• UNII FDA
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Records 53561 to 53580 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
91617908 4HWQ88O5UA mol2, pdbqt 403,17 0,057147 26,3 -7,943 504,796 9,5001 2 0 2 -8,8242 9,85855216052703E-02
91617910 X3J1G4M20S mol2, pdbqt 545,68 0,28075 224,08 -2,205 765,903 -0,7781 12 4 2 -11,688 4,35468041392576E-02
91617917 836A2PAK5H mol2, pdbqt 744,28 0,37142 374,13 -4,928 1105,27 -1,2841 23 14 3 -4,6323 0,19153359498181
91617918 NB80O9O5B7 mol2, pdbqt 272,82 0,2285 86,99 -4,082 392,534 2,2035 5 3 0 -0,017513 0,555450325541598
91617922 4N19ON48ZN mol2, pdbqt 216,53 0,27026 90,35 -3,307 315,415 0,3497 5 2 0 -2,4644 0,470597024379113
91617932 SS0BBT2OLA mol2, pdbqt 91,38 0,66612 79,87 0,188 138,059 -2,8214 4 2 0 -11,514 0,49531975030366
91617935 GPL09GLO9X mol2, pdbqt 340,87 0,24121 99,13 -4,378 508,556 2,1058 7 1 1 1,3192 0,529975547449663
91617936 Z6P87Q3S82 mol2, pdbqt 346,3 0,32183 156,9 -3,413 450,969 -0,2679 9 4 0 4,2096 0,214368155416233
91617937 1C9358G40M mol2, pdbqt 78,6 0 0 -0,53 142,074 0 0 0 0 -1 0,37472408311985
91617938 17O7D4040O mol2, pdbqt 47,55 0 0 -1,165 115,357 0 0 0 0 -1 0,622596975130205
91617940 371986TW0N mol2, pdbqt 409,45 0,15306 72,91 -5,755 539,754 5,8301 6 0 2 4,3123 0,295442663089224
91617941 H92K6Q47Q9 mol2, pdbqt 766,11 0,37894 382,82 -6,34 1019,26 -1,1103 20 13 3 -2,2022 0,16610686511802
91617945 O4S01C64Y5 mol2, pdbqt 230,21 0,4144 121,67 -5,216 309,332 1,6302 8 2 0 2,3363 0,648428257594197
91617946 EGM8884LLE mol2, pdbqt 373,38 0,17698 71,06 -6,167 514,7 5,0768 6 0 2 -2,6438 0,142250183965335
91617947 0416TL8388 mol2, pdbqt 296,73 0,42399 173,21 -3,436 433,388 0,7659 10 7 1 -4,6793 0,386668866881513
91617950 HST809JCP3 mol2, pdbqt 329,16 0,24508 90,37 -3,077 448,525 0,4217 9 1 0 2,7382 0,744985796403675
91617951 3V3X0IX41I mol2, pdbqt 276,88 0,28344 115,06 -5,973 388,374 4,1431 6 4 0 -1,9035 0,131751403986444
91617952 7AQE53A8HS mol2, pdbqt 10 1 9,23 -0,53 18,0149 0 1 1 0 -1 0,135605826048597
91617960 UGR874142R mol2, pdbqt 54,78 1 82,98 1,524 98,0779 -3,4103 4 2 0 -2,0209 7,20337002000834E-02
91617966 R5U9EZY06G mol2, pdbqt 532,81 0,2768 184,8 -2,859 690,856 2,325 13 2 2 5,8388 0,299913414958365
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Records 53561 to 53580 of 55865
These data are only available for scientific research purposes.