0 B21R3.6564131 Brc1cc(Cl)c(c2c1C(=O)c3ccccc3C2=O)N Amb1349098 [0,0,0,0,0,0|3,0,0]=3 1 B21R3.6564131 Cc1cc(Br)c2c(c1I)C(=O)c3ccccc3C2=O Amb21947850 [0,0,0,0,0,0|3,0,0]=3 2 B21R3.6564131 Cc1cc(Br)c2c(c1O)C(=O)c3ccccc3C2=O Amb23534637 [0,0,0,0,0,0|2,0,0]=2 3 B21R3.6564131 Cc1cc(Cl)c2C(=O)c3ccccc3C(=O)c2c1Cl Amb17842998 [0,0,0,0,0,0|3,0,0]=3 4 B21R3.6564131 Clc1cc(Br)c(c2c1C(=O)c3ccccc3C2=O)N Amb1900043 [0,0,0,0,0,0|3,0,0]=3 5 B21R3.6564131 Clc1cc(Cl)c(c2c1C(=O)c3ccccc3C2=O)N Amb1196441 [0,0,0,0,0,0|3,0,0]=3 6 B21R3.6564131 Oc1cc(Br)c(c2c1C(=O)c3ccccc3C2=O)N Amb1146689 [0,0,0,0,0,0|2,0,0]=2 7 B21R3.6564131 Oc1cc(S)c(c2c1C(=O)c3ccccc3C2=O)N Amb16204982 [0,0,0,0,0,0|1,1,0]=2 8 B20R3.275669 Brc1ccc(c2c1C(=O)c3ccccc3C2=O)O Amb1773658 [1,0,0,0,0,0|1,0,0]=2 9 B20R3.275669 CC1c2ccccc2C(=O)c3c(O)ccc(O)c13 Amb17689146 [1,0,0,0,0,0|1,0,1]=3 10 B20R3.275669 Clc1ccc(c2c1C(=O)c3ccccc3C2=O)N Amb1351824 [1,0,0,0,0,0|2,0,0]=3 11 B20R3.275669 Fc1ccc(c2c1C(=O)c3ccccc3C2=O)F Amb2227576 [1,0,0,0,0,0|2,0,0]=3 12 B20R3.275669 Ic1ccc(c2c1C(=O)c3ccccc3C2=O)N Amb16228674 [1,0,0,0,0,0|2,0,0]=3 13 B20R3.275669 Nc1ccc(c2c1C(=O)c3ccccc3C2=O)N Amb1199034 [1,0,0,0,0,0|2,0,0]=3 14 B20R3.275669 O=C1C=CC(=O)C2=C1C(=O)c3ccccc3C2=O Amb18548576 [1,0,0,0,0,0|0,0,2]=3 15 B20R3.275669 O=C1c2c(c(F)ccc2F)C(=O)c3c[n]ccc13 Amb19889008 [1,0,0,0,0,0|3,0,0]=4 16 B20R3.275669 Oc1ccc(c2c1C(=O)c3ncccc3C2=O)O Amb17596685 [1,0,0,0,0,0|1,0,0]=2 17 B20R3.278138 Cc1c(O)ccc2c1C(=O)c3ccccc3C2=O Amb23560546 [1,0,0,0,0,0|1,0,0]=2 18 B20R3.278138 Cc1ccc2c(c1Br)C(=O)c3ccccc3C2=O Amb21947849 [1,0,0,0,0,0|2,0,0]=3 19 B20R3.278138 Cc1ccc2c(c1I)C(=O)c3ccccc3C2=O Amb22359159 [1,0,0,0,0,0|2,0,0]=3 20 B20R3.278138 Nc1c([S-])ccc2C(=O)c3ccccc3C(=O)c12 Amb17777530 [1,0,0,0,0,0|1,1,0]=3 21 B20R3.278138 O=C1c2ccc(F)c(F)c2C(=O)c3ccccc13 Amb19889007 [1,0,0,0,0,0|2,0,0]=3 22 B20R3.278138 O=C1c2ccccc2C(=O)c3c1ccc(c3Cl)N Amb1106824 [1,0,0,0,0,0|2,0,0]=3 23 B20R3.278138 O=C1c2ccccc2C(=O)c3c1ccc(c3N)N Amb1349103 [1,0,0,0,0,0|2,0,0]=3 24 B20R3.4308849 CN1c2cc(O)cc(O)c2C(=O)c3ccccc13 Amb18663889 [1,0,0,0,0,0|2,0,0]=3 25 B20R3.4308849 Cc1cc(Br)c2C(=O)c3ccccc3C(=O)c2c1 Amb17843260 [1,0,0,0,0,0|2,0,0]=3 26 B20R3.4308849 Cc1cc(C)c2c(n1)C(=O)c3c(C2=O)cccc3 Amb16204913 [1,0,0,0,0,0|3,0,0]=4 27 B20R3.4308849 Cc1cc(N)c2C(=O)c3ccccc3C(=O)c2c1 Amb17843259 [1,0,0,0,0,0|2,0,0]=3 28 B20R3.4308849 O=C1c2cc(Br)cc(Br)c2C(=O)c3ccccc13 Amb24183006 [1,0,0,0,0,0|2,0,0]=3 29 B22R3.179084 COc1c2c(C(=O)c3ccccc3N2C)c(O)cc1O Amb19959178 [0,1,0,0,0,0|2,0,0]=3 30 B22R3.16381672 OCc1cc(O)c2c(C(=O)c3ccccc3C2=O)c1O Amb22755906 [0,1,0,0,0,0|0,0,0]=1 31 B22R3.132468317 Nc1c2c(c(Cl)c(Cl)c1Cl)C(=O)c3ccccc3C2=O Amb22754916 [0,1,0,0,0,0|3,0,0]=4 32 B22R3.132468317 O=C1c2ccccc2C(=O)c3c1c(Br)c(c(c3O)C)C Amb16204002 [0,1,0,0,0,0|2,0,0]=3 33 B22R3.132468317 O=C1c2ccccc2C(=O)c3c1c(Cl)c(c(c3Cl)C)C Amb16767173 [0,1,0,0,0,0|3,0,0]=4 34 B22R3.132468317 O=C1c2ccccc2C(=O)c3c1c(Cl)c(c(c3Cl)Cl)Cl Amb2227694 [0,1,0,0,0,0|3,0,0]=4 35 B22R3.132468317 O=C1c2ccccc2C(=O)c3c1c(O)c(c(c3O)C)C Amb1198449 [0,1,0,0,0,0|1,0,0]=2 36 B22R3.132468317 O=C1c2ccccc2C(=O)c3c1c(O)c(c(c3O)O)O Amb17597388 [0,1,0,0,0,0|0,0,0]=1 37 B19R3.152782 Brc1cccc2c1C(=O)c3ccccc3C2=O Amb2227571 [2,0,0,0,0,0|1,0,0]=3 38 B19R3.152782 C=C1c2ccccc2C(=O)c3c(O)cccc31 Amb22467215 [2,0,0,0,0,0|1,0,0]=3 39 B19R3.152782 CN1c2cccc(O)c2C(=O)c3ccccc13 Amb18659152 [2,0,0,0,0,0|2,0,0]=4 40 B19R3.152782 Fc1cccc2c1C(=O)c3ccccc3C2=O Amb1144483 [2,0,0,0,0,0|1,0,0]=3 41 B19R3.152782 Ic1cccc2c1C(=O)c3ccccc3C2=O Amb2227573 [2,0,0,0,0,0|1,0,0]=3 42 B19R3.152782 Nc1cccc2c1C(=O)c3ccccc3C2=O Amb1198458 [2,0,0,0,0,0|1,0,0]=3 43 B19R3.167834 Oc1ccc(O)c2Oc3ccccc3C(=O)c12 Amb18659898 [2,0,0,0,0,0|1,0,0]=3 44 B19R3.169423 Oc1ccc2c(cc3ccccc3c2O)c1O Amb22264831 [2,0,0,0,0,0|0,0,1]=3 45 B19R3.169429 Brc1ccc2c(c1)C(=O)c3c(C2=O)cccc3 Amb2227572 [2,0,0,0,0,0|1,0,0]=3 46 B19R3.169429 Cc1ccc2C(=O)c3ccccc3C(=O)c2c1 Amb17701611 [2,0,0,0,0,0|1,0,0]=3 47 B19R3.169429 Clc1ccc2c(c1)C(=O)c3c(C2=O)cccc3 Amb2227702 [2,0,0,0,0,0|1,0,0]=3 48 B19R3.169429 Fc1ccc2c(c1)C(=O)c3c(C2=O)cccc3 Amb2227530 [2,0,0,0,0,0|1,0,0]=3 49 B19R3.169429 Oc1ccc2c(c1)C(=O)c3c(C2=O)cccc3 Amb2227548 [2,0,0,0,0,0|0,0,0]=2 50 B19R3.1709309 Cc1cc(O)cc2C(=O)c3ccccc3Sc21 Amb19523959 [2,0,0,0,0,0|2,0,0]=4 51 B19R3.1709309 Oc1cc(C)c2c(c1)c(=O)c3c(s2)cccc3 Amb1027045 [2,0,0,0,0,0|2,0,0]=4 52 B19R3.2936359 Oc1cc2Nc3ccccc3C(=O)c2c(O)c1 Amb18659616 [2,0,0,0,0,0|1,0,0]=3 53 B19R3.2936359 Oc1cc2Oc3ccccc3C(=O)c2c(O)c1 Amb19119970 [2,0,0,0,0,0|1,0,0]=3 54 B21R3.784628 CNc1ccc(N)c2c1C(=O)c3ccccc3C2=O Amb22234246 [1,1,0,0,0,0|2,0,0]=4 55 B21R3.784628 CNc1ccc(c2c1C(=O)c3ccccc3C2=O)Br Amb1103961 [1,1,0,0,0,0|2,0,0]=4 56 B21R3.784628 CSc1ccc(c2c1C(=O)c3ccccc3C2=O)O Amb1094208 [1,1,0,0,0,0|0,1,0]=3 57 B21R3.6746879 Clc1cccc2c1C(=O)c3c(C2=O)c(Cl)ccc3Cl Amb2227626 [1,1,0,0,0,0|2,0,0]=4 58 B21R3.6746879 Oc1ccc(c2c1C(=O)c3cccc(c3C2=O)O)Cl Amb17597439 [1,1,0,0,0,0|1,0,0]=3 59 B21R3.99746 CNc1c(S)ccc2c1C(=O)c3ccccc3C2=O Amb20246269 [1,1,0,0,0,0|1,1,0]=4 60 B21R3.436940 Nc1cc2c(cc1)C(=O)c3ccc(O)c(O)c3C2=O Amb22000038 [1,1,0,0,0,0|0,0,0]=2 61 B21R3.788935 C#Cc1ccc2c(c1N)C(=O)c3c(C2=O)cccc3 Amb2227438 [1,1,0,0,0,0|2,0,0]=4 62 B21R3.788935 CSc1ccc2C(=O)c3ccccc3C(=O)c2c1N Amb17777521 [1,1,0,0,0,0|1,1,0]=4 63 B21R3.788935 Cc1c2c(ccc1OC)C(=O)c3ccccc3C2=O Amb23454580 [1,1,0,0,0,0|1,0,0]=3 64 B21R3.788935 Nc1c(C=O)ccc2C(=O)c3ccccc3C(=O)c12 Amb17842776 [1,1,0,0,0,0|1,0,1]=4 65 B21R3.788935 OCc1ccc2c(c1N)C(=O)c3c(C2=O)cccc3 Amb2227439 [1,1,0,0,0,0|1,0,0]=3 66 B21R3.788935 Oc1c(CO)ccc2c1C(=O)c3ccccc3C2=O Amb22173882 [1,1,0,0,0,0|0,0,0]=2 67 B21R3.4233845 Cc1cc2c(C(=O)c3ccccc3C2=O)c(C)c1O Amb23560547 [1,1,0,0,0,0|1,0,0]=3 68 B21R3.4233845 O=C1c2cc(Cl)c(Cl)c(Cl)c2C(=O)c3ccccc13 Amb20527681 [1,1,0,0,0,0|2,0,0]=4 69 B21R3.4233845 O=C1c2ccccc2C(=O)c3c1c(Br)c(c(c3)Cl)N Amb1913248 [1,1,0,0,0,0|2,0,0]=4 70 B21R3.4233845 O=C1c2ccccc2C(=O)c3c1c(O)c(c(c3)Cl)O Amb17597438 [1,1,0,0,0,0|0,0,0]=2 71 B21R3.4233845 O=C1c2ccccc2C(=O)c3c1c(O)c(c(c3)N)O Amb17597050 [1,1,0,0,0,0|0,0,0]=2 72 B21R3.800316 COc1cc(C)cc2c1C(=O)c3ccccc3C2=O Amb16204122 [1,1,0,0,0,0|1,0,0]=3 73 B21R3.10019488 COc1cc(O)c2c(c1)n(C)c3c(c2=O)cccc3 Amb16200069 [1,1,0,0,0,0|2,0,0]=4 74 B23R3.16384814 Brc1cc(C(=O)O)c(c2c1C(=O)c3ccccc3C2=O)N Amb1036002 [0,2,0,0,0,0|2,0,0]=4 75 B23R3.16384814 CN(c1cc(O)c2c(c1O)C(=O)c3c(C2=O)cccc3)C Amb16756414 [0,2,0,0,0,0|1,0,0]=3 76 B23R3.16384814 Clc1cc(C(=O)O)c(c2c1C(=O)c3ccccc3C2=O)N Amb1198446 [0,2,0,0,0,0|2,0,0]=4 77 B23R3.16384814 Oc1cc(C(=O)O)c(c2c1C(=O)c3ccccc3C2=O)N Amb1349115 [0,2,0,0,0,0|1,0,0]=3 78 B23R3.603251660 Nc1cc(Br)c(O)c2c1C(=O)c3c(C2=O)c(N)ccc3O Amb22823211 [0,2,0,0,0,0|2,0,0]=4 79 B21R3.418246 Cc1ccc2NC(=O)c3ccccc3C(=O)c2c1C Amb20665544 [1,0,0,0,0,1|2,0,0]=4 80 B21R3.418246 Cc1ccc2NC(=O)c3ccccc3C(=O)c2c1Cl Amb20665511 [1,0,0,0,0,1|2,0,0]=4