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 of 2794
Records 54381 to 54400 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
92135711 7YF71Y10H8 mol2, pdbqt 126,8 0,43202 82,98 -0,27 188,203 -0,5715 4 2 0 -3,7056 0,40231852830457
92135712 UT54A5UB2I mol2, pdbqt 126,8 0,43202 82,98 -0,27 188,203 -0,5715 4 2 0 -4,7477 0,317014892143443
92135713 AF15V5N72R mol2, pdbqt 126,8 0,43202 82,98 -0,27 188,203 -0,5715 4 2 0 -4,0077 0,399904288774097
92135714 G55YWB788I mol2, pdbqt 126,8 0,43202 82,98 -0,27 188,203 -0,5715 4 2 0 -3,6656 0,503367096079539
92135715 S0K8CUC5GN mol2, pdbqt 126,8 0,43202 82,98 -0,27 188,203 -0,5715 4 2 0 -4,3789 0,178990385756698
92135717 LJ6S311ZHN mol2, pdbqt 371,41 0,20236 91,76 -6,74 501,503 4,8027 7 2 1 -6,0239 6,00550868703537E-02
92135748 9ZSZ0PUC0U mol2, pdbqt 250,08 0,084133 28,54 -4,809 309,476 4,164 1 0 0 3,7736 0,371686914288031
92135750 P9HI0UQH0Y mol2, pdbqt 157,98 0,27086 53,16 -1,861 196,317 1,4229 2 1 0 3,3433 0,937350198908032
92135751 X25TBW2YFJ mol2, pdbqt 233,04 0,015233 3,24 -4,412 287,405 4,5999 1 0 0 6,4602 0,227658718772792
92135758 P677W4F5C5 mol2, pdbqt 166,2 0,46426 95,74 -0,919 238,202 -1,0484 8 1 0 -1,7325 0,557886179862857
92135764 59LEP9I1C6 mol2, pdbqt 241,15 0,11632 32,34 -2,304 256,432 3,444 3 1 0 -16,037 0,430739129051788
92135770 H09QB181BC mol2, pdbqt 296,19 0,094703 32,34 -3,384 312,54 5,2616 3 1 1 -16,037 0,313318242271565
92135771 27RQ6C4VV2 mol2, pdbqt 280,99 0,21616 77,24 -6,387 387,36 4,5824 5 2 0 -7,3954 0,215832054488685
92135791 HDG1QQX7C7 mol2, pdbqt 379,27 0,14736 81 -2,839 410,616 3,8857 5 3 0 -19,146 8,35492154932764E-02
92135793 CH003LLL0N mol2, pdbqt 155,02 0,40059 78,43 -1,94 186,21 0,6567 5 3 0 3,0835 0,162313853181254
92135794 305T85J01Y mol2, pdbqt 251,4 0,066229 23,47 -3,763 321,462 3,8109 2 1 0 5,6038 0,741403323194335
92135808 2VXT34O9XO mol2, pdbqt 330,19 0,18735 74,02 -3,49 418,576 3,356 6 1 0 -13,849 0,129887825510848
92135809 NLX9ZI72X1 mol2, pdbqt 198,99 0,14151 35,83 -3,406 284,745 3,4206 3 1 0 4,0857 0,801275100195574
92135810 69LI1B79OY mol2, pdbqt 198,99 0,14151 35,83 -3,406 284,745 3,4206 3 1 0 4,0857 0,801275100195574
92135812 3FFM4L8F61 mol2, pdbqt 308,16 0,074961 29,46 -5,729 386,617 6,3792 2 1 1 -8,9578 8,57814015917988E-02
These data are only available for scientific research purposes.