0 B13R2.155 BrC1=CC=C2C=CC(Br)=CC2=C1 077436 [1,0,0,0,0,0|2,1,0]=4 1 B13R2.155 CC1=CC2=C(C=C1)OCC(=O)N2 103389 [1,0,0,0,0,0|2,0,1]=4 2 B13R2.155 CC1=CC=C2C=CC(C)=CC2=C1 005541 [1,0,0,0,0,0|3,0,0]=4 3 B13R2.155 CC1=NC2=CC(Cl)=CC=C2C=C1 002536 [1,0,0,0,0,0|1,1,1]=4 4 B13R2.155 NC1=CC2=C(C=C1)OCC(=O)N2 043629 [1,0,0,0,0,0|2,0,1]=4 5 B13R2.155 NC1=CC2=C(C=CC(=O)N2)C=C1 223239 [1,0,0,0,0,0|1,0,0]=2 6 B13R2.155 O=C1C=CC2=C(C=C(O)C=C2)O1 076753 [1,0,0,0,0,0|2,0,0]=3 7 B13R2.155 O=C1CCC2=C(C=C(O)C=C2)N1 079214 [1,0,0,0,0,0|1,0,2]=4 8 B13R2.155 O=C1CNC2=CC=C(Cl)C=C2N1 011629 [1,0,0,0,0,0|1,1,1]=4 9 B13R2.155 O=C1COC2=CC=C(Cl)C=C2N1 012230 [1,0,0,0,0,0|1,1,1]=4 10 B13R2.155 OC1=CC=C2C=CC(Br)=CC2=C1 076491 [1,0,0,0,0,0|1,1,1]=4 11 B13R2.155 OC1=CC=C2C=CC(O)=NC2=C1 076721 [1,0,0,0,0,0|1,0,2]=4 12 B13R2.369 CC1=NC2=C(C=CC=C2)N=C1O 237570 [1,0,0,0,0,0|2,0,1]=4 13 B13R2.369 NC1=CC2=C(C=CC=C2)C=C1N 236796 [1,0,0,0,0,0|3,0,0]=4 14 B13R2.369 O=C1NC2=C(C=CC=C2)NC1=O 092678 [1,0,0,0,0,0|1,0,1]=3 15 B13R2.369 OC1=C(O)C=C2C=CC=CC2=C1 209264 [1,0,0,0,0,0|1,0,1]=3 16 B13R2.3683 CC1=NC2=CC=C(F)C=C2C=C1 002573 [1,0,0,0,0,0|3,0,0]=4 17 B13R2.3683 FC1=CC=C2C=C(Br)C=CC2=C1 067631 [1,0,0,0,0,0|2,0,0]=3 18 B13R2.3683 NC1=CC2=CC=C(Br)C=C2C=C1 047803 [1,0,0,0,0,0|2,1,0]=4 19 B13R2.3683 O=C1C=CC2=CC(O)=CC=C2N1 245876 [1,0,0,0,0,0|3,0,0]=4 20 B13R2.3683 O=C1C=CC2=CC(O)=CC=C2O1 069115 [1,0,0,0,0,0|3,0,0]=4 21 B13R2.3683 OC1=CC=C2C=C(Br)C=CC2=C1 048804 [1,0,0,0,0,0|1,1,0]=3 22 B13R2.3683 OC1=CC=C2N=C(O)C=CC2=C1 079759 [1,0,0,0,0,0|3,0,0]=4 23 B13R2.3028 CC1=CC2=C(C=C1)NC(=O)C2=O 093452 [0,0,0,0,1,0|2,0,1]=4 24 B13R2.3028 O=C1NC2=CC=C(Br)C=C2C1=O 060624 [0,0,0,0,1,0|1,1,1]=4 25 B13R2.3028 O=C1NC2=CC=C(Cl)C=C2C1=O 001745 [0,0,0,0,1,0|1,1,1]=4 26 B13R2.3028 O=C1NC2=CC=C(F)C=C2C1=O 008155 [0,0,0,0,1,0|1,0,1]=3 27 B13R2.3028 O=C1NC2=CC=C(I)C=C2C1=O 013160 [0,0,0,0,1,0|1,1,1]=4 28 B13R2.5190 O=C1NC2=C(C=CC(Cl)=C2)C1=O 040367 [0,0,0,0,1,0|0,1,1]=3 29 B12R1.21 CC1=CC=C(\C=C\C(=O)O)C=C1 046849 [1,0,1,0,0,0|2,0,0]=4 30 B12R1.21 NC(=O)COC1=CC=C(F)C=C1 106307 [1,0,1,0,0,0|1,0,1]=4 31 B12R1.21 NC1=CC=C(\C=C\C(=O)O)C=C1 104178 [1,0,1,0,0,0|2,0,0]=4 32 B12R1.21 NC1=CC=C(\C=C\C(=O)O)C=C1 239541 [1,0,1,0,0,0|2,0,0]=4 33 B12R1.21 NC1=CC=C(\C=C\C(=O)O)C=C1 464926 [1,0,1,0,0,0|2,0,0]=4 34 B12R1.21 O=C(Cl)\C=C\C1=CC=C(F)C=C1 014744 [1,0,1,0,0,0|1,0,0]=3 35 B12R1.21 O=C(O)\C=C\C1=CC=C(Br)C=C1 001109 [1,0,1,0,0,0|1,1,0]=4 36 B12R1.21 O=C(O)\C=C\C1=CC=C(Cl)C=C1 001144 [1,0,1,0,0,0|1,1,0]=4 37 B12R1.21 O=C(O)\C=C\C1=CC=C(F)C=C1 001180 [1,0,1,0,0,0|1,0,0]=3 38 B12R1.21 O=C(O)\C=C\C1=CC=C(O)C=C1 076727 [1,0,1,0,0,0|2,0,0]=4 39 B12R1.21 O=C(O)\C=C\c1ccc(O)cc1 195783 [1,0,1,0,0,0|2,0,0]=4 40 B12R1.21 O=[N+]([O-])\C=C\C1=CC=C(F)C=C1 006306 [1,0,1,0,0,0|2,0,0]=4 41 B12R1.43 C\C(=C/C1=CC=CC=C1)C(=O)O 241185 [1,0,1,0,0,0|2,0,0]=4 42 B12R1.50 O=C(CCl)NC1=CC(F)=CC=C1 004367 [1,0,1,0,0,0|1,0,1]=4 43 B12R1.226 O=C(O)\C=C\C1=CC=CC(F)=C1 001441 [1,0,1,0,0,0|2,0,0]=4 44 B12R1.127 O=C(O)CC1=C(F)C=CC(F)=C1 001944 [1,0,1,0,0,0|2,0,0]=4 45 B12R1.233 O=C(O)CC1=C(Br)C=C(F)C=C1 034918 [1,0,1,0,0,0|1,0,1]=4 46 B12R1.233 O=C(O)CC1=C(F)C=C(F)C=C1 001927 [1,0,1,0,0,0|1,0,1]=4 47 B12R2.24 BrC1=CC2=C(C=CC=C2)N=C1 044937 [2,0,0,0,0,0|1,0,1]=4 48 B12R2.24 BrC1=CC=C2C=CC=CC2=C1 077976 [2,0,0,0,0,0|1,1,0]=4 49 B12R2.24 BrC1=CC=C2C=CC=NC2=C1 076676 [2,0,0,0,0,0|0,1,1]=4 50 B12R2.24 BrC1=NC2=CC=CC=C2C=C1 076108 [2,0,0,0,0,0|1,0,1]=4 51 B12R2.24 CC1=CC=C2C=CC=CC2=C1 216647 [2,0,0,0,0,0|2,0,0]=4 52 B12R2.24 CC1=NC2=CC=CC=C2C=C1 078623 [2,0,0,0,0,0|1,0,1]=4 53 B12R2.24 IC1=CC2=C(C=CC=C2)C=C1 238872 [2,0,0,0,0,0|1,1,0]=4 54 B12R2.24 NC1=CC2=CC=CC=C2N=C1 064971 [2,0,0,0,0,0|1,0,1]=4 55 B12R2.24 NC1=CC=C2C=CC=CC2=C1 079046 [2,0,0,0,0,0|2,0,0]=4 56 B12R2.24 NC1=NC2=CC=CC=C2C=C1 105400 [2,0,0,0,0,0|1,0,1]=4 57 B12R2.24 O=C1C=C2C=CC=CC2=CN1 208952 [2,0,0,0,0,0|2,0,0]=4 58 B12R2.24 O=C1C=CC2=C(C=CC=C2)N1 358402 [2,0,0,0,0,0|0,0,0]=2 59 B12R2.24 O=C1C=CC2=CC=CC=C2O1 239149 [2,0,0,0,0,0|1,0,0]=3 60 B12R2.24 O=C1C=NC2=CC=CC=C2N1 042360 [2,0,0,0,0,0|1,0,0]=3 61 B12R2.24 O=C1CCC2=C(C=CC=C2)N1 047953 [2,0,0,0,0,0|0,0,2]=4 62 B12R2.24 O=C1CNC2=CC=CC=C2N1 015374 [2,0,0,0,0,0|1,0,1]=4 63 B12R2.24 O=C1COC2=CC=CC=C2N1 012228 [2,0,0,0,0,0|1,0,1]=4 64 B12R2.24 O=C1CSC2=CC=CC=C2N1 011093 [2,0,0,0,0,0|1,0,1]=4 65 B12R2.24 OC1=CC2=CC=CC=C2N=C1 076701 [2,0,0,0,0,0|0,0,1]=3 66 B12R2.24 OC1=CC=C2C=CC=CC2=C1 235727 [2,0,0,0,0,0|1,0,0]=3 67 B12R2.24 OC1=CC=C2C=CC=NC2=C1 076325 [2,0,0,0,0,0|1,0,1]=4 68 B12R2.24 OC1=CC=C2C=CN=CC2=C1 068840 [2,0,0,0,0,0|2,0,0]=4 69 B12R2.24 OC1=CC=C2N=CC=CC2=C1 076700 [2,0,0,0,0,0|2,0,0]=4 70 B12R2.24 SC1=CC=C2C=CC=CC2=C1 227409 [2,0,0,0,0,0|1,1,0]=4 71 B14R2.29365 CC1=CC(=O)OC2=C1C=CC(O)=C2 093391 [1,1,0,0,0,0|2,0,0]=4 72 B14R2.29365 CC1=CC(=O)OC2=CC(N)=CC=C12 017134 [1,1,0,0,0,0|2,0,0]=4 73 B14R2.29365 O=C1C=CC2=C(C=C(O)C=C2O)O1 209765 [1,1,0,0,0,0|2,0,0]=4 74 B14R2.29365 O=C1NC2=C(C=CC(F)=C2)C(=O)O1 040353 [1,1,0,0,0,0|1,0,0]=3 75 B14R2.2332 COC1=CC2=CC=C(O)C=C2C=C1 215979 [1,1,0,0,0,0|2,0,0]=4 76 B14R2.2332 COC1=CC=C2C=C(Br)C=CC2=C1 023276 [1,1,0,0,0,0|1,1,0]=4 77 B14R2.2332 N#CC1=CC=C2C=C(O)C=CC2=C1 069169 [1,1,0,0,0,0|2,0,0]=4 78 B14R2.645 O=C1NC2=C(C=C(F)C(F)=C2)C1=O 078059 [0,1,0,0,1,0|1,0,1]=4 79 B14R2.1815 COC1=CC2=C(C=C1)C(=O)C(=O)N2 038240 [0,1,0,0,1,0|1,0,1]=4 80 B14R2.27750 O=C1NC2=C(C1=O)C(Cl)=CC(Cl)=C2 079343 [0,1,0,0,1,0|0,1,1]=4 81 B16R2.23521 O=C(O)C1=C(O)C=C2C=CC(O)=CC2=C1 223024 [0,2,0,0,0,0|2,0,0]=4 82 B12R1.20 O=C(O)C(O)C1=CC=C(F)C=C1 006259 [0,0,1,0,1,0|1,0,1]=4 83 B12R2.132 CC1=CSC2=CC=C(F)C=C12 008343 [1,0,0,0,1,0|2,0,0]=4 84 B12R2.132 O=C1CCC2=C1C=C(F)C=C2 032493 [1,0,0,0,1,0|0,0,2]=4 85 B12R2.606 CC1=CC2=C(C=C1)OC(=O)N2 094105 [1,0,0,0,1,0|2,0,0]=4 86 B12R2.606 NC1=CC2=C(C=C1)NC(=O)N2 015552 [1,0,0,0,1,0|2,0,0]=4 87 B12R2.606 O=C1CC2=C(C=C(Br)C=C2)N1 076758 [1,0,0,0,1,0|0,1,1]=4 88 B12R2.606 O=C1CC2=C(C=C(O)C=C2)N1 209032 [1,0,0,0,1,0|1,0,1]=4 89 B12R2.606 O=C1NC2=C(C=CC(Cl)=C2)O1 358326 [1,0,0,0,1,0|1,1,0]=4 90 B12R2.606 O=C1NC2=CC=C(Cl)C=C2N1 068825 [1,0,0,0,1,0|1,1,0]=4 91 B12R2.18 CC1=C(C)C2=C(C=CC=C2)N1 223002 [1,0,0,0,1,0|2,0,0]=4 92 B12R2.18 O=C1NC2=C(C=CC=C2)C1=O 077309 [1,0,0,0,1,0|0,0,1]=3 93 B12R2.612 NC1=NNC2=CC(F)=CC=C21 302062 [1,0,0,0,1,0|2,0,0]=4 94 B12R2.612 OC1=NNC2=C1C=CC(Br)=C2 078080 [1,0,0,0,1,0|1,1,0]=4