0 B9R1.35 CC(=O)C1=CC(Br)=CS1 BBL104318 [0,0,0,0,0,0|4,0,0]=4 1 B9R1.35 CC(=O)C1=CC=C(C)O1 BBL027428 [0,0,0,0,0,0|4,0,0]=4 2 B9R1.35 CC(=O)C1=CN(C)N=C1 BBL028299 [0,0,0,0,0,0|3,0,1]=4 3 B9R1.35 CC1=CC(C(=O)Cl)=CS1 BBL014946 [0,0,0,0,0,0|3,0,0]=3 4 B9R1.35 CC1=CC(C(=O)Cl)=NO1 BBL014478 [0,0,0,0,0,0|2,0,0]=2 5 B9R1.35 CC1=CC(C(=O)O)=NO1 BBL015822 [0,0,0,0,0,0|1,0,0]=1 6 B9R1.35 CC1=CC=C(C(=O)Cl)S1 BBL014853 [0,0,0,0,0,0|4,0,0]=4 7 B9R1.35 CC1=CC=C(C(=O)O)S1 BBL037421 [0,0,0,0,0,0|3,0,0]=3 8 B9R1.35 CC1=NC(C(=O)O)=CO1 BBL028443 [0,0,0,0,0,0|3,0,0]=3 9 B9R1.35 CC1=NC(C(=O)O)=NN1 BBL032381 [0,0,0,0,0,0|1,0,0]=1 10 B9R1.35 CC1=NNC([N+](=O)[O-])=C1 BBL013080 [0,0,0,0,0,0|1,0,3]=4 11 B9R1.35 CC1=NOC(C(=O)O)=C1 BBL016103 [0,0,0,0,0,0|1,0,1]=2 12 B9R1.35 CN1C=C(C(=O)Cl)C=N1 BBL041082 [0,0,0,0,0,0|3,0,1]=4 13 B9R1.35 NC1=CC(C(=O)O)=NN1 BBL038225 [0,0,0,0,0,0|1,0,0]=1 14 B9R1.35 NC1=NC(C(=O)O)=CS1 BBL003682 [0,0,0,0,0,0|4,0,0]=4 15 B9R1.35 NC1=NN=C(C(=O)O)N1 BBL001452 [0,0,0,0,0,0|2,0,1]=3 16 B9R1.35 O=C(O)C1=CC(Br)=CS1 BBL038304 [0,0,0,0,0,0|3,0,0]=3 17 B9R1.35 O=C(O)C1=CC(Cl)=CN1 BBL025690 [0,0,0,0,0,0|2,0,1]=3 18 B9R1.35 O=C(O)C1=CC(Cl)=NO1 BBL029454 [0,0,0,0,0,0|2,0,1]=3 19 B9R1.35 O=C(O)C1=CC=C(Br)O1 BBL009134 [0,0,0,0,0,0|4,0,0]=4 20 B9R1.35 O=C(O)C1=CC=C(Br)S1 BBL016317 [0,0,0,0,0,0|4,0,0]=4 21 B9R1.35 O=C(O)C1=CC=C(Cl)S1 BBL037515 [0,0,0,0,0,0|4,0,0]=4 22 B9R1.35 O=C(O)C1=CC=C(F)S1 BBL040753 [0,0,0,0,0,0|4,0,0]=4 23 B9R1.35 O=C(O)C1=CN=C(Br)S1 BBL010885 [0,0,0,0,0,0|3,0,1]=4 24 B9R1.35 O=C(O)C1=CSC(Br)=N1 BBL010836 [0,0,0,0,0,0|4,0,0]=4 25 B9R1.35 O=C(O)C1=NNC(Br)=N1 BBL031758 [0,0,0,0,0,0|2,0,0]=2 26 B9R1.35 O=C(O)C1=NNC(O)=N1 BBL025792 [0,0,0,0,0,0|2,0,0]=2 27 B9R1.35 O=C1C=C(C(=O)O)NN1 BBL010248 [0,0,0,0,0,0|1,0,1]=2 28 B9R1.35 O=C1NC=C(C(=O)O)N1 BBL003459 [0,0,0,0,0,0|3,0,0]=3 29 B9R1.35 O=C1NN=C(C(=O)[O-])N1 BBL033572 [0,0,0,0,0,0|2,0,1]=3 30 B9R1.35 O=[N+]([O-])C1=NNC(Br)=N1 BBL004031 [0,0,0,0,0,0|3,0,1]=4 31 B8R1.1 CC1=CC=C(C=O)N1 BBL011859 [1,0,0,0,0,0|3,0,0]=4 32 B8R1.1 CC1=CN(CO)N=C1 BBL040434 [1,0,0,0,0,0|2,0,1]=4 33 B8R1.1 NC1=NC(CO)=NN1 BBL013223 [1,0,0,0,0,0|2,0,1]=4 34 B8R1.7 CC(=O)C1=CC=CN1 BBL010104 [1,0,0,0,0,0|2,0,1]=4 35 B8R1.7 CS(=O)C1=NNC=N1 BBL013230 [1,0,0,0,0,0|3,0,0]=4 36 B8R1.7 O=C(Cl)C1=CC=CS1 BBL011388 [1,0,0,0,0,0|3,0,0]=4 37 B8R1.7 O=C(Cl)C1=CSN=N1 BBL010219 [1,0,0,0,0,0|2,0,1]=4 38 B8R1.7 O=C(O)C1=CC=CO1 BBL009679 [1,0,0,0,0,0|2,0,0]=3 39 B8R1.7 O=C(O)C1=CNN=C1 BBL104304 [1,0,0,0,0,0|2,0,0]=3 40 B8R1.7 O=C(O)C1=COC=C1 BBL025800 [1,0,0,0,0,0|2,0,0]=3 41 B8R1.7 O=C(O)C1=CSN=N1 BBL010216 [1,0,0,0,0,0|1,0,1]=3 42 B8R1.7 O=C(O)C1=NN=CN1 BBL033501 [1,0,0,0,0,0|1,0,1]=3 43 B8R1.7 O=[N+]([O-])C1=NNC=N1 BBL010181 [1,0,0,0,0,0|2,0,1]=4 44 B10R1.14 CC1=CC(C(=O)NN)=CS1 BBL017214 [0,1,0,0,0,0|3,0,0]=4 45 B10R1.14 CC1=CC(C(=O)NN)=NO1 BBL016191 [0,1,0,0,0,0|2,0,0]=3 46 B10R1.14 CC1=NNC(C(=O)NN)=C1 BBL012753 [0,1,0,0,0,0|1,0,2]=4 47 B10R1.14 COC(=O)C1=NNC(C)=C1 BBL030093 [0,1,0,0,0,0|0,0,0]=1 48 B10R1.14 COC(=O)C1=NNC(C)=N1 BBL035269 [0,1,0,0,0,0|1,0,0]=2 49 B10R1.14 COC(=O)C1=NNC(N)=C1 BBL040969 [0,1,0,0,0,0|1,0,0]=2 50 B10R1.14 COC(=O)C1=NNC(N)=N1 BBL005409 [0,1,0,0,0,0|2,0,0]=3 51 B10R1.14 O=C(NO)C1=NNC(Cl)=N1 BBL032997 [0,1,0,0,0,0|2,0,0]=3 52 B10R1.31 CCC1=CC(C(=O)Cl)=CS1 BBL014950 [0,1,0,0,0,0|3,0,0]=4 53 B10R1.31 CCC1=CC(C(=O)O)=CS1 BBL015797 [0,1,0,0,0,0|2,0,0]=3 54 B10R1.31 CCC1=CC(C(=O)O)=NO1 BBL015883 [0,1,0,0,0,0|1,0,0]=2 55 B10R1.31 CCC1=CC=C(C(=O)O)S1 BBL028250 [0,1,0,0,0,0|3,0,0]=4 56 B10R1.31 CCN1C=C(C(=O)O)C=N1 BBL015059 [0,1,0,0,0,0|2,0,1]=4 57 B10R1.31 N#CC1=CNC(C(=O)O)=C1 BBL025905 [0,1,0,0,0,0|1,0,2]=4 58 B10R1.31 O=C(O)C1=CC=C(CO)O1 BBL015780 [0,1,0,0,0,0|3,0,0]=4 59 B10R1.31 O=C(O)C1=CN(CO)N=C1 BBL010160 [0,1,0,0,0,0|2,0,1]=4 60 B10R1.55 CC1=CC(C(F)(F)Cl)=NN1 BBL104308 [0,1,0,0,0,0|2,0,1]=4 61 B10R1.58 CC1=CC([N+](=O)[O-])=NN1C BBL038665 [0,1,0,0,0,0|1,0,1]=3 62 B10R1.58 CN1N=C(C(=O)O)N=C1Br BBL036496 [0,1,0,0,0,0|2,0,0]=3 63 B10R1.58 CN1N=C(C(=O)O)N=C1Cl BBL036485 [0,1,0,0,0,0|2,0,0]=3 64 B10R1.58 CN1N=C(C(=O)O)N=C1O BBL036486 [0,1,0,0,0,0|2,0,0]=3 65 B10R1.58 CN1N=C(C(N)=O)N=C1Cl BBL036762 [0,1,0,0,0,0|3,0,0]=4 66 B10R1.58 O=C(O)C1=CC(Br)=C(Br)S1 BBL038338 [0,1,0,0,0,0|3,0,0]=4 67 B10R1.59 CC(=O)C1=CC(C)=NN1C BBL038942 [0,1,0,0,0,0|1,0,2]=4 68 B10R1.59 CC1=CC(C(=O)Cl)=C(C)O1 BBL014856 [0,1,0,0,0,0|3,0,0]=4 69 B10R1.59 CC1=CC(C(=O)O)=C(C)N1 BBL012869 [0,1,0,0,0,0|1,0,0]=2 70 B10R1.59 CC1=CC(C(=O)O)=C(C)O1 BBL014473 [0,1,0,0,0,0|2,0,0]=3 71 B10R1.59 CC1=CC(C(=O)O)=C(N)S1 BBL015798 [0,1,0,0,0,0|2,0,0]=3 72 B10R1.59 CC1=CC(C(N)=O)=C(N)S1 BBL025808 [0,1,0,0,0,0|3,0,0]=4 73 B10R1.59 CC1=NC(C(=O)O)=C(C)S1 BBL031605 [0,1,0,0,0,0|3,0,0]=4 74 B10R1.59 CC1=NC(C)=C(C(=O)O)O1 BBL030451 [0,1,0,0,0,0|2,0,1]=4 75 B10R1.59 CN1C=C(Br)C=C1C(=O)O BBL030879 [0,1,0,0,0,0|2,0,1]=4 76 B10R1.59 CN1C=C(Cl)C=C1C(=O)O BBL025924 [0,1,0,0,0,0|2,0,1]=4 77 B10R1.59 CN1N=C(N)C=C1C(=O)O BBL040299 [0,1,0,0,0,0|1,0,2]=4 78 B10R1.194 CC1=C(Br)C(C(=O)O)=NN1 BBL011308 [0,1,0,0,0,0|0,0,0]=1 79 B10R1.194 CC1=C(C(=O)O)NNC1=O BBL031926 [0,1,0,0,0,0|1,0,1]=3 80 B10R1.194 CC1=C(C)C(C(=O)Cl)=CS1 BBL014947 [0,1,0,0,0,0|3,0,0]=4 81 B10R1.194 CC1=C(C)C(C(=O)O)=CS1 BBL016567 [0,1,0,0,0,0|2,0,0]=3 82 B10R1.194 CC1=C(Cl)C(C(=O)O)=NN1 BBL013035 [0,1,0,0,0,0|0,0,0]=1 83 B10R1.194 CC1=C(Cl)C([N+](=O)[O-])=NN1 BBL038360 [0,1,0,0,0,0|1,0,1]=3 84 B10R1.194 CC1=NNC(C(=O)O)=C1I BBL032834 [0,1,0,0,0,0|0,0,2]=3 85 B10R1.194 CC1=NNC(C(N)=O)=C1Br BBL034956 [0,1,0,0,0,0|1,0,2]=4 86 B10R1.194 CN1N=CC(C(=O)O)=C1N BBL029100 [0,1,0,0,0,0|2,0,1]=4 87 B10R1.194 NC1=NNC(C(=O)O)=C1Cl BBL039460 [0,1,0,0,0,0|1,0,2]=4 88 B10R1.194 O=C(O)C1=C(Br)C(Br)=NN1 BBL039262 [0,1,0,0,0,0|1,0,2]=4 89 B8R0.23 C\C(=C/C(=O)O)C(=O)O BBL023435 [0,0,1,0,0,0|3,0,0]=4 90 B10R1.13 CC1=CC=C(C(=O)Cl)C=C1 BBL027306 [0,0,0,0,0,1|3,0,0]=4 91 B10R1.13 CC1=CC=C(C(N)=O)C=N1 BBL100086 [0,0,0,0,0,1|2,0,1]=4 92 B10R1.13 NC1=NC=C(C(=O)O)C=C1 BBL018585 [0,0,0,0,0,1|2,0,1]=4 93 B10R1.13 O=C(O)C1=CC=C(O)C=C1 BBL011981 [0,0,0,0,0,1|3,0,0]=4 94 B10R1.13 O=C1C=CC(C(=O)O)=CN1 BBL001444 [0,0,0,0,0,1|2,0,0]=3 95 B10R1.13 O=C1C=CC(C(=O)O)=CO1 BBL009090 [0,0,0,0,0,1|3,0,0]=4 96 B10R1.13 O=C1C=CC(C(=O)O)=NN1 BBL015079 [0,0,0,0,0,1|1,0,0]=2 97 B10R1.13 O=C1CCC(C(=O)O)=NN1 BBL012242 [0,0,0,0,0,1|1,0,1]=3 98 B10R1.54 CC1=CN(CC(=O)Cl)N=C1 BBL040183 [0,0,0,0,0,1|3,0,0]=4 99 B10R1.54 CC1=CN(CC(=O)O)N=C1 BBL029986 [0,0,0,0,0,1|2,0,0]=3 100 B10R1.54 CC1=NC(CC(=O)O)=CS1 BBL029738 [0,0,0,0,0,1|3,0,0]=4 101 B10R1.54 NC(=O)CC1=NNC(N)=N1 BBL032996 [0,0,0,0,0,1|3,0,0]=4 102 B10R1.54 NC1=CN(CC(=O)O)N=C1 BBL040383 [0,0,0,0,0,1|3,0,0]=4 103 B10R1.54 NC1=NC(CC(=O)O)=NN1 BBL013222 [0,0,0,0,0,1|2,0,0]=3 104 B10R1.54 NC1=NN=C(CC(=O)O)S1 BBL020168 [0,0,0,0,0,1|2,0,1]=4 105 B10R1.54 O=C(O)CC1=CC(=O)NN1 BBL034976 [0,0,0,0,0,1|1,0,1]=3 106 B10R1.54 O=C(O)CN1C=C(Br)C=N1 BBL008593 [0,0,0,0,0,1|3,0,0]=4 107 B10R1.54 O=C(O)CN1C=C(Cl)C=N1 BBL016031 [0,0,0,0,0,1|3,0,0]=4 108 B10R1.54 O=C(O)CN1C=C(I)C=N1 BBL036698 [0,0,0,0,0,1|3,0,0]=4 109 B10R1.113 CC1=CC=CC(C(=O)O)=N1 BBL023748 [0,0,0,0,0,1|3,0,0]=4 110 B10R1.113 NC1=CC(C(=O)O)=CN=C1 BBL011806 [0,0,0,0,0,1|2,0,0]=3 111 B10R1.113 NC1=CC=CC(C(=O)O)=C1 BBL037339 [0,0,0,0,0,1|3,0,0]=4 112 B10R1.113 NC1=NC=CC(C(=O)O)=C1 BBL009435 [0,0,0,0,0,1|2,0,1]=4 113 B10R1.113 O=C(O)C1=CC(Br)=CC=C1 BBL025793 [0,0,0,0,0,1|3,0,0]=4 114 B10R1.113 O=C(O)C1=CC(O)=CC=C1 BBL011983 [0,0,0,0,0,1|3,0,0]=4 115 B10R1.113 O=C(O)C1=CC(O)=CN=C1 BBL010930 [0,0,0,0,0,1|2,0,0]=3 116 B7R0.4 C\C=C\C=C/C(=O)O BBL011617 [1,0,1,0,0,0|2,0,0]=4 117 B7R0.5 CCNC(=O)C(=O)O BBL005118 [1,0,1,0,0,0|1,0,1]=4 118 B7R1.1 O=CC1=CNN=C1 BBL038290 [2,0,0,0,0,0|2,0,0]=4 119 B7R1.1 O=CC1=CSC=C1 BBL012656 [2,0,0,0,0,0|2,0,0]=4 120 B7R1.2 CC1=CC(O)=NO1 BBL033480 [2,0,0,0,0,0|1,0,0]=3 121 B7R1.2 CC1=NC(Br)=NN1 BBL032367 [2,0,0,0,0,0|2,0,0]=4 122 B7R1.2 CC1=NNC(N)=C1 BBL010620 [2,0,0,0,0,0|1,0,1]=4 123 B7R1.2 NC1=CC(O)=NO1 BBL028339 [2,0,0,0,0,0|2,0,0]=4 124 B7R1.2 OC1=NNC(Br)=N1 BBL033636 [2,0,0,0,0,0|2,0,0]=4 125 B9R1.22 CC1=CC(C=O)=C(C)N1 BBL012646 [1,1,0,0,0,0|1,0,0]=3 126 B9R1.22 CC1=CC(C=O)=C(C)S1 BBL039889 [1,1,0,0,0,0|2,0,0]=4 127 B9R1.22 CC1=NN(C)C(C=O)=C1 BBL104313 [1,1,0,0,0,0|0,0,2]=4 128 B9R1.23 CC1=CC(C=O)=NN1C BBL039105 [1,1,0,0,0,0|0,0,0]=2 129 B9R1.23 CC1=CC(CN)=NN1C BBL039181 [1,1,0,0,0,0|1,0,1]=4 130 B9R1.11 COC(=O)C1=CNN=C1 BBL038232 [1,1,0,0,0,0|2,0,0]=4 131 B9R1.41 CC1=NNC=C1C(=O)O BBL011874 [1,1,0,0,0,0|2,0,0]=4 132 B9R1.41 CC1=NNN=C1C(=O)O BBL030286 [1,1,0,0,0,0|1,0,0]=3 133 B9R1.41 CC1=NON=C1C(=O)O BBL028634 [1,1,0,0,0,0|2,0,0]=4 134 B9R1.41 NC1=C(C(=O)O)C=NN1 BBL018009 [1,1,0,0,0,0|2,0,0]=4 135 B9R1.41 NC1=NON=C1C(=O)O BBL012636 [1,1,0,0,0,0|2,0,0]=4 136 B9R1.41 O=C(Cl)C1=NNC=C1Cl BBL039671 [1,1,0,0,0,0|1,0,0]=3 137 B9R1.41 O=C(O)C1=C(I)C=NN1 BBL016065 [1,1,0,0,0,0|0,0,2]=4 138 B9R1.41 O=[N+]([O-])C1=NNC=C1Br BBL039424 [1,1,0,0,0,0|1,0,1]=4 139 B11R1.3 COC1=NC=C(C(=O)O)C=C1 BBL004515 [0,1,0,0,0,1|1,0,1]=4 140 B11R1.21 CC1=CC=C(C(=O)O)C=C1N BBL009326 [0,1,0,0,0,1|2,0,0]=4 141 B11R1.21 CC1=CN=C(C(=O)O)C=[N+]1[O-] BBL009924 [0,1,0,0,0,1|1,0,0]=3 142 B11R1.21 CN1N=C(C(=O)O)C=CC1=O BBL012020 [0,1,0,0,0,1|1,0,0]=3 143 B11R1.166 CC1=CC=C(C(=O)O)C(=O)N1 BBL028630 [0,1,0,0,0,1|1,0,0]=3 144 B11R1.166 NC1=NC=C(C(=O)O)C(=O)N1 BBL011914 [0,1,0,0,0,1|2,0,0]=4 145 B11R1.166 O=C1NC=C(C(=O)O)C(=O)N1 BBL009640 [0,1,0,0,0,1|2,0,0]=4 146 B11R1.39 COC(=O)CC1=NNC(N)=N1 BBL033152 [0,1,0,0,0,1|2,0,0]=4 147 B11R1.314 CC1=CN(C(C)C(=O)O)N=C1 BBL038573 [0,1,0,0,0,1|2,0,0]=4 148 B11R1.74 CC1=CC(C(=O)O)=CC(=O)N1 BBL031017 [0,1,0,0,0,1|1,0,0]=3 149 B11R1.74 CC1=NC(O)=NC(C(=O)O)=C1 BBL030988 [0,1,0,0,0,1|0,0,1]=3 150 B11R1.74 O=C1C=C(C(=O)O)NC(=O)N1 BBL013050 [0,1,0,0,0,1|1,0,1]=4 151 B11R1.159 CC1=CC=CC(C(=O)O)=C1O BBL023681 [0,1,0,0,0,1|2,0,0]=4 152 B11R1.167 CC1=CC=C(O)C(C(=O)O)=C1 BBL027383 [0,1,0,0,0,1|2,0,0]=4 153 B11R1.167 O=C(O)C1=CC(Br)=CN=C1O BBL009282 [0,1,0,0,0,1|2,0,0]=4 154 B11R1.266 COC1=NC=CC(C(=O)O)=C1 BBL013255 [0,1,0,0,0,1|1,0,1]=4 155 B11R1.266 NCC1=CC=CC(C(=O)O)=C1 BBL010150 [0,1,0,0,0,1|2,0,0]=4 156 B11R1.266 O=C(O)C1=CC(CBr)=CC=C1 BBL104328 [0,1,0,0,0,1|2,0,0]=4 157 B11R1.15 CCOC(=O)C1=CC(C)=NN1 BBL008948 [0,2,0,0,0,0|0,0,2]=4 158 B11R1.15 CCOC(=O)C1=CC(C)=NO1 BBL004014 [0,2,0,0,0,0|1,0,1]=4 159 B11R1.15 CCOC(=O)C1=NNC(N)=C1 BBL040905 [0,2,0,0,0,0|1,0,0]=3 160 B11R1.15 CCOC(=O)C1=NOC(C)=C1 BBL008537 [0,2,0,0,0,0|1,0,0]=3 161 B11R1.44 COC(=O)C1=CC(CCl)=CS1 BBL010192 [0,2,0,0,0,0|2,0,0]=4 162 B11R1.225 COC(=O)C1=CC(C)=NN1C BBL030468 [0,2,0,0,0,0|0,0,2]=4 163 B11R1.226 COC(=O)C1=NN(C)C(Br)=N1 BBL036839 [0,2,0,0,0,0|2,0,0]=4 164 B11R1.226 COC(=O)C1=NN(C)C(Cl)=N1 BBL036876 [0,2,0,0,0,0|2,0,0]=4 165 B11R1.865 COC(=O)C1=C(Cl)C(C)=NN1 BBL036512 [0,2,0,0,0,0|0,0,2]=4 166 B11R1.865 COC(=O)C1=C(I)C(C)=NN1 BBL036513 [0,2,0,0,0,0|0,0,2]=4 167 B11R1.865 COC(=O)C1=NNC(C)=C1Br BBL011309 [0,2,0,0,0,0|0,0,0]=2 168 B11R1.865 NNC(=O)C1=NNC(Br)=C1Br BBL039298 [0,2,0,0,0,0|2,0,0]=4 169 B11R1.48 CC1=CC([N+](=O)[O-])=NN1CO BBL013107 [0,2,0,0,0,0|1,0,1]=4 170 B11R1.48 CCN1N=C(C(=O)O)C=C1C BBL031015 [0,2,0,0,0,0|0,0,0]=2 171 B11R1.48 COC1=NC(C(=O)O)=NN1C BBL036735 [0,2,0,0,0,0|1,0,0]=3 172 B11R1.124 CCCC1=CC(C(=O)O)=CS1 BBL013931 [0,2,0,0,0,0|2,0,0]=4 173 B11R1.124 CCCC1=CC(C(=O)O)=NN1 BBL031087 [0,2,0,0,0,0|0,0,0]=2 174 B11R1.124 CCCC1=CC(C(=O)O)=NO1 BBL039456 [0,2,0,0,0,0|1,0,0]=3 175 B11R1.175 CC(C)C1=CC(C(=O)O)=CS1 BBL016195 [0,2,0,0,0,0|2,0,0]=4 176 B11R1.175 CC(C)C1=NNC(C(=O)O)=C1 BBL008246 [0,2,0,0,0,0|0,0,2]=4 177 B11R1.175 O=C(O)C1=CC(C(=O)O)=NN1 BBL013494 [0,2,0,0,0,0|0,0,1]=3 178 B11R1.473 CCC1=NNC(C(=O)O)=C1Br BBL035089 [0,2,0,0,0,0|0,0,2]=4 179 B11R1.49 CCN1N=C(C)C=C1C(=O)O BBL010154 [0,2,0,0,0,0|0,0,2]=4 180 B11R1.673 CC1=NN(C)C(C(=O)O)=C1Br BBL013086 [0,2,0,0,0,0|0,0,2]=4 181 B11R1.64 CCC1=C(C)SC=C1C(=O)O BBL016193 [0,2,0,0,0,0|2,0,0]=4 182 B11R1.64 COC1=C(C(=O)O)SC=C1C BBL041000 [0,2,0,0,0,0|2,0,0]=4 183 B9R1.13 O=C(O)CC1=CSC=C1 BBL025878 [1,0,0,0,0,1|2,0,0]=4 184 B9R1.13 O=C(O)CN1C=CC=N1 BBL008568 [1,0,0,0,0,1|2,0,0]=4 185 B11R1.75 CC1=NN=C(SCC(=O)O)O1 BBL036104 [0,0,0,0,0,2|1,0,1]=4 186 B11R1.75 CC1=NN=C(SCC(=O)O)S1 BBL038199 [0,0,0,0,0,2|1,0,1]=4 187 B11R1.75 NC1=NC(CCC(=O)O)=NN1 BBL013126 [0,0,0,0,0,2|2,0,0]=4 188 B11R1.75 NC1=NC(\C=C/C(=O)O)=NN1 BBL033132 [0,0,0,0,0,2|2,0,0]=4 189 B11R1.75 O=C(O)CCC1=NNC(S)=N1 BBL033537 [0,0,0,0,0,2|2,0,0]=4