• UNII FDA
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Records 201 to 220 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
807 9679TC07X4 mol2, pdbqt 66,06 0 0 -0,53 253,8 -2,765 0 0 0 -1,3975 0,348504283739654
811 Q4516562YH mol2, pdbqt 98,21 0,53233 74,6 -0,537 130,099 -0,2457 4 2 0 -5,1515 0,49579207756567
824 V639KTF2SZ mol2, pdbqt 98,4 0,42083 63,32 -0,946 117,147 -2,0823 3 2 0 -12,394 0,493050030460753
836 QI9C343R60 mol2, pdbqt 144,84 0,46679 103,78 -0,949 197,189 -2,2406 5 4 0 -11,045 0,489176396850541
838 GR0L9S3J0F mol2, pdbqt 142,29 0,35674 72,72 -0,464 183,206 -0,3154 4 4 0 2,574 0,946668732441679
847 O74B4F6OYL mol2, pdbqt 121,12 0,52947 99,6 0,032 165,212 -4,3006 4 2 0 -14,296 0,493951092328954
849 H254GW7PVV mol2, pdbqt 103,1 0,36469 49,33 -0,978 129,158 -2,2705 3 2 0 -2,7231 0,522922021995391
853 QR0BV3BRIA mol2, pdbqt 313,37 0,20586 92,78 -7,606 776,855 1,2491 5 3 1 -10,339 0,136662851737734
857 1QSS9D5DR6 mol2, pdbqt 109,4 0,37852 63,32 -1,106 131,174 -1,864 3 2 0 -16,969 0,491827936805632
861 O48UO55HR0 mol2, pdbqt 287,09 0,2247 92,78 -6,59 650,963 0,812 5 3 1 -10,339 0,132369818365442
863 Q1GT04827L mol2, pdbqt 156,31 0,4049 93,69 -2,931 205,345 2,2316 2 1 0 -9,4126 0,45158100422387
864 73Y7P0K73Y mol2, pdbqt 154,14 0,39652 87,9 -2,855 206,329 2,6294 2 1 0 -9,4356 0,447100608742429
866 AI4RT59273 mol2, pdbqt 122,18 0,46391 89,34 -0,785 146,189 -4,6792 4 3 0 -18,213 0,492840235102126
867 9KX7ZMG0MK mol2, pdbqt 75,46 0,69282 74,6 -0,204 104,061 -1,121 4 2 0 -3,7615 0,18235008669182
868 9K1T0U0R4C mol2, pdbqt 70,9 0,55261 54,37 -0,437 88,0618 -0,9837 3 1 0 -3,8708 0,303085240474298
873 CN1RK42MAD mol2, pdbqt 131,23 0,29902 57,53 -1,568 166,175 1,2515 3 2 0 -2,755 0,327036987648664
876 73JWT2K6T3 mol2, pdbqt 115,89 0,50824 88,62 -1,051 149,213 -2,3875 3 2 0 -13,321 0,491496672252524
878 2X8406WW9I mol2, pdbqt 41,62 0,54325 38,8 -1,409 48,1088 0,413 0 0 0 -2,2831 0,321025635604933
880 722KLD7415 mol2, pdbqt 63,05 0,41364 34,14 -0,614 72,0628 -0,7604 2 0 0 -5,6342 0,107234388489754
887 Y4S76JWI15 mol2, pdbqt 32,11 0,40797 20,23 -0,177 32,0418 -0,3558 1 1 0 -2,3891 0,116120846279605
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Records 201 to 220 of 55865
These data are only available for scientific research purposes.