0 B12R1.16 CCCC(=O)C1=CC=C(C)C=C1 RT11080 [0,0,0,0,0,0|2,0,0]=2 1 B12R1.16 CCCC(=O)C1=CC=C(F)C=C1 XJ0996 [0,0,0,0,0,0|2,0,0]=2 2 B12R1.16 CCCC(C)C1=CC=C(O)C=C1 RT17651 [0,0,0,0,0,0|3,0,1]=4 3 B12R1.16 CCOC(=N)C1=CC=C(Cl)C=C1 RT12541 [0,0,0,0,0,0|2,0,0]=2 4 B12R1.16 CCOC(=O)C1=CC=C(Br)C=C1 HL3014 [0,0,0,0,0,0|1,0,0]=1 5 B12R1.16 CCOC(=O)C1=CC=C(Cl)C=C1 LQ3269 [0,0,0,0,0,0|1,0,0]=1 6 B12R1.16 CCOC(=O)C1=CC=C(Cl)N=C1 LT5203 [0,0,0,0,0,0|2,0,0]=2 7 B12R1.16 CCOC(=O)C1=CC=C(I)C=C1 CJ2917 [0,0,0,0,0,0|1,0,0]=1 8 B12R1.16 CCOC(=O)C1=CC=C(N)C=C1 SY0289 [0,0,0,0,0,0|0,0,0]=0 9 B12R1.16 CCOC(=O)C1=CC=C(N)C=C1 YH48180 [0,0,0,0,0,0|0,0,0]=0 10 B12R1.16 CCOC(=O)C1=CC=C(N)N=C1 YH65801 [0,0,0,0,0,0|1,0,0]=1 11 B12R1.16 CCOC(=O)C1=CN=C(Cl)N=C1 LX2162 [0,0,0,0,0,0|3,0,0]=3 12 B12R1.16 CCOC(=O)C1=CN=C(O)C=C1 LX3039 [0,0,0,0,0,0|2,0,0]=2 13 B12R1.16 N#CCC(=O)C1=CC=C(Cl)C=C1 LQ2708 [0,0,0,0,0,0|3,0,1]=4 14 B12R1.16 N#CCC(=O)C1=CC=C(F)C=C1 JZ0578 [0,0,0,0,0,0|3,0,1]=4 15 B12R1.16 O=C(CCCl)C1=CC=C(Cl)C=C1 LT4187 [0,0,0,0,0,0|3,0,0]=3 16 B12R1.16 O=C(CCCl)C1=CC=C(F)C=C1 LQ0709 [0,0,0,0,0,0|3,0,0]=3 17 B12R1.16 O=C(CCCl)C1=CC=C(O)C=C1 RT10798 [0,0,0,0,0,0|3,0,0]=3 18 B11R1.1 CCCCC1=CC=C(Br)C=C1 LT1922 [1,0,0,0,0,0|2,0,1]=4 19 B11R1.1 CCCCC1=CC=C(Cl)C=C1 LQ3832 [1,0,0,0,0,0|2,0,1]=4 20 B11R1.1 CCCCC1=CC=C(I)C=C1 LT2407 [1,0,0,0,0,0|2,0,1]=4 21 B11R1.1 OC\C=C\C1=CC=C(Br)C=C1 CJ3236 [1,0,0,0,0,0|3,0,0]=4 22 B11R1.16 CCCC(C)C1=CC=CC=C1 XJ2276 [1,0,0,0,0,0|2,0,1]=4 23 B11R1.16 CCC[C@H](N)C1=CC=CC=C1 HL2642 [1,0,0,0,0,0|2,0,1]=4 24 B11R1.16 CCOC(=N)C1=CC=CC=C1 XJ2841 [1,0,0,0,0,0|1,0,0]=2 25 B11R1.16 CCOC(=O)C1=CC=CC=C1 HL1235 [1,0,0,0,0,0|0,0,0]=1 26 B11R1.16 CCOC(=O)C1=CC=CC=C1 XJ5129 [1,0,0,0,0,0|0,0,0]=1 27 B11R1.16 CCOC(=O)C1=CC=NC=C1 JZ0760 [1,0,0,0,0,0|1,0,0]=2 28 B11R1.16 CCOC(=O)C1=CC=NN=C1 YH58768 [1,0,0,0,0,0|2,0,0]=3 29 B11R1.16 CCOC(=O)C1=CCC=CC1 RT16430 [1,0,0,0,0,0|0,0,2]=3 30 B11R1.16 CCOC(=O)C1=CN=CC=C1 JZ0757 [1,0,0,0,0,0|1,0,0]=2 31 B11R1.16 CCOC(=O)C1=NC=NC=C1 XJ5992 [1,0,0,0,0,0|2,0,0]=3 32 B11R1.16 COCC(=O)C1=CC=CC=C1 XJ2596 [1,0,0,0,0,0|2,0,0]=3 33 B11R1.16 N#CCC(=O)C1=CC=CC=C1 LT6989 [1,0,0,0,0,0|2,0,1]=4 34 B11R1.16 O=C(CCBr)C1=CC=CC=C1 YH65517 [1,0,0,0,0,0|2,0,0]=3 35 B11R1.16 O=C(CCCl)C1=CC=CC=C1 YH58599 [1,0,0,0,0,0|2,0,0]=3 36 B11R1.16 O=C(N=C=S)C1=CC=CC=C1 LL0937 [1,0,0,0,0,0|2,0,1]=4 37 B11R1.22 CC1=CC=C(C(=O)CN)C=C1 YH65417 [1,0,0,0,0,0|2,0,0]=3 38 B11R1.22 CCC(=O)C1=CC=C(N)C=C1 YH14959 [1,0,0,0,0,0|0,0,0]=1 39 B11R1.22 CCC(=O)C1=CC=C(O)C=C1 RT11202 [1,0,0,0,0,0|1,0,0]=2 40 B11R1.22 CCC(C)C1=CC=C(Br)C=C1 LT4307 [1,0,0,0,0,0|2,0,1]=4 41 B11R1.22 COC(=O)C1=CC=C(Br)C=C1 JZ3934 [1,0,0,0,0,0|1,0,0]=2 42 B11R1.22 COC(=O)C1=CC=C(C)N=C1 RT12187 [1,0,0,0,0,0|2,0,0]=3 43 B11R1.22 COC(=O)C1=CC=C(Cl)C=C1 HL0691 [1,0,0,0,0,0|1,0,0]=2 44 B11R1.22 COC(=O)C1=CC=C(Cl)N=C1 JZ0748 [1,0,0,0,0,0|2,0,0]=3 45 B11R1.22 COC(=O)C1=CC=C(F)C=C1 JZ1260 [1,0,0,0,0,0|1,0,0]=2 46 B11R1.22 COC(=O)C1=CC=C(F)N=C1 XJ1741 [1,0,0,0,0,0|2,0,0]=3 47 B11R1.22 COC(=O)C1=CC=C(I)C=C1 JZ3935 [1,0,0,0,0,0|1,0,0]=2 48 B11R1.22 COC(=O)C1=CC=C(N)C=C1 JZ3936 [1,0,0,0,0,0|0,0,0]=1 49 B11R1.22 COC(=O)C1=CC=C(N)N=C1 JZ1658 [1,0,0,0,0,0|1,0,0]=2 50 B11R1.22 COC(=O)C1=CC=C(O)C=C1 LT7452 [1,0,0,0,0,0|1,0,0]=2 51 B11R1.22 COC(=O)C1=CC=C(O)C=N1 SY0217 [1,0,0,0,0,0|2,0,0]=3 52 B11R1.22 COC(=O)C1=CC=C([O-])C=C1 YH03826 [1,0,0,0,0,0|1,0,0]=2 53 B11R1.22 COC(=O)C1=CN=C(Br)C=C1 LX3189 [1,0,0,0,0,0|2,0,0]=3 54 B11R1.22 COC(=O)C1=NC=C(Br)C=C1 XJ4983 [1,0,0,0,0,0|2,0,0]=3 55 B11R1.22 COC(=O)C1=NC=C(Br)C=N1 YH93944 [1,0,0,0,0,0|3,0,0]=4 56 B11R1.22 COC(=O)C1=NC=C(Cl)N=C1 LT5905 [1,0,0,0,0,0|3,0,0]=4 57 B11R1.22 COC(=O)C1=NC=C(O)N=C1 LT5907 [1,0,0,0,0,0|3,0,0]=4 58 B11R1.22 NC1=CC=C(C(=O)CBr)C=C1 RT1562 [1,0,0,0,0,0|1,0,0]=2 59 B11R1.22 NCC(=O)C1=CC=C(Br)C=C1 LQ2917 [1,0,0,0,0,0|2,0,0]=3 60 B11R1.22 NCC(=O)C1=CC=C(Br)C=C1 RT2897 [1,0,0,0,0,0|2,0,0]=3 61 B11R1.22 NCC(=O)C1=CC=C(Br)C=C1 YH17779 [1,0,0,0,0,0|2,0,0]=3 62 B11R1.22 NCC(=O)C1=CC=C(Cl)C=C1 YH17778 [1,0,0,0,0,0|2,0,0]=3 63 B11R1.22 NCC(=O)C1=CC=C(F)C=C1 HL1815 [1,0,0,0,0,0|2,0,0]=3 64 B11R1.22 NCC(=O)C1=CC=C(F)C=C1 LX2710 [1,0,0,0,0,0|2,0,0]=3 65 B11R1.22 NCC(=O)C1=CC=C(O)C=C1 YH43755 [1,0,0,0,0,0|2,0,0]=3 66 B11R1.22 NNC(=O)C1=CC=C(Br)C=C1 LQ2961 [1,0,0,0,0,0|3,0,0]=4 67 B11R1.22 NNC(=O)C1=CC=C(Cl)C=C1 LL0964 [1,0,0,0,0,0|3,0,0]=4 68 B11R1.22 NNC(=O)C1=CC=C(F)C=C1 HL1818 [1,0,0,0,0,0|3,0,0]=4 69 B11R1.22 NNC(=O)C1=CC=C(N)C=C1 XJ2875 [1,0,0,0,0,0|2,0,0]=3 70 B11R1.22 O=C(CBr)C1=CC=C(Br)C=C1 HL1296 [1,0,0,0,0,0|2,0,0]=3 71 B11R1.22 O=C(CBr)C1=CC=C(Cl)C=C1 LT2785 [1,0,0,0,0,0|2,0,0]=3 72 B11R1.22 O=C(CBr)C1=CC=C(O)C=C1 RT10679 [1,0,0,0,0,0|2,0,0]=3 73 B11R1.22 O=C(CCl)C1=CC=C(F)C=C1 HL1817 [1,0,0,0,0,0|2,0,0]=3 74 B11R1.22 O=C(CCl)C1=CC=C(O)C=C1 YH11049 [1,0,0,0,0,0|2,0,0]=3 75 B11R1.22 O=CC(=O)C1=CC=C(Br)C=C1 YH04927 [1,0,0,0,0,0|2,0,1]=4 76 B13R1.17 CCCCC(=O)C1=CC=C(Br)C=C1 LT2754 [0,1,0,0,0,0|2,0,0]=3 77 B13R1.17 CCCCC(=O)C1=CC=C(C)C=C1 LQ1869 [0,1,0,0,0,0|2,0,0]=3 78 B13R1.17 CCCOC(=O)C1=CC=C(N)C=C1 HL1244 [0,1,0,0,0,0|0,0,0]=1 79 B13R1.17 CCCOC(=O)C1=CC=C([O-])C=C1 YH56463 [0,1,0,0,0,0|1,0,0]=2 80 B13R1.17 NC1=CC=C(C(=O)NCCO)C=C1 LT6436 [0,1,0,0,0,0|1,0,0]=2 81 B13R1.17 O=C(CCCCl)C1=CC=C(F)C=C1 LT2763 [0,1,0,0,0,0|2,0,0]=3 82 B13R1.29 CCNS(=O)(=O)C1=CC=C(C)C=C1 JZ1714 [0,1,0,0,0,0|3,0,0]=4 83 B13R1.29 CCNS(=O)(=O)C1=CC=C(C)C=C1 JZ1715 [0,1,0,0,0,0|3,0,0]=4 84 B13R1.29 CCNS(=O)(=O)C1=CC=C(C)C=C1 JZ5729 [0,1,0,0,0,0|3,0,0]=4 85 B13R1.29 CCNS(=O)(=O)C1=CC=C(C)C=C1 LQ1746 [0,1,0,0,0,0|3,0,0]=4 86 B13R1.29 CCNS(=O)(=O)C1=CC=C(C)C=C1 LT5632 [0,1,0,0,0,0|3,0,0]=4 87 B13R1.452 C=CC1=CC=C(C(=O)OCC)C=C1 YH51162 [0,1,0,0,0,0|1,0,0]=2 88 B13R1.452 CCOC(=O)C1=CC=C(C=O)C=C1 LT2976 [0,1,0,0,0,0|1,0,0]=2 89 B13R1.452 CCOC(=O)C1=CC=C(CBr)C=C1 LQ4527 [0,1,0,0,0,0|1,0,0]=2 90 B13R1.452 CCOC(=O)C1=CC=C(NC)C=C1 RT3205 [0,1,0,0,0,0|0,0,0]=1 91 B13R1.452 CCOC(=O)C1=CC=C(NN)C=C1 YH35358 [0,1,0,0,0,0|0,0,0]=1 92 B13R1.452 CCOC(=O)C1=CC=C(OC)C=C1 LQ0231 [0,1,0,0,0,0|1,0,0]=2 93 B13R1.452 CCOC(=O)C1=CN=C(C#N)C=C1 YH17643 [0,1,0,0,0,0|1,0,1]=3 94 B13R1.452 CCOC(=O)C1=CN=C(SC)N=C1 LL1309 [0,1,0,0,0,0|3,0,0]=4 95 B13R1.452 CCOC(=O)C1=NC=C(CO)N=C1 LX2206 [0,1,0,0,0,0|3,0,0]=4 96 B13R1.452 COC1=CC=C(C(=O)CCCl)C=C1 LT4193 [0,1,0,0,0,0|3,0,0]=4 97 B13R1.466 CC1=CC=C(C(=O)CCCl)C=C1C CJ2843 [0,1,0,0,0,0|3,0,0]=4 98 B13R1.466 CCCC(=O)C1=CC=C(O)C(O)=C1 RT6100 [0,1,0,0,0,0|2,0,0]=3 99 B13R1.466 CCOC(=O)C1=CC(=O)N(C)C=C1 LT5880 [0,1,0,0,0,0|2,0,0]=3 100 B13R1.466 CCOC(=O)C1=CC(Cl)=C(N)C=C1 LT2023 [0,1,0,0,0,0|0,0,0]=1 101 B13R1.466 CCOC(=O)C1=CC=C(O)C(Br)=C1 YH66436 [0,1,0,0,0,0|1,0,0]=2 102 B13R1.466 CCOC(=O)C1=CN(C)C(=O)C=C1 LT5875 [0,1,0,0,0,0|2,0,0]=3 103 B13R1.466 CCOC(=O)C1=CN=C(C)C(C)=C1 RT9408 [0,1,0,0,0,0|2,0,0]=3 104 B13R1.466 CNCC(=O)C1=CC=C(O)C(O)=C1 HL1306 [0,1,0,0,0,0|3,0,0]=4 105 B13R1.1511 CCOC(=O)C1=C(C)NC(=O)C=C1 YH55617 [0,1,0,0,0,0|2,0,0]=3 106 B13R1.1511 CCOC(=O)C1=C(Cl)C=C(Cl)N=C1 YH59540 [0,1,0,0,0,0|2,0,0]=3 107 B13R1.1511 CCOC(=O)C1=C(O)N=C(N)N=C1 YH36691 [0,1,0,0,0,0|2,0,0]=3 108 B13R1.1511 CCOC(=O)C1=CC=C(F)C=C1F HL3208 [0,1,0,0,0,0|1,0,0]=2 109 B13R1.1511 CCOC(=O)C1=CN=C(Cl)N=C1Cl YH04925 [0,1,0,0,0,0|3,0,0]=4 110 B13R1.1511 CCOC(=O)C1=CN=C(Cl)N=C1N XJ6218 [0,1,0,0,0,0|3,0,0]=4 111 B13R1.1511 CCOC(=O)C1=CN=C(S)N=C1N HL0435 [0,1,0,0,0,0|3,0,0]=4 112 B13R1.1511 CCOC(=O)C1=CNC(=O)NC1=O LQ4602 [0,1,0,0,0,0|3,0,0]=4 113 B13R2.520 O=C(C1=CC=C(Br)C=C1)C2CC2 YH14397 [0,0,0,1,0,0|2,0,0]=3 114 B13R2.520 O=C(C1=CC=C(F)C=C1)C2CC2 HL0424 [0,0,0,1,0,0|2,0,0]=3 115 B13R2.5179 CC1=CC=C2C(=O)CCOC2=C1 LT5927 [0,0,0,1,0,0|3,0,0]=4 116 B13R2.5179 NC1=CC2=C(C=C1)C(=O)CCC2 LQ2489 [0,0,0,1,0,0|1,0,0]=2 117 B13R2.5179 NC1=CC2=C(C=C1)C(=O)NCC2 RT2455 [0,0,0,1,0,0|1,0,0]=2 118 B13R2.5179 O=C1CCCC2=C1C=CC(O)=C2 LQ2488 [0,0,0,1,0,0|2,0,0]=3 119 B13R2.5179 O=C1CCCC2=CC(Br)=CC=C12 YH12709 [0,0,0,1,0,0|2,0,0]=3 120 B13R2.5179 O=C1CCCC2=CC(Cl)=CC=C12 YH65510 [0,0,0,1,0,0|2,0,0]=3 121 B13R2.5179 O=C1CCCC2=CC(F)=CC=C12 LX2938 [0,0,0,1,0,0|2,0,0]=3 122 B13R2.5179 O=C1NCCC2=C1C=CC(F)=C2 YH66658 [0,0,0,1,0,0|2,0,0]=3 123 B13R2.5179 O=C1NCCC2=CC(Br)=CC=C12 RT2428 [0,0,0,1,0,0|2,0,0]=3 124 B13R2.5187 O=C1OC(=O)C2=CC(F)=CC=C12 XJ0647 [0,0,0,1,0,0|2,0,1]=4 125 B13R2.5187 O=C1OC(=O)C2=CC(O)=CC=C12 LT5970 [0,0,0,1,0,0|2,0,1]=4 126 B11R1.15 CCOC(=O)C1=CN=C(Br)S1 XJ5467 [0,0,0,0,1,0|3,0,0]=4 127 B11R1.15 CCOC(=O)C1=CN=C(N)S1 YH54736 [0,0,0,0,1,0|2,0,0]=3 128 B11R1.15 CCOC(=O)C1=CNC(C)=N1 YH91397 [0,0,0,0,1,0|3,0,0]=4 129 B11R1.15 CCOC(=O)C1=COC(N)=N1 RT4500 [0,0,0,0,1,0|2,0,0]=3 130 B11R1.15 CCOC(=O)C1=CSC(Br)=C1 YH39378 [0,0,0,0,1,0|2,0,0]=3 131 B11R1.15 CCOC(=O)C1=CSC(N)=N1 HL2923 [0,0,0,0,1,0|2,0,0]=3 132 B11R1.15 CCOC(=O)C1=NC(Br)=CS1 YH98273 [0,0,0,0,1,0|3,0,0]=4 133 B11R1.15 CCOC(=O)C1=NNC(N)=C1 XJ6802 [0,0,0,0,1,0|2,0,0]=3 134 B13R1.19 CCOC(=O)CC1=CC=C(Br)C=C1 JZ4838 [0,0,0,0,0,1|1,0,0]=2 135 B13R1.19 CCOC(=O)CC1=CC=C(Cl)C=C1 YH02840 [0,0,0,0,0,1|1,0,0]=2 136 B13R1.19 CCOC(=O)CC1=CC=C(O)C=C1 XJ4339 [0,0,0,0,0,1|1,0,0]=2 137 B13R1.19 CCOC(=O)CC1=NC=C(C)C=C1 YH66166 [0,0,0,0,0,1|2,0,0]=3 138 B13R1.19 CCOC(=O)CC1=NC=C(C)C=C1 YH66167 [0,0,0,0,0,1|2,0,0]=3 139 B10R0.3 CCOC(=O)\C=C\C=C(C)C RT1214 [1,0,1,0,0,0|1,0,1]=4 140 B10R1.1 CCCC1=CC=C(N)C=C1 XJ2253 [2,0,0,0,0,0|0,0,1]=3 141 B10R1.1 CCNC1=CC=C(C)C=C1 JZ4006 [2,0,0,0,0,0|2,0,0]=4 142 B10R1.1 CCNC1=CC=C(Cl)C=C1 YH66088 [2,0,0,0,0,0|2,0,0]=4 143 B10R1.1 CCOC1=CC=C(Br)C=N1 LQ5337 [2,0,0,0,0,0|2,0,0]=4 144 B10R1.1 CCOC1=CC=C(I)C=C1 LQ1391 [2,0,0,0,0,0|1,0,0]=3 145 B10R1.1 CCOC1=CC=C(N)C=C1 RT3081 [2,0,0,0,0,0|0,0,0]=2 146 B10R1.1 CCOC1=CC=C(O)C=C1 JZ4008 [2,0,0,0,0,0|1,0,0]=3 147 B10R1.1 CCOC1=CN=C(Cl)C=C1 LX1903 [2,0,0,0,0,0|2,0,0]=4 148 B10R1.1 CCOC1=CN=C(N)N=C1 YH58894 [2,0,0,0,0,0|2,0,0]=4 149 B10R1.1 CCOC1=NC=C(N)C=C1 YH04966 [2,0,0,0,0,0|1,0,0]=3 150 B10R1.1 COCC1=CC=C(O)C=C1 YH05854 [2,0,0,0,0,0|1,0,1]=4 151 B10R1.1 NCCC1=CC=C(N)C=C1 LT0213 [2,0,0,0,0,0|1,0,1]=4 152 B10R1.17 BrC\C=C\C1=CC=CC=C1 LT4566 [2,0,0,0,0,0|2,0,0]=4 153 B10R1.17 CCC#CC1=CC=CC=C1 JZ4010 [2,0,0,0,0,0|1,0,1]=4 154 B10R1.17 CCCNC1=CC=CC=C1 XJ1126 [2,0,0,0,0,0|2,0,0]=4 155 B10R1.17 CCCOC1=CC=CC=C1 XJ1127 [2,0,0,0,0,0|2,0,0]=4 156 B10R1.17 ClCOCC1=CC=CC=C1 JZ2365 [2,0,0,0,0,0|1,0,1]=4 157 B10R1.15 C1=CC=C(C(=O)OC)C=C1 LQ3514 [2,0,0,0,0,0|0,0,0]=2 158 B10R1.15 CCC(=O)C1=CC=CN=C1 JZ4667 [2,0,0,0,0,0|1,0,0]=3 159 B10R1.15 CCC(C)C1=CC=CC=C1 LL0562 [2,0,0,0,0,0|1,0,1]=4 160 B10R1.15 CC[C@@H](N)C1=CC=CC=C1 HL2472 [2,0,0,0,0,0|1,0,1]=4 161 B10R1.15 CNC(=O)C1=CC=CC=C1 HL0175 [2,0,0,0,0,0|1,0,0]=3 162 B10R1.15 CNC(=O)C1=NC=CC=C1 RT3529 [2,0,0,0,0,0|2,0,0]=4 163 B10R1.15 COC(=N)C1=NC=CC=C1 RT4090 [2,0,0,0,0,0|2,0,0]=4 164 B10R1.15 COC(=O)C1=CC=CN=C1 JZ0756 [2,0,0,0,0,0|1,0,0]=3 165 B10R1.15 COC(=O)C1=CC=NC=C1 RT1566 [2,0,0,0,0,0|1,0,0]=3 166 B10R1.15 COC(=O)C1=CN=CN=C1 YH55622 [2,0,0,0,0,0|2,0,0]=4 167 B10R1.15 COC(=O)C1=NC=CC=N1 YH55623 [2,0,0,0,0,0|2,0,0]=4 168 B10R1.15 NCC(=O)C1=CC=CC=C1 LT5895 [2,0,0,0,0,0|1,0,0]=3 169 B10R1.15 NCC(=O)C1=CC=CN=C1 RT4369 [2,0,0,0,0,0|2,0,0]=4 170 B10R1.15 NNC(=O)C1=CC=CC=C1 LT4155 [2,0,0,0,0,0|2,0,0]=4 171 B10R1.15 O=C(CBr)C1=CC=CC=C1 RT11120 [2,0,0,0,0,0|1,0,0]=3 172 B10R1.15 O=C(CBr)C1=CC=CC=C1 YH43692 [2,0,0,0,0,0|1,0,0]=3 173 B10R1.15 O=C(CBr)C1=CC=NC=C1 XJ2872 [2,0,0,0,0,0|2,0,0]=4 174 B10R1.15 O=C(CBr)C1=NC=CC=C1 LQ4012 [2,0,0,0,0,0|2,0,0]=4 175 B10R1.15 O=C(CCl)C1=CC=CC=C1 LT3832 [2,0,0,0,0,0|1,0,0]=3 176 B10R1.15 O=C(NO)C1=CC=CC=C1 LT6975 [2,0,0,0,0,0|2,0,0]=4 177 B10R1.13 CC(=O)C1=CC=C(Br)C=C1 HL1303 [2,0,0,0,0,0|1,0,0]=3 178 B10R1.13 CC(=O)C1=CC=C(C)N=C1 RT18075 [2,0,0,0,0,0|2,0,0]=4 179 B10R1.13 CC(=O)C1=CC=C(Cl)C=C1 JZ1119 [2,0,0,0,0,0|1,0,0]=3 180 B10R1.13 CC(=O)C1=CC=C(Cl)N=C1 YH07034 [2,0,0,0,0,0|2,0,0]=4 181 B10R1.13 CC(=O)C1=CC=C(F)C=C1 JZ1124 [2,0,0,0,0,0|1,0,0]=3 182 B10R1.13 CC(=O)C1=CC=C(N)C=C1 LT6854 [2,0,0,0,0,0|0,0,0]=2 183 B10R1.13 CC(=O)C1=CC=C(O)C=C1 RT11987 [2,0,0,0,0,0|1,0,0]=3 184 B10R1.13 CC(=O)C1=CN=C(Br)C=C1 HL3496 [2,0,0,0,0,0|2,0,0]=4 185 B10R1.13 CC(=O)C1=NC=C(Br)C=C1 CJ2729 [2,0,0,0,0,0|2,0,0]=4 186 B10R1.13 CC1=CC=C(C(=O)O)C=C1 JZ0130 [2,0,0,0,0,0|1,0,0]=3 187 B10R1.13 CC1=CC=C(C(=O)O)C=N1 JZ2268 [2,0,0,0,0,0|2,0,0]=4 188 B10R1.13 CC1=CC=C(C(N)=O)C=C1 JZ3937 [2,0,0,0,0,0|2,0,0]=4 189 B10R1.13 CC1=CC=C(S(=O)O)C=C1 LL0969 [2,0,0,0,0,0|2,0,0]=4 190 B10R1.13 CC1=CN=C(C(=O)O)C=C1 YH01820 [2,0,0,0,0,0|2,0,0]=4 191 B10R1.13 CN(C)C1=CC=C(N)C=C1 HL1305 [2,0,0,0,0,0|2,0,0]=4 192 B10R1.13 CN(C)C1=CC=C(N)C=C1 LL0967 [2,0,0,0,0,0|2,0,0]=4 193 B10R1.13 CN(C)C1=CC=C(N)C=C1 LQ4413 [2,0,0,0,0,0|2,0,0]=4 194 B10R1.13 CN(C)C1=CC=C(N)C=C1 XJ3077 [2,0,0,0,0,0|2,0,0]=4 195 B10R1.13 N=C(N)C1=CC=C(N)C=C1 HL2287 [2,0,0,0,0,0|2,0,0]=4 196 B10R1.13 N=C(N)C1=CC=C(N)C=C1 JZ3229 [2,0,0,0,0,0|2,0,0]=4 197 B10R1.13 NC(=O)C1=CC=C(Br)C=C1 LQ1385 [2,0,0,0,0,0|2,0,0]=4 198 B10R1.13 NC(=O)C1=CC=C(Cl)C=C1 JZ3938 [2,0,0,0,0,0|2,0,0]=4 199 B10R1.13 NC(=O)C1=CC=C(F)C=C1 JZ4190 [2,0,0,0,0,0|2,0,0]=4 200 B10R1.13 NC(=O)C1=CC=C(I)C=C1 YH59026 [2,0,0,0,0,0|2,0,0]=4 201 B10R1.13 NC(=O)C1=CC=C(O)C=C1 JZ3939 [2,0,0,0,0,0|2,0,0]=4 202 B10R1.13 NC(=O)C1=NC=C(N)C=C1 YH35056 [2,0,0,0,0,0|2,0,0]=4 203 B10R1.13 NC1=CC=C(B(O)O)C=C1 SY0280 [2,0,0,0,0,0|1,0,1]=4 204 B10R1.13 NC1=CC=C(C(=O)O)C=C1 RT3381 [2,0,0,0,0,0|0,0,0]=2 205 B10R1.13 NC1=CC=C(C(=O)O)C=N1 LT3585 [2,0,0,0,0,0|1,0,0]=3 206 B10R1.13 NC1=CC=C(C(=O)[O-])C=C1 LT3105 [2,0,0,0,0,0|0,0,1]=3 207 B10R1.13 NC1=CC=C([N+](=O)[O-])C=C1 JZ0055 [2,0,0,0,0,0|1,0,1]=4 208 B10R1.13 NC1=CN=C(C(=O)O)C=C1 JZ1163 [2,0,0,0,0,0|1,0,0]=3 209 B10R1.13 O=C(Cl)C1=CC=C(Cl)C=C1 XJ0449 [2,0,0,0,0,0|2,0,0]=4 210 B10R1.13 O=C(Cl)C1=CC=C(F)C=C1 JZ1126 [2,0,0,0,0,0|2,0,0]=4 211 B10R1.13 O=C(Cl)C1=CC=C(I)C=C1 JZ4692 [2,0,0,0,0,0|2,0,0]=4 212 B10R1.13 O=C(O)C1=CC=C(Br)C=C1 XJ1044 [2,0,0,0,0,0|1,0,0]=3 213 B10R1.13 O=C(O)C1=CC=C(Br)C=N1 JZ0785 [2,0,0,0,0,0|2,0,0]=4 214 B10R1.13 O=C(O)C1=CC=C(Br)N=C1 JZ1200 [2,0,0,0,0,0|2,0,0]=4 215 B10R1.13 O=C(O)C1=CC=C(Cl)C=C1 JZ0383 [2,0,0,0,0,0|1,0,0]=3 216 B10R1.13 O=C(O)C1=CC=C(Cl)N=C1 LT3592 [2,0,0,0,0,0|2,0,0]=4 217 B10R1.13 O=C(O)C1=CC=C(F)C=C1 JZ1125 [2,0,0,0,0,0|1,0,0]=3 218 B10R1.13 O=C(O)C1=CC=C(I)C=C1 JZ3940 [2,0,0,0,0,0|1,0,0]=3 219 B10R1.13 O=C(O)C1=CC=C(O)C=C1 JZ0015 [2,0,0,0,0,0|1,0,0]=3 220 B10R1.13 O=C(O)C1=CC=C(O)C=N1 XJ4141 [2,0,0,0,0,0|2,0,0]=4 221 B10R1.13 O=C(O)C1=CC=C(O)N=C1 RT9389 [2,0,0,0,0,0|2,0,0]=4 222 B10R1.13 O=C(O)C1=CN=C(F)C=C1 CJ2890 [2,0,0,0,0,0|2,0,0]=4 223 B10R1.13 O=C(O)C1=NC=C(Cl)C=C1 LL1597 [2,0,0,0,0,0|2,0,0]=4 224 B10R1.13 O=C(O)C1=NC=C(F)C=C1 YH23879 [2,0,0,0,0,0|2,0,0]=4 225 B10R1.13 O=C([O-])C1=CC=C(O)C=C1 HL1435 [2,0,0,0,0,0|1,0,1]=4 226 B12R1.1 CCCCOC1=CC=C(N)C=C1 JZ2480 [1,1,0,0,0,0|1,0,1]=4 227 B12R1.385 CCCOC1=CC=C(N)C(N)=C1 LT3465 [1,1,0,0,0,0|2,0,0]=4 228 B12R1.385 CCCSC1=CC=C(N)C(N)=C1 LT3838 [1,1,0,0,0,0|2,0,0]=4 229 B12R1.17 CCOC(=O)C1=CC(=O)NC=N1 YH47503 [1,1,0,0,0,0|2,0,0]=4 230 B12R1.17 CCOC(=O)C1=CC(=O)NN=C1 LT5882 [1,1,0,0,0,0|2,0,0]=4 231 B12R1.17 CCOC(=O)C1=CC(C)=CC=C1 LL0469 [1,1,0,0,0,0|0,0,0]=2 232 B12R1.17 CCOC(=O)C1=CC(C)=CN=C1 HL1082 [1,1,0,0,0,0|1,0,0]=3 233 B12R1.17 CCOC(=O)C1=CC(Cl)=CC=C1 HL0704 [1,1,0,0,0,0|0,0,0]=2 234 B12R1.17 CCOC(=O)C1=CC(F)=CC=C1 XJ0783 [1,1,0,0,0,0|0,0,0]=2 235 B12R1.17 CCOC(=O)C1=CC(N)=CC=C1 XJ0992 [1,1,0,0,0,0|0,0,0]=2 236 B12R1.17 CCOC(=O)C1=CC(N)=NC=C1 XJ3863 [1,1,0,0,0,0|1,0,0]=3 237 B12R1.17 CCOC(=O)C1=CC(O)=CC=C1 XJ3351 [1,1,0,0,0,0|0,0,0]=2 238 B12R1.17 CCOC(=O)C1=CC(O)=CN=C1 YH08900 [1,1,0,0,0,0|1,0,0]=3 239 B12R1.17 CCOC(=O)C1=NC(Br)=CC=C1 YH45965 [1,1,0,0,0,0|1,0,0]=3 240 B12R1.17 CCOC(=O)C1=NC=NC(Cl)=C1 YH04924 [1,1,0,0,0,0|2,0,0]=4 241 B12R1.17 CNCC(=O)C1=CC(O)=CC=C1 RT2728 [1,1,0,0,0,0|2,0,0]=4 242 B12R1.30 CCCCC(=O)C1=CC=CC=C1 HL0607 [1,1,0,0,0,0|1,0,0]=3 243 B12R1.30 CCCNC(=O)C1=NC=CC=C1 CJ3376 [1,1,0,0,0,0|2,0,0]=4 244 B12R1.30 CCCOC(=O)C1=CC=CC=C1 HL2226 [1,1,0,0,0,0|0,0,0]=2 245 B12R1.30 NCCOC(=O)C1=CN=CC=C1 RT2347 [1,1,0,0,0,0|1,0,0]=3 246 B12R1.30 O=C(CCCO)C1=CC=CN=C1 RT9397 [1,1,0,0,0,0|2,0,0]=4 247 B12R1.30 O=C(OCCO)C1=CC=CC=C1 RT0571 [1,1,0,0,0,0|0,0,0]=2 248 B12R1.34 CCC(Br)C(=O)C1=CC=CC=C1 RT12924 [1,1,0,0,0,0|1,0,0]=3 249 B12R1.34 COC(=O)C(=O)C1=CC=CC=C1 LT5550 [1,1,0,0,0,0|2,0,0]=4 250 B12R1.34 CON(C)C(=O)C1=CC=CC=C1 YH14235 [1,1,0,0,0,0|2,0,0]=4 251 B12R1.39 CCOS(=O)(=O)C1=CC=CC=C1 RT12173 [1,1,0,0,0,0|1,0,0]=3 252 B12R1.107 CC(=O)CC(=O)C1=CC=CC=C1 HL1237 [1,1,0,0,0,0|1,0,1]=4 253 B12R1.308 CCOC(=O)C1=C(C)C=CC=C1 LQ0202 [1,1,0,0,0,0|0,0,0]=2 254 B12R1.308 CCOC(=O)C1=C(C)C=NC=C1 YH08753 [1,1,0,0,0,0|1,0,0]=3 255 B12R1.308 CCOC(=O)C1=C(Cl)C=CC=C1 LQ3267 [1,1,0,0,0,0|0,0,0]=2 256 B12R1.308 CCOC(=O)C1=C(Cl)N=CN=C1 YH65810 [1,1,0,0,0,0|2,0,0]=4 257 B12R1.308 CCOC(=O)C1=C(F)C=CC=C1 LL0830 [1,1,0,0,0,0|0,0,0]=2 258 B12R1.308 CCOC(=O)C1=C(I)C=CC=C1 HL2008 [1,1,0,0,0,0|0,0,0]=2 259 B12R1.308 CCOC(=O)C1=C(N)C=CC=N1 RT2194 [1,1,0,0,0,0|1,0,0]=3 260 B12R1.308 CCOC(=O)C1=C(N)C=NC=C1 JZ4908 [1,1,0,0,0,0|1,0,0]=3 261 B12R1.308 CCOC(=O)C1=C(O)C=CN=C1 YH08219 [1,1,0,0,0,0|1,0,0]=3 262 B12R1.308 CCOC(=O)C1=CN=CN=C1O JZ2600 [1,1,0,0,0,0|2,0,0]=4 263 B12R1.308 O=C(NCO)C1=CC=CC=C1O YH32384 [1,1,0,0,0,0|2,0,0]=4 264 B12R1.5 CCC(=O)C1=CC=C(OC)C=C1 LL0515 [1,1,0,0,0,0|1,0,0]=3 265 B12R1.5 COC(=O)C1=CC=C(C#N)C=C1 HL0707 [1,1,0,0,0,0|0,0,1]=3 266 B12R1.5 COC(=O)C1=CC=C(C=O)C=C1 JZ4668 [1,1,0,0,0,0|1,0,0]=3 267 B12R1.5 COC(=O)C1=CC=C(C=O)C=C1 LQ1892 [1,1,0,0,0,0|1,0,0]=3 268 B12R1.5 COC(=O)C1=CC=C(CBr)C=C1 LT5149 [1,1,0,0,0,0|1,0,0]=3 269 B12R1.5 COC(=O)C1=CC=C(CCl)C=C1 LT5150 [1,1,0,0,0,0|1,0,0]=3 270 B12R1.5 COC(=O)C1=CC=C(CO)C=C1 JZ3023 [1,1,0,0,0,0|1,0,0]=3 271 B12R1.5 COC(=O)C1=CC=C(OC)N=C1 JZ0753 [1,1,0,0,0,0|2,0,0]=4 272 B12R1.5 COC(=O)C1=CN=C(C=O)C=C1 YH21073 [1,1,0,0,0,0|2,0,0]=4 273 B12R1.5 COC(=O)C1=CN=C(CO)C=C1 LQ5359 [1,1,0,0,0,0|2,0,0]=4 274 B12R1.5 COC1=CC=C(C(=O)CCl)C=C1 LT3323 [1,1,0,0,0,0|2,0,0]=4 275 B12R1.5 COC1=CC=C(C(=O)CN)C=C1 LQ5042 [1,1,0,0,0,0|2,0,0]=4 276 B12R1.5 N#CC1=CC=C(C(=O)CBr)C=C1 LQ4188 [1,1,0,0,0,0|1,0,1]=4 277 B12R1.9 CCS(=O)(=O)C1=CC=C(Cl)C=C1 LT3073 [1,1,0,0,0,0|2,0,0]=4 278 B12R1.9 COS(=O)(=O)C1=CC=C(C)C=C1 LQ4642 [1,1,0,0,0,0|2,0,0]=4 279 B12R1.9 NC1=CC=C(S(=O)(=O)O[Na])C=C1 HL1939 [1,1,0,0,0,0|2,0,0]=4 280 B12R1.12 CCN(CC)C1=CC=C(N)C=C1 HL1211 [1,1,0,0,0,0|2,0,0]=4 281 B12R1.12 CCN(CC)C1=CC=C(N)C=C1 JZ1929 [1,1,0,0,0,0|2,0,0]=4 282 B12R1.12 CCN(CC)C1=CC=C(N)C=C1 LT5591 [1,1,0,0,0,0|2,0,0]=4 283 B12R1.12 CCN(CC)C1=CC=C(N)C=C1 XJ5961 [1,1,0,0,0,0|2,0,0]=4 284 B12R1.20 CC(=O)C(=O)C1=CC=C(Cl)C=C1 LQ3474 [1,1,0,0,0,0|1,0,1]=4 285 B12R1.20 CC(C)C(=O)C1=CC=C(Cl)C=C1 YH65724 [1,1,0,0,0,0|1,0,0]=3 286 B12R1.20 CC1=CC=C(C(=O)C(C)Cl)C=C1 YH47530 [1,1,0,0,0,0|1,0,0]=3 287 B12R1.20 CN(C)C(=O)C1=CC=C(N)C=C1 LQ3089 [1,1,0,0,0,0|1,0,0]=3 288 B12R1.367 COC(=O)C1=CC(Br)=C(Cl)N=C1 LL1424 [1,1,0,0,0,0|2,0,0]=4 289 B12R1.367 COC(=O)C1=CC(Br)=C(N)N=C1 JZ1657 [1,1,0,0,0,0|1,0,0]=3 290 B12R1.367 COC(=O)C1=CC(C)=C(Br)C=C1 LL2255 [1,1,0,0,0,0|1,0,0]=3 291 B12R1.367 COC(=O)C1=CC(C)=C(Cl)C=C1 LL1641 [1,1,0,0,0,0|1,0,0]=3 292 B12R1.367 COC(=O)C1=CC(Cl)=C(N)C=C1 XJ6490 [1,1,0,0,0,0|0,0,0]=2 293 B12R1.367 COC(=O)C1=CC(I)=C(C)C=C1 HL4891 [1,1,0,0,0,0|1,0,0]=3 294 B12R1.367 COC(=O)C1=CC(I)=C(Cl)C=C1 YH57244 [1,1,0,0,0,0|1,0,0]=3 295 B12R1.367 COC(=O)C1=CC(I)=C(O)C=C1 XJ4161 [1,1,0,0,0,0|1,0,0]=3 296 B12R1.367 COC(=O)C1=CC(N)=C(C)C=C1 RT3244 [1,1,0,0,0,0|1,0,0]=3 297 B12R1.367 COC(=O)C1=CC(O)=C(C)C=C1 YH56650 [1,1,0,0,0,0|1,0,0]=3 298 B12R1.367 COC(=O)C1=CC(O)=C(F)C=C1 LL2617 [1,1,0,0,0,0|1,0,0]=3 299 B12R1.367 COC(=O)C1=CC(O)=C(N)C=C1 YH11298 [1,1,0,0,0,0|0,0,0]=2 300 B12R1.367 COC(=O)C1=CC=C(Br)C(O)=C1 RT10880 [1,1,0,0,0,0|1,0,0]=3 301 B12R1.367 COC(=O)C1=CC=C(C)C(Br)=C1 XJ6779 [1,1,0,0,0,0|1,0,0]=3 302 B12R1.367 COC(=O)C1=CC=C(C)C(N)=C1 YH65012 [1,1,0,0,0,0|1,0,0]=3 303 B12R1.367 COC(=O)C1=CC=C(Cl)C(N)=C1 LT3014 [1,1,0,0,0,0|1,0,0]=3 304 B12R1.367 COC(=O)C1=CC=C(I)C(Br)=C1 YH65503 [1,1,0,0,0,0|1,0,0]=3 305 B12R1.367 COC(=O)C1=CC=C(N)C(C)=C1 LT3146 [1,1,0,0,0,0|0,0,0]=2 306 B12R1.367 COC(=O)C1=CC=C(O)C(C)=C1 YH00863 [1,1,0,0,0,0|1,0,0]=3 307 B12R1.367 COC(=O)C1=CC=C(O)C(N)=C1 RT2941 [1,1,0,0,0,0|1,0,0]=3 308 B12R1.367 COC(=O)C1=CN(C)C(=O)C=C1 LT5876 [1,1,0,0,0,0|2,0,0]=4 309 B12R1.367 O=C(CBr)C1=CC(Cl)=C(Cl)C=C1 LT1996 [1,1,0,0,0,0|2,0,0]=4 310 B12R1.367 O=C(CCl)C1=CC(O)=C(O)C=C1 XJ0281 [1,1,0,0,0,0|2,0,0]=4 311 B12R1.1703 CCC(=O)C1=C(O)C=C(O)C=C1 HL3011 [1,1,0,0,0,0|1,0,0]=3 312 B12R1.1703 COC(=O)C1=C(Br)C=C(C)C=C1 YH91859 [1,1,0,0,0,0|1,0,0]=3 313 B12R1.1703 COC(=O)C1=C(C)C=C(Cl)C=C1 XJ2408 [1,1,0,0,0,0|1,0,0]=3 314 B12R1.1703 COC(=O)C1=C(C)N=C(C)C=C1 RT9229 [1,1,0,0,0,0|2,0,0]=4 315 B12R1.1703 COC(=O)C1=C(Cl)C=C(Cl)N=C1 YH12488 [1,1,0,0,0,0|2,0,0]=4 316 B12R1.1703 COC(=O)C1=C(F)C=C(F)C=C1 CJ2192 [1,1,0,0,0,0|1,0,0]=3 317 B12R1.1703 COC(=O)C1=C(O)C=C(C)C=C1 LQ2726 [1,1,0,0,0,0|1,0,0]=3 318 B12R1.1703 COC(=O)C1=C(O)C=C(F)C=C1 HL1734 [1,1,0,0,0,0|1,0,0]=3 319 B12R1.1703 COC(=O)C1=C(O)C=C(O)C=C1 LQ2098 [1,1,0,0,0,0|1,0,0]=3 320 B12R1.1703 COC(=O)C1=CC=C(Br)C=C1Br RT11090 [1,1,0,0,0,0|1,0,0]=3 321 B12R1.1703 COC(=O)C1=CC=C(Br)C=C1I CJ3332 [1,1,0,0,0,0|1,0,0]=3 322 B12R1.1703 COC(=O)C1=CC=C(Br)C=C1N YH32748 [1,1,0,0,0,0|1,0,0]=3 323 B12R1.1703 COC(=O)C1=CC=C(N)C=C1C YH14295 [1,1,0,0,0,0|0,0,0]=2 324 B12R1.1703 COC(=O)C1=CC=C(N)C=C1Cl YH02304 [1,1,0,0,0,0|0,0,0]=2 325 B12R1.1703 COC(=O)C1=CC=C(N)C=C1O LT5969 [1,1,0,0,0,0|0,0,0]=2 326 B12R1.1703 NC1=CC(Cl)=CC=C1C(=O)CCl RT1619 [1,1,0,0,0,0|2,0,0]=4 327 B12R1.1703 NC1=CC(O)=C(C(=O)O[Na])C=C1 CJ2106 [1,1,0,0,0,0|1,0,0]=3 328 B12R1.1703 NCC(=O)C1=C(Cl)C=C(Cl)C=C1 YH53846 [1,1,0,0,0,0|2,0,0]=4 329 B12R1.1703 O=C(CBr)C1=C(O)C=C(O)C=C1 YH49339 [1,1,0,0,0,0|2,0,0]=4 330 B12R1.1703 O=C(CBr)C1=CC=C(Cl)C=C1Cl JZ2098 [1,1,0,0,0,0|2,0,0]=4 331 B12R1.1703 O=C(CBr)C1=CC=C(F)C=C1F HL3116 [1,1,0,0,0,0|2,0,0]=4 332 B12R1.313 CCOC(=O)C1=C(Br)SC(N)=N1 HL4198 [0,1,0,0,1,0|2,0,0]=4 333 B12R1.313 CCOC(=O)C1=C(C)C=C(C)N1 JZ1932 [0,1,0,0,1,0|2,0,0]=4 334 B12R1.313 CCOC(=O)C1=C(C)C=C(N)S1 LT0697 [0,1,0,0,1,0|1,0,0]=3 335 B12R1.313 CCOC(=O)C1=C(C)N=C(N)S1 LT5386 [0,1,0,0,1,0|2,0,0]=4 336 B12R1.1579 CCOC(=O)C1=CN=C(N)N1C YH66597 [0,1,0,0,1,0|2,0,0]=4 337 B14R1.35 CCOC(=O)C(=O)C1=CC=C(Br)C=C1 YH44497 [0,1,0,0,0,1|1,0,0]=3 338 B14R1.35 CCOC(=O)C(=O)C1=CC=C(Cl)C=C1 XJ5220 [0,1,0,0,0,1|1,0,0]=3 339 B14R1.954 CCOC(=O)CC1=NC=C(CC)C=C1 RT7880 [0,1,0,0,0,1|2,0,0]=4 340 B14R1.6823 CCOC(=O)CC1=C(Cl)C=C(Cl)C=C1 YH00369 [0,1,0,0,0,1|1,0,0]=3 341 B14R1.6823 CCOC(=O)CC1=CC=C(Br)C=C1Cl RT11859 [0,1,0,0,0,1|1,0,0]=3 342 B14R1.19 CCCCOC(=O)C1=CC=C(N)C=C1 LT7046 [0,2,0,0,0,0|0,0,0]=2 343 B14R1.125 CC1=CC=C(S(=O)(=O)OCCF)C=C1 LX2315 [0,2,0,0,0,0|2,0,0]=4 344 B14R1.125 CCCOS(=O)(=O)C1=CC=C(C)C=C1 JZ3932 [0,2,0,0,0,0|2,0,0]=4 345 B14R1.678 CC1=CC=C(C(=O)CNC(C)C)C=C1 RT6161 [0,2,0,0,0,0|2,0,0]=4 346 B14R1.678 CN(C)CCC(=O)C1=CC=C(Br)C=C1 RT1558 [0,2,0,0,0,0|2,0,0]=4 347 B14R1.678 NC1=CC=C(C(=O)NCC(=O)O)C=C1 XJ0008 [0,2,0,0,0,0|1,0,1]=4 348 B14R1.678 NC1=CC=C(C(=O)NCC(=O)[O-])C=C1 HL1243 [0,2,0,0,0,0|1,0,1]=4 349 B14R1.941 CCCCC(=O)C1=CC(Cl)=C(Cl)C=C1 CJ2963 [0,2,0,0,0,0|2,0,0]=4 350 B14R1.694 CC1=CC=C(S(=O)(=O)OC(C)C)C=C1 LX2028 [0,2,0,0,0,0|2,0,0]=4 351 B14R1.2 C(=O)C1=CC=C(C(=O)NC(C)C)C=C1 JZ3705 [0,2,0,0,0,0|2,0,0]=4 352 B14R1.683 CC(C)(C)OC(=O)C1=CC=C(Br)C=C1 RT12815 [0,2,0,0,0,0|1,0,0]=3 353 B14R1.683 CC(C)(C)OC(=O)C1=CC=C(N)C=C1 YH41542 [0,2,0,0,0,0|0,0,0]=2 354 B14R1.25 CCOC(=O)C1=CC=C(OCC)C=C1 LT2808 [0,2,0,0,0,0|1,0,0]=3 355 B14R1.626 CCOC(=O)C1=CC(OC)=C(O)C=C1 LQ1200 [0,2,0,0,0,0|1,0,0]=3 356 B14R1.7264 CCOC(=O)C1=CC(C)=C(C)N=C1Cl RT9403 [0,2,0,0,0,0|2,0,0]=4 357 B14R1.7264 CCOC(=O)C1=CN(C)C(=O)C=C1Cl YH88108 [0,2,0,0,0,0|2,0,0]=4 358 B14R1.7265 CCOC(=O)C1=C(C)C(=O)C(C)=CO1 RT15349 [0,2,0,0,0,0|2,0,0]=4 359 B14R1.18811 CCOC(=O)C1=C(C)C=C(C)C=C1C XJ1882 [0,2,0,0,0,0|1,0,0]=3 360 B14R1.18811 CCOC(=O)C1=C(O)C=C(O)C=C1O RT12736 [0,2,0,0,0,0|1,0,0]=3 361 B12R2.24 NC1=CC2=C(C=C1)CNCC2 YH15702 [1,0,0,1,0,0|1,0,1]=4 362 B12R2.2 C1=CC=C(C2CCCO2)C=C1 YH37915 [1,0,0,1,0,0|1,0,1]=4 363 B12R2.2 C1=CN=CC(C2=NCCO2)=C1 RT2485 [1,0,0,1,0,0|2,0,0]=4 364 B12R2.1081 O=C1CCCC2=C1C=CC=C2 RT11341 [1,0,0,1,0,0|1,0,0]=3 365 B12R2.1081 O=C1CCCC2=CC=CN=C12 LX2062 [1,0,0,1,0,0|2,0,0]=4 366 B12R2.1081 O=C1CCCC2=CC=NC=C12 YH46803 [1,0,0,1,0,0|2,0,0]=4 367 B12R2.1081 O=C1CCCC2=CN=CC=C12 YH46802 [1,0,0,1,0,0|2,0,0]=4 368 B12R2.1081 O=C1CCCC2=NC=CC=C12 YH05749 [1,0,0,1,0,0|2,0,0]=4 369 B12R2.1081 O=C1CCOC2=CC=CC=C12 LL0873 [1,0,0,1,0,0|2,0,0]=4 370 B12R2.1081 O=C1NCCC2=CC=CC=C12 JZ4485 [1,0,0,1,0,0|1,0,0]=3 371 B12R2.1081 O=C1OCCC2=CC=CC=C12 LQ2745 [1,0,0,1,0,0|0,0,0]=2 372 B12R2.2028 CC1=CC(C)C2=C1C=CC=C2 YH66162 [1,0,0,1,0,0|2,0,0]=4 373 B12R2.2028 O=C1OC(=O)C2=C1C=CC=C2 LQ0154 [1,0,0,1,0,0|1,0,1]=4 374 B12R2.2028 O=C1OC(=O)C2=CC=CC=C12 XJ5075 [1,0,0,1,0,0|1,0,1]=4 375 B12R2.2028 O=C1OC(Br)C2=C1C=CC=C2 JZ3058 [1,0,0,1,0,0|1,0,0]=3 376 B12R2.2028 O=C1OC(Cl)C2=CC=CC=C12 LQ3023 [1,0,0,1,0,0|1,0,0]=3 377 B12R2.2075 O=C(C1=CC=CC=C1)C2CC2 LQ2435 [1,0,0,1,0,0|1,0,0]=3 378 B12R2.612 CC1=CC=C2C(=O)CCC2=C1 HL2805 [1,0,0,1,0,0|1,0,0]=3 379 B12R2.612 NC1=CC2=C(C=C1)C(=O)CC2 LQ2490 [1,0,0,1,0,0|0,0,0]=2 380 B12R2.612 O=C1CCC2=C1C=CC(O)=C2 LQ2487 [1,0,0,1,0,0|1,0,0]=3 381 B12R2.612 O=C1CCC2=CC(Br)=CC=C12 XJ5153 [1,0,0,1,0,0|1,0,0]=3 382 B12R2.612 O=C1CCC2=CC(Cl)=CC=C12 YH01019 [1,0,0,1,0,0|1,0,0]=3 383 B12R2.612 O=C1CCC2=CC(F)=CC=C12 JZ4104 [1,0,0,1,0,0|1,0,0]=3 384 B12R2.612 O=C1COC2=CC(Br)=CC=C12 YH44457 [1,0,0,1,0,0|2,0,0]=4 385 B12R2.612 O=C1COC2=CC(Cl)=CC=C12 XJ2407 [1,0,0,1,0,0|2,0,0]=4 386 B14R2.949 O=C(CC1=CC=C(F)C=C1)C2CC2 RT11216 [0,0,0,1,0,1|2,0,0]=4 387 B14R2.1801 COC1=CC2=C(C=C1)C(=O)CCC2 YH23936 [0,1,0,1,0,0|2,0,0]=4 388 B14R2.1801 COC1=CC=C2C(=O)NCCC2=C1 YH47331 [0,1,0,1,0,0|2,0,0]=4 389 B14R2.1801 COC1=CC=C2C(=O)OCCC2=C1 YH45271 [0,1,0,1,0,0|1,0,0]=3 390 B10R0.108 C\C=C(C)\C=C\C(=O)OCC RT18867 [0,0,1,0,1,0|1,0,1]=4 391 B10R1.11 CCCC(=O)C1=CC=CS1 XJ2839 [1,0,0,0,1,0|2,0,0]=4 392 B10R1.11 CCOC(=O)C1=CC=CN1 LX2718 [1,0,0,0,1,0|1,0,0]=3 393 B10R1.11 CCOC(=O)C1=CC=CS1 HL2383 [1,0,0,0,1,0|1,0,0]=3 394 B10R1.11 CCOC(=O)C1=CNC=N1 XJ4741 [1,0,0,0,1,0|2,0,0]=4 395 B10R1.11 CCOC(=O)C1=CNN=C1 RT14133 [1,0,0,0,1,0|2,0,0]=4 396 B10R1.11 CCOC(=O)C1=CSC=N1 LQ3748 [1,0,0,0,1,0|2,0,0]=4 397 B10R1.11 CCOC(=O)C1=NC=CN1 LQ4757 [1,0,0,0,1,0|2,0,0]=4 398 B10R1.14 COC(=O)C1=CC=C(N)S1 YH35219 [1,0,0,0,1,0|1,0,0]=3 399 B10R1.14 COC(=O)C1=CN=C(N)S1 LX2982 [1,0,0,0,1,0|2,0,0]=4 400 B10R1.14 COC(=O)C1=CSC(N)=N1 RT15694 [1,0,0,0,1,0|2,0,0]=4 401 B12R1.32 CCCC(=O)CC1=CC=CC=C1 RT12903 [1,0,0,0,0,1|1,0,0]=3 402 B12R1.32 CCOC(=O)CC1=CC=NC=C1 RT14075 [1,0,0,0,0,1|1,0,0]=3 403 B12R1.32 CCOC(=O)CC1=NC=CC=C1 XJ2291 [1,0,0,0,0,1|1,0,0]=3 404 B12R1.32 CCOC(=O)NC1=CC=CC=C1 LQ0343 [1,0,0,0,0,1|0,0,0]=2 405 B14R1.502 CCOC(=O)\C=C\C1=CC=C(C)C=C1 JZ5402 [0,0,0,0,0,2|1,0,0]=3 406 B14R1.502 CCOC(=O)\C=C\C1=CC=C(N)C=C1 LT5392 [0,0,0,0,0,2|0,0,0]=2 407 B14R1.502 CCOC(=O)\C=C\C1=CC=C(O)C=C1 XJ2320 [0,0,0,0,0,2|1,0,0]=3 408 B14R1.502 CCOC(=O)\C=C\C1=CC=C(S)C=C1 RT19777 [0,0,0,0,0,2|1,0,0]=3