqt 228,98 0,3399 104,03 -4,276 326,399 0,9384 6 4 0 1,8516 0,730552872280393
68026984 843G0TDV51 mol2, pdbqt 259,35 0,19009 69,92 -4,091 348,397 4,2224 4 3 0 -1,3949 0,241371627563039
68088610 0SUF2IX83T mol2, pdbqt 316,26 0,33457 138,46 -3,201 446,479 1,0692 9 2 0 -1,2491 0,465590230609401
68107965 Q641JSF42X mol2, pdbqt 309,38 0,18243 64,11 -5,804 399,424 4,2648 5 1 0 -0,9221 0,311740222601638
68109743 8RAL5N48VT mol2, pdbqt 312,85 0,29372 111,56 -5,193 436,919 2,8842 8 1 0 5,533 0,345661091203671
68120176 Q45149O98I mol2, pdbqt 298,66 0,12121 49,69 -5,709 374,563 6,8453 3 2 1 -17,83 0,171748362642874
68122919 BE608TNS5G mol2, pdbqt 411,09 0,23158 113,04 -5,29 560,657 4,1054 8 0 1 3,7914 0,240081914362997
68130054 IBD92T6H85 mol2, pdbqt 284,28 0,27276 83,09 -4,073 359,377 3,1639 7 1 0 -12,634 0,368421845623177
68146615 F14MZU489K mol2, pdbqt 188,43 0,25166 53,16 -2,412 221,303 0,2391 4 3 0 3,8585 0,20191992971849
68159338 9CVW3JO4MC mol2, pdbqt 136,94 0,39806 83,55 -1,71 179,174 -1,1631 4 3 0 -3,0994 0,303798350345876
68165256 HYW8DB273J mol2, pdbqt 437,93 0,18845 95,67 -6,199 584,103 4,4493 9 2 1 -1,851 4,17145905545991E-02
68169234 150GCO461X mol2, pdbqt 166,22 0,34665 61,42 -1,84 212,216 -0,2502 6 0 0 2,84 0,935557030304644
68178377 48W5FXB9PY mol2, pdbqt 315,65 0,18749 72,83 -4,476 402,529 3,8688 5 1 0 -1,1011 0,393655625467973
68178378 5533E53W0Y mol2, pdbqt 321,92 0,22453 93,06 -4,123 420,544 3,0716 6 2 0 2,5983 0,664013602293426
68185467 447591A1PU mol2, pdbqt 325,58 0,31943 125,41 -5,611 526,398 3,3253 8 2 1 0,12446 0,338743639707594
68210102 W4OGW9QZ97 mol2, pdbqt 412,75 0,1983 91,29 -5,049 526,683 3,9615 8 3 1 6,6055 0,459004989036132
68212798 T7755XP5Y6 mol2, pdbqt 381,41 0,27915 130,85 -4,297 514,649 2,8748 10 2 1 2,2716 0,548240408775645
68234908 55G92WGH3X mol2, pdbqt 408,09 0,1396 58,87 -8,76 557,014 7,5994 6 1 2 6,5232 0,182390134041843
68237813 R50K9CUX7Z mol2, pdbqt 524,03 0,32262 215,22 -4,709 749,807 1,2596 14 5 2 0,84311 0,345743412100849
Page 
 of 2794
Records 48221 to 48240 of 55865
These data are only available for scientific research purposes.