0 B14R1.15069 CCOC1=C(C=C(C(=C1)C=O)Br)OC Z53852787 [0,0,0,0,0,0|4,0,0]=4 1 B14R1.15069 CNCC1=C(C=C(C(=C1)OC)C)OC Z5102256186 [0,0,0,0,0,0|3,0,0]=3 2 B13R1.355 CNCC1=C(C=CC(=C1)OC)OC Z1263820454 [1,0,0,0,0,0|2,0,0]=3 3 B13R1.355 COC1=CC(=C(C=C1)OC)/C=N/O Z49568346 [1,0,0,0,0,0|2,0,1]=4 4 B13R1.2200 COC1=C(C=C(C(=C1)Br)C=O)OC Z53852786 [1,0,0,0,0,0|3,0,0]=4 5 B13R1.2200 COC1=C(C=C(C(=C1)Br)CN)OC Z1222278702 [1,0,0,0,0,0|3,0,0]=4 6 B13R1.2200 COC1=CC(=C(C=C1C=O)OC)Br Z57888149 [1,0,0,0,0,0|1,0,1]=3 7 B13R1.2200 COC1=CC(=C(C=C1C=O)OC)C Z1198159973 [1,0,0,0,0,0|2,0,1]=4 8 B13R1.2200 COC1=CC(=C(C=C1CCl)OC)Br Z57041988 [1,0,0,0,0,0|1,0,0]=2 9 B13R1.2200 COC1=CC(=C(C=C1CN)OC)C Z5143427122 [1,0,0,0,0,0|1,0,0]=2 10 B13R1.2200 COC1=CC(=C(C=C1OC)OC)I Z1269212576 [1,0,0,0,0,0|1,1,0]=3 11 B13R1.2200 COC1=CC(=C(C=C1OC)OC)N Z406520390 [1,0,0,0,0,0|2,0,0]=3 12 B15R1.1788 COC1=CC(=C(C=C1CC(=O)O)OC)Br Z1509582713 [0,1,0,0,0,0|1,0,1]=3 13 B15R1.27356 C=CCC1=C(C=C(C(=C1)OC)OC)OC Z3178023286 [0,1,0,0,0,0|2,0,1]=4 14 B15R1.27356 CNCC1=C(C=C(C(=C1)OC)OC)OC Z2736561843 [0,1,0,0,0,0|3,0,0]=4 15 B15R1.27356 COC1=CC(=C(C=C1OC)OC)CCN Z5208872384 [0,1,0,0,0,0|1,0,0]=2 16 B15R2.2039 COC1=C(C=C2C(=O)NCCC2=C1)Cl Z1416159511 [0,0,0,1,0,0|2,1,0]=4 17 B15R2.2215 C=CCC1=C(C=C2OCOC2=C1)OC Z2182005509 [0,0,0,1,0,0|2,0,1]=4 18 B12R1.78 CCC1=C(C=CC(=C1)C=O)OC Z1201623458 [2,0,0,0,0,0|2,0,0]=4 19 B12R1.78 CCC1=C(C=CC(=C1)OC)C=O Z1222423530 [2,0,0,0,0,0|2,0,0]=4 20 B12R1.78 CCC1=C(C=CC(=C1)OC)CN Z4182788171 [2,0,0,0,0,0|2,0,0]=4 21 B12R1.78 CNC1=C(C=C(C=C1)OC)OC Z335256774 [2,0,0,0,0,0|2,0,0]=4 22 B12R1.78 CNC1=C(C=CC(=C1)OC)OC Z335266076 [2,0,0,0,0,0|1,0,0]=3 23 B12R1.78 CNC1=CC(=C(C=C1)OC)OC Z1259341013 [2,0,0,0,0,0|2,0,0]=4 24 B12R1.78 COC1=CC(=C(C=C1)OC)C#N Z56995180 [2,0,0,0,0,0|0,0,2]=4 25 B12R1.78 COC1=CC(=C(C=C1)OC)CBr Z96091884 [2,0,0,0,0,0|1,0,0]=3 26 B12R1.78 COC1=CC(=C(C=C1)OC)CN Z285139178 [2,0,0,0,0,0|0,0,0]=2 27 B12R1.78 COC1=CC(=C(C=C1)OC)CO Z104509944 [2,0,0,0,0,0|1,0,0]=3 28 B12R1.78 COC1=NC(=C(C=C1)OC)CN Z5467393345 [2,0,0,0,0,0|1,0,0]=3 29 B12R1.268 CCNC1=C(C=CC(=C1)C)OC Z3892824844 [2,0,0,0,0,0|2,0,0]=4 30 B12R1.268 CNCC1=C(C=CC(=C1)C)OC Z94598686 [2,0,0,0,0,0|2,0,0]=4 31 B12R1.268 COC1=C(C=C(C=C1)Br)CCN Z1682072470 [2,0,0,0,0,0|1,0,0]=3 32 B12R1.268 COC1=C(C=C(C=C1)C)CC#N Z94597857 [2,0,0,0,0,0|0,0,2]=4 33 B12R1.268 COC1=C(C=C(C=C1)C)CCN Z96092050 [2,0,0,0,0,0|0,0,0]=2 34 B12R1.268 COC1=C(C=C(C=C1)Cl)CCN Z1267773768 [2,0,0,0,0,0|1,0,0]=3 35 B12R1.268 COC1=C(C=C(C=C1)F)CCN Z2805877171 [2,0,0,0,0,0|1,0,0]=3 36 B12R1.268 CSC1=C(C=C(C=C1)Br)CCN Z2857139707 [2,0,0,0,0,0|1,1,0]=4 37 B12R1.270 C=CCC1=C(C=CC(=C1)OC)O Z57046211 [2,0,0,0,0,0|1,0,1]=4 38 B12R1.448 COC1=C(C=C(C(=C1)Br)Br)OC Z57463255 [2,0,0,0,0,0|2,0,0]=4 39 B12R1.448 COC1=C(C=C(C(=C1)Br)I)OC Z1269199489 [2,0,0,0,0,0|2,0,0]=4 40 B12R1.448 COC1=C(C=C(C(=C1)C)Br)OC Z442350448 [2,0,0,0,0,0|1,0,0]=3 41 B12R1.448 COC1=C(C=C(C(=C1)C)N)OC Z56895725 [2,0,0,0,0,0|2,0,0]=4 42 B12R1.448 COC1=C(C=C(C(=C1)I)Cl)CN Z1973465439 [2,0,0,0,0,0|1,1,0]=4 43 B12R1.448 COC1=C(C=C(C(=C1)N)Br)OC Z361598886 [2,0,0,0,0,0|2,0,0]=4 44 B12R1.448 COC1=C(C=C(C(=C1)O)F)OC Z1251415019 [2,0,0,0,0,0|1,1,0]=4 45 B12R1.449 CCC1=C(C=C(C(=C1)OC)N)C Z2065635599 [2,0,0,0,0,0|1,0,0]=3 46 B12R1.449 COC1=C(C=C(C(=C1)CN)F)Br Z5385134673 [2,0,0,0,0,0|1,0,0]=3 47 B12R1.449 COC1=CC(=C(C=C1Br)N)OC Z1147474006 [2,0,0,0,0,0|2,0,0]=4 48 B12R1.450 COC1=CC(=C(C=C1Br)OC)Br Z1269241582 [2,0,0,0,0,0|1,0,0]=3 49 B12R1.450 COC1=CC(=C(C=C1Br)OC)C Z1269124531 [2,0,0,0,0,0|0,0,0]=2 50 B12R1.450 COC1=CC(=C(C=C1Br)OC)N Z1416179328 [2,0,0,0,0,0|0,0,0]=2 51 B12R1.450 COC1=CC(=C(C=C1I)OC)C Z1269205185 [2,0,0,0,0,0|0,1,0]=3 52 B12R1.450 COC1=CC(=C(C=C1I)OC)Cl Z1269177045 [2,0,0,0,0,0|1,1,0]=4 53 B12R1.112 COC1=C(C=CC(=C1)Br)CCN Z1551924124 [2,0,0,0,0,0|0,0,0]=2 54 B12R1.112 COC1=C(C=CC(=C1)F)CCN Z5577629908 [2,0,0,0,0,0|0,1,0]=3 55 B12R1.286 COC1=C(C=CC(=C1)CCN)C Z1198167712 [2,0,0,0,0,0|1,0,0]=3 56 B12R1.286 COC1=C(C=CC(=C1)CCN)O Z1268152336 [2,0,0,0,0,0|1,0,0]=3 57 B14R1.2315 COC1=CC(=C(C=C1)OC)C(=O)CCl Z56346966 [1,1,0,0,0,0|1,0,1]=4 58 B14R1.2315 COC1=CC(=C(C=C1)OC)C(O)CN Z330910894 [1,1,0,0,0,0|0,0,0]=2 59 B14R1.2315 COC1=CC(=C(C=C1)OC)C(O)CO Z1139750982 [1,1,0,0,0,0|1,0,0]=3 60 B14R1.3723 COC1=CC(=C(C=C1)OC)CC(=O)O Z104495790 [1,1,0,0,0,0|1,0,1]=4 61 B14R1.2282 COC1=CC(=C(C=C1C#N)OC)OC Z57900336 [1,1,0,0,0,0|2,0,0]=4 62 B14R1.2282 COC1=CC(=C(C=C1C=O)OC)OC Z104477478 [1,1,0,0,0,0|2,0,0]=4 63 B14R1.2282 COC1=CC(=C(C=C1OC)OC)CO Z90122579 [1,1,0,0,0,0|2,0,0]=4 64 B14R1.2288 COC1=CC(=C(C=C1C(=O)C)OC)Br Z1269120149 [1,1,0,0,0,0|0,0,1]=3 65 B14R1.2288 COC1=CC(=C(C=C1C(=O)C)OC)O Z1413438403 [1,1,0,0,0,0|1,0,1]=4 66 B14R1.2288 COC1=CC(=C(C=C1C(=O)O)OC)Br Z1269197259 [1,1,0,0,0,0|1,0,1]=4 67 B14R1.14946 CNCC1=C(C=C(C(=C1)OC)OC)Br Z2734776517 [1,1,0,0,0,0|2,0,0]=4 68 B14R1.14946 COC1=C(C=C(C(=C1)Br)CCN)OC Z3224147572 [1,1,0,0,0,0|2,0,0]=4 69 B16R1.20087 COC(=O)CC1=C(C=C(C(=C1)OC)Br)OC Z2755967217 [0,2,0,0,0,0|1,0,1]=4 70 B16R1.25767 COC1=CC(=C(C=C1C(=O)O)OC)CCN Z4967497918 [0,2,0,0,0,0|1,0,0]=3 71 B14R2.1747 COC1=C2CCCC2=C(C=C1)OC Z1255448313 [1,0,0,1,0,0|1,0,0]=3 72 B14R2.1801 COC1=CC2=C(C=C1)C(NCC2)C Z3018393762 [1,0,0,1,0,0|1,0,0]=3 73 B14R2.1801 COC1=CC2=C(C=C1)N(CCC2)C Z197223766 [1,0,0,1,0,0|2,0,0]=4 74 B14R2.2400 COC1=CC2=C(C=C1)CCNCC2 Z425387736 [1,0,0,1,0,0|1,0,0]=3 75 B14R2.2400 COC1=CC2=C(C=C1)NCCCC2 Z1255490316 [1,0,0,1,0,0|2,0,0]=4 76 B14R2.3519 COC1=CC(=C(C=C1)OC)C2CO2 Z278165250 [1,0,0,1,0,0|1,0,0]=3 77 B14R2.1128 COC1=C(C=C2CCCCC2=C1)O Z3241899355 [1,0,0,1,0,0|2,0,0]=4 78 B14R2.1128 COC1=C(C=C2CCNCC2=C1)Cl Z4528212721 [1,0,0,1,0,0|1,1,0]=4 79 B14R2.1128 COC1=C(C=C2CCNCC2=C1)F Z4593255272 [1,0,0,1,0,0|1,1,0]=4 80 B14R2.1128 COC1=C(C=C2CNCCC2=C1)Br Z1416170073 [1,0,0,1,0,0|2,0,0]=4 81 B14R2.1416 COC1=C(C=C2C(=O)CCC2=C1)Br Z1269221410 [1,0,0,1,0,0|2,0,0]=4 82 B14R2.2167 COC1=C(C=C2CCC(C2=C1)N)F Z2010010257 [1,0,0,1,0,0|1,1,0]=4 83 B14R2.28472 CC1NCCC2=C1C=C(C(=C2)O)O Z235344915 [1,0,0,1,0,0|2,0,0]=4 84 B16R2.1935 COC1=C(C=C2C(=C1)CCNC2C)OC Z57157098 [0,1,0,1,0,0|2,0,0]=4 85 B16R2.36189 COC1=C(C=C2CCNCCC2=C1)OC Z414834388 [0,1,0,1,0,0|2,0,0]=4 86 B16R2.37423 COC1=C2CCCC2=C(C(=C1)C=O)OC Z1509501432 [0,1,0,1,0,0|2,0,0]=4 87 B14R1.5210 COC1=C(C(=C(C=C1)CCN)OC)Br Z4663978865 [0,0,0,0,1,1|0,0,0]=2