• UNII FDA
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Records 821 to 840 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
3116 T940307O7B mol2, pdbqt 343,54 0,1948 68,94 -1,898 416,52 3,2004 8 0 0 -4,4073 0,318581992981614
3117 TR3MLJ1UAI mol2, pdbqt 238,58 0,4111 121,26 -3,266 296,547 3,343 2 0 0 0,97088 0,091320227822589
3118 3CY5EKL6MT mol2, pdbqt 212,79 0,40867 110,96 -3,466 274,409 3,5135 2 0 0 -14,228 5,19292894300989E-02
3119 VFS4ZUK33P mol2, pdbqt 550,82 0,12494 66,38 -7,772 718,943 7,4708 8 2 2 6,0534 0,15210940013126
3120 9I3SDS92WY mol2, pdbqt 168,13 0,16684 32,34 -3,247 233,097 2,5708 3 1 0 -0,37571 0,132416468148928
3121 614OI1Z5WI mol2, pdbqt 129,66 0,2016 37,3 -1,969 144,213 2,1912 2 1 0 -2,6221 0,301951415594718
3122 P34K80CUSM mol2, pdbqt 163,89 0,51638 130,66 -0,331 225,18 -5,0291 6 4 0 -32,462 0,488795683177409
3124 C9AO82G1R1 mol2, pdbqt 131,56 0,564 91,54 -2,822 181,198 -1,3882 6 4 0 4,1286 0,930777805154199
3125 X88TTO174Z mol2, pdbqt 148,66 0,36668 83,55 -1,354 195,217 -1,5143 4 3 0 -3,6955 0,299326221735718
3128 540OPI9I4Z mol2, pdbqt 150,92 0,075934 12,03 -2,718 183,681 2,4114 1 1 0 3,0298 0,889276903695087
3132 B79L7B5X3Z mol2, pdbqt 196,21 0,37332 105,2 -2,448 253,321 0,832 4 2 0 -6,3498 0,467287346598588
3134 649SA4S2CV mol2, pdbqt 128,53 0,39252 57,7 -2,229 163,183 0,2267 5 1 0 1,3031 0,147879678714045
3149 4AZL56CU0F mol2, pdbqt 315,97 0,042884 12,47 -3,792 334,566 5,2517 2 0 1 -12,51 0,179288711985732
3151 5587267Z69 mol2, pdbqt 306,08 0,19488 67,92 -5,877 425,919 3,2161 7 2 0 8,5287 0,512877889326604
3152 8SSC91326P mol2, pdbqt 299,91 0,122 38,77 -4,347 379,498 4,2149 4 0 0 5,6409 0,631295559532766
3153 ZTM7UYI7VX mol2, pdbqt 134,76 0,30773 66,48 -1,793 179,218 0,8751 3 3 0 -2,4102 0,520962999627241
3156 94F3830Q73 mol2, pdbqt 299,62 0,10059 32,78 -2,03 378,514 3,2136 4 0 0 5,9517 0,655233657802509
3157 NW1291F1W8 mol2, pdbqt 330,83 0,29426 112,27 -4,1 451,481 2,1379 10 1 0 7,1196 0,682909699930097
3162 95QB77JKPL mol2, pdbqt 226,79 0,10812 25,36 -1,64 270,375 1,8821 3 0 0 4,9909 0,93046680731635
3166 4QWV355536 mol2, pdbqt 271,17 0,098057 29,54 -3,439 317,471 3,8547 3 0 0 5,4388 0,456595143076839
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 of 2794
Records 821 to 840 of 55865
These data are only available for scientific research purposes.