0 B10R1.59 CC(=O)C1=CC(C)=NN1C B018730 [0,0,0,0,0,0|2,0,0]=2 1 B10R1.59 CC(=O)C1=CN(C)N=C1C B007420 [0,0,0,0,0,0|2,0,0]=2 2 B10R1.59 CC(=O)C1=NN(C)C=C1Cl B017914 [0,0,0,0,0,0|4,0,0]=4 3 B10R1.59 CC(=O)C1=NN(C)C=C1I B047752 [0,0,0,0,0,0|4,0,0]=4 4 B10R1.59 CC1=C(C(=O)O)SC(N)=N1 B030024 [0,0,0,0,0,0|4,0,0]=4 5 B10R1.59 CC1=NC(C(N)=O)=C(N)N1 B049430 [0,0,0,0,0,0|4,0,0]=4 6 B10R1.59 CC1=NN(C)C(C(=O)O)=C1 B013525 [0,0,0,0,0,0|3,0,0]=3 7 B10R1.59 CC1=NN(C)C([N+](=O)[O-])=C1 B037610 [0,0,0,0,0,0|4,0,0]=4 8 B10R1.59 CC1=NN(C)C=C1C(=O)Cl B011575 [0,0,0,0,0,0|3,0,0]=3 9 B10R1.59 CC1=NN(C)C=C1C(=O)O B000228 [0,0,0,0,0,0|3,0,0]=3 10 B10R1.59 CC1=NN(C)C=C1C(C)N B014439 [0,0,0,0,0,0|3,0,1]=4 11 B10R1.59 CC1=NN(C)C=C1C(C)N B047089 [0,0,0,0,0,0|3,0,1]=4 12 B10R1.59 CC1=NN(C)C=C1[N+](=O)[O-] B006748 [0,0,0,0,0,0|4,0,0]=4 13 B10R1.59 CN1C=C(C(=O)O)C(Br)=N1 B059852 [0,0,0,0,0,0|4,0,0]=4 14 B10R1.59 CN1C=C(C(=O)O)C(I)=N1 B059950 [0,0,0,0,0,0|4,0,0]=4 15 B10R1.59 CN1C=C(C(=O)O)C(N)=N1 B051780 [0,0,0,0,0,0|4,0,0]=4 16 B10R1.59 CN1C=C(C(N)=O)C(N)=N1 B051801 [0,0,0,0,0,0|4,0,0]=4 17 B10R1.59 CN1N=C(N)C=C1C(=O)O B024383 [0,0,0,0,0,0|4,0,0]=4 18 B10R1.59 CN1N=C(N)C=C1C(=O)O B037119 [0,0,0,0,0,0|4,0,0]=4 19 B10R1.59 CN1N=C(N)C=C1C(N)=O B047129 [0,0,0,0,0,0|4,0,0]=4 20 B9R1.22 CC1=CC(C=O)=C(C)S1 B018517 [1,0,0,0,0,0|0,1,0]=2 21 B9R1.22 CC1=CN(C)C(C=O)=N1 B047108 [1,0,0,0,0,0|3,0,0]=4 22 B9R1.22 CC1=CN(C)N=C1C=O B047533 [1,0,0,0,0,0|3,0,0]=4 23 B9R1.22 CC1=NN(C)C(C=O)=C1 B015985 [1,0,0,0,0,0|2,0,0]=3 24 B9R1.22 CC1=NN(C)C=C1C=O B000370 [1,0,0,0,0,0|2,0,0]=3 25 B9R1.22 CN1C=C(C=O)C(Br)=N1 B059872 [1,0,0,0,0,0|3,0,0]=4 26 B9R1.22 CN1C=C(C=O)C(I)=N1 B059893 [1,0,0,0,0,0|3,0,0]=4 27 B9R1.35 CC(=O)C1=CC(Br)=CS1 B020506 [1,0,0,0,0,0|3,0,0]=4 28 B9R1.35 CC(=O)C1=CC=C(F)S1 B046183 [1,0,0,0,0,0|3,0,0]=4 29 B9R1.35 CC(=O)C1=CN(C)N=C1 B007418 [1,0,0,0,0,0|2,0,0]=3 30 B9R1.35 CC(=O)C1=CSC(C)=N1 B059741 [1,0,0,0,0,0|1,1,0]=3 31 B9R1.35 CC(=O)C1=NN(C)C=C1 B017804 [1,0,0,0,0,0|3,0,0]=4 32 B9R1.35 CC1=CC(C(=O)O)=CS1 B007488 [1,0,0,0,0,0|1,1,0]=3 33 B9R1.35 CC1=CC(C(=O)O)=NN1 B000144 [1,0,0,0,0,0|3,0,0]=4 34 B9R1.35 CC1=CC(C(=O)O)=NO1 B007473 [1,0,0,0,0,0|2,0,0]=3 35 B9R1.35 CC1=NOC(C(=O)O)=C1 B028540 [1,0,0,0,0,0|3,0,0]=4 36 B9R1.35 CN1C=C(C(=O)Cl)C=N1 B011574 [1,0,0,0,0,0|3,0,0]=4 37 B9R1.35 CN1C=C(C(=O)O)C=N1 B000227 [1,0,0,0,0,0|3,0,0]=4 38 B9R1.41 CC(=O)C1=CC=NN1C B017805 [1,0,0,0,0,0|2,0,0]=3 39 B9R1.41 CC(=O)C1=NON=C1C B048952 [1,0,0,0,0,0|3,0,0]=4 40 B9R1.41 CN1N=CC=C1C(=O)Cl B006621 [1,0,0,0,0,0|3,0,0]=4 41 B9R1.41 CN1N=CC=C1C(=O)O B000141 [1,0,0,0,0,0|3,0,0]=4 42 B9R1.41 CN1N=CC=C1C(N)=O B020779 [1,0,0,0,0,0|3,0,0]=4 43 B9R1.41 NC(=O)C1=C(N)SC=C1 B014696 [1,0,0,0,0,0|2,1,0]=4 44 B11R1.49 CCN1N=C(C)C=C1C(=O)O B035887 [0,1,0,0,0,0|3,0,0]=4 45 B11R1.49 CN1C=C(C(=O)O)C(CO)=N1 B059380 [0,1,0,0,0,0|3,0,0]=4 46 B11R1.50 CCN1C=C(C(=O)Cl)C(C)=N1 B011564 [0,1,0,0,0,0|3,0,0]=4 47 B11R1.50 CCN1C=C(C(=O)O)C(C)=N1 B000217 [0,1,0,0,0,0|3,0,0]=4 48 B11R1.50 CCN1C=C(C(C)=O)C(C)=N1 B007421 [0,1,0,0,0,0|2,0,0]=3 49 B11R1.225 CC1=NN(C)C(C(=O)NN)=C1 B006469 [0,1,0,0,0,0|3,0,0]=4 50 B11R1.225 CC1=NN(C)C=C1C(=O)NN B006709 [0,1,0,0,0,0|3,0,0]=4 51 B11R1.225 CC1=NN(C)C=C1\C(C)=N/O B015956 [0,1,0,0,0,0|2,0,1]=4 52 B11R1.225 CCC(=O)C1=CN(C)N=C1C B036166 [0,1,0,0,0,0|2,0,0]=3 53 B11R1.225 CNC(=O)C1=CC(N)=NN1C B046748 [0,1,0,0,0,0|3,0,0]=4 54 B11R1.225 CNC(=O)C1=CN(C)N=C1N B062640 [0,1,0,0,0,0|3,0,0]=4 55 B11R1.225 COC(=O)C1=C(C)N=C(N)S1 B000344 [0,1,0,0,0,0|3,0,0]=4 56 B11R1.225 COC(=O)C1=C(N)SC(C)=C1 B000748 [0,1,0,0,0,0|1,1,0]=3 57 B11R1.225 COC(=O)C1=CC(C)=NN1C B030227 [0,1,0,0,0,0|2,0,0]=3 58 B11R1.225 COC(=O)C1=CC(N)=NN1C B047489 [0,1,0,0,0,0|3,0,0]=4 59 B11R1.225 COC(=O)C1=CN(C)N=C1Br B059832 [0,1,0,0,0,0|3,0,0]=4 60 B11R1.225 COC(=O)C1=CN(C)N=C1C B035653 [0,1,0,0,0,0|2,0,0]=3 61 B11R1.225 COC(=O)C1=CN(C)N=C1I B059931 [0,1,0,0,0,0|3,0,0]=4 62 B11R1.225 COC(=O)C1=CN(C)N=C1N B051794 [0,1,0,0,0,0|3,0,0]=4 63 B11R1.673 CC(=O)C1=C(C)N(C)N=C1C B018671 [0,1,0,0,0,0|2,0,0]=3 64 B11R1.673 CC1=C(C)C(C(N)=O)=C(N)S1 B000687 [0,1,0,0,0,0|2,1,0]=4 65 B11R1.673 CC1=NN(C)C(C(=O)Cl)=C1Br B011559 [0,1,0,0,0,0|3,0,0]=4 66 B11R1.673 CC1=NN(C)C(C(=O)O)=C1Br B000212 [0,1,0,0,0,0|3,0,0]=4 67 B11R1.673 CC1=NN(C)C(C(=O)O)=C1Cl B000151 [0,1,0,0,0,0|3,0,0]=4 68 B11R1.673 CC1=NN(C)C(C)=C1C(=O)Cl B011778 [0,1,0,0,0,0|3,0,0]=4 69 B11R1.673 CC1=NN(C)C(C)=C1C(=O)O B006363 [0,1,0,0,0,0|3,0,0]=4 70 B11R1.673 CC1=NN(C)C(F)=C1C(=O)Cl B051235 [0,1,0,0,0,0|3,0,0]=4 71 B11R1.673 CC1=NN(C)C(F)=C1C(=O)O B051234 [0,1,0,0,0,0|3,0,0]=4 72 B11R1.166 CC1=CC(C)=C(C(C)N)C=C1 B006832 [0,0,0,0,0,1|2,0,1]=4 73 B11R1.645 CC(=O)CN1N=C(C)C=C1C B021107 [0,0,0,0,0,1|3,0,0]=4 74 B11R1.645 CC1=NN(C)C(CC(=O)O)=C1 B047378 [0,0,0,0,0,1|3,0,0]=4 75 B8R1.1 CC1=CC=C(C=O)S1 B015983 [2,0,0,0,0,0|2,0,0]=4 76 B8R1.1 CC1=NNC(C=O)=C1 B014001 [2,0,0,0,0,0|2,0,0]=4 77 B8R1.1 CN1C=C(C=O)C=N1 B000400 [2,0,0,0,0,0|2,0,0]=4 78 B8R1.1 O=CC1=CSC(Br)=C1 B059806 [2,0,0,0,0,0|1,1,0]=4 79 B8R1.11 CC1=C(C=O)C=NN1 B034879 [2,0,0,0,0,0|2,0,0]=4 80 B8R1.11 CC1=C(C=O)C=NN1 B047429 [2,0,0,0,0,0|2,0,0]=4 81 B8R1.11 CN1N=CC=C1C=O B007393 [2,0,0,0,0,0|2,0,0]=4 82 B10R1.35 CCN1C=C(C=O)C(C)=N1 B000391 [1,1,0,0,0,0|2,0,0]=4 83 B10R1.256 C(=O)C1=C(F)N(C)N=C1C B051233 [1,1,0,0,0,0|2,0,0]=4 84 B10R1.256 CC1=NN(C)C(C)=C1C=O B006543 [1,1,0,0,0,0|2,0,0]=4 85 B10R1.256 CC1=NN(C)C(C=O)=C1Cl B046351 [1,1,0,0,0,0|2,0,0]=4 86 B10R1.14 CC1=CC(C(=O)NN)=NO1 B007474 [1,1,0,0,0,0|2,0,0]=4 87 B10R1.14 CCC(=O)C1=CN(C)N=C1 B036111 [1,1,0,0,0,0|2,0,0]=4 88 B10R1.14 COC(=O)C1=CC(C)=NN1 B024667 [1,1,0,0,0,0|2,0,0]=4 89 B10R1.14 COC(=O)C1=CC(C)=NO1 B038460 [1,1,0,0,0,0|2,0,0]=4 90 B10R1.14 COC(=O)C1=CN(C)N=C1 B051307 [1,1,0,0,0,0|2,0,0]=4 91 B10R1.14 COC(=O)C1=NOC(C)=C1 B007472 [1,1,0,0,0,0|1,0,0]=3 92 B10R1.31 CC(=O)C1=CC(CO)=CS1 B050197 [1,1,0,0,0,0|2,0,0]=4 93 B10R1.31 CCC1=CC=C(C(C)=O)S1 B020337 [1,1,0,0,0,0|2,0,0]=4 94 B10R1.31 CCN1C=C(C(C)=O)C=N1 B007419 [1,1,0,0,0,0|2,0,0]=4 95 B10R1.31 NC(=O)C1=NOC(CO)=C1 B050337 [1,1,0,0,0,0|2,0,0]=4 96 B10R1.31 O=C(O)C1=NOC(CO)=C1 B050339 [1,1,0,0,0,0|2,0,0]=4 97 B10R1.58 CC(=O)C1=NN(C)C(C)=C1 B059391 [1,1,0,0,0,0|2,0,0]=4 98 B10R1.194 CC(=O)C1=C(C)N(C)N=C1 B007422 [1,1,0,0,0,0|2,0,0]=4 99 B10R1.194 CC1=C(Br)C(C(=O)O)=NO1 B047202 [1,1,0,0,0,0|2,0,0]=4 100 B10R1.194 CC1=C(C)C(C(=O)O)=CS1 B007490 [1,1,0,0,0,0|1,1,0]=4 101 B10R1.194 CC1=C(C)C(C(=O)O)=NO1 B022861 [1,1,0,0,0,0|2,0,0]=4 102 B10R1.39 CCN1N=CC=C1C(C)=O B016266 [1,1,0,0,0,0|2,0,0]=4 103 B10R1.149 COC(=O)C1=CC=NN1C B016222 [1,1,0,0,0,0|2,0,0]=4 104 B10R1.192 CC(=O)C1=C(Br)C=NN1C B017918 [1,1,0,0,0,0|2,0,0]=4 105 B10R1.192 CC(=O)C1=C(Cl)C=NN1C B017917 [1,1,0,0,0,0|2,0,0]=4 106 B10R1.192 CC(=O)C1=C(I)C=NN1C B047751 [1,1,0,0,0,0|2,0,0]=4 107 B10R1.192 CC1=NOC(C)=C1C(=O)O B007458 [1,1,0,0,0,0|2,0,0]=4 108 B12R1.1926 CCN1N=C(C)C=C1C(=O)OC B036659 [0,2,0,0,0,0|2,0,0]=4 109 B12R1.1926 COC(=O)C1=CN(C)N=C1CCl B060147 [0,2,0,0,0,0|2,0,0]=4 110 B12R1.1926 COC(=O)C1=CN(C)N=C1CO B059392 [0,2,0,0,0,0|2,0,0]=4 111 B12R1.111 CC(=O)C1=CC(C(C)C)=NN1C B058995 [0,2,0,0,0,0|2,0,0]=4 112 B12R1.277 CCCN1C=C(C(C)=O)C(C)=N1 B021124 [0,2,0,0,0,0|2,0,0]=4 113 B12R1.608 CCC(=O)C1=CN(CC)N=C1C B038192 [0,2,0,0,0,0|2,0,0]=4 114 B12R1.608 CCC1=CC(C(=O)OC)=C(N)S1 B000749 [0,2,0,0,0,0|1,1,0]=4 115 B12R1.608 CCN1C=C(C(=O)OC)C(C)=N1 B035851 [0,2,0,0,0,0|2,0,0]=4 116 B12R1.1979 CCN1N=C(C)C(C(C)=O)=C1C B028618 [0,2,0,0,0,0|2,0,0]=4 117 B12R1.313 CC1=NN(C)C=C1C(=O)CC#N B051264 [0,2,0,0,0,0|2,0,0]=4 118 B12R1.313 CCOC(=O)C1=C(N)SC(C)=C1 B000754 [0,2,0,0,0,0|1,1,0]=4 119 B12R1.313 CCOC(=O)C1=CC(C)=NN1C B001425 [0,2,0,0,0,0|2,0,0]=4 120 B12R1.3443 COC(=O)C1=C(F)N(C)N=C1C B052538 [0,2,0,0,0,0|2,0,0]=4 121 B12R1.3443 COC(=O)C1=C(N)SC(C)=C1C B000679 [0,2,0,0,0,0|1,1,0]=4