• UNII FDA
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Records 52981 to 53000 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
90470058 3X85950A89 mol2, pdbqt 337,89 0,10714 49,69 -5,778 408,664 7,2288 3 2 1 -13,728 9,46403995254846E-02
90470261 6044P09Y9J mol2, pdbqt 223,24 0,32378 93,06 -1,998 284,307 0,9216 6 2 0 -3,695 0,47851043643399
90470745 84M8SHQ8LY mol2, pdbqt 292,48 0,20213 69,67 -3,589 380,439 3,3039 5 0 0 -3,8119 0,230491943138828
90471646 MPJ2Q8WI8G mol2, pdbqt 703,65 0,40509 430,9 -1,165 941,107 -2,4176 22 20 3 -18,322 0,14911147997187
90472176 N9NMT97JQN mol2, pdbqt 196,65 0 0 -4,035 232,409 4,9984 0 0 0 -5,4051 0,19110744067743
90472959 6D04Y0152T mol2, pdbqt 208,72 0,17559 41,93 -2,483 301,385 1,3553 4 1 0 4,0197 0,721797004270339
90473015 R3M4L88DXV mol2, pdbqt 333,37 0,18799 72,91 -4,311 433,502 3,4315 6 0 0 0,86466 0,197155905515156
90473042 7PR7IKZ4SR mol2, pdbqt 155,05 0,26882 62,75 -2,172 222,263 0,9686 3 1 0 -4,0678 0,481470083268098
90473201 832Q0VW947 mol2, pdbqt 330,63 0,30669 135,04 -3,769 460,521 1,2183 8 2 0 -1,9433 0,143574402872706
90473203 72E8VPX14H mol2, pdbqt 105,19 0,28225 40,54 0,683 118,155 -1,9936 3 1 0 -2,6524 0,529079691278082
90473209 JC5Y4Y2O5V mol2, pdbqt 264,02 0,33725 112,75 -3,124 339,415 2,2461 7 3 0 2,3847 0,332726106701587
90473259 44GZC163QZ mol2, pdbqt 154,79 0,084631 20,23 -4,142 204,655 3,5791 1 1 0 -1,9236 0,42705544191811
90473341 593H15QHNY mol2, pdbqt 291,5 0,17955 77,76 -4,879 392,578 4,0315 4 3 0 0,23822 0,165193566322182
90473403 6V96R5G8MM mol2, pdbqt 153,59 0,17019 37,3 -2,416 172,267 3,2114 2 1 0 -17,514 0,44359895690876
90473619 07YBE5FZ9M mol2, pdbqt 202,34 0,11387 26,3 -3,976 264,407 3,8203 2 0 0 -3,9769 0,379077308163071
90474308 4T60YRT2TG mol2, pdbqt 362,22 0,2546 108,36 -3,92 486,559 2,8885 8 1 0 -4,396 0,193181972446705
90474583 VA588FVM6S mol2, pdbqt 173,13 0,35973 83,83 -2,105 226,227 1,0537 5 2 0 -8,7438 0,47365910232414
90474726 237B2EJX0J mol2, pdbqt 145,35 0,15556 38,8 -3,369 160,324 3,9741 0 0 0 -20,619 0,237108351154641
90474765 0340J5BCGY mol2, pdbqt 111,83 0,37029 63,32 -1,411 143,185 -1,903 3 2 0 -10,932 0,293808259157493
90475575 U7190A9Q1L mol2, pdbqt 372,63 0,12334 50,36 -5,239 410,684 6,8369 4 2 1 -6,2854 0,179023589630337
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Records 52981 to 53000 of 55865
These data are only available for scientific research purposes.