0 B12R2.24 BrC1=CC2=C(C=CC=C2)C=N1 SY009417 [0,0,0,0,0,0|3,0,1]=4 1 B12R2.24 BrC1=NC2=C(C=CC=C2)C=C1 SY019854 [0,0,0,0,0,0|2,0,2]=4 2 B12R2.24 BrC1=NC2=CC=CC=C2N=C1 SY021711 [0,0,0,0,0,0|3,0,1]=4 3 B12R2.24 BrC1CCC2=C(C=CC=C2)C1 SY297477 [0,0,0,0,0,0|2,0,1]=3 4 B12R2.24 CC1=CC2=CC=CC=C2N=C1 SY048469 [0,0,0,0,0,0|3,0,1]=4 5 B12R2.24 CC1CCC2=C(C=CC=C2)N1 SY045570 [0,0,0,0,0,0|2,0,1]=3 6 B12R2.24 ClC1=CC2=C(C=CC=C2)C=N1 SY005184 [0,0,0,0,0,0|3,0,1]=4 7 B12R2.24 ClC1=CC2=CC=CC=C2N=C1 SY021114 [0,0,0,0,0,0|3,0,1]=4 8 B12R2.24 ClC1=CC=C2C=CC=CC2=C1 SY055345 [0,0,0,0,0,0|2,0,2]=4 9 B12R2.24 ClC1=CN=C2C=CC=CC2=N1 SY014068 [0,0,0,0,0,0|3,0,1]=4 10 B12R2.24 ClC1=NC2=CC=CC=C2C=C1 SY001152 [0,0,0,0,0,0|2,0,2]=4 11 B12R2.24 ClC1=NC=C2C=CC=CC2=N1 SY004996 [0,0,0,0,0,0|3,0,1]=4 12 B12R2.24 FC1=CC2=CC=CC=C2N=C1 SY260141 [0,0,0,0,0,0|3,0,1]=4 13 B12R2.24 IC1=CC2=CC=CC=C2N=C1 SY191981 [0,0,0,0,0,0|3,0,1]=4 14 B12R2.24 IC1=CC=C2C=CC=CC2=C1 SY103936 [0,0,0,0,0,0|2,0,2]=4 15 B12R2.24 NC1=CC2=C(C=CC=C2)C=N1 SY030951 [0,0,0,0,0,0|3,0,1]=4 16 B12R2.24 NC1=NC=C2C=CC=CC2=N1 SY109190 [0,0,0,0,0,0|3,0,1]=4 17 B12R2.24 NC1CCC2=C(C=CC=C2)C1 SY031850 [0,0,0,0,0,0|2,0,1]=3 18 B12R2.24 N[C@@H]1CCC2=C(C=CC=C2)C1 SY118721 [0,0,0,0,0,0|2,0,1]=3 19 B12R2.24 N[C@@H]1COC2=C(C=CC=C2)C1 SY021954 [0,0,0,0,0,0|3,0,1]=4 20 B12R2.24 O=C1C=CC2=C(C=CN=C2)N1 SY129309 [0,0,0,0,0,0|2,0,2]=4 21 B12R2.24 O=C1C=CC2=C(N=CC=C2)N1 SY241058 [0,0,0,0,0,0|2,0,2]=4 22 B12R2.24 O=C1CC2=C(C=CC=C2)CO1 SY036247 [0,0,0,0,0,0|2,0,0]=2 23 B12R2.24 O=C1CCC2=CC=NC=C2N1 SY249512 [0,0,0,0,0,0|2,0,0]=2 24 B12R2.24 O=C1CNC2=C(C=CC=C2)C1 SY292612 [0,0,0,0,0,0|2,0,0]=2 25 B12R2.24 O=C1CNC2=C(C=CC=C2)N1 SY018411 [0,0,0,0,0,0|2,0,0]=2 26 B12R2.24 O=C1CNC2=CC=CC=C2O1 SY292600 [0,0,0,0,0,0|1,0,0]=1 27 B12R2.24 O=C1COC2=C(C=CC=C2)N1 SY007578 [0,0,0,0,0,0|2,0,0]=2 28 B12R2.24 O=C1COC2=C(C=NC=C2)N1 SY130715 [0,0,0,0,0,0|3,0,0]=3 29 B12R2.24 O=C1COC2=C(N=CC=C2)N1 SY007983 [0,0,0,0,0,0|3,0,0]=3 30 B12R2.24 O=C1CSC2=C(C=CC=C2)C1 SY033162 [0,0,0,0,0,0|2,0,0]=2 31 B12R2.24 O=C1NC2=C(C=CN=C2)CO1 SY129221 [0,0,0,0,0,0|3,0,0]=3 32 B12R2.24 O=C1NC2=C(C=NC=C2)CO1 SY129222 [0,0,0,0,0,0|3,0,0]=3 33 B12R2.24 O=C1NC2=CC=CC=C2CO1 SY129148 [0,0,0,0,0,0|2,0,0]=2 34 B12R2.24 O=C1NC2=NC=CC=C2CO1 SY129220 [0,0,0,0,0,0|3,0,0]=3 35 B12R2.24 OC1=CC2=C(C=CC=C2)N=C1 SY009024 [0,0,0,0,0,0|2,0,2]=4 36 B12R2.24 OC1=CC2=CC=CC=C2C=N1 SY005563 [0,0,0,0,0,0|2,0,2]=4 37 B12R2.24 OC1=NC2=C(C=CC=C2)C=C1 SY003693 [0,0,0,0,0,0|1,0,3]=4 38 B12R2.24 OC1=NC2=C(C=CC=C2)N=C1 SY013680 [0,0,0,0,0,0|2,0,2]=4 39 B12R2.24 OC1CC2=C(C=CC=C2)CO1 SY293993 [0,0,0,0,0,0|2,0,2]=4 40 B12R2.24 OC1CCC2=C(C=CC=C2)C1 SY056861 [0,0,0,0,0,0|1,0,2]=3 41 B11R2.20 C1=C2C=CC=NC2=CC=C1 SY246331 [1,0,0,0,0,0|1,0,2]=4 42 B11R2.20 C1=C2N=CC=CC2=CC=C1 SY246333 [1,0,0,0,0,0|1,0,2]=4 43 B11R2.20 C1=CC2=C(C=C1)CCC=C2 SY050004 [1,0,0,0,0,0|1,0,0]=2 44 B11R2.20 C1=CC2=C(C=C1)CCN=C2 SY025255 [1,0,0,0,0,0|2,0,0]=3 45 B11R2.20 C1=CC2=C(C=C1)CNCC2 SY001156 [1,0,0,0,0,0|2,0,0]=3 46 B11R2.20 C1=CC2=C(C=C1)CNNC2 SY022231 [1,0,0,0,0,0|3,0,0]=4 47 B11R2.20 C1=CC2=C(C=C1)COCC2 SY018228 [1,0,0,0,0,0|2,0,0]=3 48 B11R2.20 C1=CC2=C(C=C1)CSCC2 SY286030 [1,0,0,0,0,0|2,0,0]=3 49 B11R2.20 C1=CC2=C(C=C1)N=CC=N2 SY005377 [1,0,0,0,0,0|2,0,1]=4 50 B11R2.20 C1=CC2=C(C=C1)N=CN=C2 SY006075 [1,0,0,0,0,0|2,0,1]=4 51 B11R2.20 C1=CC2=C(C=C1)NCCC2 SY001847 [1,0,0,0,0,0|1,0,1]=3 52 B11R2.20 C1=CC2=C(C=C1)NCCN2 SY025682 [1,0,0,0,0,0|2,0,1]=4 53 B11R2.20 C1=CC2=C(C=C1)OCCC2 SY174231 [1,0,0,0,0,0|0,0,1]=2 54 B11R2.20 C1=CC2=C(C=C1)OCCN2 SY011618 [1,0,0,0,0,0|1,0,1]=3 55 B11R2.20 C1=CC2=C(C=N1)CCCN2 SY023238 [1,0,0,0,0,0|2,0,1]=4 56 B11R2.20 C1=CC2=C(C=N1)NCCO2 SY130741 [1,0,0,0,0,0|2,0,1]=4 57 B11R2.20 C1=CC2=C(CCCC2)N=C1 SY004991 [1,0,0,0,0,0|2,0,1]=4 58 B11R2.20 C1=CC2=C(CCNC2)N=C1 SY022463 [1,0,0,0,0,0|3,0,0]=4 59 B11R2.20 C1=CC2=C(CNCC2)N=C1 SY114285 [1,0,0,0,0,0|3,0,0]=4 60 B11R2.20 C1=CC2=C(N=C1)NCCC2 SY022462 [1,0,0,0,0,0|2,0,1]=4 61 B11R2.20 C1=CC2=C(N=C1)NCCO2 SY008040 [1,0,0,0,0,0|2,0,1]=4 62 B11R2.20 C1=CC2=CC=CC=C2N=C1 SY246329 [1,0,0,0,0,0|1,0,2]=4 63 B11R2.20 C1=CC=C2C=CC=NC2=C1 SY246281 [1,0,0,0,0,0|1,0,2]=4 64 B11R2.20 C1=CC=C2N=CC=CC2=C1 SY246332 [1,0,0,0,0,0|1,0,2]=4 65 B11R2.20 C1=CC=C2OCCOC2=C1 SY032893 [1,0,0,0,0,0|1,0,1]=3 66 B11R2.20 C1=CC=C2SCCNC2=C1 SY079423 [1,0,0,0,0,0|1,1,1]=4 67 B11R2.20 C1=CC=CC2=C1C=CN=C2 SY246282 [1,0,0,0,0,0|2,0,1]=4 68 B11R2.20 C1=CC=NC2=CC=CC=C12 SY246330 [1,0,0,0,0,0|1,0,2]=4 69 B11R2.20 C1=CN=C2CCCNC2=C1 SY011552 [1,0,0,0,0,0|2,0,1]=4 70 B11R2.20 C1=CN=C2CCNCC2=C1 SY022124 [1,0,0,0,0,0|3,0,0]=4 71 B11R2.20 C1=CN=C2OCCNC2=C1 SY130735 [1,0,0,0,0,0|2,0,1]=4 72 B11R2.20 C1=CN=C2OCCOC2=C1 SY045905 [1,0,0,0,0,0|2,0,1]=4 73 B11R2.20 C1=NC2=CC=CC=C2C=C1 SY246328 [1,0,0,0,0,0|1,0,2]=4 74 B11R2.20 C1=NC=C2CNCCC2=C1 SY102429 [1,0,0,0,0,0|3,0,0]=4 75 B13R2.32 CC1CCC2=C(C=CC=C2)C1=O SY101951 [0,1,0,0,0,0|2,0,1]=4 76 B13R2.32 CC1CCC2=C(C=CC=C2)N1C SY280205 [0,1,0,0,0,0|2,0,1]=4 77 B13R2.57 NCC1CCC2=C(C=CC=C2)O1 SY240524 [0,1,0,0,0,0|1,0,1]=3 78 B13R2.57 NCC1CCC2=C(C=CC=C2)O1 SY250687 [0,1,0,0,0,0|1,0,1]=3 79 B13R2.57 NCC1COC2=C(C=CC=C2)O1 SY014251 [0,1,0,0,0,0|2,0,1]=4 80 B13R2.57 NCC1COC2=CC=CC=C2O1 SY019804 [0,1,0,0,0,0|2,0,1]=4 81 B13R2.57 NC[C@@H]1COC2=CC=CC=C2O1 SY250683 [0,1,0,0,0,0|2,0,1]=4 82 B13R2.57 NNC1CCC2=C(C=CC=C2)C1 SY265143 [0,1,0,0,0,0|2,0,1]=4 83 B13R2.57 O=CC1=CC2=CC=CC=C2N=C1 SY002981 [0,1,0,0,0,0|2,0,1]=4 84 B13R2.57 O=CC1=NC2=CC=CC=C2C=C1 SY019180 [0,1,0,0,0,0|1,0,2]=4 85 B13R2.155 CC1=CC2=C(C=CC(=O)O2)C=C1 SY051344 [0,1,0,0,0,0|0,0,2]=3 86 B13R2.155 CN1CCC2=C(C=C(Br)C=C2)C1 SY265426 [0,1,0,0,0,0|3,0,0]=4 87 B13R2.155 CN1CCC2=C(C=C(N)C=C2)C1 SY098224 [0,1,0,0,0,0|3,0,0]=4 88 B13R2.155 NC1=CC2=C(C=CC(=O)N2)C=C1 SY025890 [0,1,0,0,0,0|1,0,2]=4 89 B13R2.155 NC1=CC2=C(C=CC(=O)O2)C=C1 SY286160 [0,1,0,0,0,0|0,0,2]=3 90 B13R2.155 NC1=CC=C2COC(=O)NC2=C1 SY129167 [0,1,0,0,0,0|2,0,0]=3 91 B13R2.155 N[C@H]1CCC2=CC=C(O)C=C2C1 SY009732 [0,1,0,0,0,0|2,0,1]=4 92 B13R2.155 O=C1C=CC2=C(C=C(Br)C=C2)N1 SY022625 [0,1,0,0,0,0|1,0,2]=4 93 B13R2.155 O=C1C=CC2=C(C=C(Cl)C=C2)O1 SY036154 [0,1,0,0,0,0|0,0,2]=3 94 B13R2.155 O=C1C=CC2=C(C=C(I)C=C2)N1 SY294241 [0,1,0,0,0,0|1,0,2]=4 95 B13R2.155 O=C1C=CC2=C(C=C(O)C=C2)N1 SY047363 [0,1,0,0,0,0|1,0,2]=4 96 B13R2.155 O=C1C=CC2=C(C=C(O)C=C2)O1 SY001924 [0,1,0,0,0,0|0,0,2]=3 97 B13R2.155 O=C1C=NC2=C(C=C(Br)C=C2)N1 SY112246 [0,1,0,0,0,0|2,0,1]=4 98 B13R2.155 O=C1CC2=C(C=CC(Br)=C2)CN1 SY263246 [0,1,0,0,0,0|2,0,0]=3 99 B13R2.155 O=C1CCC2=C(C=C(Br)C=C2)N1 SY024896 [0,1,0,0,0,0|1,0,0]=2 100 B13R2.155 O=C1CCC2=C(C=C(Br)C=C2)O1 SY289389 [0,1,0,0,0,0|0,0,0]=1 101 B13R2.155 O=C1CCC2=C(C=C(Cl)N=C2)N1 SY262941 [0,1,0,0,0,0|2,0,0]=3 102 B13R2.155 O=C1CCC2=C(C=C(F)C=C2)N1 SY016687 [0,1,0,0,0,0|1,0,0]=2 103 B13R2.155 O=C1CCC2=CC=C(O)C=C2N1 SY009657 [0,1,0,0,0,0|1,0,0]=2 104 B13R2.155 O=C1CCC2=NC=C(Br)C=C2N1 SY060537 [0,1,0,0,0,0|2,0,0]=3 105 B13R2.155 O=C1CNC2=CC=C(Cl)N=C2N1 SY291712 [0,1,0,0,0,0|3,0,0]=4 106 B13R2.155 O=C1COC2=C(C=C(Br)C=C2)N1 SY007660 [0,1,0,0,0,0|2,0,0]=3 107 B13R2.155 O=C1COC2=C(C=C(Br)N=C2)N1 SY059724 [0,1,0,0,0,0|3,0,0]=4 108 B13R2.155 O=C1COC2=C(C=C(Cl)N=C2)N1 SY025992 [0,1,0,0,0,0|3,0,0]=4 109 B13R2.155 O=C1COC2=CC=C(Br)N=C2N1 SY019440 [0,1,0,0,0,0|3,0,0]=4 110 B13R2.155 O=C1COC2=NC=C(Br)C=C2N1 SY060496 [0,1,0,0,0,0|3,0,0]=4 111 B13R2.155 O=C1COC2=NC=C(Cl)C=C2N1 SY130725 [0,1,0,0,0,0|3,0,0]=4 112 B13R2.155 O=C1NC2=CC(Br)=CC=C2CO1 SY058763 [0,1,0,0,0,0|2,0,0]=3 113 B13R2.155 O=C1NC2=CC(Cl)=CC=C2CO1 SY129152 [0,1,0,0,0,0|2,0,0]=3 114 B13R2.155 O=C1NC2=CC(F)=CC=C2CO1 SY129162 [0,1,0,0,0,0|2,0,0]=3 115 B13R2.162 CC1=C2NC(=O)COC2=CC=C1 SY100551 [0,1,0,0,0,0|2,0,0]=3 116 B13R2.162 CC1=C2NC(=O)OCC2=CC=C1 SY129182 [0,1,0,0,0,0|2,0,0]=3 117 B13R2.162 CC1=CC=CC2=C1NC(=O)C=C2 SY021046 [0,1,0,0,0,0|1,0,2]=4 118 B13R2.162 CC1=CC=CC2=C1NC(=O)CC2 SY021047 [0,1,0,0,0,0|1,0,0]=2 119 B13R2.162 NC1=C2NC(=O)COC2=CC=C1 SY110266 [0,1,0,0,0,0|2,0,0]=3 120 B13R2.162 NC1=C2NC(=O)OCC2=CC=C1 SY129157 [0,1,0,0,0,0|2,0,0]=3 121 B13R2.162 O=C1C=CC2=C(N1)C(Br)=CC=C2 SY122943 [0,1,0,0,0,0|1,0,2]=4 122 B13R2.162 O=C1CCC2=C(C1)C(Br)=CC=C2 SY042920 [0,1,0,0,0,0|1,0,0]=2 123 B13R2.162 O=C1CCC2=C(C1)C(F)=CC=C2 SY267880 [0,1,0,0,0,0|1,0,0]=2 124 B13R2.162 O=C1COC2=CC=CC(F)=C2N1 SY100542 [0,1,0,0,0,0|2,0,0]=3 125 B13R2.162 O=C1NC2=C(Br)C=CC=C2CO1 SY129180 [0,1,0,0,0,0|2,0,0]=3 126 B13R2.162 O=C1NC2=C(Cl)C=CC=C2CO1 SY129207 [0,1,0,0,0,0|2,0,0]=3 127 B13R2.162 O=C1NC2=C(F)C=CC=C2CO1 SY129153 [0,1,0,0,0,0|2,0,0]=3 128 B13R2.222 CC1(C)CCC2=C(C=CC=C2)N1 SY205781 [0,1,0,0,0,0|2,0,1]=4 129 B13R2.222 O=P1(Cl)OCC2=CC=CC=C2O1 SY290788 [0,1,0,0,0,0|2,0,0]=3 130 B13R2.328 O=C1C=C(Br)C2=CC=CC=C2O1 SY026916 [0,1,0,0,0,0|0,0,2]=3 131 B13R2.328 O=C1C=C(O)C2=C(C=CC=C2)O1 SY001614 [0,1,0,0,0,0|0,0,2]=3 132 B13R2.328 O=C1NC(=O)C2=C(C=CC=C2)N1 SY003536 [0,1,0,0,0,0|2,0,1]=4 133 B13R2.369 NC1=CC2=C(C=CC=C2)NC1=O SY254129 [0,1,0,0,0,0|1,0,2]=4 134 B13R2.3683 CC1=CC2=C(C=C1)CC(=O)CC2 SY238121 [0,1,0,0,0,0|1,0,0]=2 135 B13R2.3683 CC1=CC=C2NC(=O)COC2=C1 SY130720 [0,1,0,0,0,0|2,0,0]=3 136 B13R2.3683 CC1=CC=C2NC(=O)OCC2=C1 SY129172 [0,1,0,0,0,0|2,0,0]=3 137 B13R2.3683 CC1=CC=C2OC(=O)C=CC2=C1 SY012943 [0,1,0,0,0,0|0,0,2]=3 138 B13R2.3683 NC1=CC=C2NC(=O)COC2=C1 SY060762 [0,1,0,0,0,0|2,0,0]=3 139 B13R2.3683 NC1=CC=C2NC(=O)OCC2=C1 SY129160 [0,1,0,0,0,0|2,0,0]=3 140 B13R2.3683 O=C1C=CC2=C(C=CC(Br)=C2)O1 SY112628 [0,1,0,0,0,0|0,0,2]=3 141 B13R2.3683 O=C1C=CC2=C(C=CC(Cl)=C2)O1 SY036153 [0,1,0,0,0,0|0,0,2]=3 142 B13R2.3683 O=C1C=CC2=C(C=CC(I)=C2)N1 SY033794 [0,1,0,0,0,0|1,0,2]=4 143 B13R2.3683 O=C1C=CC2=CC(Br)=CC=C2N1 SY006761 [0,1,0,0,0,0|1,0,2]=4 144 B13R2.3683 O=C1C=NC2=C(C=CC(Br)=C2)N1 SY031934 [0,1,0,0,0,0|2,0,1]=4 145 B13R2.3683 O=C1CC2=C(C=C(O)C=C2)CN1 SY035160 [0,1,0,0,0,0|2,0,0]=3 146 B13R2.3683 O=C1CCC2=C(C=CC(=O)N2)C1 SY277863 [0,1,0,0,0,0|2,0,0]=3 147 B13R2.3683 O=C1CCC2=C(C=CC(Br)=C2)N1 SY004486 [0,1,0,0,0,0|1,0,0]=2 148 B13R2.3683 O=C1CCC2=C(C=CC(O)=C2)N1 SY002022 [0,1,0,0,0,0|1,0,0]=2 149 B13R2.3683 O=C1CCC2=C(N=CC(Br)=C2)N1 SY009000 [0,1,0,0,0,0|2,0,0]=3 150 B13R2.3683 O=C1CCC2=CC(Br)=CC=C2C1 SY013008 [0,1,0,0,0,0|1,0,0]=2 151 B13R2.3683 O=C1CCC2=CC(Br)=CC=C2O1 SY108538 [0,1,0,0,0,0|0,0,0]=1 152 B13R2.3683 O=C1CNC2=C(C=CC(Br)=C2)N1 SY100547 [0,1,0,0,0,0|2,0,0]=3 153 B13R2.3683 O=C1COC2=CC(Br)=CC=C2N1 SY104617 [0,1,0,0,0,0|2,0,0]=3 154 B13R2.3683 O=C1COC2=CC(Br)=CN=C2N1 SY108543 [0,1,0,0,0,0|3,0,0]=4 155 B13R2.3683 O=C1COC2=CC(Cl)=CC=C2N1 SY110914 [0,1,0,0,0,0|2,0,0]=3 156 B13R2.3683 O=C1COC2=CC(F)=CC=C2N1 SY110545 [0,1,0,0,0,0|2,0,0]=3 157 B13R2.3683 O=C1COC2=CC(O)=CC=C2N1 SY286048 [0,1,0,0,0,0|2,0,0]=3 158 B13R2.3683 O=C1COC2=NC(Br)=CC=C2N1 SY129389 [0,1,0,0,0,0|3,0,0]=4 159 B13R2.3683 O=C1N=CC2=C(C=CC(Br)=C2)N1 SY047984 [0,1,0,0,0,0|2,0,1]=4 160 B13R2.3683 O=C1NC2=CC=C(Br)C=C2CO1 SY059722 [0,1,0,0,0,0|2,0,0]=3 161 B13R2.3683 O=C1NC2=CC=C(F)C=C2CO1 SY129151 [0,1,0,0,0,0|2,0,0]=3 162 B13R2.3683 O=C1NC2=CC=C(I)C=C2CO1 SY129171 [0,1,0,0,0,0|2,0,0]=3 163 B13R2.3683 O=C1NC2=NC=C(Br)C=C2CO1 SY060507 [0,1,0,0,0,0|3,0,0]=4 164 B13R2.3683 O=C1NCC2=CC(Br)=CN=C2N1 SY060521 [0,1,0,0,0,0|3,0,0]=4 165 B13R2.5179 CC1=C2COC(=O)NC2=CC=C1 SY100557 [0,1,0,0,0,0|2,0,0]=3 166 B13R2.5179 CC1=CC=CC2=C1C=CC(=O)N2 SY295224 [0,1,0,0,0,0|1,0,2]=4 167 B13R2.5179 NC1=C2COC(=O)NC2=CC=C1 SY129177 [0,1,0,0,0,0|2,0,0]=3 168 B13R2.5179 O=C1C=CC2=C(C=CC=C2Br)O1 SY269658 [0,1,0,0,0,0|0,0,2]=3 169 B13R2.5179 O=C1C=CC2=C(C=CC=C2O)N1 SY110039 [0,1,0,0,0,0|1,0,2]=4 170 B13R2.5179 O=C1CC2=C(CN1)C(Br)=CC=C2 SY263243 [0,1,0,0,0,0|2,0,0]=3 171 B13R2.5179 O=C1CCC2=C(C=CC=C2Br)N1 SY035130 [0,1,0,0,0,0|1,0,0]=2 172 B13R2.5179 O=C1CCC2=C(C=CC=C2O)N1 SY104338 [0,1,0,0,0,0|1,0,0]=2 173 B13R2.5179 O=C1CCC2=C(N=CC=C2F)N1 SY046433 [0,1,0,0,0,0|2,0,0]=3 174 B13R2.5179 O=C1COC2=C(Br)C=CC=C2N1 SY028434 [0,1,0,0,0,0|2,0,0]=3 175 B13R2.5179 O=C1COC2=C(Cl)C=CC=C2N1 SY130716 [0,1,0,0,0,0|2,0,0]=3 176 B13R2.5179 O=C1COC2=C(F)C=CC=C2N1 SY130722 [0,1,0,0,0,0|2,0,0]=3 177 B13R2.5179 O=C1NC2=CC=CC(Br)=C2CO1 SY129212 [0,1,0,0,0,0|2,0,0]=3 178 B13R2.5179 O=C1NC2=CC=CC(Cl)=C2CO1 SY129163 [0,1,0,0,0,0|2,0,0]=3 179 B13R2.5179 O=C1NC2=CC=CC(F)=C2CO1 SY129155 [0,1,0,0,0,0|2,0,0]=3 180 B11R1.17 C=CCOC1=CC=CC=C1O SY115738 [0,0,1,0,0,0|2,0,0]=3 181 B11R1.17 CCNCC1=CC=CC=C1O SY018670 [0,0,1,0,0,0|2,0,1]=4 182 B11R1.17 CNCCC1=CC=CC=C1F SY002937 [0,0,1,0,0,0|3,0,0]=4 183 B11R1.17 NCCCC1=CC=CC=C1Br SY030070 [0,0,1,0,0,0|2,0,1]=4 184 B11R1.17 OCCCC1=CC=CC=C1Br SY021684 [0,0,1,0,0,0|1,0,2]=4 185 B11R1.40 C=CC(=O)NC1=CC=CC=C1 SY052499 [0,0,1,0,0,0|1,0,2]=4 186 B11R1.40 C=CC(=O)OC1=CC=CC=C1 SY050025 [0,0,1,0,0,0|0,0,2]=3 187 B11R1.40 COC(=O)CC1=CC=CN=C1 SY014800 [0,0,1,0,0,0|3,0,0]=4 188 B11R1.40 COC(=O)CC1=CC=CN=C1 SY033634 [0,0,1,0,0,0|3,0,0]=4 189 B11R1.40 COC(=O)CC1=CC=NC=C1 SY003565 [0,0,1,0,0,0|3,0,0]=4 190 B11R1.40 COC(=O)CC1=CC=NC=C1 SY007994 [0,0,1,0,0,0|3,0,0]=4 191 B11R1.40 COC(=O)CC1=NC=CC=C1 SY030291 [0,0,1,0,0,0|3,0,0]=4 192 B11R1.40 N#CC(=O)CC1=CC=CC=C1 SY235509 [0,0,1,0,0,0|2,0,1]=4 193 B11R1.40 NNC(=O)CC1=CC=CC=C1 SY032275 [0,0,1,0,0,0|3,0,0]=4 194 B11R1.40 NNC(=O)OC1=CC=CC=C1 SY262826 [0,0,1,0,0,0|2,0,0]=3 195 B11R1.40 O=C(CBr)OC1=CC=CC=C1 SY036432 [0,0,1,0,0,0|1,0,0]=2 196 B11R1.40 O=C(CCl)NC1=CC=NC=C1 SY022530 [0,0,1,0,0,0|3,0,0]=4 197 B11R1.40 O=C(CCl)NC1=NC=CC=C1 SY022508 [0,0,1,0,0,0|3,0,0]=4 198 B11R1.41 COC1=C(OCCl)C=CC=C1 SY298549 [0,0,1,0,0,0|2,0,1]=4 199 B11R1.41 COC1=CC=CC=C1CC=O SY022663 [0,0,1,0,0,0|2,0,0]=3 200 B11R1.41 COC1=CC=CC=C1N=C=O SY048800 [0,0,1,0,0,0|2,0,1]=4 201 B11R1.86 CC(=O)CC1=C(Br)C=CC=C1 SY011510 [0,0,1,0,0,0|2,0,0]=3 202 B11R1.86 CC(=O)CC1=C(Cl)C=CC=C1 SY037165 [0,0,1,0,0,0|2,0,0]=3 203 B11R1.86 CC(=O)NC1=C(Br)C=CC=C1 SY034454 [0,0,1,0,0,0|2,0,0]=3 204 B11R1.86 CC(=O)NC1=C(O)C=CC=C1 SY004721 [0,0,1,0,0,0|2,0,0]=3 205 B11R1.86 CC(=O)NC1=CC=CC=C1Cl SY048591 [0,0,1,0,0,0|2,0,0]=3 206 B11R1.86 CC(=O)NC1=CC=CC=C1N SY050887 [0,0,1,0,0,0|2,0,0]=3 207 B11R1.86 CC(=O)NC1=NC=CC=C1O SY084890 [0,0,1,0,0,0|3,0,0]=4 208 B11R1.86 CC(=O)NC1=NN=CC=C1C SY014812 [0,0,1,0,0,0|3,0,0]=4 209 B11R1.86 CC(=O)OC1=CC=CC=C1Br SY265515 [0,0,1,0,0,0|1,0,0]=2 210 B11R1.86 CC(=O)OC1=CC=CC=C1C SY052277 [0,0,1,0,0,0|0,0,0]=1 211 B11R1.86 CC(=O)OC1=CC=CC=C1F SY224313 [0,0,1,0,0,0|1,0,0]=2 212 B11R1.86 CC(C)OC1=CC=CC=C1N SY006071 [0,0,1,0,0,0|2,0,1]=4 213 B11R1.86 CC(C)OC1=CC=CC=C1O SY062038 [0,0,1,0,0,0|2,0,1]=4 214 B11R1.86 CC1=C(OC(=O)Cl)C=CC=C1 SY296811 [0,0,1,0,0,0|1,0,0]=2 215 B11R1.86 CC1=CC=CC=C1CC(=O)O SY003130 [0,0,1,0,0,0|2,0,0]=3 216 B11R1.86 NC(=O)CC1=CC=CC=C1Cl SY016301 [0,0,1,0,0,0|3,0,0]=4 217 B11R1.86 NC1=CC=CC=C1CC(=O)O SY101243 [0,0,1,0,0,0|3,0,0]=4 218 B11R1.86 O=C(Cl)OC1=CC=CC=C1Br SY296808 [0,0,1,0,0,0|2,0,0]=3 219 B11R1.86 O=C(Cl)OC1=CC=CC=C1F SY202667 [0,0,1,0,0,0|2,0,0]=3 220 B11R1.86 O=C(Cl)OC1=CC=CC=C1I SY296904 [0,0,1,0,0,0|2,0,0]=3 221 B11R1.86 O=C(O)CC1=CC=CC=C1Br SY003588 [0,0,1,0,0,0|3,0,0]=4 222 B11R1.86 O=C(O)CC1=CC=CC=C1F SY003125 [0,0,1,0,0,0|3,0,0]=4 223 B11R1.86 O=C(O)CC1=CC=CC=C1I SY035508 [0,0,1,0,0,0|3,0,0]=4 224 B11R1.91 CC(=O)C#CC1=CC=CC=C1 SY051763 [0,0,1,0,0,0|1,0,2]=4 225 B11R1.91 CC(=O)CCC1=CC=CC=C1 SY013502 [0,0,1,0,0,0|1,0,0]=2 226 B11R1.91 CC(=O)COC1=NC=CC=C1 SY251719 [0,0,1,0,0,0|3,0,0]=4 227 B11R1.91 N=C(N)COC1=CC=CC=C1 SY003970 [0,0,1,0,0,0|3,0,0]=4 228 B11R1.91 NC(=O)CCC1=CC=CN=C1 SY022419 [0,0,1,0,0,0|2,0,0]=3 229 B11R1.91 NC(=O)CCC1=CC=NC=C1 SY022418 [0,0,1,0,0,0|2,0,0]=3 230 B11R1.91 NC(=O)CCC1=NC=CC=C1 SY022420 [0,0,1,0,0,0|2,0,0]=3 231 B11R1.91 NC(=O)NCC1=CC=CC=C1 SY049437 [0,0,1,0,0,0|2,0,0]=3 232 B11R1.91 NC(=O)OCC1=CC=CC=C1 SY015067 [0,0,1,0,0,0|2,0,0]=3 233 B11R1.91 O=C(O)C#CC1=CC=CC=C1 SY023402 [0,0,1,0,0,0|0,0,2]=3 234 B11R1.91 O=C(O)C#CC1=CC=CN=C1 SY022409 [0,0,1,0,0,0|1,0,2]=4 235 B11R1.91 O=C(O)C#CC1=CC=NC=C1 SY022408 [0,0,1,0,0,0|1,0,2]=4 236 B11R1.91 O=C(O)C#CC1=NC=CC=C1 SY022410 [0,0,1,0,0,0|1,0,2]=4 237 B11R1.91 O=C(O)C=CC1=CC=NC=C1 SY036404 [0,0,1,0,0,0|1,0,2]=4 238 B11R1.91 O=C(O)CCC1=CC=CC=C1 SY001654 [0,0,1,0,0,0|0,0,0]=1 239 B11R1.91 O=C(O)CCC1=CC=NC=C1 SY022403 [0,0,1,0,0,0|1,0,0]=2 240 B11R1.91 O=C(O)CCC1=CN=CC=C1 SY017981 [0,0,1,0,0,0|1,0,0]=2 241 B11R1.91 O=C(O)CCC1=NC=CC=C1 SY013900 [0,0,1,0,0,0|1,0,0]=2 242 B11R1.91 O=C(O)COC1=CC=CN=C1 SY110065 [0,0,1,0,0,0|2,0,0]=3 243 B11R1.91 O=C(O)\C=C\C1=CC=CN=C1 SY009573 [0,0,1,0,0,0|1,0,2]=4 244 B11R1.91 O=C(O)\C=C\C1=NC=CC=C1 SY016110 [0,0,1,0,0,0|1,0,2]=4 245 B11R1.91 O=[N+]([O-])CCC1=CC=CC=C1 SY043104 [0,0,1,0,0,0|1,0,1]=3 246 B11R1.91 OB(O)CCC1=CC=CC=C1 SY014651 [0,0,1,0,0,0|1,0,1]=3 247 B11R2.1 BrC1=COC2=C1C=CC=C2 SY004448 [0,0,0,0,1,0|2,0,1]=4 248 B11R2.1 BrC1=CSC2=CC=CC=C12 SY062543 [0,0,0,0,1,0|2,0,1]=4 249 B11R2.1 BrC1=NNC2=C1C=CC=C2 SY021216 [0,0,0,0,1,0|3,0,0]=4 250 B11R2.1 C=C1CCC2=C1C=CC=C2 SY031740 [0,0,0,0,1,0|1,0,0]=2 251 B11R2.1 CC1=C2C=CC=CC2=NO1 SY246355 [0,0,0,0,1,0|3,0,0]=4 252 B11R2.1 CC1=COC2=CC=CC=C12 SY028461 [0,0,0,0,1,0|2,0,1]=4 253 B11R2.1 CC1=NNC2=C1C=CC=C2 SY015996 [0,0,0,0,1,0|3,0,0]=4 254 B11R2.1 CC1CNC2=C1C=CC=C2 SY178552 [0,0,0,0,1,0|2,0,1]=4 255 B11R2.1 CN1CNC2=CC=CC=C21 SY289611 [0,0,0,0,1,0|3,0,0]=4 256 B11R2.1 ClC1=NOC2=CC=CC=C21 SY042811 [0,0,0,0,1,0|3,0,0]=4 257 B11R2.1 ClC1=NSC2=C1C=CC=C2 SY050239 [0,0,0,0,1,0|3,0,0]=4 258 B11R2.1 IC1=NNC2=C1C=CC=C2 SY031006 [0,0,0,0,1,0|3,0,0]=4 259 B11R2.1 NC1=C2C=CC=CC2=NO1 SY233373 [0,0,0,0,1,0|3,0,0]=4 260 B11R2.1 NC1=CNC2=C1C=CC=C2 SY236577 [0,0,0,0,1,0|2,0,1]=4 261 B11R2.1 NC1=CSC2=CC=CC=C12 SY151802 [0,0,0,0,1,0|2,0,1]=4 262 B11R2.1 NC1=NCC2=C1C=CC=C2 SY027372 [0,0,0,0,1,0|2,0,0]=3 263 B11R2.1 NC1=NNC2=C1C=CC=C2 SY007051 [0,0,0,0,1,0|3,0,0]=4 264 B11R2.1 NC1=NOC2=CC=CC=C21 SY034280 [0,0,0,0,1,0|3,0,0]=4 265 B11R2.1 NC1CCC2=C1C=CC=C2 SY004953 [0,0,0,0,1,0|1,0,1]=3 266 B11R2.1 NC1CCC2=CC=CC=C21 SY004234 [0,0,0,0,1,0|1,0,1]=3 267 B11R2.1 NC1COC2=CC=CC=C21 SY283285 [0,0,0,0,1,0|2,0,1]=4 268 B11R2.1 NN1CCC2=C1C=CC=C2 SY096651 [0,0,0,0,1,0|2,0,0]=3 269 B11R2.1 N[C@@H]1CCC2=C1C=CC=C2 SY030463 [0,0,0,0,1,0|1,0,1]=3 270 B11R2.1 N[C@H]1CCC2=C1C=CC=C2 SY028017 [0,0,0,0,1,0|1,0,1]=3 271 B11R2.1 O=C1CCC2=C1C=CC=C2 SY001380 [0,0,0,0,1,0|0,0,0]=1 272 B11R2.1 O=C1CCC2=C1C=CN=C2 SY009406 [0,0,0,0,1,0|1,0,0]=2 273 B11R2.1 O=C1CCC2=CC=CN=C12 SY009408 [0,0,0,0,1,0|1,0,0]=2 274 B11R2.1 O=C1CCC2=NC=CC=C12 SY009444 [0,0,0,0,1,0|1,0,0]=2 275 B11R2.1 O=C1COC2=C1C=CC=C2 SY011530 [0,0,0,0,1,0|1,0,0]=2 276 B11R2.1 O=C1CSC2=CC=CC=C12 SY030591 [0,0,0,0,1,0|1,0,0]=2 277 B11R2.1 O=C1NCC2=C1C=CC=C2 SY020116 [0,0,0,0,1,0|1,0,0]=2 278 B11R2.1 O=C1NCC2=CC=CN=C12 SY206198 [0,0,0,0,1,0|2,0,0]=3 279 B11R2.1 O=C1NN=C2C=CC=CN12 SY036845 [0,0,0,0,1,0|3,0,0]=4 280 B11R2.1 O=C1NNC2=C1C=CC=C2 SY051085 [0,0,0,0,1,0|2,0,0]=3 281 B11R2.1 O=C1OCC2=C1C=CC=C2 SY001701 [0,0,0,0,1,0|1,0,0]=2 282 B11R2.1 O=C1OCC2=C1C=CN=C2 SY045272 [0,0,0,0,1,0|2,0,0]=3 283 B11R2.1 O=C1OCC2=NC=CC=C12 SY033776 [0,0,0,0,1,0|2,0,0]=3 284 B11R2.1 O=C1SSC2=CC=CC=C12 SY123412 [0,0,0,0,1,0|2,0,0]=3 285 B11R2.1 OB1OCC2=CC=CC=C12 SY025271 [0,0,0,0,1,0|2,0,1]=4 286 B11R2.1 OC1=NOC2=CC=CC=C21 SY031398 [0,0,0,0,1,0|2,0,1]=4 287 B11R2.1 OC1CCC2=C1C=CC=C2 SY014889 [0,0,0,0,1,0|0,0,2]=3 288 B11R2.1 OC1CCC2=C1N=CC=C2 SY017306 [0,0,0,0,1,0|1,0,2]=4 289 B11R2.1 O[C@H]1CCC2=C1C=CC=C2 SY275070 [0,0,0,0,1,0|0,0,2]=3 290 B11R2.10 BrC1=CC2=C(C=CC=C2)C1 SY004720 [0,0,0,0,1,0|2,0,0]=3 291 B11R2.10 BrC1=CC2=CC=CC=C2O1 SY101367 [0,0,0,0,1,0|1,0,1]=3 292 B11R2.10 BrC1=NC2=CC=CC=C2N1 SY050717 [0,0,0,0,1,0|3,0,0]=4 293 B11R2.10 BrC1=NC2=CC=CC=C2O1 SY192184 [0,0,0,0,1,0|2,0,0]=3 294 B11R2.10 BrC1CC2=C(C=CC=C2)C1 SY185759 [0,0,0,0,1,0|2,0,1]=4 295 B11R2.10 CC1=CC2=C(C=CC=C2)C1 SY037985 [0,0,0,0,1,0|2,0,0]=3 296 B11R2.10 CC1=CC2=CC=CC=C2O1 SY039830 [0,0,0,0,1,0|1,0,1]=3 297 B11R2.10 CC1=NC2=C(C=CN=C2)O1 SY130002 [0,0,0,0,1,0|3,0,0]=4 298 B11R2.10 CC1=NC2=CC=CC=C2N1 SY015991 [0,0,0,0,1,0|3,0,0]=4 299 B11R2.10 CC1=NC2=CC=CC=C2O1 SY048477 [0,0,0,0,1,0|2,0,0]=3 300 B11R2.10 CC1=NC2=CC=CC=C2S1 SY001190 [0,0,0,0,1,0|2,1,0]=4 301 B11R2.10 CC1=NC2=CC=CN=C2O1 SY018740 [0,0,0,0,1,0|3,0,0]=4 302 B11R2.10 CC1=NC2=NC=CC=C2O1 SY018743 [0,0,0,0,1,0|3,0,0]=4 303 B11R2.10 CC1CC2=C(C=CC=C2)N1 SY014921 [0,0,0,0,1,0|2,0,1]=4 304 B11R2.10 ClC1=CC2=C(C=CC=C2)N1 SY115626 [0,0,0,0,1,0|2,0,1]=4 305 B11R2.10 ClC1=CC2=CC=CC=C2O1 SY045676 [0,0,0,0,1,0|1,0,1]=3 306 B11R2.10 ClC1=NC2=C(C=CC=C2)N1 SY004072 [0,0,0,0,1,0|3,0,0]=4 307 B11R2.10 ClC1=NC2=C(C=CC=C2)O1 SY010741 [0,0,0,0,1,0|2,0,0]=3 308 B11R2.10 ClC1=NC2=C(C=NC=C2)O1 SY273675 [0,0,0,0,1,0|3,0,0]=4 309 B11R2.10 ClC1=NC2=CC=CN=C2O1 SY047505 [0,0,0,0,1,0|3,0,0]=4 310 B11R2.10 ClC1=NC2=NC=CC=C2O1 SY130040 [0,0,0,0,1,0|3,0,0]=4 311 B11R2.10 IC1=NC2=CC=CC=C2S1 SY040107 [0,0,0,0,1,0|2,1,0]=4 312 B11R2.10 NC1=NC2=C(C=CC=C2)O1 SY010713 [0,0,0,0,1,0|2,0,0]=3 313 B11R2.10 NC1=NC2=C(C=CN=C2)O1 SY114774 [0,0,0,0,1,0|3,0,0]=4 314 B11R2.10 NC1=NC2=CC=CC=C2N1 SY032901 [0,0,0,0,1,0|3,0,0]=4 315 B11R2.10 NC1=NC2=CC=CN=C2O1 SY130073 [0,0,0,0,1,0|3,0,0]=4 316 B11R2.10 NC1=NC2=NC=CC=C2O1 SY130061 [0,0,0,0,1,0|3,0,0]=4 317 B11R2.10 O=C1CC2=C(C=CC=C2)C1 SY001481 [0,0,0,0,1,0|1,0,0]=2 318 B11R2.10 O=C1CC2=C(C=CC=C2)O1 SY038967 [0,0,0,0,1,0|0,0,0]=1 319 B11R2.10 O=C1CC2=CC=CC=C2N1 SY004718 [0,0,0,0,1,0|1,0,0]=2 320 B11R2.10 O=C1CC2=CC=CN=C2N1 SY008090 [0,0,0,0,1,0|2,0,0]=3 321 B11R2.10 O=C1NC2=C(C=CC=C2)O1 SY007021 [0,0,0,0,1,0|1,0,0]=2 322 B11R2.10 O=C1NC2=C(C=CN=C2)O1 SY130167 [0,0,0,0,1,0|2,0,0]=3 323 B11R2.10 O=C1NC2=C(N=CC=C2)N1 SY007153 [0,0,0,0,1,0|3,0,0]=4 324 B11R2.10 O=C1NC2=CC=CN=C2O1 SY116296 [0,0,0,0,1,0|2,0,0]=3 325 B11R2.10 O=C1NC2=NC=CC=C2O1 SY007988 [0,0,0,0,1,0|2,0,0]=3 326 B11R2.10 OC1=NC2=CC=CC=C2N1 SY033248 [0,0,0,0,1,0|2,0,1]=4 327 B11R2.10 OC1=NC2=CC=CC=C2S1 SY003005 [0,0,0,0,1,0|1,1,1]=4 328 B11R2.10 OC1CC2=C(C=CC=C2)C1 SY033139 [0,0,0,0,1,0|1,0,2]=4 329 B11R2.10 S=C1NC2=CC=CN=C2O1 SY130024 [0,0,0,0,1,0|2,1,0]=4 330 B11R2.10 S=C1NC2=NC=CC=C2O1 SY086794 [0,0,0,0,1,0|2,1,0]=4 331 B11R2.10 SC1=NC2=C(C=CN=C2)O1 SY233069 [0,0,0,0,1,0|2,1,0]=4 332 B11R2.10 SC1=NC2=CC=CC=C2O1 SY048415 [0,0,0,0,1,0|1,1,0]=3 333 B13R2.33 O=C1CCC2=CC=CC=C2CC1 SY036148 [0,0,0,0,0,1|1,0,0]=2 334 B13R2.163 O=C1CC2=CC=CC=C2C=CN1 SY018989 [0,0,0,0,0,1|1,0,2]=4 335 B13R2.163 O=C1CCCC2=CC=CC=C2N1 SY017407 [0,0,0,0,0,1|1,0,0]=2 336 B13R2.163 O=C1CCNC2=CC=CC=C2N1 SY079183 [0,0,0,0,0,1|1,0,0]=2 337 B13R2.163 O=C1CCNC2=NC=CC=C2N1 SY019671 [0,0,0,0,0,1|2,0,0]=3 338 B10R1.17 BrCCCC1=CC=CC=C1 SY046253 [1,0,1,0,0,0|1,0,1]=4 339 B10R1.17 C1=CC=CC=C1CCC#N SY246292 [1,0,1,0,0,0|1,0,1]=4 340 B10R1.17 C=COCC1=CC=CC=C1 SY097145 [1,0,1,0,0,0|2,0,0]=4 341 B10R1.17 CCC#CC1=CC=CC=C1 SY049474 [1,0,1,0,0,0|1,0,1]=4 342 B10R1.17 CNCCC1=CC=CC=C1 SY002512 [1,0,1,0,0,0|2,0,0]=4 343 B10R1.17 ClCCCC1=CC=CC=C1 SY048978 [1,0,1,0,0,0|1,0,1]=4 344 B10R1.17 ClCCOC1=CC=CC=C1 SY033599 [1,0,1,0,0,0|1,0,1]=4 345 B10R1.17 ICCCC1=CC=CC=C1 SY249461 [1,0,1,0,0,0|1,0,1]=4 346 B10R1.17 NCCCC1=CC=CC=C1 SY049659 [1,0,1,0,0,0|1,0,1]=4 347 B10R1.17 NCCOC1=CC=CC=C1 SY004523 [1,0,1,0,0,0|1,0,1]=4 348 B10R1.17 NC\C=C\C1=CC=CC=C1 SY123671 [1,0,1,0,0,0|2,0,0]=4 349 B10R1.17 NNCCC1=CC=CC=C1 SY048081 [1,0,1,0,0,0|2,0,0]=4 350 B10R1.17 NOCCC1=CC=CC=C1 SY114401 [1,0,1,0,0,0|2,0,0]=4 351 B10R1.17 NOCCC1=CC=CC=C1 SY281546 [1,0,1,0,0,0|2,0,0]=4 352 B10R1.17 O=CC#CC1=CC=CC=C1 SY015622 [1,0,1,0,0,0|0,0,2]=4 353 B10R1.17 O=CNCC1=NC=CC=C1 SY236692 [1,0,1,0,0,0|2,0,0]=4 354 B10R1.17 OCCCC1=CC=CC=C1 SY003672 [1,0,1,0,0,0|0,0,1]=3 355 B10R1.17 OCCCC1=CC=CN=C1 SY129435 [1,0,1,0,0,0|1,0,1]=4 356 B10R1.17 OCCCC1=CC=NC=C1 SY003677 [1,0,1,0,0,0|1,0,1]=4 357 B10R1.17 OCCCC1=NC=CC=C1 SY023125 [1,0,1,0,0,0|1,0,1]=4 358 B10R1.17 OC\C=C/C1=CC=CC=C1 SY129813 [1,0,1,0,0,0|2,0,0]=4 359 B10R1.4 CC1=CC=CC=C1CCO SY036944 [1,0,1,0,0,0|1,0,1]=4 360 B10R1.4 CC1=CC=CC=C1OCCl SY298330 [1,0,1,0,0,0|1,0,1]=4 361 B10R1.4 CCOC1=C(Br)C=CC=C1 SY018463 [1,0,1,0,0,0|1,0,1]=4 362 B10R1.4 CCOC1=C(C)C=CN=C1 SY129406 [1,0,1,0,0,0|1,0,1]=4 363 B10R1.4 CNCC1=CC=CC=C1C SY021461 [1,0,1,0,0,0|2,0,0]=4 364 B10R1.4 COCC1=CC=CC=C1O SY026429 [1,0,1,0,0,0|1,0,1]=4 365 B10R1.4 ClC1=C(CCBr)C=CC=C1 SY004845 [1,0,1,0,0,0|2,0,0]=4 366 B10R1.4 FC1=CC=CC=C1CCCl SY035952 [1,0,1,0,0,0|2,0,0]=4 367 B10R1.4 N#CCC1=CC=CC=C1O SY012295 [1,0,1,0,0,0|1,0,1]=4 368 B10R1.4 NCCC1=CC=CC=C1N SY104426 [1,0,1,0,0,0|2,0,0]=4 369 B10R1.4 NCCC1=CC=CC=C1O SY040467 [1,0,1,0,0,0|1,0,0]=3 370 B10R1.4 OCCC1=C(Br)C=CC=C1 SY011299 [1,0,1,0,0,0|1,0,1]=4 371 B10R1.4 OCCC1=C(Cl)C=CC=C1 SY005018 [1,0,1,0,0,0|1,0,1]=4 372 B10R1.4 OCCC1=CC=CC=C1F SY021828 [1,0,1,0,0,0|1,0,1]=4 373 B10R1.4 OCCC1=CC=CC=C1I SY096684 [1,0,1,0,0,0|1,0,1]=4 374 B10R1.4 OCCC1=CC=CC=C1O SY066615 [1,0,1,0,0,0|0,0,1]=3 375 B10R1.20 C#CC1=CC=CC=C1C=O SY101505 [1,0,1,0,0,0|0,0,2]=4 376 B10R1.20 CCC1=CC=CC=C1C=O SY066602 [1,0,1,0,0,0|0,0,0]=2 377 B10R1.20 CCC1=CC=CC=C1ON SY282222 [1,0,1,0,0,0|1,0,0]=3 378 B10R1.20 CCC1=CC=CC=C1ON SY282223 [1,0,1,0,0,0|1,0,0]=3 379 B10R1.20 COC1=C(CCl)C=CC=C1 SY018869 [1,0,1,0,0,0|1,0,1]=4 380 B10R1.20 COC1=C(CO)C=CC=C1 SY019123 [1,0,1,0,0,0|1,0,1]=4 381 B10R1.20 COC1=CC=CC=C1C=O SY001108 [1,0,1,0,0,0|1,0,0]=3 382 B10R1.20 COC1=CC=CC=C1OC SY001445 [1,0,1,0,0,0|1,0,1]=4 383 B10R1.20 COC1=CC=CC=C1ON SY282052 [1,0,1,0,0,0|2,0,0]=4 384 B10R1.20 COC1=CC=CC=C1ON SY282053 [1,0,1,0,0,0|2,0,0]=4 385 B10R1.20 COC1=NC=CC=C1C=O SY022300 [1,0,1,0,0,0|2,0,0]=4 386 B10R1.20 CSC1=CC=CC=C1ON SY282194 [1,0,1,0,0,0|2,0,0]=4 387 B10R1.20 CSC1=CC=CC=C1ON SY282195 [1,0,1,0,0,0|2,0,0]=4 388 B10R1.20 N#CC1=C(C=O)C=CC=C1 SY005781 [1,0,1,0,0,0|1,0,1]=4 389 B10R1.20 O=CC1=CC=CC=C1CBr SY260825 [1,0,1,0,0,0|1,0,0]=3 390 B10R1.18 CC(=O)CC1=CC=NC=C1 SY002437 [1,0,1,0,0,0|2,0,0]=4 391 B10R1.18 CC(=O)CC1=CC=NC=C1 SY005221 [1,0,1,0,0,0|2,0,0]=4 392 B10R1.18 CC(=O)CC1=NC=CC=C1 SY002438 [1,0,1,0,0,0|2,0,0]=4 393 B10R1.18 CC(C)=CC1=CC=CC=C1 SY055240 [1,0,1,0,0,0|2,0,0]=4 394 B10R1.18 NC(=O)CC1=CC=CC=C1 SY017094 [1,0,1,0,0,0|2,0,0]=4 395 B10R1.18 NC(=O)OC1=CC=CC=C1 SY109407 [1,0,1,0,0,0|1,0,0]=3 396 B12R1.125 CC1=CC=CC=C1CCC(=O)O SY017785 [0,1,1,0,0,0|1,0,0]=3 397 B12R1.125 O=C(O)CCC1=CC=CC=C1Br SY017169 [0,1,1,0,0,0|1,0,0]=3 398 B12R1.125 O=C(O)CCC1=CC=CC=C1Cl SY003324 [0,1,1,0,0,0|1,0,0]=3 399 B12R1.125 O=C(O)CCC1=CC=CC=C1F SY016160 [0,1,1,0,0,0|1,0,0]=3 400 B12R1.125 O=C(O)CCC1=CC=CC=C1I SY238889 [0,1,1,0,0,0|1,0,0]=3 401 B12R1.125 O=C(O)CCC1=CC=CC=C1O SY101015 [0,1,1,0,0,0|0,0,0]=2 402 B12R1.125 O=C(O)CCC1=NC=CC=C1Br SY244454 [0,1,1,0,0,0|2,0,0]=4 403 B12R1.125 O=C(O)COC1=CC=CC=C1F SY008332 [0,1,1,0,0,0|2,0,0]=4 404 B12R1.125 O=C(O)\C=C\C1=CC=CC=C1O SY048367 [0,1,1,0,0,0|0,0,2]=4 405 B12R1.125 O=[N+]([O-])CCC1=CC=CC=C1Cl SY266525 [0,1,1,0,0,0|2,0,0]=4 406 B12R1.32 CCOC(=O)CC1=CC=CN=C1 SY021549 [0,1,1,0,0,0|2,0,0]=4 407 B12R1.32 CCOC(=O)CC1=CC=NC=C1 SY011574 [0,1,1,0,0,0|2,0,0]=4 408 B12R1.32 CCOC(=O)CC1=NC=CC=C1 SY001136 [0,1,1,0,0,0|2,0,0]=4 409 B12R1.32 COCC(=O)OC1=CC=CC=C1 SY261726 [0,1,1,0,0,0|0,0,0]=2 410 B12R1.32 N#CCC(=O)NC1=CC=CC=C1 SY043058 [0,1,1,0,0,0|1,0,1]=4 411 B12R1.34 COC(=O)C(=O)C1=CC=CC=C1 SY014788 [0,1,1,0,0,0|2,0,0]=4 412 B12R1.34 COC(=O)C(N)C1=CC=CC=C1 SY113594 [0,1,1,0,0,0|2,0,0]=4 413 B12R1.34 COC(=O)[C@@H](O)C1=CC=CC=C1 SY003754 [0,1,1,0,0,0|2,0,0]=4 414 B12R1.34 COC(=O)[C@H](N)C1=CC=CC=C1 SY020988 [0,1,1,0,0,0|2,0,0]=4 415 B12R1.34 COC(=O)[C@H](O)C1=CC=CC=C1 SY003762 [0,1,1,0,0,0|2,0,0]=4 416 B12R1.43 C=C(C)C(=O)NC1=CC=CC=C1 SY051128 [0,1,1,0,0,0|1,0,1]=4 417 B12R1.43 CC(N)C(=O)CC1=CC=CC=C1 SY147169 [0,1,1,0,0,0|1,0,0]=3 418 B12R1.75 CC(=O)NC1=CC=CC=C1CO SY011672 [0,1,1,0,0,0|2,0,0]=4 419 B12R1.75 CC(=O)OC1=CC=CC=C1CBr SY119613 [0,1,1,0,0,0|1,0,0]=3 420 B12R1.75 CCC1=CC=CC=C1OC(=O)Cl SY296970 [0,1,1,0,0,0|0,0,0]=2 421 B12R1.75 COC1=C(CC(=O)O)C=CC=C1 SY014484 [0,1,1,0,0,0|2,0,0]=4 422 B12R1.75 COC1=CC=CC=C1NC(C)=O SY107302 [0,1,1,0,0,0|2,0,0]=4 423 B12R1.75 COC1=CC=CC=C1OC(=O)Cl SY297050 [0,1,1,0,0,0|1,0,0]=3 424 B12R1.75 CSC1=CC=CC=C1OC(=O)Cl SY296822 [0,1,1,0,0,0|1,0,0]=3 425 B12R1.75 NCC1=CC=CC=C1CC(=O)O SY020261 [0,1,1,0,0,0|2,0,0]=4 426 B12R1.75 O=C(O)CC1=CC=CC=C1CBr SY266812 [0,1,1,0,0,0|2,0,0]=4 427 B12R1.169 CCOC1=CC=CC=C1OCC SY047589 [0,1,1,0,0,0|1,0,1]=4 428 B12R1.169 CCOC1=CC=CC=C1OCCl SY298548 [0,1,1,0,0,0|1,0,1]=4 429 B12R1.283 CC(C)C1=C(OCCl)C=CC=C1 SY298421 [0,1,1,0,0,0|1,0,1]=4 430 B12R1.124 CC1=CC=CC=C1C(F)C(=O)O SY263430 [0,1,1,0,0,0|2,0,0]=4 431 B12R1.127 CC(=O)NC1=CC(C)=CC=C1C SY036049 [0,1,1,0,0,0|1,0,0]=3 432 B12R1.127 CC(=O)NC1=CC(C)=CC=C1O SY001813 [0,1,1,0,0,0|2,0,0]=4 433 B12R1.127 CC(=O)NC1=CC(F)=CC=C1C SY005884 [0,1,1,0,0,0|1,0,0]=3 434 B12R1.127 CC(=O)OC1=CC(N)=CC=C1Cl SY250781 [0,1,1,0,0,0|1,0,0]=3 435 B12R1.127 CC1=CC(OC(=O)Cl)=C(C)C=C1 SY296809 [0,1,1,0,0,0|1,0,0]=3 436 B12R1.127 CC1=CC=C(Br)C(OC(=O)Cl)=C1 SY296928 [0,1,1,0,0,0|2,0,0]=4 437 B12R1.127 CC1=CC=C(Br)C=C1OC(=O)Cl SY296926 [0,1,1,0,0,0|1,0,0]=3 438 B12R1.127 CC1=CC=C(C)C(CC(=O)O)=C1 SY020969 [0,1,1,0,0,0|2,0,0]=4 439 B12R1.127 CC1=CC=C(Cl)C=C1OC(=O)Cl SY296919 [0,1,1,0,0,0|1,0,0]=3 440 B12R1.127 CC1=CC=C(F)C(OC(=O)Cl)=C1 SY296850 [0,1,1,0,0,0|2,0,0]=4 441 B12R1.127 CC1=CC=C(F)C=C1OC(=O)Cl SY296813 [0,1,1,0,0,0|1,0,0]=3 442 B12R1.127 O=C(Cl)OC1=CC(Br)=CC=C1Br SY296849 [0,1,1,0,0,0|2,0,0]=4 443 B12R1.127 O=C(Cl)OC1=CC(Br)=CC=C1F SY296821 [0,1,1,0,0,0|2,0,0]=4 444 B12R1.127 O=C(Cl)OC1=CC(Cl)=CC=C1F SY296917 [0,1,1,0,0,0|2,0,0]=4 445 B12R1.127 O=C(Cl)OC1=CC(F)=CC=C1Br SY296965 [0,1,1,0,0,0|2,0,0]=4 446 B12R1.127 O=C(Cl)OC1=CC(F)=CC=C1Cl SY296932 [0,1,1,0,0,0|2,0,0]=4 447 B12R1.127 O=C(Cl)OC1=CC(F)=CC=C1F SY296907 [0,1,1,0,0,0|2,0,0]=4 448 B12R1.151 CC1=C(OC(C)(C)C)C=CC=C1 SY298710 [0,1,1,0,0,0|1,0,1]=4 449 B12R1.224 CC(=O)OC1=CN=CC(F)=C1C SY129418 [0,1,1,0,0,0|1,0,0]=3 450 B12R1.224 CC1=C(Cl)C=CC=C1OC(=O)Cl SY296929 [0,1,1,0,0,0|1,0,0]=3 451 B12R1.224 CC1=C(F)C(OC(=O)Cl)=CC=C1 SY296848 [0,1,1,0,0,0|2,0,0]=4 452 B12R1.224 CC1=C(F)C=CC=C1OC(=O)Cl SY297037 [0,1,1,0,0,0|1,0,0]=3 453 B12R1.224 O=C(Cl)OC1=CC=CC(Cl)=C1F SY296854 [0,1,1,0,0,0|2,0,0]=4 454 B12R1.224 O=C(Cl)OC1=CC=CC(F)=C1Br SY296967 [0,1,1,0,0,0|2,0,0]=4 455 B12R1.224 O=C(Cl)OC1=CC=CC(F)=C1Cl SY296935 [0,1,1,0,0,0|2,0,0]=4 456 B12R1.224 O=C(Cl)OC1=CC=CC(F)=C1F SY296961 [0,1,1,0,0,0|2,0,0]=4 457 B12R1.1009 CC(=O)NC1=C(C)C=CC=C1C SY061310 [0,1,1,0,0,0|1,0,0]=3 458 B12R1.1009 CC(=O)NC1=C(C)C=CN=C1Cl SY037248 [0,1,1,0,0,0|2,0,0]=4 459 B12R1.1009 CC(=O)OC1=C(C)C=CC=C1C SY294412 [0,1,1,0,0,0|0,0,0]=2 460 B12R1.1009 CC1=C(OC(=O)Cl)C(Cl)=CC=C1 SY296921 [0,1,1,0,0,0|1,0,0]=3 461 B12R1.1009 O=C(Cl)OC1=C(Br)C=CC=C1Br SY296837 [0,1,1,0,0,0|2,0,0]=4 462 B12R1.1009 O=C(Cl)OC1=C(Cl)C=CC=C1Cl SY293022 [0,1,1,0,0,0|2,0,0]=4 463 B12R1.1009 O=C(Cl)OC1=C(F)C=CC=C1Cl SY296857 [0,1,1,0,0,0|2,0,0]=4 464 B12R1.1009 O=C(Cl)OC1=C(F)C=CC=C1F SY293021 [0,1,1,0,0,0|2,0,0]=4 465 B12R1.27 C=CC(=O)OCC1=CC=CC=C1 SY004327 [0,1,1,0,0,0|2,0,0]=4 466 B12R1.27 COC(=O)CCC1=CC=CC=C1 SY017877 [0,1,1,0,0,0|0,0,0]=2 467 B12R1.27 COC(=O)CCC1=CC=NC=C1 SY022395 [0,1,1,0,0,0|1,0,0]=3 468 B12R1.27 COC(=O)CCC1=NC=CC=C1 SY022458 [0,1,1,0,0,0|1,0,0]=3 469 B12R1.27 COC(=O)COC1=CC=CC=C1 SY037886 [0,1,1,0,0,0|1,0,0]=3 470 B12R1.27 NCC(=O)OCC1=CC=CC=C1 SY021003 [0,1,1,0,0,0|2,0,0]=4 471 B12R1.27 NCC(=O)OCC1=CC=CC=C1 SY038933 [0,1,1,0,0,0|2,0,0]=4 472 B12R1.27 NNC(=O)OCC1=CC=CC=C1 SY017007 [0,1,1,0,0,0|2,0,0]=4 473 B12R1.27 O=C(CBr)OCC1=CC=CC=C1 SY002918 [0,1,1,0,0,0|2,0,0]=4 474 B12R1.27 O=C(CO)OCC1=CC=CC=C1 SY115712 [0,1,1,0,0,0|1,0,0]=3 475 B12R1.27 O=C(NO)OCC1=CC=CC=C1 SY024162 [0,1,1,0,0,0|1,0,0]=3 476 B12R1.107 CC(=O)CC(=O)C1=CC=CC=C1 SY011141 [0,1,1,0,0,0|1,0,1]=4 477 B12R1.107 CC(=O)NC(C)C1=CC=CC=C1 SY007036 [0,1,1,0,0,0|2,0,0]=4 478 B12R1.107 CC(CC(N)=O)C1=CC=CC=C1 SY249488 [0,1,1,0,0,0|1,0,0]=3 479 B12R1.107 CN(CC(=O)O)C1=NC=CC=C1 SY008636 [0,1,1,0,0,0|2,0,0]=4 480 B12R1.107 C[C@@H](CC(=O)O)C1=CC=CC=C1 SY231348 [0,1,1,0,0,0|0,0,0]=2 481 B12R1.107 C[C@H](CC(=O)O)C1=CC=CC=C1 SY226436 [0,1,1,0,0,0|0,0,0]=2 482 B12R1.107 NC(CC(=O)O)C1=CC=CC=C1 SY002485 [0,1,1,0,0,0|0,0,0]=2 483 B12R1.107 NC(CC(=O)O)C1=CC=CN=C1 SY013379 [0,1,1,0,0,0|1,0,0]=3 484 B12R1.107 N[C@@H](CC(=O)O)C1=CC=CC=C1 SY017494 [0,1,1,0,0,0|0,0,0]=2 485 B12R1.107 N[C@H](CC(=O)O)C1=CC=CC=C1 SY014163 [0,1,1,0,0,0|0,0,0]=2 486 B12R1.107 O=C(O)CC(=O)C1=CC=CC=C1 SY045029 [0,1,1,0,0,0|0,0,1]=3 487 B12R1.107 O=C(O)CC(O)C1=CC=CC=C1 SY017555 [0,1,1,0,0,0|0,0,0]=2 488 B12R1.891 O=S(=O)(Cl)CCC1=CC=CC=C1 SY039026 [0,1,1,0,0,0|1,0,1]=4 489 B12R2.1081 BrC1=C2OCCNC2=CC=C1 SY027328 [1,1,0,0,0,0|1,0,1]=4 490 B12R2.1081 BrC1=CC=CC2=C1CCCN2 SY097814 [1,1,0,0,0,0|1,0,1]=4 491 B12R2.1081 BrC1=CC=CC2=C1CCCO2 SY121094 [1,1,0,0,0,0|0,0,1]=3 492 B12R2.1081 BrC1=CC=CC2=C1CCNC2 SY021156 [1,1,0,0,0,0|2,0,0]=4 493 B12R2.1081 BrC1=CC=CC2=C1CCNC2 SY041598 [1,1,0,0,0,0|2,0,0]=4 494 B12R2.1081 BrC1=CC=CC2=C1CNCC2 SY021179 [1,1,0,0,0,0|2,0,0]=4 495 B12R2.1081 BrC1=CC=CC2=C1CNCC2 SY041614 [1,1,0,0,0,0|2,0,0]=4 496 B12R2.1081 CC1=C2NCCOC2=CC=C1 SY130750 [1,1,0,0,0,0|1,0,1]=4 497 B12R2.1081 CC1=C2OCCOC2=CC=C1 SY252849 [1,1,0,0,0,0|1,0,1]=4 498 B12R2.1081 CC1=CC=CC2=C1NCCC2 SY081306 [1,1,0,0,0,0|1,0,1]=4 499 B12R2.1081 CC1NCCC2=C1C=CC=C2 SY027949 [1,1,0,0,0,0|2,0,0]=4 500 B12R2.1081 ClC1=C2OCCNC2=CC=C1 SY130743 [1,1,0,0,0,0|1,0,1]=4 501 B12R2.1081 ClC1=CC=CC2=C1CNCC2 SY041616 [1,1,0,0,0,0|2,0,0]=4 502 B12R2.1081 ClC1=CC=CC2=C1NCCC2 SY183818 [1,1,0,0,0,0|1,0,1]=4 503 B12R2.1081 FC1=C2NCCOC2=CC=C1 SY130736 [1,1,0,0,0,0|1,0,1]=4 504 B12R2.1081 FC1=C2OCCNC2=CC=C1 SY114250 [1,1,0,0,0,0|1,0,1]=4 505 B12R2.1081 NC1=C2NCCOC2=CC=C1 SY130749 [1,1,0,0,0,0|1,0,1]=4 506 B12R2.1081 NC1=C2OCCOC2=CC=C1 SY041972 [1,1,0,0,0,0|1,0,1]=4 507 B12R2.1081 NC1=CC=CC2=C1CCNC2 SY116736 [1,1,0,0,0,0|2,0,0]=4 508 B12R2.1081 NC1CCCC2=C1C=CC=C2 SY004141 [1,1,0,0,0,0|1,0,1]=4 509 B12R2.1081 NC1CCOC2=C1C=CC=C2 SY009356 [1,1,0,0,0,0|0,0,1]=3 510 B12R2.1081 NC1CCOC2=CC=CN=C21 SY263199 [1,1,0,0,0,0|1,0,1]=4 511 B12R2.1081 N[C@@H]1CCCC2=C1C=CC=C2 SY045443 [1,1,0,0,0,0|1,0,1]=4 512 B12R2.1081 N[C@@H]1CCOC2=C1C=CC=C2 SY030240 [1,1,0,0,0,0|0,0,1]=3 513 B12R2.1081 N[C@@H]1CCOC2=C1C=CC=C2 SY239976 [1,1,0,0,0,0|0,0,1]=3 514 B12R2.1081 N[C@H]1CCCC2=C1C=CC=C2 SY001972 [1,1,0,0,0,0|1,0,1]=4 515 B12R2.1081 N[C@H]1CCOC2=C1C=CC=C2 SY020601 [1,1,0,0,0,0|0,0,1]=3 516 B12R2.1081 O=C1C=COC2=C1C=CC=C2 SY020315 [1,1,0,0,0,0|0,0,2]=4 517 B12R2.1081 O=C1CCCC2=C1C=CC=C2 SY001538 [1,1,0,0,0,0|1,0,1]=4 518 B12R2.1081 O=C1CCOC2=C1C=CC=C2 SY003783 [1,1,0,0,0,0|0,0,2]=4 519 B12R2.1081 O=C1NCCC2=C1C=CC=C2 SY021304 [1,1,0,0,0,0|2,0,0]=4 520 B12R2.1081 O=C1OCCC2=C1C=CC=C2 SY031574 [1,1,0,0,0,0|2,0,0]=4 521 B12R2.1081 OC1=C2CCCCC2=CC=C1 SY049625 [1,1,0,0,0,0|1,0,1]=4 522 B12R2.1081 OC1=C2NCCCC2=CC=C1 SY010056 [1,1,0,0,0,0|1,0,1]=4 523 B12R2.1081 OC1=C2OCCOC2=CC=C1 SY104249 [1,1,0,0,0,0|1,0,1]=4 524 B12R2.1081 OC1CCCC2=CC=CC=C21 SY009329 [1,1,0,0,0,0|1,0,1]=4 525 B12R2.1081 OC1CCOC2=C1C=CC=C2 SY027475 [1,1,0,0,0,0|0,0,1]=3 526 B12R2.1081 O[C@H]1CCCC2=C1C=CC=C2 SY104799 [1,1,0,0,0,0|1,0,1]=4 527 B12R2.1 O=CC1=C2C=CC=CC2=NO1 SY246815 [0,1,0,0,1,0|2,0,0]=4 528 B12R2.1 O=CC1=COC2=CC=CC=C12 SY023570 [0,1,0,0,1,0|1,0,1]=4 529 B12R2.1 O=CC1=CSC2=C1C=CC=C2 SY014520 [0,1,0,0,1,0|1,0,1]=4 530 B12R2.1 O=CC1=NNC2=C1C=CC=C2 SY004602 [0,1,0,0,1,0|2,0,0]=4 531 B12R2.1 OCC1CCC2=C1C=CC=C2 SY030168 [0,1,0,0,1,0|0,0,2]=4 532 B12R2.18 CC1CC2=C(C=CC=C2)C1=O SY081370 [0,1,0,0,1,0|0,0,0]=2 533 B12R2.18 NC1C2=CC=CC=C2CC1O SY003676 [0,1,0,0,1,0|1,0,1]=4 534 B12R2.18 NN1SC2=CC=CC=C2C1=O SY294805 [0,1,0,0,1,0|2,0,0]=4 535 B12R2.18 N[C@@H]1C2=C(C=CC=C2)C[C@@H]1O SY007785 [0,1,0,0,1,0|1,0,1]=4 536 B12R2.18 N[C@@H]1C2=C(C=CC=C2)C[C@H]1O SY007747 [0,1,0,0,1,0|1,0,1]=4 537 B12R2.18 N[C@H]1C2=C(C=CC=C2)C[C@@H]1O SY007896 [0,1,0,0,1,0|1,0,1]=4 538 B12R2.18 N[C@H]1C2=C(C=CC=C2)C[C@H]1O SY009651 [0,1,0,0,1,0|1,0,1]=4 539 B12R2.18 N[C@H]1C2=C(C=CC=C2)C[C@H]1O SY279293 [0,1,0,0,1,0|1,0,1]=4 540 B12R2.18 O=C1CC2=C(C=CC=C2)C1=O SY016747 [0,1,0,0,1,0|0,0,1]=3 541 B12R2.18 O=C1NC2=CC=CC=C2C1=O SY005277 [0,1,0,0,1,0|1,0,1]=4 542 B12R2.18 O=C1OC2=CC=CC=C2C1=O SY023499 [0,1,0,0,1,0|1,0,1]=4 543 B12R2.18 O[C@@H]1C2=C(C=CC=C2)C[C@H]1Br SY015553 [0,1,0,0,1,0|0,0,2]=4 544 B12R2.132 CC1=CC=C2CCC(=O)C2=C1 SY019194 [0,1,0,0,1,0|0,0,0]=2 545 B12R2.132 NC1=CC2=C(C=C1)CNC2=O SY031793 [0,1,0,0,1,0|1,0,0]=3 546 B12R2.132 O=C1CCC2=C1C=C(Br)C=C2 SY007083 [0,1,0,0,1,0|0,0,0]=2 547 B12R2.132 O=C1CCC2=C1C=C(Cl)C=C2 SY021488 [0,1,0,0,1,0|0,0,0]=2 548 B12R2.132 O=C1CCC2=C1C=C(O)C=C2 SY047079 [0,1,0,0,1,0|0,0,0]=2 549 B12R2.132 O=C1CCC2=CC=C(F)C=C12 SY010637 [0,1,0,0,1,0|0,0,0]=2 550 B12R2.132 O=C1COC2=CC=C(Br)C=C12 SY009757 [0,1,0,0,1,0|1,0,0]=3 551 B12R2.132 O=C1COC2=CC=C(Cl)C=C12 SY011536 [0,1,0,0,1,0|1,0,0]=3 552 B12R2.132 O=C1COC2=CC=C(F)C=C12 SY011534 [0,1,0,0,1,0|1,0,0]=3 553 B12R2.132 O=C1NCC2=C1C=C(Br)C=C2 SY017598 [0,1,0,0,1,0|1,0,0]=3 554 B12R2.132 O=C1NCC2=C1C=C(F)C=C2 SY043062 [0,1,0,0,1,0|1,0,0]=3 555 B12R2.132 O=C1NCC2=C1C=C(O)C=C2 SY031207 [0,1,0,0,1,0|1,0,0]=3 556 B12R2.132 O=C1NNC2=C1C=C(Br)C=C2 SY046900 [0,1,0,0,1,0|2,0,0]=4 557 B12R2.132 O=C1NOC2=C1C=C(Br)C=C2 SY041232 [0,1,0,0,1,0|2,0,0]=4 558 B12R2.132 O=C1NOC2=CC=C(I)C=C12 SY280846 [0,1,0,0,1,0|2,0,0]=4 559 B12R2.132 O=C1OCC2=C1C=C(Br)C=C2 SY030534 [0,1,0,0,1,0|1,0,0]=3 560 B12R2.132 OC1CCC2=C1C=C(Br)C=C2 SY115499 [0,1,0,0,1,0|0,0,2]=4 561 B12R2.196 CC1=C2OCC(=O)C2=CC=C1 SY023821 [0,1,0,0,1,0|1,0,0]=3 562 B12R2.196 CC1=CC=CC2=C1CCC2=O SY023823 [0,1,0,0,1,0|0,0,0]=2 563 B12R2.196 CN1CCC2=C1C=CC=C2N SY142604 [0,1,0,0,1,0|2,0,0]=4 564 B12R2.196 NC1=CC=CC2=C1CNC2=O SY042841 [0,1,0,0,1,0|1,0,0]=3 565 B12R2.196 O=C1CCC2=C(Br)C=CC=C12 SY017585 [0,1,0,0,1,0|0,0,0]=2 566 B12R2.196 O=C1CCC2=C1C=CC=C2Cl SY041548 [0,1,0,0,1,0|0,0,0]=2 567 B12R2.196 O=C1CCC2=C1C=CC=C2F SY101474 [0,1,0,0,1,0|0,0,0]=2 568 B12R2.196 O=C1CCC2=C1C=CC=C2O SY020876 [0,1,0,0,1,0|0,0,0]=2 569 B12R2.196 O=C1CCC2=C1C=NC=C2Br SY249965 [0,1,0,0,1,0|1,0,0]=3 570 B12R2.196 O=C1COC2=C(Br)C=CC=C12 SY097073 [0,1,0,0,1,0|1,0,0]=3 571 B12R2.196 O=C1NCC2=C1C=CC=C2Br SY017599 [0,1,0,0,1,0|1,0,0]=3 572 B12R2.196 O=C1NCC2=C1C=CC=C2Cl SY057487 [0,1,0,0,1,0|1,0,0]=3 573 B12R2.196 O=C1NCC2=C1C=CN=C2Cl SY060577 [0,1,0,0,1,0|2,0,0]=4 574 B12R2.196 O=C1NOC2=C(Br)C=CC=C12 SY280819 [0,1,0,0,1,0|2,0,0]=4 575 B12R2.196 O=C1NOC2=C(Cl)C=CC=C12 SY280840 [0,1,0,0,1,0|2,0,0]=4 576 B12R2.196 O=C1OCC2=C(Br)C=CC=C12 SY110693 [0,1,0,0,1,0|1,0,0]=3 577 B12R2.196 O=C1OCC2=C1C=CC=C2Cl SY001014 [0,1,0,0,1,0|1,0,0]=3 578 B12R2.196 O=C1OCC2=C1C=CC=C2O SY274862 [0,1,0,0,1,0|1,0,0]=3 579 B12R2.203 CC1=C2C(=O)NOC2=CC=C1 SY280842 [0,1,0,0,1,0|2,0,0]=4 580 B12R2.203 CC1=CC=CC2=C1C(=O)CC2 SY116573 [0,1,0,0,1,0|0,0,0]=2 581 B12R2.203 NC1CCC2=C1C(Br)=CC=C2 SY244736 [0,1,0,0,1,0|1,0,1]=4 582 B12R2.203 NC1CCC2=C1C(F)=CC=C2 SY265846 [0,1,0,0,1,0|1,0,1]=4 583 B12R2.203 NC1CCC2=C1C(O)=CC=C2 SY263192 [0,1,0,0,1,0|1,0,1]=4 584 B12R2.203 O=C1CCC2=C1C(Br)=CC=C2 SY035082 [0,1,0,0,1,0|0,0,0]=2 585 B12R2.203 O=C1CCC2=C1C(Cl)=CC=C2 SY041547 [0,1,0,0,1,0|0,0,0]=2 586 B12R2.203 O=C1CCC2=C1C(F)=CC=C2 SY021872 [0,1,0,0,1,0|0,0,0]=2 587 B12R2.203 O=C1CCC2=C1C(O)=CC=C2 SY008240 [0,1,0,0,1,0|0,0,0]=2 588 B12R2.203 O=C1NCC2=C1C(Br)=CC=C2 SY105412 [0,1,0,0,1,0|1,0,0]=3 589 B12R2.203 O=C1NCC2=C1C(Cl)=CC=C2 SY057490 [0,1,0,0,1,0|1,0,0]=3 590 B12R2.203 O=C1NNC2=C1C(Br)=CC=C2 SY020829 [0,1,0,0,1,0|2,0,0]=4 591 B12R2.203 O=C1NOC2=CC=CC(F)=C12 SY113965 [0,1,0,0,1,0|2,0,0]=4 592 B12R2.203 O=C1OCC2=C1C(Br)=CC=C2 SY272662 [0,1,0,0,1,0|1,0,0]=3 593 B12R2.203 O=C1OCC2=C1C(Cl)=CC=C2 SY001015 [0,1,0,0,1,0|1,0,0]=3 594 B12R2.612 CC1=CC2=C(C=C1)C(=O)CC2 SY107054 [0,1,0,0,1,0|0,0,0]=2 595 B12R2.612 CC1=CC2=C(C=C1)C(=O)OC2 SY046065 [0,1,0,0,1,0|1,0,0]=3 596 B12R2.612 CC1=CC=C2C(=O)COC2=C1 SY058301 [0,1,0,0,1,0|1,0,0]=3 597 B12R2.612 NC1=CC2=C(C=C1)C(=O)CC2 SY047054 [0,1,0,0,1,0|0,0,0]=2 598 B12R2.612 NC1=CC2=C(C=C1)C(=O)NC2 SY009635 [0,1,0,0,1,0|1,0,0]=3 599 B12R2.612 NC1=CC2=C(C=C1)C(=O)NN2 SY021946 [0,1,0,0,1,0|2,0,0]=4 600 B12R2.612 NC1=CC2=C(C=C1)C(=O)OC2 SY024775 [0,1,0,0,1,0|1,0,0]=3 601 B12R2.612 NC1CCC2=C1C=CC(Br)=C2 SY249642 [0,1,0,0,1,0|1,0,1]=4 602 B12R2.612 O=C1CCC2=C1C=CC(Br)=C2 SY001016 [0,1,0,0,1,0|0,0,0]=2 603 B12R2.612 O=C1CCC2=C1C=CC(Cl)=C2 SY004428 [0,1,0,0,1,0|0,0,0]=2 604 B12R2.612 O=C1CCC2=C1C=CC(O)=C2 SY002061 [0,1,0,0,1,0|0,0,0]=2 605 B12R2.612 O=C1CCC2=CC(Cl)=CN=C12 SY292828 [0,1,0,0,1,0|1,0,0]=3 606 B12R2.612 O=C1CCC2=CC(F)=CC=C12 SY017170 [0,1,0,0,1,0|0,0,0]=2 607 B12R2.612 O=C1COC2=C1C=CC(O)=C2 SY019039 [0,1,0,0,1,0|1,0,0]=3 608 B12R2.612 O=C1COC2=CC(Br)=CC=C12 SY033914 [0,1,0,0,1,0|1,0,0]=3 609 B12R2.612 O=C1COC2=CC(Cl)=CC=C12 SY009720 [0,1,0,0,1,0|1,0,0]=3 610 B12R2.612 O=C1COC2=CC(F)=CC=C12 SY011535 [0,1,0,0,1,0|1,0,0]=3 611 B12R2.612 O=C1NCC2=C1C=CC(Br)=C2 SY024144 [0,1,0,0,1,0|1,0,0]=3 612 B12R2.612 O=C1NCC2=C1C=CC(Cl)=C2 SY033496 [0,1,0,0,1,0|1,0,0]=3 613 B12R2.612 O=C1NCC2=C1C=CC(F)=C2 SY258649 [0,1,0,0,1,0|1,0,0]=3 614 B12R2.612 O=C1NCC2=C1C=CC(O)=C2 SY031206 [0,1,0,0,1,0|1,0,0]=3 615 B12R2.612 O=C1NCC2=CC(Br)=CN=C12 SY250056 [0,1,0,0,1,0|2,0,0]=4 616 B12R2.612 O=C1NOC2=CC(Br)=CC=C12 SY112425 [0,1,0,0,1,0|2,0,0]=4 617 B12R2.612 O=C1NOC2=CC(Cl)=CC=C12 SY104108 [0,1,0,0,1,0|2,0,0]=4 618 B12R2.612 O=C1NOC2=CC(I)=CC=C12 SY280799 [0,1,0,0,1,0|2,0,0]=4 619 B12R2.612 O=C1NSC2=CC(Br)=CC=C12 SY290156 [0,1,0,0,1,0|2,0,0]=4 620 B12R2.612 O=C1OCC2=C1C=CC(Br)=C2 SY020509 [0,1,0,0,1,0|1,0,0]=3 621 B12R2.612 O=C1OCC2=C1C=CC(O)=C2 SY244477 [0,1,0,0,1,0|1,0,0]=3 622 B12R2.612 O[C@@H]1CCC2=C1C=CC(Br)=C2 SY123884 [0,1,0,0,1,0|0,0,2]=4 623 B12R2.612 O[C@H]1CCC2=C1C=CC(Br)=C2 SY258330 [0,1,0,0,1,0|0,0,2]=4 624 B12R2.2028 O=C1C=C(Br)C2=C1C=CC=C2 SY268545 [0,1,0,0,1,0|0,0,2]=4 625 B12R2.2028 O=C1CC(=O)C2=C1C=CC=C2 SY014846 [0,1,0,0,1,0|0,0,1]=3 626 B12R2.2028 O=C1CC(Br)C2=C1C=CC=C2 SY031995 [0,1,0,0,1,0|0,0,0]=2 627 B12R2.2028 O=C1OC(Br)C2=C1C=CC=C2 SY036169 [0,1,0,0,1,0|1,0,0]=3 628 B12R2.2028 O=C1OC(O)C2=C1C=CC=C2 SY270554 [0,1,0,0,1,0|1,0,0]=3 629 B12R2.2028 O=C1O[IH2](O)C2=CC=CC=C12 SY041374 [0,1,0,0,1,0|2,0,0]=4 630 B12R2.2028 O=C1[N-]C(=O)C2=CC=CC=C12 SY001384 [0,1,0,0,1,0|1,0,1]=4 631 B12R2.32 BrCC1=CC2=CC=CC=C2O1 SY045637 [0,1,0,0,1,0|1,0,1]=4 632 B12R2.32 CCC1=CC2=CC=CC=C2O1 SY067362 [0,1,0,0,1,0|1,0,1]=4 633 B12R2.32 ClCC1=CC2=CC=CC=C2O1 SY045662 [0,1,0,0,1,0|1,0,1]=4 634 B12R2.32 NCC1=CC2=CC=CC=C2O1 SY026572 [0,1,0,0,1,0|1,0,1]=4 635 B12R2.32 NCC1=NC2=CC=CC=C2O1 SY026571 [0,1,0,0,1,0|2,0,0]=4 636 B12R2.32 O=CC1=CC2=C(C=CC=C2)N1 SY042244 [0,1,0,0,1,0|1,0,1]=4 637 B12R2.32 O=CC1=CC2=CC=CC=C2O1 SY013762 [0,1,0,0,1,0|0,0,1]=3 638 B12R2.32 O=CC1=CC2=CC=CC=C2S1 SY019968 [0,1,0,0,1,0|0,1,1]=4 639 B12R2.32 O=CC1=NC2=CC=CC=C2N1 SY025423 [0,1,0,0,1,0|2,0,0]=4 640 B12R2.32 O=CC1=NC2=CC=CC=C2O1 SY206427 [0,1,0,0,1,0|1,0,0]=3 641 B12R2.32 O=CC1=NC2=CC=CC=C2S1 SY059450 [0,1,0,0,1,0|1,1,0]=4 642 B12R2.32 OCC1=CC2=CC=CC=C2O1 SY122875 [0,1,0,0,1,0|0,0,2]=4 643 B12R2.32 OCC1CC2=CC=CC=C2O1 SY045474 [0,1,0,0,1,0|0,0,2]=4 644 B12R2.202 CC1=C2N=C(Cl)OC2=CC=C1 SY130043 [0,1,0,0,1,0|2,0,0]=4 645 B12R2.202 CC1=C2N=C(N)OC2=CC=C1 SY130057 [0,1,0,0,1,0|2,0,0]=4 646 B12R2.202 CC1=C2NC(=O)OC2=CC=C1 SY130158 [0,1,0,0,1,0|1,0,0]=3 647 B12R2.202 CC1=C2NC(=S)OC2=CC=C1 SY086235 [0,1,0,0,1,0|1,1,0]=4 648 B12R2.202 CC1=CC2=C(C1)C(Br)=CC=C2 SY035152 [0,1,0,0,1,0|2,0,0]=4 649 B12R2.202 CC1=CC2=CC=CC(Br)=C2O1 SY045664 [0,1,0,0,1,0|1,0,1]=4 650 B12R2.202 CC1=CC=CC2=C1CC(=O)N2 SY009386 [0,1,0,0,1,0|1,0,0]=3 651 B12R2.202 CC1=CC=CC2=C1NC(=O)C2 SY084752 [0,1,0,0,1,0|1,0,0]=3 652 B12R2.202 CC1=NC2=C(C)C=CC=C2O1 SY018726 [0,1,0,0,1,0|2,0,0]=4 653 B12R2.202 CC1=NC2=C(F)C=CC=C2O1 SY130014 [0,1,0,0,1,0|2,0,0]=4 654 B12R2.202 CC1=NC2=C(N)C=CC=C2O1 SY064932 [0,1,0,0,1,0|2,0,0]=4 655 B12R2.202 CC1=NC2=CC=CC(Br)=C2O1 SY018761 [0,1,0,0,1,0|2,0,0]=4 656 B12R2.202 CC1=NC2=CC=CC(Cl)=C2O1 SY130010 [0,1,0,0,1,0|2,0,0]=4 657 B12R2.202 CC1=NC2=CC=CC(F)=C2O1 SY130006 [0,1,0,0,1,0|2,0,0]=4 658 B12R2.202 CC1=NC2=CC=CC(O)=C2O1 SY274444 [0,1,0,0,1,0|2,0,0]=4 659 B12R2.202 ClC1=NC2=CC=CC(Br)=C2O1 SY130050 [0,1,0,0,1,0|2,0,0]=4 660 B12R2.202 ClC1=NC2=CC=CC(Cl)=C2O1 SY130052 [0,1,0,0,1,0|2,0,0]=4 661 B12R2.202 FC1=C2N=C(Cl)OC2=CC=C1 SY130055 [0,1,0,0,1,0|2,0,0]=4 662 B12R2.202 FC1=C2NC(=S)OC2=CC=C1 SY130039 [0,1,0,0,1,0|1,1,0]=4 663 B12R2.202 FC1=C2OC(=S)NC2=CC=C1 SY130032 [0,1,0,0,1,0|1,1,0]=4 664 B12R2.202 FC1=C2OC(Cl)=NC2=CC=C1 SY130048 [0,1,0,0,1,0|2,0,0]=4 665 B12R2.202 NC1=C2NC(=O)OC2=CC=C1 SY130163 [0,1,0,0,1,0|1,0,0]=3 666 B12R2.202 NC1=C2NC(=S)OC2=CC=C1 SY130027 [0,1,0,0,1,0|1,1,0]=4 667 B12R2.202 NC1=C2OC(=O)NC2=CC=C1 SY055244 [0,1,0,0,1,0|1,0,0]=3 668 B12R2.202 NC1=CC=CC2=C1NC(=O)C2 SY248415 [0,1,0,0,1,0|1,0,0]=3 669 B12R2.202 NC1=NC2=C(F)C=CC=C2O1 SY130080 [0,1,0,0,1,0|2,0,0]=4 670 B12R2.202 NC1=NC2=C(N)C=CC=C2O1 SY130066 [0,1,0,0,1,0|2,0,0]=4 671 B12R2.202 NC1=NC2=CC=CC(Br)=C2O1 SY116064 [0,1,0,0,1,0|2,0,0]=4 672 B12R2.202 NC1=NC2=CC=CC(Cl)=C2O1 SY130060 [0,1,0,0,1,0|2,0,0]=4 673 B12R2.202 NC1=NC2=CC=CC(F)=C2O1 SY130068 [0,1,0,0,1,0|2,0,0]=4 674 B12R2.202 O=C1CC2=C(Br)C=CN=C2N1 SY033197 [0,1,0,0,1,0|2,0,0]=4 675 B12R2.202 O=C1CC2=C(C1)C(Br)=CC=C2 SY022357 [0,1,0,0,1,0|1,0,0]=3 676 B12R2.202 O=C1CC2=C(C=CC=C2Br)N1 SY003107 [0,1,0,0,1,0|1,0,0]=3 677 B12R2.202 O=C1CC2=C(C=CC=C2Cl)N1 SY009372 [0,1,0,0,1,0|1,0,0]=3 678 B12R2.202 O=C1CC2=C(C=CC=C2F)N1 SY105094 [0,1,0,0,1,0|1,0,0]=3 679 B12R2.202 O=C1CC2=C(C=CC=C2I)N1 SY224083 [0,1,0,0,1,0|1,0,0]=3 680 B12R2.202 O=C1CC2=C(C=CC=C2O)N1 SY036030 [0,1,0,0,1,0|1,0,0]=3 681 B12R2.202 O=C1CC2=C(N1)C(Br)=CC=C2 SY029304 [0,1,0,0,1,0|1,0,0]=3 682 B12R2.202 O=C1CC2=C(N1)C(F)=CC=C2 SY029301 [0,1,0,0,1,0|1,0,0]=3 683 B12R2.202 O=C1CC2=C(N=CC=C2Cl)N1 SY008984 [0,1,0,0,1,0|2,0,0]=4 684 B12R2.202 O=C1NC2=C(F)C=CC=C2O1 SY130173 [0,1,0,0,1,0|1,0,0]=3 685 B12R2.202 O=C1NC2=CC=CC(Br)=C2O1 SY077887 [0,1,0,0,1,0|1,0,0]=3 686 B12R2.202 O=C1NC2=CC=CC(Cl)=C2O1 SY130170 [0,1,0,0,1,0|1,0,0]=3 687 B12R2.202 O=C1NC2=CC=CC(F)=C2O1 SY130165 [0,1,0,0,1,0|1,0,0]=3 688 B12R2.202 OC1=CC=CC2=C1NC(=S)O2 SY008400 [0,1,0,0,1,0|1,1,0]=4 689 B12R2.202 S=C1NC2=CC=CC(Br)=C2O1 SY130035 [0,1,0,0,1,0|1,1,0]=4 690 B12R2.202 S=C1NC2=CC=CC(Cl)=C2O1 SY058054 [0,1,0,0,1,0|1,1,0]=4 691 B12R2.606 CC1=CC2=C(C=C1)CC(=O)N2 SY020777 [0,1,0,0,1,0|1,0,0]=3 692 B12R2.606 CC1=CC2=C(C=C1)OC(C)=N2 SY018752 [0,1,0,0,1,0|2,0,0]=4 693 B12R2.606 CC1=CC2=CC(N)=CC=C2O1 SY045624 [0,1,0,0,1,0|1,0,1]=4 694 B12R2.606 CC1=CC=C2N=C(C)OC2=C1 SY130000 [0,1,0,0,1,0|2,0,0]=4 695 B12R2.606 CC1=CC=C2N=C(Cl)OC2=C1 SY130045 [0,1,0,0,1,0|2,0,0]=4 696 B12R2.606 CC1=CC=C2N=C(N)OC2=C1 SY084800 [0,1,0,0,1,0|2,0,0]=4 697 B12R2.606 CC1=CC=C2NC(=O)NC2=C1 SY045908 [0,1,0,0,1,0|2,0,0]=4 698 B12R2.606 CC1=CC=C2NC(=O)OC2=C1 SY081557 [0,1,0,0,1,0|1,0,0]=3 699 B12R2.606 CC1=CC=C2NC(=S)OC2=C1 SY130029 [0,1,0,0,1,0|1,1,0]=4 700 B12R2.606 CC1=NC2=C(C=CC(Br)=C2)O1 SY018737 [0,1,0,0,1,0|2,0,0]=4 701 B12R2.606 CC1=NC2=CC(F)=CC=C2O1 SY018734 [0,1,0,0,1,0|2,0,0]=4 702 B12R2.606 CC1=NC2=CC(N)=CC=C2O1 SY064769 [0,1,0,0,1,0|2,0,0]=4 703 B12R2.606 CC1=NC2=CC(O)=CC=C2O1 SY102193 [0,1,0,0,1,0|2,0,0]=4 704 B12R2.606 CC1=NC2=CC=C(Cl)C=C2O1 SY018758 [0,1,0,0,1,0|2,0,0]=4 705 B12R2.606 CC1=NC2=CC=C(F)C=C2O1 SY129999 [0,1,0,0,1,0|2,0,0]=4 706 B12R2.606 ClC1=CC2=C(C=C1)N=C(Cl)O2 SY005172 [0,1,0,0,1,0|2,0,0]=4 707 B12R2.606 ClC1=NC2=CC(Br)=CC=C2O1 SY029225 [0,1,0,0,1,0|2,0,0]=4 708 B12R2.606 ClC1=NC2=CC=C(Br)C=C2O1 SY029221 [0,1,0,0,1,0|2,0,0]=4 709 B12R2.606 FC1=CC=C2N=C(Cl)OC2=C1 SY112662 [0,1,0,0,1,0|2,0,0]=4 710 B12R2.606 FC1=CC=C2NC(=S)OC2=C1 SY130031 [0,1,0,0,1,0|1,1,0]=4 711 B12R2.606 FC1=CC=C2OC(=S)NC2=C1 SY067559 [0,1,0,0,1,0|1,1,0]=4 712 B12R2.606 FC1=CC=C2OC(Cl)=NC2=C1 SY130047 [0,1,0,0,1,0|2,0,0]=4 713 B12R2.606 NC1=CC2=C(C=C1)CC(=O)N2 SY030708 [0,1,0,0,1,0|1,0,0]=3 714 B12R2.606 NC1=CC2=C(C=C1)NC(=O)C2 SY031781 [0,1,0,0,1,0|1,0,0]=3 715 B12R2.606 NC1=CC=C2N=C(N)OC2=C1 SY130064 [0,1,0,0,1,0|2,0,0]=4 716 B12R2.606 NC1=CC=C2NC(=O)NC2=C1 SY007179 [0,1,0,0,1,0|2,0,0]=4 717 B12R2.606 NC1=CC=C2NC(=O)OC2=C1 SY031786 [0,1,0,0,1,0|1,0,0]=3 718 B12R2.606 NC1=CC=C2NC(=O)SC2=C1 SY031792 [0,1,0,0,1,0|1,1,0]=4 719 B12R2.606 NC1=CC=C2NC(=S)OC2=C1 SY130021 [0,1,0,0,1,0|1,1,0]=4 720 B12R2.606 NC1=CC=C2OC(=O)NC2=C1 SY043261 [0,1,0,0,1,0|1,0,0]=3 721 B12R2.606 NC1=CC=C2OC(N)=NC2=C1 SY130062 [0,1,0,0,1,0|2,0,0]=4 722 B12R2.606 NC1=CC=C2OC(S)=NC2=C1 SY130025 [0,1,0,0,1,0|1,1,0]=4 723 B12R2.606 NC1=NC2=C(C=C(Cl)C=C2)O1 SY005591 [0,1,0,0,1,0|2,0,0]=4 724 B12R2.606 NC1=NC2=CC(Br)=CC=C2O1 SY013293 [0,1,0,0,1,0|2,0,0]=4 725 B12R2.606 NC1=NC2=CC(F)=CC=C2O1 SY130059 [0,1,0,0,1,0|2,0,0]=4 726 B12R2.606 NC1=NC2=CC=C(Br)C=C2O1 SY017659 [0,1,0,0,1,0|2,0,0]=4 727 B12R2.606 NC1=NC2=CC=C(F)C=C2O1 SY086886 [0,1,0,0,1,0|2,0,0]=4 728 B12R2.606 O=C1CC2=C(C=C(Br)C=C2)C1 SY040582 [0,1,0,0,1,0|1,0,0]=3 729 B12R2.606 O=C1CC2=C(C=C(Cl)C=C2)N1 SY002545 [0,1,0,0,1,0|1,0,0]=3 730 B12R2.606 O=C1CC2=C(C=C(Cl)N=C2)N1 SY031690 [0,1,0,0,1,0|2,0,0]=4 731 B12R2.606 O=C1CC2=C(C=C(F)C=C2)N1 SY028412 [0,1,0,0,1,0|1,0,0]=3 732 B12R2.606 O=C1CC2=C(C=C(O)C=C2)N1 SY023129 [0,1,0,0,1,0|1,0,0]=3 733 B12R2.606 O=C1CC2=C(C=CC(Br)=C2)N1 SY008441 [0,1,0,0,1,0|1,0,0]=3 734 B12R2.606 O=C1CC2=C(C=CC(F)=C2)N1 SY002547 [0,1,0,0,1,0|1,0,0]=3 735 B12R2.606 O=C1CC2=C(C=CC(I)=C2)N1 SY004828 [0,1,0,0,1,0|1,0,0]=3 736 B12R2.606 O=C1CC2=C(N=CC(Br)=C2)N1 SY005427 [0,1,0,0,1,0|2,0,0]=4 737 B12R2.606 O=C1CC2=CC(Cl)=CC=C2O1 SY285548 [0,1,0,0,1,0|0,0,0]=2 738 B12R2.606 O=C1CC2=CC=C(Br)C=C2N1 SY004439 [0,1,0,0,1,0|1,0,0]=3 739 B12R2.606 O=C1CC2=CC=C(Cl)N=C2N1 SY031668 [0,1,0,0,1,0|2,0,0]=4 740 B12R2.606 O=C1CC2=NC=C(Cl)C=C2N1 SY033632 [0,1,0,0,1,0|2,0,0]=4 741 B12R2.606 O=C1NC2=CC(Br)=CC=C2O1 SY038495 [0,1,0,0,1,0|1,0,0]=3 742 B12R2.606 O=C1NC2=CC(Br)=CN=C2O1 SY059599 [0,1,0,0,1,0|2,0,0]=4 743 B12R2.606 O=C1NC2=CC(Cl)=CN=C2O1 SY130169 [0,1,0,0,1,0|2,0,0]=4 744 B12R2.606 O=C1NC2=CC(F)=CC=C2O1 SY101449 [0,1,0,0,1,0|1,0,0]=3 745 B12R2.606 O=C1NC2=CC(I)=CC=C2O1 SY268394 [0,1,0,0,1,0|1,0,0]=3 746 B12R2.606 O=C1NC2=CC=C(Br)C=C2N1 SY004487 [0,1,0,0,1,0|2,0,0]=4 747 B12R2.606 O=C1NC2=CC=C(Br)C=C2O1 SY038492 [0,1,0,0,1,0|1,0,0]=3 748 B12R2.606 O=C1NC2=CC=C(Br)C=C2S1 SY026443 [0,1,0,0,1,0|1,1,0]=4 749 B12R2.606 O=C1NC2=CC=C(F)C=C2N1 SY039596 [0,1,0,0,1,0|2,0,0]=4 750 B12R2.606 O=C1NC2=CC=C(O)C=C2S1 SY261696 [0,1,0,0,1,0|1,1,0]=4 751 B12R2.606 O=C1NC2=NC(Br)=CC=C2O1 SY059597 [0,1,0,0,1,0|2,0,0]=4 752 B12R2.606 O=C1NC2=NC=C(Br)C=C2O1 SY007993 [0,1,0,0,1,0|2,0,0]=4 753 B12R2.606 O=C1NC2=NC=C(Cl)C=C2O1 SY028333 [0,1,0,0,1,0|2,0,0]=4 754 B12R2.606 S=C1NC2=CC(Br)=CC=C2O1 SY113276 [0,1,0,0,1,0|1,1,0]=4 755 B12R2.606 SC1=NC2=CC=C(Br)C=C2O1 SY047815 [0,1,0,0,1,0|1,1,0]=4 756 B14R2.5634 CC1=CC=C2OCC(=O)COC2=C1 SY037154 [0,1,0,0,0,1|1,0,0]=3 757 B14R2.287 O=C1CCC(=O)C2=CC=CC=C2N1 SY046901 [0,1,0,0,0,1|1,0,0]=3 758 B14R2.92 O=CC1=C(Cl)C2=C(C=CC=C2)CC1 SY264195 [0,2,0,0,0,0|1,0,0]=3 759 B14R2.4513 CC1=C(Br)C=CC2=C1NC(=O)CC2 SY060536 [0,2,0,0,0,0|1,0,0]=3 760 B14R2.4513 CC1=C2NC(=O)COC2=CC=C1Br SY100552 [0,2,0,0,0,0|2,0,0]=4 761 B14R2.4513 CC1=CC=C2COC(=O)NC2=C1C SY129165 [0,2,0,0,0,0|2,0,0]=4 762 B14R2.4513 CN1C(=O)COC2=CC=C(N)C=C21 SY192499 [0,2,0,0,0,0|2,0,0]=4 763 B14R2.4513 CN1C(=O)CSC2=CC=C(N)C=C21 SY264738 [0,2,0,0,0,0|2,0,0]=4 764 B14R2.4513 O=C1CCC2=C(N1)C(Br)=C(F)C=C2 SY271494 [0,2,0,0,0,0|1,0,0]=3 765 B14R2.4513 O=C1COC2=CC=C(Br)C(F)=C2N1 SY100556 [0,2,0,0,0,0|2,0,0]=4 766 B14R2.29369 CC1=C2COC(=O)NC2=CC=C1Br SY060520 [0,2,0,0,0,0|2,0,0]=4 767 B14R2.29369 CN1C(=O)COC2=CC(Br)=CC=C21 SY129385 [0,2,0,0,0,0|2,0,0]=4 768 B14R2.29369 O=C1COC2=C(F)C(F)=CC=C2N1 SY130723 [0,2,0,0,0,0|2,0,0]=4 769 B14R2.134 COC1=CC2=C(C=C1)CCC(=O)C2 SY004719 [0,2,0,0,0,0|1,0,0]=3 770 B14R2.134 COC1=CC2=C(C=C1)COC(=O)C2 SY241602 [0,2,0,0,0,0|2,0,0]=4 771 B14R2.134 COC1=CC=C2COC(=O)NC2=C1 SY129174 [0,2,0,0,0,0|2,0,0]=4 772 B14R2.134 COC1=CC=C2OCC(=O)NC2=C1 SY130717 [0,2,0,0,0,0|2,0,0]=4 773 B14R2.781 O=C(O)C1CCC2=C(C=CC=C2)C1 SY046895 [0,2,0,0,0,0|1,0,1]=4 774 B14R2.781 O=C(O)C1CCC2=C(C=CC=C2)O1 SY064639 [0,2,0,0,0,0|0,0,1]=3 775 B14R2.781 O=C(O)C1COC2=CC=CC=C2O1 SY003328 [0,2,0,0,0,0|1,0,1]=4 776 B14R2.781 OB(O)C1=CC2=C(C=CC=C2)CC1 SY263138 [0,2,0,0,0,0|1,0,1]=4 777 B14R2.2332 COC1=CC=C2NC(=O)OCC2=C1 SY129196 [0,2,0,0,0,0|2,0,0]=4 778 B14R2.2332 O=C1COC2=CC(CO)=CC=C2N1 SY279374 [0,2,0,0,0,0|2,0,0]=4 779 B14R2.8239 NC1CC2=C(C=C(Cl)C=C2)NC1=O SY031681 [0,2,0,0,0,0|1,0,0]=3 780 B14R2.8239 NN1CC2=C(C=CC(Cl)=C2)NC1=O SY275818 [0,2,0,0,0,0|2,0,0]=4 781 B14R2.8239 NN1CC2=C(C=CC(F)=C2)NC1=O SY275976 [0,2,0,0,0,0|2,0,0]=4 782 B14R2.8239 O=C1C=CC2=C(C=C(O)C(O)=C2)O1 SY036794 [0,2,0,0,0,0|0,0,2]=4 783 B14R2.8239 O=C1CCC2=C(C=C(F)C(Br)=C2)N1 SY016679 [0,2,0,0,0,0|1,0,0]=3 784 B14R2.8239 O=C1CNC2=C(C=C(Br)C(F)=C2)N1 SY060532 [0,2,0,0,0,0|2,0,0]=4 785 B14R2.8239 O=C1CNC2=C(C=C(F)C(Br)=C2)N1 SY291520 [0,2,0,0,0,0|2,0,0]=4 786 B14R2.8239 O=C1NC2=CC(F)=C(F)C=C2CO1 SY129192 [0,2,0,0,0,0|2,0,0]=4 787 B14R2.29365 CC1=CC(=O)OC2=C1C=CC(N)=C2 SY009093 [0,2,0,0,0,0|0,0,2]=4 788 B14R2.29365 CC1=CC(=O)OC2=C1C=CC(O)=C2 SY017941 [0,2,0,0,0,0|0,0,2]=4 789 B14R2.29365 O=C1C=C(Cl)C2=C(C=C(Cl)C=C2)O1 SY130851 [0,2,0,0,0,0|0,0,2]=4 790 B14R2.29365 O=C1C=C(Cl)C2=C(C=C(O)C=C2)O1 SY130852 [0,2,0,0,0,0|0,0,2]=4 791 B14R2.29365 O=C1C=C(O)C2=C(C=C(Br)C=C2)O1 SY130837 [0,2,0,0,0,0|0,0,2]=4 792 B14R2.29365 O=C1C=C(O)C2=C(C=C(Cl)C=C2)O1 SY224192 [0,2,0,0,0,0|0,0,2]=4 793 B14R2.29365 O=C1C=CC2=C(C=C(O)C=C2O)O1 SY033827 [0,2,0,0,0,0|0,0,2]=4 794 B14R2.29365 O=C1COC2=C(Cl)C=C(Br)C=C2N1 SY100549 [0,2,0,0,0,0|2,0,0]=4 795 B14R2.29365 O=C1COC2=C(Cl)C=C(Cl)C=C2N1 SY130726 [0,2,0,0,0,0|2,0,0]=4 796 B14R2.29365 O=C1NC2=CC(F)=CC(F)=C2CO1 SY129211 [0,2,0,0,0,0|2,0,0]=4 797 B14R2.8045 CC1=CC=CC2=C1OC(=O)C=C2O SY130846 [0,2,0,0,0,0|0,0,2]=4 798 B14R2.8045 O=C1C=C(O)C2=C(O1)C(F)=CC=C2 SY130839 [0,2,0,0,0,0|0,0,2]=4 799 B14R2.8235 CC1=CC(Br)=CC2=C1NC(=O)CC2 SY021048 [0,2,0,0,0,0|1,0,0]=3 800 B14R2.8235 CC1=CC(C)=C2NC(=O)OCC2=C1 SY129198 [0,2,0,0,0,0|2,0,0]=4 801 B14R2.8235 CC1=CC2=C(C=C1)OC(=O)C=C2Cl SY130845 [0,2,0,0,0,0|0,0,2]=4 802 B14R2.8235 CC1=CC2=C(C=C1)OC(=O)C=C2O SY050960 [0,2,0,0,0,0|0,0,2]=4 803 B14R2.8235 O=C1C=C(O)C2=C(C=CC(O)=C2)O1 SY028438 [0,2,0,0,0,0|0,0,2]=4 804 B14R2.8235 O=C1CCC2=C(N1)C(Br)=CC(O)=C2 SY292471 [0,2,0,0,0,0|1,0,0]=3 805 B14R2.8235 O=C1NC2=C(Br)C=C(Cl)C=C2CO1 SY129209 [0,2,0,0,0,0|2,0,0]=4 806 B14R2.8235 O=C1NC2=C(F)C=C(F)C=C2CO1 SY129206 [0,2,0,0,0,0|2,0,0]=4 807 B14R2.11684 COC1=C2NC(=O)OCC2=CC=C1 SY129193 [0,2,0,0,0,0|2,0,0]=4 808 B14R2.11684 COC1=CC=CC2=C1OC(=O)C=C2 SY287603 [0,2,0,0,0,0|0,0,2]=4 809 B14R2.639 CC1(C)OC2=CC=CC=C2NC1=O SY130765 [0,2,0,0,0,0|2,0,0]=4 810 B14R2.28480 O=C1C=C(O)C2=C(C=CC=C2Cl)O1 SY130838 [0,2,0,0,0,0|0,0,2]=4 811 B14R2.28480 O=C1C=C(O)C2=C(C=CC=C2F)O1 SY130840 [0,2,0,0,0,0|0,0,2]=4 812 B14R2.1073 COC1=C2COC(=O)NC2=CC=C1 SY129169 [0,2,0,0,0,0|2,0,0]=4 813 B14R2.1073 COC1=CC=CC2=C1CCC(=O)C2 SY025362 [0,2,0,0,0,0|1,0,0]=3 814 B12R2.315 NCC1=C2OC=NC2=CC=C1 SY036519 [0,0,1,1,0,0|2,0,0]=4 815 B12R2.3190 O=C(O)C1CC2=CC=CC=C21 SY185508 [0,0,1,1,0,0|2,0,0]=4 816 B12R2.22 O=C1CC(C2=CC=CC=C2)C1 SY029843 [0,0,1,1,0,0|1,0,0]=3 817 B12R3.12 C1=CC2=C(C=C1)C3OC3C2 SY272668 [1,0,0,1,0,0|2,0,0]=4 818 B10R1.15 CCC(=O)C1=CC=CC=N1 SY005362 [0,0,1,0,1,0|1,0,0]=3 819 B10R1.15 CCC(O)C1=CC=CC=C1 SY020321 [0,0,1,0,1,0|0,0,2]=4 820 B10R1.15 CCN(C)C1=CC=CC=C1 SY032004 [0,0,1,0,1,0|2,0,0]=4 821 B10R1.15 CNC(=O)C1=CC=CC=C1 SY037937 [0,0,1,0,1,0|1,0,0]=3 822 B10R1.15 COC(=O)C1=NC=CC=C1 SY005022 [0,0,1,0,1,0|2,0,0]=4 823 B10R1.15 COS(=O)C1=CC=CC=C1 SY050665 [0,0,1,0,1,0|2,0,0]=4 824 B10R1.15 NCC(=O)C1=CC=CC=C1 SY007242 [0,0,1,0,1,0|1,0,0]=3 825 B10R1.15 O=C(CBr)C1=CC=CN=C1 SY023116 [0,0,1,0,1,0|2,0,0]=4 826 B10R1.15 O=C(CBr)C1=NC=CC=C1 SY007962 [0,0,1,0,1,0|2,0,0]=4 827 B10R1.15 O=C(CBr)C1=NC=CC=C1 SY226653 [0,0,1,0,1,0|2,0,0]=4 828 B10R1.15 O=C(CCl)C1=CC=NC=C1 SY011676 [0,0,1,0,1,0|2,0,0]=4 829 B10R1.15 O=C(CO)C1=CC=CC=C1 SY014756 [0,0,1,0,1,0|1,0,0]=3 830 B10R1.15 O=C(CO)C1=CC=CN=C1 SY131032 [0,0,1,0,1,0|2,0,0]=4 831 B10R1.15 O=C(CO)C1=CC=NC=C1 SY131033 [0,0,1,0,1,0|2,0,0]=4 832 B10R1.15 O=C(CO)C1=NC=CC=C1 SY131031 [0,0,1,0,1,0|2,0,0]=4 833 B10R1.15 O=CC(=O)C1=CC=CC=C1 SY047494 [0,0,1,0,1,0|1,0,1]=4 834 B10R1.61 C=C(C)C1=CC=CC=C1F SY154483 [0,0,1,0,1,0|2,0,0]=4 835 B10R1.61 CC(=O)C1=C(Br)C=NC=C1 SY029921 [0,0,1,0,1,0|2,0,0]=4 836 B10R1.61 CC(=O)C1=C(C)C=CC=N1 SY005230 [0,0,1,0,1,0|1,0,0]=3 837 B10R1.61 CC(=O)C1=C(F)C=NC=C1 SY011662 [0,0,1,0,1,0|2,0,0]=4 838 B10R1.61 CC(=O)C1=C(I)C=CC=C1 SY010667 [0,0,1,0,1,0|1,0,0]=3 839 B10R1.61 CC(=O)C1=CC=CC=C1Br SY002108 [0,0,1,0,1,0|1,0,0]=3 840 B10R1.61 CC(=O)C1=CC=CC=C1C SY002283 [0,0,1,0,1,0|0,0,0]=2 841 B10R1.61 CC(=O)C1=CC=CC=C1N SY001368 [0,0,1,0,1,0|1,0,0]=3 842 B10R1.61 CC(=O)C1=CC=CN=C1C SY108212 [0,0,1,0,1,0|1,0,0]=3 843 B10R1.61 CC(=O)C1=CC=CN=C1Cl SY007174 [0,0,1,0,1,0|2,0,0]=4 844 B10R1.61 CC(=O)C1=CC=CN=C1F SY064682 [0,0,1,0,1,0|2,0,0]=4 845 B10R1.61 CC(=O)C1=CC=CN=C1N SY040774 [0,0,1,0,1,0|2,0,0]=4 846 B10R1.61 CC(=O)C1=NC=CC=C1Br SY029920 [0,0,1,0,1,0|2,0,0]=4 847 B10R1.61 CC(=O)C1=NC=CC=C1F SY022346 [0,0,1,0,1,0|2,0,0]=4 848 B10R1.61 CC(=O)C1=NC=CC=C1N SY240339 [0,0,1,0,1,0|2,0,0]=4 849 B10R1.61 CC(=O)C1=NC=CN=C1C SY027476 [0,0,1,0,1,0|2,0,0]=4 850 B10R1.61 CC1=C(C(=N)N)C=CC=C1 SY003976 [0,0,1,0,1,0|2,0,0]=4 851 B10R1.61 CC1=C(C(=O)O)C=CC=C1 SY008811 [0,0,1,0,1,0|1,0,0]=3 852 B10R1.61 CC1=C(C(=O)O)C=CN=C1 SY013083 [0,0,1,0,1,0|2,0,0]=4 853 B10R1.61 CC1=C(C(=O)O)C=NC=C1 SY003372 [0,0,1,0,1,0|2,0,0]=4 854 B10R1.61 CC1=C(C(C)N)C=CC=C1 SY006058 [0,0,1,0,1,0|1,0,1]=4 855 B10R1.61 CC1=C(C(C)O)C=CC=C1 SY005056 [0,0,1,0,1,0|0,0,2]=4 856 B10R1.61 CC1=CC=CC=C1C(C)N SY002511 [0,0,1,0,1,0|1,0,1]=4 857 B10R1.61 CC1=CC=CN=C1C(=O)O SY005196 [0,0,1,0,1,0|2,0,0]=4 858 B10R1.61 CC1=NC=CC=C1C(=O)O SY007014 [0,0,1,0,1,0|2,0,0]=4 859 B10R1.61 NC(=O)C1=C(I)C=CC=C1 SY013782 [0,0,1,0,1,0|2,0,0]=4 860 B10R1.61 NC(=O)C1=CC=CC=C1Br SY026521 [0,0,1,0,1,0|2,0,0]=4 861 B10R1.61 NC(=O)C1=CC=CC=C1F SY023168 [0,0,1,0,1,0|2,0,0]=4 862 B10R1.61 NC(=O)C1=CC=CC=C1N SY001144 [0,0,1,0,1,0|2,0,0]=4 863 B10R1.61 O=C(O)C1=C(Br)C=CC=C1 SY003796 [0,0,1,0,1,0|2,0,0]=4 864 B10R1.61 O=C(O)C1=C(S)C=CC=C1 SY007814 [0,0,1,0,1,0|2,0,0]=4 865 B10R1.61 O=C(O)C1=CC=CC=C1F SY001376 [0,0,1,0,1,0|2,0,0]=4 866 B10R1.61 O=C(O)C1=CC=CC=C1I SY001344 [0,0,1,0,1,0|2,0,0]=4 867 B10R1.61 O=C([O-])C1=CC=CC=C1O SY013574 [0,0,1,0,1,0|2,0,0]=4 868 B10R1.66 O=C(O)CCC1=CC=CS1 SY005413 [0,0,1,0,1,0|1,0,0]=3 869 B10R1.66 O=C(O)CCC1=CSC=C1 SY122984 [0,0,1,0,1,0|1,0,0]=3 870 B10R1.66 O=C(O)CCC1=NC=CS1 SY019802 [0,0,1,0,1,0|2,0,0]=4 871 B10R1.66 O=C(O)CCN1C=CC=C1 SY010374 [0,0,1,0,1,0|1,0,0]=3 872 B10R1.66 O=C(O)CCN1C=CC=N1 SY014172 [0,0,1,0,1,0|2,0,0]=4 873 B10R1.66 O=C(O)CCN1C=CN=C1 SY024292 [0,0,1,0,1,0|2,0,0]=4 874 B10R2.7 C1=CC2=C(C=C1)CNC2 SY006502 [1,0,0,0,1,0|1,0,1]=4 875 B10R2.7 C1=CC2=C(C=C1)NCC2 SY012760 [1,0,0,0,1,0|1,0,0]=3 876 B10R2.7 C1=CC2=C(C=C1)NN=C2 SY001125 [1,0,0,0,1,0|2,0,0]=4 877 B10R2.7 C1=CC2=C(C=C1)OCC2 SY003884 [1,0,0,0,1,0|0,0,0]=2 878 B10R2.7 C1=CC2=C(C=N1)N=CO2 SY129985 [1,0,0,0,1,0|2,0,0]=4 879 B10R2.7 C1=CC2=C(N=C1)NCC2 SY005307 [1,0,0,0,1,0|2,0,0]=4 880 B10R2.7 C1=CC=C2CNCC2=C1 SY006104 [1,0,0,0,1,0|1,0,1]=4 881 B10R2.7 C1=CC=C2CSCC2=C1 SY143431 [1,0,0,0,1,0|1,0,1]=4 882 B10R2.7 C1=CC=C2NC=NC2=C1 SY012765 [1,0,0,0,1,0|2,0,0]=4 883 B10R2.7 C1=CC=C2SC=CC2=C1 SY246286 [1,0,0,0,1,0|0,1,1]=4 884 B10R2.7 C1=CC=C2[Se]C=CC2=C1 SY263659 [1,0,0,0,1,0|0,1,1]=4 885 B10R2.7 C1=CN=C2C=COC2=C1 SY097654 [1,0,0,0,1,0|1,0,1]=4 886 B10R2.7 C1=CN=C2CCCC2=C1 SY005163 [1,0,0,0,1,0|1,0,1]=4 887 B10R2.7 C1=CN=C2CCNC2=C1 SY253170 [1,0,0,0,1,0|2,0,0]=4 888 B10R2.7 C1=CN=C2CCOC2=C1 SY285018 [1,0,0,0,1,0|1,0,0]=3 889 B10R2.7 C1=CN=C2N=COC2=C1 SY018742 [1,0,0,0,1,0|2,0,0]=4 890 B10R2.7 C1=CN=C2OC=NC2=C1 SY018739 [1,0,0,0,1,0|2,0,0]=4 891 B10R2.7 C1=CN=C2OCOC2=C1 SY296678 [1,0,0,0,1,0|2,0,0]=4 892 B10R2.32 O=C1CCC2=C1C=CS2 SY056658 [0,0,0,0,2,0|1,0,0]=3 893 B10R2.32 O=C1CCC2=C1SC=C2 SY027678 [0,0,0,0,2,0|1,0,0]=3 894 B10R2.320 O=C1CC2=CC=CC=C12 SY031738 [0,0,0,0,2,0|0,0,0]=2 895 B12R1.252 CC(=O)COCC1=CC=CC=C1 SY107427 [0,0,1,0,0,1|1,0,0]=3 896 B12R1.252 CC(O)COCC1=CC=CC=C1 SY115719 [0,0,1,0,0,1|1,0,1]=4 897 B12R1.252 C[C@@H](O)CNCC1=CC=CC=C1 SY046157 [0,0,1,0,0,1|1,0,1]=4 898 B12R1.252 C[C@@H](O)COCC1=CC=CC=C1 SY226247 [0,0,1,0,0,1|1,0,1]=4 899 B12R1.252 C[C@H](O)COCC1=CC=CC=C1 SY059957 [0,0,1,0,0,1|1,0,1]=4 900 B12R1.252 O=C(O)CCCC1=CC=CC=C1 SY004771 [0,0,1,0,0,1|0,0,0]=2 901 B12R1.252 O=C(O)CCCC1=NC=CC=C1 SY110052 [0,0,1,0,0,1|1,0,0]=3 902 B12R1.252 O=C(O)CCNC1=CC=CC=C1 SY019790 [0,0,1,0,0,1|0,0,0]=2 903 B12R1.252 O=C(O)CNCC1=CC=CC=C1 SY003481 [0,0,1,0,0,1|0,0,0]=2 904 B12R1.252 O=C(O)CNCC1=CC=CC=C1 SY015802 [0,0,1,0,0,1|0,0,0]=2 905 B12R1.252 O=C(O)COCC1=CC=CC=C1 SY002087 [0,0,1,0,0,1|0,0,0]=2 906 B12R1.252 O=C(O)C\C=C\C1=CC=CC=C1 SY083558 [0,0,1,0,0,1|0,0,1]=3 907 B12R1.252 O=C([O-])CCCC1=CC=CC=C1 SY067225 [0,0,1,0,0,1|0,0,1]=3 908 B12R1.252 O=[N+]([O-])CCCC1=CC=CC=C1 SY266519 [0,0,1,0,0,1|1,0,1]=4