• UNII FDA
Page 
 of 2794
Records 47541 to 47560 of 55865
 
PUBCHEM ID
UNII
Download
Total Surface Area
Relative PSA
TPSA
cLogS
MW
cLogP
H-Acceptors
H-Donors
Ro5 violations
Druglikeness
DrugScore
57009973 BES45B384G mol2, pdbqt 209,08 0,22039 52,6 -2,568 244,33 2,7065 4 0 0 -0,526 0,491137882723198
57018692 5R3KSG35KJ mol2, pdbqt 185,76 0,24871 58,92 -1,422 226,271 0,7625 4 2 0 -1,2397 0,471043151886021
57019232 5QB05909LE mol2, pdbqt 145,28 0,24835 43,37 -2,25 190,197 1,1248 3 0 0 -16,383 0,284614034357348
57039485 01B3PR4VA4 mol2, pdbqt 226,17 0 0 -7,872 548,692 6,9448 0 0 2 -3,9741 6,14764691650448E-02
57066553 JHI5792M7Y mol2, pdbqt 187,01 0,40971 104,64 -2,623 232,279 1,2136 6 2 0 1,7825 0,861736671331001
57076571 9E3G7I53FI mol2, pdbqt 610,88 0,075432 52,6 -10,29 651,109 15,979 4 0 2 -25,683 7,16236439859558E-02
57077296 38874YC44C mol2, pdbqt 155,05 0,26882 62,75 -2,172 222,263 0,9686 3 1 0 -4,5326 0,103364578010944
57090934 F9V9W3014W mol2, pdbqt 170,33 0,13527 26,3 -2,775 186,294 3,3847 2 0 0 -1,8473 0,29397947889025
57106001 0R0R2RMA9G mol2, pdbqt 294,65 0,23373 94,91 -2,879 343,462 3,6339 6 2 0 -27,809 0,396959950910419
57117450 M512W1R7YN mol2, pdbqt 155,33 0,42091 94,83 -1,276 210,184 0,2803 5 3 0 -1,7208 0,55809782463014
57125363 PP082U6W1L mol2, pdbqt 480,3 0,32165 174,77 -9,551 661,658 2,0106 13 4 2 -1,9 4,81772567537741E-02
57127567 1V43DU2GYQ mol2, pdbqt 116,57 0,19765 26,3 -1,744 128,17 1,6177 2 0 0 -12,935 8,29283039325799E-02
57161740 YKA760W618 mol2, pdbqt 208,56 0 0 -4,409 238,373 5,5881 0 0 1 -1,2542 0,266901757189262
57164040 V25F9362OP mol2, pdbqt 454,85 0,35124 210,23 -6,795 645,663 2,7027 13 6 3 8,5054 0,187777246410663
57180994 40U37V505D mol2, pdbqt 232,72 0,26981 79,23 -2,874 343,378 0,091 6 2 0 5,0812 0,878049762078928
57183875 5COV0OAU1T mol2, pdbqt 320,96 0,24062 95,94 -3,371 416,516 0,6183 7 2 0 -3,8863 0,40285397802433
57202485 17ZZX184UA mol2, pdbqt 218,79 0,15769 38,33 -3,494 261,364 2,9209 3 1 0 -5,5944 0,25158724340052
57212162 MUU258Q35N mol2, pdbqt 433,01 0,33431 179,15 -5,167 566,701 3,5956 9 3 1 -11,542 0,215259688905909
57215421 693AB2R3XW mol2, pdbqt 264,18 0,28034 83,03 -4,915 338,366 1,8987 7 2 0 0,91426 0,286890706704596
57244632 685T1EWG9C mol2, pdbqt 749,14 0,17778 132,92 -5,756 929,157 5,8206 14 0 3 -2,378 0,117487023520653
Page 
 of 2794
Records 47541 to 47560 of 55865
These data are only available for scientific research purposes.