0 B13R1.386 CNCC1=CC=C(OC)C(OC)=C1 AC-59470 [0,0,0,0,0,0|1,0,1]=2 1 B13R1.386 COC1=CC=C(CC#N)C=C1OC AC-23374 [0,0,0,0,0,0|1,0,1]=2 2 B12R1.78 CCC1=CC=C(OC)C(OC)=C1 AC-83110 [1,0,0,0,0,0|0,0,1]=2 3 B12R1.78 COC1=C(OC)N=C(C=O)C=C1 AC-81351 [1,0,0,0,0,0|2,0,0]=3 4 B12R1.78 COC1=C(OC)N=C(CN)C=C1 AC-95379 [1,0,0,0,0,0|2,0,0]=3 5 B12R1.78 COC1=CC(C=O)=CN=C1OC AC-80388 [1,0,0,0,0,0|2,0,0]=3 6 B12R1.78 COC1=CC=C(CN)C=C1OC AC-18306 [1,0,0,0,0,0|1,0,0]=2 7 B12R1.78 COC1=CN=C(CO)C=C1OC AC-90574 [1,0,0,0,0,0|2,0,0]=3 8 B12R1.286 CCCC1=CC=C(O)C(OC)=C1 AC-84874 [1,0,0,0,0,0|0,0,2]=3 9 B12R1.286 COC1=CC(CC#N)=CC=C1C AC-79377 [1,0,0,0,0,0|1,0,1]=3 10 B12R1.286 COC1=CC(CC#N)=CC=C1F AC-29473 [1,0,0,0,0,0|2,0,1]=4 11 B12R1.286 COC1=CC(CCN)=CC=C1Br AC-85325 [1,0,0,0,0,0|2,0,1]=4 12 B12R1.286 COC1=CC(CCO)=CC=C1O AC-65687 [1,0,0,0,0,0|1,0,1]=3 13 B12R1.288 CNCC1=CC=C(OC)C(Br)=C1 AC-93150 [1,0,0,0,0,0|2,0,1]=4 14 B12R1.288 COC1=C(C)C=C(CCN)C=N1 AC-76075 [1,0,0,0,0,0|2,0,1]=4 15 B12R1.288 COC1=CC=C(CC#N)C=C1F AC-29472 [1,0,0,0,0,0|2,0,1]=4 16 B14R1.1864 CCC(O)C1=CC=C(OC)C(OC)=C1 AC-87663 [0,1,0,0,0,0|0,0,2]=3 17 B14R1.1864 COC1=CC=C(C(=O)C=O)C=C1OC AC-77329 [0,1,0,0,0,0|1,0,1]=3 18 B14R1.1864 COC1=CC=C(C(=O)CBr)C=C1OC AC-18520 [0,1,0,0,0,0|1,0,2]=4 19 B14R1.1864 COC1=CC=C([C@@H](N)CO)C=C1OC AC-83300 [0,1,0,0,0,0|1,0,1]=3 20 B14R1.3651 COC1=CC=C(CC(=O)O)C=C1OC AC-23370 [0,1,0,0,0,0|1,0,0]=2 21 B14R1.3651 COC1=CC=C(CC(C)=O)C=C1OC AC-14506 [0,1,0,0,0,0|0,0,1]=2 22 B14R2.82 COC1=C(OC)C=C2NC=NC2=C1 AC-18304 [0,0,0,1,0,0|2,0,0]=3 23 B14R2.82 COC1=CC2=C(C=C1OC)NC=C2 AC-19349 [0,0,0,1,0,0|1,0,0]=2 24 B11R1.37 CCC1=CC=C(N)C=C1OC AC-90175 [2,0,0,0,0,0|2,0,0]=4 25 B11R1.37 CNC1=CC=C(F)C=C1OC AC-84319 [2,0,0,0,0,0|2,0,0]=4 26 B11R1.37 CNC1=CC=C(F)C=C1OC AC-95974 [2,0,0,0,0,0|2,0,0]=4 27 B11R1.37 COC1=C(OC)N=CC(N)=C1 AC-89038 [2,0,0,0,0,0|2,0,0]=4 28 B11R1.37 COC1=CC(Br)=CN=C1OC AC-89120 [2,0,0,0,0,0|2,0,0]=4 29 B11R1.37 COC1=CC(C)=CC=C1C=O AC-30282 [2,0,0,0,0,0|2,0,0]=4 30 B11R1.37 COC1=CC(C)=CC=C1CO AC-85644 [2,0,0,0,0,0|2,0,0]=4 31 B11R1.37 COC1=CC(I)=CN=C1OC AC-81400 [2,0,0,0,0,0|2,0,0]=4 32 B11R1.37 COC1=CC=C(C)C=C1C#N AC-30293 [2,0,0,0,0,0|2,0,0]=4 33 B11R1.37 COC1=CC=C(C)C=C1OC AC-19389 [2,0,0,0,0,0|0,0,0]=2 34 B11R1.37 COC1=CC=C(Cl)N=C1OC AC-89113 [2,0,0,0,0,0|2,0,0]=4 35 B11R1.37 COC1=CC=C(F)C=C1OC AC-19342 [2,0,0,0,0,0|1,0,0]=3 36 B11R1.37 COC1=CN=C(N)C=C1OC AC-81824 [2,0,0,0,0,0|2,0,0]=4 37 B11R1.279 CCC1=CC=C(OC)C(I)=C1 AC-87706 [2,0,0,0,0,0|1,0,1]=4 38 B11R1.279 COC1=CC=C(C=O)C=C1I AC-83004 [2,0,0,0,0,0|2,0,0]=4 39 B11R1.279 COC1=CC=C(C=O)C=C1N AC-32282 [2,0,0,0,0,0|2,0,0]=4 40 B11R1.279 COC1=CC=C(C=O)C=C1O AC-16715 [2,0,0,0,0,0|1,0,0]=3 41 B11R1.279 COC1=CC=C(CBr)C=C1Cl AC-80492 [2,0,0,0,0,0|2,0,0]=4 42 B11R1.279 COC1=CC=C(CN)C=C1Cl AC-26027 [2,0,0,0,0,0|2,0,0]=4 43 B11R1.279 COC1=CC=C(CN)C=C1Cl AC-76962 [2,0,0,0,0,0|2,0,0]=4 44 B11R1.279 COC1=CC=C(CO)C=C1Br AC-25140 [2,0,0,0,0,0|2,0,0]=4 45 B11R1.279 COC1=CC=C(CO)C=C1I AC-90285 [2,0,0,0,0,0|2,0,0]=4 46 B11R1.279 COC1=CC=C(CO)C=C1O AC-38483 [2,0,0,0,0,0|1,0,0]=3 47 B11R1.279 COC1=CC=C(OC)C(O)=C1 AC-80376 [2,0,0,0,0,0|1,0,1]=4 48 B11R1.280 C=CC1=CC=C(F)C(OC)=C1 AC-86265 [2,0,0,0,0,0|1,0,0]=3 49 B11R1.280 C=CC1=CC=C(O)C(OC)=C1 AC-61278 [2,0,0,0,0,0|0,0,0]=2 50 B11R1.280 CCC1=CC=C(Br)C(OC)=C1 AC-96775 [2,0,0,0,0,0|1,0,1]=4 51 B11R1.280 CCC1=CC=C(F)C(OC)=C1 AC-90163 [2,0,0,0,0,0|1,0,1]=4 52 B11R1.280 COC1=CC(C=O)=CC=C1C AC-10435 [2,0,0,0,0,0|1,0,0]=3 53 B11R1.280 COC1=CC(CBr)=CC=C1Br AC-82463 [2,0,0,0,0,0|2,0,0]=4 54 B11R1.280 COC1=CC(CBr)=CC=C1Cl AC-93340 [2,0,0,0,0,0|2,0,0]=4 55 B11R1.280 COC1=CC(CBr)=CC=C1F AC-94063 [2,0,0,0,0,0|2,0,0]=4 56 B11R1.280 COC1=CC(CCl)=CC=C1I AC-96674 [2,0,0,0,0,0|2,0,0]=4 57 B11R1.280 COC1=CC(CN)=CC=C1C AC-75481 [2,0,0,0,0,0|1,0,0]=3 58 B11R1.280 COC1=CC(CN)=CC=C1Cl AC-26028 [2,0,0,0,0,0|2,0,0]=4 59 B11R1.280 COC1=CC(CN)=CC=C1Cl AC-85150 [2,0,0,0,0,0|2,0,0]=4 60 B11R1.280 COC1=CC(CN)=CC=C1O AC-15347 [2,0,0,0,0,0|1,0,0]=3 61 B11R1.280 COC1=CC(CO)=CC=C1F AC-29478 [2,0,0,0,0,0|2,0,0]=4 62 B11R1.280 COC1=CC(CO)=CC=C1O AC-65534 [2,0,0,0,0,0|1,0,0]=3 63 B11R1.189 CNCC1=CC=CC(OC)=C1 AC-56041 [2,0,0,0,0,0|1,0,1]=4 64 B11R1.189 COC1=CC(CCN)=CC=C1 AC-38532 [2,0,0,0,0,0|1,0,1]=4 65 B11R1.189 COC1=CC(CNN)=CC=C1 AC-88440 [2,0,0,0,0,0|2,0,0]=4 66 B11R1.192 NCCC1=CC=C(O)C(O)=C1 AC-38337 [2,0,0,0,0,0|1,0,1]=4 67 B11R1.192 OCCC1=CC=C(O)C(O)=C1 AC-28202 [2,0,0,0,0,0|1,0,1]=4 68 B11R1.83 COC1=CC=C(CCO)C=C1 AC-85291 [2,0,0,0,0,0|1,0,1]=4 69 B11R1.83 COC1=CC=C(CNN)C=C1 AC-55737 [2,0,0,0,0,0|2,0,0]=4 70 B11R1.83 COC1=CC=C(CNN)C=C1 AC-77138 [2,0,0,0,0,0|2,0,0]=4 71 B11R1.83 COC1=CC=C(CON)C=C1 AC-81030 [2,0,0,0,0,0|2,0,0]=4 72 B11R1.83 C\C=C\C1=CC=C(OC)C=C1 AC-77032 [2,0,0,0,0,0|0,0,2]=4 73 B13R1.355 CCOC1=CC(C#N)=CC=C1OC AC-73884 [1,1,0,0,0,0|1,0,1]=4 74 B13R1.434 COC1=C(OC)C(I)=CC(C=O)=C1 AC-23353 [1,1,0,0,0,0|1,0,0]=3 75 B13R1.434 COC1=CC(C=O)=CC(O)=C1OC AC-28268 [1,1,0,0,0,0|1,0,0]=3 76 B13R1.1249 CCOC1=CC=C(CC)C=C1OC AC-86124 [1,1,0,0,0,0|0,0,1]=3 77 B13R1.2200 COC1=C(OC)C=C(C=O)C(F)=C1 AC-18307 [1,1,0,0,0,0|1,0,0]=3 78 B13R1.2200 COC1=C(OC)C=C(C=O)C(I)=C1 AC-84785 [1,1,0,0,0,0|1,0,0]=3 79 B13R1.2200 COC1=C(OC)C=C(CO)C(Br)=C1 AC-93735 [1,1,0,0,0,0|1,0,0]=3 80 B13R1.2200 COC1=CC(Br)=C(C=O)C=C1OC AC-21774 [1,1,0,0,0,0|1,0,0]=3 81 B13R1.2422 CCC1=CC=C(OC)C(OC)=C1F AC-96108 [1,1,0,0,0,0|0,0,1]=3 82 B13R1.3091 CCC1=CC=C(C(=O)O)C=C1OC AC-86332 [1,1,0,0,0,0|2,0,0]=4 83 B13R1.3091 COC1=CC=C(C(=O)O)C=C1OC AC-11299 [1,1,0,0,0,0|1,0,0]=3 84 B13R1.3091 COC1=CC=C(C(C)O)C=C1OC AC-38308 [1,1,0,0,0,0|0,0,1]=3 85 B13R1.52 COC1=CC(CC(=O)O)=CC=C1F AC-29470 [1,1,0,0,0,0|2,0,0]=4 86 B13R1.4030 COC1=C(O)C(O)=CC(CCN)=C1 AC-96302 [1,1,0,0,0,0|1,0,1]=4 87 B13R1.2901 COC1=C(O)C=C(CCN)C(O)=C1 AC-90351 [1,1,0,0,0,0|1,0,1]=4 88 B15R1.3769 CCC(=O)CC1=CC=C(OC)C(OC)=C1 AC-90436 [0,2,0,0,0,0|0,0,1]=3 89 B15R1.3769 COC(=O)CC1=CC=C(OC)C(OC)=C1 AC-77257 [0,2,0,0,0,0|0,0,1]=3 90 B15R1.38111 COC1=C(OC)C=C(CCCO)C(O)=C1 AC-96730 [0,2,0,0,0,0|0,0,2]=4 91 B15R1.3705 CNCC1=CC(OC)=C(OC)C(OC)=C1 AC-58939 [0,2,0,0,0,0|1,0,1]=4 92 B15R1.3705 COC1=CC(CC#N)=CC(OC)=C1OC AC-12681 [0,2,0,0,0,0|1,0,1]=4 93 B15R1.9548 CCOC1=CC=C(CC(=O)O)C=C1OC AC-28753 [0,2,0,0,0,0|1,0,0]=3 94 B13R2.57 ClCC1=CC=C2OCCOC2=C1 AC-82281 [1,0,0,1,0,0|1,0,0]=3 95 B13R2.57 N#CC1=CC=C2OCCOC2=C1 AC-76168 [1,0,0,1,0,0|1,0,1]=4 96 B13R2.57 NCC1=CC=C2OCCNC2=C1 AC-93644 [1,0,0,1,0,0|2,0,0]=4 97 B13R2.57 O=CC1=CC2=C(C=N1)OCCO2 AC-89448 [1,0,0,1,0,0|2,0,0]=4 98 B13R2.57 O=CC1=CC=C2OCCOC2=C1 AC-16028 [1,0,0,1,0,0|1,0,0]=3 99 B13R2.57 OCC1=CC=C2OCCOC2=C1 AC-75415 [1,0,0,1,0,0|1,0,0]=3 100 B13R2.599 COC1=CC2=C(C=CN2)C=C1C AC-81799 [1,0,0,1,0,0|1,0,0]=3 101 B13R2.599 COC1=CC2=C(C=NN2)C=C1O AC-95020 [1,0,0,1,0,0|2,0,0]=4 102 B13R2.84 COC1=C(C)C2=C(C=C1)NC=C2 AC-95084 [1,0,0,1,0,0|1,0,0]=3 103 B13R2.84 COC1=C(F)C2=C(C=C1)NC=C2 AC-89162 [1,0,0,1,0,0|2,0,0]=4 104 B15R2.117 COC1=C(OC)C=C2C=CC=CC2=C1 AC-81551 [0,1,0,1,0,0|0,0,1]=3 105 B15R2.117 COC1=C(OC)C=C2C=NC=CC2=C1 AC-28274 [0,1,0,1,0,0|0,0,1]=3 106 B15R2.117 COC1=CC2=C(C=C1OC)CCN=C2 AC-28260 [0,1,0,1,0,0|0,0,1]=3 107 B15R2.117 COC1=CC2=C(C=C1OC)CCN=C2 AC-28261 [0,1,0,1,0,0|0,0,1]=3 108 B15R2.117 COC1=CC2=C(C=C1OC)CNCC2 AC-80650 [0,1,0,1,0,0|0,0,2]=4 109 B15R2.3136 COC1=C(OC)C2=C(C=C1)CNC2=O AC-89568 [0,1,0,1,0,0|1,0,0]=3 110 B15R2.21574 COC1=CC2=C(C=C1OC)C(=O)CC2 AC-11747 [0,1,0,1,0,0|0,0,1]=3 111 B15R2.31888 COC1=CC=C(CC2CC2)C=C1OC AC-96109 [0,1,0,1,0,0|0,0,2]=4 112 B15R2.2035 COC1=C(OC)C=C2NC(C)=NC2=C1 AC-94044 [0,1,0,1,0,0|1,0,1]=4