• UNII FDA
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Records 61 to 80 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
240 TA269SD04T mol2, pdbqt 92,8 0,14052 17,07 -1,94 106,124 1,5929 1 0 0 -4,225 0,104923117051638
241 J64922108F mol2, pdbqt 73,26 0 0 -1,616 78,1136 1,6596 0 0 0 -2,3575 6,78501999566976E-02
243 8SKN0B0MIM mol2, pdbqt 97,36 0,26849 37,3 -1,629 122,123 1,1447 2 1 0 -1,8442 0,198040361486154
244 LKG8494WBH mol2, pdbqt 93,37 0,1403 20,23 -1,5 108,14 1,0623 1 1 0 -2,2456 6,89822321899547E-02
247 3SCV180C9W mol2, pdbqt 105,19 0,28225 40,54 0,683 118,155 -1,9936 3 1 0 -2,6524 0,529079691278082
259 952902IX06 mol2, pdbqt 25,38 0 0 -0,53 80,9119 0 0 0 0 -1 0,626724863310258
261 H21352682A mol2, pdbqt 72,82 0,17907 17,07 -1,232 72,1065 0,747 1 0 0 -6,6072 0,176440732814282
263 8PJ61P6TS3 mol2, pdbqt 73,39 0,1785 20,23 -1,017 74,1224 0,9593 1 1 0 -6,3463 0,105954766956212
264 40UIR9Q29H mol2, pdbqt 77,38 0,33781 37,3 -0,999 88,1055 0,6097 2 1 0 -3,94 0,180032881569563
273 L90BEN6OLL mol2, pdbqt 99,34 0,30743 52,04 -0,932 102,18 -0,3086 2 2 0 -5,5908 0,296599780492018
275 QXB6XSA047 mol2, pdbqt 136,15 0,68645 136,95 -1,169 176,175 -3,6023 7 4 0 -10,046 0,489693663912198
277 O0UC6XOS4H mol2, pdbqt 46,12 0,89788 63,32 -0,722 61,0398 -0,9216 3 2 0 -1,3919 0,213526755755458
279 O3Y2KY16L1 mol2, pdbqt 125,69 0,73236 129,72 -0,612 176,128 -2,3005 7 4 0 -8,1729 0,491909038089599
280 142M471B3J mol2, pdbqt 38,6 0,67565 34,14 -0,63 44,009 -0,3668 2 0 0 -2,2201 0,325886371822526
281 7U1EE4V452 mol2, pdbqt 28,7 0,45436 17,07 -0,53 29,0179 0 1 0 0 -2,3891 0,536193479320896
284 0YIW783RG1 mol2, pdbqt 39,39 0,66362 37,3 -0,628 46,0249 -0,6699 2 1 0 -2,125 0,11831916201559
286 14I68GI3OQ mol2, pdbqt 69,88 0,73569 72,55 -0,355 91,0657 -1,6712 4 2 0 -1,1359 0,369551594551868
288 S7UI8SM58A mol2, pdbqt 137,8 0,31052 60,77 0,542 162,208 -2,1066 4 2 0 1,5334 0,901343731510073
289 LF3AJ089DQ mol2, pdbqt 85,96 0,30479 40,46 -1,024 110,112 0,9682 2 2 0 -2,2721 0,115452571530189
296 036CTC7X1V mol2, pdbqt 81,9 0,47839 54,37 -0,597 102,089 -0,7654 3 1 0 -3,5827 0,405991795340635
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Records 61 to 80 of 55865
These data are only available for scientific research purposes.