0 B13R1.3 CCC1=CC=C(CCC(=O)O)C=C1 SC-50581 [0,0,0,0,0,0|3,0,0]=3 1 B13R1.3 CCC1=CC=C(\C=C\C(=O)O)C=C1 SC-39214 [0,0,0,0,0,0|3,0,1]=4 2 B13R1.3 COC1=CC=C(CCC(=N)N)C=C1 SC-38555 [0,0,0,0,0,0|3,0,0]=3 3 B13R1.3 COC1=CC=C(CCC(=O)Cl)C=C1 SC-58001 [0,0,0,0,0,0|2,0,0]=2 4 B13R1.3 COC1=CC=C(CCC(=O)O)C=C1 SC-02096 [0,0,0,0,0,0|2,0,0]=2 5 B13R1.3 COC1=CC=C(\C=C\C(=O)O)C=C1 SC-77648 [0,0,0,0,0,0|2,0,1]=3 6 B13R1.3 COC1=CC=C(\C=C\C(=O)O)C=N1 SC-39812 [0,0,0,0,0,0|3,0,1]=4 7 B13R1.3 CSC1=CC=C(\C=C\C(=O)O)C=C1 SC-39309 [0,0,0,0,0,0|2,1,1]=4 8 B12R1.21 CC(=O)CCC1=CC=C(Br)C=C1 SC-34731 [1,0,0,0,0,0|2,0,0]=3 9 B12R1.21 CC(=O)CCC1=CC=C(O)C=C1 SC-18497 [1,0,0,0,0,0|1,0,0]=2 10 B12R1.21 CC(=O)\C=C\C1=CC=C(O)C=C1 SC-80308 [1,0,0,0,0,0|1,0,1]=3 11 B12R1.21 CC(=S)CSC1=CC=C(C)C=C1 SC-43259 [1,0,0,0,0,0|2,1,0]=4 12 B12R1.21 CC(C)OCC1=CC=C(Br)C=C1 SC-34569 [1,0,0,0,0,0|2,0,1]=4 13 B12R1.21 CC1=CC=C(OCC(=O)Cl)C=C1 SC-91235 [1,0,0,0,0,0|3,0,0]=4 14 B12R1.21 CC1=CC=C(OCC(=O)O)C=C1 SC-50222 [1,0,0,0,0,0|3,0,0]=4 15 B12R1.21 CC1=CC=C(\C=C\C(=O)O)C=C1 SC-01993 [1,0,0,0,0,0|2,0,1]=4 16 B12R1.21 CN(C)CCC1=CC=C(O)C=C1 SC-13784 [1,0,0,0,0,0|3,0,0]=4 17 B12R1.21 N=C(N)CCC1=CC=C(O)C=C1 SC-41086 [1,0,0,0,0,0|3,0,0]=4 18 B12R1.21 O=C(O)CCC1=CC=C(F)C=C1 SC-25794 [1,0,0,0,0,0|3,0,0]=4 19 B12R1.21 O=C(O)CNC1=CC=C(O)C=C1 SC-48863 [1,0,0,0,0,0|3,0,0]=4 20 B12R1.21 O=C(O)\C=C\C1=CC=C(O)C=C1 SC-65982 [1,0,0,0,0,0|2,0,1]=4 21 B12R1.71 CCCNC1=CC=C(OC)C=C1 SC-41004 [1,0,0,0,0,0|2,0,1]=4 22 B12R1.71 CCOCC1=CC=C(OC)C=C1 SC-51464 [1,0,0,0,0,0|0,0,1]=2 23 B12R1.71 COC1=CC=C(CCCCl)C=C1 SC-53908 [1,0,0,0,0,0|2,0,1]=4 24 B12R1.71 COC1=CC=C(CCCO)C=C1 SC-23493 [1,0,0,0,0,0|1,0,2]=4 25 B12R1.71 COC1=CC=C(CCNN)C=C1 SC-60012 [1,0,0,0,0,0|3,0,0]=4 26 B12R1.71 COC1=CC=C(CCNN)C=C1 SC-62687 [1,0,0,0,0,0|3,0,0]=4 27 B12R1.71 COC1=CC=C(COCCl)C=C1 SC-49858 [1,0,0,0,0,0|1,0,1]=3 28 B14R1.2 COC1=CC=C(C(=O)CC(C)=O)C=C1 SC-24051 [0,1,0,0,0,0|1,0,1]=3 29 B14R1.2 CSC1=CC=C(C(N)CC(=O)O)C=C1 SC-62659 [0,1,0,0,0,0|2,1,0]=4 30 B14R1.5 COC(=O)CCC1=CC=C(C#N)C=C1 SC-74262 [0,1,0,0,0,0|3,0,0]=4 31 B14R1.5 COC(=O)CCC1=CC=C(CN)C=C1 SC-74259 [0,1,0,0,0,0|3,0,0]=4 32 B14R1.103 COC1=CC=C(\C=C\C(=O)O)C(C)=C1 SC-39082 [0,1,0,0,0,0|2,0,1]=4 33 B14R1.211 CCC1=CC=C(COS(C)(=O)=O)C=C1 SC-61618 [0,1,0,0,0,0|2,0,0]=3 34 B14R1.211 COC1=CC=C(COP(=O)([O-])[O-])C=C1 SC-25273 [0,1,0,0,0,0|2,0,0]=3 35 B14R1.419 CN(C)C1=CC=C(CCC(=O)O)C=C1 SC-43933 [0,1,0,0,0,0|3,0,0]=4 36 B14R1.419 O=C(Cl)OCC1=CC=C([N+](=O)[O-])C=C1 SC-17804 [0,1,0,0,0,0|3,0,0]=4 37 B14R1.3653 CCC1=CC=C(CCC(=O)O)C=C1N SC-13182 [0,1,0,0,0,0|3,0,0]=4 38 B14R1.3653 COC1=C(Br)C=C(\C=C\C(=O)O)C=C1 SC-41346 [0,1,0,0,0,0|2,0,1]=4 39 B14R1.3653 COC1=CC=C(\C=C\C(=O)O)C=C1C SC-39501 [0,1,0,0,0,0|2,0,1]=4 40 B14R1.3653 COC1=CC=C(\C=C\C(=O)O)C=C1Cl SC-39418 [0,1,0,0,0,0|2,0,1]=4 41 B14R1.3653 COC1=CC=C(\C=C\C(=O)O)C=C1F SC-38995 [0,1,0,0,0,0|2,0,1]=4 42 B14R2.27 COC1=CC=C(C2CC(=O)C2)C=C1 SC-35905 [0,0,0,1,0,0|1,0,0]=2 43 B14R2.134 COC1=CC=C2OCC(=O)NC2=C1 SC-33444 [0,0,0,1,0,0|3,0,0]=4 44 B12R1.4 CC(=O)NC1=CC=C(NN)C=C1 SC-26181 [0,0,0,0,1,0|3,0,0]=4 45 B12R1.4 CCC1=CC=C(CC(=N)N)C=C1 SC-40772 [0,0,0,0,1,0|3,0,0]=4 46 B12R1.4 CCC1=CC=C(CC(=O)O)C=C1 SC-60150 [0,0,0,0,1,0|2,0,0]=3 47 B12R1.4 COC1=CC=C(CC(=N)N)C=C1 SC-40571 [0,0,0,0,1,0|2,0,0]=3 48 B12R1.4 COC1=CC=C(CC(=O)Cl)C=C1 SC-48474 [0,0,0,0,1,0|1,0,0]=2 49 B12R1.4 COC1=CC=C(NC(C)=O)C=C1 SC-15897 [0,0,0,0,1,0|1,0,0]=2 50 B12R1.4 COC1=CC=C(NC(C)=O)C=C1 SC-77885 [0,0,0,0,1,0|1,0,0]=2 51 B12R1.4 CSC1=CC=C(CC(=N)N)C=C1 SC-40897 [0,0,0,0,1,0|2,1,0]=4 52 B12R1.4 CSC1=CC=C(CC(=O)O)C=C1 SC-18858 [0,0,0,0,1,0|1,1,0]=3 53 B14R1.4 C=C(C)CNCC1=CC=C(OC)C=C1 SC-31967 [0,0,0,0,0,1|2,0,0]=3 54 B14R1.4 COC1=CC=C(CCNC(=N)N)C=C1 SC-60376 [0,0,0,0,0,1|3,0,0]=4 55 B11R0.111 COC(=O)\C=C\CCOC(C)=O SC-30975 [1,0,1,0,0,0|1,0,1]=4 56 B11R1.1 CC1=CC=C(CN=C=O)C=C1 SC-54133 [2,0,0,0,0,0|1,0,1]=4 57 B11R1.1 CCOCC1=CC=C(Br)C=C1 SC-34265 [2,0,0,0,0,0|1,0,1]=4 58 B11R1.1 COCCC1=CC=C(O)C=C1 SC-17787 [2,0,0,0,0,0|2,0,0]=4 59 B11R1.91 CC(=N)NCC1=CC=CC=C1 SC-62048 [2,0,0,0,0,0|2,0,0]=4 60 B11R1.91 CC(=O)NCC1=CC=NC=C1 SC-54472 [2,0,0,0,0,0|2,0,0]=4 61 B11R1.91 CC(=O)NCC1=CN=CC=C1 SC-65166 [2,0,0,0,0,0|2,0,0]=4 62 B11R1.91 CC(=O)NCC1=NC=CC=C1 SC-54471 [2,0,0,0,0,0|2,0,0]=4 63 B11R1.91 O=C(O)CCC1=CC=CC=C1 SC-04862 [2,0,0,0,0,0|2,0,0]=4 64 B11R1.83 CCC1=CC=C(CC=O)C=C1 SC-45697 [2,0,0,0,0,0|1,0,0]=3 65 B11R1.83 CCC1=CC=C(CNC)C=C1 SC-28006 [2,0,0,0,0,0|2,0,0]=4 66 B11R1.83 CCC1=CC=C(NC=O)C=C1 SC-59806 [2,0,0,0,0,0|2,0,0]=4 67 B11R1.83 CCC1=CN=C(CC=O)C=C1 SC-61426 [2,0,0,0,0,0|2,0,0]=4 68 B11R1.83 CCNC1=CC=C(OC)C=C1 SC-25595 [2,0,0,0,0,0|1,0,1]=4 69 B11R1.83 COC1=CC=C(CCBr)C=C1 SC-48565 [2,0,0,0,0,0|1,0,1]=4 70 B11R1.83 COC1=CC=C(N=C=O)C=C1 SC-46397 [2,0,0,0,0,0|1,0,1]=4 71 B11R1.83 COCC1=CC=C(CO)C=C1 SC-51429 [2,0,0,0,0,0|2,0,0]=4 72 B11R1.83 C\C=C\C1=CC=C(OC)C=C1 SC-47202 [2,0,0,0,0,0|0,0,1]=3 73 B13R1.14 COC(=O)CCC1=CC=C(F)C=C1 SC-53419 [1,1,0,0,0,0|2,0,0]=4 74 B13R1.14 O=C(CBr)CCC1=CC=C(Br)C=C1 SC-34471 [1,1,0,0,0,0|2,0,0]=4 75 B13R1.132 CC1=CC=C(C(N)CC(=O)O)C=C1 SC-52131 [1,1,0,0,0,0|2,0,0]=4 76 B13R1.132 NC(CC(=O)O)C1=CC=C(O)C=C1 SC-59306 [1,1,0,0,0,0|2,0,0]=4 77 B13R1.133 CC1=CC=C(CC(N)C(=O)O)C=C1 SC-10870 [1,1,0,0,0,0|2,0,0]=4 78 B13R1.133 NC(CC1=CC=C(O)C=C1)C(=O)O SC-09927 [1,1,0,0,0,0|2,0,0]=4 79 B13R1.133 O=C(O)C(O)CC1=CC=C(O)C=C1 SC-46145 [1,1,0,0,0,0|2,0,0]=4 80 B13R1.133 O=C([O-])C(=O)CC1=CC=C(O)C=C1 SC-87615 [1,1,0,0,0,0|2,0,0]=4 81 B13R1.133 [C@H](N)(CC1=CC=C(O)C=C1)C(N)=O SC-09966 [1,1,0,0,0,0|2,0,0]=4 82 B13R1.164 CC1=CC=C(CCC(=O)O)C(Br)=C1 SC-42391 [1,1,0,0,0,0|2,0,0]=4 83 B13R1.164 O=C(O)CCC1=CC=C(O)C=C1Cl SC-49265 [1,1,0,0,0,0|2,0,0]=4 84 B13R1.511 CC1=CC=C(CCC(=O)O)C=C1Br SC-42409 [1,1,0,0,0,0|2,0,0]=4 85 B13R1.511 CC1=CC=C(CCC(=O)O)C=C1Cl SC-42204 [1,1,0,0,0,0|2,0,0]=4 86 B13R1.512 CC1=CC=C(COS(C)(=O)=O)C=C1 SC-61606 [1,1,0,0,0,0|1,0,0]=3 87 B13R1.512 CS(=O)(=O)OCC1=CC=C(Br)C=C1 SC-61612 [1,1,0,0,0,0|2,0,0]=4 88 B13R1.512 CS(=O)(=O)OCC1=CC=C(Cl)C=C1 SC-61607 [1,1,0,0,0,0|2,0,0]=4 89 B13R1.512 CS(=O)(=O)OCC1=CC=C(F)C=C1 SC-61604 [1,1,0,0,0,0|2,0,0]=4 90 B13R1.371 CCCCNC1=CC=C(OC)C=C1 SC-61662 [1,1,0,0,0,0|1,0,1]=4 91 B13R1.371 COC1=CC=C(CCCC=O)C=C1 SC-57737 [1,1,0,0,0,0|1,0,0]=3 92 B13R1.452 CCCC(C)C1=CC=C(OC)C=C1 SC-36347 [1,1,0,0,0,0|1,0,1]=4 93 B13R1.577 CCC1=CC=C(CCC=O)C=C1N SC-42027 [1,1,0,0,0,0|2,0,0]=4 94 B13R1.4 COC1=CC=C(OS(C)(=O)=O)C=C1 SC-58213 [0,1,0,0,1,0|1,0,0]=3 95 B13R1.35 COC1=CC=C(CC(=N)N)C=C1Br SC-39008 [0,1,0,0,1,0|2,0,0]=4 96 B13R1.35 COC1=CC=C(CC(=O)O)C=C1Br SC-22595 [0,1,0,0,1,0|1,0,0]=3 97 B13R1.35 COC1=CC=C(CC(=O)O)C=C1F SC-69991 [0,1,0,0,1,0|1,0,0]=3 98 B13R1.36 COC1=CC=C(C(C)C(=O)O)C=C1 SC-50177 [0,1,0,0,1,0|1,0,0]=3 99 B13R1.36 CSC1=CC=C(C(N)C(=O)O)C=C1 SC-59520 [0,1,0,0,1,0|1,1,0]=4 100 B13R1.142 CCCC1=CC=C(CC(=O)O)C=C1 SC-12735 [0,1,0,0,1,0|2,0,0]=4 101 B13R1.585 CC(=O)OC1=CC=C(C(=O)Cl)C=C1 SC-49882 [0,1,0,0,1,0|2,0,0]=4 102 B13R1.585 CC(=O)OC1=CC=C(C(C)C)C=C1 SC-45921 [0,1,0,0,1,0|1,0,0]=3 103 B13R1.585 CC(=O)OC1=CC=C([N+](=O)[O-])C=C1 SC-75404 [0,1,0,0,1,0|2,0,0]=4 104 B13R1.585 CN(C)C1=CC=C(CC(=O)O)C=C1 SC-43877 [0,1,0,0,1,0|2,0,0]=4 105 B13R1.653 COC1=CC(C)=C(CC(=O)O)C=C1 SC-12847 [0,1,0,0,1,0|1,0,0]=3 106 B13R1.653 COC1=CC(C)=C(NC(C)=O)C=C1 SC-27256 [0,1,0,0,1,0|1,0,0]=3 107 B13R1.653 COC1=CC(Cl)=C(CC(=O)O)C=C1 SC-68294 [0,1,0,0,1,0|1,0,0]=3 108 B13R1.653 COC1=CC=C(CC(=O)O)C(F)=C1 SC-21518 [0,1,0,0,1,0|1,0,0]=3 109 B15R1.211 COC(=O)CC(=O)C1=CC=C(OC)C=C1 SC-19777 [0,2,0,0,0,0|1,0,1]=4 110 B15R1.1854 COC1=CC=C(C(N)CC(=O)O)C(O)=C1 SC-59336 [0,2,0,0,0,0|2,0,0]=4 111 B15R1.3776 COC1=CC=C(C(N)CC(=O)O)C=C1Br SC-59300 [0,2,0,0,0,0|2,0,0]=4 112 B15R1.3776 COC1=CC=C(C(N)CC(=O)O)C=C1C SC-59351 [0,2,0,0,0,0|2,0,0]=4 113 B15R1.3776 COC1=CC=C(C(N)CC(=O)O)C=C1Cl SC-59302 [0,2,0,0,0,0|2,0,0]=4 114 B15R1.3776 COC1=CC=C(C(N)CC(=O)O)C=C1F SC-62656 [0,2,0,0,0,0|2,0,0]=4 115 B15R1.793 CCOC(=N)CCC1=CC=C(OC)C=C1 SC-38875 [0,2,0,0,0,0|2,0,0]=4 116 B15R1.793 CCOC(=O)\C=C\C1=CC=C(OC)C=C1 SC-65627 [0,2,0,0,0,0|1,0,1]=4 117 B15R1.793 CCOC(=O)\C=C\C1=CC=C(OC)C=C1 SC-69569 [0,2,0,0,0,0|1,0,1]=4 118 B15R1.702 COC1=CC(F)=C(CCC(=O)O)C(F)=C1 SC-42014 [0,2,0,0,0,0|2,0,0]=4 119 B15R1.5613 CCOC1=CC=C(COS(C)(=O)=O)C=C1 SC-61617 [0,2,0,0,0,0|1,0,0]=3 120 B13R2.147 CC1=CC=C(C2CC(=O)C2)C=C1 SC-36009 [1,0,0,1,0,0|1,0,0]=3 121 B13R2.147 O=C1CC(C2=CC=C(Br)C=C2)C1 SC-35818 [1,0,0,1,0,0|2,0,0]=4 122 B13R2.147 O=C1CC(C2=CC=C(F)C=C2)C1 SC-36161 [1,0,0,1,0,0|2,0,0]=4 123 B13R2.57 COC1=CC2=C(C=C1)CCC=C2 SC-51812 [1,0,0,1,0,0|1,0,1]=4 124 B13R2.57 COC1=CC2=C(C=C1)CCNC2 SC-52105 [1,0,0,1,0,0|2,0,0]=4 125 B13R2.669 COC1=CC2=C(C=C1)CCC2=S SC-42566 [1,0,0,1,0,0|1,1,0]=4 126 B13R2.669 COC1=CC2=C(C=C1)OCC2=O SC-49772 [1,0,0,1,0,0|2,0,0]=4 127 B13R2.669 COC1=CC=C2OCC(=O)C2=C1 SC-49765 [1,0,0,1,0,0|2,0,0]=4 128 B13R2.669 COC1=CC=C2ON=C(C)C2=C1 SC-86499 [1,0,0,1,0,0|2,0,0]=4 129 B13R2.2121 COC1=CC2=C(C=C1)NC(=O)C2 SC-06722 [0,0,0,1,1,0|1,0,0]=3 130 B13R2.2121 COC1=CC2=C(C=C1)OC(N)=N2 SC-14665 [0,0,0,1,1,0|2,0,0]=4 131 B13R2.2121 COC1=CC=C2N=C(C)OC2=C1 SC-50491 [0,0,0,1,1,0|1,0,1]=4 132 B13R2.2121 COC1=CC=C2OC(S)=NC2=C1 SC-70041 [0,0,0,1,1,0|1,1,0]=4 133 B15R2.2 COC1=CC=C(C2CCC(=O)O2)C=C1 SC-36133 [0,0,0,1,0,1|2,0,0]=4 134 B15R2.3137 COC1=CC2=C(C=C1)NC=C2C(C)=O SC-63720 [0,0,0,1,0,1|1,0,1]=4 135 B15R2.3137 COC1=CC2=C(C=C1)OC=C2C(C)=O SC-33220 [0,0,0,1,0,1|1,0,1]=4 136 B15R2.4834 COC1=CC=C2N=C(C(C)=O)SC2=C1 SC-33012 [0,1,0,1,0,0|2,0,0]=4 137 B15R2.7688 O=C(O)CCC1=CC2=C(C=C1)OCC2 SC-19727 [0,1,0,1,0,0|2,0,0]=4 138 B11R1.20 CC(=O)CC1=CC=C(N)C=C1 SC-69577 [1,0,0,0,1,0|1,0,0]=3 139 B11R1.20 CC(=O)NC1=CC=C(Br)C=C1 SC-26629 [1,0,0,0,1,0|2,0,0]=4 140 B11R1.20 CC(=O)NC1=CC=C(C)C=N1 SC-60671 [1,0,0,0,1,0|2,0,0]=4 141 B11R1.20 CC(=O)OC1=CC=C(F)C=C1 SC-04325 [1,0,0,0,1,0|1,0,0]=3 142 B11R1.20 CC(=O)OC1=CC=C(N)C=C1 SC-70450 [1,0,0,0,1,0|1,0,0]=3 143 B11R1.20 CC1=CC=C(CC(=N)N)C=C1 SC-40675 [1,0,0,0,1,0|2,0,0]=4 144 B11R1.20 CC1=CC=C(CC(=O)Cl)C=C1 SC-54628 [1,0,0,0,1,0|1,0,0]=3 145 B11R1.20 N=C(N)CC1=CC=C(O)C=C1 SC-40367 [1,0,0,0,1,0|2,0,0]=4 146 B11R1.20 NC(=O)CC1=CC=C(Br)C=C1 SC-71656 [1,0,0,0,1,0|2,0,0]=4 147 B11R1.20 NC1=CC=C(CC(=O)O)C=C1 SC-15574 [1,0,0,0,1,0|2,0,0]=4 148 B11R1.20 O=C(O)CC1=CC=C(O)C=C1 SC-22383 [1,0,0,0,1,0|1,0,0]=3 149 B11R1.3 C#CC1=CC=C(C(C)=O)C=C1 SC-22283 [0,0,0,0,2,0|1,0,1]=4 150 B11R1.3 CNC1=CC=C(C(=O)O)C=C1 SC-51809 [0,0,0,0,2,0|2,0,0]=4 151 B11R1.3 COC1=CC=C(C(C)N)C=C1 SC-27751 [0,0,0,0,2,0|1,0,1]=4 152 B11R1.3 COC1=CC=C(C(C)O)C=C1 SC-26983 [0,0,0,0,2,0|0,0,2]=4 153 B11R1.3 COC1=CN=C(C(N)=O)C=C1 SC-60559 [0,0,0,0,2,0|2,0,0]=4 154 B11R1.3 COC1=NC=C(C(=O)O)C=C1 SC-25402 [0,0,0,0,2,0|2,0,0]=4