• UNII FDA
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Records 55481 to 55500 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
119058036 7SE5582Q2P mol2, pdbqt 3139,1 0,44726 1815,6 -9,907 4102,78 -35,535 107 61 3 0,84621 0,214031054943717
119058037 744M0WHE80 mol2, pdbqt 290,95 0,18701 60,33 -3,41 362,443 3,2541 5 1 0 -1,2083 0,47914767355435
119058038 4HUF3V875C mol2, pdbqt 931,11 0,3513 447,52 -8,447 1327,52 -0,0968 26 9 3 -14,683 7,70831681560989E-02
119058039 LSJ1YAW9R1 mol2, pdbqt 150,77 0,24395 47,61 -2,868 190,245 1,2874 3 1 0 0,90557 0,791501817028392
119058040 X9NBG680PN mol2, pdbqt 150,77 0,24395 47,61 -2,868 190,245 1,2874 3 1 0 0,90557 0,791501817028392
119058041 3M7TX701A4 mol2, pdbqt 1210,9 0,41548 657,01 -7,202 1660,25 -10,149 39 20 3 -4,9838 8,30287880103842E-02
119058042 ROV204583W mol2, pdbqt 1324,3 0,36441 596,68 -4,524 1711,01 -2,6672 41 20 3 -11,576 0,202055089975079
119058043 9QBH807006 mol2, pdbqt 928,43 0,5677 695,42 -2,647 1351,51 -12,945 34 17 3 -18,868 0,239155276620188
119058044 2N1280157D mol2, pdbqt 294,43 0,22206 73,22 -3,728 383,422 2,5798 6 1 0 2,4512 0,443456742210591
119058045 H2HEN05B8P mol2, pdbqt 306,29 0,21346 73,22 -4,132 385,506 3,2874 6 1 0 -12,023 0,21226974564593
119058046 1N77GG658H mol2, pdbqt 164,01 0,14938 29,1 -2,851 191,273 1,6049 2 1 0 2,5527 0,532762316308902
119058047 62O4IYO9GT mol2, pdbqt 263,54 0,15732 39,72 -3,359 315,412 3,0135 4 1 0 4,5476 0,816631716578237
119058048 CYH3QOU6FN mol2, pdbqt 287,38 0,20767 77,12 -3,535 361,459 2,9942 5 2 0 -7,6238 0,392424724003532
119058049 W6Z0932HYU mol2, pdbqt 277,21 0,21529 77,12 -3,358 347,432 2,4284 5 2 0 1,9168 0,772176355216986
119058050 LOL2KQM530 mol2, pdbqt 286,14 0,24691 90,01 -3,639 362,447 2,2552 6 2 0 -6,5318 0,240570645154012
119058051 DX55R9D737 mol2, pdbqt 285,04 0,24786 90,01 -3,788 364,876 2,1443 6 2 0 -2,0658 0,126585787044175
119058052 Y21A13WADY mol2, pdbqt 296,12 0,22079 73,22 -3,955 371,479 2,7216 6 1 0 -0,80297 0,297129398495151
119058053 P5PZX56UCW mol2, pdbqt 281,86 0,23196 73,22 -3,439 345,441 2,7407 6 1 0 -1,1956 0,299884275363578
119058383 H0E32V45MQ mol2, pdbqt 317,32 0,23774 107,22 -3,716 408,464 2,951 6 4 0 -9,6086 0,367813926376627
119058385 19OP2S99RQ mol2, pdbqt 269,83 0,19042 67,43 -2,562 368,455 2,8171 6 3 0 -10,584 0,250000719250434
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 of 2794
Records 55481 to 55500 of 55865
These data are only available for scientific research purposes.