• UNII FDA
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 of 2794
Records 48761 to 48780 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
71416843 YGQ120RH3I mol2, pdbqt 298,64 0,28824 89,52 -1,014 350,406 0,6318 8 0 0 -16,574 0,164619043475952
71417597 90AX5T9G36 mol2, pdbqt 376,15 0,45881 237,13 -1,271 467,573 -3,9589 13 8 2 -2,0394 0,439709853231655
71420565 84246P91I5 mol2, pdbqt 391,1 0,025569 9,23 -12,252 494,825 10,622 1 0 1 -79,005 0,045661790981314
71422850 WMV46KRG5J mol2, pdbqt 168,1 0,28316 58,56 -1,885 209,244 0,5014 4 2 0 2,5747 0,740009626736112
71422851 FJ267O4DJ1 mol2, pdbqt 168,1 0,28316 58,56 -1,885 209,244 0,5014 4 2 0 2,5747 0,740009626736112
71423166 O37300B3AP mol2, pdbqt 159,44 0,42405 103,78 1,18 209,008 -1,8258 5 4 0 -21,995 0,491838448801302
71433786 E9V8K0B0F0 mol2, pdbqt 489,61 0,21409 109,61 -6,172 613,752 5,0332 9 3 2 -0,070427 0,205654500435238
71433959 1D91H0NG3B mol2, pdbqt 435,69 0,17102 102,01 -11,935 1120,74 3,5189 6 3 1 -10,339 0,113601154983096
71434435 L4E3LO73B0 mol2, pdbqt 176,45 0,29459 60,36 -4,133 254,717 1,956 2 0 0 -16,397 0,124699877009885
71436367 UE8I077QZ1 mol2, pdbqt 737,62 0,11385 108,8 -13,818 857,405 18,773 4 2 2 -14,297 6,33554098218767E-02
71436822 KLQ64O4153 mol2, pdbqt 229,91 0,3444 91,29 -2,49 322,312 0,7944 7 1 0 -2,3816 0,14129891275387
71437500 L62PI92L73 mol2, pdbqt 117,84 0,41735 63,6 -1,006 156,137 -0,4696 4 1 0 0,51116 0,637694323993048
71438214 7HQZ604M8H mol2, pdbqt 148,75 0,20524 42,37 -1,607 172,291 2,4354 1 0 0 -2,4878 0,505778774328569
71438864 ZH57S5A267 mol2, pdbqt 249,36 0,23464 68,29 -5,002 320,347 3,8308 5 1 0 -14,381 0,313304218489649
71438887 738M7FJV26 mol2, pdbqt 178,07 0,42332 104,06 -0,998 244,242 -1,1733 6 3 0 -1,4316 0,346409195971217
71440701 69AG10PKT8 mol2, pdbqt 210,73 0,36051 104,81 -2,057 268,312 -1,3622 6 4 0 6,8404 0,567105663811868
71440863 1MJT82A62R mol2, pdbqt 125,69 0,73236 129,72 0,352 176,128 -5,1837 7 4 0 -9,2245 0,395076650371984
71442452 4KDJ27EOJE mol2, pdbqt 237,08 0,15269 49,69 -3,077 260,416 3,8395 3 2 0 -26,981 0,192609009968051
71442569 6DUZ894D3D mol2, pdbqt 187,8 0,48131 119,33 -1,231 284,267 -1,7849 8 4 0 2,7719 0,925579650596381
71443120 JFG6R45N6D mol2, pdbqt 81,78 0,18672 26,02 -1,692 93,1286 0,9823 1 1 0 -1,9084 0,070975060991368
Page 
 of 2794
Records 48761 to 48780 of 55865
These data are only available for scientific research purposes.