0 B12R1.8 CCCCCCC1=CC=NC=C1 3H32-1-HV [0,0,0,0,0,0|2,0,0]=2 1 B12R1.8 CCCCCNC1=CC=CC=C1 3631-1-0R [0,0,0,0,0,0|2,0,0]=2 2 B12R1.8 CCCCNCC1=CC=CC=C1 3731-1-X5 [0,0,0,0,0,0|2,0,0]=2 3 B12R1.8 CNCCNCC1=CC=CC=C1 3631-1-0Y [0,0,0,0,0,0|3,0,0]=3 4 B12R1.8 COCCNCC1=CC=CC=C1 4656-1-9W [0,0,0,0,0,0|3,0,0]=3 5 B12R1.8 ClCCCSCC1=CC=CC=C1 5666-5-0C [0,0,0,0,0,0|2,0,0]=2 6 B12R1.8 FCCCSCC1=CC=CC=C1 5666-3-1A [0,0,0,0,0,0|2,0,0]=2 7 B12R1.8 N#CCCNCC1=CC=NC=C1 3H37-1-V7 [0,0,0,0,0,0|3,0,1]=4 8 B12R1.8 N#CCCOCC1=CC=CC=C1 4637-1-21 [0,0,0,0,0,0|2,0,1]=3 9 B12R1.8 NCCCCOC1=CC=CC=C1 4656-1-9Z [0,0,0,0,0,0|2,0,0]=2 10 B12R1.8 NCCCNCC1=CC=CC=C1 3731-1-02 [0,0,0,0,0,0|2,0,0]=2 11 B12R1.8 NCCCOCC1=CC=CC=C1 4H56-1-06S [0,0,0,0,0,0|2,0,0]=2 12 B12R1.8 OCCCC#CC1=CC=CC=C1 2601-1-0Q [0,0,0,0,0,0|0,0,2]=2 13 B12R1.8 OCCCNCC1=CC=CC=C1 4631-1-0F [0,0,0,0,0,0|1,0,0]=1 14 B12R1.8 OCCCOCC1=CC=CC=C1 2707-1-01 [0,0,0,0,0,0|1,0,0]=1 15 B11R1.28 BrCCOCC1=CC=CC=C1 2607-9-0K [1,0,0,0,0,0|2,0,0]=3 16 B11R1.28 BrCCSCC1=CC=CC=C1 5666-9-00 [1,0,0,0,0,0|2,0,0]=3 17 B11R1.28 C=CCNCC1=CC=CC=C1 3631-1-0A [1,0,0,0,0,0|1,0,2]=4 18 B11R1.28 C=CCOCC1=CC=CC=C1 2907-1-17 [1,0,0,0,0,0|1,0,2]=4 19 B11R1.28 CCCCCC1=CC=CC=C1 1700-1-25 [1,0,0,0,0,0|0,0,0]=1 20 B11R1.28 CCCCCC1=CC=CC=N1 3H32-1-8W [1,0,0,0,0,0|1,0,0]=2 21 B11R1.28 CCCCCC1=CC=NC=C1 3H32-1-MQ [1,0,0,0,0,0|1,0,0]=2 22 B11R1.28 CCCNCC1=CC=CC=C1 3631-1-0J [1,0,0,0,0,0|1,0,0]=2 23 B11R1.28 CCOCCC1=CC=CC=N1 4H07-1-67 [1,0,0,0,0,0|2,0,0]=3 24 B11R1.28 CNCCCC1=CC=CC=C1 3731-1-X1 [1,0,0,0,0,0|1,0,0]=2 25 B11R1.28 CNCCOC1=CC=CC=C1 4656-5-00 [1,0,0,0,0,0|2,0,0]=3 26 B11R1.28 ClCCCOC1=CC=CC=C1 2607-5-0T [1,0,0,0,0,0|2,0,0]=3 27 B11R1.28 ClCCOCC1=CC=CC=C1 2607-5-1C [1,0,0,0,0,0|2,0,0]=3 28 B11R1.28 ClCCSCC1=CC=CC=C1 5666-5-0B [1,0,0,0,0,0|2,0,0]=3 29 B11R1.28 FCCCOC1=CC=CC=C1 2607-3-1A [1,0,0,0,0,0|2,0,0]=3 30 B11R1.28 N#CCCOC1=CC=CC=C1 4637-1-3E [1,0,0,0,0,0|2,0,1]=4 31 B11R1.28 N#CCNCC1=CC=CC=C1 3637-1-0K [1,0,0,0,0,0|2,0,1]=4 32 B11R1.28 NCCCCC1=CC=CC=C1 3730-1-48 [1,0,0,0,0,0|1,0,0]=2 33 B11R1.28 NCCCOC1=CC=CC=C1 4656-5-2X [1,0,0,0,0,0|2,0,0]=3 34 B11R1.28 NCCNCC1=CC=CC=C1 3731-1-00 [1,0,0,0,0,0|2,0,0]=3 35 B11R1.28 NCCOCC1=CC=CC=C1 4756-1-0P [1,0,0,0,0,0|2,0,0]=3 36 B11R1.28 NOCCOC1=CC=CC=C1 4647-5-08 [1,0,0,0,0,0|3,0,0]=4 37 B11R1.28 NOCOCC1=CC=CC=C1 4656-1-4L [1,0,0,0,0,0|3,0,0]=4 38 B11R1.28 O=CCOCC1=CC=CC=C1 2615-1-08 [1,0,0,0,0,0|1,0,2]=4 39 B11R1.28 OCCC#CC1=CC=NC=C1 4H56-1-0Q2 [1,0,0,0,0,0|1,0,2]=4 40 B11R1.28 OCCCCC1=CC=CN=C1 4H01-1-B4 [1,0,0,0,0,0|1,0,0]=2 41 B11R1.28 OCCCCC1=CC=NC=C1 4H01-1-9W [1,0,0,0,0,0|1,0,0]=2 42 B11R1.28 OCCCNC1=CC=CC=C1 4656-1-A2 [1,0,0,0,0,0|1,0,0]=2 43 B11R1.28 OCCCOC1=CC=CC=C1 4607-1-01 [1,0,0,0,0,0|1,0,0]=2 44 B13R1.9 CCCCCOC1=CC=C(O)C=C1 2601-1-0K [0,1,0,0,0,0|2,0,0]=3 45 B13R1.9 N#CCCSCC1=CC=C(Cl)C=C1 7666-5-X0 [0,1,0,0,0,0|2,0,1]=4 46 B13R1.24 CCCCCC(=O)C1=CC=CC=C1 2617-1-2A [0,1,0,0,0,0|1,0,1]=3 47 B13R1.24 CCCCCC(O)C1=CC=CC=C1 2602-1-0F [0,1,0,0,0,0|1,0,0]=2 48 B13R1.24 CCCCSC(=O)C1=CC=CC=C1 6666-1-0P [0,1,0,0,0,0|2,0,1]=4 49 B13R1.24 C[C@@H](NCCCO)C1=CC=CC=C1 4756-1-44 [0,1,0,0,0,0|1,0,0]=2 50 B13R1.24 O=C(OCCCCl)C1=CC=CC=C1 2623-5-0L [0,1,0,0,0,0|2,0,1]=4 51 B13R1.24 O=C(OCCCF)C1=CC=CC=C1 2623-3-1J [0,1,0,0,0,0|2,0,1]=4 52 B13R1.28 N#CCCNCCC1=CC=CC=N1 3H37-1-V5 [0,1,0,0,0,0|2,0,1]=4 53 B13R1.28 OCCCCCCC1=CC=CC=C1 2601-1-0C [0,1,0,0,0,0|0,0,0]=1 54 B13R1.42 CCOC(=O)CCC1=CC=CC=C1 2723-1-24 [0,1,0,0,0,0|2,0,1]=4 55 B13R1.42 O=C(CCCl)NCC1=CC=CC=C1 4648-5-2B [0,1,0,0,0,0|2,0,1]=4 56 B13R1.42 O=C(CCCl)OCC1=CC=CC=C1 2623-5-0X [0,1,0,0,0,0|2,0,1]=4 57 B13R1.42 O=C(CCF)OCC1=CC=CC=C1 2623-3-2K [0,1,0,0,0,0|2,0,1]=4 58 B13R1.42 O=C(CCO)OCC1=CC=CC=C1 2629-1-3E [0,1,0,0,0,0|1,0,1]=3 59 B13R1.44 CNCCN(C)CC1=CC=CC=C1 3631-1-0T [0,1,0,0,0,0|3,0,0]=4 60 B13R1.44 O=C(CC1=CC=CC=C1)NCCO 4648-1-1A [0,1,0,0,0,0|1,0,1]=3 61 B13R1.337 CC(C)CCOCC1=CC=CC=C1 2607-1-1U [0,1,0,0,0,0|2,0,0]=3 62 B13R1.337 O=C(O)CCCCC1=CC=CC=C1 2721-1-70 [0,1,0,0,0,0|0,0,1]=2 63 B13R1.337 O=C(O)CCOCC1=CC=CC=C1 2721-1-04 [0,1,0,0,0,0|1,0,1]=3 64 B13R1.555 CCCCNCC1=CC=CC=C1Cl 3631-5-0N [0,1,0,0,0,0|2,0,0]=3 65 B13R1.555 CCOCCOC1=C(O)C=CC=C1 2608-1-1G [0,1,0,0,0,0|3,0,0]=4 66 B13R1.718 CCC(=O)COCC1=CC=CC=C1 2717-1-15 [0,1,0,0,0,0|2,0,1]=4 67 B13R1.718 COC(=O)CCCC1=CC=CC=C1 2623-1-0S [0,1,0,0,0,0|2,0,1]=4 68 B13R1.718 N[C@@H](CO)COCC1=CC=CC=C1 4656-5-53 [0,1,0,0,0,0|1,0,0]=2 69 B13R1.718 N[C@@H](CO)COCC1=CC=CC=C1 4756-1-0F [0,1,0,0,0,0|1,0,0]=2 70 B13R1.718 N[C@H](CO)COCC1=CC=CC=C1 4656-5-52 [0,1,0,0,0,0|1,0,0]=2 71 B13R1.718 O=C(CCl)NCCC1=CC=CC=C1 4748-5-X2 [0,1,0,0,0,0|2,0,1]=4 72 B13R1.718 OC(CCl)CNCC1=CC=CC=C1 4756-5-39 [0,1,0,0,0,0|2,0,0]=3 73 B13R1.718 OC[C@@H](O)COCC1=CC=CC=C1 2607-1-R0 [0,1,0,0,0,0|1,0,0]=2 74 B13R1.718 OC[C@H](O)COCC1=CC=CC=C1 2607-1-S0 [0,1,0,0,0,0|1,0,0]=2 75 B13R2.1 NCCN1CCC2=C1C=CC=C2 3H30-1-UU [0,0,0,1,0,0|2,0,0]=3 76 B13R2.1 OCCC1=COC2=CC=CC=C12 2H01-1-05 [0,0,0,1,0,0|1,0,2]=4 77 B13R2.1 OCCN1N=NC2=CC=CC=C21 4H01-1-DH [0,0,0,1,0,0|3,0,0]=4 78 B13R2.3 C1=CC(C2CCCCN2)=CC=N1 3H31-1-8F [0,0,0,1,0,0|2,0,0]=3 79 B13R2.3 C1=CC=C(B2OCCCO2)C=C1 6660-1-PM [0,0,0,1,0,0|2,0,0]=3 80 B13R2.3 C1=CC=C(C2=CCNCC2)C=C1 3H31-5-77 [0,0,0,1,0,0|2,0,1]=4 81 B13R2.3 C1=CC=C(C2=CCOCC2)C=C1 2H10-1-51 [0,0,0,1,0,0|2,0,1]=4 82 B13R2.3 C1=CC=C(C2CCCCN2)C=C1 3H31-5-4V [0,0,0,1,0,0|1,0,0]=2 83 B13R2.3 C1=CC=C(C2CCCNC2)C=C1 3H31-5-36 [0,0,0,1,0,0|2,0,0]=3 84 B13R2.3 C1=CC=C(C2CCCNC2)N=C1 3H31-1-6M [0,0,0,1,0,0|3,0,0]=4 85 B13R2.3 C1=CC=C(C2CCNCC2)N=C1 3H31-1-6G [0,0,0,1,0,0|3,0,0]=4 86 B13R2.3 C1=CC=C(C2CCNCC2)N=C1 3H31-5-BS [0,0,0,1,0,0|3,0,0]=4 87 B13R2.3 C1=CC=C(C2CNCCN2)C=C1 3H31-5-57 [0,0,0,1,0,0|2,0,0]=3 88 B13R2.3 C1=CC=C(C2CNCCO2)C=C1 4H56-5-P9 [0,0,0,1,0,0|1,0,0]=2 89 B13R2.3 C1=CC=C(C2CNCCS2)C=C1 7H70-5-25 [0,0,0,1,0,0|1,1,0]=3 90 B13R2.3 C1=CC=C(C2COCCN2)C=C1 4H44-5-05 [0,0,0,1,0,0|2,0,0]=3 91 B13R2.3 C1=CC=C(C2CSCCN2)C=C1 7H70-1-31 [0,0,0,1,0,0|2,0,0]=3 92 B13R2.3 C1=CC=C(N2CCCCC2)C=C1 3H32-1-LJ [0,0,0,1,0,0|2,0,0]=3 93 B13R2.3 C1=CC=C(N2CCOCC2)C=C1 4H32-1-0U [0,0,0,1,0,0|3,0,0]=4 94 B13R2.3 C1=CC=C([C@@H]2COCCN2)C=C1 4H44-1-06 [0,0,0,1,0,0|2,0,0]=3 95 B13R2.3 C1=CC=C([C@H]2CCCCN2)C=C1 3H31-1-RA [0,0,0,1,0,0|1,0,0]=2 96 B13R2.3 C1=CC=C([C@H]2CCCNC2)C=C1 3H31-1-RD [0,0,0,1,0,0|2,0,0]=3 97 B13R2.3 C1=CC=C([C@H]2COCCN2)C=C1 4H44-1-07 [0,0,0,1,0,0|2,0,0]=3 98 B13R2.3 C1=CN=CC(B2OCCCO2)=C1 8H60-1-1J [0,0,0,1,0,0|3,0,0]=4 99 B13R2.3 C1=CN=CC(C2CCCCN2)=C1 3H32-1-U8 [0,0,0,1,0,0|2,0,0]=3 100 B13R2.3 C1=CN=CC(C2CCNCC2)=C1 3H31-5-8F [0,0,0,1,0,0|3,0,0]=4 101 B13R2.3 C1=CN=CC(C2CNCCO2)=C1 4H56-1-7H [0,0,0,1,0,0|2,0,0]=3 102 B13R2.3 C1=CN=CC(C2CNCCS2)=C1 7H70-1-X4 [0,0,0,1,0,0|2,1,0]=4 103 B13R2.3 C1=CN=CC(C2CSCCN2)=C1 7H70-1-30 [0,0,0,1,0,0|3,0,0]=4 104 B13R2.15 O=C1CCCC1C2=CC=CC=N2 4H17-1-26 [0,0,0,1,0,0|1,0,2]=4 105 B13R2.15 O=C1CCCN1C2=CC=CC=C2 4H48-1-051 [0,0,0,1,0,0|1,0,2]=4 106 B13R2.64 C1=CC=C(CC2=NCCN2)C=C1 3H32-1-KA [0,0,0,1,0,0|2,0,1]=4 107 B13R2.64 C1=CC=C(CC2CCCN2)C=C1 3H31-1-T0 [0,0,0,1,0,0|1,0,0]=2 108 B13R2.64 C1=CC=C(CC2CCNC2)C=C1 3H31-1-T1 [0,0,0,1,0,0|2,0,0]=3 109 B13R2.64 C1=CC=C(CC2OCCO2)C=C1 2H10-1-1B [0,0,0,1,0,0|1,0,0]=2 110 B13R2.64 C1=CC=C(CN2CCCC2)C=C1 3H32-1-HK [0,0,0,1,0,0|2,0,0]=3 111 B13R2.64 C1=CC=C(CN2CCOC2)C=C1 4H32-1-1G [0,0,0,1,0,0|3,0,0]=4 112 B13R2.64 C1=CC=C(C[C@@H]2CCCN2)C=C1 3H31-1-37 [0,0,0,1,0,0|1,0,0]=2 113 B13R2.64 C1=CC=C(C[C@H]2CCCN2)C=C1 3H32-1-1D [0,0,0,1,0,0|1,0,0]=2 114 B13R2.64 C1=CC=C(C[S+]2CCCC2)C=C1 5H76-3-00 [0,0,0,1,0,0|2,0,0]=3 115 B13R2.64 C1=CC=C(OC2CCNC2)C=C1 4H56-5-CA [0,0,0,1,0,0|3,0,0]=4 116 B13R2.64 C1=CC=C(O[C@@H]2CCNC2)C=C1 4H07-5-R1 [0,0,0,1,0,0|3,0,0]=4 117 B13R2.64 C1=CN=CC(CC2CCCN2)=C1 3H31-5-Z2 [0,0,0,1,0,0|2,0,0]=3 118 B13R2.1613 N#CC1CCCC2=CC=CC=C21 3H37-1-9K [0,0,0,1,0,0|1,0,1]=3 119 B13R2.1613 NCC1NCCC2=CC=CC=C21 3H30-5-83 [0,0,0,1,0,0|2,0,0]=3 120 B13R2.1613 NCC1OCCC2=CC=CC=C21 4H56-1-0KL [0,0,0,1,0,0|2,0,0]=3 121 B13R2.1613 O\N=C1/CCCC2=CC=CC=C21 4747-1-12 [0,0,0,1,0,0|1,0,1]=3 122 B13R2.1613 O\N=C1/CCOC2=C1C=CC=C2 4H47-1-0V [0,0,0,1,0,0|2,0,1]=4 123 B13R2.1613 O\N=C1\CCCC2=CC=CN=C21 4H47-1-0W [0,0,0,1,0,0|2,0,1]=4 124 B13R2.5252 NC1CCCCC2=CC=CN=C21 3H30-1-FQ [0,0,0,1,0,0|2,0,0]=3 125 B13R2.5252 O=C1CCCCC2=CC=CC=C12 2617-1-1T [0,0,0,1,0,0|0,0,2]=3 126 B13R2.5252 O=C1CCCOC2=C1C=CC=C2 2H17-1-1F [0,0,0,1,0,0|1,0,2]=4 127 B13R2.5252 O=C1NCCCC2=CC=CC=C12 4H48-1-03Z [0,0,0,1,0,0|1,0,2]=4 128 B13R2.5252 OC1CCCOC2=C1C=CC=C2 2H01-1-01 [0,0,0,1,0,0|1,0,0]=2 129 B11R1.4 CCCCCCC1=CSC=C1 5H66-1-X8 [0,0,0,0,1,0|2,0,0]=3 130 B11R1.4 CCCCCCN1C=CN=C1 3H32-1-KE [0,0,0,0,1,0|3,0,0]=4 131 B11R1.4 CCCCNCC1=CC=CS1 7H31-1-0P [0,0,0,0,1,0|3,0,0]=4 132 B10R1.17 BrCCSC1=CC=CC=C1 6666-9-05 [2,0,0,0,0,0|2,0,0]=4 133 B10R1.17 C#CCCC1=CC=CC=C1 1900-1-0F [2,0,0,0,0,0|0,0,2]=4 134 B10R1.17 C=CCCC1=CC=CC=C1 1900-1-43 [2,0,0,0,0,0|0,0,2]=4 135 B10R1.17 CCCCC1=CC=CN=C1 3H32-1-JE [2,0,0,0,0,0|1,0,0]=3 136 B10R1.17 CCCC[N+]1=CC=CC=C1 3H33-5-1Z [2,0,0,0,0,0|1,0,0]=3 137 B10R1.17 CCCC[N+]1=CC=CC=C1 7H60-3-29 [2,0,0,0,0,0|1,0,0]=3 138 B10R1.17 CCCC[N+]1=CC=CC=C1 7H73-3-01 [2,0,0,0,0,0|1,0,0]=3 139 B10R1.17 CCCNC1=CC=CC=C1 3631-1-0M [2,0,0,0,0,0|1,0,0]=3 140 B10R1.17 CCCOC1=CC=CC=C1 2607-1-1S [2,0,0,0,0,0|1,0,0]=3 141 B10R1.17 CCNCC1=CC=CN=C1 3H31-1-3J [2,0,0,0,0,0|2,0,0]=4 142 B10R1.17 CCNCC1=CC=NC=C1 3H31-1-3L [2,0,0,0,0,0|2,0,0]=4 143 B10R1.17 CNCCC1=CC=CN=C1 3H31-5-64 [2,0,0,0,0,0|2,0,0]=4 144 B10R1.17 CNCCC1=CC=NC=C1 3H31-1-17 [2,0,0,0,0,0|2,0,0]=4 145 B10R1.17 CNCCC1=CC=NC=C1 3H31-5-93 [2,0,0,0,0,0|2,0,0]=4 146 B10R1.17 COCCC1=CC=CC=C1 2607-1-0N [2,0,0,0,0,0|1,0,0]=3 147 B10R1.17 COCCC1=NC=CC=C1 4H07-1-6R [2,0,0,0,0,0|2,0,0]=4 148 B10R1.17 ClCCOC1=CC=CC=C1 2607-5-00 [2,0,0,0,0,0|2,0,0]=4 149 B10R1.17 ClCOCC1=CC=CC=C1 2607-5-2Q [2,0,0,0,0,0|2,0,0]=4 150 B10R1.17 FCCNC1=CC=CC=C1 3631-3-0A [2,0,0,0,0,0|2,0,0]=4 151 B10R1.17 N#CCCC1=CC=CC=C1 3637-1-0U [2,0,0,0,0,0|1,0,1]=4 152 B10R1.17 NCCCC1=CC=CN=C1 3H30-1-FT [2,0,0,0,0,0|2,0,0]=4 153 B10R1.17 NCCSC1=CC=CC=C1 7H66-1-0L [2,0,0,0,0,0|2,0,0]=4 154 B10R1.17 O=CCCC1=CC=CC=C1 2615-1-0W [2,0,0,0,0,0|0,0,2]=4 155 B10R1.17 OCCCC1=CC=CC=C1 2601-1-0D [2,0,0,0,0,0|0,0,0]=2 156 B10R1.17 OCCCC1=CC=CC=N1 4H01-5-2G [2,0,0,0,0,0|1,0,0]=3 157 B10R1.17 OCCCC1=CC=NC=C1 4H01-1-74 [2,0,0,0,0,0|1,0,0]=3 158 B10R1.17 OCCNC1=CC=CC=C1 4631-1-05 [2,0,0,0,0,0|1,0,0]=3 159 B10R1.17 OCCSC1=CC=CC=C1 6666-1-03 [2,0,0,0,0,0|1,0,0]=3 160 B10R1.17 OCCSC1=CC=CC=N1 8H66-1-80 [2,0,0,0,0,0|2,0,0]=4 161 B10R1.17 SCCCC1=CC=NC=C1 7H61-1-03 [2,0,0,0,0,0|1,1,0]=4 162 B10R1.17 SCCCC1=CN=CC=C1 7H61-1-02 [2,0,0,0,0,0|1,1,0]=4 163 B10R1.17 SCCCC1=NC=CC=C1 7H61-1-01 [2,0,0,0,0,0|1,1,0]=4 164 B10R1.17 [C-]#[N+]CCC1=CC=CC=C1 3637-1-0A [2,0,0,0,0,0|1,0,1]=4 165 B10R1.17 [O-]CCNC1=CC=CC=C1 4656-1-7K [2,0,0,0,0,0|1,0,1]=4 166 B12R1.1 CCCCCC1=CC=C(N)C=C1 3730-1-58 [1,1,0,0,0,0|0,0,0]=2 167 B12R1.1 CCCCCC1=CC=C(O)C=C1 2701-1-06 [1,1,0,0,0,0|0,0,0]=2 168 B12R1.1 CCCCNC1=CC=C(Br)C=N1 3H31-9-36 [1,1,0,0,0,0|2,0,0]=4 169 B12R1.1 CCCCOC1=CC=C(Br)C=C1 2607-9-X1 [1,1,0,0,0,0|1,0,0]=3 170 B12R1.1 CCCCOC1=CC=C(O)C=C1 2607-1-0P [1,1,0,0,0,0|1,0,0]=3 171 B12R1.1 COCCOC1=CC=C(N)C=C1 4630-1-0T [1,1,0,0,0,0|2,0,0]=4 172 B12R1.1 ClC1=CC=C(OCCCI)C=C1 2607-M-00 [1,1,0,0,0,0|2,0,0]=4 173 B12R1.1 ClC1=CC=C(OCCCI)C=C1 2707-M-01 [1,1,0,0,0,0|2,0,0]=4 174 B12R1.1 ClCCCOC1=CC=C(Br)C=C1 2607-D-0F [1,1,0,0,0,0|2,0,0]=4 175 B12R1.1 FC1=CC=C(OCCCCl)C=C1 2607-7-X0 [1,1,0,0,0,0|2,0,0]=4 176 B12R1.1 FCCCOC1=CC=C(Br)C=C1 2607-B-1C [1,1,0,0,0,0|2,0,0]=4 177 B12R1.1 NC1=CC=C(OCCCCl)C=C1 4656-5-1W [1,1,0,0,0,0|2,0,0]=4 178 B12R1.1 NC1=CC=C(OCCCF)C=C1 4656-3-1C [1,1,0,0,0,0|2,0,0]=4 179 B12R1.1 NCCCOC1=CC=C(Cl)C=C1 4630-5-0P [1,1,0,0,0,0|2,0,0]=4 180 B12R1.1 NCCCOC1=CC=C(F)C=C1 4630-3-0G [1,1,0,0,0,0|2,0,0]=4 181 B12R1.1 NCCCOC1=CC=C(F)C=C1 4656-7-38 [1,1,0,0,0,0|2,0,0]=4 182 B12R1.1 NCCNCC1=CC=C(F)C=C1 3731-3-02 [1,1,0,0,0,0|2,0,0]=4 183 B12R1.1 NCCSCC1=CC=C(Cl)C=C1 7766-5-X0 [1,1,0,0,0,0|2,0,0]=4 184 B12R1.1 OC1=CC=C(NCCCCl)C=C1 4656-5-1V [1,1,0,0,0,0|2,0,0]=4 185 B12R1.1 OC1=CC=C(NCCCF)C=C1 4656-3-1B [1,1,0,0,0,0|2,0,0]=4 186 B12R1.1 OC1=CC=C(OCCCCl)C=C1 2607-5-0S [1,1,0,0,0,0|2,0,0]=4 187 B12R1.1 OC1=CC=C(OCCCF)C=C1 2601-3-1A [1,1,0,0,0,0|2,0,0]=4 188 B12R1.1 OCCNCC1=CC=C(F)C=C1 4656-3-7E [1,1,0,0,0,0|1,0,0]=3 189 B12R1.1 OCCOCC1=CC=C(Cl)C=C1 2607-5-0W [1,1,0,0,0,0|1,0,0]=3 190 B12R1.27 C#CC(O)CCC1=CC=CC=C1 2902-1-00 [1,1,0,0,0,0|0,0,2]=4 191 B12R1.27 NCC(O)COC1=CC=CC=C1 4656-5-0P [1,1,0,0,0,0|2,0,0]=4 192 B12R1.27 O=C(CBr)CCC1=CC=CC=C1 2617-9-0P [1,1,0,0,0,0|1,0,1]=4 193 B12R1.27 O=C(CO)OCC1=CC=CC=C1 2629-1-2N [1,1,0,0,0,0|1,0,1]=4 194 B12R1.28 CC1=CC=CC(OCCCN)=C1 4756-1-1Q [1,1,0,0,0,0|2,0,0]=4 195 B12R1.28 CCCCCC1=CC=CC(=O)O1 2H25-1-X0 [1,1,0,0,0,0|1,0,0]=3 196 B12R1.28 CCCCOC1=CC=CC(Br)=N1 4H56-9-1Y [1,1,0,0,0,0|2,0,0]=4 197 B12R1.28 CCCCOC1=CC=CC(O)=C1 2607-1-2F [1,1,0,0,0,0|1,0,0]=3 198 B12R1.28 CCCNCC1=CC(F)=CC=C1 3631-3-0N [1,1,0,0,0,0|1,0,0]=3 199 B12R1.28 CNCCOC1=CC=CC(C)=C1 4756-1-2T [1,1,0,0,0,0|2,0,0]=4 200 B12R1.28 COCCOC1=CC(N)=CC=C1 4630-1-0Y [1,1,0,0,0,0|2,0,0]=4 201 B12R1.28 ClC1=CC=CC(OCCCBr)=C1 2607-D-02 [1,1,0,0,0,0|2,0,0]=4 202 B12R1.28 ClCCCOC1=CC=CC(Br)=C1 2607-D-0G [1,1,0,0,0,0|2,0,0]=4 203 B12R1.28 FCCCOC1=CC=CC(Br)=C1 2607-B-1B [1,1,0,0,0,0|2,0,0]=4 204 B12R1.28 NCCCOC1=CC(Cl)=CC=C1 4656-5-Y6 [1,1,0,0,0,0|2,0,0]=4 205 B12R1.28 NCCCOC1=CC=CC(F)=C1 4630-3-0J [1,1,0,0,0,0|2,0,0]=4 206 B12R1.28 OC1=CC(NCCCF)=CC=C1 4656-3-8R [1,1,0,0,0,0|2,0,0]=4 207 B12R1.28 OC1=CC(OCCCF)=CC=C1 2607-3-5G [1,1,0,0,0,0|2,0,0]=4 208 B12R1.28 OC1=CC=CC(NCCCCl)=C1 4656-5-1T [1,1,0,0,0,0|2,0,0]=4 209 B12R1.28 OC1=CC=CC(OCCCCl)=C1 2607-5-0Q [1,1,0,0,0,0|2,0,0]=4 210 B12R1.28 OCCCNC1=NC(F)=CC=C1 4H56-3-JD [1,1,0,0,0,0|2,0,0]=4 211 B12R1.30 CC(NCCCl)C1=CC=CC=C1 3731-5-05 [1,1,0,0,0,0|2,0,0]=4 212 B12R1.30 CCCCC(=O)C1=NC=CC=C1 4H17-1-9Z [1,1,0,0,0,0|1,0,1]=4 213 B12R1.30 CCCCN(N)C1=CC=CC=C1 3639-1-07 [1,1,0,0,0,0|1,0,0]=3 214 B12R1.30 CCSCC(=O)C1=CC=CC=C1 6666-1-14 [1,1,0,0,0,0|1,0,1]=4 215 B12R1.30 CN(CCCN)C1=CC=CC=C1 3632-1-0B [1,1,0,0,0,0|2,0,0]=4 216 B12R1.30 CNCCC(O)C1=CC=CC=C1 4656-1-81 [1,1,0,0,0,0|1,0,0]=3 217 B12R1.30 NCCCC(N)C1=CC=CC=N1 3H30-1-H3 [1,1,0,0,0,0|2,0,0]=4 218 B12R1.30 O=C(CCCCl)C1=CC=CC=C1 2617-5-Z5 [1,1,0,0,0,0|1,0,1]=4 219 B12R1.30 O=C(OCCO)C1=CC=CC=C1 2629-1-0R [1,1,0,0,0,0|1,0,1]=4 220 B12R1.32 CCCC(=O)CC1=CC=CC=C1 2617-1-0X [1,1,0,0,0,0|0,0,1]=3 221 B12R1.32 CCCC(=O)OC1=CC=CC=C1 2623-1-16 [1,1,0,0,0,0|1,0,1]=4 222 B12R1.32 CN(CCCl)CC1=CC=CC=C1 3632-5-X0 [1,1,0,0,0,0|2,0,0]=4 223 B12R1.32 COC[C@@H](N)CC1=CC=CC=C1 4656-1-S00 [1,1,0,0,0,0|1,0,0]=3 224 B12R1.252 CC(=O)NCCC1=CC=CC=C1 4748-1-31 [1,1,0,0,0,0|1,0,1]=4 225 B12R1.252 CC(C)CNCC1=CC=CC=C1 3631-1-0U [1,1,0,0,0,0|1,0,0]=3 226 B12R1.252 CC(F)CSCC1=CC=CC=C1 5666-3-0B [1,1,0,0,0,0|1,0,0]=3 227 B12R1.252 CN(C)CCCC1=CC=NC=C1 3H32-1-8Q [1,1,0,0,0,0|2,0,0]=4 228 B12R1.252 CN(C)CCOC1=CC=CC=C1 4656-1-9L [1,1,0,0,0,0|2,0,0]=4 229 B12R1.252 C[C@@H](O)COCC1=CC=CC=C1 2607-1-R4 [1,1,0,0,0,0|1,0,0]=3 230 B12R1.252 FC(F)CSCC1=CC=CC=C1 5666-3-03 [1,1,0,0,0,0|2,0,0]=4 231 B12R1.252 O=C(Cl)CCCC1=CC=CC=C1 2616-5-0L [1,1,0,0,0,0|0,0,2]=4 232 B12R1.252 O=C(O)CCNC1=CC=CC=C1 4631-1-0D [1,1,0,0,0,0|1,0,1]=4 233 B12R1.252 O=C(O)CCSC1=CC=CC=C1 6666-1-04 [1,1,0,0,0,0|1,0,1]=4 234 B12R1.252 O=C(O)CNCC1=CC=CC=C1 4757-1-17 [1,1,0,0,0,0|1,0,1]=4 235 B12R1.252 OB(O)CCCC1=CC=CC=C1 6660-1-1L [1,1,0,0,0,0|1,0,0]=3 236 B12R1.267 CC1=CC=CC=C1OCCCN 4756-1-2P [1,1,0,0,0,0|2,0,0]=4 237 B12R1.267 CCCCOC1=CC=CC=C1N 4630-1-04 [1,1,0,0,0,0|1,0,0]=3 238 B12R1.267 CCCNCC1=C(Cl)C=CC=C1 3631-5-0S [1,1,0,0,0,0|1,0,0]=3 239 B12R1.267 CCCNCC1=C(O)C=CC=C1 4631-1-18 [1,1,0,0,0,0|1,0,0]=3 240 B12R1.267 COCCOC1=C(N)C=CC=C1 4630-1-2M [1,1,0,0,0,0|2,0,0]=4 241 B12R1.267 ClCCCOC1=CC=CC=C1Br 2607-D-0H [1,1,0,0,0,0|2,0,0]=4 242 B12R1.267 FCCCOC1=CC=CC=C1Br 2607-B-1A [1,1,0,0,0,0|2,0,0]=4 243 B12R1.267 NCCCOC1=CC=CC=C1Cl 4656-5-2W [1,1,0,0,0,0|2,0,0]=4 244 B12R1.267 NCCCOC1=CC=CC=C1F 4656-3-CC [1,1,0,0,0,0|2,0,0]=4 245 B12R1.267 OC1=C(NCCCF)C=CC=C1 4656-3-9K [1,1,0,0,0,0|2,0,0]=4 246 B12R1.267 OC1=C(OCCCF)C=CC=C1 2607-3-5Y [1,1,0,0,0,0|2,0,0]=4 247 B12R1.267 OC1=CC=CC=C1NCCCCl 4656-5-1U [1,1,0,0,0,0|2,0,0]=4 248 B12R1.267 OC1=CC=CC=C1OCCCCl 2607-5-0R [1,1,0,0,0,0|2,0,0]=4 249 B14R1.14 CCCCCCCC1=CC=C(O)C=C1 2701-1-22 [0,2,0,0,0,0|1,0,0]=3 250 B14R1.14 ClC1=CC=C(OCCCCCBr)C=C1 2607-D-05 [0,2,0,0,0,0|1,0,0]=3 251 B14R1.14 OCCCCCOC1=CC=C(Cl)C=C1 2607-5-08 [0,2,0,0,0,0|0,0,0]=2 252 B14R1.19 CCCCCC(=O)C1=CC=C(F)C=C1 2617-3-0X [0,2,0,0,0,0|1,0,1]=4 253 B14R1.19 CCCCCC(=O)C1=CC=C(N)C=C1 4630-1-2J [0,2,0,0,0,0|1,0,1]=4 254 B14R1.19 CCCCCC(=O)C1=CC=C(O)C=C1 2617-1-2F [0,2,0,0,0,0|1,0,1]=4 255 B14R1.502 CCCC(=O)CCC1=CC=C(F)C=C1 2717-3-20 [0,2,0,0,0,0|1,0,1]=4 256 B14R1.677 O=C(Cl)CCCCC1=CC=C(F)C=C1 2716-7-18 [0,2,0,0,0,0|0,0,2]=4 257 B14R1.776 C#CC1=CC=C(CCCCCC)C=C1 1900-1-29 [0,2,0,0,0,0|1,0,0]=3 258 B14R1.776 C#CC1=CC=C(OCCCCC)C=C1 2907-1-13 [0,2,0,0,0,0|2,0,0]=4 259 B14R1.776 COC1=CC=C(CCCCCBr)C=C1 2707-9-X2 [0,2,0,0,0,0|1,0,0]=3 260 B14R1.38 O=C(OCCCCI)C1=CC=CC=C1 2623-H-04 [0,2,0,0,0,0|1,0,1]=4 261 B14R1.420 O=C(O)CCCC(=O)C1=CC=CC=C1 2621-1-1Q [0,2,0,0,0,0|0,0,2]=4 262 B14R1.123 OCCCCCOCC1=CC=CC=C1 2607-1-29 [0,2,0,0,0,0|0,0,0]=2 263 B14R1.156 O=C(CCCBr)OCC1=CC=CC=C1 2623-9-40 [0,2,0,0,0,0|1,0,1]=4 264 B14R1.156 O=C(NCCO)OCC1=CC=CC=C1 4656-1-7P [0,2,0,0,0,0|1,0,1]=4 265 B14R1.422 O=C(O)CCCCCC1=CC=CC=C1 2721-1-66 [0,2,0,0,0,0|0,0,0]=2 266 B14R1.716 COC(=O)CCOCC1=CC=CC=C1 2623-1-0P [0,2,0,0,0,0|1,0,1]=4 267 B14R1.818 NC(CCC1=CC=CC=C1)CC(=O)O 4657-1-60 [0,2,0,0,0,0|0,0,1]=3 268 B14R1.423 CN(CCC(=O)O)CC1=CC=CC=C1 4658-1-3H [0,2,0,0,0,0|1,0,1]=4 269 B14R1.6449 N[C@@H](CNCC1=CC=CC=C1)C(=O)O 4657-1-SG [0,2,0,0,0,0|1,0,1]=4 270 B14R1.6449 N[C@@H](COCC1=CC=CC=C1)C(=O)O 4657-1-SM [0,2,0,0,0,0|1,0,1]=4 271 B14R1.6449 N[C@H](CNCC1=CC=CC=C1)C(=O)O 4657-1-RG [0,2,0,0,0,0|1,0,1]=4 272 B14R1.6449 N[C@H](COCC1=CC=CC=C1)C(=O)O 4157-1-RM [0,2,0,0,0,0|1,0,1]=4 273 B14R1.546 OCC(CO)COCC1=CC=CC=C1 2607-1-22 [0,2,0,0,0,0|1,0,0]=3 274 B12R2.1 CCC1C=CC2=CC=CC=C21 1700-1-71 [1,0,0,1,0,0|0,0,2]=4 275 B12R2.1 COC1OCC2=CC=CC=C21 2H07-1-0H [1,0,0,1,0,0|2,0,0]=4 276 B12R2.2 C1=CC(C2CCNC2)=CC=N1 3H32-1-U5 [1,0,0,1,0,0|2,0,0]=4 277 B12R2.2 C1=CC=C(C2=NCCC2)C=C1 3H31-1-AK [1,0,0,1,0,0|1,0,1]=4 278 B12R2.2 C1=CC=C(C2CCNC2)C=C1 3H31-1-N0 [1,0,0,1,0,0|1,0,0]=3 279 B12R2.2 C1=CC=C(C2CCNC2)C=C1 3H31-5-00 [1,0,0,1,0,0|1,0,0]=3 280 B12R2.2 C1=CC=C(C2CCNC2)N=C1 3H31-5-8R [1,0,0,1,0,0|2,0,0]=4 281 B12R2.2 C1=CC=C(C2CCNC2)N=C1 3H32-1-U4 [1,0,0,1,0,0|2,0,0]=4 282 B12R2.2 C1=CC=C(N2CCCC2)C=C1 3H32-1-GH [1,0,0,1,0,0|1,0,0]=3 283 B12R2.2 C1=CC=C([C@@H]2CCCN2)C=C1 3631-1-S3 [1,0,0,1,0,0|1,0,0]=3 284 B12R2.2 C1=CC=C([C@@H]2CCCN2)N=C1 3H33-5-S2 [1,0,0,1,0,0|2,0,0]=4 285 B12R2.2 C1=CC=C([C@H]2CCNC2)C=C1 3H31-5-04 [1,0,0,1,0,0|1,0,0]=3 286 B12R2.2 C1=CC=C([S+]2CCCC2)C=C1 5H76-3-02 [1,0,0,1,0,0|1,0,0]=3 287 B12R2.2 C1=CN=CC(C2CCCN2)=C1 4H32-1-14 [1,0,0,1,0,0|2,0,0]=4 288 B12R2.2 C1=CN=CC(C2CCNC2)=C1 3H32-1-6B [1,0,0,1,0,0|2,0,0]=4 289 B12R2.2 C1=CN=CC(C2CCNC2)=C1 3H32-5-BD [1,0,0,1,0,0|2,0,0]=4 290 B12R2.41 C1=CC=C2CCNCCC2=C1 3H31-1-3E [1,0,0,1,0,0|1,0,0]=3 291 B12R2.41 C1=CC=C2CCNCCC2=C1 3H31-5-0J [1,0,0,1,0,0|1,0,0]=3 292 B12R2.41 C1=CC=C2CNCCCC2=C1 3H33-5-0X [1,0,0,1,0,0|1,0,0]=3 293 B12R2.41 C1=CC=C2NCCCCC2=C1 3H31-1-CT [1,0,0,1,0,0|1,0,0]=3 294 B12R2.41 C1=CC=C2OCCCOC2=C1 2H10-1-0U [1,0,0,1,0,0|1,0,0]=3 295 B12R2.1081 CC1CCNC2=CC=CC=C21 3H31-1-CC [1,0,0,1,0,0|1,0,0]=3 296 B12R2.1081 CC1CNCC2=CC=CC=C21 3H31-1-7D [1,0,0,1,0,0|1,0,0]=3 297 B12R2.1081 CC1CNCC2=CC=CC=C21 3H33-5-0F [1,0,0,1,0,0|1,0,0]=3 298 B12R2.1081 CC1NCCC2=CC=CC=C21 3H31-1-7F [1,0,0,1,0,0|1,0,0]=3 299 B12R2.1081 CN1CCCC2=CC=CC=C21 3H32-1-JW [1,0,0,1,0,0|1,0,0]=3 300 B12R2.1081 CN1CCOC2=C1C=CC=C2 4H56-1-0QS [1,0,0,1,0,0|2,0,0]=4 301 B12R2.1081 FC1CNCC2=CC=CC=C21 3H31-3-0C [1,0,0,1,0,0|2,0,0]=4 302 B12R2.1081 NC1CCCC2=C1C=CN=C2 3H30-5-8N [1,0,0,1,0,0|2,0,0]=4 303 B12R2.1081 NC1CCCC2=CC=CC=C21 3630-1-0D [1,0,0,1,0,0|1,0,0]=3 304 B12R2.1081 NC1CCCC2=CC=CN=C21 3H30-1-PP [1,0,0,1,0,0|2,0,0]=4 305 B12R2.1081 NN1CCCC2=C1C=CC=C2 3H39-1-0D [1,0,0,1,0,0|2,0,0]=4 306 B12R2.1081 N[C@@H]1CCCC2=CC=CC=C21 3730-1-R1 [1,0,0,1,0,0|1,0,0]=3 307 B12R2.1081 N[C@@H]1CCCC2=CC=CN=C21 3H32-5-R8 [1,0,0,1,0,0|2,0,0]=4 308 B12R2.1081 N[C@H]1CCCC2=CC=CN=C21 3H30-5-S8 [1,0,0,1,0,0|2,0,0]=4 309 B12R2.1081 N[C@H]1CCOC2=CC=CC=C21 4H30-5-10 [1,0,0,1,0,0|2,0,0]=4 310 B12R2.1081 OB1OCCC2=CC=CC=C12 6H60-1-43 [1,0,0,1,0,0|2,0,0]=4 311 B12R2.1081 OC1CCCC2=CC=CN=C21 4H56-5-H8 [1,0,0,1,0,0|1,0,0]=3 312 B12R2.1081 OC1CCOC2=C1C=NC=C2 4H56-1-GT [1,0,0,1,0,0|2,0,0]=4 313 B12R2.2057 C1=CC=C(OC[C@@H]2CO2)C=C1 2609-1-05 [1,0,0,1,0,0|1,0,0]=3 314 B12R2.2057 C1=CN=CC(CNC2CC2)=C1 3H31-1-D7 [1,0,0,1,0,0|2,0,0]=4 315 B12R2.2058 C1=CC=C(CC2CNC2)C=C1 3H31-1-5Z [1,0,0,1,0,0|1,0,0]=3 316 B12R2.2058 C1=CC=C(SC2CCC2)C=C1 5666-1-01 [1,0,0,1,0,0|1,0,0]=3 317 B14R2.21 BrC1=CC(C2CCNCC2)=CC=C1 3H31-D-0C [0,1,0,1,0,0|2,0,0]=4 318 B14R2.21 BrC1=CC=CC(C2CNCCO2)=C1 4H56-9-4X [0,1,0,1,0,0|1,0,0]=3 319 B14R2.21 CC1=CC(C2CCCCN2)=CC=C1 3H31-1-FP [0,1,0,1,0,0|1,0,0]=3 320 B14R2.21 CC1=CC=CC(C2CCNCC2)=C1 3H31-1-7W [0,1,0,1,0,0|2,0,0]=4 321 B14R2.21 ClC1=CC(C2CCCCN2)=CC=C1 3H31-5-BF [0,1,0,1,0,0|1,0,0]=3 322 B14R2.21 ClC1=CC=CC(C2CCNCC2)=C1 3H31-5-0E [0,1,0,1,0,0|2,0,0]=4 323 B14R2.21 ClC1=CC=CC(C2CNCCN2)=C1 3H31-5-AU [0,1,0,1,0,0|2,0,0]=4 324 B14R2.21 ClC1=CC=CC(N2CCCCC2)=C1 3H32-5-PW [0,1,0,1,0,0|2,0,0]=4 325 B14R2.21 FC1=CC(C2CCNCC2)=CC=C1 3H31-3-8N [0,1,0,1,0,0|2,0,0]=4 326 B14R2.21 FC1=CC=CC(C2CCCCN2)=C1 3H31-3-7S [0,1,0,1,0,0|1,0,0]=3 327 B14R2.21 NC1=CC=CC(C2CCCCN2)=C1 3H30-1-WK [0,1,0,1,0,0|1,0,0]=3 328 B14R2.21 NC1=CC=CC(C2OCCCO2)=C1 4H30-1-2M [0,1,0,1,0,0|1,0,0]=3 329 B14R2.21 NC1=CC=CC(N2CCCCC2)=C1 3H30-1-C7 [0,1,0,1,0,0|2,0,0]=4 330 B14R2.21 NC1=CC=CC(N2CCCCC2)=C1 3H30-5-1Z [0,1,0,1,0,0|2,0,0]=4 331 B14R2.21 N[C@@H]1CCC[C@H](C2=CC=CC=N2)C1 3H33-5-2R [0,1,0,1,0,0|2,0,0]=4 332 B14R2.21 N[C@@H]1CCC[C@H](C2=CC=CN=C2)C1 3H33-5-2Q [0,1,0,1,0,0|2,0,0]=4 333 B14R2.21 N[C@@H]1CCC[C@H](C2=CC=NC=C2)C1 3H33-5-2P [0,1,0,1,0,0|2,0,0]=4 334 B14R2.21 O=C1CCCC(C2=CC=CC=C2)C1 2617-1-1C [0,1,0,1,0,0|0,0,2]=4 335 B14R2.21 OC1=CC(C2CCNCC2)=CC=C1 4H01-5-0G [0,1,0,1,0,0|2,0,0]=4 336 B14R2.21 OC1=CC=CC(N2CCCCC2)=C1 4H01-1-4G [0,1,0,1,0,0|2,0,0]=4 337 B14R2.716 CC1=CC=CC(CC2CCCN2)=C1 3H31-1-FR [0,1,0,1,0,0|1,0,0]=3 338 B14R2.716 CC1=NC(CC2CCCN2)=CC=C1 3H31-1-F5 [0,1,0,1,0,0|2,0,0]=4 339 B14R2.716 ClC1=CC(CC2CCCN2)=CC=C1 3H31-5-BG [0,1,0,1,0,0|1,0,0]=3 340 B14R2.716 IC1=CC=CC(CN2CCCC2)=C1 3H32-H-25 [0,1,0,1,0,0|2,0,0]=4 341 B14R2.716 NC1=CC=CC(CN2CCCC2)=C1 3H30-1-CG [0,1,0,1,0,0|2,0,0]=4 342 B14R2.9061 FC1=CC=CC(CNCC2CC2)=C1 3631-3-08 [0,1,0,1,0,0|2,0,0]=4 343 B14R2.68 BrC1=CC=C(C2CCNCC2)C=C1 3H31-9-47 [0,1,0,1,0,0|2,0,0]=4 344 B14R2.68 BrC1=CC=C(C2CNCCO2)C=C1 4H56-9-4W [0,1,0,1,0,0|1,0,0]=3 345 B14R2.68 BrC1=CC=C([C@@H]2CCCNC2)C=C1 3H31-9-S1 [0,1,0,1,0,0|2,0,0]=4 346 B14R2.68 BrC1=CC=C([C@@H]2CCCNC2)C=C1 3H31-D-S5 [0,1,0,1,0,0|2,0,0]=4 347 B14R2.68 BrC1=CC=C([C@H]2CCCNC2)C=C1 3H31-9-R1 [0,1,0,1,0,0|2,0,0]=4 348 B14R2.68 BrC1=CC=C([C@H]2CCCNC2)C=C1 3H31-D-R3 [0,1,0,1,0,0|2,0,0]=4 349 B14R2.68 BrC1=CC=C([C@H]2CCCNC2)C=C1 4H22-9-R0 [0,1,0,1,0,0|2,0,0]=4 350 B14R2.68 CC1=CC=C(C2CCNCC2)C=C1 3H31-1-DQ [0,1,0,1,0,0|2,0,0]=4 351 B14R2.68 CC1=CC=C(C2CNCCN2)C=C1 3H31-1-CS [0,1,0,1,0,0|2,0,0]=4 352 B14R2.68 CC1=CC=C(C2CNCCO2)C=C1 4H21-1-8H [0,1,0,1,0,0|1,0,0]=3 353 B14R2.68 CC1=CC=C(C2COCCN2)C=C1 4H31-5-X3 [0,1,0,1,0,0|2,0,0]=4 354 B14R2.68 ClC1=CC=C(B2OCCCO2)C=C1 6H60-5-06 [0,1,0,1,0,0|2,0,0]=4 355 B14R2.68 ClC1=CC=C(C2CCCCN2)C=C1 3H31-5-Y6 [0,1,0,1,0,0|1,0,0]=3 356 B14R2.68 ClC1=CC=C(C2CCNCC2)C=C1 3H31-5-40 [0,1,0,1,0,0|2,0,0]=4 357 B14R2.68 ClC1=CC=C(C2CNCCN2)C=C1 3H31-5-69 [0,1,0,1,0,0|2,0,0]=4 358 B14R2.68 ClC1=CC=C(C2CNCCO2)C=C1 4H44-5-22 [0,1,0,1,0,0|1,0,0]=3 359 B14R2.68 ClC1=CC=C(C2COCCN2)C=C1 4H32-5-X3 [0,1,0,1,0,0|2,0,0]=4 360 B14R2.68 FC1=CC=C(C2CCCCN2)C=C1 3H31-3-8S [0,1,0,1,0,0|1,0,0]=3 361 B14R2.68 FC1=CC=C(C2CCCNC2)C=C1 3H31-3-6W [0,1,0,1,0,0|2,0,0]=4 362 B14R2.68 FC1=CC=C(C2CCCNC2)C=C1 3H33-7-16 [0,1,0,1,0,0|2,0,0]=4 363 B14R2.68 FC1=CC=C(C2CCNCC2)C=C1 3H31-3-3A [0,1,0,1,0,0|2,0,0]=4 364 B14R2.68 FC1=CC=C(C2CCNCC2)C=C1 3H31-7-3B [0,1,0,1,0,0|2,0,0]=4 365 B14R2.68 FC1=CC=C(C2CNCCN2)C=C1 3H31-3-7R [0,1,0,1,0,0|2,0,0]=4 366 B14R2.68 FC1=CC=C(C2COCCN2)C=C1 4H44-3-03 [0,1,0,1,0,0|2,0,0]=4 367 B14R2.68 FC1=CC=C(C2COCCN2)C=C1 4H56-7-6V [0,1,0,1,0,0|2,0,0]=4 368 B14R2.68 FC1=CC=C(C2CSCCN2)C=C1 7H70-3-0E [0,1,0,1,0,0|2,0,0]=4 369 B14R2.68 FC1=CC=C([C@@H]2CCCCN2)C=C1 3H31-7-S5 [0,1,0,1,0,0|1,0,0]=3 370 B14R2.68 FC1=CC=C([C@@H]2CCCNC2)C=C1 3H33-7-S0 [0,1,0,1,0,0|2,0,0]=4 371 B14R2.68 NC1=CC=C(C2CCCCC2)C=C1 3730-1-W0 [0,1,0,1,0,0|1,0,0]=3 372 B14R2.68 NC1=CC=C(C2CCCCN2)C=C1 3H30-1-WE [0,1,0,1,0,0|1,0,0]=3 373 B14R2.68 NC1=CC=C(C2CCCNC2)C=C1 3H30-1-FZ [0,1,0,1,0,0|2,0,0]=4 374 B14R2.68 NC1=CC=C(C2CCCNC2)C=C1 3H31-5-7V [0,1,0,1,0,0|2,0,0]=4 375 B14R2.68 NC1=CC=C(C2CCNCC2)C=C1 3H30-1-63 [0,1,0,1,0,0|2,0,0]=4 376 B14R2.68 NC1=CC=C(C2CCNCC2)C=C1 3H30-5-8H [0,1,0,1,0,0|2,0,0]=4 377 B14R2.68 NC1=CC=C(C2CCOCC2)C=C1 4H30-1-B9 [0,1,0,1,0,0|2,0,0]=4 378 B14R2.68 NC1=CC=C([C@@H]2CCCNC2)C=C1 3H30-1-SH [0,1,0,1,0,0|2,0,0]=4 379 B14R2.68 NC1CC=C(C2=CC=CC=C2)CC1 3630-1-0G [0,1,0,1,0,0|1,0,1]=4 380 B14R2.68 NC1CCC(C2=CC=CC=C2)CC1 3630-1-14 [0,1,0,1,0,0|1,0,0]=3 381 B14R2.68 NC1CCN(C2=CC=CC=C2)CC1 3H30-1-EP [0,1,0,1,0,0|2,0,0]=4 382 B14R2.68 OC1=CC=C(B2OCCCO2)C=C1 6660-1-0Z [0,1,0,1,0,0|2,0,0]=4 383 B14R2.68 OC1=CC=C(C2SCCCS2)C=C1 6H01-1-10 [0,1,0,1,0,0|1,1,0]=4 384 B14R2.68 OC1CCN(C2=CC=CC=C2)CC1 4H56-1-09 [0,1,0,1,0,0|2,0,0]=4 385 B14R2.68 O[C@H]1CO[C@@H](C2=CC=CC=C2)OC1 2H02-1-06 [0,1,0,1,0,0|1,0,0]=3 386 B14R2.68 SC1=CC=C(C2CCCCC2)C=C1 5761-1-00 [0,1,0,1,0,0|1,0,0]=3 387 B14R2.72 CC1=CC=C(CC2CCCN2)C=C1 3H31-1-FL [0,1,0,1,0,0|1,0,0]=3 388 B14R2.72 CC1=CC=C(CC2CCNC2)C=C1 3H31-5-70 [0,1,0,1,0,0|2,0,0]=4 389 B14R2.72 ClC1=CC=C(CC2CCCN2)C=C1 3H31-5-BE [0,1,0,1,0,0|1,0,0]=3 390 B14R2.72 IC1=CC=C(CN2CCCC2)C=C1 3H32-H-26 [0,1,0,1,0,0|2,0,0]=4 391 B14R2.72 NC1=CC=C(CN2CCCC2)C=C1 3H30-5-2N [0,1,0,1,0,0|2,0,0]=4 392 B14R2.72 NC1=CC=C(CN2CCCC2)C=C1 3H30-5-5U [0,1,0,1,0,0|2,0,0]=4 393 B14R2.8 OCC1CCN(C2=CC=CC=C2)C1 4H56-1-0LJ [0,1,0,1,0,0|1,0,0]=3 394 B14R2.114 NC(C1=CC=CC=C1)C2CCCC2 3630-1-21 [0,1,0,1,0,0|1,0,0]=3 395 B14R2.114 O=C(C1=CC=CC=C1)C2CCCC2 2617-1-1E [0,1,0,1,0,0|1,0,1]=4 396 B14R2.5540 C[C@@]1(C2=CC=CC=C2)CCCCN1 3H31-1-SC [0,1,0,1,0,0|1,0,0]=3 397 B14R2.5540 C[C@]1(C2=CC=CC=C2)CCCCN1 3H31-1-RC [0,1,0,1,0,0|1,0,0]=3 398 B14R2.5540 FC1(C2=CC=CC=C2)CCNCC1 G311-A-16 [0,1,0,1,0,0|2,0,0]=4 399 B14R2.5540 OC1(C2=CC=CC=C2)CCCNC1 4H01-5-1Q [0,1,0,1,0,0|2,0,0]=4 400 B14R2.5540 OC1(C2=CC=CC=C2)CCNCC1 4H56-1-UG [0,1,0,1,0,0|2,0,0]=4 401 B14R2.5540 OC1(C2=CC=CC=C2)CCOCC1 2H03-1-01 [0,1,0,1,0,0|2,0,0]=4 402 B14R2.3 C#CCNC1CCC2=CC=CC=C21 3637-1-0L [0,1,0,1,0,0|1,0,1]=4 403 B14R2.3 C#CCN[C@@H]1CCC2=CC=CC=C21 3637-1-R0 [0,1,0,1,0,0|1,0,1]=4 404 B14R2.3 C#CCN[C@H]1CCC2=CC=CC=C21 3631-1-S0 [0,1,0,1,0,0|1,0,1]=4 405 B14R2.3 OCCCC1=CNC2=CC=CC=C12 4H01-1-3C [0,1,0,1,0,0|0,0,2]=4 406 B14R2.6 C1=CC(CC2CCCCN2)=CC=N1 3H31-1-FK [0,1,0,1,0,0|2,0,0]=4 407 B14R2.6 C1=CC(CC2CCNCC2)=CC=N1 3H31-5-Y4 [0,1,0,1,0,0|2,0,0]=4 408 B14R2.6 C1=CC=C(CC2CCCNC2)C=C1 3H31-5-62 [0,1,0,1,0,0|1,0,0]=3 409 B14R2.6 C1=CC=C(CC2COCCN2)C=C1 4H31-5-X2 [0,1,0,1,0,0|1,0,0]=3 410 B14R2.6 C1=CC=C(CN2CCCCC2)C=C1 3H32-1-KN [0,1,0,1,0,0|1,0,0]=3 411 B14R2.6 C1=CC=C(CN2CCNCC2)C=C1 3H32-1-37 [0,1,0,1,0,0|2,0,0]=4 412 B14R2.6 C1=CC=C(CN2CCNCC2)C=C1 3H32-5-44 [0,1,0,1,0,0|2,0,0]=4 413 B14R2.6 C1=CC=C(CN2CCOCC2)C=C1 4H32-1-0W [0,1,0,1,0,0|2,0,0]=4 414 B14R2.6 C1=CC=C(C[C@@H]2CCCCN2)C=C1 3H31-5-SE [0,1,0,1,0,0|1,0,0]=3 415 B14R2.6 C1=CC=C(C[C@@H]2COCCN2)C=C1 4H44-1-05 [0,1,0,1,0,0|1,0,0]=3 416 B14R2.6 C1=CC=C(C[C@H]2CCCCN2)C=C1 3H31-5-RE [0,1,0,1,0,0|1,0,0]=3 417 B14R2.6 C1=CC=C(NC2CCCCC2)C=C1 3631-5-X3 [0,1,0,1,0,0|1,0,0]=3 418 B14R2.6 C1=CC=C(NC2CCNCC2)C=C1 3H31-1-36 [0,1,0,1,0,0|2,0,0]=4 419 B14R2.6 C1=CC=C(OC2CCCNC2)C=C1 4H07-5-37 [0,1,0,1,0,0|2,0,0]=4 420 B14R2.6 C1=CC=C(SC2CCCNC2)C=C1 7H66-5-09 [0,1,0,1,0,0|2,0,0]=4 421 B14R2.6 C1=CC=C(SC2CCNCC2)C=C1 7H66-5-X0 [0,1,0,1,0,0|2,0,0]=4 422 B14R2.6 C1=CN=CC(CC2CCCNC2)=C1 3H31-5-Z4 [0,1,0,1,0,0|2,0,0]=4 423 B14R2.24 CC1=CC=CC=C1B2OCCCO2 6H60-1-39 [0,1,0,1,0,0|2,0,0]=4 424 B14R2.24 CN1CCNCC1C2=CC=CC=C2 3H32-1-JV [0,1,0,1,0,0|2,0,0]=4 425 B14R2.24 ClC1=CC=CC=C1C2CNCCS2 7H70-5-27 [0,1,0,1,0,0|1,1,0]=4 426 B14R2.24 ClC1=CC=CC=C1C2CSCCN2 7H70-5-28 [0,1,0,1,0,0|2,0,0]=4 427 B14R2.24 FC1=CC=CC=C1C2CCNCC2 3H44-3-16 [0,1,0,1,0,0|2,0,0]=4 428 B14R2.24 FC1=CC=CC=C1C2CNCCO2 4H44-3-02 [0,1,0,1,0,0|1,0,0]=3 429 B14R2.24 NC1=C(C2CCNCC2)C=CC=C1 3H30-5-8J [0,1,0,1,0,0|2,0,0]=4 430 B14R2.24 O=C1CCCCC1C2=CC=CC=C2 2617-1-1P [0,1,0,1,0,0|0,0,1]=3 431 B14R2.24 O=C1CCCCC1C2=CC=CC=N2 4H17-1-2D [0,1,0,1,0,0|1,0,1]=4 432 B14R2.24 O=C1CCNCC1C2=CC=CC=C2 4H56-5-BD [0,1,0,1,0,0|0,0,2]=4 433 B14R2.24 OC1=C(C2CCCCC2)C=CC=C1 2601-1-0X [0,1,0,1,0,0|1,0,0]=3 434 B14R2.24 OC1=C(C2CCNCC2)C=CC=C1 4H01-5-0H [0,1,0,1,0,0|2,0,0]=4 435 B14R2.24 OC1=CC=CC=C1N2CCCCC2 4H01-1-4D [0,1,0,1,0,0|2,0,0]=4 436 B14R2.24 O[C@@H]1CCCC[C@H]1C2=CC=CC=C2 2602-1-0C [0,1,0,1,0,0|0,0,0]=2 437 B14R2.30 O=C1CCCN1CC2=CC=CC=C2 4H48-1-WS [0,1,0,1,0,0|0,0,2]=4 438 B14R2.78 NCC1CCN1CC2=CC=CC=C2 3H30-1-VR [0,1,0,1,0,0|1,0,0]=3 439 B14R2.101 C1=CC(CCN2CCCC2)=CC=N1 3H32-1-8V [0,1,0,1,0,0|2,0,0]=4 440 B14R2.101 C1=CC=C(CCC2CCCN2)C=C1 3H31-1-T2 [0,1,0,1,0,0|1,0,0]=3 441 B14R2.101 C1=CC=C(CCC2CCNC2)C=C1 3631-1-X1 [0,1,0,1,0,0|1,0,0]=3 442 B14R2.101 C1=CC=C(COC2CCCC2)C=C1 2607-1-37 [0,1,0,1,0,0|1,0,0]=3 443 B14R2.101 C1=CC=C(OCC2OCCO2)C=C1 2H10-1-03 [0,1,0,1,0,0|1,0,0]=3 444 B14R2.3018 C1=CC=C(COCCC2CO2)C=C1 2609-1-03 [0,1,0,1,0,0|0,0,0]=2 445 B14R2.7150 N#CCC1NCCC2=CC=CC=C21 3H37-5-50 [0,1,0,1,0,0|1,0,1]=4 446 B14R2.7150 NCCN1CCCC2=CC=CC=C21 3H30-1-PM [0,1,0,1,0,0|1,0,0]=3 447 B14R2.112 NCCC1COC2=CC=CC=C2O1 4H30-1-A5 [0,1,0,1,0,0|2,0,0]=4 448 B14R2.112 NCCN1CCC2=CC=CC=C2C1 3H30-1-NF [0,1,0,1,0,0|2,0,0]=4 449 B14R2.436 N[C@H]1C[C@@H](OCC2=CC=CC=C2)C1 4630-1-0R [0,1,0,1,0,0|2,0,0]=4 450 B14R2.436 N[C@H]1C[C@H](OCC2=CC=CC=C2)C1 4656-1-EA [0,1,0,1,0,0|2,0,0]=4 451 B14R2.436 OC1CC(OCC2=CC=CC=C2)C1 2607-1-15 [0,1,0,1,0,0|1,0,0]=3 452 B14R2.19 BrC1CCN(CC2=CC=CC=C2)C1 3H32-9-BD [0,1,0,1,0,0|2,0,0]=4 453 B14R2.19 NC1CCN(CC2=CC=CC=C2)C1 3H30-1-AC [0,1,0,1,0,0|2,0,0]=4 454 B14R2.19 N[C@H]1CCN(CC2=CC=CC=C2)C1 3H30-1-S1 [0,1,0,1,0,0|2,0,0]=4 455 B14R2.19 O[C@@H]1CCN(CC2=CC=CC=C2)C1 4H02-1-R2 [0,1,0,1,0,0|1,0,0]=3 456 B14R2.19 O[C@H]1CCN(CC2=CC=CC=C2)C1 4H02-1-S1 [0,1,0,1,0,0|1,0,0]=3 457 B14R2.67 OCCCC1=NC2=CC=CC=C2N1 4H01-1-0S [0,1,0,1,0,0|1,0,1]=4 458 B14R2.2 O=C(O)CC1CCC2=C1C=CC=C2 2621-1-3H [0,1,0,1,0,0|0,0,1]=3 459 B14R2.2 O=C(O)CN1CCC2=CC=CC=C21 4H21-5-65 [0,1,0,1,0,0|1,0,1]=4 460 B14R2.31359 O=C(O)C1CCCC2=CC=CC=C21 2621-1-0D [0,1,0,1,0,0|0,0,1]=3 461 B14R2.31359 O=C(O)C1CCNC2=CC=CC=C21 4H58-1-085 [0,1,0,1,0,0|1,0,1]=4 462 B14R2.31359 O=C(O)C1NCCC2=C1C=CC=C2 4H56-1-GJ [0,1,0,1,0,0|1,0,1]=4 463 B14R2.31359 O=C(O)C1OCCC2=C1C=CC=C2 2H21-1-1B [0,1,0,1,0,0|1,0,1]=4 464 B14R2.31359 O=C(O)[C@@H]1CCCC2=CC=CC=C21 2621-1-R7 [0,1,0,1,0,0|0,0,1]=3 465 B14R2.31359 O=C(O)[C@@H]1NCCC2=C1C=CC=C2 4H21-1-65 [0,1,0,1,0,0|1,0,1]=4 466 B14R2.31359 O=C(O)[C@H]1CCCC2=CC=CC=C21 2721-1-S1 [0,1,0,1,0,0|0,0,1]=3 467 B14R2.50 FC1=C(CC2CCCN2)C=CC=C1 3H31-3-8V [0,1,0,1,0,0|1,0,0]=3 468 B14R2.50 NC1=C(CN2CCCC2)C=CC=C1 3H30-1-22 [0,1,0,1,0,0|2,0,0]=4 469 B14R2.3459 NCC1(O)CCCC2=CC=CC=C21 3630-5-19 [0,1,0,1,0,0|1,0,0]=3 470 B14R3.2544 C1=CC=C2C(=C1)C3CC[NH+]2CC3 3H33-5-09 [0,0,0,2,0,0|2,0,0]=4 471 B10R1.21 CCCCCC1=CC=CO1 2H10-1-16 [1,0,0,0,1,0|1,0,0]=3 472 B10R1.21 CCCCCC1=CC=CS1 5H66-1-14 [1,0,0,0,1,0|1,0,0]=3 473 B10R1.21 CCCCCN1C=CN=C1 3H32-1-FQ [1,0,0,0,1,0|2,0,0]=4 474 B10R1.21 CCCNCC1=CC=CS1 7H31-1-0J [1,0,0,0,1,0|2,0,0]=4