0 B11R1.16 CCNC(C)C1=CC=CC=C1 a05379 [0,0,0,0,0,0|2,0,1]=3 1 B10R1.15 CCC(N)C1=CC=CC=C1 c07353 [1,0,0,0,0,0|1,0,1]=3 2 B10R1.15 NNC(=O)C1=CC=CC=C1 e00706 [1,0,0,0,0,0|2,0,0]=3 3 B10R1.15 NNC(=O)C1=CC=NC=C1 c08623 [1,0,0,0,0,0|3,0,0]=4 4 B12R1.16 CCNC(=O)C1=CC=C(Cl)C=C1 c04047 [0,1,0,0,0,0|1,0,0]=2 5 B12R1.16 CCOC(=O)C1=CC=C(N)C=C1 e00681 [0,1,0,0,0,0|0,0,0]=1 6 B12R1.17 CCNC(=O)C1=CC(N)=CC=C1 c05403 [0,1,0,0,0,0|1,0,0]=2 7 B12R1.17 CCOC(=O)C1=CC(O)=CC=C1 c03587 [0,1,0,0,0,0|0,0,0]=1 8 B12R1.30 CCCNC(=O)C1=CC=CC=C1 a07244 [0,1,0,0,0,0|1,0,0]=2 9 B12R1.30 CCCNC(C)C1=CC=CC=C1 a05707 [0,1,0,0,0,0|2,0,1]=4 10 B12R1.30 N#CCNC(=O)C1=CC=CC=C1 a01828 [0,1,0,0,0,0|1,0,1]=3 11 B12R1.308 CCNC(=O)C1=C(Cl)C=CC=C1 c03926 [0,1,0,0,0,0|1,0,0]=2 12 B12R1.308 CCNC(=O)C1=CC=CC=C1N c07571 [0,1,0,0,0,0|1,0,0]=2 13 B12R2.1081 NC1CCCC2=CC=CC=C21 e01074 [0,0,0,1,0,0|2,0,1]=4 14 B12R2.1081 O=C1N=NNC2=C1C=CC=C2 m08825 [0,0,0,1,0,0|3,0,0]=4 15 B12R2.2028 O=C1CC(=O)C2=CC=CC=C12 c08607 [0,0,0,1,0,0|2,0,1]=4 16 B9R1.6 CC(=O)C1=CC=CC=C1 c08846 [2,0,0,0,0,0|0,0,0]=2 17 B9R1.6 NC(=O)C1=CC=CC=C1 a03942 [2,0,0,0,0,0|1,0,0]=3 18 B9R1.6 O=C(O)C1=CC=CC=C1 e00688 [2,0,0,0,0,0|0,0,0]=2 19 B9R1.6 OB(O)C1=CC=CC=C1 c00853 [2,0,0,0,0,0|1,0,1]=4 20 B9R1.8 C\C=C\C1=NC=CC=C1 a03932 [2,0,0,0,0,0|1,0,1]=4 21 B11R1.12 CC\C(=N\O)C1=CC=CC=C1 c07299 [1,1,0,0,0,0|0,0,1]=3 22 B11R1.22 CC1=CC=C(C(=O)NN)C=C1 e00712 [1,1,0,0,0,0|2,0,0]=4 23 B11R1.22 CCC(N)C1=CC=C(O)C=C1 c07399 [1,1,0,0,0,0|1,0,1]=4 24 B11R1.22 CNC(=O)C1=CC=C(N)C=C1 c07252 [1,1,0,0,0,0|1,0,0]=3 25 B11R1.22 COC(=O)C1=CC=C(N)C=C1 c04948 [1,1,0,0,0,0|0,0,0]=2 26 B11R1.22 COC(=O)C1=CC=C(O)C=C1 e00879 [1,1,0,0,0,0|0,0,0]=2 27 B11R1.22 NNC(=O)C1=CC=C(Cl)C=C1 e00711 [1,1,0,0,0,0|2,0,0]=4 28 B11R1.22 NNC(=O)C1=CC=C(N)C=C1 M04886 [1,1,0,0,0,0|2,0,0]=4 29 B11R1.22 O=C(CBr)C1=CC=C(Br)C=C1 a08341 [1,1,0,0,0,0|1,0,0]=3 30 B11R1.23 CC1=CC(C(=O)NN)=CC=C1 e00709 [1,1,0,0,0,0|2,0,0]=4 31 B11R1.23 CNC(=O)C1=CC(N)=CC=C1 c05440 [1,1,0,0,0,0|1,0,0]=3 32 B11R1.23 COC(=O)C1=CC(O)=CC=C1 c00871 [1,1,0,0,0,0|0,0,0]=2 33 B11R1.23 NNC(=O)C1=CC(I)=CC=C1 M01603 [1,1,0,0,0,0|2,0,0]=4 34 B11R1.222 CC1=C(C(=O)NN)C=CC=C1 m08174 [1,1,0,0,0,0|2,0,0]=4 35 B11R1.222 CNC(=O)C1=CC=CC=C1N c01847 [1,1,0,0,0,0|1,0,0]=3 36 B11R1.222 NNC(=O)C1=C(Cl)C=CC=C1 a03954 [1,1,0,0,0,0|2,0,0]=4 37 B11R1.222 NNC(=O)C1=CC=CC=C1N c05360 [1,1,0,0,0,0|2,0,0]=4 38 B11R1.1 CCNCC1=CC=C(Cl)C=C1 c04044 [1,1,0,0,0,0|1,0,1]=4 39 B11R1.17 CCNCC1=C(Cl)C=CC=C1 c03998 [1,1,0,0,0,0|1,0,1]=4 40 B11R1.28 CCCNCC1=CC=CC=C1 a07316 [1,1,0,0,0,0|1,0,1]=4 41 B11R1.28 OCCNCC1=CC=CC=C1 a05540 [1,1,0,0,0,0|1,0,1]=4 42 B11R1.40 CCC(=O)NC1=CC=CC=C1 a03951 [1,1,0,0,0,0|2,0,0]=4 43 B11R1.15 CCOC(=O)C1=CC(C)=NN1 c07619 [0,1,0,0,1,0|2,0,0]=4 44 B13R1.19 CCCC(=O)NC1=CC=C(N)C=C1 c05224 [0,1,0,0,0,1|1,0,0]=3 45 B13R1.20 CCCC(=O)NC1=CC=CC(N)=C1 c04928 [0,1,0,0,0,1|1,0,0]=3 46 B13R1.17 C=CCNC(=O)C1=CC=C(C)C=C1 c09249 [0,2,0,0,0,0|1,0,1]=4 47 B13R1.17 C=CCNC(=O)C1=CC=C(Cl)C=C1 c09261 [0,2,0,0,0,0|1,0,1]=4 48 B13R1.17 CCCNC(=O)C1=CC=C(N)C=C1 c05301 [0,2,0,0,0,0|1,0,0]=3 49 B13R1.132 CC(C)NC(=O)C1=CC=C(N)C=C1 c06026 [0,2,0,0,0,0|1,0,0]=3 50 B13R1.132 CC(C)OC(=O)C1=CC=C(O)C=C1 c04158 [0,2,0,0,0,0|0,0,0]=2 51 B13R1.466 CCOC(=O)C1=CC=C(O)C(Br)=C1 c00882 [0,2,0,0,0,0|0,0,0]=2 52 B13R1.18 C=CCNC(=O)C1=CC(Br)=CC=C1 M07201 [0,2,0,0,0,0|1,0,1]=4 53 B13R1.18 CCCNC(=O)C1=CC(N)=CC=C1 c05300 [0,2,0,0,0,0|1,0,0]=3 54 B13R1.147 CC(C)NC(=O)C1=CC(N)=CC=C1 c05015 [0,2,0,0,0,0|1,0,0]=3 55 B13R1.147 CC(C)OC(=O)C1=CC(O)=CC=C1 c04251 [0,2,0,0,0,0|0,0,0]=2 56 B13R1.446 CCOC(=O)C1=CC(Br)=CC=C1O c01721 [0,2,0,0,0,0|0,0,0]=2 57 B13R1.450 CCOC(=O)C1=NC(N)=NC(C)=C1 c07856 [0,2,0,0,0,0|2,0,0]=4 58 B13R1.45 CC(=O)NNC(=O)C1=CC=CC=C1 M03981 [0,2,0,0,0,0|1,0,1]=4 59 B13R1.45 O=C(CC[N+](=O)[O-])C1=CC=CC=C1 e01168 [0,2,0,0,0,0|2,0,0]=4 60 B13R1.45 O=C(O)CCC(=O)C1=CC=CC=C1 c08612 [0,2,0,0,0,0|1,0,1]=4 61 B13R1.674 C=CCNC(=O)C1=C(C)C=CC=C1 c09254 [0,2,0,0,0,0|1,0,1]=4 62 B13R1.674 C=CCNC(=O)C1=CC=CC=C1N a08048 [0,2,0,0,0,0|1,0,1]=4 63 B13R1.674 CCCNC(=O)C1=C(Cl)C=CC=C1 c03925 [0,2,0,0,0,0|1,0,0]=3 64 B13R1.674 CCCNC(=O)C1=CC=CC=C1N a09887 [0,2,0,0,0,0|1,0,0]=3 65 B13R1.201 CC(C)NC(=O)C1=C(Br)C=CC=C1 c04048 [0,2,0,0,0,0|1,0,0]=3 66 B13R1.201 CC(C)NC(=O)C1=C(Cl)C=CC=C1 c03927 [0,2,0,0,0,0|1,0,0]=3 67 B13R1.201 CC(C)NC(=O)C1=CC=CC=C1N a09782 [0,2,0,0,0,0|1,0,0]=3 68 B13R2.444 O=C(C[N+]1=CC=CC=C1)C2CC2 m07480 [0,0,0,1,0,1|2,0,0]=4 69 B13R2.3085 CN1C(=O)C(=O)C2=C1C=CC=C2 c08319 [0,1,0,1,0,0|2,0,0]=4 70 B13R1.42 CCNC(=O)CCC1=CC=CC=C1 c03821 [0,0,0,0,0,2|1,0,0]=3