• UNII FDA
Page 
 of 2794
Records 741 to 760 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
2890 PV6YEC8983 mol2, pdbqt 190,63 0,19194 38,77 -2,397 247,293 2,4767 4 0 0 -5,552 0,455911707678951
2893 4139O1OAY2 mol2, pdbqt 219,83 0,1644 46,53 -3,245 276,375 2,9264 3 1 0 -3,7379 0,259884211031208
2895 69O5WQQ5TI mol2, pdbqt 233,07 0,015231 3,24 -4,172 275,394 4,3534 1 0 0 3,4998 0,40202533193414
2896 6732XGX1RK mol2, pdbqt 107,17 0,52692 78,92 -0,329 143,145 -1,717 5 2 0 -2,3894 0,535479974773987
2898 J468V64WZ1 mol2, pdbqt 291,26 0,15821 52,6 -5,349 364,44 4,3213 4 0 0 -6,1848 9,73250378107628E-02
2904 866GEV195O mol2, pdbqt 244,08 0,39065 135,12 -3,657 379,888 1,4287 7 3 0 5,4628 0,47876988457388
2905 I76F4SHP7J mol2, pdbqt 234,15 0,16951 49,77 -2,119 291,39 1,8767 4 1 0 4,1325 0,909659342126052
2906 4259VRY3GN mol2, pdbqt 76,06 0,20076 26,02 -1,557 85,1493 0,4601 1 1 0 -6,1232 0,489048479521898
2907 6UXW23996M mol2, pdbqt 182,69 0,23006 51,38 -1,895 261,088 0,727 4 1 0 -10,321 0,102136231980381
2910 P71U09G5BW mol2, pdbqt 240,8 0,39597 135,12 -3,565 389,883 0,9443 7 3 0 7,6525 0,384766412685179
2911 543567RFQQ mol2, pdbqt 237,18 0,0702 23,47 -3,39 287,445 3,8185 2 1 0 3,737 0,770736984286649
2912 1TR49121NP mol2, pdbqt 306,96 0,15181 59,32 -6,688 416,303 5,3412 4 0 1 -4,5036 2,32075043631792E-02
2913 2YHB6175DO mol2, pdbqt 233,04 0,015233 3,24 -4,412 287,405 4,5999 1 0 0 6,4602 0,227658718772792
2915 R110LV8L02 mol2, pdbqt 120,56 0,54346 102,64 -1,426 152,285 -0,2602 2 2 0 -1,8656 0,265734402987816
2916 WFH6A9S0V4 mol2, pdbqt 103,5 0,73411 118,66 1,333 157,13 -5,4835 4 3 0 -7,4642 0,107096905173342
2929 80K4H2RB8P mol2, pdbqt 291,48 0,19 63,99 -4,193 389,841 3,0517 5 1 0 0,83517 0,361314144712983
2943 ZU3X5G2QLR mol2, pdbqt 214,96 0,21437 52,6 -4,842 331,966 3,9096 4 0 0 -3,7766 4,19613315113229E-02
2944 EDH7CNS75I mol2, pdbqt 93,93 0,70851 93,5 -2,459 126,119 -1,7403 5 3 0 -0,25784 0,687473333839766
2950 Z4XE6IBF3V mol2, pdbqt 167,72 0,31171 74,6 -4,138 240,214 2,342 4 2 0 -1,0702 0,1093032315999
2955 8W5C518302 mol2, pdbqt 178,64 0,33094 94,56 -3,304 248,305 1,0102 4 2 0 0,83748 0,163730927670823
Page 
 of 2794
Records 741 to 760 of 55865
These data are only available for scientific research purposes.