0 B13R1.386 COC1=C(OC)C=C(CC#N)C=C1 1567312 [0,0,0,0,0,0|1,0,1]=2 1 B13R1.386 COC1=C(OC)C=C(CCN)C=C1 1038636 [0,0,0,0,0,0|1,0,1]=2 2 B13R1.386 COC1=CC=C(N=C=O)C=C1OC 1055596 [0,0,0,0,0,0|2,0,1]=3 3 B12R1.78 CCC1=C(OC)C=CC(OC)=C1 5980440 [1,0,0,0,0,0|2,0,1]=4 4 B12R1.78 CNC1=CC(OC)=C(OC)C=C1 1367347 [1,0,0,0,0,0|1,0,1]=3 5 B12R1.78 COC1=C(OC)C=C(C=O)C=C1 1180632 [1,0,0,0,0,0|1,0,0]=2 6 B12R1.78 COC1=C(OC)C=C(CO)C=C1 1780297 [1,0,0,0,0,0|1,0,0]=2 7 B12R1.78 COC1=C(OC)C=C(CS)C=C1 1974792 [1,0,0,0,0,0|1,0,0]=2 8 B12R1.78 COC1=CC(OC)=C(OC)C=C1 8563103 [1,0,0,0,0,0|1,0,1]=3 9 B12R1.78 COC1=CC=C(C#N)C=C1OC 1284733 [1,0,0,0,0,0|1,0,1]=3 10 B12R1.286 COC1=C(O)C=CC(\C=N\O)=C1 7020542821 [1,0,0,0,0,0|2,0,1]=4 11 B12R1.288 COC1=C(F)C=C(CCO)C=C1 1780413 [1,0,0,0,0,0|2,0,1]=4 12 B14R1.793 COC1=C(OC)C=C(NCCN)C=C1 1142662 [0,1,0,0,0,0|1,0,1]=3 13 B14R1.1864 CCC(=O)C1=CC=C(OC)C(OC)=C1 1043831 [0,1,0,0,0,0|0,0,3]=4 14 B14R1.1864 COC1=C(OC)C=C(C(=O)CBr)C=C1 7119984401 [0,1,0,0,0,0|1,0,2]=4 15 B14R1.1864 COC1=C(OC)C=C(C(=O)CI)C=C1 11186060 [0,1,0,0,0,0|1,0,2]=4 16 B14R1.1864 COC1=C(OC)C=C(C(O)CN)C=C1 1055879 [0,1,0,0,0,0|1,0,1]=3 17 B14R1.3237 COC1=C(OC)C(Br)=CC(\C=N\O)=C1 7018822409 [0,1,0,0,0,0|2,0,1]=4 18 B14R1.3651 COC1=C(OC)C=C(CC(N)=O)C=C1 1976032 [0,1,0,0,0,0|1,0,0]=2 19 B14R1.3651 COC1=CC=C(CC(=O)O)C=C1OC 7020330571 [0,1,0,0,0,0|1,0,0]=2 20 B14R1.10285 COC1=C(OC)C(C)=C(CCN)C=C1 3683807 [0,1,0,0,0,0|1,0,1]=3 21 B14R1.14946 COC1=C(OC)C=C(CC#N)C(C)=C1 4196244 [0,1,0,0,0,0|1,0,1]=3 22 B14R1.14946 COC1=C(OC)C=C(CC#N)C(N)=C1 3682334 [0,1,0,0,0,0|1,0,1]=3 23 B14R1.14946 COC1=C(OC)C=C(CCN)C(C)=C1 4249162 [0,1,0,0,0,0|1,0,1]=3 24 B14R2.82 COC1=C(OC)C=C2NC=NC2=C1 7020542486 [0,0,0,1,0,0|2,0,0]=3 25 B14R2.82 COC1=CC2=C(C=C1OC)NCC2 3356402 [0,0,0,1,0,0|1,0,1]=3 26 B14R2.112 NCCC1=CC=C2OCCOC2=C1 1038637 [0,0,0,1,0,0|1,0,1]=3 27 B14R2.112 O=C=NC1=CC2=C(C=C1)OCCO2 1055605 [0,0,0,1,0,0|2,0,1]=4 28 B14R2.112 OCCC1=CC2=C(C=C1)OCCO2 1204403 [0,0,0,1,0,0|1,0,1]=3 29 B11R1.37 COC1=C(OC)C=C(C)C=C1 2829352 [2,0,0,0,0,0|0,0,0]=2 30 B11R1.37 COC1=C(OC)C=C(N)C=C1 2829550 [2,0,0,0,0,0|1,0,0]=3 31 B11R1.37 COC1=C(OC)C=C(O)C=C1 3474805 [2,0,0,0,0,0|1,0,0]=3 32 B11R1.279 COC1=C(Br)C=C(C=O)C=C1 0125160184 [2,0,0,0,0,0|2,0,0]=4 33 B11R1.279 COC1=C(F)C=C(C=O)C=C1 2829712 [2,0,0,0,0,0|2,0,0]=4 34 B11R1.279 COC1=C(F)C=C(CCl)C=C1 1780880 [2,0,0,0,0,0|2,0,0]=4 35 B11R1.279 COC1=C(O)C=C(C=O)C=C1 7020680791 [2,0,0,0,0,0|1,0,0]=3 36 B11R1.280 CCC1=C(C)C=CC(C=O)=C1 6641589 [2,0,0,0,0,0|2,0,0]=4 37 B11R1.280 COC1=CC(C=O)=CC=C1O 0109160039 [2,0,0,0,0,0|1,0,0]=3 38 B11R1.189 CNCC1=CC(OC)=CC=C1 1268217 [2,0,0,0,0,0|1,0,1]=4 39 B11R1.189 COC1=CC=CC(CC#N)=C1 1287078 [2,0,0,0,0,0|1,0,1]=4 40 B11R1.192 N#CCC1=CC(O)=C(O)C=C1 3353953 [2,0,0,0,0,0|1,0,1]=4 41 B11R1.83 COC1=CC=C(CC#N)C=C1 1779154 [2,0,0,0,0,0|1,0,1]=4 42 B11R1.83 COC1=CC=C(CCCl)C=C1 1277181 [2,0,0,0,0,0|1,0,1]=4 43 B11R1.83 COC1=CC=C(CCN)C=C1 1038628 [2,0,0,0,0,0|1,0,1]=4 44 B13R1.434 COC1=C(OC)C(Br)=CC(C#N)=C1 7018930019 [1,1,0,0,0,0|1,0,1]=4 45 B13R1.434 COC1=CC(C=O)=CC(Br)=C1OC 7014713410 [1,1,0,0,0,0|1,0,0]=3 46 B13R1.434 COC1=CC(C=O)=CC(Cl)=C1OC 7018910893 [1,1,0,0,0,0|1,0,0]=3 47 B13R1.1249 CCOC1=C(OC)C=C(C#N)C=C1 7020671319 [1,1,0,0,0,0|1,0,1]=4 48 B13R1.1249 CCOC1=C(OC)C=C(C=O)C=C1 7020401731 [1,1,0,0,0,0|1,0,0]=3 49 B13R1.1249 CCOC1=C(OC)C=C(CN)C=C1 7020330612 [1,1,0,0,0,0|1,0,0]=3 50 B13R1.2200 COC1=C(OC)C=C(C=O)C(C)=C1 2704573 [1,1,0,0,0,0|1,0,0]=3 51 B13R1.2422 COC1=C(OC)C(C)=C(C=O)C=C1 12481892 [1,1,0,0,0,0|1,0,0]=3 52 B13R1.3091 COC1=C(OC)C=C(C(=O)O)C=C1 1782097 [1,1,0,0,0,0|1,0,0]=3 53 B13R1.3091 COC1=C(OC)C=C(C(N)=S)C=C1 7020331332 [1,1,0,0,0,0|1,0,0]=3 54 B13R1.3091 COC1=CC=C(C(C)=O)C=C1OC 1043812 [1,1,0,0,0,0|0,0,1]=3 55 B13R1.3091 COC1=CC=C(C(C)N)C=C1OC 7115240034 [1,1,0,0,0,0|0,0,1]=3 56 B13R1.575 COC1=CC(\C=C\C#N)=CC=C1O 7016234004 [1,1,0,0,0,0|0,0,2]=4 57 B13R1.35 COC1=C(Br)C=C(CC(=O)O)C=C1 1000021 [1,1,0,0,0,0|2,0,0]=4 58 B13R1.3088 C=CC(=O)C1=CC(Cl)=C(OC)C=C1 3519405 [1,1,0,0,0,0|1,0,1]=4 59 B15R1.815 CCCC(=O)C1=CC(OC)=C(OC)C=C1 1312986 [0,2,0,0,0,0|0,0,2]=4 60 B15R1.815 CCCC(O)C1=CC(OC)=C(OC)C=C1 1371119 [0,2,0,0,0,0|0,0,2]=4 61 B15R1.815 CNCC(O)C1=CC(OC)=C(OC)C=C1 1055907 [0,2,0,0,0,0|0,0,2]=4 62 B15R1.815 COC1=C(OC)C=C(C(=O)CCCl)C=C1 1312989 [0,2,0,0,0,0|1,0,1]=4 63 B15R1.815 COC1=CC=C(C(=O)CC#N)C=C1OC 1559502 [0,2,0,0,0,0|1,0,1]=4 64 B15R1.1195 COC1=C(OC)C=C(CCCCN)C=C1 1038758 [0,2,0,0,0,0|0,0,2]=4 65 B15R1.1195 COC1=C(OC)C=C(CCNC=O)C=C1 13514593 [0,2,0,0,0,0|0,0,1]=3 66 B15R1.3769 CCC(=O)CC1=CC(OC)=C(OC)C=C1 1370698 [0,2,0,0,0,0|0,0,1]=3 67 B15R1.3769 COC1=C(OC)C=C(NC(=O)CCl)C=C1 7012702131 [0,2,0,0,0,0|1,0,1]=4 68 B15R1.3769 COC1=C(OC)C=C(NC(=O)CN)C=C1 15075355 [0,2,0,0,0,0|1,0,1]=4 69 B15R1.12854 COC1=CC=C(\C=C\C(=O)O)C=C1OC 0107620014 [0,2,0,0,0,0|0,0,1]=3 70 B15R1.12853 COC1=CC=C(C(N)C(C)C)C=C1OC 7138680 [0,2,0,0,0,0|0,0,2]=4 71 B15R1.16219 COC1=C(OC)C=C(C(C)(C)C#N)C=C1 1977304 [0,2,0,0,0,0|1,0,1]=4 72 B15R1.16219 COC1=C(OC)C=C(C(C)(C)CN)C=C1 1033194 [0,2,0,0,0,0|1,0,1]=4 73 B15R1.1799 COC1=C(OC)C=C(CC(=O)O)C(C)=C1 4251017 [0,2,0,0,0,0|1,0,0]=3 74 B15R1.9641 CCOC1=C(OCC)C=C(CCN)C=C1 7020400498 [0,2,0,0,0,0|1,0,1]=4 75 B13R2.57 NNC1=CC2=C(C=C1)OCCO2 1367291 [1,0,0,1,0,0|2,0,0]=4 76 B13R2.57 O=CC1=CC=C2OCCOC2=C1 7015151001 [1,0,0,1,0,0|1,0,0]=3 77 B13R2.449 CNCC1=CC2=C(C=C1)OCO2 7020694245 [1,0,0,1,0,0|1,0,1]=4 78 B13R2.449 NCCC1=CC=C2OCOC2=C1 7020694268 [1,0,0,1,0,0|1,0,1]=4 79 B15R2.117 COC1=C(OC)C=C2CNCCC2=C1 3155563 [0,1,0,1,0,0|0,0,2]=4 80 B15R2.117 COC1=C(OC)C=C2CNCCC2=C1 7020694051 [0,1,0,1,0,0|0,0,2]=4 81 B15R2.117 COC1=C(OC)C=C2OCCNC2=C1 2205677 [0,1,0,1,0,0|1,0,1]=4 82 B15R2.352 CCNCC1=CC=C2OCCOC2=C1 1368917 [0,1,0,1,0,0|0,0,2]=4 83 B15R2.2115 COC1=CC=C2NCCCC2=C1OC 2049434 [0,1,0,1,0,0|0,0,2]=4 84 B15R2.21574 COC1=C(OC)C=C2C(=C1)CCC2N 12486972 [0,1,0,1,0,0|0,0,2]=4 85 B15R2.1601 NCC(O)C1=CC2=C(C=C1)OCCO2 1055880 [0,1,0,1,0,0|1,0,1]=4 86 B15R2.1668 O=C(O)CC1=CC=C2OCCOC2=C1 7119860206 [0,1,0,1,0,0|1,0,0]=3 87 B15R2.2035 COC1=CC2=C(C=C1OC)NC(=O)C2 1368914 [0,1,0,1,0,0|1,0,0]=3 88 B15R3.4266 C1=NC2=CC3=C(C=C2N1)OCCO3 1088552 [0,0,0,2,0,0|2,0,0]=4