0 B12R1.32 CCOC(=O)CC1=CC=CN=C1 AC-29265 [0,0,0,0,0,0|1,0,0]=1 1 B12R1.32 CCOC(=O)CC1=CC=NC=N1 AC-80877 [0,0,0,0,0,0|2,0,0]=2 2 B12R1.32 CCOC(=O)CC1=NC=CC=N1 AC-45273 [0,0,0,0,0,0|2,0,0]=2 3 B12R1.32 CCOC(=O)CC1=NC=CN=C1 AC-79737 [0,0,0,0,0,0|2,0,0]=2 4 B12R1.32 CN(CCN)CC1=CC=CC=C1 AC-57957 [0,0,0,0,0,0|4,0,0]=4 5 B12R1.32 CN(CCO)CC1=CC=CC=C1 AC-80118 [0,0,0,0,0,0|4,0,0]=4 6 B12R1.32 O=C(CCCl)NC1=CC=CC=C1 AC-37451 [0,0,0,0,0,0|3,0,0]=3 7 B12R1.32 O=C(\C=N\O)NC1=CC=CC=C1 AC-87887 [0,0,0,0,0,0|4,0,0]=4 8 B11R1.28 BrCCOCC1=CC=CC=C1 AC-73705 [1,0,0,0,0,0|3,0,0]=4 9 B11R1.28 CNC\C=C\C1=CC=CC=C1 AC-83868 [1,0,0,0,0,0|2,0,1]=4 10 B11R1.28 NCCNCC1=CC=CC=C1 AC-22878 [1,0,0,0,0,0|3,0,0]=4 11 B11R1.28 NCCOCC1=CC=CC=C1 AC-76963 [1,0,0,0,0,0|3,0,0]=4 12 B11R1.40 COC(=N)CC1=CC=CC=C1 AC-95822 [1,0,0,0,0,0|1,0,0]=2 13 B11R1.40 COC(=O)CC1=CC=CN=C1 AC-72096 [1,0,0,0,0,0|1,0,0]=2 14 B11R1.40 NC(CO)CC1=CC=CC=C1 AC-76906 [1,0,0,0,0,0|2,0,1]=4 15 B11R1.40 NNC(=O)CC1=CC=NC=C1 AC-79701 [1,0,0,0,0,0|3,0,0]=4 16 B11R1.40 NNC(=O)C[N+]1=CC=CC=C1 AC-83729 [1,0,0,0,0,0|3,0,0]=4 17 B11R1.40 N[C@H](CO)CC1=CC=CC=C1 AC-11522 [1,0,0,0,0,0|2,0,1]=4 18 B11R1.40 O=C(CBr)CC1=CC=CC=C1 AC-75854 [1,0,0,0,0,0|1,0,0]=2 19 B11R1.40 O=C(CCl)NC1=CC=CC=C1 AC-16971 [1,0,0,0,0,0|2,0,0]=3 20 B11R1.40 O=C(CCl)NC1=CC=NC=C1 AC-72583 [1,0,0,0,0,0|3,0,0]=4 21 B13R1.19 CCOC(=O)CC1=CC=C(Br)C=C1 AC-23542 [0,1,0,0,0,0|0,0,0]=1 22 B13R1.19 CCOC(=O)CC1=CC=C(Cl)C=C1 AC-79933 [0,1,0,0,0,0|0,0,0]=1 23 B13R1.19 CCOC(=O)CC1=CC=C(F)C=C1 AC-79531 [0,1,0,0,0,0|0,0,0]=1 24 B13R1.19 CCOC(=O)CC1=CC=C(O)C=C1 AC-14351 [0,1,0,0,0,0|0,0,0]=1 25 B13R1.19 CCOC(=O)CC1=NC=C(Cl)C=C1 AC-84747 [0,1,0,0,0,0|1,0,0]=2 26 B13R1.19 CCOC(=O)CC1=NC=C(N)C=C1 AC-69599 [0,1,0,0,0,0|1,0,0]=2 27 B13R1.19 CCOC(=O)CN1C=CC(=N)C=C1 AC-83297 [0,1,0,0,0,0|1,0,0]=2 28 B13R1.19 O=C(CCCl)NC1=CC=C(O)C=C1 AC-85435 [0,1,0,0,0,0|3,0,0]=4 29 B13R1.20 CCOC(=O)CC1=CC(F)=CN=C1 AC-69923 [0,1,0,0,0,0|1,0,0]=2 30 B13R1.20 CCOC(=O)CC1=CC=CC(Br)=C1 AC-38350 [0,1,0,0,0,0|0,0,0]=1 31 B13R1.20 CCOC(=O)CC1=CC=CC(F)=C1 AC-95050 [0,1,0,0,0,0|0,0,0]=1 32 B13R1.20 CCOC(=O)C[N+]1=CC(N)=CC=C1 AC-93235 [0,1,0,0,0,0|1,0,0]=2 33 B13R1.47 CCOC(=O)C(=O)C1=NC=CC=C1 AC-69865 [0,1,0,0,0,0|1,0,1]=3 34 B13R1.47 CCOC(=O)C(N)C1=NC=CC=C1 AC-41140 [0,1,0,0,0,0|1,0,0]=2 35 B13R1.135 CCC(Br)C(=O)NC1=CC=CC=C1 AC-52421 [0,1,0,0,0,0|2,0,0]=3 36 B13R1.348 CC(C)CC(=O)CC1=CC=CC=C1 AC-93702 [0,1,0,0,0,0|1,0,0]=2 37 B13R1.470 CCOC(=O)CC1=CC=CN=C1Cl AC-69588 [0,1,0,0,0,0|1,0,0]=2 38 B13R1.470 CCOC(=O)CC1=NC=CC=C1Br AC-69964 [0,1,0,0,0,0|1,0,0]=2 39 B13R1.470 CCOC(=O)CN1C=CC=CC1=N AC-85580 [0,1,0,0,0,0|1,0,0]=2 40 B13R2.15 CC1=NCCC1C2=CC=CC=C2 AC-95940 [0,0,0,1,0,0|2,0,0]=3 41 B13R2.15 O=C1NCCN1C2=CC=CC=C2 AC-75983 [0,0,0,1,0,0|2,0,0]=3 42 B13R2.15 O=C1OCCC1C2=CC=NC=C2 AC-88715 [0,0,0,1,0,0|1,0,0]=2 43 B13R2.26 CCCC1=NC2=CC=CC=C2N1 AC-56938 [0,0,0,1,0,0|3,0,0]=4 44 B13R2.64 C1=CC(CC2OCCO2)=CC=N1 AC-94545 [0,0,0,1,0,0|1,0,2]=4 45 B13R2.64 C1=CC=C(CC2CCCN2)C=C1 AC-81264 [0,0,0,1,0,0|2,0,1]=4 46 B13R2.64 C1=CC=C(CN2CCCC2)C=C1 AC-91622 [0,0,0,1,0,0|3,0,0]=4 47 B13R2.64 C1=CN=CC(CC2OCCO2)=C1 AC-94552 [0,0,0,1,0,0|1,0,2]=4 48 B13R2.135 CCN1C(C)=CC2=C1C=CC=C2 AC-66287 [0,0,0,1,0,0|2,0,1]=4 49 B13R2.135 CCN1C2=CC=CC=C2N=C1Cl AC-83591 [0,0,0,1,0,0|3,0,0]=4 50 B13R2.135 NCC1C(=O)NC2=C1C=CC=C2 AC-92475 [0,0,0,1,0,0|3,0,0]=4 51 B13R2.163 O=C1CCCC2=CC=CC=C2N1 AC-19159 [0,0,0,1,0,0|2,0,0]=3 52 B13R2.163 O=C1CCNC2=CC=CC=C2N1 AC-57392 [0,0,0,1,0,0|3,0,0]=4 53 B13R2.444 O=C(CC1=NC=CC=C1)C2CC2 AC-93151 [0,0,0,1,0,0|2,0,0]=3 54 B13R2.444 OC(CC1=CC=CC=C1)C2CC2 AC-75899 [0,0,0,1,0,0|1,0,2]=4 55 B11R1.16 CCCC(=O)C1=CC=CN=C1 AC-89818 [0,0,0,0,1,0|2,0,0]=3 56 B11R1.16 CCCC(=O)C1=CC=NC=C1 AC-80358 [0,0,0,0,1,0|2,0,0]=3 57 B11R1.16 CCOC(=O)C1=CC=NC=C1 AC-74067 [0,0,0,0,1,0|1,0,0]=2 58 B11R1.16 CCOC(=O)C1=CN=CC=C1 AC-66280 [0,0,0,0,1,0|1,0,0]=2 59 B11R1.16 CCOC(=O)C1=CN=CN=C1 AC-29270 [0,0,0,0,1,0|2,0,0]=3 60 B11R1.16 CCOC(=O)C1=NC=CC=C1 AC-66261 [0,0,0,0,1,0|1,0,0]=2 61 B11R1.16 CCOC(=O)C1=NC=CC=N1 AC-29271 [0,0,0,0,1,0|2,0,0]=3 62 B11R1.16 N#CCC(=O)C1=CC=CC=C1 AC-16572 [0,0,0,0,1,0|2,0,1]=4 63 B11R1.16 O=C(NCO)C1=CN=CC=C1 AC-13191 [0,0,0,0,1,0|3,0,0]=4 64 B11R1.30 CCOC(=O)CC1=CC=CS1 AC-23554 [0,0,0,0,1,0|1,0,0]=2 65 B11R1.30 CCOC(=O)CC1=CSC=C1 AC-93425 [0,0,0,0,1,0|1,0,0]=2 66 B11R1.30 CCOC(=O)CC1=CSC=N1 AC-72333 [0,0,0,0,1,0|2,0,0]=3 67 B11R1.30 CCOC(=O)CC1=NC=CS1 AC-79517 [0,0,0,0,1,0|2,0,0]=3 68 B13R1.42 C=CNC(=O)OCC1=CC=CC=C1 AC-33326 [0,0,0,0,0,1|1,0,2]=4 69 B13R1.42 CCOC(=O)C#CC1=NC=CC=C1 AC-92847 [0,0,0,0,0,1|1,0,1]=3 70 B13R1.42 CCOC(=O)CSC1=NC=CC=C1 AC-88970 [0,0,0,0,0,1|1,0,0]=2 71 B13R1.42 O=C(CCCl)NCC1=CC=CC=C1 AC-83666 [0,0,0,0,0,1|2,0,0]=3 72 B13R1.42 O=C(CCO)OCC1=CC=CC=C1 AC-81818 [0,0,0,0,0,1|2,0,0]=3 73 B10R1.17 BrC\C=C\C1=CC=CC=C1 AC-27040 [2,0,0,0,0,0|1,0,1]=4 74 B10R1.17 CCCCC1=CC=NC=C1 AC-79321 [2,0,0,0,0,0|1,0,1]=4 75 B10R1.17 CCNCC1=CC=CC=C1 AC-23535 [2,0,0,0,0,0|1,0,0]=3 76 B10R1.17 CCNCC1=NC=CC=C1 AC-41270 [2,0,0,0,0,0|2,0,0]=4 77 B10R1.17 ClCSCC1=CC=CC=C1 AC-94728 [2,0,0,0,0,0|1,1,0]=4 78 B10R1.17 ClC\C=C\C1=CC=CC=C1 AC-93428 [2,0,0,0,0,0|1,0,1]=4 79 B10R1.17 OCCCC1=CC=CC=C1 AC-90879 [2,0,0,0,0,0|1,0,1]=4 80 B10R1.17 OC\C=C\C1=CC=CC=C1 AC-96518 [2,0,0,0,0,0|1,0,1]=4 81 B10R1.18 CC(=O)CC1=CC=CN=C1 AC-86273 [2,0,0,0,0,0|1,0,0]=3 82 B10R1.18 CC(=O)CC1=CC=NC=C1 AC-20022 [2,0,0,0,0,0|1,0,0]=3 83 B10R1.18 CC(=O)CC1=NC=CC=C1 AC-56618 [2,0,0,0,0,0|1,0,0]=3 84 B10R1.18 CC(=O)OC1=CC=CN=C1 AC-58110 [2,0,0,0,0,0|2,0,0]=4 85 B10R1.18 CC(Br)CC1=CC=CC=C1 AC-91740 [2,0,0,0,0,0|1,0,1]=4 86 B10R1.18 CC(C)=CC1=CC=CC=C1 AC-94041 [2,0,0,0,0,0|1,0,1]=4 87 B10R1.18 NC(=O)CC1=CC=CC=C1 AC-64120 [2,0,0,0,0,0|1,0,0]=3 88 B10R1.18 NC(=O)CC1=CC=CN=C1 AC-82928 [2,0,0,0,0,0|2,0,0]=4 89 B10R1.18 NC(=O)NC1=CC=CC=C1 AC-76979 [2,0,0,0,0,0|2,0,0]=4 90 B10R1.18 O=C(Cl)OC1=CC=CC=C1 AC-64085 [2,0,0,0,0,0|2,0,0]=4 91 B10R1.18 O=C(O)CC1=CC=CN=C1 AC-11679 [2,0,0,0,0,0|1,0,0]=3 92 B10R1.18 O=C(O)CC1=CC=CN=C1 AC-12682 [2,0,0,0,0,0|1,0,0]=3 93 B10R1.18 O=C(O)CC1=CC=NC=C1 AC-11642 [2,0,0,0,0,0|1,0,0]=3 94 B10R1.18 O=C(O)CC1=CC=NC=C1 AC-81529 [2,0,0,0,0,0|1,0,0]=3 95 B10R1.18 O=C(O)CC1=CC=NC=N1 AC-86762 [2,0,0,0,0,0|2,0,0]=4 96 B10R1.18 O=C(O)CC1=NC=CC=C1 AC-11641 [2,0,0,0,0,0|1,0,0]=3 97 B10R1.18 O=C(O)CC1=NC=CC=C1 AC-45374 [2,0,0,0,0,0|1,0,0]=3 98 B12R1.8 BrCCCCCC1=CC=CC=C1 AC-16353 [1,1,0,0,0,0|1,0,1]=4 99 B12R1.8 NCCCNCC1=CC=CC=C1 AC-52358 [1,1,0,0,0,0|2,0,0]=4 100 B12R1.8 NCCCOCC1=CC=CC=C1 AC-58975 [1,1,0,0,0,0|2,0,0]=4 101 B12R1.8 OCCCNCC1=CC=CC=C1 AC-12719 [1,1,0,0,0,0|2,0,0]=4 102 B12R1.8 OCCCOCC1=CC=CC=C1 AC-24730 [1,1,0,0,0,0|2,0,0]=4 103 B12R1.27 CCC(=O)OCC1=CC=CC=C1 AC-86751 [1,1,0,0,0,0|2,0,0]=4 104 B12R1.28 CCCCCC1=CC(F)=CC=C1 AC-84400 [1,1,0,0,0,0|1,0,1]=4 105 B12R1.28 CCNCCC1=CC=CC(Cl)=C1 AC-92775 [1,1,0,0,0,0|1,0,1]=4 106 B12R1.34 C=C(C(=O)OC)C1=CC=CC=C1 AC-94042 [1,1,0,0,0,0|0,0,1]=3 107 B12R1.34 CN(C(=O)CBr)C1=CC=CC=C1 AC-87986 [1,1,0,0,0,0|2,0,0]=4 108 B12R1.34 CNC(=O)C(N)C1=CC=CC=C1 AC-76236 [1,1,0,0,0,0|1,0,0]=3 109 B12R1.34 CNC(=O)C(O)C1=CC=CC=C1 AC-83053 [1,1,0,0,0,0|1,0,0]=3 110 B12R1.34 COC(=O)C(Br)C1=CC=CC=C1 AC-94487 [1,1,0,0,0,0|0,0,0]=2 111 B12R1.34 COC(=O)C(Cl)C1=CC=CC=C1 AC-14792 [1,1,0,0,0,0|0,0,0]=2 112 B12R1.34 COC(=O)C(N)C1=CC=CC=C1 AC-59199 [1,1,0,0,0,0|0,0,0]=2 113 B12R1.34 COC(=O)C(N)C1=CC=NC=C1 AC-72384 [1,1,0,0,0,0|1,0,0]=3 114 B12R1.34 COC(=O)C(N)C1=NC=CC=C1 AC-71284 [1,1,0,0,0,0|1,0,0]=3 115 B12R1.34 COC(=O)[C@@H](O)C1=CC=CC=C1 AC-38667 [1,1,0,0,0,0|0,0,0]=2 116 B12R1.34 COC(=O)[C@H](O)C1=CC=CC=C1 AC-38666 [1,1,0,0,0,0|0,0,0]=2 117 B12R1.43 CC(C)C(=O)CC1=NC=CC=C1 AC-85634 [1,1,0,0,0,0|1,0,0]=3 118 B12R1.43 CN(C)C(=O)NC1=CC=CC=C1 AC-86700 [1,1,0,0,0,0|2,0,0]=4 119 B12R1.49 C=CC(=O)CC1=CC=C(F)C=C1 AC-96279 [1,1,0,0,0,0|0,0,2]=4 120 B12R1.49 CC1=CC=C(NC(=O)CBr)C=C1 AC-54832 [1,1,0,0,0,0|2,0,0]=4 121 B12R1.49 CNC(=O)NC1=CC=C(O)C=C1 AC-81703 [1,1,0,0,0,0|2,0,0]=4 122 B12R1.49 COC(=O)CC1=CC=C(Br)C=C1 AC-30787 [1,1,0,0,0,0|0,0,0]=2 123 B12R1.49 COC(=O)CC1=CC=C(Cl)N=C1 AC-84559 [1,1,0,0,0,0|1,0,0]=3 124 B12R1.49 COC(=O)CC1=CC=C(O)C=C1 AC-14352 [1,1,0,0,0,0|0,0,0]=2 125 B12R1.49 COC(=O)C[N+]1=CC=C(N)C=C1 AC-93619 [1,1,0,0,0,0|1,0,0]=3 126 B12R1.49 COC(=O)NC1=NC=C(Br)C=C1 AC-89194 [1,1,0,0,0,0|2,0,0]=4 127 B12R1.49 O=C(CBr)CC1=CC=C(Cl)C=C1 AC-75851 [1,1,0,0,0,0|1,0,0]=3 128 B12R1.50 CCC(=O)NC1=CC=CC(N)=C1 AC-48160 [1,1,0,0,0,0|1,0,0]=3 129 B12R1.50 COC(=O)CC1=CC=CC(Br)=C1 AC-30786 [1,1,0,0,0,0|0,0,0]=2 130 B12R1.50 COC(=O)CC1=CC=CC(Cl)=C1 AC-90989 [1,1,0,0,0,0|0,0,0]=2 131 B12R1.50 COC(=O)CC1=NC(Cl)=CC=C1 AC-41086 [1,1,0,0,0,0|1,0,0]=3 132 B12R1.50 COC(=O)CC1=NC=CC(Br)=C1 AC-92659 [1,1,0,0,0,0|1,0,0]=3 133 B12R1.50 COC(=O)CC1=NC=CC(C)=C1 AC-94381 [1,1,0,0,0,0|1,0,0]=3 134 B12R1.50 O=C(CBr)CC1=CC=CC(Br)=C1 AC-75849 [1,1,0,0,0,0|1,0,0]=3 135 B12R1.50 O=C(CBr)CC1=CC=CC(Cl)=C1 AC-75850 [1,1,0,0,0,0|1,0,0]=3 136 B12R1.371 COC(=O)CC1=CC=CC=C1Br AC-72674 [1,1,0,0,0,0|0,0,0]=2 137 B12R1.371 COC(=O)CC1=CC=CC=C1F AC-67905 [1,1,0,0,0,0|0,0,0]=2 138 B12R1.371 COC(=O)CC1=CC=CC=C1I AC-85873 [1,1,0,0,0,0|0,0,0]=2 139 B12R1.371 COC(=O)CC1=CC=CC=C1N AC-86605 [1,1,0,0,0,0|0,0,0]=2 140 B12R1.371 COC(=O)CN1C=CC=CC1=N AC-94557 [1,1,0,0,0,0|1,0,0]=3 141 B12R1.371 O=C(CBr)CC1=CC=CC=C1Cl AC-75847 [1,1,0,0,0,0|1,0,0]=3 142 B12R1.16 CCCC(=O)C1=CC=C(Br)C=C1 AC-57889 [0,1,0,0,1,0|1,0,0]=3 143 B12R1.16 CCCC(=O)C1=CC=C(C)C=C1 AC-57880 [0,1,0,0,1,0|1,0,0]=3 144 B12R1.16 CCCC(=O)C1=CC=C(Cl)N=C1 AC-35140 [0,1,0,0,1,0|2,0,0]=4 145 B12R1.16 CCNC(=O)C1=CC=C(F)C=C1 AC-84380 [0,1,0,0,1,0|1,0,0]=3 146 B12R1.16 CCOC(=O)C1=CC=C(Br)C=C1 AC-23538 [0,1,0,0,1,0|0,0,0]=2 147 B12R1.16 CCOC(=O)C1=CC=C(C)C=C1 AC-29139 [0,1,0,0,1,0|0,0,0]=2 148 B12R1.16 CCOC(=O)C1=CC=C(Cl)C=C1 AC-28956 [0,1,0,0,1,0|0,0,0]=2 149 B12R1.16 CCOC(=O)C1=CN=C(Br)C=C1 AC-80174 [0,1,0,0,1,0|1,0,0]=3 150 B12R1.16 CCOC(=O)C1=CN=C(Cl)C=C1 AC-11650 [0,1,0,0,1,0|1,0,0]=3 151 B12R1.16 CCOC(=O)C1=CN=C(Cl)N=C1 AC-28996 [0,1,0,0,1,0|2,0,0]=4 152 B12R1.16 CCOC(=O)C1=CNC(=O)N=C1 AC-29214 [0,1,0,0,1,0|2,0,0]=4 153 B12R1.16 CCOC(=O)C1=NC=C(Br)C=C1 AC-28944 [0,1,0,0,1,0|1,0,0]=3 154 B12R1.16 CCOC(=O)C1=NC=C(Cl)C=C1 AC-28992 [0,1,0,0,1,0|1,0,0]=3 155 B12R1.16 CCOC(=O)C1=NN=C(C)C=C1 AC-40970 [0,1,0,0,1,0|2,0,0]=4 156 B12R1.16 CCOC(=O)C1=NN=C(Cl)C=C1 AC-28990 [0,1,0,0,1,0|2,0,0]=4 157 B12R1.17 CCNC(=O)C1=CC(Br)=NC=C1 AC-84194 [0,1,0,0,1,0|2,0,0]=4 158 B12R1.17 CCNC(=O)C1=CN=CC(Br)=C1 AC-87574 [0,1,0,0,1,0|2,0,0]=4 159 B12R1.17 CCNC(=O)C1=NC=CC(Cl)=C1 AC-83733 [0,1,0,0,1,0|2,0,0]=4 160 B12R1.17 CCOC(=O)C1=CC(Br)=NC=C1 AC-28927 [0,1,0,0,1,0|1,0,0]=3 161 B12R1.17 CCOC(=O)C1=CC(C)=NC=C1 AC-86717 [0,1,0,0,1,0|1,0,0]=3 162 B12R1.17 CCOC(=O)C1=CC(Cl)=NC=N1 AC-69015 [0,1,0,0,1,0|2,0,0]=4 163 B12R1.17 CCOC(=O)C1=CC(N)=NC=C1 AC-28842 [0,1,0,0,1,0|1,0,0]=3 164 B12R1.17 CCOC(=O)C1=CC(O)=NC=N1 AC-42624 [0,1,0,0,1,0|2,0,0]=4 165 B12R1.17 CCOC(=O)C1=CC=CC(I)=C1 AC-76772 [0,1,0,0,1,0|0,0,0]=2 166 B12R1.17 CCOC(=O)C1=CC=CC(N)=C1 AC-14927 [0,1,0,0,1,0|0,0,0]=2 167 B12R1.17 CCOC(=O)C1=CC=CC(N)=C1 AC-62745 [0,1,0,0,1,0|0,0,0]=2 168 B12R1.17 CCOC(=O)C1=CC=CC(O)=C1 AC-22151 [0,1,0,0,1,0|0,0,0]=2 169 B12R1.17 CCOC(=O)C1=CN=CC(Br)=C1 AC-10717 [0,1,0,0,1,0|1,0,0]=3 170 B12R1.17 CCOC(=O)C1=NC(Br)=CC=C1 AC-28943 [0,1,0,0,1,0|1,0,0]=3 171 B12R1.17 CCOC(=O)C1=NC(Br)=NC=C1 AC-84653 [0,1,0,0,1,0|2,0,0]=4 172 B12R1.17 CCOC(=O)C1=NC(C)=CC=C1 AC-91197 [0,1,0,0,1,0|1,0,0]=3 173 B12R1.17 CCOC(=O)C1=NC(Cl)=CC=C1 AC-28991 [0,1,0,0,1,0|1,0,0]=3 174 B12R1.17 CCOC(=O)C1=NC=CC(Br)=C1 AC-25488 [0,1,0,0,1,0|1,0,0]=3 175 B12R1.17 CCOC(=O)C1=NC=CC(C)=C1 AC-83921 [0,1,0,0,1,0|1,0,0]=3 176 B12R1.17 CCOC(=O)C1=NC=CC(N)=N1 AC-43473 [0,1,0,0,1,0|2,0,0]=4 177 B12R1.17 CCOC(=O)C1=NC=CC(O)=C1 AC-94657 [0,1,0,0,1,0|1,0,0]=3 178 B12R1.107 CC(=O)CC(=O)C1=CC=CC=C1 AC-22851 [0,1,0,0,1,0|1,0,1]=4 179 B12R1.107 CC(C)NC(=O)C1=CC=CC=C1 AC-30036 [0,1,0,0,1,0|1,0,0]=3 180 B12R1.107 CC(C)OC(=O)C1=CC=NC=N1 AC-88627 [0,1,0,0,1,0|2,0,0]=4 181 B12R1.308 CCCC(=O)C1=CC=CC=C1O AC-65621 [0,1,0,0,1,0|1,0,0]=3 182 B12R1.308 CCNC(=O)C1=C(N)N=CC=C1 AC-88588 [0,1,0,0,1,0|2,0,0]=4 183 B12R1.308 CCOC(=O)C1=C(Br)C=NC=C1 AC-89087 [0,1,0,0,1,0|1,0,0]=3 184 B12R1.308 CCOC(=O)C1=C(Br)N=CC=C1 AC-28935 [0,1,0,0,1,0|1,0,0]=3 185 B12R1.308 CCOC(=O)C1=C(Cl)C=NC=N1 AC-72445 [0,1,0,0,1,0|2,0,0]=4 186 B12R1.308 CCOC(=O)C1=C(F)N=CC=C1 AC-81837 [0,1,0,0,1,0|1,0,0]=3 187 B12R1.308 CCOC(=O)C1=C(O)C=NC=C1 AC-90992 [0,1,0,0,1,0|1,0,0]=3 188 B12R1.308 CCOC(=O)C1=C(O)N=CN=C1 AC-29106 [0,1,0,0,1,0|2,0,0]=4 189 B12R1.308 CCOC(=O)C1=C(O)N=CN=C1 AC-77097 [0,1,0,0,1,0|2,0,0]=4 190 B12R1.308 CCOC(=O)C1=CC=CC=C1Cl AC-76785 [0,1,0,0,1,0|0,0,0]=2 191 B12R1.308 CCOC(=O)C1=CC=CC=C1F AC-29063 [0,1,0,0,1,0|0,0,0]=2 192 B12R1.308 CCOC(=O)C1=CC=CC=C1I AC-86721 [0,1,0,0,1,0|0,0,0]=2 193 B12R1.308 CCOC(=O)C1=CC=NN=C1N AC-40966 [0,1,0,0,1,0|2,0,0]=4 194 B12R1.308 CCOC(=O)C1=CC=NN=C1O AC-40969 [0,1,0,0,1,0|2,0,0]=4 195 B12R1.308 CCOC(=O)C1=CN=CC=C1Cl AC-79867 [0,1,0,0,1,0|1,0,0]=3 196 B12R1.308 CCOC(=O)C1=CNC=CC1=O AC-83373 [0,1,0,0,1,0|1,0,0]=3 197 B12R1.308 CCOC(=O)C1=NC=CC=C1Br AC-87754 [0,1,0,0,1,0|1,0,0]=3 198 B12R1.308 CCOC(=O)C1=NC=CC=C1F AC-92242 [0,1,0,0,1,0|1,0,0]=3 199 B12R1.308 O=C(CCCl)C1=CC=CC=C1F AC-45213 [0,1,0,0,1,0|2,0,0]=4 200 B12R1.31 CCOC(=O)CC1=CN(C)N=C1 AC-88090 [0,1,0,0,1,0|2,0,0]=4 201 B12R1.31 CCOC(=O)CC1=CSC(Cl)=N1 AC-46134 [0,1,0,0,1,0|2,0,0]=4 202 B12R1.31 CCOC(=O)CC1=NC(C)=CS1 AC-94653 [0,1,0,0,1,0|2,0,0]=4 203 B12R1.318 CCOC(=O)CN1C=CN=C1C AC-72052 [0,1,0,0,1,0|2,0,0]=4 204 B14R1.29 CCOC(=O)CC(=O)C1=CC=CC=C1 AC-45308 [0,1,0,0,0,1|0,0,0]=2 205 B14R1.29 CCOC(=O)CC(=O)C1=NC=CC=C1 AC-44345 [0,1,0,0,0,1|1,0,0]=3 206 B14R1.29 CCOC(=O)CC(=O)C1=NC=CN=C1 AC-40784 [0,1,0,0,0,1|2,0,0]=4 207 B14R1.29 CCOC(=O)CC(O)C1=CC=CC=C1 AC-93778 [0,1,0,0,0,1|0,0,0]=2 208 B14R1.32 CCOC(=O)CCC1=CC=CC(N)=C1 AC-89809 [0,1,0,0,0,1|0,0,0]=2 209 B14R1.32 CCOC(=O)COC1=CC=CC(Br)=C1 AC-91098 [0,1,0,0,0,1|0,0,0]=2 210 B14R1.32 CCOC(=O)COC1=CC=CC(Cl)=C1 AC-93570 [0,1,0,0,0,1|0,0,0]=2 211 B14R1.32 CCOC(=O)\C=C\C1=CC=CC(N)=C1 AC-84634 [0,1,0,0,0,1|0,0,1]=3 212 B14R1.156 N#CCNC(=O)OCC1=CC=CC=C1 AC-91754 [0,1,0,0,0,1|1,0,1]=4 213 B14R1.156 NCCNC(=O)OCC1=CC=CC=C1 AC-61598 [0,1,0,0,0,1|1,0,0]=3 214 B14R1.156 O=C(NCCBr)OCC1=CC=CC=C1 AC-33896 [0,1,0,0,0,1|1,0,0]=3 215 B14R1.156 O=C(NCCI)OCC1=CC=CC=C1 AC-43529 [0,1,0,0,0,1|1,0,0]=3 216 B14R1.156 O=C(NCCO)OCC1=CC=CC=C1 AC-44016 [0,1,0,0,0,1|1,0,0]=3 217 B14R1.502 CCOC(=O)CCC1=CC=C(Br)C=C1 AC-25437 [0,1,0,0,0,1|0,0,0]=2 218 B14R1.502 CCOC(=O)\C=C\C1=CC=C(Br)C=C1 AC-73548 [0,1,0,0,0,1|0,0,1]=3 219 B14R1.502 CCOC(=O)\C=C\C1=CC=C(N)C=C1 AC-10434 [0,1,0,0,0,1|0,0,1]=3 220 B14R1.502 CCOC(=O)\C=C\C1=CC=C(N)C=C1 AC-10608 [0,1,0,0,0,1|0,0,1]=3 221 B14R1.502 CCOC(=O)\C=C\C1=CC=C(O)C=C1 AC-95438 [0,1,0,0,0,1|0,0,1]=3 222 B14R1.598 CCOC(=O)COC1=NC=CC=C1O AC-88469 [0,1,0,0,0,1|1,0,0]=3 223 B14R1.756 N[C@H](CO)C(=O)OCC1=CC=CC=C1 AC-83304 [0,1,0,0,0,1|2,0,0]=4 224 B14R1.35 CCOC(=O)C(=O)C1=CC=C(Br)C=C1 AC-28920 [0,2,0,0,0,0|0,0,1]=3 225 B14R1.35 CCOC(=O)C(=O)C1=CC=C(Cl)C=C1 AC-12610 [0,2,0,0,0,0|0,0,1]=3 226 B14R1.35 CCOC(=O)C(Br)C1=CC=C(Cl)C=C1 AC-94912 [0,2,0,0,0,0|0,0,0]=2 227 B14R1.35 CCOC(=O)C(O)C1=CC=C(O)C=C1 AC-91711 [0,2,0,0,0,0|0,0,0]=2 228 B14R1.134 CON(C)C(=O)CC1=CC=C(Br)C=C1 AC-42117 [0,2,0,0,0,0|2,0,0]=4 229 B14R1.954 CCOC(=O)CC1=CC=C(CO)C=C1 AC-88056 [0,2,0,0,0,0|0,0,0]=2 230 B14R1.954 CCOC(=O)CC1=CC=C(OC)C=C1 AC-88078 [0,2,0,0,0,0|0,0,0]=2 231 B14R1.954 CCOC(=O)CC1=CC=C(OC)C=C1 AC-88081 [0,2,0,0,0,0|0,0,0]=2 232 B14R1.967 CCOC(=O)CC1=CC=C(Br)C(N)=C1 AC-95768 [0,2,0,0,0,0|0,0,0]=2 233 B14R1.967 CCOC(=O)CC1=CC=C(F)C(F)=C1 AC-87344 [0,2,0,0,0,0|0,0,0]=2 234 B14R1.967 CCOC(=O)CC1=CC=C(F)C(N)=C1 AC-84714 [0,2,0,0,0,0|0,0,0]=2 235 B14R1.967 CCOC(=O)CC1=CC=C(I)C(F)=C1 AC-84239 [0,2,0,0,0,0|0,0,0]=2 236 B14R1.6823 CCOC(=O)CC1=CC=C(N)C=C1F AC-92124 [0,2,0,0,0,0|0,0,0]=2 237 B14R1.36 CCOC(=O)C(=O)C1=CC=CC(F)=C1 AC-12606 [0,2,0,0,0,0|0,0,1]=3 238 B14R1.950 CCOC(=O)NC1=NC(F)=CC=C1I AC-88302 [0,2,0,0,0,0|2,0,0]=4 239 B14R1.962 CCOC(=O)CC1=NC(NC)=CC=C1 AC-92314 [0,2,0,0,0,0|1,0,0]=3 240 B14R1.158 CCCCOC(=O)CC1=CC=CC=C1 AC-91741 [0,2,0,0,0,0|0,0,0]=2 241 B14R1.423 CC(=O)NOC(=O)CC1=CC=CC=C1 AC-24142 [0,2,0,0,0,0|0,0,1]=3 242 B14R1.423 O=C(O)CNC(=O)CC1=CC=CC=C1 AC-57754 [0,2,0,0,0,0|1,0,1]=4 243 B14R1.604 CCOC(=O)C(C=O)C1=CC=CC=C1 AC-95116 [0,2,0,0,0,0|0,0,0]=2 244 B14R1.604 CCOC(=O)\C(=C\O)C1=CC=CC=C1 AC-72448 [0,2,0,0,0,0|0,0,1]=3 245 B14R1.3348 CCOC(=O)C(=O)C1=CC=CC=C1Cl AC-84742 [0,2,0,0,0,0|0,0,1]=3 246 B14R1.3348 CCOC(=O)C(=O)C1=CC=CN=C1Cl AC-28993 [0,2,0,0,0,0|1,0,1]=4 247 B14R1.433 CC(C)(C)OC(=O)NC1=CC=NC=C1 AC-45344 [0,2,0,0,0,0|2,0,0]=4 248 B14R1.965 CCOC(=O)CC1=CC=CC=C1C#N AC-81033 [0,2,0,0,0,0|0,0,0]=2 249 B12R1.51 CCOC(=O)\C=C\C1=CC=CS1 AC-95562 [0,0,1,1,0,0|1,0,1]=4 250 B12R2.1 CCN1C=CC2=C1C=CC=C2 AC-86776 [1,0,0,1,0,0|1,0,1]=4 251 B12R2.2 C1=CC=C(C2=CCCC2)C=C1 AC-75353 [1,0,0,1,0,0|1,0,1]=4 252 B12R2.2 C1=CC=C(C2CCCN2)C=C1 AC-62045 [1,0,0,1,0,0|2,0,0]=4 253 B12R2.2 C1=CC=C(C2CCNC2)C=C1 AC-57402 [1,0,0,1,0,0|1,0,1]=4 254 B12R2.2 C1=CC=C(C2CCNC2)C=C1 AC-91187 [1,0,0,1,0,0|1,0,1]=4 255 B12R2.2 C1=CC=C([C@@H]2CCNC2)C=C1 AC-83118 [1,0,0,1,0,0|1,0,1]=4 256 B12R2.2 C1=CC=C([C@H]2CCNC2)C=C1 AC-71372 [1,0,0,1,0,0|1,0,1]=4 257 B12R2.41 C1=CC=C2CCNCCC2=C1 AC-86580 [1,0,0,1,0,0|1,0,1]=4 258 B12R2.1081 CC1CNCC2=C1C=CC=C2 AC-41446 [1,0,0,1,0,0|2,0,0]=4 259 B12R2.1081 CC1CNCC2=C1C=CC=C2 AC-79561 [1,0,0,1,0,0|2,0,0]=4 260 B12R2.18 CN1C(=O)CC2=C1C=CC=C2 AC-75973 [1,0,0,1,0,0|1,0,0]=3 261 B12R2.18 CN1C(=O)NC2=CC=CC=C21 AC-75955 [1,0,0,1,0,0|2,0,0]=4 262 B12R2.18 O=C1CC2=C(C=CC=C2)C1=O AC-65337 [1,0,0,1,0,0|1,0,1]=4 263 B12R2.18 O=C1NC2=C(C=CC=C2)C1Br AC-85247 [1,0,0,1,0,0|2,0,0]=4 264 B12R2.24 CN1CCC2=C(C=CC=C2)C1 AC-95591 [1,0,0,1,0,0|2,0,0]=4 265 B12R2.24 NC1CCC2=C(C=CC=C2)C1 AC-80418 [1,0,0,1,0,0|1,0,1]=4 266 B12R2.24 NN1CCC2=C(C=CC=C2)C1 AC-84934 [1,0,0,1,0,0|2,0,0]=4 267 B12R2.24 O=C1CC2=C(C=CC=C2)CO1 AC-10639 [1,0,0,1,0,0|0,0,0]=2 268 B12R2.24 O=C1CCC2=C(C=CC=C2)C1 AC-21974 [1,0,0,1,0,0|0,0,0]=2 269 B12R2.24 O=C1CCC2=C(C=CC=C2)N1 AC-45915 [1,0,0,1,0,0|1,0,0]=3 270 B12R2.24 O=C1CCC2=C(C=CC=C2)O1 AC-28072 [1,0,0,1,0,0|1,0,0]=3 271 B12R2.24 O=C1CCC2=C(N=CC=C2)N1 AC-28118 [1,0,0,1,0,0|2,0,0]=4 272 B12R2.24 O=C1CCN2C=CC=CC2=N1 AC-83000 [1,0,0,1,0,0|2,0,0]=4 273 B12R2.24 O=C1COC2=CC=CC=C2N1 AC-22850 [1,0,0,1,0,0|2,0,0]=4 274 B12R2.24 O=C1CSC2=CC=CC=C2N1 AC-16563 [1,0,0,1,0,0|2,0,0]=4 275 B12R2.32 CCC1=CC2=C(C=CC=C2)N1 AC-29123 [1,0,0,1,0,0|1,0,1]=4 276 B12R2.32 CCC1=NC2=CC=CC=C2N1 AC-28893 [1,0,0,1,0,0|2,0,0]=4 277 B12R2.2028 CN1NC(=O)C2=C1C=CC=C2 AC-83562 [0,0,0,1,1,0|2,0,0]=4 278 B12R2.2028 NC1NC(=O)C2=C1C=CC=C2 AC-92774 [0,0,0,1,1,0|2,0,0]=4 279 B12R2.2028 O=C1CC(Br)C2=C1C=CC=C2 AC-71476 [0,0,0,1,1,0|2,0,0]=4 280 B12R2.2075 O=C(C1=NC=CC=C1)C2CC2 AC-87704 [0,0,0,1,1,0|2,0,0]=4 281 B14R2.21 O=C1CC(C2=CC=CC=C2)CCN1 AC-80738 [0,0,0,1,0,1|1,0,0]=3 282 B14R2.21 O=C1CCCC(C2=CC=CC=C2)C1 AC-84803 [0,0,0,1,0,1|1,0,0]=3 283 B14R2.21 O=C1CCCC(C2=CC=CN=C2)C1 AC-76514 [0,0,0,1,0,1|2,0,0]=4 284 B14R2.21 O=C1CCCC(C2=CC=NC=C2)C1 AC-76517 [0,0,0,1,0,1|2,0,0]=4 285 B14R2.21 O=C1CCCN(C2=CC=CC=C2)C1 AC-63991 [0,0,0,1,0,1|1,0,0]=3 286 B14R2.21 O=C1CCOC(C2=CC=CC=C2)C1 AC-40757 [0,0,0,1,0,1|2,0,0]=4 287 B14R2.30 CC1=NCCN1CC2=CC=CC=C2 AC-87994 [0,0,0,1,0,1|2,0,0]=4 288 B14R2.72 FC1=CC=C(CC2=NCCC2)C=C1 AC-94200 [0,1,0,1,0,0|2,0,0]=4 289 B14R2.926 O=C1CCCN1C2=CC=C(F)C=C2 AC-77492 [0,1,0,1,0,0|2,0,0]=4 290 B14R2.926 O=C1NCCN1C2=CC=C(Cl)C=C2 AC-87506 [0,1,0,1,0,0|2,0,0]=4 291 B14R2.269 NC1=CC(N2CCCC2=O)=CC=C1 AC-51078 [0,1,0,1,0,0|2,0,0]=4 292 B14R2.269 O=C1NCCN1C2=CC=CC(Cl)=C2 AC-89425 [0,1,0,1,0,0|2,0,0]=4 293 B14R2.6 C1=CC=C(CC2COCCN2)C=C1 AC-76596 [0,1,0,1,0,0|1,0,1]=4 294 B14R2.6 C1=CC=C(C[C@H]2CNCCO2)C=C1 AC-81855 [0,1,0,1,0,0|1,0,1]=4 295 B14R2.24 O=C1C=CCCN1C2=CC=CC=C2 AC-90003 [0,1,0,1,0,0|2,0,0]=4 296 B14R2.24 O=C1NCCNC1C2=CC=CC=C2 AC-43454 [0,1,0,1,0,0|1,0,0]=3 297 B14R2.67 CCCCC1=CC2=C(C=CC=C2)C1 AC-34430 [0,1,0,1,0,0|2,0,0]=4 298 B14R2.741 NC1CCC2=CC=CC=C2NC1=O AC-86197 [0,1,0,1,0,0|2,0,0]=4 299 B14R2.741 O=C1NC2=CC=CC=C2CCC1Br AC-12990 [0,1,0,1,0,0|2,0,0]=4 300 B14R2.741 O=C1NC2=CC=CC=C2CCC1Cl AC-84250 [0,1,0,1,0,0|2,0,0]=4 301 B14R2.1128 CCC1OC2=CC=CC=C2NC1=O AC-81913 [0,1,0,1,0,0|2,0,0]=4 302 B14R2.296 O=C1CCCN1C2=CC=CC=C2Br AC-45652 [0,1,0,1,0,0|2,0,0]=4 303 B14R2.390 O=C1CCCC2=CC=CC(Cl)=C2N1 AC-85902 [0,1,0,1,0,0|2,0,0]=4 304 B14R2.4621 O=C(CC1=CC=CC=C1F)C2CC2 AC-27288 [0,1,0,1,0,0|1,0,0]=3 305 B10R1.15 CCC(=O)C1=CC=CC=C1 AC-15135 [1,0,0,0,1,0|0,0,0]=2 306 B10R1.15 CCC(=O)C1=CC=NC=C1 AC-23999 [1,0,0,0,1,0|1,0,0]=3 307 B10R1.15 CCC(=O)C1=NC=CC=C1 AC-41298 [1,0,0,0,1,0|1,0,0]=3 308 B10R1.15 CCC(=O)C1=NC=CC=N1 AC-93513 [1,0,0,0,1,0|2,0,0]=4 309 B10R1.15 COC(=O)C1=CC=NC=C1 AC-73084 [1,0,0,0,1,0|1,0,0]=3 310 B10R1.15 COC(=O)C1=CC=NN=C1 AC-40982 [1,0,0,0,1,0|2,0,0]=4 311 B10R1.15 COC(=O)C1=CN=CC=C1 AC-74068 [1,0,0,0,1,0|1,0,0]=3 312 B10R1.15 COC(=O)C1=CN=CN=C1 AC-31705 [1,0,0,0,1,0|2,0,0]=4 313 B10R1.15 COC(=O)C1=NC=CC=C1 AC-41241 [1,0,0,0,1,0|1,0,0]=3 314 B10R1.15 COC(=O)C1=NC=CC=N1 AC-26605 [1,0,0,0,1,0|2,0,0]=4 315 B10R1.15 COC(=O)C1=NC=CN=C1 AC-31578 [1,0,0,0,1,0|2,0,0]=4 316 B10R1.15 NNC(=O)C1=CC=CC=C1 AC-33227 [1,0,0,0,1,0|2,0,0]=4 317 B10R1.15 O=C(CBr)C1=CC=CN=C1 AC-17732 [1,0,0,0,1,0|2,0,0]=4 318 B10R1.15 O=C(CBr)C1=CC=NC=C1 AC-17733 [1,0,0,0,1,0|2,0,0]=4 319 B10R1.15 O=C(CBr)C1=NC=CC=C1 AC-17731 [1,0,0,0,1,0|2,0,0]=4 320 B10R1.15 O=C(CCl)C1=CC=CC=C1 AC-25606 [1,0,0,0,1,0|1,0,0]=3 321 B10R1.15 O=C(CCl)C1=CC=CN=C1 AC-76332 [1,0,0,0,1,0|2,0,0]=4 322 B10R1.15 O=C(CCl)C1=CC=CN=C1 AC-87675 [1,0,0,0,1,0|2,0,0]=4 323 B10R1.27 COC(=O)CC1=CNC=N1 AC-93409 [1,0,0,0,1,0|2,0,0]=4 324 B10R1.27 COC(=O)CC1=CSC=C1 AC-83080 [1,0,0,0,1,0|1,0,0]=3 325 B10R1.27 COC(=O)CC1=NC=CN1 AC-61937 [1,0,0,0,1,0|2,0,0]=4 326 B10R1.27 COC(=O)CN1C=CN=C1 AC-39348 [1,0,0,0,1,0|2,0,0]=4 327 B10R1.11 CCOC(=O)C1=CC=CO1 AC-61785 [0,0,0,0,2,0|1,0,0]=3 328 B10R1.11 CCOC(=O)C1=CC=CS1 AC-13562 [0,0,0,0,2,0|1,0,0]=3 329 B10R1.11 CCOC(=O)C1=CC=NO1 AC-95157 [0,0,0,0,2,0|2,0,0]=4 330 B10R1.11 CCOC(=O)C1=CN=CS1 AC-29299 [0,0,0,0,2,0|2,0,0]=4 331 B10R1.11 CCOC(=O)C1=CON=C1 AC-57024 [0,0,0,0,2,0|2,0,0]=4 332 B10R1.11 CCOC(=O)C1=CSC=C1 AC-23556 [0,0,0,0,2,0|1,0,0]=3 333 B10R1.11 CCOC(=O)C1=NC=CN1 AC-29110 [0,0,0,0,2,0|2,0,0]=4 334 B10R1.11 CCOC(=O)C1=NC=CO1 AC-29209 [0,0,0,0,2,0|2,0,0]=4 335 B10R1.11 CCOC(=O)C1=NNC=C1 AC-29253 [0,0,0,0,2,0|2,0,0]=4 336 B14R1.520 CCOC(=O)CCCC1=CC=CC=C1 AC-29228 [0,0,0,0,0,2|0,0,0]=2 337 B14R1.520 CCOC(=O)CNCC1=CC=CC=C1 AC-22881 [0,0,0,0,0,2|0,0,0]=2 338 B14R1.520 CCOC(=O)CNCC1=CC=CC=C1 AC-83717 [0,0,0,0,0,2|0,0,0]=2