0 B13R1.14 C/C(=N\O)/COC1=CC=C(C=C1)Cl MCULE-5070086409 [0,0,0,0,0,0|2,0,1]=3 1 B13R1.14 CC(=NO)COC1=CC=C(C=C1)Cl MCULE-4634565615 [0,0,0,0,0,0|2,0,1]=3 2 B13R1.14 CC(CN)CSC1=CC=C(C=C1)Cl MCULE-9164172364 [0,0,0,0,0,0|2,1,0]=3 3 B13R1.14 CC1=CC=C(C=C1)OC/C(=N/O)/N MCULE-9785394592 [0,0,0,0,0,0|3,0,1]=4 4 B13R1.14 CC1=CC=C(C=C1)OCC(O)CN MCULE-2898356437 [0,0,0,0,0,0|2,0,0]=2 5 B13R1.14 CC1=CC=C(C=C1)OCC(O)CN MCULE-6724525740 [0,0,0,0,0,0|2,0,0]=2 6 B13R1.14 CCC(=O)CSC1=CC=C(C=C1)Cl MCULE-5134003532 [0,0,0,0,0,0|1,1,2]=4 7 B13R1.14 CCC(C)COC1=CC=C(C=C1)O MCULE-1443483595 [0,0,0,0,0,0|3,0,0]=3 8 B13R1.14 CCC(C)NCC1=CC=C(C=C1)Cl MCULE-1745673519 [0,0,0,0,0,0|4,0,0]=4 9 B13R1.14 CCC(C)NCC1=CC=C(C=C1)Cl MCULE-9053976057 [0,0,0,0,0,0|4,0,0]=4 10 B13R1.14 CC[C@H](C)COC1=CC=C(C=C1)N MCULE-8142971941 [0,0,0,0,0,0|3,0,0]=3 11 B13R1.14 CNC(=N)COC1=CC=C(C=C1)Cl MCULE-3108313368 [0,0,0,0,0,0|3,0,1]=4 12 B13R1.14 CNC(=N)COC1=CC=C(C=C1)Cl MCULE-3809496171 [0,0,0,0,0,0|3,0,1]=4 13 B13R1.14 CNC(C)CCC1=CC=C(C=C1)Cl MCULE-4813223068 [0,0,0,0,0,0|4,0,0]=4 14 B13R1.14 COC(=O)COC1=CC=C(C=C1)Cl MCULE-3738417589 [0,0,0,0,0,0|2,0,2]=4 15 B13R1.14 N/C(=N/O)/CSC1=CC=C(C=C1)Cl MCULE-9381318207 [0,0,0,0,0,0|2,1,1]=4 16 B13R1.14 N/C(=N\O)/COC1=CC=C(C=C1)Br MCULE-6188199615 [0,0,0,0,0,0|2,1,1]=4 17 B13R1.14 N/C(=N\O)/COC1=CC=C(C=C1)Cl MCULE-9259863187 [0,0,0,0,0,0|2,0,1]=3 18 B13R1.14 N/C(=N\O)/COC1=CC=C(C=C1)F MCULE-5936392982 [0,0,0,0,0,0|2,1,1]=4 19 B13R1.14 N=C(CSC1=CC=C(C=C1)Cl)NO MCULE-1591058634 [0,0,0,0,0,0|2,1,1]=4 20 B13R1.14 NC(CO)COC1=CC=C(C=C1)Br MCULE-2377647586 [0,0,0,0,0,0|1,1,0]=2 21 B13R1.14 NC(CO)COC1=CC=C(C=C1)Br MCULE-7242566637 [0,0,0,0,0,0|1,1,0]=2 22 B13R1.14 NCC(O)COC1=CC=C(C=C1)Br MCULE-5736258284 [0,0,0,0,0,0|1,1,0]=2 23 B13R1.14 NCC(O)COC1=CC=C(C=C1)Br MCULE-9185600564 [0,0,0,0,0,0|1,1,0]=2 24 B13R1.14 NCC(O)COC1=CC=C(C=C1)Cl MCULE-5894445408 [0,0,0,0,0,0|1,0,0]=1 25 B13R1.14 NCC(O)COC1=CC=C(C=C1)F MCULE-5142647957 [0,0,0,0,0,0|1,1,0]=2 26 B13R1.14 NCC(O)COC1=CC=C(C=C1)I MCULE-1752624376 [0,0,0,0,0,0|1,1,0]=2 27 B13R1.14 NNC(=O)COC1=CC=C(C=C1)Cl MCULE-7900568623 [0,0,0,0,0,0|2,0,2]=4 28 B13R1.14 O=C(CBr)COC1=CC=C(C=C1)Br MCULE-1263759838 [0,0,0,0,0,0|1,1,2]=4 29 B13R1.14 O=C(CBr)COC1=CC=C(C=C1)F MCULE-4003016897 [0,0,0,0,0,0|1,1,2]=4 30 B13R1.14 O=C(CCl)COC1=CC=C(C=C1)Cl MCULE-8569526882 [0,0,0,0,0,0|1,0,2]=3 31 B13R1.14 O=C(COC1=CC=C(C=C1)Br)NO MCULE-1040741480 [0,0,0,0,0,0|1,1,2]=4 32 B13R1.14 OC(CCl)CCC1=CC=C(C=C1)Cl MCULE-2252000178 [0,0,0,0,0,0|2,0,0]=2 33 B13R1.14 OC(CCl)COC1=CC=C(C=C1)F MCULE-7738166120 [0,0,0,0,0,0|1,1,0]=2 34 B13R1.14 OC(CCl)NCC1=CC=C(C=C1)F MCULE-9836354725 [0,0,0,0,0,0|3,1,0]=4 35 B13R1.14 OCC(O)COC1=CC=C(C=C1)Br MCULE-5196956323 [0,0,0,0,0,0|0,1,0]=1 36 B13R1.14 OCC(O)COC1=CC=C(C=C1)Cl MCULE-1985229890 [0,0,0,0,0,0|0,0,0]=0 37 B13R1.14 O[C@H](CCl)COC1=CC=C(C=C1)F MCULE-9905991343 [0,0,0,0,0,0|1,1,0]=2 38 B13R1.14 [C@H](O)(CCl)COC1=CC=C(C=C1)F MCULE-2067197311 [0,0,0,0,0,0|1,1,0]=2 39 B12R1.1 BrC1=CC=C(C=C1)CCCCI MCULE-6185687600 [1,0,0,0,0,0|2,1,0]=4 40 B12R1.1 BrCCCCC1=CC=C(C=C1)Br MCULE-5711818711 [1,0,0,0,0,0|2,1,0]=4 41 B12R1.1 BrCCCOC1=CC=C(C=C1)Br MCULE-6269131573 [1,0,0,0,0,0|1,1,0]=3 42 B12R1.1 C=CCCCC1=CC=C(C=C1)Cl MCULE-8420862160 [1,0,0,0,0,0|2,0,1]=4 43 B12R1.1 C=CCCOC1=CC=C(C=C1)Br MCULE-9205866192 [1,0,0,0,0,0|1,1,1]=4 44 B12R1.1 C=CCCOC1=CC=C(C=C1)I MCULE-3830838207 [1,0,0,0,0,0|1,1,1]=4 45 B12R1.1 C=CCCOC1=CC=C(C=C1)N MCULE-3018482293 [1,0,0,0,0,0|2,0,1]=4 46 B12R1.1 C=CCCOC1=CC=C(C=C1)O MCULE-8187531592 [1,0,0,0,0,0|2,0,1]=4 47 B12R1.1 CC1=CC=C(C=C1)C#CCCO MCULE-1260585835 [1,0,0,0,0,0|2,0,1]=4 48 B12R1.1 CC1=CC=C(C=C1)CCCCN MCULE-5265503935 [1,0,0,0,0,0|3,0,0]=4 49 B12R1.1 CC1=CC=C(C=C1)CNCCO MCULE-5043645456 [1,0,0,0,0,0|3,0,0]=4 50 B12R1.1 CC1=CC=C(C=C1)CNCCO MCULE-5810967464 [1,0,0,0,0,0|3,0,0]=4 51 B12R1.1 CC1=CC=C(C=C1)CSCCO MCULE-1725502806 [1,0,0,0,0,0|3,0,0]=4 52 B12R1.1 CC1=CC=C(C=C1)OCCC#N MCULE-5149047724 [1,0,0,0,0,0|2,0,1]=4 53 B12R1.1 CC1=CC=C(C=C1)OCCCBr MCULE-4566556104 [1,0,0,0,0,0|2,0,0]=3 54 B12R1.1 CC1=CC=C(C=C1)OCCCN MCULE-5477766782 [1,0,0,0,0,0|2,0,0]=3 55 B12R1.1 CC1=CC=C(C=C1)OCCCN MCULE-9443588391 [1,0,0,0,0,0|2,0,0]=3 56 B12R1.1 CC1=CC=C(C=C1)OCCCO MCULE-7709322159 [1,0,0,0,0,0|1,0,0]=2 57 B12R1.1 CC1=CC=C(C=C1)OCCCS MCULE-3508003621 [1,0,0,0,0,0|1,1,0]=3 58 B12R1.1 CC1=CC=C(C=C1)SCCCN MCULE-6158946738 [1,0,0,0,0,0|2,1,0]=4 59 B12R1.1 CC1=NC=C(C=C1)OCCCN MCULE-7298210201 [1,0,0,0,0,0|3,0,0]=4 60 B12R1.1 CC1=NC=C(C=C1)OCCCN MCULE-8211733551 [1,0,0,0,0,0|3,0,0]=4 61 B12R1.1 CCCC#CC1=CC=C(C=C1)Cl MCULE-2469018584 [1,0,0,0,0,0|2,0,1]=4 62 B12R1.1 CCCCCC1=CC=C(C=C1)Br MCULE-6002180162 [1,0,0,0,0,0|2,1,0]=4 63 B12R1.1 CCCCCC1=CC=C(C=C1)Cl MCULE-8705075866 [1,0,0,0,0,0|2,0,0]=3 64 B12R1.1 CCCCCC1=CC=C(C=C1)F MCULE-5175147071 [1,0,0,0,0,0|2,1,0]=4 65 B12R1.1 CCCCCC1=CC=C(C=C1)I MCULE-1115407306 [1,0,0,0,0,0|2,1,0]=4 66 B12R1.1 CCCCCC1=CC=C(C=C1)N MCULE-8970105380 [1,0,0,0,0,0|3,0,0]=4 67 B12R1.1 CCCCCC1=CC=C(C=C1)O MCULE-8456321538 [1,0,0,0,0,0|3,0,0]=4 68 B12R1.1 CCCCNC1=CN=C(C=C1)Cl MCULE-4747765756 [1,0,0,0,0,0|3,0,0]=4 69 B12R1.1 CCCCOC1=CC=C(C=C1)Br MCULE-9549321149 [1,0,0,0,0,0|1,1,0]=3 70 B12R1.1 CCCCOC1=CC=C(C=C1)C MCULE-7541981253 [1,0,0,0,0,0|2,0,0]=3 71 B12R1.1 CCCCOC1=CC=C(C=C1)Cl MCULE-9791852542 [1,0,0,0,0,0|1,0,0]=2 72 B12R1.1 CCCCOC1=CC=C(C=C1)I MCULE-7908144555 [1,0,0,0,0,0|1,1,0]=3 73 B12R1.1 CCCCOC1=CC=C(C=C1)N MCULE-7144214119 [1,0,0,0,0,0|2,0,0]=3 74 B12R1.1 CCCCOC1=CC=C(C=C1)O MCULE-2788753406 [1,0,0,0,0,0|2,0,0]=3 75 B12R1.1 CCCCOC1=CC=C(C=C1)S MCULE-3826990607 [1,0,0,0,0,0|2,0,0]=3 76 B12R1.1 CCCCOC1=CC=C(N=N1)Cl MCULE-7788137546 [1,0,0,0,0,0|3,0,0]=4 77 B12R1.1 CCCCOC1=CN=C(C=C1)Br MCULE-3543698633 [1,0,0,0,0,0|2,1,0]=4 78 B12R1.1 CCCCOC1=CN=C(C=C1)Cl MCULE-2341290261 [1,0,0,0,0,0|2,0,0]=3 79 B12R1.1 CCCCOC1=NC=C(C=C1)Br MCULE-2535904781 [1,0,0,0,0,0|2,1,0]=4 80 B12R1.1 CCCCOC1=NC=C(C=C1)N MCULE-4590305039 [1,0,0,0,0,0|3,0,0]=4 81 B12R1.1 CCCCSC1=CC=C(C=C1)Br MCULE-5189550387 [1,0,0,0,0,0|1,2,0]=4 82 B12R1.1 CCCCSC1=CC=C(C=C1)N MCULE-3643820895 [1,0,0,0,0,0|2,1,0]=4 83 B12R1.1 CCCCSC1=CC=C(C=C1)N MCULE-9146644497 [1,0,0,0,0,0|2,1,0]=4 84 B12R1.1 CCCCSC1=CC=C(C=C1)S MCULE-1508004342 [1,0,0,0,0,0|2,1,0]=4 85 B12R1.1 CCCNCC1=CC=C(C=C1)Cl MCULE-4668059713 [1,0,0,0,0,0|3,0,0]=4 86 B12R1.1 CCCNCC1=CC=C(C=C1)Cl MCULE-7444662136 [1,0,0,0,0,0|3,0,0]=4 87 B12R1.1 CCNCCC1=CC=C(C=C1)Cl MCULE-5486426687 [1,0,0,0,0,0|3,0,0]=4 88 B12R1.1 CNCCCC1=CC=C(C=C1)Cl MCULE-7703874160 [1,0,0,0,0,0|3,0,0]=4 89 B12R1.1 CNCCOC1=CC=C(C=C1)Br MCULE-1769461316 [1,0,0,0,0,0|2,1,0]=4 90 B12R1.1 CNCCOC1=CC=C(C=C1)C MCULE-8024420624 [1,0,0,0,0,0|3,0,0]=4 91 B12R1.1 CNCCOC1=CC=C(C=C1)C MCULE-9238250369 [1,0,0,0,0,0|3,0,0]=4 92 B12R1.1 CNCCOC1=CC=C(C=C1)Cl MCULE-5685453428 [1,0,0,0,0,0|2,0,0]=3 93 B12R1.1 CNCCOC1=CC=C(C=C1)F MCULE-6731130804 [1,0,0,0,0,0|2,1,0]=4 94 B12R1.1 CNCCOC1=CC=C(C=C1)F MCULE-8031330355 [1,0,0,0,0,0|2,1,0]=4 95 B12R1.1 CNCCOC1=CC=C(C=C1)I MCULE-2464238803 [1,0,0,0,0,0|2,1,0]=4 96 B12R1.1 CNCCOC1=CC=C(C=C1)I MCULE-9184269545 [1,0,0,0,0,0|2,1,0]=4 97 B12R1.1 CNCCOC1=CC=C(C=C1)N MCULE-2859770364 [1,0,0,0,0,0|3,0,0]=4 98 B12R1.1 CNCCOC1=CC=C(C=C1)N MCULE-8654754918 [1,0,0,0,0,0|3,0,0]=4 99 B12R1.1 CNCCOC1=CC=C(C=C1)O MCULE-1273802285 [1,0,0,0,0,0|3,0,0]=4 100 B12R1.1 CNCCOC1=CC=C(C=C1)O MCULE-7676883331 [1,0,0,0,0,0|3,0,0]=4 101 B12R1.1 COCCOC1=CC=C(C=C1)Br MCULE-9776475287 [1,0,0,0,0,0|2,1,0]=4 102 B12R1.1 COCCOC1=CC=C(C=C1)I MCULE-4065589382 [1,0,0,0,0,0|2,1,0]=4 103 B12R1.1 COCCOC1=CC=C(C=C1)N MCULE-2518862939 [1,0,0,0,0,0|3,0,0]=4 104 B12R1.1 COCCOC1=CC=C(C=C1)N MCULE-8006382784 [1,0,0,0,0,0|3,0,0]=4 105 B12R1.1 COCCOC1=CC=C(C=C1)O MCULE-2789105139 [1,0,0,0,0,0|3,0,0]=4 106 B12R1.1 COCCOC1=CC=C(C=C1)S MCULE-2804548936 [1,0,0,0,0,0|3,0,0]=4 107 B12R1.1 COCCSC1=CC=C(C=C1)Cl MCULE-4633440213 [1,0,0,0,0,0|2,1,0]=4 108 B12R1.1 CSCCOC1=CC=C(C=C1)Br MCULE-3784176995 [1,0,0,0,0,0|2,1,0]=4 109 B12R1.1 ClC1=CC=C(C=C1)CCCCBr MCULE-6761397442 [1,0,0,0,0,0|2,0,0]=3 110 B12R1.1 ClC1=CC=C(C=C1)OCCCBr MCULE-6346887041 [1,0,0,0,0,0|1,0,0]=2 111 B12R1.1 ClC1=CC=C(C=C1)OCCCI MCULE-9400534993 [1,0,0,0,0,0|1,0,0]=2 112 B12R1.1 ClC=CCOC1=CC=C(C=C1)Cl MCULE-1922803734 [1,0,0,0,0,0|1,0,2]=4 113 B12R1.1 ClCCCOC1=CC=C(C=C1)Br MCULE-8068457059 [1,0,0,0,0,0|1,1,0]=3 114 B12R1.1 ClCCCSC1=CC=C(C=C1)Br MCULE-2038431623 [1,0,0,0,0,0|1,2,0]=4 115 B12R1.1 ClCCOCC1=CC=C(C=C1)Cl MCULE-9294187605 [1,0,0,0,0,0|3,0,0]=4 116 B12R1.1 FC1=CC=C(C=C1)CCCCBr MCULE-9099920436 [1,0,0,0,0,0|2,1,0]=4 117 B12R1.1 FC1=CC=C(C=C1)CCCCCl MCULE-7968412954 [1,0,0,0,0,0|2,1,0]=4 118 B12R1.1 FC1=CC=C(C=C1)CCCCI MCULE-5963177554 [1,0,0,0,0,0|2,1,0]=4 119 B12R1.1 FC1=CC=C(C=C1)OCCCBr MCULE-5487431967 [1,0,0,0,0,0|1,1,0]=3 120 B12R1.1 FC1=CC=C(C=C1)OCCCCl MCULE-6755412863 [1,0,0,0,0,0|1,1,0]=3 121 B12R1.1 FC1=CC=C(C=C1)SCCCBr MCULE-8045255947 [1,0,0,0,0,0|1,2,0]=4 122 B12R1.1 FCCCOC1=CC=C(C=C1)I MCULE-7086539211 [1,0,0,0,0,0|1,1,0]=3 123 B12R1.1 N#CCCNC1=CC=C(C=C1)Cl MCULE-3238530741 [1,0,0,0,0,0|2,0,1]=4 124 B12R1.1 N#CCCOC1=CC=C(C=C1)Br MCULE-6480828215 [1,0,0,0,0,0|1,1,1]=4 125 B12R1.1 N#CCCOC1=CC=C(C=C1)Cl MCULE-6167580820 [1,0,0,0,0,0|1,0,1]=3 126 B12R1.1 N#CCCOC1=CC=C(C=C1)F MCULE-2228346765 [1,0,0,0,0,0|1,1,1]=4 127 B12R1.1 N#CCCSC1=CC=C(C=C1)Cl MCULE-2676539016 [1,0,0,0,0,0|1,1,1]=4 128 B12R1.1 N(CCO)CC1=CC=C(C=C1)Br MCULE-1782578881 [1,0,0,0,0,0|2,1,0]=4 129 B12R1.1 NC1=CC=C(C=C1)CCCCO MCULE-3059080015 [1,0,0,0,0,0|2,0,0]=3 130 B12R1.1 NC1=CC=C(C=C1)COCCO MCULE-8808035118 [1,0,0,0,0,0|3,0,0]=4 131 B12R1.1 NC1=CC=C(C=C1)OCCCBr MCULE-6988768902 [1,0,0,0,0,0|2,0,0]=3 132 B12R1.1 NC1=CC=C(C=C1)OCCCO MCULE-1993173792 [1,0,0,0,0,0|1,0,0]=2 133 B12R1.1 NC1=CC=C(C=C1)SCCCO MCULE-1800885805 [1,0,0,0,0,0|1,1,0]=3 134 B12R1.1 NC1=CN=C(C=C1)NCCCO MCULE-8822622385 [1,0,0,0,0,0|3,0,0]=4 135 B12R1.1 NC1=CN=C(C=C1)NCCCO MCULE-9191142868 [1,0,0,0,0,0|3,0,0]=4 136 B12R1.1 NCCCCC1=CC=C(C=C1)Br MCULE-7791570338 [1,0,0,0,0,0|2,1,0]=4 137 B12R1.1 NCCCCC1=CC=C(C=C1)Cl MCULE-6697094830 [1,0,0,0,0,0|2,0,0]=3 138 B12R1.1 NCCCCC1=CC=C(C=C1)Cl MCULE-6928037348 [1,0,0,0,0,0|2,0,0]=3 139 B12R1.1 NCCCCC1=CC=C(C=C1)F MCULE-3444273774 [1,0,0,0,0,0|2,1,0]=4 140 B12R1.1 NCCCCC1=CC=C(C=C1)O MCULE-4000188123 [1,0,0,0,0,0|3,0,0]=4 141 B12R1.1 NCCCNC1=NC=C(C=C1)Cl MCULE-1196057241 [1,0,0,0,0,0|3,0,0]=4 142 B12R1.1 NCCCOC1=CC=C(C=C1)Br MCULE-4651481116 [1,0,0,0,0,0|1,1,0]=3 143 B12R1.1 NCCCOC1=CC=C(C=C1)Br MCULE-7275016026 [1,0,0,0,0,0|1,1,0]=3 144 B12R1.1 NCCCOC1=CC=C(C=C1)Cl MCULE-3072823574 [1,0,0,0,0,0|1,0,0]=2 145 B12R1.1 NCCCOC1=CC=C(C=C1)Cl MCULE-3897690853 [1,0,0,0,0,0|1,0,0]=2 146 B12R1.1 NCCCOC1=CC=C(C=C1)F MCULE-3183250453 [1,0,0,0,0,0|1,1,0]=3 147 B12R1.1 NCCCOC1=CC=C(C=C1)F MCULE-4114794145 [1,0,0,0,0,0|1,1,0]=3 148 B12R1.1 NCCCOC1=CC=C(N=C1)F MCULE-5429609024 [1,0,0,0,0,0|2,1,0]=4 149 B12R1.1 NCCCOC1=CN=C(C=C1)F MCULE-7126932961 [1,0,0,0,0,0|2,1,0]=4 150 B12R1.1 NCCCOC1=CN=C(C=C1)N MCULE-8119793256 [1,0,0,0,0,0|3,0,0]=4 151 B12R1.1 NCCCSC1=CC=C(C=C1)Cl MCULE-7022356506 [1,0,0,0,0,0|1,1,0]=3 152 B12R1.1 NCCCSC1=CC=C(C=C1)F MCULE-8733793775 [1,0,0,0,0,0|1,2,0]=4 153 B12R1.1 NCCCSC1=CC=C(C=C1)F MCULE-9941719728 [1,0,0,0,0,0|1,2,0]=4 154 B12R1.1 NCCNCC1=CC=C(C=C1)Cl MCULE-6913109406 [1,0,0,0,0,0|3,0,0]=4 155 B12R1.1 NCCOCC1=CC=C(C=C1)Cl MCULE-7782520432 [1,0,0,0,0,0|3,0,0]=4 156 B12R1.1 NCCOCC1=CC=C(C=C1)Cl MCULE-8015070590 [1,0,0,0,0,0|3,0,0]=4 157 B12R1.1 NCCSCC1=CC=C(C=C1)Cl MCULE-2539940911 [1,0,0,0,0,0|3,0,0]=4 158 B12R1.1 NCCSCC1=CC=C(C=C1)Cl MCULE-2778737556 [1,0,0,0,0,0|3,0,0]=4 159 B12R1.1 NNCCOC1=CC=C(C=C1)Cl MCULE-5166118743 [1,0,0,0,0,0|2,0,0]=3 160 B12R1.1 NNCCOC1=CC=C(C=C1)Cl MCULE-6774715276 [1,0,0,0,0,0|2,0,0]=3 161 B12R1.1 NOCCOC1=CC=C(C=C1)Br MCULE-2385190415 [1,0,0,0,0,0|2,1,0]=4 162 B12R1.1 O=CCCCC1=CC=C(C=C1)Cl MCULE-1857271582 [1,0,0,0,0,0|1,0,2]=4 163 B12R1.1 O=CCCOC1=CC=C(C=C1)Cl MCULE-6678784478 [1,0,0,0,0,0|0,0,2]=3 164 B12R1.1 OC1=CC=C(C=C1)OCCCBr MCULE-1751518826 [1,0,0,0,0,0|2,0,0]=3 165 B12R1.1 OCCC#CC1=CC=C(C=C1)Cl MCULE-3546200529 [1,0,0,0,0,0|1,0,1]=3 166 B12R1.1 OCCC#CC1=CC=C(C=C1)F MCULE-9235241064 [1,0,0,0,0,0|1,1,1]=4 167 B12R1.1 OCCCCC1=CC=C(C=C1)Br MCULE-6127744393 [1,0,0,0,0,0|1,1,0]=3 168 B12R1.1 OCCCCC1=CC=C(C=C1)F MCULE-5160690383 [1,0,0,0,0,0|1,1,0]=3 169 B12R1.1 OCCCCC1=CC=C(C=C1)O MCULE-4460665362 [1,0,0,0,0,0|2,0,0]=3 170 B12R1.1 OCCCNC1=CC=C(C=C1)Cl MCULE-2660436567 [1,0,0,0,0,0|1,0,0]=2 171 B12R1.1 OCCCNC1=NC=C(C=C1)Br MCULE-6029704917 [1,0,0,0,0,0|2,1,0]=4 172 B12R1.1 OCCCOC1=CC=C(C=C1)Br MCULE-5179754471 [1,0,0,0,0,0|0,1,0]=2 173 B12R1.1 OCCCOC1=CC=C(C=C1)Cl MCULE-2660721683 [1,0,0,0,0,0|0,0,0]=1 174 B12R1.1 OCCCOC1=CC=C(C=C1)F MCULE-2279899178 [1,0,0,0,0,0|0,1,0]=2 175 B12R1.1 OCCCOC1=CC=C(C=C1)I MCULE-1239233152 [1,0,0,0,0,0|0,1,0]=2 176 B12R1.1 OCCCOC1=CC=C(C=C1)O MCULE-7677000457 [1,0,0,0,0,0|1,0,0]=2 177 B12R1.1 OCCCOC1=CC=C(N=C1)F MCULE-8573812520 [1,0,0,0,0,0|1,1,0]=3 178 B12R1.1 OCCCOC1=NC=C(C=C1)Br MCULE-8313492283 [1,0,0,0,0,0|1,1,0]=3 179 B12R1.1 OCCCSC1=CC=C(C=C1)Br MCULE-7490523123 [1,0,0,0,0,0|0,2,0]=3 180 B12R1.1 OCCCSC1=CC=C(C=C1)Cl MCULE-8305954042 [1,0,0,0,0,0|0,1,0]=2 181 B12R1.1 OCCCSC1=CC=C(C=C1)F MCULE-7371521641 [1,0,0,0,0,0|0,2,0]=3 182 B12R1.1 OCCNCC1=CC=C(C=C1)Br MCULE-9033721938 [1,0,0,0,0,0|2,1,0]=4 183 B12R1.1 OCCNCC1=CC=C(C=C1)Cl MCULE-1133597542 [1,0,0,0,0,0|2,0,0]=3 184 B12R1.1 OCCNCC1=CC=C(C=C1)Cl MCULE-7609927332 [1,0,0,0,0,0|2,0,0]=3 185 B12R1.1 OCCNCC1=CC=C(C=C1)F MCULE-3759160457 [1,0,0,0,0,0|2,1,0]=4 186 B12R1.1 OCCNCC1=CC=C(C=C1)F MCULE-6800441964 [1,0,0,0,0,0|2,1,0]=4 187 B12R1.1 OCCNCC1=CC=C(N=C1)Cl MCULE-2998672341 [1,0,0,0,0,0|3,0,0]=4 188 B12R1.1 OCCOCC1=CC=C(C=C1)Br MCULE-4082736797 [1,0,0,0,0,0|2,1,0]=4 189 B12R1.1 OCCOCC1=CC=C(C=C1)Cl MCULE-5397647382 [1,0,0,0,0,0|2,0,0]=3 190 B12R1.1 OCCSCC1=CC=C(C=C1)Br MCULE-2165163590 [1,0,0,0,0,0|2,1,0]=4 191 B12R1.1 OCCSCC1=CC=C(C=C1)Cl MCULE-4390720537 [1,0,0,0,0,0|2,0,0]=3 192 B12R1.1 OCCSCC1=CC=C(C=C1)F MCULE-3595880435 [1,0,0,0,0,0|2,1,0]=4 193 B12R1.21 C=C(C)CCC1=CC=C(C=C1)Cl MCULE-4308113169 [1,0,0,0,0,0|2,0,1]=4 194 B12R1.21 C=C(C)CNC1=CC=C(C=C1)Cl MCULE-6192235728 [1,0,0,0,0,0|2,0,1]=4 195 B12R1.21 C=C(C)COC1=CC=C(C=C1)F MCULE-6325581603 [1,0,0,0,0,0|1,1,1]=4 196 B12R1.21 C=C(C)COC1=CC=C(C=C1)N MCULE-7033178988 [1,0,0,0,0,0|2,0,1]=4 197 B12R1.21 C=C(C)COC1=CC=C(C=C1)N MCULE-7232037248 [1,0,0,0,0,0|2,0,1]=4 198 B12R1.21 CC(=O)CCC1=CC=C(C=C1)Cl MCULE-7275025982 [1,0,0,0,0,0|1,0,2]=4 199 B12R1.21 CC(=O)COC1=CC=C(C=C1)Br MCULE-9922743680 [1,0,0,0,0,0|0,1,2]=4 200 B12R1.21 CC(=O)COC1=CC=C(C=C1)Cl MCULE-9629148904 [1,0,0,0,0,0|0,0,2]=3 201 B12R1.21 CC(=O)CSC1=CC=C(C=C1)Cl MCULE-4086873829 [1,0,0,0,0,0|0,1,2]=4 202 B12R1.21 CC(C)CCC1=CC=C(C=C1)N MCULE-9020886448 [1,0,0,0,0,0|3,0,0]=4 203 B12R1.21 CC(C)CNC1=CC=C(C=C1)Br MCULE-5660258266 [1,0,0,0,0,0|2,1,0]=4 204 B12R1.21 CC(C)CNC1=CC=C(C=C1)Cl MCULE-8117170064 [1,0,0,0,0,0|2,0,0]=3 205 B12R1.21 CC(C)CNC1=CC=C(C=C1)F MCULE-6306220583 [1,0,0,0,0,0|2,1,0]=4 206 B12R1.21 CC(C)COC1=CC=C(C=C1)Br MCULE-5668724033 [1,0,0,0,0,0|1,1,0]=3 207 B12R1.21 CC(C)COC1=CC=C(C=C1)F MCULE-9289541643 [1,0,0,0,0,0|1,1,0]=3 208 B12R1.21 CC(C)COC1=CC=C(C=C1)N MCULE-5788731882 [1,0,0,0,0,0|2,0,0]=3 209 B12R1.21 CC(C)COC1=CC=C(C=C1)N MCULE-8407409314 [1,0,0,0,0,0|2,0,0]=3 210 B12R1.21 CC(C)COC1=CC=C(C=C1)O MCULE-4226412599 [1,0,0,0,0,0|2,0,0]=3 211 B12R1.21 CC(C)COC1=CC=C(C=C1)S MCULE-2551312023 [1,0,0,0,0,0|2,0,0]=3 212 B12R1.21 CC(C)COC1=CC=C(N=C1)F MCULE-9235816869 [1,0,0,0,0,0|2,1,0]=4 213 B12R1.21 CC(C)COC1=CN=C(C=C1)Br MCULE-9557352601 [1,0,0,0,0,0|2,1,0]=4 214 B12R1.21 CC(C)COC1=CN=C(C=C1)N MCULE-3776012849 [1,0,0,0,0,0|3,0,0]=4 215 B12R1.21 CC(C)COC1=CN=C(N=C1)Cl MCULE-9261708866 [1,0,0,0,0,0|3,0,0]=4 216 B12R1.21 CC(C)COC1=NC=C(C=C1)Br MCULE-5164224743 [1,0,0,0,0,0|2,1,0]=4 217 B12R1.21 CC(C)COC1=NC=C(C=C1)N MCULE-7543218876 [1,0,0,0,0,0|3,0,0]=4 218 B12R1.21 CC(C)COC1=NC=C(C=C1)O MCULE-4593811866 [1,0,0,0,0,0|3,0,0]=4 219 B12R1.21 CC(C)CSC1=CC=C(C=C1)Br MCULE-2429263022 [1,0,0,0,0,0|1,2,0]=4 220 B12R1.21 CC(C)CSC1=CC=C(C=C1)S MCULE-9624527787 [1,0,0,0,0,0|2,1,0]=4 221 B12R1.21 CC(C)NCC1=CC=C(C=C1)Cl MCULE-8754491155 [1,0,0,0,0,0|3,0,0]=4 222 B12R1.21 CC(C)NCC1=CC=C(C=C1)Cl MCULE-9846983112 [1,0,0,0,0,0|3,0,0]=4 223 B12R1.21 CC(N)CCC1=CC=C(C=C1)Br MCULE-6111482459 [1,0,0,0,0,0|2,1,0]=4 224 B12R1.21 CC(N)CCC1=CC=C(C=C1)Br MCULE-6433808249 [1,0,0,0,0,0|2,1,0]=4 225 B12R1.21 CC(N)CCC1=CC=C(C=C1)Cl MCULE-4427273513 [1,0,0,0,0,0|2,0,0]=3 226 B12R1.21 CC(N)CCC1=CC=C(C=C1)F MCULE-4904835077 [1,0,0,0,0,0|2,1,0]=4 227 B12R1.21 CC(N)CCC1=CC=C(C=C1)I MCULE-1882757411 [1,0,0,0,0,0|2,1,0]=4 228 B12R1.21 CC(N)CCC1=CC=C(C=C1)I MCULE-6640289781 [1,0,0,0,0,0|2,1,0]=4 229 B12R1.21 CC(N)CCC1=CC=C(C=C1)O MCULE-4220057160 [1,0,0,0,0,0|3,0,0]=4 230 B12R1.21 CC(N)COC1=CC=C(C=C1)Br MCULE-3502892922 [1,0,0,0,0,0|1,1,0]=3 231 B12R1.21 CC(N)COC1=CC=C(C=C1)Cl MCULE-4976258940 [1,0,0,0,0,0|1,0,0]=2 232 B12R1.21 CC(N)COC1=CC=C(C=C1)Cl MCULE-5296469326 [1,0,0,0,0,0|1,0,0]=2 233 B12R1.21 CC(N)COC1=CC=C(C=C1)F MCULE-4404536611 [1,0,0,0,0,0|1,1,0]=3 234 B12R1.21 CC(O)/C=C/C1=CC=C(C=C1)Br MCULE-8529912157 [1,0,0,0,0,0|1,1,1]=4 235 B12R1.21 CC(O)C#CC1=CC=C(C=C1)Cl MCULE-9086476586 [1,0,0,0,0,0|1,0,1]=3 236 B12R1.21 CC(O)C#CC1=CC=C(C=C1)F MCULE-2255924453 [1,0,0,0,0,0|1,1,1]=4 237 B12R1.21 CC(O)CCC1=CC=C(C=C1)Br MCULE-2162811740 [1,0,0,0,0,0|1,1,0]=3 238 B12R1.21 CC(O)CCC1=CC=C(C=C1)Cl MCULE-6029302606 [1,0,0,0,0,0|1,0,0]=2 239 B12R1.21 CC(O)CCC1=CC=C(C=C1)O MCULE-1743643873 [1,0,0,0,0,0|2,0,0]=3 240 B12R1.21 CC(O)COC1=CC=C(C=C1)Cl MCULE-1438026372 [1,0,0,0,0,0|0,0,0]=1 241 B12R1.21 CC(O)CSC1=CC=C(C=C1)Cl MCULE-4992180169 [1,0,0,0,0,0|0,1,0]=2 242 B12R1.21 CC1=CC=C(C=C1)C#CC(C)O MCULE-1469546557 [1,0,0,0,0,0|2,0,1]=4 243 B12R1.21 CC1=CC=C(C=C1)CCC(C)N MCULE-9545862036 [1,0,0,0,0,0|3,0,0]=4 244 B12R1.21 CC1=CC=C(C=C1)NCC(C)C MCULE-3565417490 [1,0,0,0,0,0|3,0,0]=4 245 B12R1.21 CC1=CC=C(C=C1)NCC(C)C MCULE-7804204848 [1,0,0,0,0,0|3,0,0]=4 246 B12R1.21 CC1=CC=C(C=C1)OCC(=O)O MCULE-6655773819 [1,0,0,0,0,0|1,0,2]=4 247 B12R1.21 CC1=CC=C(C=C1)OCC(C)N MCULE-1538133670 [1,0,0,0,0,0|2,0,0]=3 248 B12R1.21 CC1=CC=C(C=C1)OCC(C)N MCULE-4155467310 [1,0,0,0,0,0|2,0,0]=3 249 B12R1.21 CC1=CC=C(C=C1)OCC(C)O MCULE-6186322684 [1,0,0,0,0,0|1,0,0]=2 250 B12R1.21 CC1=CC=C(C=C1)SCC(C)N MCULE-2188428822 [1,0,0,0,0,0|2,1,0]=4 251 B12R1.21 C[C@@H](N)CCC1=CC=C(C=C1)O MCULE-3551661935 [1,0,0,0,0,0|3,0,0]=4 252 B12R1.21 C[C@@H](N)CCC1=CC=C(C=C1)O MCULE-5189739309 [1,0,0,0,0,0|3,0,0]=4 253 B12R1.21 C[C@@H](N)COC1=CC=C(C=C1)F MCULE-4245908705 [1,0,0,0,0,0|1,1,0]=3 254 B12R1.21 C[C@@H](O)CCC1=CC=C(C=C1)Cl MCULE-1876186806 [1,0,0,0,0,0|1,0,0]=2 255 B12R1.21 C[C@@H](O)CCC1=CC=C(C=C1)Cl MCULE-3275461399 [1,0,0,0,0,0|1,0,0]=2 256 B12R1.21 C[C@@H](O)CCC1=CC=C(C=C1)O MCULE-5901999576 [1,0,0,0,0,0|2,0,0]=3 257 B12R1.21 C[C@@H](O)CCC1=CC=C(C=C1)O MCULE-8613264387 [1,0,0,0,0,0|2,0,0]=3 258 B12R1.21 C[C@H](O)CCC1=CC=C(C=C1)O MCULE-4216892656 [1,0,0,0,0,0|2,0,0]=3 259 B12R1.21 C[C@H](O)CCC1=CC=C(C=C1)O MCULE-8670625635 [1,0,0,0,0,0|2,0,0]=3 260 B12R1.21 FC(F)COC1=CC=C(C=C1)Br MCULE-6096844815 [1,0,0,0,0,0|2,1,0]=4 261 B12R1.21 FC(F)COC1=CC=C(C=C1)I MCULE-9181502063 [1,0,0,0,0,0|2,1,0]=4 262 B12R1.21 FC(F)COC1=CC=C(N=C1)Cl MCULE-3124503037 [1,0,0,0,0,0|3,0,0]=4 263 B12R1.21 N=C(N)COC1=CC=C(C=C1)Cl MCULE-8834081415 [1,0,0,0,0,0|2,0,1]=4 264 B12R1.21 N=C(N)COC1=CC=C(C=C1)Cl MCULE-9946614972 [1,0,0,0,0,0|2,0,1]=4 265 B12R1.21 NC(=O)COC1=CC=C(C=C1)Cl MCULE-4869532442 [1,0,0,0,0,0|1,0,2]=4 266 B12R1.21 NC(=S)COC1=CC=C(C=C1)Cl MCULE-3175411035 [1,0,0,0,0,0|1,1,1]=4 267 B12R1.21 NC1=CC=C(C=C1)OCC(=O)O MCULE-5505108288 [1,0,0,0,0,0|1,0,2]=4 268 B12R1.21 NC1=CC=C(C=C1)OCC(F)F MCULE-5969588723 [1,0,0,0,0,0|3,0,0]=4 269 B12R1.21 NC1=CC=C(C=C1)OCC(F)F MCULE-8750463241 [1,0,0,0,0,0|3,0,0]=4 270 B12R1.21 O=C(Cl)COC1=CC=C(C=C1)Cl MCULE-5734605698 [1,0,0,0,0,0|1,0,2]=4 271 B12R1.21 O=C(O)CCC1=CC=C(C=C1)Cl MCULE-1600813005 [1,0,0,0,0,0|1,0,2]=4 272 B12R1.21 O=C(O)CNC1=CC=C(C=C1)Cl MCULE-7511412994 [1,0,0,0,0,0|1,0,2]=4 273 B12R1.21 O=C(O)CNC1=CC=C(C=C1)Cl MCULE-9676921611 [1,0,0,0,0,0|1,0,2]=4 274 B12R1.21 O=C(O)COC1=CC=C(C=C1)Br MCULE-1086285737 [1,0,0,0,0,0|0,1,2]=4 275 B12R1.21 O=C(O)COC1=CC=C(C=C1)Cl MCULE-9539789488 [1,0,0,0,0,0|0,0,2]=3 276 B12R1.21 O=C(O)COC1=CC=C(C=C1)F MCULE-9999059727 [1,0,0,0,0,0|0,1,2]=4 277 B12R1.21 O=C(O)COC1=CC=C(C=C1)I MCULE-2347603234 [1,0,0,0,0,0|0,1,2]=4 278 B12R1.21 O=C(O)COC1=CC=C(C=C1)O MCULE-1682652071 [1,0,0,0,0,0|1,0,2]=4 279 B12R1.21 O=C(O)COC1=CN=C(C=C1)Cl MCULE-7497981832 [1,0,0,0,0,0|1,0,2]=4 280 B12R1.21 O=C(O)COC1=NC=C(C=C1)Cl MCULE-1476293205 [1,0,0,0,0,0|1,0,2]=4 281 B12R1.21 O=C(O)CSC1=CC=C(C=C1)Cl MCULE-5442245504 [1,0,0,0,0,0|0,1,2]=4 282 B12R1.21 O=C([O-])COC1=CC=C(C=C1)Cl MCULE-9943796876 [1,0,0,0,0,0|0,0,3]=4 283 B12R1.21 OB(O)/C=C/C1=CC=C(C=C1)Cl MCULE-2134656577 [1,0,0,0,0,0|2,0,1]=4 284 B12R1.21 OB(O)C=CC1=CC=C(C=C1)Cl MCULE-7576144829 [1,0,0,0,0,0|2,0,1]=4 285 B12R1.21 OC1=CC=C(C=C1)OCC(F)F MCULE-6386536472 [1,0,0,0,0,0|3,0,0]=4 286 B12R1.21 [C@@H](C)(O)COC1=CC=C(C=C1)F MCULE-1636871184 [1,0,0,0,0,0|0,1,0]=2 287 B12R1.21 [C@H](C)(O)COC1=CC=C(C=C1)F MCULE-2471780560 [1,0,0,0,0,0|0,1,0]=2 288 B12R1.27 C#CC(O)CCC1=CC=CC=C1 MCULE-5755162407 [1,0,0,0,0,0|2,0,1]=4 289 B12R1.27 C#C[C@H](O)CCC1=CC=CC=C1 MCULE-8377014160 [1,0,0,0,0,0|2,0,1]=4 290 B12R1.27 C=CC(O)CSC1=CC=CC=C1 MCULE-1471280182 [1,0,0,0,0,0|1,1,1]=4 291 B12R1.27 CC(CO)CCC1=CC=CC=C1 MCULE-6469270838 [1,0,0,0,0,0|2,0,0]=3 292 B12R1.27 CC(CO)COC1=CC=CC=C1 MCULE-4468639580 [1,0,0,0,0,0|1,0,0]=2 293 B12R1.27 CC(CO)NCC1=CC=CC=C1 MCULE-1902857827 [1,0,0,0,0,0|3,0,0]=4 294 B12R1.27 CC(CO)NCC1=CC=CC=C1 MCULE-3055324759 [1,0,0,0,0,0|3,0,0]=4 295 B12R1.27 CC(CO)OCC1=CC=CC=C1 MCULE-8625266464 [1,0,0,0,0,0|3,0,0]=4 296 B12R1.27 CC(COC1=CC=CC=C1)NN MCULE-2766062912 [1,0,0,0,0,0|3,0,0]=4 297 B12R1.27 CC(COC1=CC=CC=C1)NN MCULE-5769601908 [1,0,0,0,0,0|3,0,0]=4 298 B12R1.27 CCC(N)CCC1=CC=CC=C1 MCULE-2546669799 [1,0,0,0,0,0|3,0,0]=4 299 B12R1.27 CCC(N)CNC1=CC=CC=C1 MCULE-5095589807 [1,0,0,0,0,0|3,0,0]=4 300 B12R1.27 CCC(N)CSC1=CC=CC=C1 MCULE-9383829075 [1,0,0,0,0,0|2,1,0]=4 301 B12R1.27 CCC(O)C#CC1=CC=CC=C1 MCULE-7216360010 [1,0,0,0,0,0|2,0,1]=4 302 B12R1.27 CCC(O)CCC1=CN=CC=C1 MCULE-1533382502 [1,0,0,0,0,0|3,0,0]=4 303 B12R1.27 C[C@@H](CO)NCC1=CC=CC=C1 MCULE-6124782827 [1,0,0,0,0,0|3,0,0]=4 304 B12R1.27 C[C@@H](CO)NCC1=CC=CC=C1 MCULE-9966908901 [1,0,0,0,0,0|3,0,0]=4 305 B12R1.27 C[C@@H](CO)OCC1=CC=CC=C1 MCULE-1610645268 [1,0,0,0,0,0|3,0,0]=4 306 B12R1.27 C[C@@H](CO)OCC1=CC=CC=C1 MCULE-8538388512 [1,0,0,0,0,0|3,0,0]=4 307 B12R1.27 C[C@H](CO)NCC1=CC=CC=C1 MCULE-7444198296 [1,0,0,0,0,0|3,0,0]=4 308 B12R1.27 C[C@H](CO)NCC1=CC=CC=C1 MCULE-9319805277 [1,0,0,0,0,0|3,0,0]=4 309 B12R1.27 C[C@H](CO)OCC1=CC=CC=C1 MCULE-2997554093 [1,0,0,0,0,0|3,0,0]=4 310 B12R1.27 C[C@H](CO)OCC1=CC=CC=C1 MCULE-5595889168 [1,0,0,0,0,0|3,0,0]=4 311 B12R1.27 N#CC(O)CCC1=CC=CC=C1 MCULE-6823931694 [1,0,0,0,0,0|2,0,1]=4 312 B12R1.27 N/C(=N\O)/COC1=CC=CC=C1 MCULE-7017178957 [1,0,0,0,0,0|2,0,1]=4 313 B12R1.27 NC(CO)CCC1=CC=CC=C1 MCULE-6673850897 [1,0,0,0,0,0|2,0,0]=3 314 B12R1.27 NC(CO)CCC1=CC=NC=C1 MCULE-5974343480 [1,0,0,0,0,0|3,0,0]=4 315 B12R1.27 NCC(O)C=CC1=CC=CC=C1 MCULE-5882478715 [1,0,0,0,0,0|2,0,1]=4 316 B12R1.27 NCC(O)CCC1=CC=CC=C1 MCULE-1179789034 [1,0,0,0,0,0|2,0,0]=3 317 B12R1.27 NCC(O)COC1=CC=CC=C1 MCULE-6040203191 [1,0,0,0,0,0|1,0,0]=2 318 B12R1.27 NCC(O)COC1=CC=CC=C1 MCULE-9281419461 [1,0,0,0,0,0|1,0,0]=2 319 B12R1.27 NC[C@@H](O)COC1=CC=CC=C1 MCULE-7044532278 [1,0,0,0,0,0|1,0,0]=2 320 B12R1.27 NC[C@H](O)COC1=CC=CC=C1 MCULE-3308855758 [1,0,0,0,0,0|1,0,0]=2 321 B12R1.27 NC[C@H](O)COC1=CC=CC=C1 MCULE-7782154972 [1,0,0,0,0,0|1,0,0]=2 322 B12R1.27 N[C@@H](CO)CCC1=CC=CC=C1 MCULE-1937001414 [1,0,0,0,0,0|2,0,0]=3 323 B12R1.27 N[C@@H](CO)CCC1=CC=CC=C1 MCULE-1994503014 [1,0,0,0,0,0|2,0,0]=3 324 B12R1.27 N[C@H](CO)CCC1=CC=CC=C1 MCULE-3457504038 [1,0,0,0,0,0|2,0,0]=3 325 B12R1.27 N[C@H](CO)CCC1=CC=CC=C1 MCULE-9691986906 [1,0,0,0,0,0|2,0,0]=3 326 B12R1.27 O=C(CCl)COC1=CC=CC=C1 MCULE-6747260923 [1,0,0,0,0,0|1,0,2]=4 327 B12R1.27 O=C(COC1=CC=CC=C1)NO MCULE-9180977721 [1,0,0,0,0,0|1,0,2]=4 328 B12R1.27 OC(CCl)COC1=CC=CC=C1 MCULE-5650362399 [1,0,0,0,0,0|1,0,0]=2 329 B12R1.27 OC(CF)COC1=CC=CC=C1 MCULE-5882248742 [1,0,0,0,0,0|1,0,0]=2 330 B12R1.27 OCC(F)COC1=CC=CC=C1 MCULE-8634603114 [1,0,0,0,0,0|1,0,0]=2 331 B12R1.27 OCC(O)CCC1=CC=CN=C1 MCULE-3150087712 [1,0,0,0,0,0|2,0,0]=3 332 B12R1.27 OCC(O)COC1=CC=CC=C1 MCULE-7331561605 [1,0,0,0,0,0|0,0,0]=1 333 B12R1.27 OCC(O)CSC1=CC=CC=C1 MCULE-1671039702 [1,0,0,0,0,0|0,1,0]=2 334 B12R1.27 OC[C@H](O)COC1=CC=CC=C1 MCULE-7557155907 [1,0,0,0,0,0|0,0,0]=1 335 B14R1.5 CCC1=CC=C(C=C1)OCC(O)CN MCULE-6687792730 [0,1,0,0,0,0|2,0,0]=3 336 B14R1.5 CCC1=CC=C(C=C1)OCC(O)CN MCULE-9493989027 [0,1,0,0,0,0|2,0,0]=3 337 B14R1.5 COC1=CC=C(C=C1)OCC(O)CN MCULE-6823298540 [0,1,0,0,0,0|2,0,0]=3 338 B14R1.5 COC1=CC=C(C=C1)OCC(O)CO MCULE-4431151260 [0,1,0,0,0,0|1,0,0]=2 339 B14R1.10 CCC(O)OB(O)C1=CC=C(C=C1)Cl MCULE-2160000955 [0,1,0,0,0,0|3,0,0]=4 340 B14R1.134 CC(=NO)C(C)OC1=CC=C(C=C1)Cl MCULE-8677093155 [0,1,0,0,0,0|2,0,1]=4 341 B14R1.134 CC(OC1=CC=C(C=C1)Cl)/C(=N/O)/[NH3+] MCULE-8655422225 [0,1,0,0,0,0|2,0,1]=4 342 B14R1.134 CC(OC1=CC=C(C=C1)Cl)/C(=N\O)/N MCULE-4192132367 [0,1,0,0,0,0|2,0,1]=4 343 B14R1.293 CC(C)(CO)COC1=CC=C(C=C1)Br MCULE-5330985633 [0,1,0,0,0,0|1,1,0]=3 344 B14R1.293 CC(C)(CO)N=CC1=CC=C(C=C1)Cl MCULE-4976564454 [0,1,0,0,0,0|3,0,0]=4 345 B14R1.293 CC(C)(CO)NCC1=CC=C(C=C1)Cl MCULE-8411974820 [0,1,0,0,0,0|3,0,0]=4 346 B14R1.293 CC(N)(C#N)COC1=CC=C(C=C1)Cl MCULE-6754462392 [0,1,0,0,0,0|2,0,1]=4 347 B14R1.293 CCC(C)(O)C#CC1=CC=C(C=C1)Cl MCULE-3933644211 [0,1,0,0,0,0|2,0,1]=4 348 B14R1.293 N(CC1=CC=C(C=C1)Cl)C(C)(C)CO MCULE-7252358400 [0,1,0,0,0,0|3,0,0]=4 349 B14R1.502 CCCC(C)COC1=CC=C(C=C1)N MCULE-5638037769 [0,1,0,0,0,0|3,0,0]=4 350 B14R1.502 CCOC(=O)COC1=CC=C(C=C1)Cl MCULE-9387657861 [0,1,0,0,0,0|1,0,2]=4 351 B14R1.502 CNCC(O)COC1=CC=C(C=C1)C MCULE-7766702190 [0,1,0,0,0,0|2,0,0]=3 352 B14R1.502 COCC(O)CNC1=CC=C(C=C1)C MCULE-1652401658 [0,1,0,0,0,0|2,0,0]=3 353 B14R1.502 N#CCC(O)COC1=CC=C(C=C1)Cl MCULE-3092415597 [0,1,0,0,0,0|1,0,0]=2 354 B14R1.502 O[C@@H](C=CBr)COC1=CC=C(C=C1)F MCULE-6200532975 [0,1,0,0,0,0|1,1,1]=4 355 B14R1.529 CCC(CO)N=CC1=CC=C(C=C1)Cl MCULE-1885856684 [0,1,0,0,0,0|3,0,0]=4 356 B14R1.529 CCC(CO)NCC1=CC=C(C=C1)Cl MCULE-3075998388 [0,1,0,0,0,0|3,0,0]=4 357 B14R1.529 CCC(CO)NCC1=CC=C(C=C1)Cl MCULE-7453367634 [0,1,0,0,0,0|3,0,0]=4 358 B14R1.529 CC[C@H](CO)NCC1=CC=C(C=C1)Cl MCULE-4517607274 [0,1,0,0,0,0|3,0,0]=4 359 B14R1.529 CC[C@H](CO)NCC1=CC=C(C=C1)Cl MCULE-4813098260 [0,1,0,0,0,0|3,0,0]=4 360 B14R1.529 COC(COC1=CC=C(C=C1)Br)OC MCULE-5216477401 [0,1,0,0,0,0|2,1,0]=4 361 B14R1.529 OCC(CO)N=CC1=CC=C(C=C1)F MCULE-1372762022 [0,1,0,0,0,0|2,1,0]=4 362 B14R1.679 CC(C)C(O)C#CC1=CC=C(C=C1)Cl MCULE-1364174351 [0,1,0,0,0,0|2,0,1]=4 363 B14R1.679 CC(CSC1=CC=C(C=C1)Cl)C(=O)O MCULE-3112521304 [0,1,0,0,0,0|1,1,1]=4 364 B14R1.679 NC(CCC1=CC=C(C=C1)Cl)C(=O)O MCULE-3171400958 [0,1,0,0,0,0|2,0,1]=4 365 B14R1.679 N[C@@H](CCC1=CC=C(C=C1)Cl)C(=O)O MCULE-6279196888 [0,1,0,0,0,0|2,0,1]=4 366 B14R1.679 N[C@@H](CCC1=CC=C(C=C1)Cl)C(=O)O MCULE-9257393922 [0,1,0,0,0,0|2,0,1]=4 367 B14R1.727 CC(=NO)COC1=C(C=C(C=C1)Cl)Cl MCULE-2621633846 [0,1,0,0,0,0|2,0,1]=4 368 B14R1.727 CC1=CC(=C(C=C1)OCC(O)CN)C MCULE-3324012124 [0,1,0,0,0,0|2,0,0]=3 369 B14R1.727 CC1=CC(=C(C=C1)OCC(O)CN)C MCULE-4454495375 [0,1,0,0,0,0|2,0,0]=3 370 B14R1.727 CC1=CC(=CC=C1OC/C(=N\O)/N)Cl MCULE-3963432497 [0,1,0,0,0,0|2,0,1]=4 371 B14R1.727 CC1=CC=C(C(=C1)Br)NCC(O)CN MCULE-3770365503 [0,1,0,0,0,0|3,0,0]=4 372 B14R1.727 N/C(=N\O)/COC1=C(C=C(C=C1)Cl)Cl MCULE-5313622152 [0,1,0,0,0,0|2,0,1]=4 373 B14R1.727 O=C(COC1=C(C=C(C=C1)Cl)Cl)NO MCULE-6309848033 [0,1,0,0,0,0|1,0,2]=4 374 B14R1.833 CC1=CC(=CC=C1Cl)OCC(O)CN MCULE-7806517629 [0,1,0,0,0,0|1,0,0]=2 375 B14R1.833 CC1=CC=C(C=C1C)OCC(O)CN MCULE-6932549833 [0,1,0,0,0,0|2,0,0]=3 376 B14R1.833 N/C(=N\O)/COC1=CC(=C(C=C1)Cl)Cl MCULE-2603313907 [0,1,0,0,0,0|2,0,1]=4 377 B14R1.833 NCC(O)COC1=CC(=C(C=C1)F)F MCULE-7896761933 [0,1,0,0,0,0|1,1,0]=3 378 B14R1.833 OCC(O)COC1=CC=C(C(=C1)F)Br MCULE-9737587665 [0,1,0,0,0,0|0,1,0]=2 379 B14R2.20 NC1=CC=C(C=C1)N2CCC(C2)O MCULE-5158422836 [0,0,0,1,0,0|3,0,0]=4 380 B14R2.20 NC1CCC(C1)C2=CC=C(C=C2)Cl MCULE-5445280103 [0,0,0,1,0,0|3,0,0]=4 381 B14R2.20 NC1CCC(C1)C2=CC=C(C=C2)Cl MCULE-6076331664 [0,0,0,1,0,0|3,0,0]=4 382 B14R2.20 NC1CCN(C1)C2=CC=C(C=C2)Cl MCULE-7128592339 [0,0,0,1,0,0|3,0,0]=4 383 B14R2.20 OC1CCN(C1)C2=CC=C(C=C2)Br MCULE-3530186861 [0,0,0,1,0,0|2,1,0]=4 384 B14R2.20 OC1CCN(C1)C2=CC=C(C=C2)Cl MCULE-4711664899 [0,0,0,1,0,0|2,0,0]=3 385 B14R2.20 OC1CCN(C1)C2=CC=C(C=C2)F MCULE-7149751021 [0,0,0,1,0,0|2,1,0]=4 386 B14R2.20 OC1CNC(C1)C2=CC=C(C=C2)Br MCULE-4862606899 [0,0,0,1,0,0|2,1,0]=4 387 B14R2.20 OC1CNC(C1)C2=CC=C(C=C2)Br MCULE-9836443767 [0,0,0,1,0,0|2,1,0]=4 388 B14R2.20 OC1CNC(C1)C2=CC=C(C=C2)F MCULE-4224902418 [0,0,0,1,0,0|2,1,0]=4 389 B14R2.20 OC1CNC(C1)C2=CC=C(C=C2)F MCULE-9571072551 [0,0,0,1,0,0|2,1,0]=4 390 B14R2.134 NC1=CC2=C(C=C1)OCC(N2)CO MCULE-1182104905 [0,0,0,1,0,0|2,0,0]=3 391 B14R2.134 NC1=CC2=C(C=C1)OCC(N2)CO MCULE-7548388373 [0,0,0,1,0,0|2,0,0]=3 392 B14R2.134 NCC1COC2=C(C1)C=C(C=C2)Br MCULE-1643787629 [0,0,0,1,0,0|2,1,0]=4 393 B14R2.134 NCC1COC2=C(C1)C=C(C=C2)Br MCULE-4600197345 [0,0,0,1,0,0|2,1,0]=4 394 B14R2.134 NCC1COC2=C(C1)C=C(C=C2)Cl MCULE-4610141354 [0,0,0,1,0,0|2,0,0]=3 395 B14R2.134 NCC1COC2=C(C1)C=C(C=C2)Cl MCULE-7376379141 [0,0,0,1,0,0|2,0,0]=3 396 B14R2.134 O=CC1COC2=CC=C(C=C2C1)Cl MCULE-2260229960 [0,0,0,1,0,0|1,0,2]=4 397 B14R2.134 OCC1CNC2=C(O1)C=C(C=C2)F MCULE-2280965002 [0,0,0,1,0,0|1,1,0]=3 398 B14R2.134 OCC1CNC2=C(O1)C=C(C=C2)F MCULE-2633330626 [0,0,0,1,0,0|1,1,0]=3 399 B14R2.134 OCC1COC2=CC=C(C=C2O1)Br MCULE-2769891644 [0,0,0,1,0,0|0,1,0]=2 400 B14R2.946 CC1=CC=C(C=C1)NC2CCC2O MCULE-6175617455 [0,0,0,1,0,0|3,0,0]=4 401 B14R2.946 CC1=CC=C(C=C1)O[C@@H]2CC[C@H]2O MCULE-2934671956 [0,0,0,1,0,0|2,0,0]=3 402 B14R2.946 CC1=CC=C(C=N1)O[C@@H]2CC[C@H]2O MCULE-4569085830 [0,0,0,1,0,0|3,0,0]=4 403 B14R2.946 O[C@@H]1CC[C@H]1OC2=CC=C(C=C2)Cl MCULE-4311634671 [0,0,0,1,0,0|1,0,0]=2 404 B14R2.946 O[C@@H]1CC[C@H]1OC2=CC=C(C=C2)F MCULE-1068572790 [0,0,0,1,0,0|1,1,0]=3 405 B14R2.948 NC1(CC1)COC2=CC=C(C=C2)Br MCULE-1367399092 [0,0,0,1,0,0|2,1,0]=4 406 B14R2.948 NC1(CC1)COC2=CC=C(C=C2)Br MCULE-9118458528 [0,0,0,1,0,0|2,1,0]=4 407 B14R2.948 NC1(CC1)COC2=CC=C(C=C2)Cl MCULE-9159078657 [0,0,0,1,0,0|2,0,0]=3 408 B14R2.948 NC1(CC1)COC2=CC=C(C=C2)F MCULE-1926767280 [0,0,0,1,0,0|2,1,0]=4 409 B14R2.948 NC1(CC1)COC2=CC=C(C=C2)F MCULE-6859369304 [0,0,0,1,0,0|2,1,0]=4 410 B14R2.948 NC1(CC1)COC2=CC=C(C=C2)I MCULE-7123922322 [0,0,0,1,0,0|2,1,0]=4 411 B14R2.948 NC1(CC1)COC2=CC=C(C=C2)I MCULE-8925435094 [0,0,0,1,0,0|2,1,0]=4 412 B14R2.953 CC1=CC=C(C=C1)OCC2CC2N MCULE-9336014750 [0,0,0,1,0,0|3,0,0]=4 413 B14R2.953 NC1CC1COC2=CC=C(C=C2)Br MCULE-8799506121 [0,0,0,1,0,0|2,1,0]=4 414 B14R2.953 NC1CC1COC2=CC=C(C=C2)Cl MCULE-2798132016 [0,0,0,1,0,0|2,0,0]=3 415 B14R2.953 NC1CC1COC2=CC=C(C=C2)F MCULE-2872639116 [0,0,0,1,0,0|2,1,0]=4 416 B14R2.4513 NC1COC2=C(C1=O)C=C(C=C2)Cl MCULE-3240054850 [0,0,0,1,0,0|1,0,2]=4 417 B14R2.4513 NC1COC2=C(C1=O)C=C(C=C2)Cl MCULE-4539832093 [0,0,0,1,0,0|1,0,2]=4 418 B14R2.4513 O=C1C2=C(C=CC(=C2)Cl)OCC1Br MCULE-4092260198 [0,0,0,1,0,0|1,0,2]=4 419 B14R2.5634 CC1=CC2=C(C=C1)OCC(CO2)O MCULE-2616704984 [0,0,0,1,0,0|1,0,0]=2 420 B14R2.5634 CC1=CC=C2OCC(=O)COC2=C1 MCULE-7670066964 [0,0,0,1,0,0|1,0,2]=4 421 B14R2.5634 CC1CNC2=C(C=CC(=C2)Cl)SC1 MCULE-5064059346 [0,0,0,1,0,0|2,1,0]=4 422 B14R2.5634 CC1CNC2=C(C=CC(=C2)Cl)SC1 MCULE-6104927597 [0,0,0,1,0,0|2,1,0]=4 423 B14R2.10626 BrC1=CC=C(C=C1)OCC2CCC2 MCULE-6984898224 [0,0,0,1,0,0|2,1,0]=4 424 B14R2.10626 CC1=CC=C(C=C1)OCC2CNC2 MCULE-1681858689 [0,0,0,1,0,0|3,0,0]=4 425 B14R2.10626 CC1=CC=C(C=C1)OCC2CNC2 MCULE-9024204683 [0,0,0,1,0,0|3,0,0]=4 426 B14R2.10626 ClC1=CC=C(C=C1)CNC2COC2 MCULE-3554412247 [0,0,0,1,0,0|3,0,0]=4 427 B14R2.10626 ClC1=CC=C(C=C1)OCC2CNC2 MCULE-3378040199 [0,0,0,1,0,0|2,0,0]=3 428 B14R2.10626 ClC1=CC=C(C=C1)OCC2CNC2 MCULE-8019585257 [0,0,0,1,0,0|2,0,0]=3 429 B14R2.10626 ClC1=CC=C(C=N1)OCC2CCC2 MCULE-8094067700 [0,0,0,1,0,0|3,0,0]=4 430 B14R2.10626 ClC1=CC=C(C=N1)OC[C@H]2CCN2 MCULE-1820902495 [0,0,0,1,0,0|3,0,0]=4 431 B14R2.10626 ClC1=CC=C(C=N1)OC[C@H]2CCN2 MCULE-7945257111 [0,0,0,1,0,0|3,0,0]=4 432 B14R2.10626 ClC1=CC=C(C=N1)OC[C@H]2CCN2 MCULE-8448291007 [0,0,0,1,0,0|3,0,0]=4 433 B14R2.10626 ClC1=NC=C(C=C1)OCC2CCN2 MCULE-5946314414 [0,0,0,1,0,0|3,0,0]=4 434 B14R2.10626 ClC1=NC=C(C=C1)OCC2CCN2 MCULE-9395372509 [0,0,0,1,0,0|3,0,0]=4 435 B14R2.10626 ClC1=NC=C(C=C1)OC[C@H]2CCN2 MCULE-2396140201 [0,0,0,1,0,0|3,0,0]=4 436 B14R2.10626 ClC1=NC=C(C=C1)OC[C@H]2CCN2 MCULE-9069684105 [0,0,0,1,0,0|3,0,0]=4 437 B14R2.10626 FC1=CC=C(C=C1)OCC2CNC2 MCULE-6079799696 [0,0,0,1,0,0|2,1,0]=4 438 B14R2.10626 FC1=CC=C(C=C1)OCC2CNC2 MCULE-8675218008 [0,0,0,1,0,0|2,1,0]=4 439 B14R2.10626 FC1=CN=C(C=C1)OCC2CCO2 MCULE-9594981603 [0,0,0,1,0,0|2,1,0]=4 440 B14R2.10626 NC1=CC=C(C=C1)OCC2CCC2 MCULE-7021095015 [0,0,0,1,0,0|3,0,0]=4 441 B14R2.10626 OC1=CC=C(C=C1)OCC2CCC2 MCULE-2255927131 [0,0,0,1,0,0|3,0,0]=4 442 B14R2.10626 OC1=CC=C(C=C1)OCC2CNC2 MCULE-1333193479 [0,0,0,1,0,0|3,0,0]=4 443 B14R2.10626 OC1=CC=C(C=C1)OCC2CNC2 MCULE-9229661671 [0,0,0,1,0,0|3,0,0]=4 444 B14R2.47668 CC1=CC=C2CCC(C2=C1)(O)CN MCULE-2708460681 [0,0,0,1,0,0|3,0,0]=4 445 B14R2.47668 NCC1(CCC2=CC=C(C=C12)Cl)O MCULE-9572994183 [0,0,0,1,0,0|2,0,0]=3 446 B14R2.47668 NCC1(CCC2=CC=C(C=C12)F)O MCULE-7805540911 [0,0,0,1,0,0|2,1,0]=4 447 B12R1.49 C(N)(CO)CC1=CC=C(C=C1)O MCULE-4364318479 [0,0,0,0,1,0|2,0,0]=3 448 B12R1.49 C(N)(CO)CC1=CC=C(C=C1)O MCULE-7731641378 [0,0,0,0,1,0|2,0,0]=3 449 B12R1.49 CC(C#N)CC1=CC=C(C=C1)Cl MCULE-5307304035 [0,0,0,0,1,0|2,0,1]=4 450 B12R1.49 CC(CBr)CC1=CC=C(C=C1)F MCULE-5029136279 [0,0,0,0,1,0|2,1,0]=4 451 B12R1.49 CC(CBr)OC1=CC=C(C=C1)F MCULE-2133422284 [0,0,0,0,1,0|2,1,0]=4 452 B12R1.49 CC(CCl)CC1=CC=C(C=C1)F MCULE-3570552754 [0,0,0,0,1,0|2,1,0]=4 453 B12R1.49 CC(CN)CC1=CC=C(C=C1)F MCULE-7096613435 [0,0,0,0,1,0|2,1,0]=4 454 B12R1.49 CC(CN)OC1=CC=C(C=C1)Br MCULE-4659526505 [0,0,0,0,1,0|2,1,0]=4 455 B12R1.49 CC(CN)OC1=CC=C(C=C1)Cl MCULE-5946279815 [0,0,0,0,1,0|2,0,0]=3 456 B12R1.49 CC(CN)OC1=CC=C(C=C1)F MCULE-2308620066 [0,0,0,0,1,0|2,1,0]=4 457 B12R1.49 CC(CN)OC1=CC=C(C=C1)F MCULE-6219886961 [0,0,0,0,1,0|2,1,0]=4 458 B12R1.49 CC(CO)CC1=CC=C(C=C1)Br MCULE-4463530757 [0,0,0,0,1,0|1,1,0]=3 459 B12R1.49 CC(CO)CC1=CC=C(C=C1)Cl MCULE-2757746872 [0,0,0,0,1,0|1,0,0]=2 460 B12R1.49 CC(CO)CC1=CC=C(C=C1)F MCULE-4088443539 [0,0,0,0,1,0|1,1,0]=3 461 B12R1.49 CC(CO)SC1=CC=C(C=C1)Br MCULE-1639384538 [0,0,0,0,1,0|1,2,0]=4 462 B12R1.49 CC1=CC=C(C=C1)CC(C)CO MCULE-8274181207 [0,0,0,0,1,0|2,0,0]=3 463 B12R1.49 CC1=CC=C(C=C1)CC(N)CO MCULE-4779951404 [0,0,0,0,1,0|2,0,0]=3 464 B12R1.49 CC1=CC=C(C=C1)CC(N)CO MCULE-5830668486 [0,0,0,0,1,0|2,0,0]=3 465 B12R1.49 CC1=CC=C(C=C1)OC(C)CN MCULE-1033353119 [0,0,0,0,1,0|3,0,0]=4 466 B12R1.49 CCC(=O)CC1=CC=C(C=C1)Cl MCULE-4847222042 [0,0,0,0,1,0|1,0,2]=4 467 B12R1.49 CCC(=O)OC1=CC=C(C=C1)Cl MCULE-9154358927 [0,0,0,0,1,0|1,0,2]=4 468 B12R1.49 CCC(C)OC1=CC=C(C=C1)Br MCULE-9181285145 [0,0,0,0,1,0|2,1,0]=4 469 B12R1.49 CCC(C)OC1=CC=C(C=C1)Cl MCULE-6690861068 [0,0,0,0,1,0|2,0,0]=3 470 B12R1.49 CCC(C)OC1=CC=C(C=C1)N MCULE-1854078876 [0,0,0,0,1,0|3,0,0]=4 471 B12R1.49 CCC(C)OC1=CC=C(C=C1)N MCULE-4719216896 [0,0,0,0,1,0|3,0,0]=4 472 B12R1.49 CCC(N)CC1=CC=C(C=C1)Br MCULE-1475245514 [0,0,0,0,1,0|2,1,0]=4 473 B12R1.49 CCC(N)CC1=CC=C(C=C1)Br MCULE-6219846318 [0,0,0,0,1,0|2,1,0]=4 474 B12R1.49 CCC(N)CC1=CC=C(C=C1)C MCULE-2985140727 [0,0,0,0,1,0|3,0,0]=4 475 B12R1.49 CCC(N)CC1=CC=C(C=C1)Cl MCULE-3017958772 [0,0,0,0,1,0|2,0,0]=3 476 B12R1.49 CCC(N)CC1=CC=C(C=C1)Cl MCULE-9392040331 [0,0,0,0,1,0|2,0,0]=3 477 B12R1.49 CCC(N)CC1=CC=C(C=C1)F MCULE-1382850122 [0,0,0,0,1,0|2,1,0]=4 478 B12R1.49 CCC(N)CC1=CC=C(C=C1)F MCULE-8290205391 [0,0,0,0,1,0|2,1,0]=4 479 B12R1.49 CCC(O)CC1=CC=C(C=C1)Br MCULE-5397663365 [0,0,0,0,1,0|1,1,0]=3 480 B12R1.49 CCC(O)CC1=CC=C(C=C1)C MCULE-2536892447 [0,0,0,0,1,0|2,0,0]=3 481 B12R1.49 CCC(O)CC1=CC=C(C=C1)Cl MCULE-6270104347 [0,0,0,0,1,0|1,0,0]=2 482 B12R1.49 CCC(O)CC1=CC=C(C=C1)F MCULE-8602286149 [0,0,0,0,1,0|1,1,0]=3 483 B12R1.49 CNC(C)CC1=CC=C(C=C1)Cl MCULE-5500526577 [0,0,0,0,1,0|3,0,0]=4 484 B12R1.49 CNC(C)CC1=CC=C(C=C1)Cl MCULE-5518204792 [0,0,0,0,1,0|3,0,0]=4 485 B12R1.49 C[C@@H](CO)OC1=CC=C(C=C1)Cl MCULE-2561216008 [0,0,0,0,1,0|1,0,0]=2 486 B12R1.49 N#CC(O)CC1=CC=C(C=C1)F MCULE-9173124758 [0,0,0,0,1,0|1,1,1]=4 487 B12R1.49 N/C(=N\O)/CC1=CC=C(C=C1)Cl MCULE-2900273415 [0,0,0,0,1,0|2,0,1]=4 488 B12R1.49 NC(CO)CC1=CC=C(C=C1)Cl MCULE-2451229136 [0,0,0,0,1,0|1,0,0]=2 489 B12R1.49 NC(CO)CC1=CC=C(C=C1)Cl MCULE-5055032465 [0,0,0,0,1,0|1,0,0]=2 490 B12R1.49 NC(CO)CC1=CC=C(C=C1)Cl MCULE-9478178353 [0,0,0,0,1,0|1,0,0]=2 491 B12R1.49 NC(CO)CC1=CC=C(C=C1)F MCULE-6787204944 [0,0,0,0,1,0|1,1,0]=3 492 B12R1.49 NC(CO)CC1=CC=C(C=C1)F MCULE-7862382113 [0,0,0,0,1,0|1,1,0]=3 493 B12R1.49 NC(CO)CC1=CC=C(C=C1)F MCULE-8412695071 [0,0,0,0,1,0|1,1,0]=3 494 B12R1.49 NC(CO)CC1=CC=C(C=C1)F MCULE-9886176160 [0,0,0,0,1,0|1,1,0]=3 495 B12R1.49 NC(CO)CC1=CC=C(C=C1)I MCULE-2322452328 [0,0,0,0,1,0|1,1,0]=3 496 B12R1.49 NCC(O)CC1=CC=C(C=C1)Cl MCULE-7013050569 [0,0,0,0,1,0|1,0,0]=2 497 B12R1.49 NCC(O)CC1=CC=C(C=C1)F MCULE-8740089240 [0,0,0,0,1,0|1,1,0]=3 498 B12R1.49 N[C@@H](CO)CC1=CC=C(C=C1)Cl MCULE-1948546882 [0,0,0,0,1,0|1,0,0]=2 499 B12R1.49 N[C@@H](CO)CC1=CC=C(C=C1)F MCULE-3791493238 [0,0,0,0,1,0|1,1,0]=3 500 B12R1.49 N[C@@H](CO)CC1=CC=C(C=C1)F MCULE-3941031483 [0,0,0,0,1,0|1,1,0]=3 501 B12R1.49 N[C@@H](CO)CC1=CC=C(C=C1)F MCULE-6839715881 [0,0,0,0,1,0|1,1,0]=3 502 B12R1.49 N[C@@H](CO)CC1=CC=C(C=C1)F MCULE-7796624646 [0,0,0,0,1,0|1,1,0]=3 503 B12R1.49 N[C@@H](CO)CC1=CC=C(C=C1)I MCULE-2463014757 [0,0,0,0,1,0|1,1,0]=3 504 B12R1.49 N[C@@H](CO)CC1=CC=C(C=C1)I MCULE-9894685394 [0,0,0,0,1,0|1,1,0]=3 505 B12R1.49 N[C@@H](CO)CC1=CC=C(C=C1)O MCULE-3432213644 [0,0,0,0,1,0|2,0,0]=3 506 B12R1.49 N[C@@H](CO)CC1=CC=C(C=C1)O MCULE-4720290854 [0,0,0,0,1,0|2,0,0]=3 507 B12R1.49 N[C@@H](CO)CC1=CC=C(C=C1)O MCULE-5805805181 [0,0,0,0,1,0|2,0,0]=3 508 B12R1.49 N[C@@H](CO)CC1=CC=C(C=C1)O MCULE-7125179229 [0,0,0,0,1,0|2,0,0]=3 509 B12R1.49 N[C@H](CO)CC1=CC=C(C=C1)Br MCULE-7337035743 [0,0,0,0,1,0|1,1,0]=3 510 B12R1.49 N[C@H](CO)CC1=CC=C(C=C1)Cl MCULE-2850702380 [0,0,0,0,1,0|1,0,0]=2 511 B12R1.49 N[C@H](CO)CC1=CC=C(C=C1)Cl MCULE-3670314163 [0,0,0,0,1,0|1,0,0]=2 512 B12R1.49 N[C@H](CO)CC1=CC=C(C=C1)Cl MCULE-7854906977 [0,0,0,0,1,0|1,0,0]=2 513 B12R1.49 N[C@H](CO)CC1=CC=C(C=C1)Cl MCULE-8742967393 [0,0,0,0,1,0|1,0,0]=2 514 B12R1.49 N[C@H](CO)CC1=CC=C(C=C1)F MCULE-3245725968 [0,0,0,0,1,0|1,1,0]=3 515 B12R1.49 N[C@H](CO)CC1=CC=C(C=C1)F MCULE-4191115900 [0,0,0,0,1,0|1,1,0]=3 516 B12R1.49 N[C@H](CO)CC1=CC=C(C=C1)O MCULE-4240093020 [0,0,0,0,1,0|2,0,0]=3 517 B12R1.49 N[C@H](CO)CC1=CC=C(C=C1)O MCULE-5219837114 [0,0,0,0,1,0|2,0,0]=3 518 B12R1.49 N[C@H](CO)CC1=CC=C(C=C1)O MCULE-6710049160 [0,0,0,0,1,0|2,0,0]=3 519 B12R1.49 N[C@H](CO)CC1=CC=C(C=C1)O MCULE-7653376778 [0,0,0,0,1,0|2,0,0]=3 520 B12R1.49 O=C(CBr)CC1=CC=C(C=C1)Cl MCULE-9899315320 [0,0,0,0,1,0|1,0,2]=4 521 B12R1.49 O=C(CCl)CC1=CC=C(C=C1)Cl MCULE-2312080370 [0,0,0,0,1,0|1,0,2]=4 522 B12R1.49 O=C(CCl)OC1=CC=C(C=C1)Cl MCULE-1153829117 [0,0,0,0,1,0|1,0,2]=4 523 B12R1.49 O=C(CO)NC1=CC=C(C=C1)Cl MCULE-9237329010 [0,0,0,0,1,0|1,0,2]=4 524 B12R1.49 O=CC(Cl)CC1=CC=C(C=C1)Cl MCULE-7350394782 [0,0,0,0,1,0|1,0,2]=4 525 B12R1.49 OC(CCl)SC1=CC=C(C=C1)Cl MCULE-7834693271 [0,0,0,0,1,0|1,1,0]=3 526 B12R1.49 [C@@H](N)(CO)CC1=CC=C(C=C1)Br MCULE-7701953937 [0,0,0,0,1,0|1,1,0]=3 527 B12R1.49 [C@@H](N)(CO)CC1=CC=C(C=C1)Br MCULE-9104846655 [0,0,0,0,1,0|1,1,0]=3 528 B14R1.13 CC1=CC=C(C=C1)CSC[C@H](N)CO MCULE-7514648139 [0,0,0,0,0,1|2,1,0]=4 529 B14R1.13 CC1=CC=C(C=C1)CSC[C@H](N)CO MCULE-8464797141 [0,0,0,0,0,1|2,1,0]=4 530 B14R1.13 O[C@H](CCl)C/N=C/C1=CC=C(C=C1)Cl MCULE-8110496639 [0,0,0,0,0,1|2,0,0]=3 531 B14R1.13 O[C@H](CCl)CN=CC1=CC=C(C=C1)Cl MCULE-9472513169 [0,0,0,0,0,1|2,0,0]=3 532 B11R1.1 BrCCCC1=CC=C(C=C1)Br MCULE-9723157036 [2,0,0,0,0,0|1,1,0]=4 533 B11R1.1 BrCCOC1=CC=C(C=C1)Br MCULE-3371509739 [2,0,0,0,0,0|1,1,0]=4 534 B11R1.1 BrCCOC1=CC=C(C=C1)I MCULE-1411450201 [2,0,0,0,0,0|1,1,0]=4 535 B11R1.1 C#CCOC1=CC=C(C=C1)Cl MCULE-1824032599 [2,0,0,0,0,0|0,0,2]=4 536 B11R1.1 C=CCCC1=CC=C(C=C1)Cl MCULE-1744113911 [2,0,0,0,0,0|1,0,1]=4 537 B11R1.1 C=CCOC1=CC=C(C=C1)Cl MCULE-2563875562 [2,0,0,0,0,0|0,0,2]=4 538 B11R1.1 CC1=CC=C(C=C1)CCCBr MCULE-7273450941 [2,0,0,0,0,0|2,0,0]=4 539 B11R1.1 CC1=CC=C(C=C1)CCCN MCULE-2972333960 [2,0,0,0,0,0|2,0,0]=4 540 B11R1.1 CC1=CC=C(C=C1)CCCN MCULE-8892367369 [2,0,0,0,0,0|2,0,0]=4 541 B11R1.1 CC1=CC=C(C=C1)CCCO MCULE-9632662084 [2,0,0,0,0,0|1,0,0]=3 542 B11R1.1 CC1=CC=C(C=C1)CCCS MCULE-6657451156 [2,0,0,0,0,0|1,1,0]=4 543 B11R1.1 CC1=CC=C(C=C1)NCCO MCULE-9356268016 [2,0,0,0,0,0|2,0,0]=4 544 B11R1.1 CC1=CC=C(C=C1)OCCBr MCULE-5239846845 [2,0,0,0,0,0|2,0,0]=4 545 B11R1.1 CC1=CC=C(C=C1)OCCCl MCULE-9557606031 [2,0,0,0,0,0|2,0,0]=4 546 B11R1.1 CC1=CC=C(C=C1)OCCN MCULE-4353714522 [2,0,0,0,0,0|2,0,0]=4 547 B11R1.1 CC1=CC=C(C=C1)OCCN MCULE-5223061520 [2,0,0,0,0,0|2,0,0]=4 548 B11R1.1 CC1=CC=C(C=C1)OCCO MCULE-7424526463 [2,0,0,0,0,0|1,0,0]=3 549 B11R1.1 CC1=CC=C(C=C1)SCCO MCULE-6492409168 [2,0,0,0,0,0|1,1,0]=4 550 B11R1.1 CC1=CN=C(C=C1)OCCO MCULE-8525744376 [2,0,0,0,0,0|2,0,0]=4 551 B11R1.1 CC1=NC=C(C=C1)CCCO MCULE-2017541211 [2,0,0,0,0,0|2,0,0]=4 552 B11R1.1 CC1=NC=C(C=C1)OCCO MCULE-5100950120 [2,0,0,0,0,0|2,0,0]=4 553 B11R1.1 CCCCC1=CC=C(C=C1)Br MCULE-5085143125 [2,0,0,0,0,0|1,1,0]=4 554 B11R1.1 CCCCC1=CC=C(C=C1)C MCULE-9857515677 [2,0,0,0,0,0|2,0,0]=4 555 B11R1.1 CCCCC1=CC=C(C=C1)Cl MCULE-1290195292 [2,0,0,0,0,0|1,0,0]=3 556 B11R1.1 CCCCC1=CC=C(C=C1)I MCULE-7199270658 [2,0,0,0,0,0|1,1,0]=4 557 B11R1.1 CCCCC1=CC=C(C=C1)N MCULE-7883402757 [2,0,0,0,0,0|2,0,0]=4 558 B11R1.1 CCCCC1=CC=C(C=C1)O MCULE-4727787995 [2,0,0,0,0,0|2,0,0]=4 559 B11R1.1 CCCCC1=CC=C(C=C1)S MCULE-3984375827 [2,0,0,0,0,0|2,0,0]=4 560 B11R1.1 CCCCC1=CN=C(C=C1)Cl MCULE-4489111401 [2,0,0,0,0,0|2,0,0]=4 561 B11R1.1 CCCNC1=CC=C(C=C1)Br MCULE-5594976871 [2,0,0,0,0,0|1,1,0]=4 562 B11R1.1 CCCNC1=CC=C(C=C1)Br MCULE-6700456398 [2,0,0,0,0,0|1,1,0]=4 563 B11R1.1 CCCNC1=CC=C(C=C1)Cl MCULE-5297114252 [2,0,0,0,0,0|1,0,0]=3 564 B11R1.1 CCCNC1=CC=C(C=C1)Cl MCULE-7223438305 [2,0,0,0,0,0|1,0,0]=3 565 B11R1.1 CCCNC1=CC=C(C=C1)F MCULE-2301617148 [2,0,0,0,0,0|1,1,0]=4 566 B11R1.1 CCCOC1=CC=C(C=C1)Br MCULE-4455951863 [2,0,0,0,0,0|0,1,0]=3 567 B11R1.1 CCCOC1=CC=C(C=C1)C MCULE-2806890142 [2,0,0,0,0,0|1,0,0]=3 568 B11R1.1 CCCOC1=CC=C(C=C1)F MCULE-2652756772 [2,0,0,0,0,0|0,1,0]=3 569 B11R1.1 CCCOC1=CC=C(C=C1)I MCULE-1104158872 [2,0,0,0,0,0|0,1,0]=3 570 B11R1.1 CCCOC1=CC=C(C=C1)N MCULE-4264616598 [2,0,0,0,0,0|1,0,0]=3 571 B11R1.1 CCCOC1=CC=C(C=C1)O MCULE-5783585132 [2,0,0,0,0,0|1,0,0]=3 572 B11R1.1 CCCOC1=CC=C(C=C1)S MCULE-9522143026 [2,0,0,0,0,0|1,0,0]=3 573 B11R1.1 CCCOC1=CC=C(C=C1)[NH3+] MCULE-2501947085 [2,0,0,0,0,0|1,0,0]=3 574 B11R1.1 CCCOC1=CC=C(C=N1)N MCULE-8735847468 [2,0,0,0,0,0|2,0,0]=4 575 B11R1.1 CCCOC1=CC=C(C=N1)O MCULE-9728892576 [2,0,0,0,0,0|2,0,0]=4 576 B11R1.1 CCCOC1=CC=C(N=N1)Cl MCULE-6156484899 [2,0,0,0,0,0|2,0,0]=4 577 B11R1.1 CCCOC1=CN=C(C=C1)Br MCULE-2313176426 [2,0,0,0,0,0|1,1,0]=4 578 B11R1.1 CCCOC1=CN=C(C=C1)N MCULE-8424992746 [2,0,0,0,0,0|2,0,0]=4 579 B11R1.1 CCCOC1=NC=C(C=C1)Br MCULE-1105074152 [2,0,0,0,0,0|1,1,0]=4 580 B11R1.1 CCCOC1=NC=C(C=C1)Cl MCULE-8592812152 [2,0,0,0,0,0|1,0,0]=3 581 B11R1.1 CCCSC1=CC=C(C=C1)Br MCULE-6800426819 [2,0,0,0,0,0|0,2,0]=4 582 B11R1.1 CCCSC1=CC=C(C=C1)C MCULE-9645232326 [2,0,0,0,0,0|1,1,0]=4 583 B11R1.1 CCCSC1=CC=C(C=C1)Cl MCULE-8886859663 [2,0,0,0,0,0|0,1,0]=3 584 B11R1.1 CCCSC1=CC=C(C=C1)N MCULE-6311190549 [2,0,0,0,0,0|1,1,0]=4 585 B11R1.1 CCCSC1=CC=C(C=C1)N MCULE-8632485277 [2,0,0,0,0,0|1,1,0]=4 586 B11R1.1 CCCSC1=CC=C(C=C1)O MCULE-1302872300 [2,0,0,0,0,0|1,1,0]=4 587 B11R1.1 CCCSC1=CC=C(C=C1)S MCULE-1434025457 [2,0,0,0,0,0|1,1,0]=4 588 B11R1.1 CCNCC1=CC=C(C=C1)Cl MCULE-4404750885 [2,0,0,0,0,0|2,0,0]=4 589 B11R1.1 CCNCC1=CC=C(C=C1)Cl MCULE-6215270230 [2,0,0,0,0,0|2,0,0]=4 590 B11R1.1 CCSCC1=CC=C(C=C1)Cl MCULE-5190766477 [2,0,0,0,0,0|2,0,0]=4 591 B11R1.1 CNCCC1=CC=C(C=C1)Cl MCULE-1775717184 [2,0,0,0,0,0|2,0,0]=4 592 B11R1.1 COCOC1=CC=C(C=C1)Br MCULE-9194353227 [2,0,0,0,0,0|1,1,0]=4 593 B11R1.1 COCOC1=CC=C(C=C1)C MCULE-5591317466 [2,0,0,0,0,0|2,0,0]=4 594 B11R1.1 COCOC1=CC=C(C=C1)Cl MCULE-5140624394 [2,0,0,0,0,0|1,0,0]=3 595 B11R1.1 COCOC1=CC=C(C=C1)F MCULE-3005873220 [2,0,0,0,0,0|1,1,0]=4 596 B11R1.1 COCOC1=CC=C(C=C1)I MCULE-5007974937 [2,0,0,0,0,0|1,1,0]=4 597 B11R1.1 COCOC1=CC=C(C=C1)N MCULE-9894527728 [2,0,0,0,0,0|2,0,0]=4 598 B11R1.1 COCOC1=CC=C(C=C1)O MCULE-2089334401 [2,0,0,0,0,0|2,0,0]=4 599 B11R1.1 COCOC1=CN=C(C=C1)Cl MCULE-9538539432 [2,0,0,0,0,0|2,0,0]=4 600 B11R1.1 ClC1=CC=C(C=C1)CCCBr MCULE-1594863019 [2,0,0,0,0,0|1,0,0]=3 601 B11R1.1 ClC1=CC=C(C=C1)OCCBr MCULE-3291284212 [2,0,0,0,0,0|1,0,0]=3 602 B11R1.1 ClC1=CC=C(C=C1)SCCBr MCULE-3425838350 [2,0,0,0,0,0|1,1,0]=4 603 B11R1.1 ClCCCC1=CC=C(C=C1)Br MCULE-8815406901 [2,0,0,0,0,0|1,1,0]=4 604 B11R1.1 ClCCCC1=CC=C(C=C1)Cl MCULE-3691902632 [2,0,0,0,0,0|1,0,0]=3 605 B11R1.1 ClCCOC1=CC=C(C=C1)Br MCULE-5762987127 [2,0,0,0,0,0|1,1,0]=4 606 B11R1.1 ClCCOC1=CC=C(C=C1)Cl MCULE-4528789295 [2,0,0,0,0,0|1,0,0]=3 607 B11R1.1 ClCCOC1=CN=C(C=C1)Cl MCULE-2874395136 [2,0,0,0,0,0|2,0,0]=4 608 B11R1.1 ClCCSC1=CC=C(C=C1)Cl MCULE-8719284731 [2,0,0,0,0,0|1,1,0]=4 609 B11R1.1 ClCSCC1=CC=C(C=C1)Cl MCULE-7549238935 [2,0,0,0,0,0|2,0,0]=4 610 B11R1.1 FC1=CC=C(C=C1)CCCBr MCULE-7335136494 [2,0,0,0,0,0|1,1,0]=4 611 B11R1.1 FC1=CC=C(C=C1)CCCCl MCULE-1711808252 [2,0,0,0,0,0|1,1,0]=4 612 B11R1.1 FC1=CC=C(C=C1)CCCI MCULE-4787594482 [2,0,0,0,0,0|1,1,0]=4 613 B11R1.1 FC1=CC=C(C=C1)CCCS MCULE-7975152669 [2,0,0,0,0,0|0,2,0]=4 614 B11R1.1 FC1=CC=C(C=C1)OCCBr MCULE-9633399830 [2,0,0,0,0,0|1,1,0]=4 615 B11R1.1 FC1=CC=C(C=C1)OCCCl MCULE-8576645557 [2,0,0,0,0,0|1,1,0]=4 616 B11R1.1 FCCOC1=CC=C(C=C1)Br MCULE-5379857061 [2,0,0,0,0,0|1,1,0]=4 617 B11R1.1 FCCOC1=CC=C(C=C1)I MCULE-2034264825 [2,0,0,0,0,0|1,1,0]=4 618 B11R1.1 N#CCCC1=CC=C(C=C1)Cl MCULE-7531507792 [2,0,0,0,0,0|1,0,1]=4 619 B11R1.1 N#CCOC1=CC=C(C=C1)Cl MCULE-3447317669 [2,0,0,0,0,0|1,0,1]=4 620 B11R1.1 NC1=CC=C(C=C1)CCCO MCULE-3861837607 [2,0,0,0,0,0|1,0,0]=3 621 B11R1.1 NC1=CC=C(C=C1)CCCO MCULE-6893752317 [2,0,0,0,0,0|1,0,0]=3 622 B11R1.1 NC1=CC=C(C=C1)NCCO MCULE-5890262028 [2,0,0,0,0,0|2,0,0]=4 623 B11R1.1 NC1=CC=C(C=C1)NCCO MCULE-5940577364 [2,0,0,0,0,0|2,0,0]=4 624 B11R1.1 NC1=CC=C(C=C1)OCCCl MCULE-2709615362 [2,0,0,0,0,0|2,0,0]=4 625 B11R1.1 NC1=CC=C(C=C1)OCCF MCULE-4776826949 [2,0,0,0,0,0|2,0,0]=4 626 B11R1.1 NC1=CC=C(C=C1)OCCO MCULE-7394614277 [2,0,0,0,0,0|1,0,0]=3 627 B11R1.1 NC1=CC=C(C=C1)OCCO MCULE-9194780278 [2,0,0,0,0,0|1,0,0]=3 628 B11R1.1 NC1=CN=C(C=C1)OCCO MCULE-1925801936 [2,0,0,0,0,0|2,0,0]=4 629 B11R1.1 NC1=CN=C(C=C1)OCCO MCULE-8509184009 [2,0,0,0,0,0|2,0,0]=4 630 B11R1.1 NCCCC1=CC=C(C=C1)Br MCULE-9595216025 [2,0,0,0,0,0|1,1,0]=4 631 B11R1.1 NCCCC1=CC=C(C=C1)Cl MCULE-1142043760 [2,0,0,0,0,0|1,0,0]=3 632 B11R1.1 NCCCC1=CC=C(C=C1)Cl MCULE-9103465456 [2,0,0,0,0,0|1,0,0]=3 633 B11R1.1 NCCCC1=CC=C(C=C1)F MCULE-3431777437 [2,0,0,0,0,0|1,1,0]=4 634 B11R1.1 NCCCC1=CC=C(C=C1)F MCULE-4673923418 [2,0,0,0,0,0|1,1,0]=4 635 B11R1.1 NCCCC1=CC=C(C=C1)N MCULE-5182106915 [2,0,0,0,0,0|2,0,0]=4 636 B11R1.1 NCCCC1=CC=C(C=C1)N MCULE-6054363220 [2,0,0,0,0,0|2,0,0]=4 637 B11R1.1 NCCCC1=CC=C(C=C1)O MCULE-1996917264 [2,0,0,0,0,0|2,0,0]=4 638 B11R1.1 NCCCC1=CC=C(C=C1)O MCULE-8194739134 [2,0,0,0,0,0|2,0,0]=4 639 B11R1.1 NCCNC1=CC=C(C=C1)Cl MCULE-6899133184 [2,0,0,0,0,0|2,0,0]=4 640 B11R1.1 NCCNC1=CC=C(C=C1)Cl MCULE-9835680607 [2,0,0,0,0,0|2,0,0]=4 641 B11R1.1 NCCOC1=CC=C(C=C1)Br MCULE-3318884969 [2,0,0,0,0,0|1,1,0]=4 642 B11R1.1 NCCOC1=CC=C(C=C1)Br MCULE-7883858991 [2,0,0,0,0,0|1,1,0]=4 643 B11R1.1 NCCOC1=CC=C(C=C1)Cl MCULE-1075264520 [2,0,0,0,0,0|1,0,0]=3 644 B11R1.1 NCCOC1=CC=C(C=C1)Cl MCULE-8477015127 [2,0,0,0,0,0|1,0,0]=3 645 B11R1.1 NCCOC1=CC=C(C=C1)F MCULE-1667785789 [2,0,0,0,0,0|1,1,0]=4 646 B11R1.1 NCCOC1=CC=C(C=C1)F MCULE-3166008678 [2,0,0,0,0,0|1,1,0]=4 647 B11R1.1 NCCOC1=CC=C(C=C1)F MCULE-6249780806 [2,0,0,0,0,0|1,1,0]=4 648 B11R1.1 NCCOC1=CC=C(C=C1)I MCULE-5470526372 [2,0,0,0,0,0|1,1,0]=4 649 B11R1.1 NCCOC1=CC=C(C=C1)N MCULE-1094488230 [2,0,0,0,0,0|2,0,0]=4 650 B11R1.1 NCCOC1=CC=C(C=C1)N MCULE-4370211203 [2,0,0,0,0,0|2,0,0]=4 651 B11R1.1 NCCOC1=CC=C(C=C1)N MCULE-4768215485 [2,0,0,0,0,0|2,0,0]=4 652 B11R1.1 NCCOC1=CC=C(C=C1)O MCULE-4374204072 [2,0,0,0,0,0|2,0,0]=4 653 B11R1.1 NCCOC1=CC=C(C=C1)O MCULE-4377637415 [2,0,0,0,0,0|2,0,0]=4 654 B11R1.1 NCCOC1=CC=C(N=C1)Cl MCULE-3195327047 [2,0,0,0,0,0|2,0,0]=4 655 B11R1.1 NCCOC1=CN=C(C=C1)Cl MCULE-7755106659 [2,0,0,0,0,0|2,0,0]=4 656 B11R1.1 NCCOC1=NC=C(C=C1)Cl MCULE-5868211120 [2,0,0,0,0,0|2,0,0]=4 657 B11R1.1 NCCOC1=NC=C(C=C1)Cl MCULE-6260337406 [2,0,0,0,0,0|2,0,0]=4 658 B11R1.1 NCCSC1=CC=C(C=C1)Cl MCULE-1672796127 [2,0,0,0,0,0|1,1,0]=4 659 B11R1.1 NCCSC1=CC=C(C=C1)Cl MCULE-4826955702 [2,0,0,0,0,0|1,1,0]=4 660 B11R1.1 NNCCC1=CC=C(C=C1)Cl MCULE-8533533939 [2,0,0,0,0,0|2,0,0]=4 661 B11R1.1 NOCCC1=CC=C(C=C1)Cl MCULE-6168725590 [2,0,0,0,0,0|2,0,0]=4 662 B11R1.1 NOCCC1=CC=C(C=C1)Cl MCULE-8064247145 [2,0,0,0,0,0|2,0,0]=4 663 B11R1.1 O=CCCC1=CC=C(C=C1)Cl MCULE-7319845020 [2,0,0,0,0,0|0,0,2]=4 664 B11R1.1 O=CCOC1=CC=C(C=C1)Cl MCULE-6963407283 [2,0,0,0,0,0|0,0,2]=4 665 B11R1.1 OC/C=C/C1=CC=C(C=C1)Cl MCULE-9189888029 [2,0,0,0,0,0|0,0,2]=4 666 B11R1.1 OC1=CC=C(C=C1)OCCBr MCULE-6459927483 [2,0,0,0,0,0|2,0,0]=4 667 B11R1.1 OC1=CC=C(C=C1)OCCF MCULE-6268513094 [2,0,0,0,0,0|2,0,0]=4 668 B11R1.1 OCC#CC1=CC=C(C=C1)Cl MCULE-8879633856 [2,0,0,0,0,0|0,0,2]=4 669 B11R1.1 OCC=CC1=CC=C(C=C1)Cl MCULE-2610952734 [2,0,0,0,0,0|0,0,2]=4 670 B11R1.1 OCCCC1=CC=C(C=C1)Br MCULE-6643038597 [2,0,0,0,0,0|0,1,0]=3 671 B11R1.1 OCCCC1=CC=C(C=C1)Cl MCULE-4902933931 [2,0,0,0,0,0|0,0,0]=2 672 B11R1.1 OCCCC1=CC=C(C=C1)F MCULE-3880816493 [2,0,0,0,0,0|0,1,0]=3 673 B11R1.1 OCCCC1=CC=C(C=C1)O MCULE-4368750678 [2,0,0,0,0,0|1,0,0]=3 674 B11R1.1 OCCCC1=CC=C(N=C1)Br MCULE-9964678216 [2,0,0,0,0,0|1,1,0]=4 675 B11R1.1 OCCCC1=CC=C(N=C1)Cl MCULE-4003392897 [2,0,0,0,0,0|1,0,0]=3 676 B11R1.1 OCCNC1=CC=C(C=C1)Br MCULE-5765016997 [2,0,0,0,0,0|1,1,0]=4 677 B11R1.1 OCCNC1=CC=C(C=C1)Cl MCULE-5179171912 [2,0,0,0,0,0|1,0,0]=3 678 B11R1.1 OCCNC1=CC=C(C=C1)F MCULE-4307483912 [2,0,0,0,0,0|1,1,0]=4 679 B11R1.1 OCCOC1=CC=C(C=C1)Br MCULE-3798440148 [2,0,0,0,0,0|0,1,0]=3 680 B11R1.1 OCCOC1=CC=C(C=C1)Cl MCULE-4863420880 [2,0,0,0,0,0|0,0,0]=2 681 B11R1.1 OCCOC1=CC=C(C=C1)F MCULE-2747862126 [2,0,0,0,0,0|0,1,0]=3 682 B11R1.1 OCCOC1=CC=C(C=C1)I MCULE-3049898017 [2,0,0,0,0,0|0,1,0]=3 683 B11R1.1 OCCOC1=CC=C(C=C1)O MCULE-1426055233 [2,0,0,0,0,0|1,0,0]=3 684 B11R1.1 OCCOC1=CN=C(C=C1)Br MCULE-1012043987 [2,0,0,0,0,0|1,1,0]=4 685 B11R1.1 OCCOC1=NC=C(C=C1)Br MCULE-8887190766 [2,0,0,0,0,0|1,1,0]=4 686 B11R1.1 OCCSC1=CC=C(C=C1)Br MCULE-7010973205 [2,0,0,0,0,0|0,2,0]=4 687 B11R1.1 OCCSC1=CC=C(C=C1)Cl MCULE-5403380064 [2,0,0,0,0,0|0,1,0]=3 688 B11R1.1 OCCSC1=CC=C(C=C1)F MCULE-8337958466 [2,0,0,0,0,0|0,2,0]=4 689 B11R1.1 OCCSC1=CC=C(C=N1)Cl MCULE-7341410398 [2,0,0,0,0,0|1,1,0]=4 690 B11R1.1 SCCCC1=CC=C(C=C1)Br MCULE-2033575664 [2,0,0,0,0,0|0,2,0]=4 691 B11R1.1 SCCCC1=CC=C(C=C1)Cl MCULE-3378799702 [2,0,0,0,0,0|0,1,0]=3 692 B11R1.28 BrCCCCC1=CC=CC=C1 MCULE-6514169369 [2,0,0,0,0,0|2,0,0]=4 693 B11R1.28 BrCCCOC1=CC=CC=C1 MCULE-7435025132 [2,0,0,0,0,0|1,0,0]=3 694 B11R1.28 BrCCCOC1=CC=CN=C1 MCULE-8480741119 [2,0,0,0,0,0|2,0,0]=4 695 B11R1.28 C#CCCOC1=CC=CC=C1 MCULE-2476958652 [2,0,0,0,0,0|1,0,1]=4 696 B11R1.28 CCCCCC1=CC=CC=C1 MCULE-8118768843 [2,0,0,0,0,0|2,0,0]=4 697 B11R1.28 CCCCNC1=CC=CC=C1 MCULE-1727897857 [2,0,0,0,0,0|2,0,0]=4 698 B11R1.28 CCCCOC1=CC=CC=C1 MCULE-6049343059 [2,0,0,0,0,0|1,0,0]=3 699 B11R1.28 CCCCOC1=NC=CC=C1 MCULE-4282859135 [2,0,0,0,0,0|2,0,0]=4 700 B11R1.28 CCCCSC1=CC=CC=C1 MCULE-5757311914 [2,0,0,0,0,0|1,1,0]=4 701 B11R1.28 CNCCOC1=CC=CC=C1 MCULE-3018465413 [2,0,0,0,0,0|2,0,0]=4 702 B11R1.28 CNCCOC1=CC=CC=C1 MCULE-3602224496 [2,0,0,0,0,0|2,0,0]=4 703 B11R1.28 CNCCOC1=CC=CC=C1 MCULE-8264685666 [2,0,0,0,0,0|2,0,0]=4 704 B11R1.28 COCCOC1=CC=CC=C1 MCULE-1219067284 [2,0,0,0,0,0|2,0,0]=4 705 B11R1.28 ClCCCCC1=CC=CC=C1 MCULE-3979825637 [2,0,0,0,0,0|2,0,0]=4 706 B11R1.28 ClCCCOC1=CC=CC=C1 MCULE-7194026086 [2,0,0,0,0,0|1,0,0]=3 707 B11R1.28 ClCCCSC1=CC=CC=C1 MCULE-9331895651 [2,0,0,0,0,0|1,1,0]=4 708 B11R1.28 ICCCCC1=CC=CC=C1 MCULE-2173904278 [2,0,0,0,0,0|2,0,0]=4 709 B11R1.28 N#CCCOC1=CC=CC=C1 MCULE-8953204606 [2,0,0,0,0,0|1,0,1]=4 710 B11R1.28 NCCCCC1=CC=CC=C1 MCULE-3134654670 [2,0,0,0,0,0|2,0,0]=4 711 B11R1.28 NCCCCC1=CC=CC=C1 MCULE-8668959909 [2,0,0,0,0,0|2,0,0]=4 712 B11R1.28 NCCCNC1=CC=CC=C1 MCULE-6169463539 [2,0,0,0,0,0|2,0,0]=4 713 B11R1.28 NCCCOC1=CC=CC=C1 MCULE-3329202690 [2,0,0,0,0,0|1,0,0]=3 714 B11R1.28 NCCCOC1=CC=CC=C1 MCULE-8437626270 [2,0,0,0,0,0|1,0,0]=3 715 B11R1.28 NCCCOC1=CC=NC=C1 MCULE-5994311540 [2,0,0,0,0,0|2,0,0]=4 716 B11R1.28 NCCCOC1=CN=CC=C1 MCULE-9013898653 [2,0,0,0,0,0|2,0,0]=4 717 B11R1.28 NCCCSC1=CC=CC=C1 MCULE-4112972029 [2,0,0,0,0,0|1,1,0]=4 718 B11R1.28 NCCCSC1=CC=CC=C1 MCULE-5709270939 [2,0,0,0,0,0|1,1,0]=4 719 B11R1.28 NNCCOC1=CC=CC=C1 MCULE-6307576942 [2,0,0,0,0,0|2,0,0]=4 720 B11R1.28 NNCCOC1=CC=CC=C1 MCULE-9141137066 [2,0,0,0,0,0|2,0,0]=4 721 B11R1.28 NNCCOC1=CC=CC=C1 MCULE-9380482669 [2,0,0,0,0,0|2,0,0]=4 722 B11R1.28 NOCCOC1=CC=CC=C1 MCULE-4945969889 [2,0,0,0,0,0|2,0,0]=4 723 B11R1.28 NOCCOC1=CC=CC=C1 MCULE-7193857621 [2,0,0,0,0,0|2,0,0]=4 724 B11R1.28 O=CCCOC1=CC=CC=C1 MCULE-3969849914 [2,0,0,0,0,0|0,0,2]=4 725 B11R1.28 OCCC#CC1=CC=CC=C1 MCULE-7167758549 [2,0,0,0,0,0|1,0,1]=4 726 B11R1.28 OCCC=CC1=CC=CC=C1 MCULE-1739095123 [2,0,0,0,0,0|1,0,1]=4 727 B11R1.28 OCCCCC1=CC=CC=C1 MCULE-2245500822 [2,0,0,0,0,0|1,0,0]=3 728 B11R1.28 OCCCCC1=CC=CN=C1 MCULE-2205588715 [2,0,0,0,0,0|2,0,0]=4 729 B11R1.28 OCCCCC1=CC=NC=C1 MCULE-6084447050 [2,0,0,0,0,0|2,0,0]=4 730 B11R1.28 OCCCCC1=CC=NC=C1 MCULE-7907949494 [2,0,0,0,0,0|2,0,0]=4 731 B11R1.28 OCCCCC1=NC=CC=C1 MCULE-9593580777 [2,0,0,0,0,0|2,0,0]=4 732 B11R1.28 OCCCNC1=CC=CC=C1 MCULE-7237361819 [2,0,0,0,0,0|1,0,0]=3 733 B11R1.28 OCCCNC1=NC=CC=C1 MCULE-1261421452 [2,0,0,0,0,0|2,0,0]=4 734 B11R1.28 OCCCOC1=CC=CC=C1 MCULE-3714545952 [2,0,0,0,0,0|0,0,0]=2 735 B11R1.28 OCCCOC1=CC=NC=C1 MCULE-9475157917 [2,0,0,0,0,0|1,0,0]=3 736 B11R1.28 OCCCSC1=CC=CC=C1 MCULE-6438909241 [2,0,0,0,0,0|0,1,0]=3 737 B11R1.28 OCCNCC1=CC=CC=C1 MCULE-3367853062 [2,0,0,0,0,0|2,0,0]=4 738 B11R1.28 OCCNCC1=CC=CC=C1 MCULE-8769899984 [2,0,0,0,0,0|2,0,0]=4 739 B11R1.28 OCCOCC1=CC=CC=C1 MCULE-4710032321 [2,0,0,0,0,0|2,0,0]=4 740 B11R1.28 OCCOCC1=CC=CC=C1 MCULE-5006902625 [2,0,0,0,0,0|2,0,0]=4 741 B11R1.28 OCCSCC1=CC=CC=C1 MCULE-3277023665 [2,0,0,0,0,0|2,0,0]=4 742 B11R1.28 SCCCCC1=CC=CC=C1 MCULE-2213321874 [2,0,0,0,0,0|1,1,0]=4 743 B11R1.91 C=C(C)COC1=CC=CC=C1 MCULE-7083540702 [2,0,0,0,0,0|1,0,1]=4 744 B11R1.91 CC(=O)COC1=CC=CC=C1 MCULE-8124389556 [2,0,0,0,0,0|0,0,2]=4 745 B11R1.91 CC(Br)CCC1=CC=CC=C1 MCULE-5033093327 [2,0,0,0,0,0|2,0,0]=4 746 B11R1.91 CC(C)CCC1=CC=CC=C1 MCULE-4070401105 [2,0,0,0,0,0|2,0,0]=4 747 B11R1.91 CC(C)CNC1=CC=CC=C1 MCULE-3071810123 [2,0,0,0,0,0|2,0,0]=4 748 B11R1.91 CC(C)CNC1=CC=CC=C1 MCULE-7918202255 [2,0,0,0,0,0|2,0,0]=4 749 B11R1.91 CC(Cl)COC1=CC=CC=C1 MCULE-6181043815 [2,0,0,0,0,0|1,0,0]=3 750 B11R1.91 CC(N)CCC1=CC=CC=C1 MCULE-8780190200 [2,0,0,0,0,0|2,0,0]=4 751 B11R1.91 CC(N)CNC1=CC=CC=C1 MCULE-4027215320 [2,0,0,0,0,0|2,0,0]=4 752 B11R1.91 CC(N)COC1=CC=CC=C1 MCULE-2954474601 [2,0,0,0,0,0|1,0,0]=3 753 B11R1.91 CC(N)COC1=CC=CC=C1 MCULE-3081214334 [2,0,0,0,0,0|1,0,0]=3 754 B11R1.91 CC(O)C#CC1=CC=CC=C1 MCULE-5271255765 [2,0,0,0,0,0|1,0,1]=4 755 B11R1.91 CC(O)C=CC1=CC=CC=C1 MCULE-5117324409 [2,0,0,0,0,0|1,0,1]=4 756 B11R1.91 CC(O)CCC1=CC=CC=C1 MCULE-6593078697 [2,0,0,0,0,0|1,0,0]=3 757 B11R1.91 CC(O)CCC1=CC=CC=N1 MCULE-7087256380 [2,0,0,0,0,0|2,0,0]=4 758 B11R1.91 CC(O)CCC1=CN=CC=C1 MCULE-3486488840 [2,0,0,0,0,0|2,0,0]=4 759 B11R1.91 CC(O)CNC1=CC=CC=C1 MCULE-4909285117 [2,0,0,0,0,0|1,0,0]=3 760 B11R1.91 CC(O)COC1=CC=CC=C1 MCULE-7693044068 [2,0,0,0,0,0|0,0,0]=2 761 B11R1.91 C[C@@H](N)CCC1=CC=CC=C1 MCULE-3014014292 [2,0,0,0,0,0|2,0,0]=4 762 B11R1.91 C[C@@H](N)COC1=CC=CC=C1 MCULE-9920037299 [2,0,0,0,0,0|1,0,0]=3 763 B11R1.91 C[C@@H](O)CCC1=CC=CC=C1 MCULE-6982217571 [2,0,0,0,0,0|1,0,0]=3 764 B11R1.91 C[C@@H](O)CCC1=CC=CC=C1 MCULE-9627887662 [2,0,0,0,0,0|1,0,0]=3 765 B11R1.91 C[C@H](N)CCC1=CC=CC=C1 MCULE-6029467007 [2,0,0,0,0,0|2,0,0]=4 766 B11R1.91 C[C@H](O)/C=C/C1=CC=CC=C1 MCULE-7363806853 [2,0,0,0,0,0|1,0,1]=4 767 B11R1.91 C[C@H](O)C=CC1=CC=CC=C1 MCULE-4644208236 [2,0,0,0,0,0|1,0,1]=4 768 B11R1.91 C[C@H](O)CCC1=CC=CC=C1 MCULE-3170440651 [2,0,0,0,0,0|1,0,0]=3 769 B11R1.91 FC(F)COC1=CC=CC=C1 MCULE-7239056257 [2,0,0,0,0,0|2,0,0]=4 770 B11R1.91 O=C(O)COC1=CC=CC=C1 MCULE-5625991303 [2,0,0,0,0,0|0,0,2]=4 771 B11R1.91 OB(O)CCC1=CC=CC=C1 MCULE-5105757901 [2,0,0,0,0,0|2,0,0]=4 772 B11R1.91 [C@@H](C)(O)CCC1=CC=CC=C1 MCULE-4848287986 [2,0,0,0,0,0|1,0,0]=3 773 B11R1.91 [C@H](C)(N)CCC1=CC=CC=C1 MCULE-2541579869 [2,0,0,0,0,0|2,0,0]=4 774 B13R1.9 BrCCCCOC1=CC=C(C=C1)Br MCULE-4008439106 [1,1,0,0,0,0|1,1,0]=4 775 B13R1.9 C=CCCCCC1=CC=C(C=C1)Cl MCULE-4913979573 [1,1,0,0,0,0|2,0,0]=4 776 B13R1.9 C=CCCCOC1=CC=C(C=C1)Br MCULE-6755432671 [1,1,0,0,0,0|1,1,0]=4 777 B13R1.9 CC1=CC=C(C=C1)C#CCCCO MCULE-6205054811 [1,1,0,0,0,0|2,0,0]=4 778 B13R1.9 CC1=CC=C(C=C1)C=CCCCO MCULE-2061768809 [1,1,0,0,0,0|2,0,0]=4 779 B13R1.9 CC1=CC=C(C=C1)CNCCCO MCULE-2436422806 [1,1,0,0,0,0|2,0,0]=4 780 B13R1.9 CC1=CC=C(C=C1)CNCCCO MCULE-7809981604 [1,1,0,0,0,0|2,0,0]=4 781 B13R1.9 CC1=CC=C(C=C1)NCCCCO MCULE-5371669467 [1,1,0,0,0,0|2,0,0]=4 782 B13R1.9 CC1=CC=C(C=C1)OCCCCBr MCULE-7781281296 [1,1,0,0,0,0|2,0,0]=4 783 B13R1.9 CC1=CC=C(C=C1)OCCCCN MCULE-4480124265 [1,1,0,0,0,0|2,0,0]=4 784 B13R1.9 CC1=CC=C(C=C1)OCCCCS MCULE-2819578610 [1,1,0,0,0,0|1,1,0]=4 785 B13R1.9 CCCCC#CC1=CC=C(C=C1)Cl MCULE-7695447569 [1,1,0,0,0,0|2,0,0]=4 786 B13R1.9 CCCCCOC1=CC=C(C=C1)Br MCULE-5221351936 [1,1,0,0,0,0|1,1,0]=4 787 B13R1.9 CCCCCOC1=CC=C(C=C1)N MCULE-6546828234 [1,1,0,0,0,0|2,0,0]=4 788 B13R1.9 CCCCCOC1=CC=C(C=C1)O MCULE-1157941118 [1,1,0,0,0,0|2,0,0]=4 789 B13R1.9 CCCCCOC1=CC=C(C=C1)S MCULE-4873891940 [1,1,0,0,0,0|2,0,0]=4 790 B13R1.9 CCCCNCC1=CC=C(C=C1)Cl MCULE-5624551092 [1,1,0,0,0,0|2,0,0]=4 791 B13R1.9 CCCCNCC1=CC=C(C=C1)Cl MCULE-6810899571 [1,1,0,0,0,0|2,0,0]=4 792 B13R1.9 CCCCOCC1=CC=C(C=C1)Br MCULE-5080766496 [1,1,0,0,0,0|1,1,0]=4 793 B13R1.9 CCCCOCC1=CC=C(C=C1)S MCULE-7049517126 [1,1,0,0,0,0|2,0,0]=4 794 B13R1.9 CCNCCOC1=CC=C(C=C1)Br MCULE-1710123997 [1,1,0,0,0,0|1,1,0]=4 795 B13R1.9 CCNCCOC1=CC=C(C=C1)Br MCULE-5916632575 [1,1,0,0,0,0|1,1,0]=4 796 B13R1.9 CCNCCOC1=CC=C(C=C1)C MCULE-7557454389 [1,1,0,0,0,0|2,0,0]=4 797 B13R1.9 CCNCCOC1=CC=C(C=C1)Cl MCULE-1502137855 [1,1,0,0,0,0|1,0,0]=3 798 B13R1.9 CCNCCOC1=CC=C(C=C1)Cl MCULE-4968509220 [1,1,0,0,0,0|1,0,0]=3 799 B13R1.9 CCNCCOC1=CC=C(C=C1)F MCULE-4328539760 [1,1,0,0,0,0|1,1,0]=4 800 B13R1.9 CCNCCOC1=CC=C(C=C1)I MCULE-5763642164 [1,1,0,0,0,0|1,1,0]=4 801 B13R1.9 CCNCCOC1=CC=C(C=C1)I MCULE-7984255428 [1,1,0,0,0,0|1,1,0]=4 802 B13R1.9 CCOCCNC1=CC=C(C=C1)Cl MCULE-1935047604 [1,1,0,0,0,0|2,0,0]=4 803 B13R1.9 CCOCCNC1=CC=C(C=C1)Cl MCULE-7857480067 [1,1,0,0,0,0|2,0,0]=4 804 B13R1.9 CCOCCOC1=CC=C(C=C1)Br MCULE-7335801691 [1,1,0,0,0,0|1,1,0]=4 805 B13R1.9 CCOCCOC1=CC=C(C=C1)N MCULE-3082203350 [1,1,0,0,0,0|2,0,0]=4 806 B13R1.9 CCOCCOC1=CC=C(C=C1)N MCULE-6302612789 [1,1,0,0,0,0|2,0,0]=4 807 B13R1.9 CNCCCOC1=CC=C(C=C1)Br MCULE-7067341108 [1,1,0,0,0,0|1,1,0]=4 808 B13R1.9 CNCCCOC1=CC=C(C=C1)Br MCULE-7904753236 [1,1,0,0,0,0|1,1,0]=4 809 B13R1.9 CNCCCOC1=CC=C(C=C1)C MCULE-4600752617 [1,1,0,0,0,0|2,0,0]=4 810 B13R1.9 CNCCCOC1=CC=C(C=C1)Cl MCULE-8275977225 [1,1,0,0,0,0|1,0,0]=3 811 B13R1.9 CNCCCOC1=CC=C(C=C1)F MCULE-6408980158 [1,1,0,0,0,0|1,1,0]=4 812 B13R1.9 CNCCCOC1=CC=C(C=C1)F MCULE-9693478947 [1,1,0,0,0,0|1,1,0]=4 813 B13R1.9 CNCCOCC1=CC=C(C=C1)Cl MCULE-4199937052 [1,1,0,0,0,0|2,0,0]=4 814 B13R1.9 CNCCOCC1=CC=C(C=C1)Cl MCULE-6384055082 [1,1,0,0,0,0|2,0,0]=4 815 B13R1.9 COCCCNC1=CC=C(C=C1)C MCULE-6315268016 [1,1,0,0,0,0|2,0,0]=4 816 B13R1.9 COCCCOC1=CC=C(C=C1)Br MCULE-6879029855 [1,1,0,0,0,0|0,1,0]=3 817 B13R1.9 COCCCOC1=CC=C(C=C1)N MCULE-3299871394 [1,1,0,0,0,0|1,0,0]=3 818 B13R1.9 COCCCOC1=CN=C(C=C1)Br MCULE-1394183262 [1,1,0,0,0,0|1,1,0]=4 819 B13R1.9 COCCCOC1=CN=C(C=C1)N MCULE-4859329851 [1,1,0,0,0,0|2,0,0]=4 820 B13R1.9 COCCCSC1=CC=C(C=C1)N MCULE-5471370121 [1,1,0,0,0,0|1,1,0]=4 821 B13R1.9 COCCNCC1=CC=C(C=C1)Cl MCULE-1573090830 [1,1,0,0,0,0|2,0,0]=4 822 B13R1.9 COCCNCC1=CC=C(C=C1)Cl MCULE-4313885576 [1,1,0,0,0,0|2,0,0]=4 823 B13R1.9 COCCNCC1=CC=C(C=C1)Cl MCULE-7639716981 [1,1,0,0,0,0|2,0,0]=4 824 B13R1.9 ClC1=CC=C(C=C1)CNCCCBr MCULE-3838017602 [1,1,0,0,0,0|2,0,0]=4 825 B13R1.9 ClC1=CC=C(C=C1)CNCCCBr MCULE-9924670293 [1,1,0,0,0,0|2,0,0]=4 826 B13R1.9 ClC1=CC=C(C=C1)OCCCCBr MCULE-1669803915 [1,1,0,0,0,0|1,0,0]=3 827 B13R1.9 ClCCCC#CC1=CC=C(C=C1)Cl MCULE-2809837917 [1,1,0,0,0,0|2,0,0]=4 828 B13R1.9 FC1=CC=C(C=C1)OCCCCS MCULE-3087506270 [1,1,0,0,0,0|0,2,0]=4 829 B13R1.9 FCCCCOC1=CC=C(C=C1)Br MCULE-6317678531 [1,1,0,0,0,0|1,1,0]=4 830 B13R1.9 FCCCOCC1=CC=C(C=C1)Br MCULE-2024705260 [1,1,0,0,0,0|1,1,0]=4 831 B13R1.9 N#CCCCOC1=CC=C(C=C1)F MCULE-4180178541 [1,1,0,0,0,0|1,1,0]=4 832 B13R1.9 N#N=NCCOC1=CC=C(C=C1)Cl MCULE-9790562451 [1,1,0,0,0,0|2,0,0]=4 833 B13R1.9 NC1=CC=C(C=C1)CCNCCO MCULE-3212733463 [1,1,0,0,0,0|2,0,0]=4 834 B13R1.9 NCC=CCOC1=CC=C(C=C1)Cl MCULE-5042628489 [1,1,0,0,0,0|1,0,1]=4 835 B13R1.9 NCCCCOC1=CC=C(C=C1)Br MCULE-1793825067 [1,1,0,0,0,0|1,1,0]=4 836 B13R1.9 NCCCCOC1=CC=C(C=C1)Cl MCULE-2539338971 [1,1,0,0,0,0|1,0,0]=3 837 B13R1.9 NCCCCOC1=CC=C(C=C1)Cl MCULE-8862410344 [1,1,0,0,0,0|1,0,0]=3 838 B13R1.9 NCCCCOC1=CC=C(C=C1)F MCULE-5358133825 [1,1,0,0,0,0|1,1,0]=4 839 B13R1.9 NCCCNCC1=CC=C(C=C1)Cl MCULE-1936212097 [1,1,0,0,0,0|2,0,0]=4 840 B13R1.9 NCCCSCC1=CC=C(C=C1)Cl MCULE-1549849660 [1,1,0,0,0,0|1,1,0]=4 841 B13R1.9 OCCCC#CC1=CC=C(C=C1)Cl MCULE-4512111318 [1,1,0,0,0,0|1,0,0]=3 842 B13R1.9 OCCCC#CC1=CC=C(C=C1)F MCULE-7814727193 [1,1,0,0,0,0|1,1,0]=4 843 B13R1.9 OCCCCNC1=CC=C(C=C1)F MCULE-4360514882 [1,1,0,0,0,0|1,1,0]=4 844 B13R1.9 OCCCCNC1=CC=C(C=C1)F MCULE-5620770961 [1,1,0,0,0,0|1,1,0]=4 845 B13R1.9 OCCCCOC1=CC=C(C=C1)Br MCULE-2787629625 [1,1,0,0,0,0|0,1,0]=3 846 B13R1.9 OCCCCOC1=CC=C(C=C1)O MCULE-5892292141 [1,1,0,0,0,0|1,0,0]=3 847 B13R1.9 OCCCCSC1=CC=C(C=C1)Cl MCULE-9622566448 [1,1,0,0,0,0|0,1,0]=3 848 B13R1.9 OCCCCSC1=CC=C(C=C1)O MCULE-5837316807 [1,1,0,0,0,0|1,1,0]=4 849 B13R1.9 OCCCNCC1=CC=C(C=C1)Br MCULE-2515584150 [1,1,0,0,0,0|1,1,0]=4 850 B13R1.9 OCCCNCC1=CC=C(C=C1)Br MCULE-2715046811 [1,1,0,0,0,0|1,1,0]=4 851 B13R1.9 OCCCNCC1=CC=C(C=C1)Cl MCULE-7525622236 [1,1,0,0,0,0|1,0,0]=3 852 B13R1.9 OCCCNCC1=CC=C(C=C1)Cl MCULE-9475519837 [1,1,0,0,0,0|1,0,0]=3 853 B13R1.9 OCCCNCC1=CC=C(C=C1)F MCULE-1945791227 [1,1,0,0,0,0|1,1,0]=4 854 B13R1.9 OCCCNCC1=CC=C(C=C1)F MCULE-6286414734 [1,1,0,0,0,0|1,1,0]=4 855 B13R1.9 OCCOCCC1=CC=C(C=C1)Br MCULE-2647903581 [1,1,0,0,0,0|1,1,0]=4 856 B13R1.17 CC(OCCO)C1=CC=C(C=C1)Cl MCULE-1431951299 [1,1,0,0,0,0|2,0,0]=4 857 B13R1.17 CC1=CC=C(C=C1)C(O)CCCO MCULE-3903253493 [1,1,0,0,0,0|2,0,0]=4 858 B13R1.17 CC1=CC=C(C=C1)[C@@H](N)CCCO MCULE-2563365079 [1,1,0,0,0,0|2,0,0]=4 859 B13R1.17 CC1=CC=C(C=C1)[C@@H](N)CCCO MCULE-6090445536 [1,1,0,0,0,0|2,0,0]=4 860 B13R1.17 CC1=CC=C(C=C1)[C@H](N)CCCO MCULE-1972053247 [1,1,0,0,0,0|2,0,0]=4 861 B13R1.17 CC1=CC=C(C=C1)[C@H](N)CCCO MCULE-9860947658 [1,1,0,0,0,0|2,0,0]=4 862 B13R1.17 CCCCC(=O)C1=CC=C(C=C1)Cl MCULE-3997083518 [1,1,0,0,0,0|2,0,0]=4 863 B13R1.17 CCCCC(N)C1=CC=C(C=C1)Cl MCULE-2774456788 [1,1,0,0,0,0|2,0,0]=4 864 B13R1.17 CCCCC(N)C1=CC=C(C=C1)Cl MCULE-6795723125 [1,1,0,0,0,0|2,0,0]=4 865 B13R1.17 CCCC[C@@H](N)C1=CC=C(C=C1)Cl MCULE-5283669143 [1,1,0,0,0,0|2,0,0]=4 866 B13R1.17 CCCC[C@@H](N)C1=CC=C(C=C1)Cl MCULE-7287920280 [1,1,0,0,0,0|2,0,0]=4 867 B13R1.17 CCCC[C@H](N)C1=CC=C(C=C1)Cl MCULE-6257804463 [1,1,0,0,0,0|2,0,0]=4 868 B13R1.17 CCCC[C@H](N)C1=CC=C(C=C1)Cl MCULE-6782120139 [1,1,0,0,0,0|2,0,0]=4 869 B13R1.17 NC(CCCO)C1=CC=C(C=C1)Cl MCULE-7861341236 [1,1,0,0,0,0|1,0,0]=3 870 B13R1.17 NC1=CC=C(C=C1)C(=O)CCCO MCULE-9898464704 [1,1,0,0,0,0|2,0,0]=4 871 B13R1.17 NCCC[C@@H](N)C1=CC=C(C=C1)Cl MCULE-5922832922 [1,1,0,0,0,0|2,0,0]=4 872 B13R1.17 NCCC[C@@H](N)C1=CC=C(C=C1)Cl MCULE-9038157979 [1,1,0,0,0,0|2,0,0]=4 873 B13R1.17 NCCC[C@H](N)C1=CC=C(C=C1)Cl MCULE-1623662689 [1,1,0,0,0,0|2,0,0]=4 874 B13R1.17 NCCC[C@H](N)C1=CC=C(C=C1)Cl MCULE-4443963182 [1,1,0,0,0,0|2,0,0]=4 875 B13R1.17 N[C@@H](CCCO)C1=CC=C(C=C1)Br MCULE-5298700199 [1,1,0,0,0,0|1,1,0]=4 876 B13R1.17 N[C@@H](CCCO)C1=CC=C(C=C1)Br MCULE-8040233159 [1,1,0,0,0,0|1,1,0]=4 877 B13R1.17 N[C@@H](CCCO)C1=CC=C(C=C1)Cl MCULE-4659594511 [1,1,0,0,0,0|1,0,0]=3 878 B13R1.17 N[C@@H](CCCO)C1=CC=C(C=C1)Cl MCULE-8740568575 [1,1,0,0,0,0|1,0,0]=3 879 B13R1.17 N[C@@H](CCCO)C1=CC=C(C=C1)F MCULE-2805952690 [1,1,0,0,0,0|1,1,0]=4 880 B13R1.17 N[C@@H](CCCO)C1=CC=C(C=C1)F MCULE-9749062768 [1,1,0,0,0,0|1,1,0]=4 881 B13R1.17 N[C@@H](CCCO)C1=CC=C(C=C1)I MCULE-1841577287 [1,1,0,0,0,0|1,1,0]=4 882 B13R1.17 N[C@@H](CCCO)C1=CC=C(C=C1)I MCULE-8395998236 [1,1,0,0,0,0|1,1,0]=4 883 B13R1.17 N[C@@H](CCCO)C1=CC=C(C=C1)O MCULE-1084384695 [1,1,0,0,0,0|2,0,0]=4 884 B13R1.17 N[C@@H](CCCO)C1=CC=C(C=C1)O MCULE-1099949263 [1,1,0,0,0,0|2,0,0]=4 885 B13R1.17 N[C@@H](CCCO)C1=CC=C(N=C1)Cl MCULE-4217007388 [1,1,0,0,0,0|2,0,0]=4 886 B13R1.17 N[C@@H](CCCO)C1=CC=C(N=C1)Cl MCULE-6734567386 [1,1,0,0,0,0|2,0,0]=4 887 B13R1.17 N[C@H](CCCO)C1=CC=C(C=C1)Br MCULE-2873677616 [1,1,0,0,0,0|1,1,0]=4 888 B13R1.17 N[C@H](CCCO)C1=CC=C(C=C1)Br MCULE-4771664162 [1,1,0,0,0,0|1,1,0]=4 889 B13R1.17 N[C@H](CCCO)C1=CC=C(C=C1)Cl MCULE-2846340183 [1,1,0,0,0,0|1,0,0]=3 890 B13R1.17 N[C@H](CCCO)C1=CC=C(C=C1)Cl MCULE-9012622744 [1,1,0,0,0,0|1,0,0]=3 891 B13R1.17 N[C@H](CCCO)C1=CC=C(C=C1)F MCULE-1057057313 [1,1,0,0,0,0|1,1,0]=4 892 B13R1.17 N[C@H](CCCO)C1=CC=C(C=C1)F MCULE-3449834381 [1,1,0,0,0,0|1,1,0]=4 893 B13R1.17 N[C@H](CCCO)C1=CC=C(C=C1)I MCULE-7428719958 [1,1,0,0,0,0|1,1,0]=4 894 B13R1.17 N[C@H](CCCO)C1=CC=C(C=C1)I MCULE-7558261869 [1,1,0,0,0,0|1,1,0]=4 895 B13R1.17 N[C@H](CCCO)C1=CC=C(C=C1)O MCULE-4377275716 [1,1,0,0,0,0|2,0,0]=4 896 B13R1.17 N[C@H](CCCO)C1=CC=C(C=C1)O MCULE-5799006227 [1,1,0,0,0,0|2,0,0]=4 897 B13R1.17 N[C@H](CCCO)C1=CC=C(N=C1)Cl MCULE-6078697820 [1,1,0,0,0,0|2,0,0]=4 898 B13R1.17 N[C@H](CCCO)C1=CC=C(N=C1)Cl MCULE-6550968515 [1,1,0,0,0,0|2,0,0]=4 899 B13R1.17 O=C(CCCBr)C1=CC=C(C=C1)Cl MCULE-9755624689 [1,1,0,0,0,0|2,0,0]=4 900 B13R1.17 O=C(CCCCl)C1=CC=C(C=C1)Cl MCULE-4163205522 [1,1,0,0,0,0|2,0,0]=4 901 B13R1.17 O=C(NCCO)C1=CC=C(C=C1)Cl MCULE-4415335034 [1,1,0,0,0,0|2,0,0]=4 902 B13R1.17 OCCCC(O)C1=CC=C(C=C1)F MCULE-7416612549 [1,1,0,0,0,0|1,1,0]=4 903 B13R1.19 CCCC(=O)OC1=CC=C(C=C1)Cl MCULE-1965141266 [1,1,0,0,0,0|1,0,1]=4 904 B13R1.19 CCCC(O)CC1=CC=C(C=C1)Cl MCULE-7996918232 [1,1,0,0,0,0|2,0,0]=4 905 B13R1.19 CN(CCO)CC1=CC=C(C=C1)Cl MCULE-5633302044 [1,1,0,0,0,0|2,0,0]=4 906 B13R1.369 BrCCCOC1=CC=C(C=C1I)Br MCULE-2950519754 [1,1,0,0,0,0|1,1,0]=4 907 B13R1.369 C=CCCOC1=C(C=C(C=C1)Cl)Br MCULE-2756549024 [1,1,0,0,0,0|1,0,1]=4 908 B13R1.369 CC1=C(C=CC(=C1)Br)OCCCCl MCULE-7408077053 [1,1,0,0,0,0|1,1,0]=4 909 B13R1.369 CC1=C(C=CC(=C1)N)OCCCO MCULE-6817435217 [1,1,0,0,0,0|1,0,0]=3 910 B13R1.369 CC1=CC(=C(C=C1)OCCCO)C MCULE-3515999389 [1,1,0,0,0,0|1,0,0]=3 911 B13R1.369 CC1=CC(=CC=C1C#CCCO)Cl MCULE-5403564841 [1,1,0,0,0,0|1,0,1]=4 912 B13R1.369 CCCCOC1=C(C=C(C=C1)Br)Cl MCULE-2457514556 [1,1,0,0,0,0|1,1,0]=4 913 B13R1.369 CCCCOC1=C(C=C(C=C1)Br)N MCULE-8351975397 [1,1,0,0,0,0|1,1,0]=4 914 B13R1.369 CCCCOC1=C(C=C(C=C1)C)Br MCULE-6939565289 [1,1,0,0,0,0|2,0,0]=4 915 B13R1.369 CCCCOC1=C(C=C(C=C1)C)N MCULE-6089093593 [1,1,0,0,0,0|2,0,0]=4 916 B13R1.369 CCCCOC1=C(C=C(C=C1)C)S MCULE-1055222009 [1,1,0,0,0,0|2,0,0]=4 917 B13R1.369 CCCCOC1=C(C=C(C=C1)Cl)N MCULE-4928786071 [1,1,0,0,0,0|1,0,0]=3 918 B13R1.369 CCCCOC1=C(C=C(C=C1)F)N MCULE-4276176570 [1,1,0,0,0,0|1,1,0]=4 919 B13R1.369 CCCCOC1=C(C=C(C=C1)F)S MCULE-5063959526 [1,1,0,0,0,0|1,1,0]=4 920 B13R1.369 CCCCOC1=C(C=C(C=C1)I)F MCULE-1741209157 [1,1,0,0,0,0|1,1,0]=4 921 B13R1.369 CCCCOC1=C(C=C(C=C1)I)N MCULE-2778950394 [1,1,0,0,0,0|1,1,0]=4 922 B13R1.369 CCCCOC1=C(C=C(C=C1)N)C MCULE-2522838792 [1,1,0,0,0,0|2,0,0]=4 923 B13R1.369 CCCCOC1=C(C=C(C=C1)N)Cl MCULE-7741392812 [1,1,0,0,0,0|2,0,0]=4 924 B13R1.369 CCCCOC1=C(C=C(C=C1)N)F MCULE-9775505596 [1,1,0,0,0,0|2,0,0]=4 925 B13R1.369 CCCCOC1=C(C=C(C=C1)O)F MCULE-6274862842 [1,1,0,0,0,0|2,0,0]=4 926 B13R1.369 CCCCOC1=CC=C(C=C1Br)Cl MCULE-4712650172 [1,1,0,0,0,0|1,0,0]=3 927 B13R1.369 CCCCOC1=CC=C(C=C1Br)F MCULE-3299693544 [1,1,0,0,0,0|1,1,0]=4 928 B13R1.369 CCCCOC1=CC=C(C=C1C)Br MCULE-7729636136 [1,1,0,0,0,0|1,1,0]=4 929 B13R1.369 CCCCOC1=CC=C(C=C1C)S MCULE-1102137220 [1,1,0,0,0,0|2,0,0]=4 930 B13R1.369 CCCCOC1=CC=C(C=C1Cl)S MCULE-9066958218 [1,1,0,0,0,0|2,0,0]=4 931 B13R1.369 CCCCOC1=CC=C(C=C1F)Br MCULE-6857908451 [1,1,0,0,0,0|1,1,0]=4 932 B13R1.369 CCCCOC1=CC=C(C=C1F)S MCULE-4638752310 [1,1,0,0,0,0|2,0,0]=4 933 B13R1.369 CCCCOC1=CC=C(C=C1I)Cl MCULE-9476903168 [1,1,0,0,0,0|1,0,0]=3 934 B13R1.369 CCCCOC1=CC=C(C=C1S)Cl MCULE-4476144252 [1,1,0,0,0,0|1,0,0]=3 935 B13R1.369 CCCCOC1=NC=C(C=C1Br)Cl MCULE-1944563106 [1,1,0,0,0,0|2,0,0]=4 936 B13R1.369 CNCCOC1=C(C=C(C=C1)Cl)C MCULE-3160374522 [1,1,0,0,0,0|2,0,0]=4 937 B13R1.369 COCCOC1=CC=C(C=C1I)Cl MCULE-8313108068 [1,1,0,0,0,0|2,0,0]=4 938 B13R1.369 COCCOC1=CC=C(C=C1N)Cl MCULE-4290909646 [1,1,0,0,0,0|2,0,0]=4 939 B13R1.369 ClC1=CC(=C(C=C1)OCCCBr)Cl MCULE-7764524264 [1,1,0,0,0,0|1,0,0]=3 940 B13R1.369 ClCCCOC1=C(C=C(C=C1)Br)Cl MCULE-2123329810 [1,1,0,0,0,0|1,1,0]=4 941 B13R1.369 FC1=C(C=CC(=C1)Br)OCCCCl MCULE-7579832918 [1,1,0,0,0,0|1,1,0]=4 942 B13R1.369 FC1=CC(=CC=C1OCCCBr)Br MCULE-2501822356 [1,1,0,0,0,0|1,1,0]=4 943 B13R1.369 FC1=CC=C(C(=C1)F)OCCCBr MCULE-8675485084 [1,1,0,0,0,0|1,1,0]=4 944 B13R1.369 N#CCCOC1=C(C=C(C=C1)Cl)Br MCULE-1105400000 [1,1,0,0,0,0|1,0,1]=4 945 B13R1.369 N#CCCOC1=C(C=C(C=C1)Cl)F MCULE-8269841945 [1,1,0,0,0,0|1,0,1]=4 946 B13R1.369 N#CCCOC1=CC=C(C=C1Cl)Cl MCULE-4852887971 [1,1,0,0,0,0|1,0,1]=4 947 B13R1.369 N(CCO)CC1=C(C=C(C=C1)Cl)Cl MCULE-9857623819 [1,1,0,0,0,0|2,0,0]=4 948 B13R1.369 NC1=C(C=CC(=C1)F)OCCCO MCULE-3418169171 [1,1,0,0,0,0|0,1,0]=3 949 B13R1.369 NC1=CC(=C(C=C1)OCCCO)F MCULE-8800897297 [1,1,0,0,0,0|1,0,0]=3 950 B13R1.369 NCCCCC1=C(C=C(C=C1)Cl)Cl MCULE-9663717142 [1,1,0,0,0,0|2,0,0]=4 951 B13R1.369 NCCCOC1=C(C=C(C=C1)Br)Cl MCULE-1088972284 [1,1,0,0,0,0|1,1,0]=4 952 B13R1.369 NCCCOC1=C(C=C(C=C1)Cl)Cl MCULE-2695104114 [1,1,0,0,0,0|1,0,0]=3 953 B13R1.369 NCCCOC1=C(C=C(C=C1)Cl)Cl MCULE-2807969760 [1,1,0,0,0,0|1,0,0]=3 954 B13R1.369 OCCCOC1=C(C=C(C=C1)Cl)Cl MCULE-2214279465 [1,1,0,0,0,0|0,0,0]=2 955 B13R1.369 OCCNCC1=C(C=C(C=C1)Cl)Cl MCULE-4413091870 [1,1,0,0,0,0|2,0,0]=4 956 B13R1.369 OCCSCC1=CC=C(C=C1Cl)Cl MCULE-1827372009 [1,1,0,0,0,0|2,0,0]=4 957 B13R1.371 C#CC1=CC=C(C=C1)OCCCC MCULE-4601750906 [1,1,0,0,0,0|2,0,0]=4 958 B13R1.371 C#CC1=CC=C(C=C1)OCCCN MCULE-8264918481 [1,1,0,0,0,0|2,0,0]=4 959 B13R1.371 CCC1=CC=C(C=C1)OCCCBr MCULE-3983439795 [1,1,0,0,0,0|2,0,0]=4 960 B13R1.371 CCCCOC1=CC=C(C=C1)C#N MCULE-5459967659 [1,1,0,0,0,0|2,0,0]=4 961 B13R1.371 CCCCOC1=CC=C(C=C1)C=O MCULE-9583711221 [1,1,0,0,0,0|2,0,0]=4 962 B13R1.371 CCCCOC1=CC=C(C=C1)CN MCULE-7444557815 [1,1,0,0,0,0|2,0,0]=4 963 B13R1.371 CCCCOC1=CC=C(C=C1)CN MCULE-8504274073 [1,1,0,0,0,0|2,0,0]=4 964 B13R1.371 CCCCOC1=CC=C(C=C1)CO MCULE-8691141550 [1,1,0,0,0,0|2,0,0]=4 965 B13R1.371 CCCCOC1=CC=C(C=C1)OC MCULE-8523644095 [1,1,0,0,0,0|2,0,0]=4 966 B13R1.371 CCCCOC1=CC=C(C=C1)SC MCULE-1727815751 [1,1,0,0,0,0|2,0,0]=4 967 B13R1.371 COC1=CC=C(C=C1)CCCCO MCULE-4790659722 [1,1,0,0,0,0|2,0,0]=4 968 B13R1.371 COC1=CC=C(C=C1)OCCCBr MCULE-2017166844 [1,1,0,0,0,0|2,0,0]=4 969 B13R1.371 COC1=CC=C(C=C1)OCCCI MCULE-8661749194 [1,1,0,0,0,0|2,0,0]=4 970 B13R1.371 COC1=CC=C(C=C1)OCCCN MCULE-2238044008 [1,1,0,0,0,0|2,0,0]=4 971 B13R1.371 COC1=CC=C(C=C1)OCCCN MCULE-5299200898 [1,1,0,0,0,0|2,0,0]=4 972 B13R1.371 COC1=CC=C(C=C1)OCCCO MCULE-8625325124 [1,1,0,0,0,0|1,0,0]=3 973 B13R1.371 COC1=CC=C(C=C1)OCCCS MCULE-6009174663 [1,1,0,0,0,0|1,1,0]=4 974 B13R1.371 COCCOC1=CC=C(C=C1)CCl MCULE-4954363747 [1,1,0,0,0,0|2,0,0]=4 975 B13R1.371 CSC1=CC=C(C=C1)OCCCN MCULE-9082539072 [1,1,0,0,0,0|2,0,0]=4 976 B13R1.371 N#CC1=CC=C(C=C1)NCCCO MCULE-7212025685 [1,1,0,0,0,0|2,0,0]=4 977 B13R1.371 N#CC1=CC=C(C=C1)OCCCBr MCULE-5914298588 [1,1,0,0,0,0|2,0,0]=4 978 B13R1.371 N#CC1=CC=C(C=C1)OCCCCl MCULE-2380549411 [1,1,0,0,0,0|2,0,0]=4 979 B13R1.371 N#CC1=CC=C(C=C1)OCCCN MCULE-9991173711 [1,1,0,0,0,0|2,0,0]=4 980 B13R1.371 N#CC1=CC=C(C=C1)OCCCO MCULE-4399196034 [1,1,0,0,0,0|1,0,0]=3 981 B13R1.371 O=CC1=CC=C(C=C1)OCCCBr MCULE-7738683101 [1,1,0,0,0,0|2,0,0]=4 982 B13R1.371 O=CC1=CC=C(C=C1)OCCCCl MCULE-6524820458 [1,1,0,0,0,0|2,0,0]=4 983 B13R1.371 O=CC1=CC=C(C=C1)OCCCF MCULE-7015870899 [1,1,0,0,0,0|2,0,0]=4 984 B13R1.371 OCC1=CC=C(C=C1)OCCCBr MCULE-4645684055 [1,1,0,0,0,0|2,0,0]=4 985 B13R1.371 OCC1=CC=C(C=C1)OCCCF MCULE-3164522015 [1,1,0,0,0,0|2,0,0]=4 986 B13R1.513 CC(C)CCOC1=CC=C(C=C1)Br MCULE-1752269767 [1,1,0,0,0,0|1,1,0]=4 987 B13R1.513 CC(C)CCOC1=CC=C(C=C1)N MCULE-5310939553 [1,1,0,0,0,0|2,0,0]=4 988 B13R1.513 CC(C)CCOC1=CC=C(C=C1)N MCULE-6700704639 [1,1,0,0,0,0|2,0,0]=4 989 B13R1.513 CC(C)CCOC1=CC=C(C=C1)S MCULE-5965982142 [1,1,0,0,0,0|2,0,0]=4 990 B13R1.513 CC(O)CC#CC1=CC=C(C=C1)Cl MCULE-6899749967 [1,1,0,0,0,0|1,0,1]=4 991 B13R1.513 CC(O)CNCC1=CC=C(C=C1)Cl MCULE-4238550811 [1,1,0,0,0,0|2,0,0]=4 992 B13R1.513 CC1=CC=C(C=C1)OCCC(=O)O MCULE-9368077352 [1,1,0,0,0,0|1,0,1]=4 993 B13R1.513 CN(C)CCOC1=CC=C(C=C1)Cl MCULE-9456999408 [1,1,0,0,0,0|2,0,0]=4 994 B13R1.513 N(CC1=CC=C(C=C1)Cl)CC(C)O MCULE-7642879609 [1,1,0,0,0,0|2,0,0]=4 995 B13R1.513 NC1=CC=C(C=C1)OCCC(=O)O MCULE-6932857541 [1,1,0,0,0,0|1,0,1]=4 996 B13R1.513 O=C(Cl)CCOC1=CC=C(C=C1)Cl MCULE-1254401549 [1,1,0,0,0,0|0,0,2]=4 997 B13R1.513 O=C(O)CCCC1=CC=C(C=C1)Cl MCULE-8089882538 [1,1,0,0,0,0|1,0,1]=4 998 B13R1.513 O=C(O)CCNC1=CC=C(C=C1)Cl MCULE-7907272480 [1,1,0,0,0,0|1,0,1]=4 999 B13R1.513 O=C(O)CCOC1=CC=C(C=C1)Br MCULE-4054160375 [1,1,0,0,0,0|0,1,1]=4 1000 B13R1.513 O=C(O)CCOC1=CC=C(C=C1)Cl MCULE-1925407378 [1,1,0,0,0,0|0,0,1]=3 1001 B13R1.513 O=C(O)CCOC1=CC=C(C=C1)F MCULE-3183471561 [1,1,0,0,0,0|0,1,1]=4 1002 B13R1.513 O=C(O)CCSC1=CC=C(C=C1)Cl MCULE-9176337975 [1,1,0,0,0,0|0,1,1]=4 1003 B13R1.513 OB(O)CCCC1=CC=C(C=C1)Cl MCULE-8568898938 [1,1,0,0,0,0|2,0,0]=4 1004 B13R1.669 CC1=C(C=C(C=C1)CCCCO)C MCULE-9978835532 [1,1,0,0,0,0|2,0,0]=4 1005 B13R1.669 CC1=C(C=C(C=C1)OCCCBr)C MCULE-1318726201 [1,1,0,0,0,0|2,0,0]=4 1006 B13R1.669 CC1=C(C=C(C=C1)OCCCN)Br MCULE-4803716965 [1,1,0,0,0,0|2,0,0]=4 1007 B13R1.669 CC1=C(C=C(C=C1)OCCCN)C MCULE-4079223998 [1,1,0,0,0,0|2,0,0]=4 1008 B13R1.669 CC1=C(C=C(C=C1)OCCCN)F MCULE-7962945075 [1,1,0,0,0,0|2,0,0]=4 1009 B13R1.669 CC1=C(C=CC(=C1)OCCCBr)Cl MCULE-5575122682 [1,1,0,0,0,0|1,0,0]=3 1010 B13R1.669 CC1=C(C=CC(=C1)OCCCN)Br MCULE-7536736611 [1,1,0,0,0,0|1,1,0]=4 1011 B13R1.669 CC1=C(C=CC(=C1)OCCCN)Cl MCULE-3054454623 [1,1,0,0,0,0|1,0,0]=3 1012 B13R1.669 CC1=C(C=CC(=C1)OCCCO)Cl MCULE-9996990493 [1,1,0,0,0,0|0,0,0]=2 1013 B13R1.669 CC1=C(C=CC(=C1)OCCCO)N MCULE-1460127075 [1,1,0,0,0,0|1,0,0]=3 1014 B13R1.669 CC1=CC(=CC=C1Br)OCCCO MCULE-7619096522 [1,1,0,0,0,0|0,1,0]=3 1015 B13R1.669 CC1=CC(=CC=C1Cl)C#CCCO MCULE-9706952326 [1,1,0,0,0,0|1,0,1]=4 1016 B13R1.669 CCCCCC1=CC=C(C(=C1)F)Cl MCULE-3104895079 [1,1,0,0,0,0|2,0,0]=4 1017 B13R1.669 CCCCOC1=CC(=C(C=C1)N)Br MCULE-3782078962 [1,1,0,0,0,0|2,0,0]=4 1018 B13R1.669 CCCCOC1=CC(=C(C=C1)N)C MCULE-9260994699 [1,1,0,0,0,0|2,0,0]=4 1019 B13R1.669 CCCCOC1=CC(=C(C=C1)S)C MCULE-4669489006 [1,1,0,0,0,0|2,0,0]=4 1020 B13R1.669 CCCCOC1=CC=C(C(=C1)Br)C MCULE-6269515552 [1,1,0,0,0,0|2,0,0]=4 1021 B13R1.669 CCCCOC1=CC=C(C(=C1)C)Br MCULE-8276239720 [1,1,0,0,0,0|1,1,0]=4 1022 B13R1.669 CCCCOC1=CC=C(C(=C1)F)Br MCULE-4712086375 [1,1,0,0,0,0|1,1,0]=4 1023 B13R1.669 CCCCOC1=CC=C(C(=C1)F)C MCULE-1582441503 [1,1,0,0,0,0|2,0,0]=4 1024 B13R1.669 CCCCOC1=CN=C(C(=C1)Cl)Cl MCULE-7237012936 [1,1,0,0,0,0|2,0,0]=4 1025 B13R1.669 CNCCOC1=CC=C(C(=C1)Cl)Cl MCULE-3530603258 [1,1,0,0,0,0|2,0,0]=4 1026 B13R1.669 CNCCOC1=CC=C(C(=C1)Cl)Cl MCULE-9304701580 [1,1,0,0,0,0|2,0,0]=4 1027 B13R1.669 COCCOC1=CC(=C(C=C1)Cl)O MCULE-9184796771 [1,1,0,0,0,0|2,0,0]=4 1028 B13R1.669 COCCOC1=CC=C(C(=C1)Br)Cl MCULE-1092315774 [1,1,0,0,0,0|2,0,0]=4 1029 B13R1.669 COCCOC1=CC=C(C(=C1)I)Cl MCULE-7471764103 [1,1,0,0,0,0|2,0,0]=4 1030 B13R1.669 COCCOC1=CC=C(C(=C1)N)Cl MCULE-4805517463 [1,1,0,0,0,0|2,0,0]=4 1031 B13R1.669 ClC1=C(C=C(C=C1)CCCCBr)Cl MCULE-4545801598 [1,1,0,0,0,0|2,0,0]=4 1032 B13R1.669 FC1=CC(=CC=C1Br)OCCCBr MCULE-7461917734 [1,1,0,0,0,0|1,1,0]=4 1033 B13R1.669 N#CCCOC1=CC(=C(C=C1)Cl)Cl MCULE-6999258614 [1,1,0,0,0,0|1,0,1]=4 1034 B13R1.669 NCCCNC1=CC=C(C(=C1)Cl)Cl MCULE-8440579988 [1,1,0,0,0,0|2,0,0]=4 1035 B13R1.669 NCCCOC1=CC(=C(C=C1)Br)F MCULE-8201479417 [1,1,0,0,0,0|1,1,0]=4 1036 B13R1.669 NCCCOC1=CC(=C(C=C1)Cl)Cl MCULE-6895749915 [1,1,0,0,0,0|1,0,0]=3 1037 B13R1.669 NCCCOC1=CC(=C(C=C1)Cl)F MCULE-9342351274 [1,1,0,0,0,0|1,0,0]=3 1038 B13R1.669 NCCCOC1=CC(=C(C=C1)F)F MCULE-2245265179 [1,1,0,0,0,0|1,1,0]=4 1039 B13R1.669 NCCCSC1=CC=C(C(=C1)Cl)Cl MCULE-9153270338 [1,1,0,0,0,0|1,1,0]=4 1040 B13R1.669 O=CCCOC1=CC(=C(C=C1)Cl)Cl MCULE-5171743867 [1,1,0,0,0,0|0,0,2]=4 1041 B13R1.669 OCCC#CC1=CC=C(C(=C1)Cl)Cl MCULE-5352118581 [1,1,0,0,0,0|1,0,1]=4 1042 B13R1.669 OCCC#CC1=CC=C(C(=C1)F)Cl MCULE-1131635715 [1,1,0,0,0,0|1,0,1]=4 1043 B13R1.669 OCCCCC1=CC(=C(C=C1)Cl)Cl MCULE-1331091807 [1,1,0,0,0,0|1,0,0]=3 1044 B13R1.669 OCCCNC1=CC(=C(C=C1)F)F MCULE-3531317358 [1,1,0,0,0,0|1,1,0]=4 1045 B13R1.669 OCCCNC1=CC(=C(C=C1)F)F MCULE-5268863218 [1,1,0,0,0,0|1,1,0]=4 1046 B13R1.669 OCCCOC1=CC(=C(C=C1)Br)F MCULE-7055542541 [1,1,0,0,0,0|0,1,0]=3 1047 B13R1.669 OCCNCC1=CC=C(C(=C1)Cl)Cl MCULE-5772704546 [1,1,0,0,0,0|2,0,0]=4 1048 B13R1.3 C#CC1=CC=C(C=C1)OCC(C)C MCULE-8714999791 [1,1,0,0,0,0|2,0,0]=4 1049 B13R1.3 CC(C)COC1=CC=C(C=C1)C#N MCULE-3987633456 [1,1,0,0,0,0|2,0,0]=4 1050 B13R1.3 CC(C)COC1=CC=C(C=C1)C=O MCULE-1100215138 [1,1,0,0,0,0|2,0,0]=4 1051 B13R1.3 CC(C)COC1=CC=C(C=C1)CN MCULE-2025972287 [1,1,0,0,0,0|2,0,0]=4 1052 B13R1.3 CC(C)COC1=CC=C(C=C1)CN MCULE-7474015597 [1,1,0,0,0,0|2,0,0]=4 1053 B13R1.3 CC(C)COC1=CC=C(C=C1)CN MCULE-9119088301 [1,1,0,0,0,0|2,0,0]=4 1054 B13R1.3 CC(C)COC1=CC=C(C=C1)CO MCULE-5555528288 [1,1,0,0,0,0|2,0,0]=4 1055 B13R1.3 CC(C)COC1=CC=C(C=C1)NN MCULE-5682728965 [1,1,0,0,0,0|2,0,0]=4 1056 B13R1.3 CC(C)COC1=CC=C(C=C1)NN MCULE-8627238959 [1,1,0,0,0,0|2,0,0]=4 1057 B13R1.3 COC1=CC=C(C=C1)CCC(C)O MCULE-5408346161 [1,1,0,0,0,0|2,0,0]=4 1058 B13R1.3 COC1=CC=C(C=C1)OCC(C)N MCULE-1497940052 [1,1,0,0,0,0|2,0,0]=4 1059 B13R1.3 COC1=CC=C(C=C1)OCC(C)O MCULE-6070951587 [1,1,0,0,0,0|1,0,0]=3 1060 B13R1.3 CSC1=CC=C(C=C1)OCC(C)C MCULE-1638892766 [1,1,0,0,0,0|2,0,0]=4 1061 B13R1.3 FC(F)COC1=CC=C(C=C1)CCl MCULE-1442570583 [1,1,0,0,0,0|2,0,0]=4 1062 B13R1.132 CC(C)CC(=O)C1=CC=C(C=C1)Cl MCULE-7411007157 [1,1,0,0,0,0|2,0,0]=4 1063 B13R1.132 CC(C)CC(N)C1=CC=C(C=C1)Cl MCULE-5955496059 [1,1,0,0,0,0|2,0,0]=4 1064 B13R1.132 CC(C)CC(N)C1=CC=C(C=C1)Cl MCULE-9217422391 [1,1,0,0,0,0|2,0,0]=4 1065 B13R1.132 CC(C)C[C@@H](N)C1=CC=C(C=C1)Cl MCULE-2171954697 [1,1,0,0,0,0|2,0,0]=4 1066 B13R1.132 CC(C)C[C@@H](N)C1=CC=C(C=C1)Cl MCULE-2419035684 [1,1,0,0,0,0|2,0,0]=4 1067 B13R1.132 CC(C)C[C@H](N)C1=CC=C(C=C1)Cl MCULE-5477808656 [1,1,0,0,0,0|2,0,0]=4 1068 B13R1.132 CC(C)C[C@H](N)C1=CC=C(C=C1)Cl MCULE-8567591569 [1,1,0,0,0,0|2,0,0]=4 1069 B13R1.133 CC(=O)C(C)OC1=CC=C(C=C1)Cl MCULE-7117815810 [1,1,0,0,0,0|0,0,2]=4 1070 B13R1.133 CC(C)C(N)CC1=CC=C(C=C1)Cl MCULE-5843487474 [1,1,0,0,0,0|2,0,0]=4 1071 B13R1.133 CC(C)C(O)CC1=CC=C(C=C1)Cl MCULE-4330561016 [1,1,0,0,0,0|2,0,0]=4 1072 B13R1.133 CC(O)C(O)CC1=CC=C(C=C1)O MCULE-5873805411 [1,1,0,0,0,0|2,0,0]=4 1073 B13R1.133 CC(OC1=CC=C(C=C1)Cl)C(=O)O MCULE-2806188004 [1,1,0,0,0,0|0,0,2]=4 1074 B13R1.133 C[C@H](OC1=CC=C(C=C1)Cl)C(=O)O MCULE-5436371376 [1,1,0,0,0,0|0,0,2]=4 1075 B13R1.164 C(F)(F)COC1=C(C=C(C=C1)Cl)N MCULE-6128099577 [1,1,0,0,0,0|2,0,0]=4 1076 B13R1.164 CC(=O)COC1=C(C=C(C=C1)Cl)Cl MCULE-9195463974 [1,1,0,0,0,0|0,0,2]=4 1077 B13R1.164 CC(C)CNC1=C(C=C(C=C1)Cl)F MCULE-6930272724 [1,1,0,0,0,0|2,0,0]=4 1078 B13R1.164 CC(C)COC1=C(C=C(C=C1)Br)N MCULE-9555792675 [1,1,0,0,0,0|1,1,0]=4 1079 B13R1.164 CC(C)COC1=C(C=C(C=C1)Cl)N MCULE-5804968238 [1,1,0,0,0,0|1,0,0]=3 1080 B13R1.164 CC(C)COC1=C(C=C(C=C1)Cl)S MCULE-7899982851 [1,1,0,0,0,0|1,0,0]=3 1081 B13R1.164 CC(C)COC1=C(C=C(C=C1)F)Br MCULE-4134644030 [1,1,0,0,0,0|1,1,0]=4 1082 B13R1.164 CC(C)COC1=C(C=C(C=C1)F)S MCULE-7397966828 [1,1,0,0,0,0|1,1,0]=4 1083 B13R1.164 CC(C)COC1=C(C=C(C=C1)I)N MCULE-9837839431 [1,1,0,0,0,0|1,1,0]=4 1084 B13R1.164 CC(C)COC1=C(C=C(C=C1)N)Br MCULE-8981242784 [1,1,0,0,0,0|2,0,0]=4 1085 B13R1.164 CC(C)COC1=C(C=C(C=C1)N)Cl MCULE-3482530418 [1,1,0,0,0,0|2,0,0]=4 1086 B13R1.164 CC(C)COC1=C(C=C(C=C1)N)Cl MCULE-8465205658 [1,1,0,0,0,0|2,0,0]=4 1087 B13R1.164 CC(C)COC1=C(C=C(C=C1)N)F MCULE-1085815400 [1,1,0,0,0,0|2,0,0]=4 1088 B13R1.164 CC(C)COC1=CC=C(C=C1Br)Cl MCULE-2485732081 [1,1,0,0,0,0|1,0,0]=3 1089 B13R1.164 CC(C)COC1=CC=C(C=C1Br)I MCULE-6058394974 [1,1,0,0,0,0|1,1,0]=4 1090 B13R1.164 CC(C)COC1=CC=C(C=C1Cl)Br MCULE-9659200722 [1,1,0,0,0,0|1,1,0]=4 1091 B13R1.164 CC(C)COC1=CC=C(C=C1Cl)S MCULE-3004954395 [1,1,0,0,0,0|2,0,0]=4 1092 B13R1.164 CC(C)COC1=CC=C(C=C1F)Br MCULE-8579525926 [1,1,0,0,0,0|1,1,0]=4 1093 B13R1.164 CC(C)COC1=CC=C(C=C1F)I MCULE-2537616720 [1,1,0,0,0,0|1,1,0]=4 1094 B13R1.164 CC(C)COC1=CC=C(C=C1F)O MCULE-8116541198 [1,1,0,0,0,0|2,0,0]=4 1095 B13R1.164 CC(C)COC1=CC=C(C=C1F)S MCULE-8901103003 [1,1,0,0,0,0|2,0,0]=4 1096 B13R1.164 CC(C)COC1=CC=C(C=C1I)Br MCULE-5577804176 [1,1,0,0,0,0|1,1,0]=4 1097 B13R1.164 CC(C)COC1=CC=C(C=C1I)Cl MCULE-9013133725 [1,1,0,0,0,0|1,0,0]=3 1098 B13R1.164 CC(C)COC1=CC=C(C=C1I)F MCULE-6803526531 [1,1,0,0,0,0|1,1,0]=4 1099 B13R1.164 CC(C)COC1=CC=C(C=C1N)F MCULE-4779024336 [1,1,0,0,0,0|1,1,0]=4 1100 B13R1.164 CC(C)COC1=CC=C(C=C1O)Br MCULE-8604024882 [1,1,0,0,0,0|1,1,0]=4 1101 B13R1.164 CC(C)COC1=NC=C(C=C1N)Cl MCULE-9663130203 [1,1,0,0,0,0|2,0,0]=4 1102 B13R1.164 CC(C)CSC1=CC=C(C=C1N)Cl MCULE-2218622305 [1,1,0,0,0,0|1,1,0]=4 1103 B13R1.164 CC(N)CCC1=CC=C(C=C1Cl)Cl MCULE-7448725592 [1,1,0,0,0,0|2,0,0]=4 1104 B13R1.164 CC(N)COC1=C(C=C(C=C1)F)F MCULE-3744549720 [1,1,0,0,0,0|1,1,0]=4 1105 B13R1.164 CC1=C(C=CC(=C1)Cl)OCC(=O)O MCULE-3405120876 [1,1,0,0,0,0|0,0,2]=4 1106 B13R1.164 CC1=C(C=CC(=C1)N)OCC(C)C MCULE-7101070275 [1,1,0,0,0,0|2,0,0]=4 1107 B13R1.164 CC1=CC(=C(C=C1)OCC(C)C)N MCULE-9095667585 [1,1,0,0,0,0|2,0,0]=4 1108 B13R1.164 CC1=CC(=C(C=C1)OCC(C)C)S MCULE-9962740864 [1,1,0,0,0,0|2,0,0]=4 1109 B13R1.164 CC1=CC(=CC=C1C#CC(C)O)Cl MCULE-3985517685 [1,1,0,0,0,0|1,0,1]=4 1110 B13R1.164 CC1=CC(=CC=C1OCC(C)C)Br MCULE-4940376174 [1,1,0,0,0,0|1,1,0]=4 1111 B13R1.164 CC1=CC(=CC=C1OCC(C)C)O MCULE-9919248005 [1,1,0,0,0,0|2,0,0]=4 1112 B13R1.164 CC1=CC(=CC=C1OCC(C)C)S MCULE-6453921032 [1,1,0,0,0,0|2,0,0]=4 1113 B13R1.164 CC1=CC(=CC=C1OCC(C)N)Cl MCULE-5985792710 [1,1,0,0,0,0|1,0,0]=3 1114 B13R1.164 CC1=CC=C(C(=C1)Br)OCC(C)C MCULE-4329994055 [1,1,0,0,0,0|2,0,0]=4 1115 B13R1.164 CC1=CC=C(C(=C1)I)OCC(C)C MCULE-8098487317 [1,1,0,0,0,0|2,0,0]=4 1116 B13R1.164 CC1=CC=C(C(=C1)O)OCC(C)C MCULE-2098259707 [1,1,0,0,0,0|2,0,0]=4 1117 B13R1.164 FC(F)COC1=CC=C(C=C1I)Cl MCULE-1498038924 [1,1,0,0,0,0|2,0,0]=4 1118 B13R1.164 NC1=C(C=CC(=C1)Cl)OCC(F)F MCULE-9025251525 [1,1,0,0,0,0|2,0,0]=4 1119 B13R1.164 O=C(O)COC1=C(C=C(C=C1)Cl)Cl MCULE-7323613760 [1,1,0,0,0,0|0,0,2]=4 1120 B13R1.164 O=C(O)COC1=C(C=C(C=C1)Cl)F MCULE-6325296568 [1,1,0,0,0,0|0,0,2]=4 1121 B13R1.164 O=C(O)COC1=CC=C(C=C1Br)Cl MCULE-9503443931 [1,1,0,0,0,0|0,0,2]=4 1122 B13R1.164 O=C(O)COC1=CC=C(C=C1Cl)Cl MCULE-6841252961 [1,1,0,0,0,0|0,0,2]=4 1123 B13R1.164 O=C(O)COC1=CC=C(C=C1I)Cl MCULE-8358512420 [1,1,0,0,0,0|0,0,2]=4 1124 B13R1.164 O=C(O)COC1=CC=C(C=C1O)Cl MCULE-9623510680 [1,1,0,0,0,0|0,0,2]=4 1125 B13R1.511 CC(=O)COC1=CC(=C(C=C1)Cl)Cl MCULE-9213442563 [1,1,0,0,0,0|0,0,2]=4 1126 B13R1.511 CC(C)COC1=CC(=C(C=C1)F)Br MCULE-4838903246 [1,1,0,0,0,0|1,1,0]=4 1127 B13R1.511 CC(C)COC1=CC(=C(C=C1)I)Br MCULE-9250758294 [1,1,0,0,0,0|1,1,0]=4 1128 B13R1.511 CC(C)COC1=CC(=C(C=C1)N)Br MCULE-1451261977 [1,1,0,0,0,0|2,0,0]=4 1129 B13R1.511 CC(C)COC1=CC(=C(C=C1)N)F MCULE-6304457275 [1,1,0,0,0,0|2,0,0]=4 1130 B13R1.511 CC(C)COC1=CC(=C(N=C1)Cl)F MCULE-4461435376 [1,1,0,0,0,0|2,0,0]=4 1131 B13R1.511 CC(C)COC1=CC=C(C(=C1)F)Br MCULE-7285400482 [1,1,0,0,0,0|1,1,0]=4 1132 B13R1.511 CC(C)COC1=CC=C(C(=C1)I)Cl MCULE-2862977994 [1,1,0,0,0,0|1,0,0]=3 1133 B13R1.511 CC(C)COC1=CC=C(C(=C1)N)F MCULE-2488498497 [1,1,0,0,0,0|1,1,0]=4 1134 B13R1.511 CC(C)COC1=CC=C(C(=C1)O)N MCULE-3643886949 [1,1,0,0,0,0|2,0,0]=4 1135 B13R1.511 CC(O)C#CC1=CC=C(C(=C1)Cl)Cl MCULE-4341507011 [1,1,0,0,0,0|1,0,1]=4 1136 B13R1.511 CC(O)C#CC1=CC=C(C(=C1)F)Cl MCULE-9331443563 [1,1,0,0,0,0|1,0,1]=4 1137 B13R1.511 CC(O)COC1=CC=C(C(=C1)Cl)Br MCULE-3189618313 [1,1,0,0,0,0|0,1,0]=3 1138 B13R1.511 CC1=C(C=C(C=C1)OCC(C)N)C MCULE-5061682077 [1,1,0,0,0,0|2,0,0]=4 1139 B13R1.511 CC1=C(C=CC(=C1)OCC(C)C)S MCULE-9850157779 [1,1,0,0,0,0|2,0,0]=4 1140 B13R1.511 CC1=CC(=CC=C1Br)OCC(C)C MCULE-4498369861 [1,1,0,0,0,0|1,1,0]=4 1141 B13R1.511 CC1=CC(=CC=C1Cl)C#CC(C)O MCULE-7919729992 [1,1,0,0,0,0|1,0,1]=4 1142 B13R1.511 CC1=CC(=CC=C1Cl)OCC(=O)O MCULE-5714027283 [1,1,0,0,0,0|0,0,2]=4 1143 B13R1.511 CC1=CC(=CC=C1I)OCC(C)C MCULE-8286215838 [1,1,0,0,0,0|1,1,0]=4 1144 B13R1.511 CC1=CC(=CC=C1N)OCC(C)C MCULE-8032472321 [1,1,0,0,0,0|2,0,0]=4 1145 B13R1.511 CC1=CC=C(C=C1I)OCC(C)C MCULE-8734156295 [1,1,0,0,0,0|2,0,0]=4 1146 B13R1.511 CC1=CC=C(C=C1N)OCC(C)C MCULE-3199964275 [1,1,0,0,0,0|2,0,0]=4 1147 B13R1.511 FC(F)COC1=CC=C(C(=C1)I)Cl MCULE-9802429536 [1,1,0,0,0,0|2,0,0]=4 1148 B13R1.511 O=C(O)COC1=CC(=C(C=C1)Cl)Cl MCULE-6424078403 [1,1,0,0,0,0|0,0,2]=4 1149 B13R1.511 O=C(O)COC1=CC(=C(C=C1)Cl)F MCULE-7352394066 [1,1,0,0,0,0|0,0,2]=4 1150 B13R1.512 CC(C)(C)COC1=CC=C(C=C1)Br MCULE-1066076548 [1,1,0,0,0,0|1,1,0]=4 1151 B13R1.512 CC(C)(C)COC1=CC=C(C=C1)N MCULE-5001759027 [1,1,0,0,0,0|2,0,0]=4 1152 B13R1.512 CC(C)(N)COC1=CC=C(C=C1)Cl MCULE-5567818616 [1,1,0,0,0,0|1,0,0]=3 1153 B13R1.512 CC(C)(O)C#CC1=CC=C(C=C1)Cl MCULE-9349386290 [1,1,0,0,0,0|1,0,1]=4 1154 B13R1.512 CC(C)(O)CCC1=CC=C(C=C1)Br MCULE-3973368675 [1,1,0,0,0,0|1,1,0]=4 1155 B13R1.512 CC(C)(O)CCC1=CC=C(C=C1)Cl MCULE-3860744962 [1,1,0,0,0,0|1,0,0]=3 1156 B13R1.512 CC(C)(O)CCC1=CC=C(C=C1)F MCULE-5773080540 [1,1,0,0,0,0|1,1,0]=4 1157 B13R1.512 CC(C)(O)COC1=CC=C(C=C1)Br MCULE-2516392010 [1,1,0,0,0,0|0,1,0]=3 1158 B13R1.512 CC(C)(O)COC1=CC=C(C=C1)I MCULE-1009712622 [1,1,0,0,0,0|0,1,0]=3 1159 B13R1.512 CC(C)(O)COC1=CC=C(C=C1)N MCULE-1728774876 [1,1,0,0,0,0|1,0,0]=3 1160 B13R1.512 CC(C)(O)CSC1=CC=C(C=C1)Br MCULE-8866997648 [1,1,0,0,0,0|0,2,0]=4 1161 B13R1.512 CC(F)(F)COC1=CC=C(C=C1)Br MCULE-6537503969 [1,1,0,0,0,0|1,1,0]=4 1162 B13R1.512 CC(F)(F)COC1=CC=C(C=C1)I MCULE-7600540886 [1,1,0,0,0,0|1,1,0]=4 1163 B13R1.512 CC(F)(F)COC1=CC=C(C=C1)O MCULE-4080391991 [1,1,0,0,0,0|2,0,0]=4 1164 B13R1.512 CC(F)(F)COC1=CC=C(N=C1)Cl MCULE-9945307244 [1,1,0,0,0,0|2,0,0]=4 1165 B13R1.512 CC1=CC=C(C=C1)CCC(C)(C)O MCULE-5054151625 [1,1,0,0,0,0|2,0,0]=4 1166 B13R1.512 CC1=CC=C(C=C1)OCC(C)(C)N MCULE-4690477061 [1,1,0,0,0,0|2,0,0]=4 1167 B13R1.15 CC1=CC(=CC=C1)OCC(O)CN MCULE-4415719539 [1,1,0,0,0,0|1,0,0]=3 1168 B13R1.15 CC1=CC=CC(=C1)OCC(N)CO MCULE-3819815616 [1,1,0,0,0,0|1,0,0]=3 1169 B13R1.15 CC1=CC=CC(=C1)OCC(O)CN MCULE-3478591776 [1,1,0,0,0,0|1,0,0]=3 1170 B13R1.15 NCC(O)COC1=CC(=CC=C1)F MCULE-7558440759 [1,1,0,0,0,0|1,0,0]=3 1171 B13R1.42 C=CCC(O)CCC1=CC=CC=C1 MCULE-2959658576 [1,1,0,0,0,0|2,0,0]=4 1172 B13R1.42 CC(CCO)CCC1=CC=CC=C1 MCULE-4902819949 [1,1,0,0,0,0|2,0,0]=4 1173 B13R1.42 CCCC(O)CCC1=CC=CC=C1 MCULE-9846152247 [1,1,0,0,0,0|2,0,0]=4 1174 B13R1.42 CNCC(O)COC1=CC=CC=C1 MCULE-7453686014 [1,1,0,0,0,0|1,0,0]=3 1175 B13R1.42 COCC(O)CNC1=CC=CC=C1 MCULE-3928692044 [1,1,0,0,0,0|1,0,0]=3 1176 B13R1.42 NCCC(O)CCC1=CC=CC=C1 MCULE-2751013188 [1,1,0,0,0,0|2,0,0]=4 1177 B13R1.42 NOCC(O)COC1=CC=CC=C1 MCULE-5119921490 [1,1,0,0,0,0|0,0,0]=2 1178 B13R1.42 NOCC(O)COC1=CC=CC=C1 MCULE-7497454683 [1,1,0,0,0,0|0,0,0]=2 1179 B13R1.135 NC(CC1=CC=CC=C1)C(O)CCl MCULE-3432918334 [1,1,0,0,0,0|2,0,0]=4 1180 B13R1.135 NC(CC1=CC=CC=C1)C(O)CCl MCULE-7289529910 [1,1,0,0,0,0|2,0,0]=4 1181 B13R1.135 NC(CC1=CC=CC=C1)C(O)CF MCULE-7109030535 [1,1,0,0,0,0|2,0,0]=4 1182 B13R1.135 [C@H](N)(CC1=CC=CC=C1)[C@H](O)CCl MCULE-1273860619 [1,1,0,0,0,0|2,0,0]=4 1183 B13R1.135 [C@H](N)(CC1=CC=CC=C1)[C@H](O)CCl MCULE-8817071278 [1,1,0,0,0,0|2,0,0]=4 1184 B13R1.254 CC(C)(CO)CNC1=CC=CC=C1 MCULE-6626006552 [1,1,0,0,0,0|2,0,0]=4 1185 B13R1.254 CC(C)(CO)COC1=CC=CC=C1 MCULE-8364659811 [1,1,0,0,0,0|1,0,0]=3 1186 B13R1.254 CC(N)(CO)CCC1=CC=CC=C1 MCULE-2004054849 [1,1,0,0,0,0|2,0,0]=4 1187 B13R1.254 CC(N)(CO)COC1=CC=CC=C1 MCULE-4063106240 [1,1,0,0,0,0|1,0,0]=3 1188 B13R1.254 CC(O)(CN)CCC1=CC=CC=C1 MCULE-8087638585 [1,1,0,0,0,0|2,0,0]=4 1189 B13R1.254 CCC(C)(O)CCC1=CC=CC=C1 MCULE-5168620248 [1,1,0,0,0,0|2,0,0]=4 1190 B13R1.351 CC(C)C(O)CCC1=CC=CC=C1 MCULE-1472205764 [1,1,0,0,0,0|2,0,0]=4 1191 B13R1.351 CC(C)C(O)CSC1=CC=CC=C1 MCULE-3732535005 [1,1,0,0,0,0|1,1,0]=4 1192 B13R1.351 CC(COC1=CC=CC=C1)C(=O)O MCULE-9503504513 [1,1,0,0,0,0|1,0,1]=4 1193 B13R1.351 NC(COC1=CC=CC=C1)C(=O)O MCULE-1983365366 [1,1,0,0,0,0|1,0,1]=4 1194 B13R1.351 N[C@@H](COC1=CC=CC=C1)C(=O)O MCULE-3653516384 [1,1,0,0,0,0|1,0,1]=4 1195 B13R1.351 N[C@H](COC1=CC=CC=C1)C(=O)O MCULE-1181768450 [1,1,0,0,0,0|1,0,1]=4 1196 B13R1.351 N[C@H](COC1=CC=CC=C1)C(=O)O MCULE-2658156823 [1,1,0,0,0,0|1,0,1]=4 1197 B13R1.351 O=C(O)C(O)CCC1=CC=CC=C1 MCULE-4257585560 [1,1,0,0,0,0|1,0,1]=4 1198 B13R1.351 O=C(O)C(O)CCC1=CC=CC=C1 MCULE-5664756838 [1,1,0,0,0,0|1,0,1]=4 1199 B13R1.351 O=C(O)[C@@H](O)CCC1=CC=CC=C1 MCULE-5061224318 [1,1,0,0,0,0|1,0,1]=4 1200 B13R1.351 O=C(O)[C@@H](O)CCC1=CC=CC=C1 MCULE-8347273271 [1,1,0,0,0,0|1,0,1]=4 1201 B13R1.351 O=C(O)[C@H](O)CCC1=CC=CC=C1 MCULE-2268613096 [1,1,0,0,0,0|1,0,1]=4 1202 B13R1.351 O=C(O)[C@H](O)CCC1=CC=CC=C1 MCULE-9835086512 [1,1,0,0,0,0|1,0,1]=4 1203 B13R1.417 COC(COC1=CC=CC=C1)OC MCULE-2154683359 [1,1,0,0,0,0|2,0,0]=4 1204 B13R1.417 OCC(CO)OCC1=CC=CC=C1 MCULE-1281778604 [1,1,0,0,0,0|2,0,0]=4 1205 B13R1.528 CC1=C(C=CC=C1)OCC(O)CN MCULE-5280328074 [1,1,0,0,0,0|1,0,0]=3 1206 B13R1.528 CC1=C(C=CC=C1)OCC(O)CN MCULE-8657354397 [1,1,0,0,0,0|1,0,0]=3 1207 B13R1.528 CC1=C(C=CC=C1)OCC(O)CO MCULE-1125347766 [1,1,0,0,0,0|0,0,0]=2 1208 B13R1.528 CCC(N)COC1=C(C=CC=C1)F MCULE-1545390078 [1,1,0,0,0,0|2,0,0]=4 1209 B13R1.528 CCC(N)COC1=C(C=CC=C1)F MCULE-6421863415 [1,1,0,0,0,0|2,0,0]=4 1210 B13R1.528 NCC(O)CNC1=CC=CC=C1Br MCULE-8261402644 [1,1,0,0,0,0|2,0,0]=4 1211 B13R1.528 NCC(O)CNC1=CC=CC=C1Cl MCULE-6615531061 [1,1,0,0,0,0|2,0,0]=4 1212 B13R1.528 NCC(O)COC1=C(C=CC=C1)Br MCULE-5775695445 [1,1,0,0,0,0|1,0,0]=3 1213 B13R1.528 OCC(O)COC1=CC=CC=C1Cl MCULE-6324610820 [1,1,0,0,0,0|0,0,0]=2 1214 B13R1.528 [NH3+]CC(O)C[NH2+]C1=C(C=CC=C1)Br MCULE-4465119717 [1,1,0,0,0,0|2,0,0]=4 1215 B13R1.5 CCC(O)CC1=CC=C(C=C1)OC MCULE-9707238215 [0,1,0,0,1,0|2,0,0]=4 1216 B13R1.5 CCC(O)CC1=CC=C(C=C1)SC MCULE-6508484040 [0,1,0,0,1,0|2,0,0]=4 1217 B13R1.5 CCC1=CC=C(C=C1)CC(C)CO MCULE-6700625981 [0,1,0,0,1,0|2,0,0]=4 1218 B13R1.5 CCC1=CC=C(C=C1)CC(O)CC MCULE-1012056163 [0,1,0,0,1,0|2,0,0]=4 1219 B13R1.5 COC1=CC=C(C=C1)CC(C)CO MCULE-4504499777 [0,1,0,0,1,0|2,0,0]=4 1220 B13R1.5 COC1=CC=C(C=C1)CC(N)CO MCULE-4373547870 [0,1,0,0,1,0|2,0,0]=4 1221 B13R1.5 COC1=CC=C(C=C1)C[C@H](N)CO MCULE-3412020166 [0,1,0,0,1,0|2,0,0]=4 1222 B13R1.5 COC1=CC=C(C=C1)OC(C)CO MCULE-3731252168 [0,1,0,0,1,0|2,0,0]=4 1223 B13R1.5 [C@@H](N)(CO)CC1=CC=C(C=C1)OC MCULE-1382796166 [0,1,0,0,1,0|2,0,0]=4 1224 B13R1.21 CC(CO)C(N)C1=CC=C(C=C1)Br MCULE-2978821593 [0,1,0,0,1,0|1,1,0]=4 1225 B13R1.21 CC(CO)C(N)C1=CC=C(C=C1)Br MCULE-8284609241 [0,1,0,0,1,0|1,1,0]=4 1226 B13R1.21 CCC(C)C(N)C1=CC=C(C=C1)Cl MCULE-2095948250 [0,1,0,0,1,0|2,0,0]=4 1227 B13R1.21 CCC(C)[C@@H](N)C1=CC=C(C=C1)Cl MCULE-8529572253 [0,1,0,0,1,0|2,0,0]=4 1228 B13R1.21 CCC(C)[C@@H](N)C1=CC=C(C=C1)Cl MCULE-9923363377 [0,1,0,0,1,0|2,0,0]=4 1229 B13R1.21 CCC(C)[C@H](N)C1=CC=C(C=C1)Cl MCULE-3055006155 [0,1,0,0,1,0|2,0,0]=4 1230 B13R1.21 CCC(C)[C@H](N)C1=CC=C(C=C1)Cl MCULE-6393454553 [0,1,0,0,1,0|2,0,0]=4 1231 B13R1.21 CC[C@@H](O)[C@@H](N)C1=CC=C(C=C1)Br MCULE-6902515035 [0,1,0,0,1,0|1,1,0]=4 1232 B13R1.21 CC[C@@H](O)[C@@H](N)C1=CC=C(C=C1)Br MCULE-8331879941 [0,1,0,0,1,0|1,1,0]=4 1233 B13R1.21 CC[C@@H](O)[C@@H](N)C1=CC=C(C=C1)C MCULE-2781723068 [0,1,0,0,1,0|2,0,0]=4 1234 B13R1.21 CC[C@@H](O)[C@@H](N)C1=CC=C(C=C1)C MCULE-8082069598 [0,1,0,0,1,0|2,0,0]=4 1235 B13R1.21 CC[C@@H](O)[C@@H](N)C1=CC=C(C=C1)Cl MCULE-2307134671 [0,1,0,0,1,0|1,0,0]=3 1236 B13R1.21 CC[C@@H](O)[C@@H](N)C1=CC=C(C=C1)Cl MCULE-8210440695 [0,1,0,0,1,0|1,0,0]=3 1237 B13R1.21 CC[C@@H](O)[C@@H](N)C1=CC=C(C=C1)I MCULE-1745762586 [0,1,0,0,1,0|1,1,0]=4 1238 B13R1.21 CC[C@@H](O)[C@@H](N)C1=CC=C(C=C1)I MCULE-3971654917 [0,1,0,0,1,0|1,1,0]=4 1239 B13R1.21 CC[C@@H](O)[C@@H](N)C1=CC=C(C=C1)O MCULE-2179167047 [0,1,0,0,1,0|2,0,0]=4 1240 B13R1.21 CC[C@@H](O)[C@@H](N)C1=CC=C(C=C1)O MCULE-6912725444 [0,1,0,0,1,0|2,0,0]=4 1241 B13R1.21 CC[C@H](O)[C@H](N)C1=CC=C(C=C1)Br MCULE-5139581160 [0,1,0,0,1,0|1,1,0]=4 1242 B13R1.21 CC[C@H](O)[C@H](N)C1=CC=C(C=C1)Br MCULE-5846959982 [0,1,0,0,1,0|1,1,0]=4 1243 B13R1.21 CC[C@H](O)[C@H](N)C1=CC=C(C=C1)C MCULE-1129284384 [0,1,0,0,1,0|2,0,0]=4 1244 B13R1.21 CC[C@H](O)[C@H](N)C1=CC=C(C=C1)C MCULE-9523148268 [0,1,0,0,1,0|2,0,0]=4 1245 B13R1.21 CC[C@H](O)[C@H](N)C1=CC=C(C=C1)Cl MCULE-6588979348 [0,1,0,0,1,0|1,0,0]=3 1246 B13R1.21 CC[C@H](O)[C@H](N)C1=CC=C(C=C1)Cl MCULE-8778537122 [0,1,0,0,1,0|1,0,0]=3 1247 B13R1.21 CC[C@H](O)[C@H](N)C1=CC=C(C=C1)I MCULE-1225657016 [0,1,0,0,1,0|1,1,0]=4 1248 B13R1.21 CC[C@H](O)[C@H](N)C1=CC=C(C=C1)I MCULE-5661302623 [0,1,0,0,1,0|1,1,0]=4 1249 B13R1.21 CC[C@H](O)[C@H](N)C1=CC=C(C=C1)O MCULE-1324034674 [0,1,0,0,1,0|2,0,0]=4 1250 B13R1.21 CC[C@H](O)[C@H](N)C1=CC=C(C=C1)O MCULE-6296429733 [0,1,0,0,1,0|2,0,0]=4 1251 B13R1.21 NC(CO)C(O)C1=CC=C(C=C1)Cl MCULE-7920314353 [0,1,0,0,1,0|1,0,0]=3 1252 B13R1.21 NC(CO)C(O)C1=CC=C(C=C1)Cl MCULE-9046793572 [0,1,0,0,1,0|1,0,0]=3 1253 B13R1.21 NC1=CC=C(C=C1)C(O)C(N)CO MCULE-4736589093 [0,1,0,0,1,0|2,0,0]=4 1254 B13R1.21 NC1=CC=C(C=C1)C(O)C(O)CO MCULE-5548439052 [0,1,0,0,1,0|1,0,0]=3 1255 B13R1.21 NC1=CC=C(C=C1)[C@H](O)[C@@H](N)CO MCULE-2696898208 [0,1,0,0,1,0|2,0,0]=4 1256 B13R1.21 NC1=CC=C(C=C1)[C@H](O)[C@@H](N)CO MCULE-9654572391 [0,1,0,0,1,0|2,0,0]=4 1257 B13R1.21 NC1=CC=C(C=C1)[C@H](O)[C@@H](N)CO MCULE-9669913435 [0,1,0,0,1,0|2,0,0]=4 1258 B13R1.21 N[C@@H](CO)[C@H](O)C1=CC=C(C=C1)Br MCULE-2686148018 [0,1,0,0,1,0|1,1,0]=4 1259 B13R1.21 N[C@H](CO)[C@H](O)C1=CC=C(C=C1)Br MCULE-1514888362 [0,1,0,0,1,0|1,1,0]=4 1260 B13R1.21 N[C@H](CO)[C@H](O)C1=CC=C(C=C1)Br MCULE-1753615037 [0,1,0,0,1,0|1,1,0]=4 1261 B13R1.21 [C@@H](N)(C1=CC=C(C=C1)F)[C@@H](O)CC MCULE-2905911067 [0,1,0,0,1,0|1,1,0]=4 1262 B13R1.21 [C@@H](N)(C1=CC=C(C=C1)F)[C@@H](O)CC MCULE-5920205110 [0,1,0,0,1,0|1,1,0]=4 1263 B13R1.21 [C@H](N)(C1=CC=C(C=C1)F)[C@H](O)CC MCULE-1880292597 [0,1,0,0,1,0|1,1,0]=4 1264 B13R1.21 [C@H](N)(C1=CC=C(C=C1)F)[C@H](O)CC MCULE-7542510066 [0,1,0,0,1,0|1,1,0]=4 1265 B13R1.145 CC1=CC=C(C=C1)CC(CN)CO MCULE-8292079252 [0,1,0,0,1,0|2,0,0]=4 1266 B13R1.145 COC(CBr)CC1=CC=C(C=C1)F MCULE-5159979151 [0,1,0,0,1,0|1,1,0]=4 1267 B13R1.145 ClC1=CC=C(C=C1)CC(CBr)CBr MCULE-5186081466 [0,1,0,0,1,0|2,0,0]=4 1268 B13R1.145 N#CC(CO)CC1=CC=C(C=C1)Br MCULE-4595537108 [0,1,0,0,1,0|1,1,0]=4 1269 B13R1.145 N#CC(CO)CC1=CC=C(C=C1)F MCULE-4947882210 [0,1,0,0,1,0|1,1,0]=4 1270 B13R1.145 NCC(CO)CC1=CC=C(C=C1)Br MCULE-1554276304 [0,1,0,0,1,0|1,1,0]=4 1271 B13R1.145 NCC(CO)CC1=CC=C(C=C1)Br MCULE-2134024188 [0,1,0,0,1,0|1,1,0]=4 1272 B13R1.145 NCC(CO)CC1=CC=C(C=C1)F MCULE-3145969882 [0,1,0,0,1,0|1,1,0]=4 1273 B13R1.145 NCC(CO)CC1=CC=C(C=C1)F MCULE-3906372614 [0,1,0,0,1,0|1,1,0]=4 1274 B13R1.145 OCC(CO)CC1=CC=C(C=C1)Cl MCULE-6904515854 [0,1,0,0,1,0|0,0,0]=2 1275 B13R1.249 CC(C)(CN)CC1=CC=C(C=C1)Cl MCULE-5157181156 [0,1,0,0,1,0|2,0,0]=4 1276 B13R1.249 CC(C)(CN)CC1=CC=C(C=C1)Cl MCULE-8736942817 [0,1,0,0,1,0|2,0,0]=4 1277 B13R1.249 CC(C)(CN)OC1=CC=C(C=C1)Cl MCULE-6358487951 [0,1,0,0,1,0|2,0,0]=4 1278 B13R1.249 CC(C)(CN)OC1=CC=C(C=C1)Cl MCULE-7782934969 [0,1,0,0,1,0|2,0,0]=4 1279 B13R1.249 CC(C)(CO)OC1=CC=C(C=C1)Cl MCULE-6493766978 [0,1,0,0,1,0|1,0,0]=3 1280 B13R1.249 CC(C)(CO)OC1=CN=C(C=C1)Cl MCULE-4466890732 [0,1,0,0,1,0|2,0,0]=4 1281 B13R1.249 CC(N)(CO)CC1=CC=C(C=C1)Br MCULE-4305131520 [0,1,0,0,1,0|1,1,0]=4 1282 B13R1.249 CC(N)(CO)CC1=CC=C(C=C1)Br MCULE-4344737160 [0,1,0,0,1,0|1,1,0]=4 1283 B13R1.249 CC(N)(CO)CC1=CC=C(C=C1)Cl MCULE-4752091992 [0,1,0,0,1,0|1,0,0]=3 1284 B13R1.249 CC(N)(CO)CC1=CC=C(C=C1)Cl MCULE-9918723944 [0,1,0,0,1,0|1,0,0]=3 1285 B13R1.249 CC(N)(CO)CC1=CC=C(C=C1)F MCULE-4241179503 [0,1,0,0,1,0|1,1,0]=4 1286 B13R1.249 CC(N)(CO)CC1=CC=C(C=C1)F MCULE-8335806118 [0,1,0,0,1,0|1,1,0]=4 1287 B13R1.2679 CC(CO)OC1=C(C=C(C=C1)Cl)Cl MCULE-1592259261 [0,1,0,0,1,0|1,0,0]=3 1288 B13R1.2679 CC1=C(C=CC(=C1)Br)OC(C)CO MCULE-4212795853 [0,1,0,0,1,0|1,1,0]=4 1289 B13R1.2679 CC1=CC(=C(C=C1)CC(O)CN)C MCULE-7370514169 [0,1,0,0,1,0|2,0,0]=4 1290 B13R1.2679 CC1=CC=C(C(=C1)F)CC(C)CO MCULE-7941010694 [0,1,0,0,1,0|2,0,0]=4 1291 B13R1.2679 CCC(C)OC1=CC=C(C=C1Br)Cl MCULE-3100813629 [0,1,0,0,1,0|2,0,0]=4 1292 B13R1.2679 CCC(N)CC1=C(C=C(C=C1)Cl)Cl MCULE-5456095209 [0,1,0,0,1,0|2,0,0]=4 1293 B13R1.2679 CCC(O)CC1=C(C=C(C=C1)Br)F MCULE-9703342132 [0,1,0,0,1,0|1,1,0]=4 1294 B13R1.2679 CCC(O)CC1=C(C=C(C=C1)C)C MCULE-1210175579 [0,1,0,0,1,0|2,0,0]=4 1295 B13R1.2679 CCC(O)CC1=C(C=C(C=C1)Cl)Cl MCULE-3481471347 [0,1,0,0,1,0|1,0,0]=3 1296 B13R1.2679 CCC(O)CC1=C(C=C(C=C1)F)C MCULE-4697474081 [0,1,0,0,1,0|1,1,0]=4 1297 B13R1.2679 CCC(O)CC1=C(C=C(C=C1)F)Cl MCULE-6264745781 [0,1,0,0,1,0|1,1,0]=4 1298 B13R1.2679 CCC(O)CC1=C(C=C(C=C1)F)F MCULE-6931712657 [0,1,0,0,1,0|1,1,0]=4 1299 B13R1.2679 CCC(O)CC1=CC=C(C=C1C)Cl MCULE-4987882142 [0,1,0,0,1,0|1,0,0]=3 1300 B13R1.2679 NC(CO)CC1=CC=C(C=C1F)F MCULE-1922304907 [0,1,0,0,1,0|1,1,0]=4 1301 B13R1.2679 NC(CO)CC1=CC=C(C=C1F)F MCULE-7935741831 [0,1,0,0,1,0|1,1,0]=4 1302 B13R1.2879 CC1=C(C=C(C=C1)CC(N)CO)C MCULE-4772541953 [0,1,0,0,1,0|2,0,0]=4 1303 B13R1.2879 CC1=C(C=C(C=C1)CC(N)CO)C MCULE-7198952968 [0,1,0,0,1,0|2,0,0]=4 1304 B13R1.2879 CC1=C(C=C(C=C1)CC(N)CO)F MCULE-5384228889 [0,1,0,0,1,0|2,0,0]=4 1305 B13R1.2879 CC1=CC(=CC=C1Br)OC(C)CO MCULE-4268441422 [0,1,0,0,1,0|1,1,0]=4 1306 B13R1.2879 CC1=CC=C(C=C1F)CC(C)CO MCULE-6175310945 [0,1,0,0,1,0|2,0,0]=4 1307 B13R1.2879 CCC(O)CC1=CC(=C(C=C1)C)C MCULE-3259135820 [0,1,0,0,1,0|2,0,0]=4 1308 B13R1.2879 CCC(O)CC1=CC(=C(C=C1)C)F MCULE-1193400768 [0,1,0,0,1,0|2,0,0]=4 1309 B13R1.2879 CCC(O)CC1=CC(=C(C=C1)Cl)C MCULE-5266986360 [0,1,0,0,1,0|1,0,0]=3 1310 B13R1.2879 CCC(O)CC1=CC(=C(C=C1)Cl)Cl MCULE-9778357666 [0,1,0,0,1,0|1,0,0]=3 1311 B13R1.2879 CCC(O)CC1=CC(=C(C=C1)Cl)F MCULE-4644391451 [0,1,0,0,1,0|1,0,0]=3 1312 B13R1.2879 CCC(O)CC1=CC(=C(C=C1)F)C MCULE-8980955781 [0,1,0,0,1,0|1,1,0]=4 1313 B13R1.2879 CCC(O)CC1=CC(=C(C=C1)F)F MCULE-1665320015 [0,1,0,0,1,0|1,1,0]=4 1314 B13R1.2879 CCC(O)CC1=CC=C(C(=C1)Cl)C MCULE-9423118385 [0,1,0,0,1,0|2,0,0]=4 1315 B13R1.2879 CCC(O)CC1=CC=C(C(=C1)Cl)F MCULE-6544222378 [0,1,0,0,1,0|1,1,0]=4 1316 B13R1.2879 NC(CO)CC1=CC(=C(C=C1)Cl)Cl MCULE-1485588972 [0,1,0,0,1,0|1,0,0]=3 1317 B13R1.2879 NC(CO)CC1=CC(=C(C=C1)F)F MCULE-9878235003 [0,1,0,0,1,0|1,1,0]=4 1318 B13R1.2879 N[C@H](CO)CC1=CC=C(C(=C1)Cl)Cl MCULE-8474145465 [0,1,0,0,1,0|1,0,0]=3 1319 B15R1.11 COCC(O)CSCC1=CC=C(C=C1)Cl MCULE-2683502200 [0,1,0,0,0,1|0,1,0]=3 1320 B15R1.11 COC[C@H](C)COCC1=CC=C(C=C1)Br MCULE-7305916809 [0,1,0,0,0,1|1,1,0]=4 1321 B15R1.132 NC1=CC=C(C=C1)C(=O)OCC(O)CO MCULE-5691553637 [0,1,0,0,0,1|1,0,0]=3 1322 B15R1.132 O=C(NCC(O)CO)C1=CC=C(C=C1)O MCULE-7666752433 [0,1,0,0,0,1|2,0,0]=4 1323 B15R1.132 O=C(OCC(O)CO)C1=CC=C(C=C1)O MCULE-2139737187 [0,1,0,0,0,1|1,0,0]=3 1324 B15R1.206 COC1=CC=C(C=C1)COCC(C)CO MCULE-2381858313 [0,1,0,0,0,1|2,0,0]=4 1325 B15R1.206 COC1=CC=C(C=C1)COCC(O)CN MCULE-2786052386 [0,1,0,0,0,1|2,0,0]=4 1326 B15R1.206 COC1=CC=C(C=C1)COC[C@@H](C)CO MCULE-7841934823 [0,1,0,0,0,1|2,0,0]=4 1327 B15R1.3836 OCC(O)CSCC1=C(C=C(C=C1)Cl)Cl MCULE-8837244901 [0,1,0,0,0,1|0,1,0]=3 1328 B15R1.11630 CC1=C(C=CC(=C1)CNCC(O)CO)Cl MCULE-4929673440 [0,1,0,0,0,1|1,0,0]=3 1329 B15R1.18 N#CCC1=CC=C(C=C1)OCC(O)CCl MCULE-4756727330 [0,2,0,0,0,0|2,0,0]=4 1330 B15R1.793 CCC1=CC=C(C=C1)OCC(O)CNC MCULE-5526371105 [0,2,0,0,0,0|2,0,0]=4 1331 B15R1.793 CCC1=CC=C(C=C1)OCC(O)CNC MCULE-6553392869 [0,2,0,0,0,0|2,0,0]=4 1332 B15R1.793 CNCC(O)COC1=CC=C(C=C1)OC MCULE-7052107790 [0,2,0,0,0,0|2,0,0]=4 1333 B15R1.956 NCC(O)COC1=CC=C(C=C1)N(=O)=O MCULE-3582688243 [0,2,0,0,0,0|2,0,0]=4 1334 B15R1.956 NCC(O)COC1=CC=C(C=C1)N(=O)=O MCULE-9723573604 [0,2,0,0,0,0|2,0,0]=4 1335 B15R1.956 O=N(=O)C1=CC=C(C=C1)OCC(O)CO MCULE-8147263589 [0,2,0,0,0,0|1,0,0]=3 1336 B15R1.1856 O=CC1=CC(=C(C=C1)OCC(O)CO)Cl MCULE-2210428056 [0,2,0,0,0,0|1,0,0]=3 1337 B15R1.1856 O=CC1=CC=C(C(=C1)Cl)OCC(O)CO MCULE-4189427768 [0,2,0,0,0,0|1,0,0]=3 1338 B15R1.1856 O=CC1=CC=C(C(=C1)Cl)OC[C@H](O)CO MCULE-6625943280 [0,2,0,0,0,0|1,0,0]=3 1339 B15R1.1856 O=CC1=CC=C(C(=C1)Cl)OC[C@H](O)CO MCULE-7271185592 [0,2,0,0,0,0|1,0,0]=3 1340 B15R1.46 O=C(NC(CO)CO)C1=CC=C(C=C1)Cl MCULE-7565056653 [0,2,0,0,0,0|2,0,0]=4 1341 B15R1.139 CCOCC(O)COC1=CC=C(C=C1)N MCULE-7261721326 [0,2,0,0,0,0|1,0,0]=3 1342 B15R1.791 CCCC(C)COC1=C(C=C(C=C1)Cl)N MCULE-4668392899 [0,2,0,0,0,0|2,0,0]=4 1343 B15R1.791 CNCC(O)COC1=CC=C(C=C1C)C MCULE-2739866203 [0,2,0,0,0,0|2,0,0]=4 1344 B15R1.870 CC1=CC=C(C=C1)OCC(O)CN(C)C MCULE-2023605075 [0,2,0,0,0,0|2,0,0]=4 1345 B15R1.870 CC1=CC=C(C=C1)OCC(O)CN(C)C MCULE-3103564181 [0,2,0,0,0,0|2,0,0]=4 1346 B15R1.870 CN(C)CC(O)COC1=CC=C(C=C1)N MCULE-4324766348 [0,2,0,0,0,0|2,0,0]=4 1347 B15R1.10390 CNCC(O)COC1=CC(=C(C=C1)Cl)C MCULE-3927141644 [0,2,0,0,0,0|1,0,0]=3 1348 B15R1.894 OC(CSC1=CC=C(C=C1)Cl)C(F)(F)F MCULE-5920190893 [0,2,0,0,0,0|1,1,0]=4 1349 B15R1.894 O[C@@H](CSC1=CC=C(C=C1)Cl)C(F)(F)F MCULE-4082118080 [0,2,0,0,0,0|1,1,0]=4 1350 B15R1.38791 OCC(O)COC1=C(C=C(C=C1Br)Br)Br MCULE-8701068311 [0,2,0,0,0,0|0,1,0]=3 1351 B13R2.12 BrC1=CC=C(C=C1)C2CCCO2 MCULE-4421082543 [1,0,0,1,0,0|1,1,0]=4 1352 B13R2.12 ClC1=CC=C(C=C1)C2=NCCC2 MCULE-6657392532 [1,0,0,1,0,0|2,0,0]=4 1353 B13R2.12 ClC1=CC=C(C=C1)C2CCCN2 MCULE-2794767536 [1,0,0,1,0,0|2,0,0]=4 1354 B13R2.12 ClC1=CC=C(C=C1)C2CCCN2 MCULE-4025877443 [1,0,0,1,0,0|2,0,0]=4 1355 B13R2.12 ClC1=CC=C(C=C1)C2CCCN2 MCULE-4221585775 [1,0,0,1,0,0|2,0,0]=4 1356 B13R2.12 ClC1=CC=C(C=C1)C2CCCN2 MCULE-9246271362 [1,0,0,1,0,0|2,0,0]=4 1357 B13R2.12 ClC1=CC=C(C=C1)C2CCCN2 MCULE-9330805054 [1,0,0,1,0,0|2,0,0]=4 1358 B13R2.12 ClC1=CC=C(C=C1)C2OCCS2 MCULE-8246476088 [1,0,0,1,0,0|2,0,0]=4 1359 B13R2.12 ClC1=CC=C(C=C1)[C@@H]2CCCN2 MCULE-1570808218 [1,0,0,1,0,0|2,0,0]=4 1360 B13R2.12 ClC1=CC=C(C=C1)[C@@H]2CCCN2 MCULE-2491792051 [1,0,0,1,0,0|2,0,0]=4 1361 B13R2.12 ClC1=CC=C(C=C1)[C@@H]2CCCN2 MCULE-7278021584 [1,0,0,1,0,0|2,0,0]=4 1362 B13R2.12 ClC1=CC=C(C=C1)[C@@H]2CCCN2 MCULE-9881360174 [1,0,0,1,0,0|2,0,0]=4 1363 B13R2.12 ClC1=CC=C(C=C1)[C@H]2CCCN2 MCULE-1980884073 [1,0,0,1,0,0|2,0,0]=4 1364 B13R2.12 ClC1=CC=C(C=C1)[C@H]2CCCN2 MCULE-2225326764 [1,0,0,1,0,0|2,0,0]=4 1365 B13R2.12 ClC1=CC=C(C=C1)[C@H]2CCCN2 MCULE-4175169464 [1,0,0,1,0,0|2,0,0]=4 1366 B13R2.12 ClC1=CC=C(C=C1)[C@H]2CCCN2 MCULE-9203477805 [1,0,0,1,0,0|2,0,0]=4 1367 B13R2.42 CC1=CC=C(C=C1)C2CC2CO MCULE-3906704747 [1,0,0,1,0,0|2,0,0]=4 1368 B13R2.42 NCC1CC1C2=CC=C(C=C2)Cl MCULE-9718072744 [1,0,0,1,0,0|2,0,0]=4 1369 B13R2.42 OCC1CC1C2=CC=C(C=C2)Br MCULE-3592461007 [1,0,0,1,0,0|1,1,0]=4 1370 B13R2.42 OCC1CC1C2=CC=C(C=C2)Cl MCULE-2113210084 [1,0,0,1,0,0|1,0,0]=3 1371 B13R2.42 OCC1CC1C2=CC=C(C=C2)F MCULE-9599383222 [1,0,0,1,0,0|1,1,0]=4 1372 B13R2.42 OC[C@@H]1C[C@@H]1C2=CC=C(C=C2)F MCULE-3127327905 [1,0,0,1,0,0|1,1,0]=4 1373 B13R2.42 OC[C@@H]1C[C@H]1C2=CC=C(C=C2)Cl MCULE-1659080044 [1,0,0,1,0,0|1,0,0]=3 1374 B13R2.42 OC[C@H]1C[C@@H]1C2=CC=C(C=C2)Cl MCULE-3938352557 [1,0,0,1,0,0|1,0,0]=3 1375 B13R2.146 OC1CCC1C2=CC=C(C=C2)Cl MCULE-4992298795 [1,0,0,1,0,0|1,0,0]=3 1376 B13R2.162 CC1=CC2=C(C=C1)CCCC2O MCULE-3647987502 [1,0,0,1,0,0|2,0,0]=4 1377 B13R2.162 CC1=CC2=C(C=C1)OCCC2N MCULE-1581937328 [1,0,0,1,0,0|2,0,0]=4 1378 B13R2.162 CC1=CC2=C(C=C1)OCCC2N MCULE-4363785610 [1,0,0,1,0,0|2,0,0]=4 1379 B13R2.162 CC1=CC2=C(C=C1)OCCC2N MCULE-5335585117 [1,0,0,1,0,0|2,0,0]=4 1380 B13R2.162 CC1=CC2=C(C=C1)OCCC2N MCULE-7807297147 [1,0,0,1,0,0|2,0,0]=4 1381 B13R2.162 CC1=CC2=C(C=C1)OCC[C@@H]2N MCULE-3774304400 [1,0,0,1,0,0|2,0,0]=4 1382 B13R2.162 CC1=CC2=C(C=C1)OCC[C@@H]2N MCULE-4229979473 [1,0,0,1,0,0|2,0,0]=4 1383 B13R2.162 CC1=CC2=C(C=C1)OCC[C@@H]2N MCULE-5267425282 [1,0,0,1,0,0|2,0,0]=4 1384 B13R2.162 CC1=CC2=C(C=C1)OCC[C@@H]2N MCULE-8251806683 [1,0,0,1,0,0|2,0,0]=4 1385 B13R2.162 CC1=CC2=C(C=C1)OCC[C@H]2N MCULE-4138789110 [1,0,0,1,0,0|2,0,0]=4 1386 B13R2.162 CC1=CC2=C(C=C1)OCC[C@H]2N MCULE-7148747153 [1,0,0,1,0,0|2,0,0]=4 1387 B13R2.162 CC1=CC=C2CCC[C@@H](C2=C1)O MCULE-6930403638 [1,0,0,1,0,0|2,0,0]=4 1388 B13R2.162 CC1CCNC2=C1C=C(C=C2)Cl MCULE-8678012011 [1,0,0,1,0,0|2,0,0]=4 1389 B13R2.162 ClC1=CC=C2CCCC(C2=C1)Cl MCULE-9751902905 [1,0,0,1,0,0|2,0,0]=4 1390 B13R2.162 NC1=CC2=C(C=C1)CCCC2O MCULE-3676413567 [1,0,0,1,0,0|2,0,0]=4 1391 B13R2.162 NC1=CC2=C(C=C1)OCC[C@@H]2N MCULE-1584230416 [1,0,0,1,0,0|2,0,0]=4 1392 B13R2.162 NC1=CC2=C(C=C1)OCC[C@@H]2N MCULE-4434267796 [1,0,0,1,0,0|2,0,0]=4 1393 B13R2.162 NC1=CC2=C(C=C1)OCC[C@H]2N MCULE-3842743091 [1,0,0,1,0,0|2,0,0]=4 1394 B13R2.162 NC1=CC2=C(C=C1)OCC[C@H]2N MCULE-9976029996 [1,0,0,1,0,0|2,0,0]=4 1395 B13R2.162 NC1CCCC2=C1C=C(C=C2)Cl MCULE-8568188539 [1,0,0,1,0,0|2,0,0]=4 1396 B13R2.162 NC1CCCC2=C1C=C(C=C2)Cl MCULE-9214159401 [1,0,0,1,0,0|2,0,0]=4 1397 B13R2.162 NC1CCNC2=C1C=C(C=C2)Cl MCULE-3127250528 [1,0,0,1,0,0|2,0,0]=4 1398 B13R2.162 NC1CCOC2=C1C=C(C=C2)Br MCULE-1024278014 [1,0,0,1,0,0|1,1,0]=4 1399 B13R2.162 NC1CCOC2=C1C=C(C=C2)Br MCULE-4565786136 [1,0,0,1,0,0|1,1,0]=4 1400 B13R2.162 NC1CCOC2=C1C=C(C=C2)Br MCULE-6614231477 [1,0,0,1,0,0|1,1,0]=4 1401 B13R2.162 NC1CCOC2=C1C=C(C=C2)Br MCULE-8367951285 [1,0,0,1,0,0|1,1,0]=4 1402 B13R2.162 NC1CCOC2=C1C=C(C=C2)Cl MCULE-2034984256 [1,0,0,1,0,0|1,0,0]=3 1403 B13R2.162 NC1CCOC2=C1C=C(C=C2)Cl MCULE-3933438417 [1,0,0,1,0,0|1,0,0]=3 1404 B13R2.162 NC1CCOC2=C1C=C(C=C2)Cl MCULE-5606342151 [1,0,0,1,0,0|1,0,0]=3 1405 B13R2.162 NC1CCOC2=C1C=C(C=C2)Cl MCULE-6586699077 [1,0,0,1,0,0|1,0,0]=3 1406 B13R2.162 NC1CCOC2=C1C=C(C=C2)F MCULE-2045484684 [1,0,0,1,0,0|1,1,0]=4 1407 B13R2.162 NC1CCOC2=C1C=C(C=C2)F MCULE-2284187273 [1,0,0,1,0,0|1,1,0]=4 1408 B13R2.162 NC1CCOC2=C1C=C(C=C2)F MCULE-5762006845 [1,0,0,1,0,0|1,1,0]=4 1409 B13R2.162 NC1CCOC2=C1C=C(C=C2)F MCULE-6480412027 [1,0,0,1,0,0|1,1,0]=4 1410 B13R2.162 NC1CCSC2=C1C=C(C=C2)Cl MCULE-5462943814 [1,0,0,1,0,0|1,1,0]=4 1411 B13R2.162 NC1CCSC2=C1C=C(C=C2)Cl MCULE-8179275569 [1,0,0,1,0,0|1,1,0]=4 1412 B13R2.162 N[C@@H]1CCCC2=C1C=C(C=C2)Cl MCULE-4156002988 [1,0,0,1,0,0|2,0,0]=4 1413 B13R2.162 N[C@@H]1CCCC2=CC=C(C=C12)Cl MCULE-9376864143 [1,0,0,1,0,0|2,0,0]=4 1414 B13R2.162 N[C@@H]1CCOC2=C1C=C(C=C2)Br MCULE-7917804008 [1,0,0,1,0,0|1,1,0]=4 1415 B13R2.162 N[C@@H]1CCOC2=C1C=C(C=C2)Br MCULE-8028593875 [1,0,0,1,0,0|1,1,0]=4 1416 B13R2.162 N[C@@H]1CCOC2=C1C=C(C=C2)Cl MCULE-1486700654 [1,0,0,1,0,0|1,0,0]=3 1417 B13R2.162 N[C@@H]1CCOC2=C1C=C(C=C2)Cl MCULE-3982918029 [1,0,0,1,0,0|1,0,0]=3 1418 B13R2.162 N[C@@H]1CCOC2=C1C=C(C=C2)Cl MCULE-7093913210 [1,0,0,1,0,0|1,0,0]=3 1419 B13R2.162 N[C@@H]1CCOC2=C1C=C(C=C2)Cl MCULE-9633029908 [1,0,0,1,0,0|1,0,0]=3 1420 B13R2.162 N[C@@H]1CCOC2=C1C=C(C=C2)F MCULE-1213900788 [1,0,0,1,0,0|1,1,0]=4 1421 B13R2.162 N[C@@H]1CCOC2=C1C=C(C=C2)F MCULE-2920468361 [1,0,0,1,0,0|1,1,0]=4 1422 B13R2.162 N[C@@H]1CCOC2=C1C=C(C=C2)F MCULE-4817370781 [1,0,0,1,0,0|1,1,0]=4 1423 B13R2.162 N[C@@H]1CCOC2=C1C=C(C=C2)F MCULE-8332743062 [1,0,0,1,0,0|1,1,0]=4 1424 B13R2.162 N[C@@H]1CCOC2=CC=C(C=C12)Br MCULE-4001767185 [1,0,0,1,0,0|1,1,0]=4 1425 B13R2.162 N[C@@H]1CCOC2=CC=C(C=C12)I MCULE-4090648742 [1,0,0,1,0,0|1,1,0]=4 1426 B13R2.162 N[C@@H]1CCOC2=CC=C(C=C12)I MCULE-9351318568 [1,0,0,1,0,0|1,1,0]=4 1427 B13R2.162 N[C@H]1CCCC2=C1C=C(C=C2)Cl MCULE-9596867451 [1,0,0,1,0,0|2,0,0]=4 1428 B13R2.162 N[C@H]1CCCC2=CC=C(C=C12)Cl MCULE-1882335645 [1,0,0,1,0,0|2,0,0]=4 1429 B13R2.162 N[C@H]1CCCC2=CC=C(C=C12)Cl MCULE-9185363649 [1,0,0,1,0,0|2,0,0]=4 1430 B13R2.162 N[C@H]1CCCC2=CC=C(C=C12)Cl MCULE-9308903209 [1,0,0,1,0,0|2,0,0]=4 1431 B13R2.162 N[C@H]1CCOC2=C1C=C(C=C2)Br MCULE-9067488538 [1,0,0,1,0,0|1,1,0]=4 1432 B13R2.162 N[C@H]1CCOC2=C1C=C(C=C2)Cl MCULE-1575135948 [1,0,0,1,0,0|1,0,0]=3 1433 B13R2.162 N[C@H]1CCOC2=C1C=C(C=C2)Cl MCULE-6339870916 [1,0,0,1,0,0|1,0,0]=3 1434 B13R2.162 N[C@H]1CCOC2=C1C=C(C=C2)Cl MCULE-7579015970 [1,0,0,1,0,0|1,0,0]=3 1435 B13R2.162 N[C@H]1CCOC2=C1C=C(C=C2)Cl MCULE-8871081385 [1,0,0,1,0,0|1,0,0]=3 1436 B13R2.162 N[C@H]1CCOC2=C1C=C(C=C2)F MCULE-3470480447 [1,0,0,1,0,0|1,1,0]=4 1437 B13R2.162 N[C@H]1CCOC2=C1C=C(C=C2)F MCULE-4202272955 [1,0,0,1,0,0|1,1,0]=4 1438 B13R2.162 N[C@H]1CCOC2=C1C=C(C=C2)F MCULE-8244407243 [1,0,0,1,0,0|1,1,0]=4 1439 B13R2.162 N[C@H]1CCOC2=C1C=C(C=C2)F MCULE-9218991320 [1,0,0,1,0,0|1,1,0]=4 1440 B13R2.162 N[C@H]1CCOC2=CC=C(C=C12)Br MCULE-4510692297 [1,0,0,1,0,0|1,1,0]=4 1441 B13R2.162 N[C@H]1CCOC2=CC=C(C=C12)Br MCULE-6324972256 [1,0,0,1,0,0|1,1,0]=4 1442 B13R2.162 N[C@H]1CCOC2=CC=C(C=C12)Br MCULE-8567038753 [1,0,0,1,0,0|1,1,0]=4 1443 B13R2.162 N[C@H]1CCOC2=CC=C(C=C12)I MCULE-8215208677 [1,0,0,1,0,0|1,1,0]=4 1444 B13R2.162 N[C@H]1CCOC2=CC=C(C=C12)I MCULE-9470876163 [1,0,0,1,0,0|1,1,0]=4 1445 B13R2.162 O=C1CCOC2=CC=C(C=C12)Cl MCULE-7653044163 [1,0,0,1,0,0|0,0,2]=4 1446 B13R2.162 OC1=CC2=C(C=C1)OCCC2O MCULE-8649461174 [1,0,0,1,0,0|1,0,0]=3 1447 B13R2.162 OC1CCCC2=C1C=C(C=C2)Br MCULE-3883709360 [1,0,0,1,0,0|1,1,0]=4 1448 B13R2.162 OC1CCCC2=C1C=C(C=C2)Cl MCULE-8659851760 [1,0,0,1,0,0|1,0,0]=3 1449 B13R2.162 OC1CCCC2=CC=C(N=C12)Cl MCULE-5142040590 [1,0,0,1,0,0|2,0,0]=4 1450 B13R2.162 OC1CCOC2=C1C=C(C=C2)Br MCULE-5385066396 [1,0,0,1,0,0|0,1,0]=3 1451 B13R2.162 OC1CCOC2=CC=C(C=C12)Cl MCULE-5159581089 [1,0,0,1,0,0|0,0,0]=2 1452 B13R2.162 OC1CCOC2=CC=C(C=C12)F MCULE-4766002349 [1,0,0,1,0,0|0,1,0]=3 1453 B13R2.162 OC1CCOC2=CC=C(C=C12)I MCULE-7004931824 [1,0,0,1,0,0|0,1,0]=3 1454 B13R2.162 OC1CCSC2=CC=C(C=C12)Cl MCULE-9787199705 [1,0,0,1,0,0|0,1,0]=3 1455 B13R2.162 OC1CNCC2=C1C=C(C=C2)Cl MCULE-5116902143 [1,0,0,1,0,0|2,0,0]=4 1456 B13R2.162 O[C@@H]1CCCC2=C1C=C(C=C2)Cl MCULE-4163457425 [1,0,0,1,0,0|1,0,0]=3 1457 B13R2.162 O[C@@H]1CCCC2=CC=C(C=C12)F MCULE-1781840391 [1,0,0,1,0,0|1,1,0]=4 1458 B13R2.162 O[C@@H]1CCOC2=C1C=C(C=C2)F MCULE-7598933120 [1,0,0,1,0,0|0,1,0]=3 1459 B13R2.162 O[C@@H]1CCOC2=CC=C(C=C12)Br MCULE-1207978310 [1,0,0,1,0,0|0,1,0]=3 1460 B13R2.162 O[C@H]1CCCC2=C1C=C(C=C2)Cl MCULE-2301046773 [1,0,0,1,0,0|1,0,0]=3 1461 B13R2.162 O[C@H]1CCCC2=CC=C(C=C12)F MCULE-4304163925 [1,0,0,1,0,0|1,1,0]=4 1462 B13R2.162 O[C@H]1CCOC2=C1C=C(C=C2)F MCULE-6047972036 [1,0,0,1,0,0|0,1,0]=3 1463 B13R2.162 O[C@H]1CCOC2=CC=C(C=C12)Br MCULE-6985661749 [1,0,0,1,0,0|0,1,0]=3 1464 B13R2.527 BrC1=CC=C(C=C1)OCC2CC2 MCULE-5269298076 [1,0,0,1,0,0|1,1,0]=4 1465 B13R2.527 BrC1=CC=C(C=C1)OCC2CO2 MCULE-6872053172 [1,0,0,1,0,0|0,1,0]=3 1466 B13R2.527 BrC1=CC=C(C=C1)OC[C@@H]2CO2 MCULE-3708064753 [1,0,0,1,0,0|0,1,0]=3 1467 B13R2.527 BrC1=CC=C(C=C1)OC[C@H]2CO2 MCULE-4285616157 [1,0,0,1,0,0|0,1,0]=3 1468 B13R2.527 CC1=CC=C(C=C1)OCC2CO2 MCULE-6465461089 [1,0,0,1,0,0|1,0,0]=3 1469 B13R2.527 CC1=CC=C(C=C1)OC[C@@H]2CO2 MCULE-2542146277 [1,0,0,1,0,0|1,0,0]=3 1470 B13R2.527 CC1=CC=C(C=C1)OC[C@H]2CO2 MCULE-2270811322 [1,0,0,1,0,0|1,0,0]=3 1471 B13R2.527 ClC1=CC=C(C=C1)NCC2CC2 MCULE-1148923729 [1,0,0,1,0,0|2,0,0]=4 1472 B13R2.527 ClC1=CC=C(C=C1)NCC2CC2 MCULE-2382523364 [1,0,0,1,0,0|2,0,0]=4 1473 B13R2.527 ClC1=CC=C(C=C1)OCC2CO2 MCULE-7924634482 [1,0,0,1,0,0|0,0,0]=2 1474 B13R2.527 ClC1=CC=C(C=C1)OC[C@@H]2CO2 MCULE-6101256652 [1,0,0,1,0,0|0,0,0]=2 1475 B13R2.527 ClC1=CC=C(C=C1)OC[C@@H]2CO2 MCULE-9950123041 [1,0,0,1,0,0|0,0,0]=2 1476 B13R2.527 ClC1=CC=C(C=C1)OC[C@H]2CO2 MCULE-3204882533 [1,0,0,1,0,0|0,0,0]=2 1477 B13R2.527 ClC1=CC=C(C=C1)OC[C@H]2CO2 MCULE-3656581663 [1,0,0,1,0,0|0,0,0]=2 1478 B13R2.527 ClC1=NC=C(C=C1)OCC2CO2 MCULE-9680143800 [1,0,0,1,0,0|1,0,0]=3 1479 B13R2.527 FC1=CC=C(C=C1)OCC2CC2 MCULE-4620254955 [1,0,0,1,0,0|1,1,0]=4 1480 B13R2.527 FC1=CC=C(C=C1)OCC2CO2 MCULE-9415244451 [1,0,0,1,0,0|0,1,0]=3 1481 B13R2.527 FC1=CC=C(C=C1)OC[C@@H]2CO2 MCULE-5810532155 [1,0,0,1,0,0|0,1,0]=3 1482 B13R2.527 FC1=CC=C(C=C1)OC[C@H]2CO2 MCULE-5802968906 [1,0,0,1,0,0|0,1,0]=3 1483 B13R2.527 IC1=CC=C(C=C1)OCC2CC2 MCULE-5347811889 [1,0,0,1,0,0|1,1,0]=4 1484 B13R2.527 NC1=CC=C(C=C1)OCC2CC2 MCULE-3421678259 [1,0,0,1,0,0|2,0,0]=4 1485 B13R2.527 NC1=CC=C(C=C1)OCC2CC2 MCULE-6326388439 [1,0,0,1,0,0|2,0,0]=4 1486 B13R2.527 NC1=CC=C(C=C1)OCC2CO2 MCULE-8558650405 [1,0,0,1,0,0|1,0,0]=3 1487 B13R2.527 OC1=CC=C(C=C1)OCC2CC2 MCULE-9642863646 [1,0,0,1,0,0|2,0,0]=4 1488 B13R2.1069 BrC1=CC=C(C=C1)OC2CCC2 MCULE-4426570649 [1,0,0,1,0,0|1,1,0]=4 1489 B13R2.1069 ClC1=CC=C(C=C1)OC2CNC2 MCULE-5462652653 [1,0,0,1,0,0|2,0,0]=4 1490 B13R2.1069 ClC1=CC=C(C=C1)OC2CNC2 MCULE-5784941180 [1,0,0,1,0,0|2,0,0]=4 1491 B13R2.1069 IC1=CC=C(C=C1)OC2CCC2 MCULE-7922864582 [1,0,0,1,0,0|1,1,0]=4 1492 B13R2.1069 NC1=CC=C(C=C1)OC2CCC2 MCULE-5260091455 [1,0,0,1,0,0|2,0,0]=4 1493 B13R2.1069 OC1=CC=C(C=C1)OC2CCC2 MCULE-2627122374 [1,0,0,1,0,0|2,0,0]=4 1494 B13R2.2136 NCC1CCC2=CC=C(C=C12)Cl MCULE-2159733172 [1,0,0,1,0,0|2,0,0]=4 1495 B13R2.2136 NCC1CCC2=CC=C(C=C12)Cl MCULE-3918282450 [1,0,0,1,0,0|2,0,0]=4 1496 B13R2.3729 BrC1=CC2=C(C=C1)OCCCN2 MCULE-7299412000 [1,0,0,1,0,0|1,1,0]=4 1497 B13R2.3729 BrC1=CC2=C(C=C1)OCCCO2 MCULE-1190785586 [1,0,0,1,0,0|0,1,0]=3 1498 B13R2.3729 CC1=CC2=C(C=C1)OCCCN2 MCULE-4195151946 [1,0,0,1,0,0|2,0,0]=4 1499 B13R2.3729 ClC1=CC2=C(C=C1)CCCCN2 MCULE-1429031785 [1,0,0,1,0,0|2,0,0]=4 1500 B13R2.3729 ClC1=CC2=C(C=C1)NCCCC2 MCULE-5645779539 [1,0,0,1,0,0|2,0,0]=4 1501 B13R2.3729 ClC1=CC2=C(C=C1)NCCCC2 MCULE-7587267262 [1,0,0,1,0,0|2,0,0]=4 1502 B13R2.3729 ClC1=CC2=C(C=C1)NCCCS2 MCULE-1802447936 [1,0,0,1,0,0|1,1,0]=4 1503 B13R2.3729 ClC1=CC2=C(C=C1)OCCNC2 MCULE-2768994066 [1,0,0,1,0,0|2,0,0]=4 1504 B13R2.3729 ClC1=CC2=C(C=C1)OCCNC2 MCULE-9273639347 [1,0,0,1,0,0|2,0,0]=4 1505 B13R2.3729 IC1=CC=C2OCCCOC2=C1 MCULE-7091976114 [1,0,0,1,0,0|0,1,0]=3 1506 B13R2.3729 NC1=CC2=C(C=C1)OCCCO2 MCULE-6903737229 [1,0,0,1,0,0|1,0,0]=3 1507 B13R2.3729 NC1=CC=C2OCCCOC2=C1 MCULE-1541493841 [1,0,0,1,0,0|1,0,0]=3 1508 B13R2.3729 OC1=CC2=C(C=C1)OCCCO2 MCULE-5430146856 [1,0,0,1,0,0|1,0,0]=3 1509 B13R2.3729 OC1=CC=C2OCCCCC2=C1 MCULE-1598098617 [1,0,0,1,0,0|2,0,0]=4 1510 B13R2.3729 SC1=CC2=C(C=C1)OCCCO2 MCULE-4966974906 [1,0,0,1,0,0|1,0,0]=3 1511 B13R2.147 NC1=CC=C(C=C1)N2CC(C2)O MCULE-8529315435 [1,0,0,1,0,0|2,0,0]=4 1512 B13R2.147 NC1CC(C1)C2=CC=C(C=C2)Cl MCULE-2394888782 [1,0,0,1,0,0|2,0,0]=4 1513 B13R2.147 NC1CC(C1)C2=CC=C(C=C2)Cl MCULE-9420825480 [1,0,0,1,0,0|2,0,0]=4 1514 B13R2.147 OC1CC(C1)C2=CC=C(C=C2)Br MCULE-5605569852 [1,0,0,1,0,0|1,1,0]=4 1515 B13R2.147 OC1CC(C1)C2=CC=C(C=C2)F MCULE-5819012717 [1,0,0,1,0,0|1,1,0]=4 1516 B13R2.147 O[C@H]1C[C@@H](C1)C2=CC=C(C=C2)Br MCULE-2085030870 [1,0,0,1,0,0|1,1,0]=4 1517 B13R2.155 CC1=CC2=C(C=C1)NCC(O2)C MCULE-1563931530 [1,0,0,1,0,0|2,0,0]=4 1518 B13R2.155 CC1=CC2=C(C=C1)OCC(N2)C MCULE-8731432490 [1,0,0,1,0,0|2,0,0]=4 1519 B13R2.155 CC1CCC2=CC=C(C=C2N1)Cl MCULE-5850339767 [1,0,0,1,0,0|2,0,0]=4 1520 B13R2.155 CC1CNC2=C(O1)C=C(C=C2)Br MCULE-2502621982 [1,0,0,1,0,0|1,1,0]=4 1521 B13R2.155 CC1CNC2=C(O1)C=C(C=C2)F MCULE-1996437262 [1,0,0,1,0,0|1,1,0]=4 1522 B13R2.155 CC1CNC2=CC=C(C=C2O1)Cl MCULE-6880889394 [1,0,0,1,0,0|1,0,0]=3 1523 B13R2.155 CC1COC2=CC=C(C=C2N1)Br MCULE-9038702810 [1,0,0,1,0,0|1,1,0]=4 1524 B13R2.155 NC1CCC2=C(C1)C=C(C=C2)Cl MCULE-4454143524 [1,0,0,1,0,0|2,0,0]=4 1525 B13R2.155 NC1CCC2=CC=C(C=C2C1)Cl MCULE-5729071255 [1,0,0,1,0,0|2,0,0]=4 1526 B13R2.155 NC1COC2=C(C1)C=C(C=C2)Cl MCULE-3357190298 [1,0,0,1,0,0|1,0,0]=3 1527 B13R2.155 NC1COC2=C(C1)C=C(C=C2)Cl MCULE-3709973205 [1,0,0,1,0,0|1,0,0]=3 1528 B13R2.155 NC1COC2=C(C1)C=C(C=C2)F MCULE-3576727150 [1,0,0,1,0,0|1,1,0]=4 1529 B13R2.155 NC1COC2=C(C1)C=C(C=C2)F MCULE-6792263615 [1,0,0,1,0,0|1,1,0]=4 1530 B13R2.155 NC1COC2=CC=C(C=C2C1)Br MCULE-3040323933 [1,0,0,1,0,0|1,1,0]=4 1531 B13R2.155 NC1COC2=CC=C(C=C2C1)Br MCULE-8411079826 [1,0,0,1,0,0|1,1,0]=4 1532 B13R2.155 O=C1COC2=C(C1)C=C(C=C2)Cl MCULE-9603339872 [1,0,0,1,0,0|0,0,2]=4 1533 B13R2.155 OC1CNC2=C(C1)C=C(C=C2)Br MCULE-1865559738 [1,0,0,1,0,0|1,1,0]=4 1534 B13R2.3791 CC1(CCC2=CC=C(C=C12)Cl)N MCULE-7130834521 [1,0,0,1,0,0|2,0,0]=4 1535 B13R2.3791 CC1(CNC2=C1C=C(C=C2)Cl)C MCULE-6083062057 [1,0,0,1,0,0|2,0,0]=4 1536 B13R2.3791 CC1(COC2=C1C=C(C=C2)Br)C MCULE-1009833714 [1,0,0,1,0,0|1,1,0]=4 1537 B13R2.3791 CC1(COC2=CC=C(C=C12)O)C MCULE-8643629769 [1,0,0,1,0,0|2,0,0]=4 1538 B13R2.10 OC1CCC(C1)C2=CC=CC=C2 MCULE-4364661007 [1,0,0,1,0,0|2,0,0]=4 1539 B13R2.10 OC1CCN(C1)C2=CC=CC=C2 MCULE-9428146950 [1,0,0,1,0,0|2,0,0]=4 1540 B13R2.10 OC1CNC(C1)C2=CC=CC=C2 MCULE-7947925519 [1,0,0,1,0,0|2,0,0]=4 1541 B13R2.10 OC1CNC(C1)C2=CC=CC=C2 MCULE-9043324679 [1,0,0,1,0,0|2,0,0]=4 1542 B13R2.10 OC1COC(C1)C2=CC=CC=C2 MCULE-7655203806 [1,0,0,1,0,0|1,0,0]=3 1543 B13R2.17 NC1CC1COC2=CC=CC=C2 MCULE-9494927952 [1,0,0,1,0,0|2,0,0]=4 1544 B13R2.27 O[C@@H]1CC[C@H]1NC2=CC=CC=C2 MCULE-4091334741 [1,0,0,1,0,0|2,0,0]=4 1545 B13R2.32 CC1COC2=C(C1N)C=CC=C2 MCULE-6840886514 [1,0,0,1,0,0|2,0,0]=4 1546 B13R2.32 CC1COC2=C(C1N)C=CC=C2 MCULE-9489268125 [1,0,0,1,0,0|2,0,0]=4 1547 B13R2.32 CC1COC2=C(C1O)C=CC=C2 MCULE-4504315262 [1,0,0,1,0,0|1,0,0]=3 1548 B13R2.32 NC1C2=C(C=CC=C2)CCC1O MCULE-4643876744 [1,0,0,1,0,0|2,0,0]=4 1549 B13R2.32 NC1C2=C(C=CC=C2)CCC1O MCULE-6750759041 [1,0,0,1,0,0|2,0,0]=4 1550 B13R2.32 NC1C2=CC=CC=C2OCC1O MCULE-5327598686 [1,0,0,1,0,0|1,0,0]=3 1551 B13R2.32 NC1CCC2=C(C1O)C=CC=C2 MCULE-2193798452 [1,0,0,1,0,0|2,0,0]=4 1552 B13R2.32 NC1CCC2=C(C1O)C=CC=C2 MCULE-9926052602 [1,0,0,1,0,0|2,0,0]=4 1553 B13R2.32 NC1COC2=C(C1O)C=CC=C2 MCULE-1616535091 [1,0,0,1,0,0|1,0,0]=3 1554 B13R2.32 NC1COC2=C(C1O)C=CC=C2 MCULE-8389919721 [1,0,0,1,0,0|1,0,0]=3 1555 B13R2.32 N[C@@H]1C2=C(C=CC=C2)CC[C@@H]1O MCULE-2626518631 [1,0,0,1,0,0|2,0,0]=4 1556 B13R2.32 N[C@@H]1C2=C(C=CC=C2)CC[C@H]1O MCULE-2036728210 [1,0,0,1,0,0|2,0,0]=4 1557 B13R2.32 N[C@H]1C2=CC=CC=C2OC[C@H]1O MCULE-3659632613 [1,0,0,1,0,0|1,0,0]=3 1558 B13R2.32 OC1C2=C(C=CC=C2)CCC1F MCULE-9593559888 [1,0,0,1,0,0|2,0,0]=4 1559 B13R2.32 OC1CCC2=C(C1O)C=CC=C2 MCULE-8543505788 [1,0,0,1,0,0|1,0,0]=3 1560 B13R2.32 O[C@@H]1C2=CC=CC=C2CC[C@@H]1Cl MCULE-4337801562 [1,0,0,1,0,0|2,0,0]=4 1561 B13R2.32 O[C@H]1C2=CC=CC=C2CC[C@H]1Br MCULE-5138686109 [1,0,0,1,0,0|2,0,0]=4 1562 B13R2.33 NC1CCC2=C(C=CC=C2)OC1 MCULE-1698475700 [1,0,0,1,0,0|2,0,0]=4 1563 B13R2.33 OC1COC2=C(C=CC=C2)CN1 MCULE-7537533247 [1,0,0,1,0,0|2,0,0]=4 1564 B13R2.50 OCC1CC1CC2=CC=CC=C2 MCULE-2072532040 [1,0,0,1,0,0|2,0,0]=4 1565 B13R2.57 BrCC1CCC2=CC=CC=C2O1 MCULE-6036112445 [1,0,0,1,0,0|2,0,0]=4 1566 B13R2.57 BrCC1COC2=C(O1)C=CC=C2 MCULE-5274713715 [1,0,0,1,0,0|1,0,0]=3 1567 B13R2.57 BrCC1COC2=CC=CC=C2O1 MCULE-4198209655 [1,0,0,1,0,0|1,0,0]=3 1568 B13R2.57 BrC[C@@H]1COC2=C(O1)C=CC=C2 MCULE-5569440927 [1,0,0,1,0,0|1,0,0]=3 1569 B13R2.57 BrC[C@H]1COC2=C(O1)C=CC=C2 MCULE-3297471477 [1,0,0,1,0,0|1,0,0]=3 1570 B13R2.57 BrC[C@H]1COC2=CC=CC=C2O1 MCULE-1095389212 [1,0,0,1,0,0|1,0,0]=3 1571 B13R2.57 CCC1CNC2=C(O1)C=CC=C2 MCULE-7403890085 [1,0,0,1,0,0|2,0,0]=4 1572 B13R2.57 ClCC1COC2=C(O1)C=CC=C2 MCULE-5687098256 [1,0,0,1,0,0|1,0,0]=3 1573 B13R2.57 N#CC1COC2=CC=CC=C2O1 MCULE-3864645088 [1,0,0,1,0,0|1,0,1]=4 1574 B13R2.57 NCC1CCC2=C(O1)C=CC=C2 MCULE-8328725812 [1,0,0,1,0,0|2,0,0]=4 1575 B13R2.57 NCC1CCC2=C(O1)C=CC=C2 MCULE-8802277069 [1,0,0,1,0,0|2,0,0]=4 1576 B13R2.57 NCC1CCC2=CC=CC=C2O1 MCULE-2890758818 [1,0,0,1,0,0|2,0,0]=4 1577 B13R2.57 NCC1CCC2=CC=CC=C2O1 MCULE-6024459697 [1,0,0,1,0,0|2,0,0]=4 1578 B13R2.57 NCC1CNC2=C(O1)C=CC=C2 MCULE-3654071465 [1,0,0,1,0,0|2,0,0]=4 1579 B13R2.57 NCC1COC2=C(C1)C=CC=C2 MCULE-4761065645 [1,0,0,1,0,0|2,0,0]=4 1580 B13R2.57 NCC1COC2=C(O1)C=CC=C2 MCULE-4899958300 [1,0,0,1,0,0|1,0,0]=3 1581 B13R2.57 NCC1COC2=C(O1)C=CC=C2 MCULE-5900271892 [1,0,0,1,0,0|1,0,0]=3 1582 B13R2.57 NCC1COC2=CC=CC=C2C1 MCULE-9073548483 [1,0,0,1,0,0|2,0,0]=4 1583 B13R2.57 NCC1COC2=CC=CC=C2N1 MCULE-1596173597 [1,0,0,1,0,0|2,0,0]=4 1584 B13R2.57 NCC1COC2=CC=CC=C2N1 MCULE-3549800643 [1,0,0,1,0,0|2,0,0]=4 1585 B13R2.57 NCC1COC2=CC=CC=C2N1 MCULE-4380884268 [1,0,0,1,0,0|2,0,0]=4 1586 B13R2.57 NCC1COC2=CC=CC=C2O1 MCULE-2581640006 [1,0,0,1,0,0|1,0,0]=3 1587 B13R2.57 NCC1COC2=CC=CC=C2O1 MCULE-2640187121 [1,0,0,1,0,0|1,0,0]=3 1588 B13R2.57 NCC1CSC2=C(O1)C=CC=C2 MCULE-2182174137 [1,0,0,1,0,0|1,1,0]=4 1589 B13R2.57 NCC1CSC2=C(O1)C=CC=C2 MCULE-9566629626 [1,0,0,1,0,0|1,1,0]=4 1590 B13R2.57 NC[C@@H]1COC2=C(O1)C=CC=C2 MCULE-5208788451 [1,0,0,1,0,0|1,0,0]=3 1591 B13R2.57 NC[C@@H]1COC2=CC=CC=C2O1 MCULE-8166511546 [1,0,0,1,0,0|1,0,0]=3 1592 B13R2.57 NC[C@@H]1COC2=CC=CC=C2O1 MCULE-9098688438 [1,0,0,1,0,0|1,0,0]=3 1593 B13R2.57 NC[C@H]1CCC2=C(O1)C=CC=C2 MCULE-3610844529 [1,0,0,1,0,0|2,0,0]=4 1594 B13R2.57 NC[C@H]1CCC2=C(O1)C=CC=C2 MCULE-6212407676 [1,0,0,1,0,0|2,0,0]=4 1595 B13R2.57 NC[C@H]1CCC2=C(O1)C=CC=C2 MCULE-7781691127 [1,0,0,1,0,0|2,0,0]=4 1596 B13R2.57 NC[C@H]1CCC2=C(O1)C=CC=C2 MCULE-8589575852 [1,0,0,1,0,0|2,0,0]=4 1597 B13R2.57 NC[C@H]1COC2=C(O1)C=CC=C2 MCULE-4706905162 [1,0,0,1,0,0|1,0,0]=3 1598 B13R2.57 NC[C@H]1COC2=CC=CC=C2O1 MCULE-2843011029 [1,0,0,1,0,0|1,0,0]=3 1599 B13R2.57 NC[C@H]1COC2=CC=CC=C2O1 MCULE-9412432550 [1,0,0,1,0,0|1,0,0]=3 1600 B13R2.57 OCC1=CC2=CC=CC=C2OC1 MCULE-2242538378 [1,0,0,1,0,0|1,0,1]=4 1601 B13R2.57 OCC1CCC2=C(C1)C=CC=C2 MCULE-1132595734 [1,0,0,1,0,0|2,0,0]=4 1602 B13R2.57 OCC1CCC2=C(N1)C=CC=C2 MCULE-1309821172 [1,0,0,1,0,0|2,0,0]=4 1603 B13R2.57 OCC1CCC2=CC=CC=C2O1 MCULE-7747662813 [1,0,0,1,0,0|1,0,0]=3 1604 B13R2.57 OCC1CNC2=C(C1)C=CC=C2 MCULE-9597312331 [1,0,0,1,0,0|2,0,0]=4 1605 B13R2.57 OCC1CNC2=C(O1)C=CC=C2 MCULE-6771984260 [1,0,0,1,0,0|1,0,0]=3 1606 B13R2.57 OCC1CNC2=C(O1)C=CC=C2 MCULE-7460125415 [1,0,0,1,0,0|1,0,0]=3 1607 B13R2.57 OCC1COC2=C(O1)N=CC=C2 MCULE-7824195976 [1,0,0,1,0,0|1,0,0]=3 1608 B13R2.57 OCC1COC2=C(O1)N=CC=C2 MCULE-9687211355 [1,0,0,1,0,0|1,0,0]=3 1609 B13R2.57 OCC1COC2=CC=CC=C2C1 MCULE-8977144018 [1,0,0,1,0,0|1,0,0]=3 1610 B13R2.57 OCC1COC2=CC=CC=C2N1 MCULE-1904752798 [1,0,0,1,0,0|1,0,0]=3 1611 B13R2.57 OCC1COC2=CC=CC=C2N1 MCULE-2696240583 [1,0,0,1,0,0|1,0,0]=3 1612 B13R2.57 OCC1COC2=CC=CC=C2N1 MCULE-7632322488 [1,0,0,1,0,0|1,0,0]=3 1613 B13R2.57 OCC1COC2=CC=CC=C2O1 MCULE-5944665011 [1,0,0,1,0,0|0,0,0]=2 1614 B13R2.57 OCC1CSC2=C(O1)C=CC=C2 MCULE-2648307753 [1,0,0,1,0,0|0,1,0]=3 1615 B13R2.57 OC[C@@H]1CCC2=C(N1)C=CC=C2 MCULE-1199446056 [1,0,0,1,0,0|2,0,0]=4 1616 B13R2.57 OC[C@@H]1CCC2=C(N1)C=CC=C2 MCULE-8695993710 [1,0,0,1,0,0|2,0,0]=4 1617 B13R2.57 OC[C@@H]1COC2=CC=CC=C2O1 MCULE-6412707156 [1,0,0,1,0,0|0,0,0]=2 1618 B13R2.57 OC[C@@H]1COC2=CC=CC=C2O1 MCULE-8278787030 [1,0,0,1,0,0|0,0,0]=2 1619 B13R2.57 OC[C@H]1COC2=CC=CC=C2O1 MCULE-4915602279 [1,0,0,1,0,0|0,0,0]=2 1620 B13R2.57 OC[C@H]1COC2=CC=CC=C2O1 MCULE-9406394238 [1,0,0,1,0,0|0,0,0]=2 1621 B13R2.98 CC1(CC1C2=CC=CC=C2)CO MCULE-7091399817 [1,0,0,1,0,0|2,0,0]=4 1622 B13R2.2383 C1=CC=C(C=C1)OCC2CNC2 MCULE-5205770869 [1,0,0,1,0,0|2,0,0]=4 1623 B13R2.2383 C1=CC=C(C=C1)OCC2CNC2 MCULE-6950071485 [1,0,0,1,0,0|2,0,0]=4 1624 B13R2.2383 C1=CN=C(C=C1)OCC2CCO2 MCULE-3845238030 [1,0,0,1,0,0|2,0,0]=4 1625 B13R2.2531 NC1(CCC2=C1C=CC=C2)CO MCULE-5331171149 [1,0,0,1,0,0|2,0,0]=4 1626 B13R2.2531 NCC1(CCC2=C1C=CC=C2)O MCULE-7415410919 [1,0,0,1,0,0|2,0,0]=4 1627 B13R2.3203 NC1(CC1)COC2=CC=CC=C2 MCULE-9182178751 [1,0,0,1,0,0|2,0,0]=4 1628 B13R2.3203 NC1(CC1)COC2=CC=CC=C2 MCULE-9723023701 [1,0,0,1,0,0|2,0,0]=4 1629 B13R2.43 ClC1=CC=C2OC(CC2=C1)CBr MCULE-4037538968 [0,0,0,1,1,0|2,0,0]=4 1630 B13R2.43 NCC1CC2=CC(=CC=C2O1)Cl MCULE-3702008117 [0,0,0,1,1,0|2,0,0]=4 1631 B13R2.43 NCC1CC2=CC(=CC=C2O1)Cl MCULE-7084404048 [0,0,0,1,1,0|2,0,0]=4 1632 B13R2.43 OCC1=CC2=CC(=CC=C2O1)Cl MCULE-5140734675 [0,0,0,1,1,0|1,0,1]=4 1633 B13R2.43 OCC1CC2=C(O1)C=CC(=C2)Br MCULE-1765545745 [0,0,0,1,1,0|1,1,0]=4 1634 B13R2.43 OCC1CC2=C(O1)C=CC(=C2)F MCULE-2600668277 [0,0,0,1,1,0|1,1,0]=4 1635 B13R2.148 NC1(CC1)CC2=CC=C(C=C2)Cl MCULE-5248240208 [0,0,0,1,1,0|2,0,0]=4 1636 B13R2.148 NC1(CC1)CC2=CC=C(C=C2)Cl MCULE-7708478326 [0,0,0,1,1,0|2,0,0]=4 1637 B13R2.148 OC1(CC1)CC2=CC=C(C=C2)F MCULE-1487465442 [0,0,0,1,1,0|1,1,0]=4 1638 B13R2.3028 NC1C2=CC(=CC=C2CC1O)Br MCULE-3246221910 [0,0,0,1,1,0|1,1,0]=4 1639 B13R2.3028 N[C@H]1C2=C(C=CC(=C2)Br)C[C@H]1O MCULE-6560571423 [0,0,0,1,1,0|1,1,0]=4 1640 B13R2.3028 N[C@H]1C2=C(C=CC(=C2)Br)C[C@H]1O MCULE-9621266149 [0,0,0,1,1,0|1,1,0]=4 1641 B13R2.3683 CC1CNC2=CC(=CC=C2O1)Cl MCULE-6540984768 [0,0,0,1,1,0|2,0,0]=4 1642 B13R2.3683 CC1COC2=C(N1)C=CC(=C2)Cl MCULE-1507476851 [0,0,0,1,1,0|2,0,0]=4 1643 B13R2.3683 NC1CCC2=C(C1)C=CC(=C2)Cl MCULE-4359842514 [0,0,0,1,1,0|2,0,0]=4 1644 B13R2.3683 NC1CCC2=C(C1)C=CC(=C2)Cl MCULE-9700257083 [0,0,0,1,1,0|2,0,0]=4 1645 B13R2.3683 NC1COC2=C(C1)C=CC(=C2)Cl MCULE-4107628424 [0,0,0,1,1,0|1,0,0]=3 1646 B13R2.3683 NC1COC2=C(C1)C=CC(=C2)F MCULE-4150091689 [0,0,0,1,1,0|1,1,0]=4 1647 B13R2.3683 NC1COC2=C(C1)C=CC(=C2)F MCULE-7316147719 [0,0,0,1,1,0|1,1,0]=4 1648 B13R2.3683 NC1COC2=CC(=CC=C2C1)Cl MCULE-5684491505 [0,0,0,1,1,0|1,0,0]=3 1649 B13R2.3683 NC1COC2=CC(=CC=C2C1)O MCULE-9709481314 [0,0,0,1,1,0|2,0,0]=4 1650 B13R2.3683 O=C1COC2=CC(=CC=C2C1)Cl MCULE-8248917022 [0,0,0,1,1,0|0,0,2]=4 1651 B13R2.3683 OC1CCC2=C(C1)C=CC(=C2)Br MCULE-1060978241 [0,0,0,1,1,0|1,1,0]=4 1652 B13R2.3683 OC1CCC2=C(C1)C=CC(=C2)F MCULE-9684793513 [0,0,0,1,1,0|1,1,0]=4 1653 B13R2.3683 OC1COC2=CC(=CC=C2C1)Cl MCULE-1807386499 [0,0,0,1,1,0|0,0,0]=2 1654 B15R2.3 OC1CCC(CC1)C2=CC=C(C=C2)Cl MCULE-7961951120 [0,0,0,1,0,1|2,0,0]=4 1655 B15R2.98 OC1CCN(C1)CC2=CC=C(C=C2)Cl MCULE-1601944288 [0,0,0,1,0,1|2,0,0]=4 1656 B15R2.98 O[C@@H]1CCN(C1)CC2=CC=C(C=C2)Cl MCULE-7745641840 [0,0,0,1,0,1|2,0,0]=4 1657 B15R2.98 O[C@H]1CCN(C1)CC2=CC=C(C=C2)Cl MCULE-2043792911 [0,0,0,1,0,1|2,0,0]=4 1658 B15R2.124 CC1=CC=C(C=C1)OCC2CC2CO MCULE-1092063824 [0,0,0,1,0,1|2,0,0]=4 1659 B15R2.124 NCC1CC1COC2=CC=C(C=C2)Cl MCULE-7569485150 [0,0,0,1,0,1|2,0,0]=4 1660 B15R2.124 OCC1CC1COC2=CC=C(C=C2)Br MCULE-8130419171 [0,0,0,1,0,1|1,1,0]=4 1661 B15R2.124 OCC1CC1COC2=CC=C(C=C2)Cl MCULE-7074496795 [0,0,0,1,0,1|1,0,0]=3 1662 B15R2.124 OCC1CC1COC2=CC=C(C=C2)F MCULE-5633474618 [0,0,0,1,0,1|1,1,0]=4 1663 B15R2.275 ClCC1COC(O1)C2=CC=C(C=C2)Cl MCULE-8720899700 [0,0,0,1,0,1|1,0,0]=3 1664 B15R2.1552 OC1CCC1NCC2=CC=C(C=C2)Cl MCULE-9104589025 [0,0,0,1,0,1|2,0,0]=4 1665 B15R2.1782 CCC1CNCC2=CC=C(C=C2O1)Cl MCULE-4729818322 [0,0,0,1,0,1|2,0,0]=4 1666 B15R2.50022 CC1=CC=C2OCCC(C(C2=C1)O)N MCULE-2451441481 [0,0,0,1,0,1|2,0,0]=4 1667 B15R2.50022 CC1=CC=C2OCCC(C(C2=C1)O)N MCULE-4288281187 [0,0,0,1,0,1|2,0,0]=4 1668 B15R2.50022 NC1CCOC2=CC=C(C=C2C1O)Cl MCULE-4446510942 [0,0,0,1,0,1|1,0,0]=3 1669 B15R2.50022 NC1CCOC2=CC=C(C=C2C1O)Cl MCULE-8946559227 [0,0,0,1,0,1|1,0,0]=3 1670 B15R2.50022 NC1CCOC2=CC=C(C=C2C1O)F MCULE-8178887929 [0,0,0,1,0,1|1,1,0]=4 1671 B15R2.50022 NC1CCOC2=CC=C(C=C2C1O)F MCULE-9145639940 [0,0,0,1,0,1|1,1,0]=4 1672 B15R2.37 COC1=CC=C(C=C1)O[C@@H]2CC[C@H]2O MCULE-9589772838 [0,1,0,1,0,0|2,0,0]=4 1673 B15R2.4776 COC1=CC2=C(C=C1)CCC(O2)CO MCULE-6888693983 [0,1,0,1,0,0|2,0,0]=4 1674 B15R2.28 CC1=CC=C(C=C1)C2CC(CCO2)O MCULE-6125386271 [0,1,0,1,0,0|2,0,0]=4 1675 B15R2.1510 CC1=CC=C(C=C1)O[C@@H]2CCC[C@H]2O MCULE-1832896704 [0,1,0,1,0,0|2,0,0]=4 1676 B15R2.1510 CC1=CC=C(C=C1)O[C@@H]2COC[C@H]2O MCULE-9695885876 [0,1,0,1,0,0|1,0,0]=3 1677 B15R2.1510 CC1=CC=C(C=N1)O[C@@H]2COC[C@H]2O MCULE-4005612835 [0,1,0,1,0,0|2,0,0]=4 1678 B15R2.1510 NC1COCC1OC2=CC=C(C=C2)Br MCULE-3338704931 [0,1,0,1,0,0|1,1,0]=4 1679 B15R2.1510 N[C@@H]1COC[C@@H]1OC2=CC=C(C=C2)Br MCULE-5873272134 [0,1,0,1,0,0|1,1,0]=4 1680 B15R2.1510 N[C@H]1COC[C@H]1OC2=CC=C(C=C2)Br MCULE-6085063516 [0,1,0,1,0,0|1,1,0]=4 1681 B15R2.1510 N[C@H]1COC[C@H]1OC2=CC=C(C=C2)Br MCULE-7284417388 [0,1,0,1,0,0|1,1,0]=4 1682 B15R2.1510 OC1=CC=C(C=C1)O[C@@H]2CCC[C@H]2O MCULE-6614797550 [0,1,0,1,0,0|2,0,0]=4 1683 B15R2.1510 OC1=CC=C(C=C1)O[C@@H]2COC[C@H]2O MCULE-7365029340 [0,1,0,1,0,0|1,0,0]=3 1684 B15R2.1510 OC1CCCC1CC2=CC=C(C=C2)Cl MCULE-6643390365 [0,1,0,1,0,0|2,0,0]=4 1685 B15R2.1510 OC1COCC1OC2=CC=C(C=C2)Br MCULE-1853585358 [0,1,0,1,0,0|0,1,0]=3 1686 B15R2.1510 O[C@@H]1COC[C@H]1OC2=CC=C(C=C2)Br MCULE-8568341136 [0,1,0,1,0,0|0,1,0]=3 1687 B15R2.1510 O[C@@H]1COC[C@H]1OC2=CC=C(C=C2)Cl MCULE-4156944568 [0,1,0,1,0,0|0,0,0]=2 1688 B15R2.5213 CC1=CC=C(C=C1)OCC2(CC2)CO MCULE-5019851419 [0,1,0,1,0,0|2,0,0]=4 1689 B15R2.5213 OCC1(CC1)COC2=CC=C(C=C2)Br MCULE-6664815528 [0,1,0,1,0,0|1,1,0]=4 1690 B15R2.5213 OCC1(CC1)COC2=CC=C(C=C2)Cl MCULE-3490051328 [0,1,0,1,0,0|1,0,0]=3 1691 B15R2.50166 CC1=CC2=C(C=C1)OCC(CO2)(C)O MCULE-2530769579 [0,1,0,1,0,0|1,0,0]=3 1692 B15R2.100 BrC1=CC=C(C=C1)OCC2CCCO2 MCULE-9886165505 [0,1,0,1,0,0|1,1,0]=4 1693 B15R2.100 ClC1=CC=C(C=C1)OCC2CCNC2 MCULE-1041563983 [0,1,0,1,0,0|2,0,0]=4 1694 B15R2.100 ClC1=CC=C(C=C1)OCC2CCNC2 MCULE-9572388439 [0,1,0,1,0,0|2,0,0]=4 1695 B15R2.100 ClC1=CN=C(C=C1)OCC2CCCO2 MCULE-7377312668 [0,1,0,1,0,0|2,0,0]=4 1696 B15R2.100 FC1=CC=C(C=C1)OCC2OCCO2 MCULE-8894674130 [0,1,0,1,0,0|1,1,0]=4 1697 B15R2.100 NC1=CC=C(C=C1)OCC2CCCO2 MCULE-3061172177 [0,1,0,1,0,0|2,0,0]=4 1698 B15R2.100 NC1=CC=C(C=C1)OCC2CCCO2 MCULE-4490876898 [0,1,0,1,0,0|2,0,0]=4 1699 B15R2.100 NC1=CC=C(C=C1)OCC2CCOC2 MCULE-1496493370 [0,1,0,1,0,0|2,0,0]=4 1700 B15R2.1282 COCC1COC2=CC=C(C=C2O1)N MCULE-1106787349 [0,1,0,1,0,0|1,0,0]=3 1701 B15R2.1282 COCC1COC2=CC=C(C=C2O1)N MCULE-8531416690 [0,1,0,1,0,0|1,0,0]=3 1702 B15R2.1282 OCCC1COC2=C(N1)C=C(C=C2)F MCULE-4814450889 [0,1,0,1,0,0|1,1,0]=4 1703 B15R2.1282 OCCC1COC2=C(N1)C=C(C=C2)F MCULE-5178251713 [0,1,0,1,0,0|1,1,0]=4 1704 B15R2.1530 NC(COC1=CC=C(C=C1)Cl)C2CC2 MCULE-9063908040 [0,1,0,1,0,0|2,0,0]=4 1705 B15R2.4986 NCC1(CC1C2=CC=C(C=C2)Cl)CO MCULE-6209927523 [0,1,0,1,0,0|2,0,0]=4 1706 B15R2.7174 O=C(O)C1COC2=C(C1)C=C(C=C2)Cl MCULE-9200515255 [0,1,0,1,0,0|1,0,1]=4 1707 B15R2.7174 O=C(O)C1COC2=C(O1)C=C(C=C2)O MCULE-5644990151 [0,1,0,1,0,0|1,0,1]=4 1708 B15R2.1153 NC1=C(C=CC(=C1)Cl)N2CCC(C2)O MCULE-9760981649 [0,1,0,1,0,0|2,0,0]=4 1709 B15R2.7564 NC1CC1COC2=CC=C(C=C2Cl)Cl MCULE-1994977396 [0,1,0,1,0,0|2,0,0]=4 1710 B15R2.15650 CC1=CC=C(C(=C1)C)O[C@@H]2CC[C@H]2O MCULE-8082486898 [0,1,0,1,0,0|2,0,0]=4 1711 B15R2.15650 O[C@@H]1CC[C@H]1OC2=CC=C(C=C2F)F MCULE-8063892724 [0,1,0,1,0,0|1,1,0]=4 1712 B15R2.15652 NC1(CC1)COC2=CC=C(C=C2I)Cl MCULE-7489559232 [0,1,0,1,0,0|2,0,0]=4 1713 B15R2.15652 NC1(CC1)COC2=CC=C(C=C2I)Cl MCULE-8185508337 [0,1,0,1,0,0|2,0,0]=4 1714 B15R2.43839 ClC1=CC(=C(C=C1)OCC2CNC2)Br MCULE-4646542909 [0,1,0,1,0,0|2,0,0]=4 1715 B15R2.43839 NC1=C(C=CC(=C1)Cl)OCC2CCC2 MCULE-4303503120 [0,1,0,1,0,0|2,0,0]=4 1716 B15R2.89396 NCC1COC2=C(C1)C=C(C=C2Br)Cl MCULE-6302590837 [0,1,0,1,0,0|2,0,0]=4 1717 B15R2.89396 NCC1COC2=C(C1)C=C(C=C2Cl)Cl MCULE-2422991300 [0,1,0,1,0,0|2,0,0]=4 1718 B15R2.89396 NCC1COC2=C(C1)C=C(C=C2Cl)Cl MCULE-4106960183 [0,1,0,1,0,0|2,0,0]=4 1719 B15R2.1522 CC1=C(C=C(C=C1)O[C@@H]2CC[C@H]2O)C MCULE-2173038727 [0,1,0,1,0,0|2,0,0]=4 1720 B15R2.1524 CC1=CC(=CC=C1Cl)OCC2(CC2)N MCULE-2577219150 [0,1,0,1,0,0|2,0,0]=4 1721 B15R2.1524 CC1=CC(=CC=C1Cl)OCC2(CC2)N MCULE-9987714184 [0,1,0,1,0,0|2,0,0]=4 1722 B15R2.18973 CC1=CC(=CC=C1Cl)OCC2CNC2 MCULE-2740814299 [0,1,0,1,0,0|2,0,0]=4 1723 B15R2.18973 ClC1=CC=C(C=C1Cl)OCC2CNC2 MCULE-2263880495 [0,1,0,1,0,0|2,0,0]=4 1724 B11R1.20 C=C(C)CC1=CC=C(C=C1)Cl MCULE-3583070094 [1,0,0,0,1,0|1,0,1]=4 1725 B11R1.20 CC(=O)CC1=CC=C(C=C1)Cl MCULE-3336422329 [1,0,0,0,1,0|0,0,2]=4 1726 B11R1.20 CC(=O)OC1=CC=C(C=C1)Cl MCULE-3972290585 [1,0,0,0,1,0|0,0,2]=4 1727 B11R1.20 CC(Br)CC1=CC=C(C=C1)F MCULE-5767075798 [1,0,0,0,1,0|1,1,0]=4 1728 B11R1.20 CC(C)CC1=CC=C(C=C1)Br MCULE-6474794697 [1,0,0,0,1,0|1,1,0]=4 1729 B11R1.20 CC(C)CC1=CC=C(C=C1)I MCULE-7733530852 [1,0,0,0,1,0|1,1,0]=4 1730 B11R1.20 CC(C)CC1=CC=C(C=C1)N MCULE-8392779304 [1,0,0,0,1,0|2,0,0]=4 1731 B11R1.20 CC(C)CC1=CC=C(C=C1)O MCULE-1003651877 [1,0,0,0,1,0|2,0,0]=4 1732 B11R1.20 CC(C)CC1=CC=C(C=C1)S MCULE-5046005431 [1,0,0,0,1,0|2,0,0]=4 1733 B11R1.20 CC(C)NC1=CC=C(C=C1)Cl MCULE-8116434052 [1,0,0,0,1,0|2,0,0]=4 1734 B11R1.20 CC(C)NC1=CC=C(C=C1)Cl MCULE-9488331084 [1,0,0,0,1,0|2,0,0]=4 1735 B11R1.20 CC(C)OC1=CC=C(C=C1)Br MCULE-4033858452 [1,0,0,0,1,0|1,1,0]=4 1736 B11R1.20 CC(C)OC1=CC=C(C=C1)Cl MCULE-8793718513 [1,0,0,0,1,0|1,0,0]=3 1737 B11R1.20 CC(C)OC1=CC=C(C=C1)F MCULE-6353645336 [1,0,0,0,1,0|1,1,0]=4 1738 B11R1.20 CC(C)OC1=CC=C(C=C1)I MCULE-8470796835 [1,0,0,0,1,0|1,1,0]=4 1739 B11R1.20 CC(C)OC1=CC=C(C=C1)N MCULE-3830403628 [1,0,0,0,1,0|2,0,0]=4 1740 B11R1.20 CC(C)OC1=CC=C(C=C1)N MCULE-4817698079 [1,0,0,0,1,0|2,0,0]=4 1741 B11R1.20 CC(C)OC1=CC=C(C=C1)O MCULE-9294728154 [1,0,0,0,1,0|2,0,0]=4 1742 B11R1.20 CC(C)OC1=CC=C(C=C1)S MCULE-6517416549 [1,0,0,0,1,0|2,0,0]=4 1743 B11R1.20 CC(C)OC1=CN=C(C=C1)Cl MCULE-2703879556 [1,0,0,0,1,0|2,0,0]=4 1744 B11R1.20 CC(C)OC1=NC=C(C=C1)Cl MCULE-1294988107 [1,0,0,0,1,0|2,0,0]=4 1745 B11R1.20 CC(C)SC1=CC=C(C=C1)Cl MCULE-4676844874 [1,0,0,0,1,0|1,1,0]=4 1746 B11R1.20 CC(N)CC1=CC=C(C=C1)Br MCULE-1821396504 [1,0,0,0,1,0|1,1,0]=4 1747 B11R1.20 CC(N)CC1=CC=C(C=C1)Br MCULE-8532370360 [1,0,0,0,1,0|1,1,0]=4 1748 B11R1.20 CC(N)CC1=CC=C(C=C1)Cl MCULE-4831505160 [1,0,0,0,1,0|1,0,0]=3 1749 B11R1.20 CC(N)CC1=CC=C(C=C1)F MCULE-1499173383 [1,0,0,0,1,0|1,1,0]=4 1750 B11R1.20 CC(N)CC1=CC=C(C=C1)F MCULE-2595256128 [1,0,0,0,1,0|1,1,0]=4 1751 B11R1.20 CC(N)CC1=CC=C(C=C1)I MCULE-7628161989 [1,0,0,0,1,0|1,1,0]=4 1752 B11R1.20 CC(N)CC1=CC=C(C=C1)I MCULE-9566480731 [1,0,0,0,1,0|1,1,0]=4 1753 B11R1.20 CC(N)CC1=CC=C(C=C1)O MCULE-4953641356 [1,0,0,0,1,0|2,0,0]=4 1754 B11R1.20 CC(N)CC1=CC=C(C=C1)O MCULE-5369076520 [1,0,0,0,1,0|2,0,0]=4 1755 B11R1.20 CC(N)CC1=CC=C(C=C1)O MCULE-6999513658 [1,0,0,0,1,0|2,0,0]=4 1756 B11R1.20 CC(O)CC1=CC=C(C=C1)Br MCULE-1180789487 [1,0,0,0,1,0|0,1,0]=3 1757 B11R1.20 CC(O)CC1=CC=C(C=C1)Cl MCULE-4333771981 [1,0,0,0,1,0|0,0,0]=2 1758 B11R1.20 CC(O)CC1=CC=C(C=C1)F MCULE-6114218839 [1,0,0,0,1,0|0,1,0]=3 1759 B11R1.20 CC([NH3+])CC1=CC=C(C=C1)Cl MCULE-9246746921 [1,0,0,0,1,0|1,0,0]=3 1760 B11R1.20 CC1=CC=C(C=C1)CC(C)N MCULE-1379540216 [1,0,0,0,1,0|2,0,0]=4 1761 B11R1.20 CC1=CC=C(C=C1)CC(C)N MCULE-4225836452 [1,0,0,0,1,0|2,0,0]=4 1762 B11R1.20 CC1=CC=C(C=C1)CC(C)O MCULE-7671597907 [1,0,0,0,1,0|1,0,0]=3 1763 B11R1.20 CN(C)CC1=CC=C(C=C1)Cl MCULE-3716298394 [1,0,0,0,1,0|2,0,0]=4 1764 B11R1.20 C[C@@H](N)CC1=CC=C(C=C1)Cl MCULE-1701678757 [1,0,0,0,1,0|1,0,0]=3 1765 B11R1.20 C[C@@H](N)CC1=CC=C(C=C1)Cl MCULE-7328272720 [1,0,0,0,1,0|1,0,0]=3 1766 B11R1.20 C[C@@H](N)CC1=CC=C(C=C1)O MCULE-7136302958 [1,0,0,0,1,0|2,0,0]=4 1767 B11R1.20 C[C@H](N)CC1=CC=C(C=C1)Cl MCULE-1664668715 [1,0,0,0,1,0|1,0,0]=3 1768 B11R1.20 C[C@H](N)CC1=CC=C(C=C1)Cl MCULE-5595141767 [1,0,0,0,1,0|1,0,0]=3 1769 B11R1.20 FC(F)OC1=CC=C(C=C1)Cl MCULE-7701047511 [1,0,0,0,1,0|2,0,0]=4 1770 B11R1.20 O=C(O)CC1=CC=C(C=C1)Cl MCULE-1634058139 [1,0,0,0,1,0|0,0,2]=4 1771 B11R1.20 OB(O)CC1=CC=C(C=C1)Br MCULE-5929978710 [1,0,0,0,1,0|1,1,0]=4 1772 B11R1.20 OB(O)CC1=CC=C(C=C1)F MCULE-9217381598 [1,0,0,0,1,0|1,1,0]=4 1773 B11R1.40 C#CC(O)CC1=CC=CC=C1 MCULE-5471365855 [1,0,0,0,1,0|1,0,1]=4 1774 B11R1.40 C=CC(O)CC1=CC=CC=C1 MCULE-4950047988 [1,0,0,0,1,0|1,0,1]=4 1775 B11R1.40 CC(CBr)CC1=CC=CC=C1 MCULE-4183709831 [1,0,0,0,1,0|2,0,0]=4 1776 B11R1.40 CC(CBr)OC1=CC=CC=C1 MCULE-3750788786 [1,0,0,0,1,0|2,0,0]=4 1777 B11R1.40 CC(CN)CC1=CC=CC=C1 MCULE-2219040199 [1,0,0,0,1,0|2,0,0]=4 1778 B11R1.40 CC(CN)CC1=CC=CC=C1 MCULE-6132254567 [1,0,0,0,1,0|2,0,0]=4 1779 B11R1.40 CC(CN)OC1=CC=CC=C1 MCULE-4521046765 [1,0,0,0,1,0|2,0,0]=4 1780 B11R1.40 CC(CN)OC1=CC=CC=C1 MCULE-6704971218 [1,0,0,0,1,0|2,0,0]=4 1781 B11R1.40 CC(CO)CC1=CC=CC=C1 MCULE-8389530009 [1,0,0,0,1,0|1,0,0]=3 1782 B11R1.40 CC(CO)OC1=CC=CC=C1 MCULE-7340953143 [1,0,0,0,1,0|1,0,0]=3 1783 B11R1.40 CCC(N)CC1=CC=CC=C1 MCULE-4408189370 [1,0,0,0,1,0|2,0,0]=4 1784 B11R1.40 CCC(N)CC1=CC=CC=C1 MCULE-8389841254 [1,0,0,0,1,0|2,0,0]=4 1785 B11R1.40 CCC(O)CC1=CC=CC=C1 MCULE-9410904340 [1,0,0,0,1,0|1,0,0]=3 1786 B11R1.40 CCC(O)CC1=CC=NC=C1 MCULE-4049108899 [1,0,0,0,1,0|2,0,0]=4 1787 B11R1.40 CC[C@@H](N)CC1=CC=CC=C1 MCULE-6883353783 [1,0,0,0,1,0|2,0,0]=4 1788 B11R1.40 CC[C@@H](O)CC1=CC=CC=C1 MCULE-6039686982 [1,0,0,0,1,0|1,0,0]=3 1789 B11R1.40 CC[C@H](N)CC1=CC=CC=C1 MCULE-5487493156 [1,0,0,0,1,0|2,0,0]=4 1790 B11R1.40 CC[C@H](N)CC1=CC=CC=C1 MCULE-8206932127 [1,0,0,0,1,0|2,0,0]=4 1791 B11R1.40 CC[C@H](N)CC1=CC=CC=C1 MCULE-9330044470 [1,0,0,0,1,0|2,0,0]=4 1792 B11R1.40 CC[C@H](N)CC1=CC=CC=C1 MCULE-9714877499 [1,0,0,0,1,0|2,0,0]=4 1793 B11R1.40 CC[C@H](O)CC1=CC=CC=C1 MCULE-9060198343 [1,0,0,0,1,0|1,0,0]=3 1794 B11R1.40 C[C@@H](CO)OC1=CC=CC=C1 MCULE-1588923401 [1,0,0,0,1,0|1,0,0]=3 1795 B11R1.40 C[C@@H](CO)OC1=CC=CC=C1 MCULE-8379428041 [1,0,0,0,1,0|1,0,0]=3 1796 B11R1.40 C[C@H](CO)CC1=CC=CC=C1 MCULE-5756779797 [1,0,0,0,1,0|1,0,0]=3 1797 B11R1.40 N#CC(O)CC1=CC=CC=C1 MCULE-6524514443 [1,0,0,0,1,0|1,0,1]=4 1798 B11R1.40 NC(CF)CC1=CC=CC=C1 MCULE-5865639971 [1,0,0,0,1,0|2,0,0]=4 1799 B11R1.40 NC(CF)CC1=CC=CC=C1 MCULE-8584439965 [1,0,0,0,1,0|2,0,0]=4 1800 B11R1.40 NC(CO)CC1=CC=CC=C1 MCULE-1704866264 [1,0,0,0,1,0|1,0,0]=3 1801 B11R1.40 NC(CO)CC1=CC=CC=C1 MCULE-2871230838 [1,0,0,0,1,0|1,0,0]=3 1802 B11R1.40 NC(CO)CC1=CC=NC=C1 MCULE-7649552853 [1,0,0,0,1,0|2,0,0]=4 1803 B11R1.40 NC(CO)CC1=CC=NC=C1 MCULE-9792012975 [1,0,0,0,1,0|2,0,0]=4 1804 B11R1.40 NC(CO)CC1=CN=CC=C1 MCULE-5682317971 [1,0,0,0,1,0|2,0,0]=4 1805 B11R1.40 NC(CO)CC1=CN=CC=C1 MCULE-8457722347 [1,0,0,0,1,0|2,0,0]=4 1806 B11R1.40 NC(CO)CC1=NC=CC=C1 MCULE-3610486856 [1,0,0,0,1,0|2,0,0]=4 1807 B11R1.40 NC(CO)CC1=NC=CC=C1 MCULE-7359951740 [1,0,0,0,1,0|2,0,0]=4 1808 B11R1.40 NCC(N)CC1=CC=CC=C1 MCULE-6120031119 [1,0,0,0,1,0|2,0,0]=4 1809 B11R1.40 NCC(O)CC1=CC=CC=C1 MCULE-5893022997 [1,0,0,0,1,0|1,0,0]=3 1810 B11R1.40 NCC(O)CC1=CC=CC=C1 MCULE-8188701911 [1,0,0,0,1,0|1,0,0]=3 1811 B11R1.40 NCC(O)CC1=NC=CC=C1 MCULE-8818263792 [1,0,0,0,1,0|2,0,0]=4 1812 B11R1.40 NC[C@@H](O)CC1=CC=CC=C1 MCULE-6629560222 [1,0,0,0,1,0|1,0,0]=3 1813 B11R1.40 NC[C@H](N)CC1=CC=CC=C1 MCULE-7018694535 [1,0,0,0,1,0|2,0,0]=4 1814 B11R1.40 NC[C@H](O)CC1=CC=CC=C1 MCULE-6275870446 [1,0,0,0,1,0|1,0,0]=3 1815 B11R1.40 N[C@@H](CBr)CC1=CC=CC=C1 MCULE-6691709076 [1,0,0,0,1,0|2,0,0]=4 1816 B11R1.40 N[C@@H](CO)CC1=CC=CC=C1 MCULE-9689370748 [1,0,0,0,1,0|1,0,0]=3 1817 B11R1.40 N[C@H](CBr)CC1=CC=CC=C1 MCULE-3237009280 [1,0,0,0,1,0|2,0,0]=4 1818 B11R1.40 N[C@H](CF)CC1=CC=CC=C1 MCULE-1645277236 [1,0,0,0,1,0|2,0,0]=4 1819 B11R1.40 N[C@H](CF)CC1=CC=CC=C1 MCULE-7512919673 [1,0,0,0,1,0|2,0,0]=4 1820 B11R1.40 N[C@H](CO)CC1=CC=CC=C1 MCULE-9800128709 [1,0,0,0,1,0|1,0,0]=3 1821 B11R1.40 O=C(CO)CC1=CC=CC=C1 MCULE-7128053671 [1,0,0,0,1,0|0,0,2]=4 1822 B11R1.40 OC(CCl)CC1=CC=CC=C1 MCULE-2266876219 [1,0,0,0,1,0|1,0,0]=3 1823 B11R1.40 OCC(Br)CC1=CC=CC=C1 MCULE-1455915180 [1,0,0,0,1,0|1,0,0]=3 1824 B11R1.40 OCC(Br)CC1=CC=CC=C1 MCULE-7007031072 [1,0,0,0,1,0|1,0,0]=3 1825 B11R1.40 OCC(O)C[N+]1=CC=CC=C1 MCULE-4485815204 [1,0,0,0,1,0|1,0,0]=3 1826 B11R1.40 OCC(O)C[N+]1=CC=CC=C1 MCULE-5672695775 [1,0,0,0,1,0|1,0,0]=3 1827 B11R1.40 OC[C@@H](Br)CC1=CC=CC=C1 MCULE-2912004304 [1,0,0,0,1,0|1,0,0]=3 1828 B11R1.40 OC[C@@H](Br)CC1=CC=CC=C1 MCULE-8422697310 [1,0,0,0,1,0|1,0,0]=3 1829 B11R1.40 OC[C@@H](Cl)CC1=CC=CC=C1 MCULE-9299594460 [1,0,0,0,1,0|1,0,0]=3 1830 B11R1.40 OC[C@@H](O)CC1=CC=CC=C1 MCULE-2223584408 [1,0,0,0,1,0|0,0,0]=2 1831 B11R1.40 OC[C@H](O)CC1=CC=CC=C1 MCULE-1522424442 [1,0,0,0,1,0|0,0,0]=2 1832 B11R1.40 O[C@H](CCl)CC1=CC=CC=C1 MCULE-3948664845 [1,0,0,0,1,0|1,0,0]=3 1833 B11R1.40 [C@@H](N)(CO)CC1=CC=CC=C1 MCULE-6887535557 [1,0,0,0,1,0|1,0,0]=3 1834 B11R1.40 [C@@H](O)(CCl)CC1=CC=CC=C1 MCULE-3485278545 [1,0,0,0,1,0|1,0,0]=3 1835 B11R1.40 [C@H](N)(CO)CC1=CC=CC=C1 MCULE-5041919913 [1,0,0,0,1,0|1,0,0]=3 1836 B11R1.40 [C@H](O)(CCl)CC1=CC=CC=C1 MCULE-3312067753 [1,0,0,0,1,0|1,0,0]=3 1837 B11R1.39 CCC(O)CC1=CC=C(S1)Cl MCULE-6917815319 [0,0,0,0,2,0|2,0,0]=4 1838 B11R1.22 C#CC(O)C1=CC=C(C=C1)Cl MCULE-8566621485 [0,0,0,0,2,0|1,0,1]=4 1839 B11R1.22 C(O)(C#N)C1=CC=C(C=C1)Cl MCULE-3249751052 [0,0,0,0,2,0|1,0,1]=4 1840 B11R1.22 CC(CN)C1=CC=C(C=C1)Cl MCULE-2872371830 [0,0,0,0,2,0|2,0,0]=4 1841 B11R1.22 CC(CN)C1=CC=C(C=C1)Cl MCULE-5893871133 [0,0,0,0,2,0|2,0,0]=4 1842 B11R1.22 CC(CO)C1=CC=C(C=C1)Br MCULE-5482934983 [0,0,0,0,2,0|1,1,0]=4 1843 B11R1.22 CC(CO)C1=CC=C(C=C1)Cl MCULE-7438035732 [0,0,0,0,2,0|1,0,0]=3 1844 B11R1.22 CC(CO)C1=CC=C(C=C1)F MCULE-8692461269 [0,0,0,0,2,0|1,1,0]=4 1845 B11R1.22 CC1=CC=C(C=C1)C(C)CO MCULE-9992096124 [0,0,0,0,2,0|2,0,0]=4 1846 B11R1.22 CC1=CC=C(C=C1)C(F)CO MCULE-1191744452 [0,0,0,0,2,0|2,0,0]=4 1847 B11R1.22 CC1=CC=C(C=C1)C(N)CO MCULE-1946754706 [0,0,0,0,2,0|2,0,0]=4 1848 B11R1.22 CC1=CC=C(C=C1)C(N)CO MCULE-3159845585 [0,0,0,0,2,0|2,0,0]=4 1849 B11R1.22 CC1=CC=C(C=C1)C(N)CO MCULE-7183363379 [0,0,0,0,2,0|2,0,0]=4 1850 B11R1.22 CC1=CC=C(C=C1)C(N)CO MCULE-9556878386 [0,0,0,0,2,0|2,0,0]=4 1851 B11R1.22 CC1=CC=C(C=C1)C(O)CN MCULE-1290534822 [0,0,0,0,2,0|2,0,0]=4 1852 B11R1.22 CC1=CC=C(C=C1)C(O)CN MCULE-4494194170 [0,0,0,0,2,0|2,0,0]=4 1853 B11R1.22 CC1=CC=C(C=C1)C(O)CN MCULE-5148844099 [0,0,0,0,2,0|2,0,0]=4 1854 B11R1.22 CC1=CC=C(C=C1)C(O)CO MCULE-3896786841 [0,0,0,0,2,0|1,0,0]=3 1855 B11R1.22 CC1=CC=C(C=C1)[C@@H](N)CO MCULE-1155273807 [0,0,0,0,2,0|2,0,0]=4 1856 B11R1.22 CC1=CC=C(C=C1)[C@@H](N)CO MCULE-2115293916 [0,0,0,0,2,0|2,0,0]=4 1857 B11R1.22 CC1=CC=C(C=C1)[C@@H](N)CO MCULE-3191529597 [0,0,0,0,2,0|2,0,0]=4 1858 B11R1.22 CC1=CC=C(C=C1)[C@@H](N)CO MCULE-3605737139 [0,0,0,0,2,0|2,0,0]=4 1859 B11R1.22 CC1=CC=C(C=C1)[C@@H](O)CCl MCULE-4284502777 [0,0,0,0,2,0|2,0,0]=4 1860 B11R1.22 CC1=CC=C(C=C1)[C@H](N)CO MCULE-3194298951 [0,0,0,0,2,0|2,0,0]=4 1861 B11R1.22 CC1=CC=C(C=C1)[C@H](N)CO MCULE-3589664223 [0,0,0,0,2,0|2,0,0]=4 1862 B11R1.22 CC1=CC=C(C=C1)[C@H](N)CO MCULE-4142376289 [0,0,0,0,2,0|2,0,0]=4 1863 B11R1.22 CC1=CC=C(C=C1)[C@H](N)CO MCULE-8666186474 [0,0,0,0,2,0|2,0,0]=4 1864 B11R1.22 CC1=CC=C(C=C1)[C@H](O)CCl MCULE-5033791536 [0,0,0,0,2,0|2,0,0]=4 1865 B11R1.22 CCC(Br)C1=CC=C(C=C1)Cl MCULE-5395138704 [0,0,0,0,2,0|2,0,0]=4 1866 B11R1.22 CCC(N)C1=CC=C(C=C1)Cl MCULE-3866548319 [0,0,0,0,2,0|2,0,0]=4 1867 B11R1.22 CCC(N)C1=CC=C(C=C1)Cl MCULE-4327084551 [0,0,0,0,2,0|2,0,0]=4 1868 B11R1.22 CCC(N)C1=CC=C(C=C1)Cl MCULE-7924479664 [0,0,0,0,2,0|2,0,0]=4 1869 B11R1.22 CCC(N)C1=CC=C(C=C1)Cl MCULE-8408749104 [0,0,0,0,2,0|2,0,0]=4 1870 B11R1.22 CCC(O)C1=CC=C(C=C1)Br MCULE-3352562829 [0,0,0,0,2,0|1,1,0]=4 1871 B11R1.22 CCC(O)C1=CC=C(C=C1)C MCULE-9541048845 [0,0,0,0,2,0|2,0,0]=4 1872 B11R1.22 CCC(O)C1=CC=C(C=C1)Cl MCULE-4313694082 [0,0,0,0,2,0|1,0,0]=3 1873 B11R1.22 CCC(O)C1=CC=C(C=C1)F MCULE-8622199247 [0,0,0,0,2,0|1,1,0]=4 1874 B11R1.22 CCC(O)C1=CC=C(C=C1)I MCULE-1626345065 [0,0,0,0,2,0|1,1,0]=4 1875 B11R1.22 CCC(O)C1=CC=C(C=C1)N MCULE-4751560986 [0,0,0,0,2,0|2,0,0]=4 1876 B11R1.22 CCC(O)C1=CC=C(C=C1)O MCULE-2124505732 [0,0,0,0,2,0|2,0,0]=4 1877 B11R1.22 CC[C@@H](N)C1=CC=C(C=C1)Cl MCULE-2350275828 [0,0,0,0,2,0|2,0,0]=4 1878 B11R1.22 CC[C@@H](N)C1=CC=C(C=C1)Cl MCULE-4231449227 [0,0,0,0,2,0|2,0,0]=4 1879 B11R1.22 CC[C@@H](N)C1=CC=C(C=C1)Cl MCULE-4759686221 [0,0,0,0,2,0|2,0,0]=4 1880 B11R1.22 CC[C@@H](N)C1=CC=C(C=C1)Cl MCULE-8135459445 [0,0,0,0,2,0|2,0,0]=4 1881 B11R1.22 CC[C@@H](O)C1=CC=C(C=C1)Br MCULE-6792040422 [0,0,0,0,2,0|1,1,0]=4 1882 B11R1.22 CC[C@@H](O)C1=CC=C(C=C1)Cl MCULE-1057832219 [0,0,0,0,2,0|1,0,0]=3 1883 B11R1.22 CC[C@H](N)C1=CC=C(C=C1)Cl MCULE-3826143667 [0,0,0,0,2,0|2,0,0]=4 1884 B11R1.22 CC[C@H](N)C1=CC=C(C=C1)Cl MCULE-6925181484 [0,0,0,0,2,0|2,0,0]=4 1885 B11R1.22 CC[C@H](N)C1=CC=C(C=C1)Cl MCULE-7640387356 [0,0,0,0,2,0|2,0,0]=4 1886 B11R1.22 CC[C@H](N)C1=CC=C(C=C1)Cl MCULE-8608271868 [0,0,0,0,2,0|2,0,0]=4 1887 B11R1.22 CC[C@H](O)C1=CC=C(C=C1)Cl MCULE-7295058920 [0,0,0,0,2,0|1,0,0]=3 1888 B11R1.22 CC[C@H](O)C1=CC=C(C=C1)I MCULE-2391291244 [0,0,0,0,2,0|1,1,0]=4 1889 B11R1.22 ClC1=CC=C(C=C1)C(Br)CBr MCULE-8795979551 [0,0,0,0,2,0|2,0,0]=4 1890 B11R1.22 FC(CBr)C1=CC=C(C=C1)Cl MCULE-9628189709 [0,0,0,0,2,0|2,0,0]=4 1891 B11R1.22 N#C[C@H](O)C1=CC=C(C=C1)Cl MCULE-5481743733 [0,0,0,0,2,0|1,0,1]=4 1892 B11R1.22 NC(CO)C1=CC=C(C=C1)Br MCULE-1180935838 [0,0,0,0,2,0|1,1,0]=4 1893 B11R1.22 NC(CO)C1=CC=C(C=C1)Br MCULE-3831035035 [0,0,0,0,2,0|1,1,0]=4 1894 B11R1.22 NC(CO)C1=CC=C(C=C1)Br MCULE-5315704065 [0,0,0,0,2,0|1,1,0]=4 1895 B11R1.22 NC(CO)C1=CC=C(C=C1)Br MCULE-7174043630 [0,0,0,0,2,0|1,1,0]=4 1896 B11R1.22 NC(CO)C1=CC=C(C=C1)Br MCULE-8922132190 [0,0,0,0,2,0|1,1,0]=4 1897 B11R1.22 NC(CO)C1=CC=C(C=C1)Cl MCULE-1865281404 [0,0,0,0,2,0|1,0,0]=3 1898 B11R1.22 NC(CO)C1=CC=C(C=C1)Cl MCULE-3334382574 [0,0,0,0,2,0|1,0,0]=3 1899 B11R1.22 NC(CO)C1=CC=C(C=C1)Cl MCULE-7580638866 [0,0,0,0,2,0|1,0,0]=3 1900 B11R1.22 NC(CO)C1=CC=C(C=C1)Cl MCULE-9277721740 [0,0,0,0,2,0|1,0,0]=3 1901 B11R1.22 NC(CO)C1=CC=C(C=C1)Cl MCULE-9639936851 [0,0,0,0,2,0|1,0,0]=3 1902 B11R1.22 NC(CO)C1=CC=C(C=C1)F MCULE-3263794772 [0,0,0,0,2,0|1,1,0]=4 1903 B11R1.22 NC(CO)C1=CC=C(C=C1)F MCULE-3427377724 [0,0,0,0,2,0|1,1,0]=4 1904 B11R1.22 NC(CO)C1=CC=C(C=C1)F MCULE-4489993255 [0,0,0,0,2,0|1,1,0]=4 1905 B11R1.22 NC(CO)C1=CC=C(C=C1)F MCULE-7651782565 [0,0,0,0,2,0|1,1,0]=4 1906 B11R1.22 NC(CO)C1=CC=C(C=C1)I MCULE-2649703475 [0,0,0,0,2,0|1,1,0]=4 1907 B11R1.22 NC(CO)C1=CC=C(C=C1)I MCULE-4670727285 [0,0,0,0,2,0|1,1,0]=4 1908 B11R1.22 NC(CO)C1=CC=C(C=C1)O MCULE-2671818682 [0,0,0,0,2,0|2,0,0]=4 1909 B11R1.22 NC(CO)C1=CC=C(C=C1)O MCULE-3999975520 [0,0,0,0,2,0|2,0,0]=4 1910 B11R1.22 NC(CO)C1=CC=C(C=C1)O MCULE-7559572681 [0,0,0,0,2,0|2,0,0]=4 1911 B11R1.22 NC(CO)C1=CC=C(C=C1)O MCULE-7775306507 [0,0,0,0,2,0|2,0,0]=4 1912 B11R1.22 NC(CO)C1=CC=C(N=C1)Cl MCULE-3069907718 [0,0,0,0,2,0|2,0,0]=4 1913 B11R1.22 NC(CO)C1=CC=C(N=C1)Cl MCULE-3858714649 [0,0,0,0,2,0|2,0,0]=4 1914 B11R1.22 NC(CO)C1=CC=C(N=C1)Cl MCULE-5082520989 [0,0,0,0,2,0|2,0,0]=4 1915 B11R1.22 NC(CO)C1=CN=C(C=C1)Cl MCULE-4567290749 [0,0,0,0,2,0|2,0,0]=4 1916 B11R1.22 NC(CO)C1=CN=C(C=C1)Cl MCULE-6628486479 [0,0,0,0,2,0|2,0,0]=4 1917 B11R1.22 NCC(F)C1=CC=C(C=C1)Cl MCULE-2132666245 [0,0,0,0,2,0|2,0,0]=4 1918 B11R1.22 NCC(F)C1=CC=C(C=C1)Cl MCULE-5726168787 [0,0,0,0,2,0|2,0,0]=4 1919 B11R1.22 NCC(N)C1=CC=C(C=C1)Cl MCULE-2097151100 [0,0,0,0,2,0|2,0,0]=4 1920 B11R1.22 NCC(N)C1=CC=C(C=C1)Cl MCULE-5693559970 [0,0,0,0,2,0|2,0,0]=4 1921 B11R1.22 NCC(O)C1=CC=C(C=C1)Br MCULE-7092347030 [0,0,0,0,2,0|1,1,0]=4 1922 B11R1.22 NCC(O)C1=CC=C(C=C1)Br MCULE-8420725723 [0,0,0,0,2,0|1,1,0]=4 1923 B11R1.22 NCC(O)C1=CC=C(C=C1)Cl MCULE-9170757927 [0,0,0,0,2,0|1,0,0]=3 1924 B11R1.22 NCC(O)C1=CC=C(C=C1)Cl MCULE-9562967945 [0,0,0,0,2,0|1,0,0]=3 1925 B11R1.22 NCC(O)C1=CC=C(C=C1)F MCULE-2677671661 [0,0,0,0,2,0|1,1,0]=4 1926 B11R1.22 NCC(O)C1=CC=C(C=C1)F MCULE-3994485515 [0,0,0,0,2,0|1,1,0]=4 1927 B11R1.22 NCC(O)C1=CC=C(C=C1)O MCULE-3790818382 [0,0,0,0,2,0|2,0,0]=4 1928 B11R1.22 NCC(O)C1=CC=C(C=C1)O MCULE-8007176625 [0,0,0,0,2,0|2,0,0]=4 1929 B11R1.22 NC[C@@H](N)C1=CC=C(C=C1)Cl MCULE-2518581441 [0,0,0,0,2,0|2,0,0]=4 1930 B11R1.22 NC[C@@H](N)C1=CC=C(C=C1)Cl MCULE-4711102733 [0,0,0,0,2,0|2,0,0]=4 1931 B11R1.22 NC[C@@H](O)C1=CC=C(C=C1)Cl MCULE-8325203651 [0,0,0,0,2,0|1,0,0]=3 1932 B11R1.22 NC[C@@H](O)C1=CC=C(C=C1)Cl MCULE-9628212002 [0,0,0,0,2,0|1,0,0]=3 1933 B11R1.22 NC[C@@H](O)C1=CC=C(C=C1)F MCULE-5001707416 [0,0,0,0,2,0|1,1,0]=4 1934 B11R1.22 NC[C@@H](O)C1=CC=C(C=C1)F MCULE-7469352230 [0,0,0,0,2,0|1,1,0]=4 1935 B11R1.22 NC[C@H](N)C1=CC=C(C=C1)Cl MCULE-2146587721 [0,0,0,0,2,0|2,0,0]=4 1936 B11R1.22 NC[C@H](N)C1=CC=C(C=C1)Cl MCULE-4039030909 [0,0,0,0,2,0|2,0,0]=4 1937 B11R1.22 NC[C@H](O)C1=CC=C(C=C1)Cl MCULE-5473945164 [0,0,0,0,2,0|1,0,0]=3 1938 B11R1.22 NC[C@H](O)C1=CC=C(C=C1)Cl MCULE-9531028822 [0,0,0,0,2,0|1,0,0]=3 1939 B11R1.22 NC[C@H](O)C1=CC=C(C=C1)F MCULE-4605481079 [0,0,0,0,2,0|1,1,0]=4 1940 B11R1.22 NC[C@H](O)C1=CC=C(C=C1)F MCULE-9593040097 [0,0,0,0,2,0|1,1,0]=4 1941 B11R1.22 N[C@@H](CF)C1=CC=C(C=C1)Cl MCULE-2409003105 [0,0,0,0,2,0|2,0,0]=4 1942 B11R1.22 N[C@@H](CF)C1=CC=C(C=C1)Cl MCULE-2578638366 [0,0,0,0,2,0|2,0,0]=4 1943 B11R1.22 N[C@@H](CO)C1=CC=C(C=C1)Br MCULE-1140972293 [0,0,0,0,2,0|1,1,0]=4 1944 B11R1.22 N[C@@H](CO)C1=CC=C(C=C1)Br MCULE-1730813975 [0,0,0,0,2,0|1,1,0]=4 1945 B11R1.22 N[C@@H](CO)C1=CC=C(C=C1)Br MCULE-6570235311 [0,0,0,0,2,0|1,1,0]=4 1946 B11R1.22 N[C@@H](CO)C1=CC=C(C=C1)Br MCULE-7617129428 [0,0,0,0,2,0|1,1,0]=4 1947 B11R1.22 N[C@@H](CO)C1=CC=C(C=C1)Cl MCULE-4923829836 [0,0,0,0,2,0|1,0,0]=3 1948 B11R1.22 N[C@@H](CO)C1=CC=C(C=C1)Cl MCULE-5521160097 [0,0,0,0,2,0|1,0,0]=3 1949 B11R1.22 N[C@@H](CO)C1=CC=C(C=C1)Cl MCULE-8741329354 [0,0,0,0,2,0|1,0,0]=3 1950 B11R1.22 N[C@@H](CO)C1=CC=C(C=C1)Cl MCULE-9019160362 [0,0,0,0,2,0|1,0,0]=3 1951 B11R1.22 N[C@@H](CO)C1=CC=C(C=C1)F MCULE-1646526022 [0,0,0,0,2,0|1,1,0]=4 1952 B11R1.22 N[C@@H](CO)C1=CC=C(C=C1)F MCULE-1990536055 [0,0,0,0,2,0|1,1,0]=4 1953 B11R1.22 N[C@@H](CO)C1=CC=C(C=C1)F MCULE-9585306472 [0,0,0,0,2,0|1,1,0]=4 1954 B11R1.22 N[C@@H](CO)C1=CC=C(C=C1)F MCULE-9642523755 [0,0,0,0,2,0|1,1,0]=4 1955 B11R1.22 N[C@@H](CO)C1=CC=C(C=C1)I MCULE-6669962108 [0,0,0,0,2,0|1,1,0]=4 1956 B11R1.22 N[C@@H](CO)C1=CC=C(C=C1)I MCULE-9207635798 [0,0,0,0,2,0|1,1,0]=4 1957 B11R1.22 N[C@@H](CO)C1=CC=C(C=C1)O MCULE-1789539749 [0,0,0,0,2,0|2,0,0]=4 1958 B11R1.22 N[C@@H](CO)C1=CC=C(C=C1)O MCULE-1922558509 [0,0,0,0,2,0|2,0,0]=4 1959 B11R1.22 N[C@@H](CO)C1=CC=C(C=C1)O MCULE-4397689731 [0,0,0,0,2,0|2,0,0]=4 1960 B11R1.22 N[C@@H](CO)C1=CC=C(C=C1)O MCULE-7029018285 [0,0,0,0,2,0|2,0,0]=4 1961 B11R1.22 N[C@@H](CO)C1=CC=C(N=C1)Cl MCULE-2347793518 [0,0,0,0,2,0|2,0,0]=4 1962 B11R1.22 N[C@@H](CO)C1=CC=C(N=C1)Cl MCULE-2779622531 [0,0,0,0,2,0|2,0,0]=4 1963 B11R1.22 N[C@@H](CO)C1=CC=C(N=C1)Cl MCULE-4923090032 [0,0,0,0,2,0|2,0,0]=4 1964 B11R1.22 N[C@@H](CO)C1=CC=C(N=C1)Cl MCULE-4992366651 [0,0,0,0,2,0|2,0,0]=4 1965 B11R1.22 N[C@@H](CO)C1=CC=C(N=C1)Cl MCULE-8535921980 [0,0,0,0,2,0|2,0,0]=4 1966 B11R1.22 N[C@@H](CO)C1=CC=C(N=C1)Cl MCULE-8877692681 [0,0,0,0,2,0|2,0,0]=4 1967 B11R1.22 N[C@H](CF)C1=CC=C(C=C1)Cl MCULE-2766660729 [0,0,0,0,2,0|2,0,0]=4 1968 B11R1.22 N[C@H](CF)C1=CC=C(C=C1)Cl MCULE-9767779188 [0,0,0,0,2,0|2,0,0]=4 1969 B11R1.22 N[C@H](CO)C1=CC=C(C=C1)Br MCULE-3311013315 [0,0,0,0,2,0|1,1,0]=4 1970 B11R1.22 N[C@H](CO)C1=CC=C(C=C1)Br MCULE-4309065982 [0,0,0,0,2,0|1,1,0]=4 1971 B11R1.22 N[C@H](CO)C1=CC=C(C=C1)Br MCULE-4687867529 [0,0,0,0,2,0|1,1,0]=4 1972 B11R1.22 N[C@H](CO)C1=CC=C(C=C1)Br MCULE-8058199187 [0,0,0,0,2,0|1,1,0]=4 1973 B11R1.22 N[C@H](CO)C1=CC=C(C=C1)Cl MCULE-2512825708 [0,0,0,0,2,0|1,0,0]=3 1974 B11R1.22 N[C@H](CO)C1=CC=C(C=C1)Cl MCULE-6905811188 [0,0,0,0,2,0|1,0,0]=3 1975 B11R1.22 N[C@H](CO)C1=CC=C(C=C1)Cl MCULE-9497353748 [0,0,0,0,2,0|1,0,0]=3 1976 B11R1.22 N[C@H](CO)C1=CC=C(C=C1)Cl MCULE-9765608002 [0,0,0,0,2,0|1,0,0]=3 1977 B11R1.22 N[C@H](CO)C1=CC=C(C=C1)F MCULE-1556350625 [0,0,0,0,2,0|1,1,0]=4 1978 B11R1.22 N[C@H](CO)C1=CC=C(C=C1)F MCULE-5404991196 [0,0,0,0,2,0|1,1,0]=4 1979 B11R1.22 N[C@H](CO)C1=CC=C(C=C1)F MCULE-5813589322 [0,0,0,0,2,0|1,1,0]=4 1980 B11R1.22 N[C@H](CO)C1=CC=C(C=C1)F MCULE-7166090644 [0,0,0,0,2,0|1,1,0]=4 1981 B11R1.22 N[C@H](CO)C1=CC=C(C=C1)I MCULE-3609180786 [0,0,0,0,2,0|1,1,0]=4 1982 B11R1.22 N[C@H](CO)C1=CC=C(C=C1)I MCULE-3773461754 [0,0,0,0,2,0|1,1,0]=4 1983 B11R1.22 N[C@H](CO)C1=CC=C(C=C1)I MCULE-4566579574 [0,0,0,0,2,0|1,1,0]=4 1984 B11R1.22 N[C@H](CO)C1=CC=C(C=C1)I MCULE-9505811936 [0,0,0,0,2,0|1,1,0]=4 1985 B11R1.22 N[C@H](CO)C1=CC=C(C=C1)O MCULE-2171036946 [0,0,0,0,2,0|2,0,0]=4 1986 B11R1.22 N[C@H](CO)C1=CC=C(C=C1)O MCULE-5617842512 [0,0,0,0,2,0|2,0,0]=4 1987 B11R1.22 N[C@H](CO)C1=CC=C(C=C1)O MCULE-6741169360 [0,0,0,0,2,0|2,0,0]=4 1988 B11R1.22 N[C@H](CO)C1=CC=C(C=C1)O MCULE-7899474411 [0,0,0,0,2,0|2,0,0]=4 1989 B11R1.22 N[C@H](CO)C1=CC=C(N=C1)Cl MCULE-6141413555 [0,0,0,0,2,0|2,0,0]=4 1990 B11R1.22 N[C@H](CO)C1=CC=C(N=C1)Cl MCULE-6814308774 [0,0,0,0,2,0|2,0,0]=4 1991 B11R1.22 O=C(CO)C1=CC=C(C=C1)Cl MCULE-4166338180 [0,0,0,0,2,0|0,0,2]=4 1992 B11R1.22 OC(CBr)C1=CC=C(C=C1)Br MCULE-7971514574 [0,0,0,0,2,0|1,1,0]=4 1993 B11R1.22 OC(CBr)C1=CC=C(C=C1)F MCULE-3235298741 [0,0,0,0,2,0|1,1,0]=4 1994 B11R1.22 OC(CCl)C1=CC=C(C=C1)Br MCULE-7327234645 [0,0,0,0,2,0|1,1,0]=4 1995 B11R1.22 OC(CCl)C1=CC=C(C=C1)Cl MCULE-7959108725 [0,0,0,0,2,0|1,0,0]=3 1996 B11R1.22 OC(CCl)C1=CC=C(C=C1)F MCULE-8932968221 [0,0,0,0,2,0|1,1,0]=4 1997 B11R1.22 OC(CF)C1=CC=C(C=C1)Br MCULE-5200939492 [0,0,0,0,2,0|1,1,0]=4 1998 B11R1.22 OC(CF)C1=CC=C(C=C1)F MCULE-8061462242 [0,0,0,0,2,0|1,1,0]=4 1999 B11R1.22 OCC(Cl)C1=CC=C(C=C1)Cl MCULE-4716164565 [0,0,0,0,2,0|1,0,0]=3 2000 B11R1.22 OCC(F)C1=CC=C(C=C1)Br MCULE-8427054332 [0,0,0,0,2,0|1,1,0]=4 2001 B11R1.22 OCC(F)C1=CC=C(C=C1)Cl MCULE-5082215470 [0,0,0,0,2,0|1,0,0]=3 2002 B11R1.22 OCC(O)C1=CC=C(C=C1)Br MCULE-1838702415 [0,0,0,0,2,0|0,1,0]=3 2003 B11R1.22 OCC(O)C1=CC=C(C=C1)Cl MCULE-9965486722 [0,0,0,0,2,0|0,0,0]=2 2004 B11R1.22 OCC(O)C1=CC=C(C=C1)F MCULE-9323974891 [0,0,0,0,2,0|0,1,0]=3 2005 B11R1.22 OC[C@@H](O)C1=CC=C(C=C1)Br MCULE-9166251018 [0,0,0,0,2,0|0,1,0]=3 2006 B11R1.22 OC[C@H](O)C1=CC=C(C=C1)Br MCULE-5206029816 [0,0,0,0,2,0|0,1,0]=3 2007 B11R1.22 OC[C@H](O)C1=CC=C(C=C1)Cl MCULE-1294606414 [0,0,0,0,2,0|0,0,0]=2 2008 B11R1.22 OC[C@H](O)C1=CC=C(C=C1)Cl MCULE-5963009920 [0,0,0,0,2,0|0,0,0]=2 2009 B11R1.22 O[C@@H](CBr)C1=CC=C(C=C1)Br MCULE-9173075299 [0,0,0,0,2,0|1,1,0]=4 2010 B11R1.22 O[C@@H](CBr)C1=CC=C(C=C1)F MCULE-1209536621 [0,0,0,0,2,0|1,1,0]=4 2011 B11R1.22 O[C@@H](CCl)C1=CC=C(C=C1)Cl MCULE-8697297376 [0,0,0,0,2,0|1,0,0]=3 2012 B11R1.22 O[C@@H](CCl)C1=CC=C(C=C1)F MCULE-3421380864 [0,0,0,0,2,0|1,1,0]=4 2013 B11R1.22 O[C@@H](CCl)C1=CC=C(C=C1)F MCULE-6947997266 [0,0,0,0,2,0|1,1,0]=4 2014 B11R1.22 O[C@H](CCl)C1=CC=C(C=C1)Br MCULE-3762091710 [0,0,0,0,2,0|1,1,0]=4 2015 B11R1.22 O[C@H](CCl)C1=CC=C(C=C1)Cl MCULE-3463991244 [0,0,0,0,2,0|1,0,0]=3 2016 B11R1.22 O[C@H](CCl)C1=CC=C(C=C1)F MCULE-1013498263 [0,0,0,0,2,0|1,1,0]=4 2017 B11R1.22 O[C@H](CCl)C1=CC=C(C=C1)F MCULE-8094998394 [0,0,0,0,2,0|1,1,0]=4 2018 B11R1.22 [C@H](O)(CBr)C1=CC=C(C=C1)Br MCULE-9790552004 [0,0,0,0,2,0|1,1,0]=4 2019 B11R1.22 [C@H](O)(CN)C1=CC=C(C=C1)O MCULE-4258530622 [0,0,0,0,2,0|2,0,0]=4 2020 B11R1.22 [C@H](O)(CN)C1=CC=C(C=C1)O MCULE-5565560740 [0,0,0,0,2,0|2,0,0]=4 2021 B13R1.718 C=C(CO)COCC1=CC=CC=C1 MCULE-6874672586 [1,0,0,0,0,1|1,0,1]=4 2022 B13R1.718 CC(CBr)COCC1=CC=CC=C1 MCULE-9857070830 [1,0,0,0,0,1|2,0,0]=4 2023 B13R1.718 CC(CN)COCC1=CC=CC=C1 MCULE-2203724625 [1,0,0,0,0,1|2,0,0]=4 2024 B13R1.718 CC(CN)COCC1=CC=CC=C1 MCULE-8037714818 [1,0,0,0,0,1|2,0,0]=4 2025 B13R1.718 CC(CO)CNCC1=CC=CC=C1 MCULE-1954928665 [1,0,0,0,0,1|2,0,0]=4 2026 B13R1.718 CC(CO)CNCC1=CC=CC=C1 MCULE-5551493458 [1,0,0,0,0,1|2,0,0]=4 2027 B13R1.718 CC(CO)COCC1=CC=CC=C1 MCULE-3688919678 [1,0,0,0,0,1|1,0,0]=3 2028 B13R1.718 CC(CO)OCCC1=CC=CC=C1 MCULE-4103630925 [1,0,0,0,0,1|2,0,0]=4 2029 B13R1.718 CCC(O)CNCC1=CC=CC=C1 MCULE-8400239306 [1,0,0,0,0,1|2,0,0]=4 2030 B13R1.718 CC[C@@H](N)COCC1=CC=CC=C1 MCULE-9921880331 [1,0,0,0,0,1|2,0,0]=4 2031 B13R1.718 CC[C@H](O)CNCC1=CC=CC=C1 MCULE-2661689023 [1,0,0,0,0,1|2,0,0]=4 2032 B13R1.718 C[C@@H](CO)COCC1=CC=CC=C1 MCULE-7372208185 [1,0,0,0,0,1|1,0,0]=3 2033 B13R1.718 NC(CO)COCC1=CC=CC=C1 MCULE-2803237620 [1,0,0,0,0,1|1,0,0]=3 2034 B13R1.718 NC(CO)COCC1=CC=CC=C1 MCULE-3193499540 [1,0,0,0,0,1|1,0,0]=3 2035 B13R1.718 NC(CO)COCC1=CC=CC=C1 MCULE-5895593275 [1,0,0,0,0,1|1,0,0]=3 2036 B13R1.718 NC(CO)COCC1=CC=CC=C1 MCULE-6971171448 [1,0,0,0,0,1|1,0,0]=3 2037 B13R1.718 NC(CO)CSCC1=CC=CC=C1 MCULE-8286161818 [1,0,0,0,0,1|1,1,0]=4 2038 B13R1.718 NCC(O)CNCC1=CC=CC=C1 MCULE-4614747674 [1,0,0,0,0,1|2,0,0]=4 2039 B13R1.718 NCC(O)CNCC1=CC=CC=C1 MCULE-9018488842 [1,0,0,0,0,1|2,0,0]=4 2040 B13R1.718 NCC(O)COCC1=CC=CC=C1 MCULE-4289107199 [1,0,0,0,0,1|1,0,0]=3 2041 B13R1.718 NCC(O)COCC1=CC=CC=C1 MCULE-6734924521 [1,0,0,0,0,1|1,0,0]=3 2042 B13R1.718 N[C@@H](CO)COCC1=CC=CC=C1 MCULE-1028373926 [1,0,0,0,0,1|1,0,0]=3 2043 B13R1.718 N[C@@H](CO)COCC1=CC=CC=C1 MCULE-1504558815 [1,0,0,0,0,1|1,0,0]=3 2044 B13R1.718 N[C@@H](CO)COCC1=CC=CC=C1 MCULE-2354785896 [1,0,0,0,0,1|1,0,0]=3 2045 B13R1.718 N[C@@H](CO)COCC1=CC=CC=C1 MCULE-5268844709 [1,0,0,0,0,1|1,0,0]=3 2046 B13R1.718 N[C@H](CO)COCC1=CC=CC=C1 MCULE-1722252406 [1,0,0,0,0,1|1,0,0]=3 2047 B13R1.718 N[C@H](CO)COCC1=CC=CC=C1 MCULE-4822217417 [1,0,0,0,0,1|1,0,0]=3 2048 B13R1.718 N[C@H](CO)COCC1=CC=CC=C1 MCULE-7066692485 [1,0,0,0,0,1|1,0,0]=3 2049 B13R1.718 N[C@H](CO)COCC1=CC=CC=C1 MCULE-9256707330 [1,0,0,0,0,1|1,0,0]=3 2050 B13R1.718 N[C@H](CO)CSCC1=CC=CC=C1 MCULE-5136442507 [1,0,0,0,0,1|1,1,0]=4 2051 B13R1.718 N[C@H](CO)CSCC1=CC=CC=C1 MCULE-6068483138 [1,0,0,0,0,1|1,1,0]=4 2052 B13R1.718 OC(CBr)COCC1=CC=CC=C1 MCULE-3391247544 [1,0,0,0,0,1|1,0,0]=3 2053 B13R1.718 OC(CCl)CNCC1=CC=CC=C1 MCULE-4752952960 [1,0,0,0,0,1|2,0,0]=4 2054 B13R1.718 OC(CCl)CNCC1=CC=CC=C1 MCULE-5187653048 [1,0,0,0,0,1|2,0,0]=4 2055 B13R1.718 OC(CCl)COCC1=CC=CC=C1 MCULE-7001751592 [1,0,0,0,0,1|1,0,0]=3 2056 B13R1.718 OCC(O)COCC1=CC=CC=C1 MCULE-7971287311 [1,0,0,0,0,1|0,0,0]=2 2057 B13R1.718 OC[C@@H](O)COCC1=CC=CC=C1 MCULE-7194781091 [1,0,0,0,0,1|0,0,0]=2 2058 B13R1.718 OC[C@@H](O)COCC1=CC=CC=C1 MCULE-8614581579 [1,0,0,0,0,1|0,0,0]=2 2059 B13R1.718 OC[C@H](O)COCC1=CC=CC=C1 MCULE-5957161309 [1,0,0,0,0,1|0,0,0]=2 2060 B13R1.718 OC[C@H](O)COCC1=CC=CC=C1 MCULE-7257670474 [1,0,0,0,0,1|0,0,0]=2 2061 B13R1.718 O[C@@H](CCl)CNCC1=CC=CC=C1 MCULE-8385555853 [1,0,0,0,0,1|2,0,0]=4 2062 B13R1.718 O[C@H](CCl)CNCC1=CC=CC=C1 MCULE-4699991790 [1,0,0,0,0,1|2,0,0]=4 2063 B13R1.718 [C@H](N)(CO)CSCC1=CC=CC=C1 MCULE-6715083466 [1,0,0,0,0,1|1,1,0]=4