0 B11R1.22 CC1=CC=C(C(=O)NN)C=C1 e00712 [0,0,0,0,0,0|3,0,0]=3 1 B11R1.22 CC1=CC=C(\C(C)=N\O)C=C1 m02696 [0,0,0,0,0,0|4,0,0]=4 2 B11R1.22 CCC(N)C1=CC=C(O)C=C1 c07399 [0,0,0,0,0,0|2,0,1]=3 3 B11R1.22 CNC(=O)C1=CC=C(N)C=C1 c07252 [0,0,0,0,0,0|2,0,0]=2 4 B11R1.22 COC(=O)C1=CC=C(N)C=C1 c04948 [0,0,0,0,0,0|1,0,0]=1 5 B11R1.22 COC(=O)C1=CC=C(O)C=C1 e00879 [0,0,0,0,0,0|0,0,0]=0 6 B11R1.22 C\C(=N\O)C1=CC=C(Br)C=C1 a01486 [0,0,0,0,0,0|4,0,0]=4 7 B11R1.22 NNC(=O)C1=CC=C(Cl)C=C1 e00711 [0,0,0,0,0,0|3,0,0]=3 8 B11R1.22 NNC(=O)C1=CC=C(N)C=C1 M04886 [0,0,0,0,0,0|3,0,0]=3 9 B11R1.22 O=C(CBr)C1=CC=C(Br)C=C1 a08341 [0,0,0,0,0,0|3,0,0]=3 10 B10R1.1 O\N=C\C1=CC=C(O)C=C1 c05010 [1,0,0,0,0,0|2,0,0]=3 11 B10R1.13 CC(N)C1=CC=C(O)C=C1 c07375 [1,0,0,0,0,0|1,0,1]=3 12 B10R1.13 CN(C)C1=CC=C(N)C=C1 c08318 [1,0,0,0,0,0|3,0,0]=4 13 B10R1.13 O=[N+]([O-])C1=CC=C(I)C=C1 c08153 [1,0,0,0,0,0|2,0,1]=4 14 B10R1.15 CCC(N)C1=CC=CC=C1 c07353 [1,0,0,0,0,0|2,0,1]=4 15 B10R1.15 NNC(=O)C1=CC=CC=C1 e00706 [1,0,0,0,0,0|2,0,0]=3 16 B10R1.15 NNC(=O)C1=CC=NC=C1 c08623 [1,0,0,0,0,0|3,0,0]=4 17 B12R1.5 COC(=O)C1=CC=C(OC)C=C1 c02414 [0,1,0,0,0,0|0,0,0]=1 18 B12R1.5 COC1=CC=C(C(=O)NN)C=C1 M04941 [0,1,0,0,0,0|2,0,0]=3 19 B12R1.12 CC\C(=N\O)C1=CC=C(O)C=C1 c06006 [0,1,0,0,0,0|1,0,1]=3 20 B12R1.16 CCNC(=O)C1=CC=C(Cl)C=C1 c04047 [0,1,0,0,0,0|2,0,0]=3 21 B12R1.16 CCOC(=O)C1=CC=C(N)C=C1 e00681 [0,1,0,0,0,0|1,0,0]=2 22 B12R1.20 CC1=CC=C(C(=O)N(C)C)C=C1 c08843 [0,1,0,0,0,0|2,0,0]=3 23 B12R1.20 CN(C)C(=O)C1=CC=C(Cl)C=C1 c07748 [0,1,0,0,0,0|2,0,0]=3 24 B12R1.20 CN(C)C(=O)C1=CC=C(N)C=C1 c05422 [0,1,0,0,0,0|2,0,0]=3 25 B12R1.367 CC1=CC=C(C(=O)NN)C=C1Br a08108 [0,1,0,0,0,0|3,0,0]=4 26 B12R1.367 COC(=O)C1=CC=C(O)C(Br)=C1 c07405 [0,1,0,0,0,0|0,0,0]=1 27 B10R1.14 COC(=O)C1=CC=C(Br)O1 a03363 [0,0,0,0,1,0|2,0,0]=3 28 B12R1.49 CC1=CC=C(NC(=O)CBr)C=C1 c03111 [0,0,0,0,0,1|3,0,0]=4 29 B12R1.49 CCC(=O)NC1=CC=C(N)C=C1 c05262 [0,0,0,0,0,1|2,0,0]=3 30 B12R1.49 CCC(=O)NC1=CC=C(O)C=C1 c02629 [0,0,0,0,0,1|1,0,0]=2 31 B12R1.49 CNC(=O)CC1=CC=C(N)C=C1 c07615 [0,0,0,0,0,1|2,0,0]=3 32 B12R1.49 NNC(=O)CC1=CC=C(Cl)C=C1 a08692 [0,0,0,0,0,1|3,0,0]=4 33 B12R1.49 O=C(CBr)NC1=CC=C(F)C=C1 c03252 [0,0,0,0,0,1|3,0,0]=4 34 B9R1.1 OCC1=CC=C(O)C=C1 c08578 [2,0,0,0,0,0|0,0,1]=3 35 B9R1.8 C\C=C\C1=NC=CC=C1 a03932 [2,0,0,0,0,0|2,0,0]=4 36 B9R1.6 CC(=O)C1=CC=CC=C1 c08846 [2,0,0,0,0,0|0,0,0]=2 37 B9R1.6 NC(=O)C1=CC=CC=C1 a03942 [2,0,0,0,0,0|1,0,0]=3 38 B9R1.6 O=C(O)C1=CC=CC=C1 e00688 [2,0,0,0,0,0|0,0,0]=2 39 B9R1.6 OB(O)C1=CC=CC=C1 c00853 [2,0,0,0,0,0|1,0,1]=4 40 B11R1.83 CCOC1=CC=C(CO)C=C1 c04426 [1,1,0,0,0,0|2,0,0]=4 41 B11R1.83 COC1=CC=C(\C=N\O)C=C1 c04966 [1,1,0,0,0,0|2,0,0]=4 42 B11R1.3 O=C(O)C1=CC=C(CCl)C=C1 c08636 [1,1,0,0,0,0|1,0,0]=3 43 B11R1.21 CC1=C(I)C=C(C(N)=O)C=C1 a05058 [1,1,0,0,0,0|2,0,0]=4 44 B11R1.21 CC1=CC=C(C(=O)O)C=C1Br a00556 [1,1,0,0,0,0|1,0,0]=3 45 B11R1.21 CC1=CC=C(C(N)=O)C=C1Br a03147 [1,1,0,0,0,0|2,0,0]=4 46 B11R1.166 NC1=C(C(=O)O)C=CC(Cl)=C1 c08848 [1,1,0,0,0,0|1,0,0]=3 47 B11R1.166 NC1=CC(O)=C(C(=O)[O-])C=C1 e00679 [1,1,0,0,0,0|1,0,1]=4 48 B11R1.166 O=C(O)C1=CN=C(O)N=C1O c07224 [1,1,0,0,0,0|2,0,0]=4 49 B11R1.12 CC\C(=N\O)C1=CC=CC=C1 c07299 [1,1,0,0,0,0|1,0,1]=4 50 B11R1.23 CC1=CC(C(=O)NN)=CC=C1 e00709 [1,1,0,0,0,0|2,0,0]=4 51 B11R1.23 CNC(=O)C1=CC(N)=CC=C1 c05440 [1,1,0,0,0,0|1,0,0]=3 52 B11R1.23 COC(=O)C1=CC(O)=CC=C1 c00871 [1,1,0,0,0,0|0,0,0]=2 53 B11R1.23 NNC(=O)C1=CC(I)=CC=C1 M01603 [1,1,0,0,0,0|2,0,0]=4 54 B11R1.222 CC1=C(C(=O)NN)C=CC=C1 m08174 [1,1,0,0,0,0|2,0,0]=4 55 B11R1.222 CNC(=O)C1=CC=CC=C1N c01847 [1,1,0,0,0,0|1,0,0]=3 56 B11R1.222 NNC(=O)C1=C(Cl)C=CC=C1 a03954 [1,1,0,0,0,0|2,0,0]=4 57 B11R1.222 NNC(=O)C1=CC=CC=C1N c05360 [1,1,0,0,0,0|2,0,0]=4 58 B11R1.225 COC(=O)C1=C(N)SC(C)=C1 M06604 [0,1,0,0,1,0|2,0,0]=4 59 B13R1.5 CCC(=O)NC1=CC=C(C#N)C=C1 M06704 [0,1,0,0,0,1|2,0,0]=4 60 B13R1.5 COC1=CC=C(CC(=O)NN)C=C1 M05232 [0,1,0,0,0,1|2,0,0]=4 61 B13R1.5 COC1=CC=C(NC(=O)CBr)C=C1 c03251 [0,1,0,0,0,1|2,0,0]=4 62 B13R1.19 CCCC(=O)NC1=CC=C(N)C=C1 c05224 [0,1,0,0,0,1|2,0,0]=4 63 B13R1.133 CC(C)C(=O)NC1=CC=C(N)C=C1 c04936 [0,1,0,0,0,1|2,0,0]=4 64 B13R1.133 CN(C)C(=O)CC1=CC=C(Cl)C=C1 e00453 [0,1,0,0,0,1|2,0,0]=4 65 B13R1.133 CN(C)C(=O)CC1=CC=C(N)C=C1 c07620 [0,1,0,0,0,1|2,0,0]=4 66 B13R1.2879 CCC(=O)NC1=CC(Cl)=C(Br)C=C1 a06049 [0,1,0,0,0,1|2,0,0]=4 67 B13R1.36 COC1=CC=C(C(=O)N(C)C)C=C1 c09234 [0,2,0,0,0,0|1,0,0]=3 68 B13R1.537 CNC(=O)C1=CC=C([N+](=O)[O-])C=C1 c07247 [0,2,0,0,0,0|1,0,1]=4 69 B13R1.537 COC(=O)C1=CC=C(C(=O)O)C=C1 c04862 [0,2,0,0,0,0|0,0,0]=2 70 B13R1.537 COC(=O)C1=CC=C([N+](=O)[O-])C=C1 a07790 [0,2,0,0,0,0|0,0,1]=3 71 B13R1.537 O=C(O)C1=CC=C(C(=O)CBr)C=C1 e00770 [0,2,0,0,0,0|2,0,0]=4 72 B13R1.3088 CNC(=O)C1=CC=C(OC)C(Br)=C1 c02719 [0,2,0,0,0,0|1,0,0]=3 73 B13R1.3088 COC(=O)C1=CC(Br)=C(OC)C=C1 a01132 [0,2,0,0,0,0|0,0,0]=2 74 B13R1.3088 COC1=CC=C(C(=O)NN)C=C1Br m08173 [0,2,0,0,0,0|2,0,0]=4 75 B13R1.3088 COC1=CC=C(C(=O)NN)C=C1I M06544 [0,2,0,0,0,0|2,0,0]=4 76 B13R1.17 C=CCNC(=O)C1=CC=C(C)C=C1 c09249 [0,2,0,0,0,0|2,0,0]=4 77 B13R1.17 C=CCNC(=O)C1=CC=C(Cl)C=C1 c09261 [0,2,0,0,0,0|2,0,0]=4 78 B13R1.17 CCCNC(=O)C1=CC=C(N)C=C1 c05301 [0,2,0,0,0,0|2,0,0]=4 79 B13R1.132 CC(C)NC(=O)C1=CC=C(N)C=C1 c06026 [0,2,0,0,0,0|2,0,0]=4 80 B13R1.132 CC(C)OC(=O)C1=CC=C(O)C=C1 c04158 [0,2,0,0,0,0|0,0,0]=2 81 B13R1.466 CCOC(=O)C1=CC=C(O)C(Br)=C1 c00882 [0,2,0,0,0,0|0,0,0]=2 82 B13R1.163 CN(C)C(=O)C1=CC=C(Cl)C=C1Cl c09225 [0,2,0,0,0,0|2,0,0]=4 83 B9R1.35 O=C(O)C1=CC=C(Br)O1 a03525 [1,0,0,0,1,0|2,0,0]=4 84 B11R1.40 CCC(=O)NC1=CC=CC=C1 a03951 [1,0,0,0,0,1|1,0,0]=3 85 B11R1.40 COC(=O)NC1=CC=CC=C1 e00869 [1,0,0,0,0,1|0,0,0]=2 86 B11R1.40 NNC(=O)CC1=CC=CC=C1 M06886 [1,0,0,0,0,1|2,0,0]=4 87 B11R1.40 O=C(CBr)NC1=CC=CC=C1 c03076 [1,0,0,0,0,1|2,0,0]=4 88 B13R1.14 CNC(=O)CCC1=CC=C(N)C=C1 c07674 [0,0,0,0,0,2|2,0,0]=4 89 B13R1.14 CNC(=O)COC1=CC=C(C)C=C1 c02590 [0,0,0,0,0,2|2,0,0]=4 90 B13R1.14 CNC(=O)\C=C\C1=CC=C(N)C=C1 c07564 [0,0,0,0,0,2|2,0,0]=4