0 B12R1.21 C(=CC1=CC=C(C=C1)I)C(=O)N MCULE-4953492668 [0,0,0,0,0,0|2,0,2]=4 1 B12R1.21 C=C(Br)CCC1=CC=C(C=C1)Br MCULE-3828666859 [0,0,0,0,0,0|3,0,0]=3 2 B12R1.21 C=C(Br)CCC1=CC=C(C=C1)C MCULE-9924953206 [0,0,0,0,0,0|3,0,0]=3 3 B12R1.21 C=C(Br)CCC1=CC=C(C=C1)Cl MCULE-8957472944 [0,0,0,0,0,0|3,0,0]=3 4 B12R1.21 C=C(Br)CCC1=CC=C(C=C1)F MCULE-3337987862 [0,0,0,0,0,0|3,0,0]=3 5 B12R1.21 C=C(Br)CCC1=CN=C(C=C1)Cl MCULE-3918121367 [0,0,0,0,0,0|4,0,0]=4 6 B12R1.21 C=C(C)CCC1=CC=C(C=C1)Br MCULE-7467911388 [0,0,0,0,0,0|3,0,0]=3 7 B12R1.21 C=C(C)CCC1=CC=C(C=C1)C MCULE-6311902974 [0,0,0,0,0,0|3,0,0]=3 8 B12R1.21 C=C(C)CCC1=CC=C(C=C1)Cl MCULE-4308113169 [0,0,0,0,0,0|3,0,0]=3 9 B12R1.21 C=C(C)CCC1=CC=C(C=C1)F MCULE-9034249023 [0,0,0,0,0,0|3,0,0]=3 10 B12R1.21 C=C(C)CCC1=CN=C(C=C1)Cl MCULE-6816153223 [0,0,0,0,0,0|4,0,0]=4 11 B12R1.21 C=C(C)CNC1=CC=C(C=C1)Cl MCULE-6192235728 [0,0,0,0,0,0|4,0,0]=4 12 B12R1.21 C=C(C)COC1=CC=C(C=C1)F MCULE-6325581603 [0,0,0,0,0,0|4,0,0]=4 13 B12R1.21 C=C(C)COC1=CC=C(C=C1)N MCULE-7033178988 [0,0,0,0,0,0|3,0,0]=3 14 B12R1.21 C=C(C)COC1=CC=C(C=C1)N MCULE-7232037248 [0,0,0,0,0,0|3,0,0]=3 15 B12R1.21 C=C(Cl)CCC1=CC=C(C=C1)Br MCULE-4927878258 [0,0,0,0,0,0|3,0,0]=3 16 B12R1.21 C=C(Cl)CCC1=CC=C(C=C1)C MCULE-4649676380 [0,0,0,0,0,0|3,0,0]=3 17 B12R1.21 C=C(Cl)CCC1=CC=C(C=C1)Cl MCULE-8589046256 [0,0,0,0,0,0|3,0,0]=3 18 B12R1.21 C=C(Cl)CCC1=CC=C(C=C1)F MCULE-6955659857 [0,0,0,0,0,0|3,0,0]=3 19 B12R1.21 C=C(Cl)CCC1=CN=C(C=C1)Cl MCULE-1962532519 [0,0,0,0,0,0|4,0,0]=4 20 B12R1.21 CC(=O)/C=C/C1=CC=C(C=C1)Br MCULE-4968966219 [0,0,0,0,0,0|2,0,2]=4 21 B12R1.21 CC(=O)/C=C/C1=CC=C(C=C1)C MCULE-1850770058 [0,0,0,0,0,0|2,0,2]=4 22 B12R1.21 CC(=O)/C=C/C1=CC=C(C=C1)Cl MCULE-8042406157 [0,0,0,0,0,0|2,0,2]=4 23 B12R1.21 CC(=O)/C=C/C1=CC=C(C=C1)F MCULE-1896531163 [0,0,0,0,0,0|2,0,2]=4 24 B12R1.21 CC(=O)/C=C/C1=CC=C(C=C1)O MCULE-3022611575 [0,0,0,0,0,0|2,0,2]=4 25 B12R1.21 CC(=O)C=CC1=CC=C(C=C1)Br MCULE-9469464573 [0,0,0,0,0,0|2,0,2]=4 26 B12R1.21 CC(=O)C=CC1=CC=C(C=C1)C MCULE-3065183970 [0,0,0,0,0,0|2,0,2]=4 27 B12R1.21 CC(=O)C=CC1=CC=C(C=C1)Cl MCULE-4900585766 [0,0,0,0,0,0|2,0,2]=4 28 B12R1.21 CC(=O)C=CC1=CC=C(C=C1)F MCULE-6872409442 [0,0,0,0,0,0|2,0,2]=4 29 B12R1.21 CC(=O)C=CC1=CC=C(C=C1)O MCULE-9722577866 [0,0,0,0,0,0|2,0,2]=4 30 B12R1.21 CC(=O)CCC1=CC=C(C=C1)Br MCULE-5032630211 [0,0,0,0,0,0|2,0,0]=2 31 B12R1.21 CC(=O)CCC1=CC=C(C=C1)C MCULE-3886403881 [0,0,0,0,0,0|2,0,0]=2 32 B12R1.21 CC(=O)CCC1=CC=C(C=C1)Cl MCULE-7275025982 [0,0,0,0,0,0|2,0,0]=2 33 B12R1.21 CC(=O)CCC1=CC=C(C=C1)F MCULE-4146230731 [0,0,0,0,0,0|2,0,0]=2 34 B12R1.21 CC(=O)CCC1=CC=C(C=C1)I MCULE-4528069890 [0,0,0,0,0,0|2,0,0]=2 35 B12R1.21 CC(=O)CCC1=CC=C(C=C1)O MCULE-8771951405 [0,0,0,0,0,0|2,0,0]=2 36 B12R1.21 CC(=O)COC1=CC=C(C=C1)Br MCULE-9922743680 [0,0,0,0,0,0|3,0,0]=3 37 B12R1.21 CC(=O)COC1=CC=C(C=C1)Cl MCULE-9629148904 [0,0,0,0,0,0|3,0,0]=3 38 B12R1.21 CC(=O)CSC1=CC=C(C=C1)Br MCULE-5454210139 [0,0,0,0,0,0|3,0,0]=3 39 B12R1.21 CC(=O)CSC1=CC=C(C=C1)C MCULE-1652837095 [0,0,0,0,0,0|3,0,0]=3 40 B12R1.21 CC(=O)CSC1=CC=C(C=C1)Cl MCULE-4086873829 [0,0,0,0,0,0|3,0,0]=3 41 B12R1.21 CC(=O)CSC1=CC=C(C=C1)F MCULE-4598491505 [0,0,0,0,0,0|3,0,0]=3 42 B12R1.21 CC(=O)NCC1=CC=C(C=C1)Br MCULE-5123042587 [0,0,0,0,0,0|3,0,0]=3 43 B12R1.21 CC(=O)NCC1=CC=C(C=C1)C MCULE-9377579573 [0,0,0,0,0,0|3,0,0]=3 44 B12R1.21 CC(=O)NCC1=CC=C(C=C1)Cl MCULE-5148797746 [0,0,0,0,0,0|3,0,0]=3 45 B12R1.21 CC(=O)NCC1=CC=C(C=C1)F MCULE-8735224434 [0,0,0,0,0,0|3,0,0]=3 46 B12R1.21 CC(=O)NCC1=CC=C(C=C1)N MCULE-4826421840 [0,0,0,0,0,0|2,0,0]=2 47 B12R1.21 CC(=O)NCC1=CC=C(C=C1)O MCULE-3038555782 [0,0,0,0,0,0|3,0,0]=3 48 B12R1.21 CC(=O)NCC1=CC=C(N=C1)Cl MCULE-8342752677 [0,0,0,0,0,0|4,0,0]=4 49 B12R1.21 CC(=O)NCC1=NC=C(C=C1)N MCULE-7995818685 [0,0,0,0,0,0|3,0,0]=3 50 B12R1.21 CC(=O)NNC1=CC=C(C=C1)Br MCULE-3443315726 [0,0,0,0,0,0|4,0,0]=4 51 B12R1.21 CC(=O)NNC1=CC=C(C=C1)C MCULE-4404294470 [0,0,0,0,0,0|4,0,0]=4 52 B12R1.21 CC(=O)OCC1=CC=C(C=C1)C MCULE-5313364173 [0,0,0,0,0,0|3,0,0]=3 53 B12R1.21 CC(=O)OCC1=CC=C(C=C1)Cl MCULE-3654865604 [0,0,0,0,0,0|3,0,0]=3 54 B12R1.21 CC(=O)OCC1=CN=C(C=C1)Cl MCULE-8909836731 [0,0,0,0,0,0|4,0,0]=4 55 B12R1.21 CC(C)CCC1=CC=C(C=C1)N MCULE-9020886448 [0,0,0,0,0,0|2,0,1]=3 56 B12R1.21 CC(C)CCC1=CN=C(C=C1)N MCULE-3587176655 [0,0,0,0,0,0|3,0,1]=4 57 B12R1.21 CC(C)COC1=CC=C(C=C1)N MCULE-5788731882 [0,0,0,0,0,0|3,0,1]=4 58 B12R1.21 CC(C)COC1=CC=C(C=C1)N MCULE-8407409314 [0,0,0,0,0,0|3,0,1]=4 59 B12R1.21 CC(C)NCC1=CC=C(C=C1)N MCULE-2440954262 [0,0,0,0,0,0|3,0,1]=4 60 B12R1.21 CC(C)OCC1=CC=C(C=C1)N MCULE-5870479607 [0,0,0,0,0,0|3,0,1]=4 61 B12R1.21 CC(N)CCC1=CC=C(C=C1)Br MCULE-6111482459 [0,0,0,0,0,0|3,0,1]=4 62 B12R1.21 CC(N)CCC1=CC=C(C=C1)Br MCULE-6433808249 [0,0,0,0,0,0|3,0,1]=4 63 B12R1.21 CC(N)CCC1=CC=C(C=C1)Cl MCULE-4427273513 [0,0,0,0,0,0|3,0,1]=4 64 B12R1.21 CC(N)CCC1=CC=C(C=C1)F MCULE-4904835077 [0,0,0,0,0,0|3,0,1]=4 65 B12R1.21 CC(N)CCC1=CC=C(C=C1)I MCULE-1882757411 [0,0,0,0,0,0|3,0,1]=4 66 B12R1.21 CC(N)CCC1=CC=C(C=C1)I MCULE-6640289781 [0,0,0,0,0,0|3,0,1]=4 67 B12R1.21 CC(N)CCC1=CC=C(C=C1)O MCULE-4220057160 [0,0,0,0,0,0|3,0,1]=4 68 B12R1.21 CC(O)CCC1=CC=C(C=C1)Br MCULE-2162811740 [0,0,0,0,0,0|2,0,1]=3 69 B12R1.21 CC(O)CCC1=CC=C(C=C1)Cl MCULE-6029302606 [0,0,0,0,0,0|2,0,1]=3 70 B12R1.21 CC(O)CCC1=CC=C(C=C1)O MCULE-1743643873 [0,0,0,0,0,0|2,0,1]=3 71 B12R1.21 CC(O)COC1=CC=C(C=C1)Cl MCULE-1438026372 [0,0,0,0,0,0|3,0,1]=4 72 B12R1.21 CC(O)CSC1=CC=C(C=C1)Cl MCULE-4992180169 [0,0,0,0,0,0|3,0,1]=4 73 B12R1.21 CC1=CC=C(C=C1)/C=C/C(=O)Cl MCULE-2058495596 [0,0,0,0,0,0|2,0,2]=4 74 B12R1.21 CC1=CC=C(C=C1)/C=C/C(=O)O MCULE-4218057596 [0,0,0,0,0,0|1,0,2]=3 75 B12R1.21 CC1=CC=C(C=C1)C#CC(=O)O MCULE-1939935257 [0,0,0,0,0,0|1,0,2]=3 76 B12R1.21 CC1=CC=C(C=C1)C=CC(=O)Cl MCULE-5021343987 [0,0,0,0,0,0|2,0,2]=4 77 B12R1.21 CC1=CC=C(C=C1)C=CC(=O)N MCULE-5979163187 [0,0,0,0,0,0|2,0,2]=4 78 B12R1.21 CC1=CC=C(C=C1)C=CC(=O)O MCULE-7310353888 [0,0,0,0,0,0|1,0,2]=3 79 B12R1.21 CC1=CC=C(C=C1)CCC(=O)Cl MCULE-3838448821 [0,0,0,0,0,0|2,0,0]=2 80 B12R1.21 CC1=CC=C(C=C1)CCC(=O)N MCULE-1037276919 [0,0,0,0,0,0|2,0,0]=2 81 B12R1.21 CC1=CC=C(C=C1)CCC(=O)O MCULE-3130199239 [0,0,0,0,0,0|1,0,0]=1 82 B12R1.21 CC1=CC=C(C=C1)CCC(C)N MCULE-9545862036 [0,0,0,0,0,0|3,0,1]=4 83 B12R1.21 CC1=CC=C(C=C1)CNC(=O)N MCULE-2888234935 [0,0,0,0,0,0|3,0,0]=3 84 B12R1.21 CC1=CC=C(C=C1)CNC(=S)N MCULE-8038050726 [0,0,0,0,0,0|3,1,0]=4 85 B12R1.21 CC1=CC=C(C=C1)CSC(=N)N MCULE-8304649618 [0,0,0,0,0,0|4,0,0]=4 86 B12R1.21 CC1=CC=C(C=C1)CSC(=N)N MCULE-8763161066 [0,0,0,0,0,0|4,0,0]=4 87 B12R1.21 CC1=CC=C(C=C1)CSC(=[NH2+])N MCULE-5465043884 [0,0,0,0,0,0|4,0,0]=4 88 B12R1.21 CC1=CC=C(C=C1)NCC(=O)N MCULE-4351578656 [0,0,0,0,0,0|3,0,0]=3 89 B12R1.21 CC1=CC=C(C=C1)NCC(=O)O MCULE-3209745558 [0,0,0,0,0,0|2,0,0]=2 90 B12R1.21 CC1=CC=C(C=C1)OCC(=N)N MCULE-6337515307 [0,0,0,0,0,0|4,0,0]=4 91 B12R1.21 CC1=CC=C(C=C1)OCC(=N)N MCULE-8064545670 [0,0,0,0,0,0|4,0,0]=4 92 B12R1.21 CC1=CC=C(C=C1)OCC(=O)Cl MCULE-2076647902 [0,0,0,0,0,0|3,0,0]=3 93 B12R1.21 CC1=CC=C(C=C1)OCC(=O)N MCULE-4521305241 [0,0,0,0,0,0|3,0,0]=3 94 B12R1.21 CC1=CC=C(C=C1)OCC(=O)O MCULE-6655773819 [0,0,0,0,0,0|2,0,0]=2 95 B12R1.21 CC1=CC=C(C=C1)OCC(=S)N MCULE-3224112009 [0,0,0,0,0,0|3,1,0]=4 96 B12R1.21 CC1=CC=C(C=C1)OCC(C)O MCULE-6186322684 [0,0,0,0,0,0|3,0,1]=4 97 B12R1.21 CC1=CC=C(C=C1)SCC(=N)N MCULE-1626982593 [0,0,0,0,0,0|4,0,0]=4 98 B12R1.21 CC1=CC=C(C=C1)SCC(=N)N MCULE-6998884993 [0,0,0,0,0,0|4,0,0]=4 99 B12R1.21 CC1=CC=C(C=C1)SCC(=O)O MCULE-6165213613 [0,0,0,0,0,0|2,0,0]=2 100 B12R1.21 CC1=CC=C(C=N1)CCC(=O)O MCULE-2456319798 [0,0,0,0,0,0|2,0,0]=2 101 B12R1.21 CC1=CC=C(N=N1)OCC(=O)O MCULE-5673154114 [0,0,0,0,0,0|4,0,0]=4 102 B12R1.21 CC1=CC=[N+](C=C1)CCC(=O)O MCULE-7103855112 [0,0,0,0,0,0|2,0,0]=2 103 B12R1.21 CC1=CC=[N+](C=C1)CCC(=O)O MCULE-8465932154 [0,0,0,0,0,0|2,0,0]=2 104 B12R1.21 CC1=CN=C(C=C1)CCC(=O)O MCULE-5456784327 [0,0,0,0,0,0|2,0,0]=2 105 B12R1.21 CC1=NC=C(C=C1)OCC(=O)O MCULE-9434015996 [0,0,0,0,0,0|3,0,0]=3 106 B12R1.21 CN(C)CCC1=CC=C(C=C1)Br MCULE-1409418364 [0,0,0,0,0,0|4,0,0]=4 107 B12R1.21 CN(C)CCC1=CC=C(C=C1)Br MCULE-2089942214 [0,0,0,0,0,0|4,0,0]=4 108 B12R1.21 CN(C)CCC1=CC=C(C=C1)N MCULE-2946311314 [0,0,0,0,0,0|3,0,0]=3 109 B12R1.21 CN(C)CCC1=CC=C(C=C1)N MCULE-7838733665 [0,0,0,0,0,0|3,0,0]=3 110 B12R1.21 CN(C)CCC1=CC=C(C=C1)N MCULE-9347621057 [0,0,0,0,0,0|3,0,0]=3 111 B12R1.21 CN(C)CCC1=CC=C(C=C1)O MCULE-4582251049 [0,0,0,0,0,0|4,0,0]=4 112 B12R1.21 CN(C)CCC1=CC=C(C=C1)O MCULE-5733361719 [0,0,0,0,0,0|4,0,0]=4 113 B12R1.21 C[C@@H](N)CCC1=CC=C(C=C1)O MCULE-3551661935 [0,0,0,0,0,0|3,0,1]=4 114 B12R1.21 C[C@@H](N)CCC1=CC=C(C=C1)O MCULE-5189739309 [0,0,0,0,0,0|3,0,1]=4 115 B12R1.21 C[C@@H](O)CCC1=CC=C(C=C1)Cl MCULE-1876186806 [0,0,0,0,0,0|2,0,1]=3 116 B12R1.21 C[C@@H](O)CCC1=CC=C(C=C1)Cl MCULE-3275461399 [0,0,0,0,0,0|2,0,1]=3 117 B12R1.21 C[C@@H](O)CCC1=CC=C(C=C1)O MCULE-5901999576 [0,0,0,0,0,0|2,0,1]=3 118 B12R1.21 C[C@@H](O)CCC1=CC=C(C=C1)O MCULE-8613264387 [0,0,0,0,0,0|2,0,1]=3 119 B12R1.21 C[C@H](O)CCC1=CC=C(C=C1)O MCULE-4216892656 [0,0,0,0,0,0|2,0,1]=3 120 B12R1.21 C[C@H](O)CCC1=CC=C(C=C1)O MCULE-8670625635 [0,0,0,0,0,0|2,0,1]=3 121 B12R1.21 C[NH+](C)CCC1=CC=C(C=C1)O MCULE-3657373460 [0,0,0,0,0,0|4,0,0]=4 122 B12R1.21 FC1=CC=C(C=C1)CNC(=S)Cl MCULE-2674366985 [0,0,0,0,0,0|3,1,0]=4 123 B12R1.21 N=C(N)CCC1=CC=C(C=C1)Cl MCULE-5890443656 [0,0,0,0,0,0|3,0,0]=3 124 B12R1.21 N=C(N)CCC1=CC=C(C=C1)O MCULE-4076608372 [0,0,0,0,0,0|3,0,0]=3 125 B12R1.21 N=C(N)CCC1=CC=C(C=C1)O MCULE-6645175325 [0,0,0,0,0,0|3,0,0]=3 126 B12R1.21 N=C(N)COC1=CC=C(C=C1)Br MCULE-6040717455 [0,0,0,0,0,0|4,0,0]=4 127 B12R1.21 N=C(N)COC1=CC=C(C=C1)Br MCULE-6381177571 [0,0,0,0,0,0|4,0,0]=4 128 B12R1.21 N=C(N)COC1=CC=C(C=C1)Cl MCULE-8834081415 [0,0,0,0,0,0|4,0,0]=4 129 B12R1.21 N=C(N)COC1=CC=C(C=C1)Cl MCULE-9946614972 [0,0,0,0,0,0|4,0,0]=4 130 B12R1.21 N=C(N)COC1=CC=C(C=C1)F MCULE-3338705710 [0,0,0,0,0,0|4,0,0]=4 131 B12R1.21 N=C(N)CSC1=CC=C(C=C1)Cl MCULE-2216027831 [0,0,0,0,0,0|4,0,0]=4 132 B12R1.21 N=C(N)CSC1=CC=C(C=C1)Cl MCULE-4003742592 [0,0,0,0,0,0|4,0,0]=4 133 B12R1.21 N=C(N)NCC1=CC=C(C=C1)F MCULE-5543694632 [0,0,0,0,0,0|4,0,0]=4 134 B12R1.21 N=C(N)NCC1=CC=C(C=C1)F MCULE-8076163713 [0,0,0,0,0,0|4,0,0]=4 135 B12R1.21 N=C(N)NCC1=CC=C(C=C1)N MCULE-5601393300 [0,0,0,0,0,0|3,0,0]=3 136 B12R1.21 N=C(N)SCC1=CC=C(C=C1)Br MCULE-3528303873 [0,0,0,0,0,0|4,0,0]=4 137 B12R1.21 N=C(N)SCC1=CC=C(C=C1)Br MCULE-6534929505 [0,0,0,0,0,0|4,0,0]=4 138 B12R1.21 N=C(N)SCC1=CC=C(C=C1)Br MCULE-6550726284 [0,0,0,0,0,0|4,0,0]=4 139 B12R1.21 N=C(N)SCC1=CC=C(C=C1)Cl MCULE-1432607297 [0,0,0,0,0,0|4,0,0]=4 140 B12R1.21 N=C(N)SCC1=CC=C(C=C1)Cl MCULE-3351079980 [0,0,0,0,0,0|4,0,0]=4 141 B12R1.21 N=C(N)SCC1=CC=C(C=C1)Cl MCULE-5040941571 [0,0,0,0,0,0|4,0,0]=4 142 B12R1.21 N=C(N)SCC1=CC=C(C=C1)F MCULE-5589241291 [0,0,0,0,0,0|4,0,0]=4 143 B12R1.21 N=C(N)SCC1=CC=C(C=C1)F MCULE-7025421735 [0,0,0,0,0,0|4,0,0]=4 144 B12R1.21 N=C(N)SCC1=CC=C(C=C1)F MCULE-7671257099 [0,0,0,0,0,0|4,0,0]=4 145 B12R1.21 N=C(N)SCC1=CC=C(C=C1)I MCULE-1805664426 [0,0,0,0,0,0|4,0,0]=4 146 B12R1.21 N=C(N)SCC1=CC=C(C=C1)I MCULE-8931080301 [0,0,0,0,0,0|4,0,0]=4 147 B12R1.21 N=C([NH3+])COC1=CC=C(C=C1)F MCULE-7931404979 [0,0,0,0,0,0|4,0,0]=4 148 B12R1.21 NC(=O)/C=C/C1=CC=C(C=C1)Br MCULE-9474644627 [0,0,0,0,0,0|2,0,2]=4 149 B12R1.21 NC(=O)/C=C/C1=CC=C(C=C1)Cl MCULE-4399110657 [0,0,0,0,0,0|2,0,2]=4 150 B12R1.21 NC(=O)/C=C/C1=CC=C(C=C1)O MCULE-7972851464 [0,0,0,0,0,0|2,0,2]=4 151 B12R1.21 NC(=O)C#CC1=CC=C(C=C1)Cl MCULE-4663143934 [0,0,0,0,0,0|2,0,2]=4 152 B12R1.21 NC(=O)C=CC1=CC=C(C=C1)Br MCULE-2059664507 [0,0,0,0,0,0|2,0,2]=4 153 B12R1.21 NC(=O)C=CC1=CC=C(C=C1)Cl MCULE-9226277544 [0,0,0,0,0,0|2,0,2]=4 154 B12R1.21 NC(=O)C=CC1=CC=C(C=C1)F MCULE-3516681833 [0,0,0,0,0,0|2,0,2]=4 155 B12R1.21 NC(=O)C=CC1=CC=C(C=C1)O MCULE-1974045025 [0,0,0,0,0,0|2,0,2]=4 156 B12R1.21 NC(=O)CCC1=CC=C(C=C1)Br MCULE-6247833294 [0,0,0,0,0,0|2,0,0]=2 157 B12R1.21 NC(=O)CCC1=CC=C(C=C1)F MCULE-9316686554 [0,0,0,0,0,0|2,0,0]=2 158 B12R1.21 NC(=O)CCC1=CC=C(C=C1)N MCULE-9065854031 [0,0,0,0,0,0|1,0,0]=1 159 B12R1.21 NC(=O)CCC1=CC=C(C=C1)O MCULE-6107630328 [0,0,0,0,0,0|2,0,0]=2 160 B12R1.21 NC(=O)CNC1=CC=C(C=C1)F MCULE-5100222404 [0,0,0,0,0,0|3,0,0]=3 161 B12R1.21 NC(=O)CNC1=CC=C(C=C1)N MCULE-2698396359 [0,0,0,0,0,0|2,0,0]=2 162 B12R1.21 NC(=O)COC1=CC=C(C=C1)Br MCULE-1505235153 [0,0,0,0,0,0|3,0,0]=3 163 B12R1.21 NC(=O)COC1=CC=C(C=C1)Cl MCULE-4869532442 [0,0,0,0,0,0|3,0,0]=3 164 B12R1.21 NC(=O)COC1=CC=C(C=C1)F MCULE-4816313895 [0,0,0,0,0,0|3,0,0]=3 165 B12R1.21 NC(=O)COC1=CC=C(C=C1)N MCULE-3622391982 [0,0,0,0,0,0|2,0,0]=2 166 B12R1.21 NC(=O)COC1=CC=C(C=C1)O MCULE-8633247555 [0,0,0,0,0,0|3,0,0]=3 167 B12R1.21 NC(=O)CSC1=CC=C(C=C1)Br MCULE-7062565415 [0,0,0,0,0,0|3,0,0]=3 168 B12R1.21 NC(=O)CSC1=CC=C(C=C1)Cl MCULE-2104652415 [0,0,0,0,0,0|3,0,0]=3 169 B12R1.21 NC(=O)CSC1=CC=C(C=C1)N MCULE-1329341080 [0,0,0,0,0,0|2,0,0]=2 170 B12R1.21 NC(=O)NCC1=CC=C(C=C1)Cl MCULE-3234239362 [0,0,0,0,0,0|3,0,0]=3 171 B12R1.21 NC(=O)NCC1=CC=C(C=C1)F MCULE-9074250951 [0,0,0,0,0,0|3,0,0]=3 172 B12R1.21 NC(=O)NCC1=CC=C(C=C1)N MCULE-1936986239 [0,0,0,0,0,0|2,0,0]=2 173 B12R1.21 NC(=O)NNC1=CC=C(C=C1)F MCULE-3757814549 [0,0,0,0,0,0|4,0,0]=4 174 B12R1.21 NC(=S)CCC1=CC=C(C=C1)N MCULE-3815342116 [0,0,0,0,0,0|1,1,0]=2 175 B12R1.21 NC(=S)COC1=CC=C(C=C1)Br MCULE-1817353678 [0,0,0,0,0,0|3,1,0]=4 176 B12R1.21 NC(=S)COC1=CC=C(C=C1)Cl MCULE-3175411035 [0,0,0,0,0,0|3,1,0]=4 177 B12R1.21 NC(=S)COC1=CC=C(C=C1)F MCULE-7533911700 [0,0,0,0,0,0|3,1,0]=4 178 B12R1.21 NC(=S)NCC1=CC=C(C=C1)Br MCULE-5432363336 [0,0,0,0,0,0|3,1,0]=4 179 B12R1.21 NC(=S)NCC1=CC=C(C=C1)Cl MCULE-8975818367 [0,0,0,0,0,0|3,1,0]=4 180 B12R1.21 NC(=S)NCC1=CC=C(C=C1)F MCULE-7349278700 [0,0,0,0,0,0|3,1,0]=4 181 B12R1.21 NC1=CC=C(C=C1)/C=C/C(=O)O MCULE-6477711177 [0,0,0,0,0,0|0,0,2]=2 182 B12R1.21 NC1=CC=C(C=C1)C=CC(=O)O MCULE-9065250783 [0,0,0,0,0,0|0,0,2]=2 183 B12R1.21 NC1=CC=C(C=C1)CCC(=O)O MCULE-5126543796 [0,0,0,0,0,0|0,0,0]=0 184 B12R1.21 NC1=CC=C(C=C1)CCC(=O)O MCULE-9559825152 [0,0,0,0,0,0|0,0,0]=0 185 B12R1.21 NC1=CC=C(C=C1)COC(F)F MCULE-6958809222 [0,0,0,0,0,0|3,0,1]=4 186 B12R1.21 NC1=CC=C(C=C1)OCC(=O)O MCULE-5505108288 [0,0,0,0,0,0|1,0,0]=1 187 B12R1.21 NC1=CC=C(C=C1)OCC(F)F MCULE-5969588723 [0,0,0,0,0,0|3,0,1]=4 188 B12R1.21 NC1=CC=C(C=C1)OCC(F)F MCULE-8750463241 [0,0,0,0,0,0|3,0,1]=4 189 B12R1.21 NC1=CC=C(C=C1)SCC(=O)O MCULE-6773423539 [0,0,0,0,0,0|1,0,0]=1 190 B12R1.21 NC1=CC=C(C=N1)CCC(=O)O MCULE-7626186877 [0,0,0,0,0,0|1,0,0]=1 191 B12R1.21 NC1=CN=C(C=C1)CCC(=O)O MCULE-9677931320 [0,0,0,0,0,0|1,0,0]=1 192 B12R1.21 NC1=NC=C(C=C1)/C=C/C(=O)O MCULE-9571181864 [0,0,0,0,0,0|1,0,2]=3 193 B12R1.21 NC1=NC=C(C=C1)C=CC(=O)O MCULE-9262977474 [0,0,0,0,0,0|1,0,2]=3 194 B12R1.21 NC1=NC=C(C=C1)CCC(=O)O MCULE-4214871845 [0,0,0,0,0,0|1,0,0]=1 195 B12R1.21 NC1=NC=C(C=N1)/C=C/C(=O)O MCULE-6793915302 [0,0,0,0,0,0|2,0,2]=4 196 B12R1.21 NC1=NC=C(C=N1)C=CC(=O)O MCULE-2723647833 [0,0,0,0,0,0|2,0,2]=4 197 B12R1.21 O=C(Cl)/C=C/C1=CC=C(C=C1)Br MCULE-1656107943 [0,0,0,0,0,0|2,0,2]=4 198 B12R1.21 O=C(Cl)/C=C/C1=CC=C(C=C1)Cl MCULE-5462639794 [0,0,0,0,0,0|2,0,2]=4 199 B12R1.21 O=C(Cl)/C=C/C1=CC=C(C=C1)F MCULE-3036184092 [0,0,0,0,0,0|2,0,2]=4 200 B12R1.21 O=C(Cl)C=CC1=CC=C(C=C1)Br MCULE-6741932936 [0,0,0,0,0,0|2,0,2]=4 201 B12R1.21 O=C(Cl)C=CC1=CC=C(C=C1)Cl MCULE-4301034303 [0,0,0,0,0,0|2,0,2]=4 202 B12R1.21 O=C(Cl)C=CC1=CC=C(C=C1)F MCULE-4813703106 [0,0,0,0,0,0|2,0,2]=4 203 B12R1.21 O=C(Cl)CCC1=CC=C(C=C1)Br MCULE-4750259114 [0,0,0,0,0,0|2,0,0]=2 204 B12R1.21 O=C(Cl)CCC1=CC=C(C=C1)Cl MCULE-6095798494 [0,0,0,0,0,0|2,0,0]=2 205 B12R1.21 O=C(Cl)CCC1=CC=C(C=C1)F MCULE-6286582016 [0,0,0,0,0,0|2,0,0]=2 206 B12R1.21 O=C(Cl)CCC1=CC=C(C=C1)O MCULE-6255281310 [0,0,0,0,0,0|2,0,0]=2 207 B12R1.21 O=C(Cl)COC1=CC=C(C=C1)Br MCULE-4698854232 [0,0,0,0,0,0|3,0,0]=3 208 B12R1.21 O=C(Cl)COC1=CC=C(C=C1)Cl MCULE-5734605698 [0,0,0,0,0,0|3,0,0]=3 209 B12R1.21 O=C(Cl)COC1=CC=C(C=C1)F MCULE-3941859331 [0,0,0,0,0,0|3,0,0]=3 210 B12R1.21 O=C(Cl)COC1=CC=C(C=C1)I MCULE-9600845444 [0,0,0,0,0,0|3,0,0]=3 211 B12R1.21 O=C(Cl)CSC1=CC=C(C=C1)Cl MCULE-6197356523 [0,0,0,0,0,0|3,0,0]=3 212 B12R1.21 O=C(Cl)CSC1=CC=C(C=C1)F MCULE-8315502770 [0,0,0,0,0,0|3,0,0]=3 213 B12R1.21 O=C(Cl)OCC1=CC=C(C=C1)Br MCULE-2179312369 [0,0,0,0,0,0|3,0,0]=3 214 B12R1.21 O=C(Cl)OCC1=CC=C(C=C1)Cl MCULE-4206803949 [0,0,0,0,0,0|3,0,0]=3 215 B12R1.21 O=C(Cl)OCC1=CC=C(C=C1)F MCULE-7280261927 [0,0,0,0,0,0|3,0,0]=3 216 B12R1.21 O=C(O)/C=C/C1=CC=C(C=C1)Br MCULE-4289979015 [0,0,0,0,0,0|1,0,2]=3 217 B12R1.21 O=C(O)/C=C/C1=CC=C(C=C1)Cl MCULE-4318861622 [0,0,0,0,0,0|1,0,2]=3 218 B12R1.21 O=C(O)/C=C/C1=CC=C(C=C1)F MCULE-9538614113 [0,0,0,0,0,0|1,0,2]=3 219 B12R1.21 O=C(O)/C=C/C1=CC=C(C=C1)I MCULE-3328397950 [0,0,0,0,0,0|1,0,2]=3 220 B12R1.21 O=C(O)/C=C/C1=CC=C(C=C1)O MCULE-9551292063 [0,0,0,0,0,0|1,0,2]=3 221 B12R1.21 O=C(O)/C=C/C1=CC=C(C=C1)S MCULE-2486115993 [0,0,0,0,0,0|1,0,2]=3 222 B12R1.21 O=C(O)/C=C/C1=CC=C(N=C1)Br MCULE-9625493002 [0,0,0,0,0,0|2,0,2]=4 223 B12R1.21 O=C(O)/C=C/C1=CN=C(C=C1)Cl MCULE-4772490742 [0,0,0,0,0,0|2,0,2]=4 224 B12R1.21 O=C(O)/C=C/C1=NC=C(C=C1)F MCULE-2551687293 [0,0,0,0,0,0|2,0,2]=4 225 B12R1.21 O=C(O)/C=C/C1=NC=C(C=C1)F MCULE-9601983386 [0,0,0,0,0,0|2,0,2]=4 226 B12R1.21 O=C(O)C#CC1=CC=C(C=C1)Br MCULE-6509182116 [0,0,0,0,0,0|1,0,2]=3 227 B12R1.21 O=C(O)C#CC1=CC=C(C=C1)Cl MCULE-8696710053 [0,0,0,0,0,0|1,0,2]=3 228 B12R1.21 O=C(O)C#CC1=CC=C(C=C1)F MCULE-5876764996 [0,0,0,0,0,0|1,0,2]=3 229 B12R1.21 O=C(O)C#CC1=CC=C(C=C1)O MCULE-2564850163 [0,0,0,0,0,0|1,0,2]=3 230 B12R1.21 O=C(O)C=CC1=CC=C(C=C1)Br MCULE-6214703716 [0,0,0,0,0,0|1,0,2]=3 231 B12R1.21 O=C(O)C=CC1=CC=C(C=C1)Cl MCULE-6051545485 [0,0,0,0,0,0|1,0,2]=3 232 B12R1.21 O=C(O)C=CC1=CC=C(C=C1)F MCULE-8711973543 [0,0,0,0,0,0|1,0,2]=3 233 B12R1.21 O=C(O)C=CC1=CC=C(C=C1)I MCULE-2006397145 [0,0,0,0,0,0|1,0,2]=3 234 B12R1.21 O=C(O)C=CC1=CC=C(C=C1)O MCULE-2590309260 [0,0,0,0,0,0|1,0,2]=3 235 B12R1.21 O=C(O)C=CC1=CC=C(C=C1)S MCULE-4579832892 [0,0,0,0,0,0|1,0,2]=3 236 B12R1.21 O=C(O)C=CC1=CC=C(N=C1)Br MCULE-1067022604 [0,0,0,0,0,0|2,0,2]=4 237 B12R1.21 O=C(O)C=CC1=CN=C(C=C1)Cl MCULE-5983392112 [0,0,0,0,0,0|2,0,2]=4 238 B12R1.21 O=C(O)C=CC1=NC=C(C=C1)F MCULE-3616932768 [0,0,0,0,0,0|2,0,2]=4 239 B12R1.21 O=C(O)C=CC1=NC=C(C=C1)F MCULE-9950644550 [0,0,0,0,0,0|2,0,2]=4 240 B12R1.21 O=C(O)CCC1=CC=C(C=C1)Br MCULE-4543776346 [0,0,0,0,0,0|1,0,0]=1 241 B12R1.21 O=C(O)CCC1=CC=C(C=C1)Cl MCULE-1600813005 [0,0,0,0,0,0|1,0,0]=1 242 B12R1.21 O=C(O)CCC1=CC=C(C=C1)F MCULE-1294455319 [0,0,0,0,0,0|1,0,0]=1 243 B12R1.21 O=C(O)CCC1=CC=C(C=C1)I MCULE-9257606064 [0,0,0,0,0,0|1,0,0]=1 244 B12R1.21 O=C(O)CCC1=CC=C(C=C1)O MCULE-6058509896 [0,0,0,0,0,0|1,0,0]=1 245 B12R1.21 O=C(O)CCC1=CC=C(C=C1)S MCULE-3033443514 [0,0,0,0,0,0|1,0,0]=1 246 B12R1.21 O=C(O)CCC1=CC=C(N=C1)Br MCULE-8674708546 [0,0,0,0,0,0|2,0,0]=2 247 B12R1.21 O=C(O)CCC1=CC=C(N=C1)F MCULE-3454488694 [0,0,0,0,0,0|2,0,0]=2 248 B12R1.21 O=C(O)CCC1=CN=C(C=C1)Cl MCULE-5091357831 [0,0,0,0,0,0|2,0,0]=2 249 B12R1.21 O=C(O)CCC1=CNC(=O)C=C1 MCULE-2339654344 [0,0,0,0,0,0|2,0,0]=2 250 B12R1.21 O=C(O)CCC1=CNC(=O)C=C1 MCULE-4103457533 [0,0,0,0,0,0|2,0,0]=2 251 B12R1.21 O=C(O)CCC1=NC=C(C=C1)Br MCULE-7064440494 [0,0,0,0,0,0|2,0,0]=2 252 B12R1.21 O=C(O)CCC1=NC=C(C=N1)F MCULE-8588248375 [0,0,0,0,0,0|3,0,0]=3 253 B12R1.21 O=C(O)CCC1=NNC(=O)C=C1 MCULE-5907904139 [0,0,0,0,0,0|3,0,0]=3 254 B12R1.21 O=C(O)CNC1=CC=C(C=C1)Br MCULE-1005193463 [0,0,0,0,0,0|2,0,0]=2 255 B12R1.21 O=C(O)CNC1=CC=C(C=C1)Cl MCULE-7511412994 [0,0,0,0,0,0|2,0,0]=2 256 B12R1.21 O=C(O)CNC1=CC=C(C=C1)Cl MCULE-9676921611 [0,0,0,0,0,0|2,0,0]=2 257 B12R1.21 O=C(O)CNC1=CC=C(C=C1)F MCULE-5532990900 [0,0,0,0,0,0|2,0,0]=2 258 B12R1.21 O=C(O)CNC1=CC=C(C=C1)I MCULE-5559141508 [0,0,0,0,0,0|2,0,0]=2 259 B12R1.21 O=C(O)CNC1=CC=C(C=C1)O MCULE-7475897538 [0,0,0,0,0,0|2,0,0]=2 260 B12R1.21 O=C(O)CNC1=NN=C(C=C1)Cl MCULE-9520610048 [0,0,0,0,0,0|4,0,0]=4 261 B12R1.21 O=C(O)COC1=CC=C(C=C1)Br MCULE-1086285737 [0,0,0,0,0,0|2,0,0]=2 262 B12R1.21 O=C(O)COC1=CC=C(C=C1)Cl MCULE-9539789488 [0,0,0,0,0,0|2,0,0]=2 263 B12R1.21 O=C(O)COC1=CC=C(C=C1)F MCULE-9999059727 [0,0,0,0,0,0|2,0,0]=2 264 B12R1.21 O=C(O)COC1=CC=C(C=C1)I MCULE-2347603234 [0,0,0,0,0,0|2,0,0]=2 265 B12R1.21 O=C(O)COC1=CC=C(C=C1)O MCULE-1682652071 [0,0,0,0,0,0|2,0,0]=2 266 B12R1.21 O=C(O)COC1=CN=C(C=C1)Cl MCULE-7497981832 [0,0,0,0,0,0|3,0,0]=3 267 B12R1.21 O=C(O)COC1=CN=C(C=C1)F MCULE-9394886074 [0,0,0,0,0,0|3,0,0]=3 268 B12R1.21 O=C(O)COC1=NC=C(C=C1)Br MCULE-2510168543 [0,0,0,0,0,0|3,0,0]=3 269 B12R1.21 O=C(O)COC1=NC=C(C=C1)Cl MCULE-1476293205 [0,0,0,0,0,0|3,0,0]=3 270 B12R1.21 O=C(O)COC1=NC=C(C=C1)F MCULE-5949144789 [0,0,0,0,0,0|3,0,0]=3 271 B12R1.21 O=C(O)COC1=NC=C(C=N1)Br MCULE-4730263318 [0,0,0,0,0,0|4,0,0]=4 272 B12R1.21 O=C(O)COC1=NNC(=O)C=C1 MCULE-7269274619 [0,0,0,0,0,0|4,0,0]=4 273 B12R1.21 O=C(O)CSC1=CC=C(C=C1)Br MCULE-9317070286 [0,0,0,0,0,0|2,0,0]=2 274 B12R1.21 O=C(O)CSC1=CC=C(C=C1)Cl MCULE-5442245504 [0,0,0,0,0,0|2,0,0]=2 275 B12R1.21 O=C(O)CSC1=CC=C(C=C1)F MCULE-8846349352 [0,0,0,0,0,0|2,0,0]=2 276 B12R1.21 O=C(O)CSC1=CC=C(C=C1)O MCULE-7002993892 [0,0,0,0,0,0|2,0,0]=2 277 B12R1.21 O=C(O)CSC1=CC=C(N=N1)Cl MCULE-7092310423 [0,0,0,0,0,0|4,0,0]=4 278 B12R1.21 O=C(O)CSC1=NC=C(C=N1)Br MCULE-2252440565 [0,0,0,0,0,0|4,0,0]=4 279 B12R1.21 O=C(O)CSC1=NC=C(C=N1)Cl MCULE-8545505273 [0,0,0,0,0,0|4,0,0]=4 280 B12R1.21 O=C([O-])COC1=CC=C(C=C1)Cl MCULE-9943796876 [0,0,0,0,0,0|2,0,1]=3 281 B12R1.21 O=C([O-])CSC1=CC=C(C=C1)F MCULE-7493386013 [0,0,0,0,0,0|2,0,1]=3 282 B12R1.21 O=C1C=CN(C=C1)OCC(=O)O MCULE-1717314194 [0,0,0,0,0,0|3,0,0]=3 283 B12R1.21 O=N(=O)CCC1=CC=C(C=C1)F MCULE-9425009430 [0,0,0,0,0,0|2,0,1]=3 284 B12R1.21 S=C(Cl)NCC1=CC=C(C=C1)Br MCULE-2991127276 [0,0,0,0,0,0|3,1,0]=4 285 B12R1.21 [C@@H](C)(O)COC1=CC=C(C=C1)F MCULE-1636871184 [0,0,0,0,0,0|3,0,1]=4 286 B12R1.21 [C@H](C)(O)COC1=CC=C(C=C1)F MCULE-2471780560 [0,0,0,0,0,0|3,0,1]=4 287 B12R1.21 [NH3+]C1=CC=C(C=C1)C=CC(=O)O MCULE-3210030968 [0,0,0,0,0,0|0,0,3]=3 288 B11R1.1 BrCCCC1=CC=C(C=C1)Br MCULE-9723157036 [1,0,0,0,0,0|2,0,1]=4 289 B11R1.1 C#CCCC1=CC=C(C=C1)Br MCULE-9570057570 [1,0,0,0,0,0|2,0,1]=4 290 B11R1.1 C#CCCC1=CC=C(C=C1)F MCULE-9456982250 [1,0,0,0,0,0|2,0,1]=4 291 B11R1.1 C#CCOC1=CC=C(C=C1)N MCULE-1680099594 [1,0,0,0,0,0|2,0,1]=4 292 B11R1.1 C#CCOC1=CC=C(C=C1)N MCULE-3629749614 [1,0,0,0,0,0|2,0,1]=4 293 B11R1.1 C=CCCC1=CC=C(C=C1)Br MCULE-5432522742 [1,0,0,0,0,0|2,0,0]=3 294 B11R1.1 C=CCCC1=CC=C(C=C1)C MCULE-4993052207 [1,0,0,0,0,0|2,0,0]=3 295 B11R1.1 C=CCCC1=CC=C(C=C1)Cl MCULE-1744113911 [1,0,0,0,0,0|2,0,0]=3 296 B11R1.1 C=CCCC1=CC=C(C=C1)F MCULE-3609599920 [1,0,0,0,0,0|2,0,0]=3 297 B11R1.1 C=CCCC1=CC=C(C=C1)O MCULE-9683414474 [1,0,0,0,0,0|2,0,0]=3 298 B11R1.1 C=CCCC1=CN=C(C=C1)Cl MCULE-6272966817 [1,0,0,0,0,0|3,0,0]=4 299 B11R1.1 C=CCNC1=CC=C(C=C1)F MCULE-1771968155 [1,0,0,0,0,0|3,0,0]=4 300 B11R1.1 C=CCOC1=CC=C(C=C1)Br MCULE-4946854309 [1,0,0,0,0,0|3,0,0]=4 301 B11R1.1 C=CCOC1=CC=C(C=C1)C MCULE-1272378249 [1,0,0,0,0,0|3,0,0]=4 302 B11R1.1 C=CCOC1=CC=C(C=C1)Cl MCULE-2563875562 [1,0,0,0,0,0|3,0,0]=4 303 B11R1.1 C=CCOC1=CC=C(C=C1)F MCULE-4378023002 [1,0,0,0,0,0|3,0,0]=4 304 B11R1.1 C=CCOC1=CC=C(C=C1)I MCULE-8882741985 [1,0,0,0,0,0|3,0,0]=4 305 B11R1.1 C=CCOC1=CC=C(C=C1)N MCULE-4657968471 [1,0,0,0,0,0|2,0,0]=3 306 B11R1.1 C=CCOC1=CC=C(C=C1)N MCULE-9695635621 [1,0,0,0,0,0|2,0,0]=3 307 B11R1.1 C=CCOC1=CC=C(C=C1)O MCULE-5295111161 [1,0,0,0,0,0|3,0,0]=4 308 B11R1.1 C=CCSC1=CC=C(C=C1)C MCULE-8921716611 [1,0,0,0,0,0|3,0,0]=4 309 B11R1.1 C=CCSC1=CC=C(C=C1)Cl MCULE-1663916012 [1,0,0,0,0,0|3,0,0]=4 310 B11R1.1 C=CCSC1=CC=C(C=C1)F MCULE-5411098417 [1,0,0,0,0,0|3,0,0]=4 311 B11R1.1 CC1=CC=C(C=C1)/C=C/C=O MCULE-9437312205 [1,0,0,0,0,0|1,0,2]=4 312 B11R1.1 CC1=CC=C(C=C1)C=CC=O MCULE-1811976125 [1,0,0,0,0,0|1,0,2]=4 313 B11R1.1 CC1=CC=C(C=C1)CCC=O MCULE-5011003207 [1,0,0,0,0,0|1,0,0]=2 314 B11R1.1 CC1=CC=C(C=C1)CCCBr MCULE-7273450941 [1,0,0,0,0,0|2,0,1]=4 315 B11R1.1 CC1=CC=C(C=C1)CCCN MCULE-2972333960 [1,0,0,0,0,0|2,0,1]=4 316 B11R1.1 CC1=CC=C(C=C1)CCCN MCULE-8892367369 [1,0,0,0,0,0|2,0,1]=4 317 B11R1.1 CC1=CC=C(C=C1)CCCO MCULE-9632662084 [1,0,0,0,0,0|1,0,1]=3 318 B11R1.1 CC1=CC=C(C=C1)CCCS MCULE-6657451156 [1,0,0,0,0,0|1,1,1]=4 319 B11R1.1 CC1=CC=C(C=C1)CN=C=O MCULE-1437351447 [1,0,0,0,0,0|2,0,1]=4 320 B11R1.1 CC1=CC=C(C=C1)CNC=O MCULE-5057658878 [1,0,0,0,0,0|2,0,0]=3 321 B11R1.1 CC1=CC=C(C=C1)NCCO MCULE-9356268016 [1,0,0,0,0,0|2,0,1]=4 322 B11R1.1 CC1=CC=C(C=C1)NNC=O MCULE-4408435132 [1,0,0,0,0,0|3,0,0]=4 323 B11R1.1 CC1=CC=C(C=C1)OCCO MCULE-7424526463 [1,0,0,0,0,0|2,0,1]=4 324 B11R1.1 CC1=CC=C(C=C1)SCCO MCULE-6492409168 [1,0,0,0,0,0|2,0,1]=4 325 B11R1.1 CC1=NC=C(C=C1)CCC=O MCULE-6100095568 [1,0,0,0,0,0|2,0,0]=3 326 B11R1.1 CC1=NC=C(C=C1)CCCO MCULE-2017541211 [1,0,0,0,0,0|2,0,1]=4 327 B11R1.1 CCCCC1=CC=C(C=C1)Br MCULE-5085143125 [1,0,0,0,0,0|2,0,1]=4 328 B11R1.1 CCCCC1=CC=C(C=C1)C MCULE-9857515677 [1,0,0,0,0,0|2,0,1]=4 329 B11R1.1 CCCCC1=CC=C(C=C1)Cl MCULE-1290195292 [1,0,0,0,0,0|2,0,1]=4 330 B11R1.1 CCCCC1=CC=C(C=C1)I MCULE-7199270658 [1,0,0,0,0,0|2,0,1]=4 331 B11R1.1 CCCCC1=CC=C(C=C1)N MCULE-7883402757 [1,0,0,0,0,0|1,0,1]=3 332 B11R1.1 CCCCC1=CC=C(C=C1)O MCULE-4727787995 [1,0,0,0,0,0|2,0,1]=4 333 B11R1.1 CCCCC1=CC=C(C=C1)S MCULE-3984375827 [1,0,0,0,0,0|2,0,1]=4 334 B11R1.1 CCCOC1=CC=C(C=C1)N MCULE-4264616598 [1,0,0,0,0,0|2,0,1]=4 335 B11R1.1 CCCSC1=CC=C(C=C1)N MCULE-6311190549 [1,0,0,0,0,0|2,0,1]=4 336 B11R1.1 CCCSC1=CC=C(C=C1)N MCULE-8632485277 [1,0,0,0,0,0|2,0,1]=4 337 B11R1.1 CCNCC1=CC=C(C=C1)N MCULE-8176216677 [1,0,0,0,0,0|2,0,1]=4 338 B11R1.1 CCOCC1=CC=C(C=C1)N MCULE-4486009312 [1,0,0,0,0,0|2,0,1]=4 339 B11R1.1 CCSCC1=CC=C(C=C1)N MCULE-3305911189 [1,0,0,0,0,0|2,0,1]=4 340 B11R1.1 CNCCC1=CC=C(C=C1)Br MCULE-3456096699 [1,0,0,0,0,0|3,0,0]=4 341 B11R1.1 CNCCC1=CC=C(C=C1)C MCULE-6467601586 [1,0,0,0,0,0|3,0,0]=4 342 B11R1.1 CNCCC1=CC=C(C=C1)Cl MCULE-1775717184 [1,0,0,0,0,0|3,0,0]=4 343 B11R1.1 CNCCC1=CC=C(C=C1)F MCULE-3033576960 [1,0,0,0,0,0|3,0,0]=4 344 B11R1.1 CNCCC1=CC=C(C=C1)F MCULE-7009349695 [1,0,0,0,0,0|3,0,0]=4 345 B11R1.1 CNCCC1=CC=C(C=C1)N MCULE-5945075538 [1,0,0,0,0,0|2,0,0]=3 346 B11R1.1 CNCCC1=CC=C(C=C1)O MCULE-3297525509 [1,0,0,0,0,0|3,0,0]=4 347 B11R1.1 CNCCC1=CC=C(C=C1)O MCULE-8307043155 [1,0,0,0,0,0|3,0,0]=4 348 B11R1.1 COCCC1=CC=C(C=C1)Br MCULE-9787998637 [1,0,0,0,0,0|3,0,0]=4 349 B11R1.1 COCCC1=CC=C(C=C1)N MCULE-4205697054 [1,0,0,0,0,0|2,0,0]=3 350 B11R1.1 COCCC1=CC=C(C=C1)O MCULE-8081983402 [1,0,0,0,0,0|3,0,0]=4 351 B11R1.1 COCOC1=CC=C(C=C1)N MCULE-9894527728 [1,0,0,0,0,0|3,0,0]=4 352 B11R1.1 CSCCC1=CC=C(C=C1)N MCULE-6797086767 [1,0,0,0,0,0|2,0,0]=3 353 B11R1.1 ClC1=CC=C(C=C1)CCCBr MCULE-1594863019 [1,0,0,0,0,0|2,0,1]=4 354 B11R1.1 ClCCCC1=CC=C(C=C1)Br MCULE-8815406901 [1,0,0,0,0,0|2,0,1]=4 355 B11R1.1 ClCCCC1=CC=C(C=C1)Cl MCULE-3691902632 [1,0,0,0,0,0|2,0,1]=4 356 B11R1.1 FC1=CC=C(C=C1)CCCBr MCULE-7335136494 [1,0,0,0,0,0|2,0,1]=4 357 B11R1.1 FC1=CC=C(C=C1)CCCCl MCULE-1711808252 [1,0,0,0,0,0|2,0,1]=4 358 B11R1.1 FC1=CC=C(C=C1)CCCI MCULE-4787594482 [1,0,0,0,0,0|2,0,1]=4 359 B11R1.1 FC1=CC=C(C=C1)CCCS MCULE-7975152669 [1,0,0,0,0,0|1,1,1]=4 360 B11R1.1 N#CCCC1=CC=C(C=C1)Br MCULE-5561987303 [1,0,0,0,0,0|2,0,1]=4 361 B11R1.1 N#CCCC1=CC=C(C=C1)Cl MCULE-7531507792 [1,0,0,0,0,0|2,0,1]=4 362 B11R1.1 N#CCCC1=CC=C(C=C1)F MCULE-6851558350 [1,0,0,0,0,0|2,0,1]=4 363 B11R1.1 N#CCCC1=CC=C(C=C1)N MCULE-9194045811 [1,0,0,0,0,0|1,0,1]=3 364 B11R1.1 N#CCCC1=CC=C(C=C1)O MCULE-9336789470 [1,0,0,0,0,0|2,0,1]=4 365 B11R1.1 N#CCOC1=CC=C(C=C1)N MCULE-8494612354 [1,0,0,0,0,0|2,0,1]=4 366 B11R1.1 N#CCSC1=CC=C(C=C1)N MCULE-8095411749 [1,0,0,0,0,0|2,0,1]=4 367 B11R1.1 NC1=CC=C(C=C1)CCCO MCULE-3861837607 [1,0,0,0,0,0|0,0,1]=2 368 B11R1.1 NC1=CC=C(C=C1)CCCO MCULE-6893752317 [1,0,0,0,0,0|0,0,1]=2 369 B11R1.1 NC1=CC=C(C=C1)NCCO MCULE-5890262028 [1,0,0,0,0,0|1,0,1]=3 370 B11R1.1 NC1=CC=C(C=C1)NCCO MCULE-5940577364 [1,0,0,0,0,0|1,0,1]=3 371 B11R1.1 NC1=CC=C(C=C1)OCCCl MCULE-2709615362 [1,0,0,0,0,0|2,0,1]=4 372 B11R1.1 NC1=CC=C(C=C1)OCCF MCULE-4776826949 [1,0,0,0,0,0|2,0,1]=4 373 B11R1.1 NC1=CC=C(C=C1)OCCO MCULE-7394614277 [1,0,0,0,0,0|1,0,1]=3 374 B11R1.1 NC1=CC=C(C=C1)OCCO MCULE-9194780278 [1,0,0,0,0,0|1,0,1]=3 375 B11R1.1 NC1=CN=C(C=C1)OCCO MCULE-1925801936 [1,0,0,0,0,0|2,0,1]=4 376 B11R1.1 NC1=CN=C(C=C1)OCCO MCULE-8509184009 [1,0,0,0,0,0|2,0,1]=4 377 B11R1.1 NC1=NC=C(C=N1)CCCO MCULE-2041317562 [1,0,0,0,0,0|2,0,1]=4 378 B11R1.1 NCCCC1=CC=C(C=C1)Br MCULE-9595216025 [1,0,0,0,0,0|2,0,1]=4 379 B11R1.1 NCCCC1=CC=C(C=C1)Cl MCULE-1142043760 [1,0,0,0,0,0|2,0,1]=4 380 B11R1.1 NCCCC1=CC=C(C=C1)Cl MCULE-9103465456 [1,0,0,0,0,0|2,0,1]=4 381 B11R1.1 NCCCC1=CC=C(C=C1)F MCULE-3431777437 [1,0,0,0,0,0|2,0,1]=4 382 B11R1.1 NCCCC1=CC=C(C=C1)F MCULE-4673923418 [1,0,0,0,0,0|2,0,1]=4 383 B11R1.1 NCCCC1=CC=C(C=C1)N MCULE-5182106915 [1,0,0,0,0,0|1,0,1]=3 384 B11R1.1 NCCCC1=CC=C(C=C1)N MCULE-6054363220 [1,0,0,0,0,0|1,0,1]=3 385 B11R1.1 NCCCC1=CC=C(C=C1)O MCULE-1996917264 [1,0,0,0,0,0|2,0,1]=4 386 B11R1.1 NCCCC1=CC=C(C=C1)O MCULE-8194739134 [1,0,0,0,0,0|2,0,1]=4 387 B11R1.1 NCCNC1=CC=C(C=C1)N MCULE-2729339614 [1,0,0,0,0,0|2,0,1]=4 388 B11R1.1 NCCOC1=CC=C(C=C1)N MCULE-1094488230 [1,0,0,0,0,0|2,0,1]=4 389 B11R1.1 NCCOC1=CC=C(C=C1)N MCULE-4370211203 [1,0,0,0,0,0|2,0,1]=4 390 B11R1.1 NCCOC1=CC=C(C=C1)N MCULE-4768215485 [1,0,0,0,0,0|2,0,1]=4 391 B11R1.1 NNCCC1=CC=C(C=C1)Cl MCULE-8533533939 [1,0,0,0,0,0|3,0,0]=4 392 B11R1.1 NOCCC1=CC=C(C=C1)Br MCULE-8740220375 [1,0,0,0,0,0|3,0,0]=4 393 B11R1.1 NOCCC1=CC=C(C=C1)Cl MCULE-6168725590 [1,0,0,0,0,0|3,0,0]=4 394 B11R1.1 NOCCC1=CC=C(C=C1)Cl MCULE-8064247145 [1,0,0,0,0,0|3,0,0]=4 395 B11R1.1 NOCCC1=CC=C(C=C1)F MCULE-1980796346 [1,0,0,0,0,0|3,0,0]=4 396 B11R1.1 NOCCC1=CC=C(C=C1)F MCULE-8248728253 [1,0,0,0,0,0|3,0,0]=4 397 B11R1.1 NOCCC1=CC=C(C=C1)I MCULE-5238871746 [1,0,0,0,0,0|3,0,0]=4 398 B11R1.1 O=C/C=C/C1=CC=C(C=C1)Br MCULE-3938754463 [1,0,0,0,0,0|1,0,2]=4 399 B11R1.1 O=C/C=C/C1=CC=C(C=C1)Cl MCULE-6118487478 [1,0,0,0,0,0|1,0,2]=4 400 B11R1.1 O=C/C=C/C1=CC=C(C=C1)F MCULE-3157524927 [1,0,0,0,0,0|1,0,2]=4 401 B11R1.1 O=C/C=C/C1=CC=C(C=C1)O MCULE-1154888936 [1,0,0,0,0,0|1,0,2]=4 402 B11R1.1 O=C=NCC1=CC=C(C=C1)Br MCULE-5388007091 [1,0,0,0,0,0|2,0,1]=4 403 B11R1.1 O=C=NCC1=CC=C(C=C1)Cl MCULE-8289110125 [1,0,0,0,0,0|2,0,1]=4 404 B11R1.1 O=C=NCC1=CC=C(C=C1)F MCULE-6982288920 [1,0,0,0,0,0|2,0,1]=4 405 B11R1.1 O=CC=CC1=CC=C(C=C1)Br MCULE-1314515743 [1,0,0,0,0,0|1,0,2]=4 406 B11R1.1 O=CC=CC1=CC=C(C=C1)Cl MCULE-5649727633 [1,0,0,0,0,0|1,0,2]=4 407 B11R1.1 O=CC=CC1=CC=C(C=C1)F MCULE-2286039273 [1,0,0,0,0,0|1,0,2]=4 408 B11R1.1 O=CC=CC1=CC=C(C=C1)O MCULE-9429867074 [1,0,0,0,0,0|1,0,2]=4 409 B11R1.1 O=CCCC1=CC=C(C=C1)Br MCULE-9739267093 [1,0,0,0,0,0|1,0,0]=2 410 B11R1.1 O=CCCC1=CC=C(C=C1)Cl MCULE-7319845020 [1,0,0,0,0,0|1,0,0]=2 411 B11R1.1 O=CCCC1=CC=C(C=C1)F MCULE-2589381526 [1,0,0,0,0,0|1,0,0]=2 412 B11R1.1 O=CCCC1=CC=C(C=C1)O MCULE-4314800576 [1,0,0,0,0,0|1,0,0]=2 413 B11R1.1 O=CCOC1=CC=C(C=C1)Cl MCULE-6963407283 [1,0,0,0,0,0|2,0,0]=3 414 B11R1.1 O=CCOC1=CC=C(C=C1)F MCULE-9393229376 [1,0,0,0,0,0|2,0,0]=3 415 B11R1.1 O=CNCC1=CC=C(C=C1)Cl MCULE-8442988317 [1,0,0,0,0,0|2,0,0]=3 416 B11R1.1 OCCCC1=CC=C(C=C1)Br MCULE-6643038597 [1,0,0,0,0,0|1,0,1]=3 417 B11R1.1 OCCCC1=CC=C(C=C1)Cl MCULE-4902933931 [1,0,0,0,0,0|1,0,1]=3 418 B11R1.1 OCCCC1=CC=C(C=C1)F MCULE-3880816493 [1,0,0,0,0,0|1,0,1]=3 419 B11R1.1 OCCCC1=CC=C(C=C1)O MCULE-4368750678 [1,0,0,0,0,0|1,0,1]=3 420 B11R1.1 OCCCC1=CC=C(N=C1)Br MCULE-9964678216 [1,0,0,0,0,0|2,0,1]=4 421 B11R1.1 OCCCC1=CC=C(N=C1)Cl MCULE-4003392897 [1,0,0,0,0,0|2,0,1]=4 422 B11R1.1 OCCNC1=CC=C(C=C1)Br MCULE-5765016997 [1,0,0,0,0,0|2,0,1]=4 423 B11R1.1 OCCNC1=CC=C(C=C1)Cl MCULE-5179171912 [1,0,0,0,0,0|2,0,1]=4 424 B11R1.1 OCCNC1=CC=C(C=C1)F MCULE-4307483912 [1,0,0,0,0,0|2,0,1]=4 425 B11R1.1 OCCOC1=CC=C(C=C1)Br MCULE-3798440148 [1,0,0,0,0,0|2,0,1]=4 426 B11R1.1 OCCOC1=CC=C(C=C1)Cl MCULE-4863420880 [1,0,0,0,0,0|2,0,1]=4 427 B11R1.1 OCCOC1=CC=C(C=C1)F MCULE-2747862126 [1,0,0,0,0,0|2,0,1]=4 428 B11R1.1 OCCOC1=CC=C(C=C1)I MCULE-3049898017 [1,0,0,0,0,0|2,0,1]=4 429 B11R1.1 OCCOC1=CC=C(C=C1)O MCULE-1426055233 [1,0,0,0,0,0|2,0,1]=4 430 B11R1.1 OCCSC1=CC=C(C=C1)Br MCULE-7010973205 [1,0,0,0,0,0|2,0,1]=4 431 B11R1.1 OCCSC1=CC=C(C=C1)Cl MCULE-5403380064 [1,0,0,0,0,0|2,0,1]=4 432 B11R1.1 OCCSC1=CC=C(C=C1)F MCULE-8337958466 [1,0,0,0,0,0|2,0,1]=4 433 B11R1.1 SCCCC1=CC=C(C=C1)Br MCULE-2033575664 [1,0,0,0,0,0|1,1,1]=4 434 B11R1.1 SCCCC1=CC=C(C=C1)Cl MCULE-3378799702 [1,0,0,0,0,0|1,1,1]=4 435 B11R1.91 C(=CC1=CC=CC=C1)C(=O)[O-] MCULE-4187228018 [1,0,0,0,0,0|0,0,3]=4 436 B11R1.91 C=C(Br)CCC1=CC=CC=C1 MCULE-6424792652 [1,0,0,0,0,0|2,0,0]=3 437 B11R1.91 C=C(C)CCC1=CC=CC=C1 MCULE-2990252396 [1,0,0,0,0,0|2,0,0]=3 438 B11R1.91 C=C(C)COC1=CC=CC=C1 MCULE-7083540702 [1,0,0,0,0,0|3,0,0]=4 439 B11R1.91 C=C(C)CSC1=CC=CC=C1 MCULE-1933566464 [1,0,0,0,0,0|3,0,0]=4 440 B11R1.91 C=C(C)OCC1=CC=CC=C1 MCULE-9253229966 [1,0,0,0,0,0|3,0,0]=4 441 B11R1.91 C=C(Cl)CCC1=CC=CC=C1 MCULE-9913703516 [1,0,0,0,0,0|2,0,0]=3 442 B11R1.91 CC(=CCC1=CC=CC=C1)C MCULE-6894689571 [1,0,0,0,0,0|2,0,1]=4 443 B11R1.91 CC(=N)NCC1=CC=CC=C1 MCULE-1620218963 [1,0,0,0,0,0|3,0,0]=4 444 B11R1.91 CC(=N)NCC1=CC=CC=C1 MCULE-8833975625 [1,0,0,0,0,0|3,0,0]=4 445 B11R1.91 CC(=N)SCC1=CC=CC=C1 MCULE-2830681415 [1,0,0,0,0,0|3,0,0]=4 446 B11R1.91 CC(=N)SCC1=CC=CC=C1 MCULE-3429191250 [1,0,0,0,0,0|3,0,0]=4 447 B11R1.91 CC(=O)/C=C/C1=CC=CC=C1 MCULE-4879858540 [1,0,0,0,0,0|1,0,2]=4 448 B11R1.91 CC(=O)/N=N/C1=CC=CC=C1 MCULE-3182323500 [1,0,0,0,0,0|3,0,0]=4 449 B11R1.91 CC(=O)C#CC1=CC=CC=C1 MCULE-7514493825 [1,0,0,0,0,0|1,0,2]=4 450 B11R1.91 CC(=O)C=CC1=CC=CC=C1 MCULE-5202944660 [1,0,0,0,0,0|1,0,2]=4 451 B11R1.91 CC(=O)CCC1=CC=CC=C1 MCULE-1136231603 [1,0,0,0,0,0|1,0,0]=2 452 B11R1.91 CC(=O)CCC1=CN=CC=C1 MCULE-8978954109 [1,0,0,0,0,0|2,0,0]=3 453 B11R1.91 CC(=O)CCC1=NC=CC=C1 MCULE-2250801533 [1,0,0,0,0,0|2,0,0]=3 454 B11R1.91 CC(=O)COC1=CC=CC=C1 MCULE-8124389556 [1,0,0,0,0,0|2,0,0]=3 455 B11R1.91 CC(=O)COC1=NC=CC=C1 MCULE-9843455535 [1,0,0,0,0,0|3,0,0]=4 456 B11R1.91 CC(=O)CSC1=CC=CC=C1 MCULE-8704732850 [1,0,0,0,0,0|2,0,0]=3 457 B11R1.91 CC(=O)N=NC1=CC=CC=C1 MCULE-1771024632 [1,0,0,0,0,0|3,0,0]=4 458 B11R1.91 CC(=O)NCC1=CC=CC=C1 MCULE-2051924381 [1,0,0,0,0,0|2,0,0]=3 459 B11R1.91 CC(=O)NCC1=CC=NC=C1 MCULE-8645049472 [1,0,0,0,0,0|3,0,0]=4 460 B11R1.91 CC(=O)NCC1=CN=CC=C1 MCULE-8882042703 [1,0,0,0,0,0|3,0,0]=4 461 B11R1.91 CC(=O)NCC1=NC=CC=C1 MCULE-3133975600 [1,0,0,0,0,0|3,0,0]=4 462 B11R1.91 CC(=O)NCC1=NC=CC=C1 MCULE-5622133685 [1,0,0,0,0,0|3,0,0]=4 463 B11R1.91 CC(=O)NNC1=CC=CC=C1 MCULE-5989143063 [1,0,0,0,0,0|3,0,0]=4 464 B11R1.91 CC(=O)OCC1=CC=CC=C1 MCULE-7952998506 [1,0,0,0,0,0|2,0,0]=3 465 B11R1.91 CC(=O)OCC1=CC=NC=C1 MCULE-9787989740 [1,0,0,0,0,0|3,0,0]=4 466 B11R1.91 CC(=O)OCC1=NC=CC=C1 MCULE-8957630952 [1,0,0,0,0,0|3,0,0]=4 467 B11R1.91 CC(=O)O[I+]C1=CC=CC=C1 MCULE-2518875564 [1,0,0,0,0,0|3,0,0]=4 468 B11R1.91 CC(=O)O[I+]C1=CC=CC=C1 MCULE-5081261516 [1,0,0,0,0,0|3,0,0]=4 469 B11R1.91 CC(=O)SCC1=CC=CN=C1 MCULE-4536121931 [1,0,0,0,0,0|3,0,0]=4 470 B11R1.91 CC(=O)SCC1=NC=CC=C1 MCULE-5300068362 [1,0,0,0,0,0|3,0,0]=4 471 B11R1.91 CC(=O)SSC1=CC=CC=C1 MCULE-9410782409 [1,0,0,0,0,0|3,0,0]=4 472 B11R1.91 CC(=S)NCC1=CC=CC=C1 MCULE-3109655156 [1,0,0,0,0,0|2,1,0]=4 473 B11R1.91 CC(Br)CCC1=CC=CC=C1 MCULE-5033093327 [1,0,0,0,0,0|2,0,1]=4 474 B11R1.91 CC(C)CCC1=CC=CC=C1 MCULE-4070401105 [1,0,0,0,0,0|2,0,1]=4 475 B11R1.91 CC(N)CCC1=CC=CC=C1 MCULE-8780190200 [1,0,0,0,0,0|2,0,1]=4 476 B11R1.91 CC(O)CCC1=CC=CC=C1 MCULE-6593078697 [1,0,0,0,0,0|1,0,1]=3 477 B11R1.91 CC(O)CCC1=CC=CC=N1 MCULE-7087256380 [1,0,0,0,0,0|2,0,1]=4 478 B11R1.91 CC(O)CCC1=CN=CC=C1 MCULE-3486488840 [1,0,0,0,0,0|2,0,1]=4 479 B11R1.91 CC(O)CNC1=CC=CC=C1 MCULE-4909285117 [1,0,0,0,0,0|2,0,1]=4 480 B11R1.91 CC(O)COC1=CC=CC=C1 MCULE-7693044068 [1,0,0,0,0,0|2,0,1]=4 481 B11R1.91 CN(C)CCC1=CC=CC=C1 MCULE-1696230069 [1,0,0,0,0,0|3,0,0]=4 482 B11R1.91 CN(C)CCC1=CC=CC=C1 MCULE-7456671409 [1,0,0,0,0,0|3,0,0]=4 483 B11R1.91 C[C@@H](N)CCC1=CC=CC=C1 MCULE-3014014292 [1,0,0,0,0,0|2,0,1]=4 484 B11R1.91 C[C@@H](O)CCC1=CC=CC=C1 MCULE-6982217571 [1,0,0,0,0,0|1,0,1]=3 485 B11R1.91 C[C@@H](O)CCC1=CC=CC=C1 MCULE-9627887662 [1,0,0,0,0,0|1,0,1]=3 486 B11R1.91 C[C@H](N)CCC1=CC=CC=C1 MCULE-6029467007 [1,0,0,0,0,0|2,0,1]=4 487 B11R1.91 C[C@H](O)CCC1=CC=CC=C1 MCULE-3170440651 [1,0,0,0,0,0|1,0,1]=3 488 B11R1.91 N=C(N)CCC1=CC=CC=C1 MCULE-3670139370 [1,0,0,0,0,0|2,0,0]=3 489 B11R1.91 N=C(N)CCC1=CC=CC=C1 MCULE-9569405514 [1,0,0,0,0,0|2,0,0]=3 490 B11R1.91 N=C(N)CCC1=CN=CC=C1 MCULE-6283877498 [1,0,0,0,0,0|3,0,0]=4 491 B11R1.91 N=C(N)CCC1=NC=CC=C1 MCULE-8138398243 [1,0,0,0,0,0|3,0,0]=4 492 B11R1.91 N=C(N)CCC1=NC=CC=C1 MCULE-9220159999 [1,0,0,0,0,0|3,0,0]=4 493 B11R1.91 N=C(N)COC1=CC=CC=C1 MCULE-2324789233 [1,0,0,0,0,0|3,0,0]=4 494 B11R1.91 N=C(N)COC1=CC=CC=C1 MCULE-8412140796 [1,0,0,0,0,0|3,0,0]=4 495 B11R1.91 N=C(N)CSC1=CC=CC=C1 MCULE-3237560312 [1,0,0,0,0,0|3,0,0]=4 496 B11R1.91 N=C(N)CSC1=CC=CC=C1 MCULE-6891706369 [1,0,0,0,0,0|3,0,0]=4 497 B11R1.91 N=C(N)NCC1=CC=CC=C1 MCULE-1999057378 [1,0,0,0,0,0|3,0,0]=4 498 B11R1.91 N=C(N)NCC1=CC=CC=C1 MCULE-7043542693 [1,0,0,0,0,0|3,0,0]=4 499 B11R1.91 N=C(N)NCC1=CC=CC=C1 MCULE-8415890377 [1,0,0,0,0,0|3,0,0]=4 500 B11R1.91 N=C(N)OCC1=CC=CC=C1 MCULE-9880051094 [1,0,0,0,0,0|3,0,0]=4 501 B11R1.91 N=C(N)SCC1=CC=CC=C1 MCULE-2727300494 [1,0,0,0,0,0|3,0,0]=4 502 B11R1.91 N=C(N)SCC1=CC=CC=C1 MCULE-9265876579 [1,0,0,0,0,0|3,0,0]=4 503 B11R1.91 N=C(N)SCC1=CC=CC=C1 MCULE-9966047767 [1,0,0,0,0,0|3,0,0]=4 504 B11R1.91 NC(=NCC1=CC=CC=C1)N MCULE-7538846735 [1,0,0,0,0,0|3,0,0]=4 505 B11R1.91 NC(=O)/C=C/C1=CC=CC=C1 MCULE-1428301205 [1,0,0,0,0,0|1,0,2]=4 506 B11R1.91 NC(=O)C#CC1=CC=CC=C1 MCULE-2555027024 [1,0,0,0,0,0|1,0,2]=4 507 B11R1.91 NC(=O)C=CC1=CC=CC=C1 MCULE-9669016303 [1,0,0,0,0,0|1,0,2]=4 508 B11R1.91 NC(=O)CCC1=CC=CC=C1 MCULE-3588566414 [1,0,0,0,0,0|1,0,0]=2 509 B11R1.91 NC(=O)CCC1=CC=CN=C1 MCULE-9563578514 [1,0,0,0,0,0|2,0,0]=3 510 B11R1.91 NC(=O)CCC1=CC=NC=C1 MCULE-7075206346 [1,0,0,0,0,0|2,0,0]=3 511 B11R1.91 NC(=O)CCC1=CC=NC=N1 MCULE-1725058959 [1,0,0,0,0,0|3,0,0]=4 512 B11R1.91 NC(=O)CCC1=NC=CC=C1 MCULE-8837139984 [1,0,0,0,0,0|2,0,0]=3 513 B11R1.91 NC(=O)CCC1=NC=CC=N1 MCULE-3344072771 [1,0,0,0,0,0|3,0,0]=4 514 B11R1.91 NC(=O)CNC1=CC=CC=C1 MCULE-7476540506 [1,0,0,0,0,0|2,0,0]=3 515 B11R1.91 NC(=O)COC1=CC=CC=C1 MCULE-6625282279 [1,0,0,0,0,0|2,0,0]=3 516 B11R1.91 NC(=O)CSC1=CC=CC=C1 MCULE-3396189878 [1,0,0,0,0,0|2,0,0]=3 517 B11R1.91 NC(=O)CSC1=NC=CC=C1 MCULE-8820423914 [1,0,0,0,0,0|3,0,0]=4 518 B11R1.91 NC(=O)NCC1=CC=CC=C1 MCULE-8856820054 [1,0,0,0,0,0|2,0,0]=3 519 B11R1.91 NC(=O)NCC1=CN=CC=C1 MCULE-4904155902 [1,0,0,0,0,0|3,0,0]=4 520 B11R1.91 NC(=O)NCC1=NC=CC=C1 MCULE-8949422121 [1,0,0,0,0,0|3,0,0]=4 521 B11R1.91 NC(=O)NNC1=CC=CC=C1 MCULE-9005466152 [1,0,0,0,0,0|3,0,0]=4 522 B11R1.91 NC(=O)NNC1=CC=CC=C1 MCULE-9682434617 [1,0,0,0,0,0|3,0,0]=4 523 B11R1.91 NC(=O)OCC1=CC=CC=C1 MCULE-8357463584 [1,0,0,0,0,0|2,0,0]=3 524 B11R1.91 NC(=S)CCC1=CC=CC=C1 MCULE-8507623226 [1,0,0,0,0,0|1,1,0]=3 525 B11R1.91 NC(=S)CCC1=NC=CC=C1 MCULE-2696064625 [1,0,0,0,0,0|2,1,0]=4 526 B11R1.91 NC(=S)COC1=CC=CC=C1 MCULE-7627348027 [1,0,0,0,0,0|2,1,0]=4 527 B11R1.91 NC(=S)CSC1=CC=CC=C1 MCULE-4737917650 [1,0,0,0,0,0|2,1,0]=4 528 B11R1.91 NC(=S)NCC1=CC=CC=C1 MCULE-3106139297 [1,0,0,0,0,0|2,1,0]=4 529 B11R1.91 O=C(Cl)/C=C/C1=CC=CC=C1 MCULE-4421630248 [1,0,0,0,0,0|1,0,2]=4 530 B11R1.91 O=C(Cl)C#CC1=CC=CC=C1 MCULE-1508665847 [1,0,0,0,0,0|1,0,2]=4 531 B11R1.91 O=C(Cl)C=CC1=CC=CC=C1 MCULE-8583623904 [1,0,0,0,0,0|1,0,2]=4 532 B11R1.91 O=C(Cl)CCC1=CC=CC=C1 MCULE-2895233000 [1,0,0,0,0,0|1,0,0]=2 533 B11R1.91 O=C(Cl)CCC1=CN=CC=C1 MCULE-1586300353 [1,0,0,0,0,0|2,0,0]=3 534 B11R1.91 O=C(Cl)CNC1=CC=CC=C1 MCULE-1633452872 [1,0,0,0,0,0|2,0,0]=3 535 B11R1.91 O=C(Cl)COC1=CC=CC=C1 MCULE-9859987129 [1,0,0,0,0,0|2,0,0]=3 536 B11R1.91 O=C(Cl)CSC1=CC=CC=C1 MCULE-8287615777 [1,0,0,0,0,0|2,0,0]=3 537 B11R1.91 O=C(Cl)CSC1=CC=NC=C1 MCULE-2006129331 [1,0,0,0,0,0|3,0,0]=4 538 B11R1.91 O=C(Cl)CSC1=CC=NC=C1 MCULE-4156257104 [1,0,0,0,0,0|3,0,0]=4 539 B11R1.91 O=C(Cl)CSC1=NC=CC=C1 MCULE-3492291546 [1,0,0,0,0,0|3,0,0]=4 540 B11R1.91 O=C(Cl)CSC1=NC=CC=C1 MCULE-4472512319 [1,0,0,0,0,0|3,0,0]=4 541 B11R1.91 O=C(Cl)OCC1=CC=CC=C1 MCULE-3541425724 [1,0,0,0,0,0|2,0,0]=3 542 B11R1.91 O=C(Cl)OCC1=CN=CC=C1 MCULE-1746574828 [1,0,0,0,0,0|3,0,0]=4 543 B11R1.91 O=C(Cl)OCC1=CN=CC=C1 MCULE-8566293910 [1,0,0,0,0,0|3,0,0]=4 544 B11R1.91 O=C(O)/C=C/C1=CC=CC=C1 MCULE-1077406303 [1,0,0,0,0,0|0,0,2]=3 545 B11R1.91 O=C(O)/C=C/C1=CC=NC=C1 MCULE-7372485168 [1,0,0,0,0,0|1,0,2]=4 546 B11R1.91 O=C(O)/C=C/C1=CN=CC=C1 MCULE-7325423443 [1,0,0,0,0,0|1,0,2]=4 547 B11R1.91 O=C(O)/C=C/C1=NC=CC=C1 MCULE-3136346884 [1,0,0,0,0,0|1,0,2]=4 548 B11R1.91 O=C(O)C#CC1=CC=CC=C1 MCULE-1724525388 [1,0,0,0,0,0|0,0,2]=3 549 B11R1.91 O=C(O)C#CC1=CC=CN=C1 MCULE-5191116080 [1,0,0,0,0,0|1,0,2]=4 550 B11R1.91 O=C(O)C#CC1=CC=NC=C1 MCULE-3386541534 [1,0,0,0,0,0|1,0,2]=4 551 B11R1.91 O=C(O)C#CC1=NC=CC=C1 MCULE-6583868222 [1,0,0,0,0,0|1,0,2]=4 552 B11R1.91 O=C(O)C=CC1=CC=CC=C1 MCULE-4051659199 [1,0,0,0,0,0|0,0,2]=3 553 B11R1.91 O=C(O)C=CC1=CC=NC=C1 MCULE-1159332612 [1,0,0,0,0,0|1,0,2]=4 554 B11R1.91 O=C(O)C=CC1=CN=CC=C1 MCULE-8996562963 [1,0,0,0,0,0|1,0,2]=4 555 B11R1.91 O=C(O)C=CC1=NC=CC=C1 MCULE-8328935452 [1,0,0,0,0,0|1,0,2]=4 556 B11R1.91 O=C(O)C=C[N+]1=CC=CC=C1 MCULE-1063030896 [1,0,0,0,0,0|1,0,2]=4 557 B11R1.91 O=C(O)C=C[N+]1=CC=CC=C1 MCULE-9365726596 [1,0,0,0,0,0|1,0,2]=4 558 B11R1.91 O=C(O)CCC1=CC=CC=C1 MCULE-1670073750 [1,0,0,0,0,0|0,0,0]=1 559 B11R1.91 O=C(O)CCC1=CC=CC=N1 MCULE-7798422459 [1,0,0,0,0,0|1,0,0]=2 560 B11R1.91 O=C(O)CCC1=CC=NC=C1 MCULE-4931237552 [1,0,0,0,0,0|1,0,0]=2 561 B11R1.91 O=C(O)CCC1=CC=NN=C1 MCULE-4137232331 [1,0,0,0,0,0|2,0,0]=3 562 B11R1.91 O=C(O)CCC1=CN=CC=C1 MCULE-9809125467 [1,0,0,0,0,0|1,0,0]=2 563 B11R1.91 O=C(O)CCC1=CN=CN=C1 MCULE-4847571821 [1,0,0,0,0,0|2,0,0]=3 564 B11R1.91 O=C(O)CCC1=NC=CC=C1 MCULE-3850875705 [1,0,0,0,0,0|1,0,0]=2 565 B11R1.91 O=C(O)CCC1=NC=CC=C1 MCULE-7947562908 [1,0,0,0,0,0|1,0,0]=2 566 B11R1.91 O=C(O)CCC1=NC=CC=N1 MCULE-6402169801 [1,0,0,0,0,0|2,0,0]=3 567 B11R1.91 O=C(O)CCC1=NC=CN=C1 MCULE-1475251267 [1,0,0,0,0,0|2,0,0]=3 568 B11R1.91 O=C(O)CCC1=NC=NC=C1 MCULE-1053932202 [1,0,0,0,0,0|2,0,0]=3 569 B11R1.91 O=C(O)CCC1=NN=CC=C1 MCULE-2530115442 [1,0,0,0,0,0|2,0,0]=3 570 B11R1.91 O=C(O)CNC1=CC=CC=C1 MCULE-4813130378 [1,0,0,0,0,0|1,0,0]=2 571 B11R1.91 O=C(O)CNC1=CC=CN=C1 MCULE-1578102322 [1,0,0,0,0,0|2,0,0]=3 572 B11R1.91 O=C(O)CNC1=CC=CN=C1 MCULE-6139247264 [1,0,0,0,0,0|2,0,0]=3 573 B11R1.91 O=C(O)CNC1=CC=NC=C1 MCULE-3150988193 [1,0,0,0,0,0|2,0,0]=3 574 B11R1.91 O=C(O)CNC1=CC=NC=C1 MCULE-6561822983 [1,0,0,0,0,0|2,0,0]=3 575 B11R1.91 O=C(O)CNC1=NC=CC=C1 MCULE-5066813794 [1,0,0,0,0,0|2,0,0]=3 576 B11R1.91 O=C(O)CNC1=NC=CC=C1 MCULE-5626569031 [1,0,0,0,0,0|2,0,0]=3 577 B11R1.91 O=C(O)CNC1=NC=CC=N1 MCULE-1554989372 [1,0,0,0,0,0|3,0,0]=4 578 B11R1.91 O=C(O)COC1=CC=CC=C1 MCULE-5625991303 [1,0,0,0,0,0|1,0,0]=2 579 B11R1.91 O=C(O)COC1=CC=CC=N1 MCULE-4844717094 [1,0,0,0,0,0|2,0,0]=3 580 B11R1.91 O=C(O)COC1=CC=NC=C1 MCULE-5903809736 [1,0,0,0,0,0|2,0,0]=3 581 B11R1.91 O=C(O)COC1=CN=CC=C1 MCULE-1733906903 [1,0,0,0,0,0|2,0,0]=3 582 B11R1.91 O=C(O)COC1=CN=CC=C1 MCULE-2439507515 [1,0,0,0,0,0|2,0,0]=3 583 B11R1.91 O=C(O)COC1=CN=CC=C1 MCULE-3978081968 [1,0,0,0,0,0|2,0,0]=3 584 B11R1.91 O=C(O)COC1=NC=CC=C1 MCULE-2958185004 [1,0,0,0,0,0|2,0,0]=3 585 B11R1.91 O=C(O)COC1=NC=CC=N1 MCULE-4203130703 [1,0,0,0,0,0|3,0,0]=4 586 B11R1.91 O=C(O)COC1=NN=CC=C1 MCULE-3500815204 [1,0,0,0,0,0|3,0,0]=4 587 B11R1.91 O=C(O)CSC1=CC=CC=C1 MCULE-4616509502 [1,0,0,0,0,0|1,0,0]=2 588 B11R1.91 O=C(O)CSC1=CC=NC=C1 MCULE-7699690938 [1,0,0,0,0,0|2,0,0]=3 589 B11R1.91 O=C(O)CSC1=CC=NC=N1 MCULE-7593533042 [1,0,0,0,0,0|3,0,0]=4 590 B11R1.91 O=C(O)CSC1=NC=CC=C1 MCULE-3224679092 [1,0,0,0,0,0|2,0,0]=3 591 B11R1.91 O=C(O)CSC1=NC=CC=N1 MCULE-2881527695 [1,0,0,0,0,0|3,0,0]=4 592 B11R1.91 O=C(O)CSC1=NN=CC=C1 MCULE-1473695413 [1,0,0,0,0,0|3,0,0]=4 593 B11R1.91 O=C([O-])/C=C/C1=CC=CC=C1 MCULE-3275895563 [1,0,0,0,0,0|0,0,3]=4 594 B11R1.91 O=C([O-])/C=C/C1=CC=CC=C1 MCULE-6688127943 [1,0,0,0,0,0|0,0,3]=4 595 B11R1.91 O=C([O-])C#CC1=CC=CC=C1 MCULE-7408380200 [1,0,0,0,0,0|0,0,3]=4 596 B11R1.91 O=C([O-])C=CC1=CC=CC=C1 MCULE-7412134653 [1,0,0,0,0,0|0,0,3]=4 597 B11R1.91 O=C([O-])CCC1=CC=CC=C1 MCULE-5708877330 [1,0,0,0,0,0|0,0,1]=2 598 B11R1.91 O=C([O-])CNC1=CC=CC=C1 MCULE-9404328653 [1,0,0,0,0,0|1,0,1]=3 599 B11R1.91 O=C([O-])COC1=CC=CC=C1 MCULE-2112503384 [1,0,0,0,0,0|1,0,1]=3 600 B11R1.91 O=C([O-])COC1=NC=CC=C1 MCULE-7533065514 [1,0,0,0,0,0|2,0,1]=4 601 B11R1.91 O=N(=O)CCC1=CC=CC=C1 MCULE-3728059699 [1,0,0,0,0,0|1,0,1]=3 602 B11R1.91 O=P([O-])CCC1=CC=NC=C1 MCULE-6727134567 [1,0,0,0,0,0|2,0,1]=4 603 B11R1.91 O=P([O-])CCC1=CC=NC=C1 MCULE-8132655069 [1,0,0,0,0,0|2,0,1]=4 604 B11R1.91 OB(O)CCC1=CC=CC=C1 MCULE-5105757901 [1,0,0,0,0,0|1,0,1]=3 605 B11R1.91 S=C(S)NCC1=CC=CC=C1 MCULE-7358133493 [1,0,0,0,0,0|1,2,0]=4 606 B11R1.91 S=C([S-])NCC1=CC=CC=C1 MCULE-9039728767 [1,0,0,0,0,0|1,2,0]=4 607 B11R1.91 [C@@H](C)(O)CCC1=CC=CC=C1 MCULE-4848287986 [1,0,0,0,0,0|1,0,1]=3 608 B11R1.91 [C@H](C)(N)CCC1=CC=CC=C1 MCULE-2541579869 [1,0,0,0,0,0|2,0,1]=4 609 B13R1.3 C#CC1=CC=C(C=C1)CCC(=O)O MCULE-5589526715 [0,1,0,0,0,0|1,0,0]=2 610 B13R1.3 C#CC1=CC=C(C=C1)CSC(=O)C MCULE-5595981815 [0,1,0,0,0,0|3,0,0]=4 611 B13R1.3 C#CC1=CC=C(C=C1)OCC(=O)O MCULE-5020938168 [0,1,0,0,0,0|2,0,0]=3 612 B13R1.3 C=C(Br)CCC1=CC=C(C=C1)C#N MCULE-8770970212 [0,1,0,0,0,0|2,0,1]=4 613 B13R1.3 C=C(Br)CCC1=CC=C(C=C1)OC MCULE-3867220286 [0,1,0,0,0,0|3,0,0]=4 614 B13R1.3 C=C(C)CCC1=CC=C(C=C1)C#N MCULE-9760093085 [0,1,0,0,0,0|2,0,1]=4 615 B13R1.3 C=C(C)CCC1=CC=C(C=C1)CC MCULE-9734268016 [0,1,0,0,0,0|3,0,0]=4 616 B13R1.3 C=C(C)CCC1=CC=C(C=C1)OC MCULE-2764148213 [0,1,0,0,0,0|3,0,0]=4 617 B13R1.3 C=C(C)CCC1=CC=C(C=C1)SC MCULE-8764822376 [0,1,0,0,0,0|3,0,0]=4 618 B13R1.3 C=C(Cl)CCC1=CC=C(C=C1)C#N MCULE-1466328035 [0,1,0,0,0,0|2,0,1]=4 619 B13R1.3 C=C(Cl)CCC1=CC=C(C=C1)OC MCULE-6154587935 [0,1,0,0,0,0|3,0,0]=4 620 B13R1.3 C=CC1=CC=C(C=C1)COC(=O)C MCULE-6926504682 [0,1,0,0,0,0|3,0,0]=4 621 B13R1.3 CC(=O)NCC1=CC=C(C=C1)C#N MCULE-1806027249 [0,1,0,0,0,0|2,0,1]=4 622 B13R1.3 CC(=O)NCC1=CC=C(C=C1)CCl MCULE-4577805547 [0,1,0,0,0,0|3,0,0]=4 623 B13R1.3 CC(=O)NCC1=CC=C(C=C1)CN MCULE-3064536101 [0,1,0,0,0,0|2,0,0]=3 624 B13R1.3 CC(=O)OCC1=CC=C(C=C1)C#N MCULE-4273299055 [0,1,0,0,0,0|2,0,1]=4 625 B13R1.3 CCC1=CC=C(C=C1)/C=C/C(=O)O MCULE-3685032116 [0,1,0,0,0,0|1,0,2]=4 626 B13R1.3 CCC1=CC=C(C=C1)C#CC(=O)O MCULE-6813022312 [0,1,0,0,0,0|1,0,2]=4 627 B13R1.3 CCC1=CC=C(C=C1)C=CC(=O)O MCULE-2720585827 [0,1,0,0,0,0|1,0,2]=4 628 B13R1.3 CCC1=CC=C(C=C1)CCC(=O)O MCULE-2110019416 [0,1,0,0,0,0|1,0,0]=2 629 B13R1.3 CCC1=CC=C(C=C1)OCC(=O)Cl MCULE-8818140025 [0,1,0,0,0,0|3,0,0]=4 630 B13R1.3 CCC1=CC=C(C=C1)OCC(=O)N MCULE-1337994961 [0,1,0,0,0,0|3,0,0]=4 631 B13R1.3 CCC1=CC=C(C=C1)OCC(=O)O MCULE-1934779223 [0,1,0,0,0,0|2,0,0]=3 632 B13R1.3 CCC1=CN=C(C=C1)CCC(=O)C MCULE-4709117893 [0,1,0,0,0,0|3,0,0]=4 633 B13R1.3 CN(C)CCC1=CC=C(C=C1)CN MCULE-4324824267 [0,1,0,0,0,0|3,0,0]=4 634 B13R1.3 COC1=CC=C(C=C1)/C=C/C(=O)O MCULE-6993960877 [0,1,0,0,0,0|1,0,2]=4 635 B13R1.3 COC1=CC=C(C=C1)C#CC(=O)O MCULE-8139724004 [0,1,0,0,0,0|1,0,2]=4 636 B13R1.3 COC1=CC=C(C=C1)C=CC(=O)O MCULE-4456423689 [0,1,0,0,0,0|1,0,2]=4 637 B13R1.3 COC1=CC=C(C=C1)CCC(=O)C MCULE-5951016256 [0,1,0,0,0,0|2,0,0]=3 638 B13R1.3 COC1=CC=C(C=C1)CCC(=O)Cl MCULE-1305857004 [0,1,0,0,0,0|2,0,0]=3 639 B13R1.3 COC1=CC=C(C=C1)CCC(=O)N MCULE-5374679110 [0,1,0,0,0,0|2,0,0]=3 640 B13R1.3 COC1=CC=C(C=C1)CCC(=O)O MCULE-1674311204 [0,1,0,0,0,0|1,0,0]=2 641 B13R1.3 COC1=CC=C(C=C1)CCC(=O)[O-] MCULE-7823760413 [0,1,0,0,0,0|1,0,1]=3 642 B13R1.3 COC1=CC=C(C=C1)CCC(C)O MCULE-5408346161 [0,1,0,0,0,0|2,0,1]=4 643 B13R1.3 COC1=CC=C(C=C1)CNC(=O)C MCULE-9545701688 [0,1,0,0,0,0|3,0,0]=4 644 B13R1.3 COC1=CC=C(C=C1)CNC(=O)N MCULE-4222293256 [0,1,0,0,0,0|3,0,0]=4 645 B13R1.3 COC1=CC=C(C=C1)CNC(=S)O MCULE-1562908189 [0,1,0,0,0,0|2,1,0]=4 646 B13R1.3 COC1=CC=C(C=C1)COC(=O)C MCULE-2255812947 [0,1,0,0,0,0|3,0,0]=4 647 B13R1.3 COC1=CC=C(C=C1)COC(=O)Cl MCULE-3261665339 [0,1,0,0,0,0|3,0,0]=4 648 B13R1.3 COC1=CC=C(C=C1)NCC(=O)O MCULE-7179149062 [0,1,0,0,0,0|2,0,0]=3 649 B13R1.3 COC1=CC=C(C=C1)OCC(=O)C MCULE-8735891948 [0,1,0,0,0,0|3,0,0]=4 650 B13R1.3 COC1=CC=C(C=C1)OCC(=O)Cl MCULE-8290511391 [0,1,0,0,0,0|3,0,0]=4 651 B13R1.3 COC1=CC=C(C=C1)OCC(=O)N MCULE-3579876699 [0,1,0,0,0,0|3,0,0]=4 652 B13R1.3 COC1=CC=C(C=C1)OCC(=O)O MCULE-3881661052 [0,1,0,0,0,0|2,0,0]=3 653 B13R1.3 COC1=CC=C(C=C1)SCC(=O)C MCULE-5660062810 [0,1,0,0,0,0|3,0,0]=4 654 B13R1.3 COC1=CC=C(C=C1)SCC(=O)N MCULE-2698425796 [0,1,0,0,0,0|3,0,0]=4 655 B13R1.3 COC1=CC=C(C=C1)SCC(=O)O MCULE-8573257372 [0,1,0,0,0,0|2,0,0]=3 656 B13R1.3 COC1=NC=C(C=C1)CCC(=O)O MCULE-9807840022 [0,1,0,0,0,0|2,0,0]=3 657 B13R1.3 CSC1=CC=C(C=C1)/C=C/C(=O)O MCULE-6324671016 [0,1,0,0,0,0|1,0,2]=4 658 B13R1.3 CSC1=CC=C(C=C1)C#CC(=O)O MCULE-9481102838 [0,1,0,0,0,0|1,0,2]=4 659 B13R1.3 CSC1=CC=C(C=C1)C=CC(=O)O MCULE-9285137157 [0,1,0,0,0,0|1,0,2]=4 660 B13R1.3 CSC1=CC=C(C=C1)CCC(=O)O MCULE-9755721169 [0,1,0,0,0,0|1,0,0]=2 661 B13R1.3 CSC1=CC=C(C=C1)OCC(=O)O MCULE-9073748724 [0,1,0,0,0,0|2,0,0]=3 662 B13R1.3 N#CC1=CC=C(C=C1)/C=C/C(=O)O MCULE-4484869195 [0,1,0,0,0,0|0,0,3]=4 663 B13R1.3 N#CC1=CC=C(C=C1)C=CC(=O)O MCULE-9879860446 [0,1,0,0,0,0|0,0,3]=4 664 B13R1.3 N#CC1=CC=C(C=C1)CCC(=O)O MCULE-6891261134 [0,1,0,0,0,0|0,0,1]=2 665 B13R1.3 N#CC1=CC=C(C=C1)CNC(=O)N MCULE-5239078431 [0,1,0,0,0,0|2,0,1]=4 666 B13R1.3 N#CC1=CC=C(C=C1)NCC(=O)O MCULE-6156960439 [0,1,0,0,0,0|1,0,1]=3 667 B13R1.3 N#CC1=CC=C(C=C1)OCC(=O)N MCULE-6270032077 [0,1,0,0,0,0|2,0,1]=4 668 B13R1.3 N#CC1=CC=C(C=C1)OCC(=O)O MCULE-1619496132 [0,1,0,0,0,0|1,0,1]=3 669 B13R1.3 N#CC1=CC=C(C=C1)SCC(=O)O MCULE-5271203534 [0,1,0,0,0,0|1,0,1]=3 670 B13R1.3 N#CC1=CN=C(C=C1)NCC(=O)O MCULE-9247766283 [0,1,0,0,0,0|2,0,1]=4 671 B13R1.3 NC(=O)CCC1=CC=C(C=C1)C=O MCULE-6927921646 [0,1,0,0,0,0|2,0,0]=3 672 B13R1.3 NC(=O)COC1=CC=C(C=C1)C=O MCULE-1657662911 [0,1,0,0,0,0|3,0,0]=4 673 B13R1.3 NC(=O)COC1=CC=C(C=C1)CCl MCULE-4742479745 [0,1,0,0,0,0|3,0,0]=4 674 B13R1.3 NCC1=CC=C(C=C1)CCC(=O)O MCULE-3166710921 [0,1,0,0,0,0|0,0,0]=1 675 B13R1.3 NCC1=CC=C(C=C1)CCC(=O)O MCULE-3624977655 [0,1,0,0,0,0|0,0,0]=1 676 B13R1.3 NCC1=CC=C(C=C1)OCC(=O)N MCULE-2362110542 [0,1,0,0,0,0|2,0,0]=3 677 B13R1.3 NNC1=CC=C(C=C1)CCC(=O)O MCULE-1705612417 [0,1,0,0,0,0|0,0,0]=1 678 B13R1.3 NNC1=CC=C(C=C1)CCC(=O)O MCULE-2881336886 [0,1,0,0,0,0|0,0,0]=1 679 B13R1.3 O=C(O)/C=C/C1=CC=C(C=C1)CBr MCULE-9998924523 [0,1,0,0,0,0|1,0,2]=4 680 B13R1.3 O=C(O)C=CC1=CC=C(C=C1)CBr MCULE-1604768230 [0,1,0,0,0,0|1,0,2]=4 681 B13R1.3 O=C(O)CCC1=CC=C(C=C1)CO MCULE-1979680062 [0,1,0,0,0,0|1,0,0]=2 682 B13R1.3 O=C(O)COC1=CC=C(C=C1)CBr MCULE-4096571478 [0,1,0,0,0,0|2,0,0]=3 683 B13R1.3 O=C(O)COC1=CC=C(C=C1)CO MCULE-4472330611 [0,1,0,0,0,0|2,0,0]=3 684 B13R1.3 O=CC1=CC=C(C=C1)/C=C/C(=O)O MCULE-5017170189 [0,1,0,0,0,0|1,0,2]=4 685 B13R1.3 O=CC1=CC=C(C=C1)C=CC(=O)O MCULE-2468143780 [0,1,0,0,0,0|1,0,2]=4 686 B13R1.3 O=CC1=CC=C(C=C1)CCC(=O)O MCULE-8265326595 [0,1,0,0,0,0|1,0,0]=2 687 B13R1.3 O=CC1=CC=C(C=C1)OCC(=O)O MCULE-9498358536 [0,1,0,0,0,0|2,0,0]=3 688 B13R1.14 C/C(=N\O)/COC1=CC=C(C=C1)Cl MCULE-5070086409 [0,1,0,0,0,0|3,0,0]=4 689 B13R1.14 C=CC(=O)NCC1=CC=C(C=C1)C MCULE-8540966859 [0,1,0,0,0,0|3,0,0]=4 690 B13R1.14 C=CC(=O)NCC1=CC=C(C=C1)Cl MCULE-9981060534 [0,1,0,0,0,0|3,0,0]=4 691 B13R1.14 C=CC(=O)NCC1=CC=C(C=C1)F MCULE-6446062664 [0,1,0,0,0,0|3,0,0]=4 692 B13R1.14 CC(=NO)COC1=CC=C(C=C1)Cl MCULE-4634565615 [0,1,0,0,0,0|3,0,0]=4 693 B13R1.14 CC1=CC=C(C=C1)CNC(=O)CBr MCULE-9377422178 [0,1,0,0,0,0|3,0,0]=4 694 B13R1.14 CC1=CC=C(C=C1)CNC(=O)CCl MCULE-3140032458 [0,1,0,0,0,0|3,0,0]=4 695 B13R1.14 CC1=CC=C(C=C1)CNC(=O)CN MCULE-4224389748 [0,1,0,0,0,0|3,0,0]=4 696 B13R1.14 CC1=CC=C(C=C1)NCC(=O)NN MCULE-2147161509 [0,1,0,0,0,0|3,0,0]=4 697 B13R1.14 CC1=CC=C(C=C1)OC/C(=N/O)/N MCULE-9785394592 [0,1,0,0,0,0|3,0,0]=4 698 B13R1.14 CC1=CC=C(C=C1)OCC(=O)NN MCULE-7083975000 [0,1,0,0,0,0|3,0,0]=4 699 B13R1.14 CC1=CC=C(C=C1)SCC(=O)NN MCULE-3043603645 [0,1,0,0,0,0|3,0,0]=4 700 B13R1.14 CCC(=O)CCC1=CC=C(C=C1)Br MCULE-3164620786 [0,1,0,0,0,0|2,0,0]=3 701 B13R1.14 CCC(=O)CSC1=CC=C(C=C1)Cl MCULE-5134003532 [0,1,0,0,0,0|3,0,0]=4 702 B13R1.14 CCC(=O)NCC1=CC=C(C=C1)Cl MCULE-7979444887 [0,1,0,0,0,0|3,0,0]=4 703 B13R1.14 CCC(=O)NCC1=CC=C(C=C1)F MCULE-4662288661 [0,1,0,0,0,0|3,0,0]=4 704 B13R1.14 CCN(C)CCC1=CC=C(C=C1)N MCULE-7987075481 [0,1,0,0,0,0|3,0,0]=4 705 B13R1.14 CNC(=O)/C=C/C1=CC=C(C=C1)N MCULE-3040998659 [0,1,0,0,0,0|1,0,2]=4 706 B13R1.14 CNC(=O)C=CC1=CC=C(C=C1)N MCULE-7627843859 [0,1,0,0,0,0|1,0,2]=4 707 B13R1.14 CNC(=O)CCC1=CC=C(C=C1)Br MCULE-4424848386 [0,1,0,0,0,0|2,0,0]=3 708 B13R1.14 CNC(=O)CCC1=CC=C(C=C1)F MCULE-2542266742 [0,1,0,0,0,0|2,0,0]=3 709 B13R1.14 CNC(=O)CCC1=CC=C(C=C1)I MCULE-6579241766 [0,1,0,0,0,0|2,0,0]=3 710 B13R1.14 CNC(=O)CCC1=CC=C(C=C1)N MCULE-1659440351 [0,1,0,0,0,0|1,0,0]=2 711 B13R1.14 CNC(=O)COC1=CC=C(C=C1)Br MCULE-5767843822 [0,1,0,0,0,0|3,0,0]=4 712 B13R1.14 CNC(=O)COC1=CC=C(C=C1)C MCULE-2377786398 [0,1,0,0,0,0|3,0,0]=4 713 B13R1.14 CNC(=O)COC1=CC=C(C=C1)N MCULE-9754283442 [0,1,0,0,0,0|2,0,0]=3 714 B13R1.14 CNC(=O)COC1=CC=C(C=C1)O MCULE-8005524261 [0,1,0,0,0,0|3,0,0]=4 715 B13R1.14 CNC(=O)CSC1=CC=C(C=C1)Cl MCULE-8676028396 [0,1,0,0,0,0|3,0,0]=4 716 B13R1.14 CNC(=O)NCC1=CC=C(C=C1)Cl MCULE-5979202859 [0,1,0,0,0,0|3,0,0]=4 717 B13R1.14 CNC(=O)NCC1=CC=C(C=C1)F MCULE-8421753667 [0,1,0,0,0,0|3,0,0]=4 718 B13R1.14 CNC(=O)NCC1=CC=C(C=C1)I MCULE-1127551367 [0,1,0,0,0,0|3,0,0]=4 719 B13R1.14 CNC(=O)OCC1=CC=C(C=C1)Cl MCULE-4360706278 [0,1,0,0,0,0|3,0,0]=4 720 B13R1.14 COC(=O)/C=C/C1=CC=C(C=C1)Br MCULE-5724910797 [0,1,0,0,0,0|1,0,2]=4 721 B13R1.14 COC(=O)/C=C/C1=CC=C(C=C1)C MCULE-3907582871 [0,1,0,0,0,0|1,0,2]=4 722 B13R1.14 COC(=O)/C=C/C1=CC=C(C=C1)Cl MCULE-1058303485 [0,1,0,0,0,0|1,0,2]=4 723 B13R1.14 COC(=O)/C=C/C1=CC=C(C=C1)F MCULE-9171784241 [0,1,0,0,0,0|1,0,2]=4 724 B13R1.14 COC(=O)/C=C/C1=CC=C(C=C1)O MCULE-8717776291 [0,1,0,0,0,0|1,0,2]=4 725 B13R1.14 COC(=O)/C=C\C1=CC=C(C=C1)O MCULE-5533869815 [0,1,0,0,0,0|1,0,2]=4 726 B13R1.14 COC(=O)C#CC1=CC=C(C=C1)Br MCULE-2822585235 [0,1,0,0,0,0|1,0,2]=4 727 B13R1.14 COC(=O)C#CC1=CC=C(C=C1)C MCULE-1359667888 [0,1,0,0,0,0|1,0,2]=4 728 B13R1.14 COC(=O)C#CC1=CC=C(C=C1)Cl MCULE-4641449375 [0,1,0,0,0,0|1,0,2]=4 729 B13R1.14 COC(=O)C#CC1=CC=C(C=C1)F MCULE-5253676516 [0,1,0,0,0,0|1,0,2]=4 730 B13R1.14 COC(=O)C=CC1=CC=C(C=C1)Br MCULE-6282370868 [0,1,0,0,0,0|1,0,2]=4 731 B13R1.14 COC(=O)C=CC1=CC=C(C=C1)C MCULE-2475203381 [0,1,0,0,0,0|1,0,2]=4 732 B13R1.14 COC(=O)C=CC1=CC=C(C=C1)Cl MCULE-9413133594 [0,1,0,0,0,0|1,0,2]=4 733 B13R1.14 COC(=O)C=CC1=CC=C(C=C1)F MCULE-1509564336 [0,1,0,0,0,0|1,0,2]=4 734 B13R1.14 COC(=O)C=CC1=CC=C(C=C1)N MCULE-7692368161 [0,1,0,0,0,0|0,0,2]=3 735 B13R1.14 COC(=O)C=CC1=CC=C(C=C1)O MCULE-7654618031 [0,1,0,0,0,0|1,0,2]=4 736 B13R1.14 COC(=O)C=CC1=CN=C(C=C1)N MCULE-8732984745 [0,1,0,0,0,0|1,0,2]=4 737 B13R1.14 COC(=O)CCC1=CC=C(C=C1)Br MCULE-1468234134 [0,1,0,0,0,0|1,0,0]=2 738 B13R1.14 COC(=O)CCC1=CC=C(C=C1)C MCULE-1613073764 [0,1,0,0,0,0|1,0,0]=2 739 B13R1.14 COC(=O)CCC1=CC=C(C=C1)Cl MCULE-6407005406 [0,1,0,0,0,0|1,0,0]=2 740 B13R1.14 COC(=O)CCC1=CC=C(C=C1)F MCULE-7006332083 [0,1,0,0,0,0|1,0,0]=2 741 B13R1.14 COC(=O)CCC1=CC=C(C=C1)I MCULE-8866758914 [0,1,0,0,0,0|1,0,0]=2 742 B13R1.14 COC(=O)CCC1=CC=C(C=C1)N MCULE-7611051758 [0,1,0,0,0,0|0,0,0]=1 743 B13R1.14 COC(=O)CCC1=CC=C(C=C1)N MCULE-9913688915 [0,1,0,0,0,0|0,0,0]=1 744 B13R1.14 COC(=O)CCC1=CC=C(C=C1)O MCULE-3632791623 [0,1,0,0,0,0|1,0,0]=2 745 B13R1.14 COC(=O)CCC1=CC=C(N=C1)N MCULE-2161987854 [0,1,0,0,0,0|1,0,0]=2 746 B13R1.14 COC(=O)CCC1=CN=C(N=C1)N MCULE-2513912837 [0,1,0,0,0,0|2,0,0]=3 747 B13R1.14 COC(=O)CNC1=CC=C(C=C1)Br MCULE-9522030585 [0,1,0,0,0,0|2,0,0]=3 748 B13R1.14 COC(=O)CNC1=CC=C(C=C1)C MCULE-4843512949 [0,1,0,0,0,0|2,0,0]=3 749 B13R1.14 COC(=O)CNC1=CC=C(C=C1)Cl MCULE-2074484739 [0,1,0,0,0,0|2,0,0]=3 750 B13R1.14 COC(=O)CNC1=CC=C(C=C1)Cl MCULE-6481645716 [0,1,0,0,0,0|2,0,0]=3 751 B13R1.14 COC(=O)CNC1=CC=C(C=C1)F MCULE-1143419416 [0,1,0,0,0,0|2,0,0]=3 752 B13R1.14 COC(=O)CNC1=CC=C(C=C1)O MCULE-1747138706 [0,1,0,0,0,0|2,0,0]=3 753 B13R1.14 COC(=O)CNC1=CC=C(C=C1)O MCULE-8643592641 [0,1,0,0,0,0|2,0,0]=3 754 B13R1.14 COC(=O)CNC1=NC=C(C=C1)Br MCULE-5366830533 [0,1,0,0,0,0|3,0,0]=4 755 B13R1.14 COC(=O)COC1=CC=C(C=C1)Br MCULE-6897052509 [0,1,0,0,0,0|2,0,0]=3 756 B13R1.14 COC(=O)COC1=CC=C(C=C1)C MCULE-2337389496 [0,1,0,0,0,0|2,0,0]=3 757 B13R1.14 COC(=O)COC1=CC=C(C=C1)Cl MCULE-3738417589 [0,1,0,0,0,0|2,0,0]=3 758 B13R1.14 COC(=O)COC1=CC=C(C=C1)F MCULE-2112895953 [0,1,0,0,0,0|2,0,0]=3 759 B13R1.14 COC(=O)COC1=CC=C(C=C1)I MCULE-7402962834 [0,1,0,0,0,0|2,0,0]=3 760 B13R1.14 COC(=O)COC1=CC=C(C=C1)N MCULE-4647021439 [0,1,0,0,0,0|1,0,0]=2 761 B13R1.14 COC(=O)COC1=CC=C(C=C1)N MCULE-8742486597 [0,1,0,0,0,0|1,0,0]=2 762 B13R1.14 COC(=O)COC1=CC=C(C=C1)O MCULE-8336452434 [0,1,0,0,0,0|2,0,0]=3 763 B13R1.14 COC(=O)COC1=CC=C(N=C1)F MCULE-8588990686 [0,1,0,0,0,0|3,0,0]=4 764 B13R1.14 COC(=O)COC1=CN=C(C=C1)Cl MCULE-9788955247 [0,1,0,0,0,0|3,0,0]=4 765 B13R1.14 COC(=O)COC1=NC=C(C=C1)Br MCULE-9679030045 [0,1,0,0,0,0|3,0,0]=4 766 B13R1.14 COC(=O)CSC1=CC=C(C=C1)C MCULE-3125051219 [0,1,0,0,0,0|2,0,0]=3 767 B13R1.14 COC(=O)CSC1=CC=C(C=C1)Cl MCULE-6718821450 [0,1,0,0,0,0|2,0,0]=3 768 B13R1.14 COC(=O)CSC1=CC=C(C=C1)N MCULE-1458518364 [0,1,0,0,0,0|1,0,0]=2 769 B13R1.14 COC(=O)CSC1=CC=C(C=C1)O MCULE-1215642980 [0,1,0,0,0,0|2,0,0]=3 770 B13R1.14 COC(=O)NCC1=CC=C(C=C1)Cl MCULE-1320029694 [0,1,0,0,0,0|2,0,0]=3 771 B13R1.14 COC(=O)NCC1=CC=C(C=C1)N MCULE-9960137532 [0,1,0,0,0,0|1,0,0]=2 772 B13R1.14 N/C(=N/O)/CSC1=CC=C(C=C1)Cl MCULE-9381318207 [0,1,0,0,0,0|3,0,0]=4 773 B13R1.14 N/C(=N\O)/COC1=CC=C(C=C1)Br MCULE-6188199615 [0,1,0,0,0,0|3,0,0]=4 774 B13R1.14 N/C(=N\O)/COC1=CC=C(C=C1)Cl MCULE-9259863187 [0,1,0,0,0,0|3,0,0]=4 775 B13R1.14 N/C(=N\O)/COC1=CC=C(C=C1)F MCULE-5936392982 [0,1,0,0,0,0|3,0,0]=4 776 B13R1.14 N=C(CSC1=CC=C(C=C1)Cl)NO MCULE-1591058634 [0,1,0,0,0,0|3,0,0]=4 777 B13R1.14 NCC(=O)NCC1=CC=C(C=C1)Br MCULE-2254709683 [0,1,0,0,0,0|3,0,0]=4 778 B13R1.14 NCC(=O)NCC1=CC=C(C=C1)Br MCULE-7082013065 [0,1,0,0,0,0|3,0,0]=4 779 B13R1.14 NCC(=O)NCC1=CC=C(C=C1)Cl MCULE-1036198566 [0,1,0,0,0,0|3,0,0]=4 780 B13R1.14 NCC(=O)NCC1=CC=C(C=C1)Cl MCULE-7581757331 [0,1,0,0,0,0|3,0,0]=4 781 B13R1.14 NCC(=O)NCC1=CC=C(C=C1)F MCULE-4122509040 [0,1,0,0,0,0|3,0,0]=4 782 B13R1.14 NCC(=O)OCC1=CC=C(C=C1)Cl MCULE-4621837025 [0,1,0,0,0,0|3,0,0]=4 783 B13R1.14 NCC(=O)OCC1=CC=C(C=C1)Cl MCULE-7942880590 [0,1,0,0,0,0|3,0,0]=4 784 B13R1.14 NNC(=O)CCC1=CC=C(C=C1)O MCULE-6673334894 [0,1,0,0,0,0|2,0,0]=3 785 B13R1.14 NNC(=O)CNC1=CC=C(C=C1)Br MCULE-9977657454 [0,1,0,0,0,0|3,0,0]=4 786 B13R1.14 NNC(=O)CNC1=CC=C(C=C1)Cl MCULE-5930974164 [0,1,0,0,0,0|3,0,0]=4 787 B13R1.14 NNC(=O)CNC1=CC=C(C=C1)F MCULE-2153804661 [0,1,0,0,0,0|3,0,0]=4 788 B13R1.14 NNC(=O)CNC1=CC=C(C=C1)I MCULE-8889776539 [0,1,0,0,0,0|3,0,0]=4 789 B13R1.14 NNC(=O)COC1=CC=C(C=C1)Br MCULE-9724875087 [0,1,0,0,0,0|3,0,0]=4 790 B13R1.14 NNC(=O)COC1=CC=C(C=C1)Cl MCULE-7900568623 [0,1,0,0,0,0|3,0,0]=4 791 B13R1.14 NNC(=O)COC1=CC=C(C=C1)F MCULE-2297123738 [0,1,0,0,0,0|3,0,0]=4 792 B13R1.14 NNC(=O)COC1=CC=C(C=C1)I MCULE-5636233494 [0,1,0,0,0,0|3,0,0]=4 793 B13R1.14 NNC(=O)CSC1=CC=C(C=C1)Cl MCULE-4924529768 [0,1,0,0,0,0|3,0,0]=4 794 B13R1.14 NNC(=O)NCC1=CC=C(C=C1)Cl MCULE-7811220121 [0,1,0,0,0,0|3,0,0]=4 795 B13R1.14 O=C(C=CC1=CC=C(C=C1)Cl)NO MCULE-8944291584 [0,1,0,0,0,0|1,0,2]=4 796 B13R1.14 O=C(CBr)COC1=CC=C(C=C1)Br MCULE-1263759838 [0,1,0,0,0,0|3,0,0]=4 797 B13R1.14 O=C(CBr)COC1=CC=C(C=C1)F MCULE-4003016897 [0,1,0,0,0,0|3,0,0]=4 798 B13R1.14 O=C(CBr)NCC1=CC=C(C=C1)Br MCULE-4672273565 [0,1,0,0,0,0|3,0,0]=4 799 B13R1.14 O=C(CBr)NCC1=CC=C(C=C1)Cl MCULE-5113784641 [0,1,0,0,0,0|3,0,0]=4 800 B13R1.14 O=C(CCl)COC1=CC=C(C=C1)Cl MCULE-8569526882 [0,1,0,0,0,0|3,0,0]=4 801 B13R1.14 O=C(CCl)NCC1=CC=C(C=C1)Br MCULE-6022768930 [0,1,0,0,0,0|3,0,0]=4 802 B13R1.14 O=C(CCl)NCC1=CC=C(C=C1)Cl MCULE-9161560785 [0,1,0,0,0,0|3,0,0]=4 803 B13R1.14 O=C(CCl)NCC1=CC=C(C=C1)F MCULE-1378850823 [0,1,0,0,0,0|3,0,0]=4 804 B13R1.14 O=C(CO)NCC1=CC=C(C=C1)F MCULE-3702181547 [0,1,0,0,0,0|2,0,0]=3 805 B13R1.14 O=C(COC1=CC=C(C=C1)Br)NO MCULE-1040741480 [0,1,0,0,0,0|2,0,0]=3 806 B13R1.14 OC(CCl)CCC1=CC=C(C=C1)Cl MCULE-2252000178 [0,1,0,0,0,0|2,0,1]=4 807 B13R1.132 C=C(C)C[C@@H](N)C1=CC=C(C=C1)Br MCULE-5716939853 [0,1,0,0,0,0|3,0,0]=4 808 B13R1.132 C=C(C)C[C@@H](N)C1=CC=C(C=C1)Br MCULE-9770491471 [0,1,0,0,0,0|3,0,0]=4 809 B13R1.132 C=C(C)C[C@@H](N)C1=CC=C(C=C1)C MCULE-1530431179 [0,1,0,0,0,0|3,0,0]=4 810 B13R1.132 C=C(C)C[C@@H](N)C1=CC=C(C=C1)C MCULE-4796355940 [0,1,0,0,0,0|3,0,0]=4 811 B13R1.132 C=C(C)C[C@@H](N)C1=CC=C(C=C1)Cl MCULE-2946418802 [0,1,0,0,0,0|3,0,0]=4 812 B13R1.132 C=C(C)C[C@@H](N)C1=CC=C(C=C1)Cl MCULE-7282905366 [0,1,0,0,0,0|3,0,0]=4 813 B13R1.132 C=C(C)C[C@@H](N)C1=CC=C(C=C1)F MCULE-3025708587 [0,1,0,0,0,0|3,0,0]=4 814 B13R1.132 C=C(C)C[C@@H](N)C1=CC=C(C=C1)F MCULE-3341540788 [0,1,0,0,0,0|3,0,0]=4 815 B13R1.132 C=C(C)C[C@@H](N)C1=CC=C(C=C1)I MCULE-1571462674 [0,1,0,0,0,0|3,0,0]=4 816 B13R1.132 C=C(C)C[C@@H](N)C1=CC=C(C=C1)I MCULE-4962541333 [0,1,0,0,0,0|3,0,0]=4 817 B13R1.132 C=C(C)C[C@@H](N)C1=CC=C(C=C1)O MCULE-7201203440 [0,1,0,0,0,0|3,0,0]=4 818 B13R1.132 C=C(C)C[C@@H](N)C1=CC=C(C=C1)O MCULE-9440322773 [0,1,0,0,0,0|3,0,0]=4 819 B13R1.132 C=C(C)C[C@H](N)C1=CC=C(C=C1)Br MCULE-8469361239 [0,1,0,0,0,0|3,0,0]=4 820 B13R1.132 C=C(C)C[C@H](N)C1=CC=C(C=C1)Br MCULE-9068835862 [0,1,0,0,0,0|3,0,0]=4 821 B13R1.132 C=C(C)C[C@H](N)C1=CC=C(C=C1)C MCULE-3121198677 [0,1,0,0,0,0|3,0,0]=4 822 B13R1.132 C=C(C)C[C@H](N)C1=CC=C(C=C1)C MCULE-4073775539 [0,1,0,0,0,0|3,0,0]=4 823 B13R1.132 C=C(C)C[C@H](N)C1=CC=C(C=C1)Cl MCULE-1925312360 [0,1,0,0,0,0|3,0,0]=4 824 B13R1.132 C=C(C)C[C@H](N)C1=CC=C(C=C1)Cl MCULE-5865494073 [0,1,0,0,0,0|3,0,0]=4 825 B13R1.132 C=C(C)C[C@H](N)C1=CC=C(C=C1)F MCULE-5948579166 [0,1,0,0,0,0|3,0,0]=4 826 B13R1.132 C=C(C)C[C@H](N)C1=CC=C(C=C1)F MCULE-9008198270 [0,1,0,0,0,0|3,0,0]=4 827 B13R1.132 C=C(C)C[C@H](N)C1=CC=C(C=C1)I MCULE-3203700915 [0,1,0,0,0,0|3,0,0]=4 828 B13R1.132 C=C(C)C[C@H](N)C1=CC=C(C=C1)I MCULE-4961679468 [0,1,0,0,0,0|3,0,0]=4 829 B13R1.132 C=C(C)C[C@H](N)C1=CC=C(C=C1)O MCULE-2249639681 [0,1,0,0,0,0|3,0,0]=4 830 B13R1.132 C=C(C)C[C@H](N)C1=CC=C(C=C1)O MCULE-9609869157 [0,1,0,0,0,0|3,0,0]=4 831 B13R1.132 CC(=CC(=O)O)C1=CC=C(C=C1)Br MCULE-4152187179 [0,1,0,0,0,0|1,0,2]=4 832 B13R1.132 CC(=CC(=O)O)C1=CC=C(C=C1)Cl MCULE-4312688305 [0,1,0,0,0,0|1,0,2]=4 833 B13R1.132 CC(=CC(=O)O)C1=CC=C(C=C1)F MCULE-2600956660 [0,1,0,0,0,0|1,0,2]=4 834 B13R1.132 CC(=O)CC(=O)C1=CC=C(C=C1)Br MCULE-1970411913 [0,1,0,0,0,0|2,0,1]=4 835 B13R1.132 CC(=O)CC(=O)C1=CC=C(C=C1)C MCULE-3747399879 [0,1,0,0,0,0|2,0,1]=4 836 B13R1.132 CC(=O)CC(=O)C1=CC=C(C=C1)Cl MCULE-9783614240 [0,1,0,0,0,0|2,0,1]=4 837 B13R1.132 CC(=O)CC(=O)C1=CC=C(C=C1)F MCULE-6529086439 [0,1,0,0,0,0|2,0,1]=4 838 B13R1.132 CC(=O)NC(C)C1=CC=C(C=C1)Br MCULE-9129274888 [0,1,0,0,0,0|3,0,0]=4 839 B13R1.132 CC(=O)NC(C)C1=CC=C(C=C1)C MCULE-8998483980 [0,1,0,0,0,0|3,0,0]=4 840 B13R1.132 CC(=O)NC(C)C1=CC=C(C=C1)Cl MCULE-7988804215 [0,1,0,0,0,0|3,0,0]=4 841 B13R1.132 CC(=O)NC(C)C1=CC=C(C=C1)F MCULE-7627856462 [0,1,0,0,0,0|3,0,0]=4 842 B13R1.132 CC(=O)NC(C)C1=CC=C(C=C1)O MCULE-2334298539 [0,1,0,0,0,0|3,0,0]=4 843 B13R1.132 CC(=O)N[C@@H](C)C1=CC=C(C=C1)O MCULE-1285422659 [0,1,0,0,0,0|3,0,0]=4 844 B13R1.132 CC(=O)N[C@H](C)C1=CC=C(C=C1)O MCULE-3116131269 [0,1,0,0,0,0|3,0,0]=4 845 B13R1.132 CC(CC(=O)N)C1=CC=C(C=C1)N MCULE-9366699241 [0,1,0,0,0,0|1,0,0]=2 846 B13R1.132 CC(CC(=O)O)C1=CC=C(C=C1)Br MCULE-2016098947 [0,1,0,0,0,0|1,0,0]=2 847 B13R1.132 CC(CC(=O)O)C1=CC=C(C=C1)Cl MCULE-2722710140 [0,1,0,0,0,0|1,0,0]=2 848 B13R1.132 CC(CC(=O)O)C1=CC=C(C=C1)F MCULE-7127297434 [0,1,0,0,0,0|1,0,0]=2 849 B13R1.132 CC(CC(=O)O)C1=CC=C(C=C1)N MCULE-1218406621 [0,1,0,0,0,0|0,0,0]=1 850 B13R1.132 CC(CC(=O)O)C1=CC=C(C=C1)O MCULE-7578972799 [0,1,0,0,0,0|1,0,0]=2 851 B13R1.132 CC(NC(=O)N)C1=CC=C(C=C1)Br MCULE-3481024253 [0,1,0,0,0,0|3,0,0]=4 852 B13R1.132 CC1=CC=C(C=C1)C(=CC(=O)O)C MCULE-2198673132 [0,1,0,0,0,0|1,0,2]=4 853 B13R1.132 CC1=CC=C(C=C1)C(C)CC(=O)O MCULE-8428341971 [0,1,0,0,0,0|1,0,0]=2 854 B13R1.132 CC1=CC=C(C=C1)C(N)CC(=O)O MCULE-9173736504 [0,1,0,0,0,0|1,0,0]=2 855 B13R1.132 CC1=CC=C(C=C1)C(O)CC(=O)O MCULE-4624408830 [0,1,0,0,0,0|1,0,0]=2 856 B13R1.132 CC1=CC=C(C=C1)[C@@H](N)CC(=O)O MCULE-5031145088 [0,1,0,0,0,0|1,0,0]=2 857 B13R1.132 CC1=CC=C(C=C1)[C@@H](N)CC(=O)O MCULE-7474694854 [0,1,0,0,0,0|1,0,0]=2 858 B13R1.132 CC1=CC=C(C=C1)[C@H](N)CC(=O)O MCULE-4625661458 [0,1,0,0,0,0|1,0,0]=2 859 B13R1.132 CC1=CC=C(C=C1)[C@H](N)CC(=O)O MCULE-5235266278 [0,1,0,0,0,0|1,0,0]=2 860 B13R1.132 CN(CC(=O)N)C1=CC=C(C=C1)N MCULE-2886552896 [0,1,0,0,0,0|2,0,0]=3 861 B13R1.132 CN(CC(=O)O)C1=CC=C(C=C1)Cl MCULE-5997355834 [0,1,0,0,0,0|2,0,0]=3 862 B13R1.132 CN(CC(=O)O)C1=NC=C(C=C1)Cl MCULE-5740950510 [0,1,0,0,0,0|3,0,0]=4 863 B13R1.132 CN(CC(=O)O)C1=NC=C(C=C1)Cl MCULE-9169348726 [0,1,0,0,0,0|3,0,0]=4 864 B13R1.132 C[C@@H](CC(=O)O)C1=CC=C(C=C1)F MCULE-9711949511 [0,1,0,0,0,0|1,0,0]=2 865 B13R1.132 C[C@H](CC(=O)O)C1=CC=C(C=C1)F MCULE-7731951555 [0,1,0,0,0,0|1,0,0]=2 866 B13R1.132 NC(=O)CC(=O)C1=CC=C(C=C1)F MCULE-4752037713 [0,1,0,0,0,0|2,0,1]=4 867 B13R1.132 NC(=O)CC(N)C1=CC=C(C=C1)F MCULE-5184019737 [0,1,0,0,0,0|2,0,0]=3 868 B13R1.132 NC(CC(=O)O)C1=CC=C(C=C1)Br MCULE-2562479227 [0,1,0,0,0,0|1,0,0]=2 869 B13R1.132 NC(CC(=O)O)C1=CC=C(C=C1)Br MCULE-3145404080 [0,1,0,0,0,0|1,0,0]=2 870 B13R1.132 NC(CC(=O)O)C1=CC=C(C=C1)Br MCULE-4957228775 [0,1,0,0,0,0|1,0,0]=2 871 B13R1.132 NC(CC(=O)O)C1=CC=C(C=C1)Br MCULE-6667254725 [0,1,0,0,0,0|1,0,0]=2 872 B13R1.132 NC(CC(=O)O)C1=CC=C(C=C1)Cl MCULE-3615570804 [0,1,0,0,0,0|1,0,0]=2 873 B13R1.132 NC(CC(=O)O)C1=CC=C(C=C1)Cl MCULE-4520940339 [0,1,0,0,0,0|1,0,0]=2 874 B13R1.132 NC(CC(=O)O)C1=CC=C(C=C1)Cl MCULE-9553001923 [0,1,0,0,0,0|1,0,0]=2 875 B13R1.132 NC(CC(=O)O)C1=CC=C(C=C1)F MCULE-4157411281 [0,1,0,0,0,0|1,0,0]=2 876 B13R1.132 NC(CC(=O)O)C1=CC=C(C=C1)F MCULE-8698893976 [0,1,0,0,0,0|1,0,0]=2 877 B13R1.132 NC(CC(=O)O)C1=CC=C(C=C1)O MCULE-8022047792 [0,1,0,0,0,0|1,0,0]=2 878 B13R1.132 NC(CC(=O)O)C1=CC=C(N=C1)Cl MCULE-2029755193 [0,1,0,0,0,0|2,0,0]=3 879 B13R1.132 N[C@@H](CC(=O)O)C1=CC=C(C=C1)Br MCULE-3280690304 [0,1,0,0,0,0|1,0,0]=2 880 B13R1.132 N[C@@H](CC(=O)O)C1=CC=C(C=C1)Br MCULE-4585504777 [0,1,0,0,0,0|1,0,0]=2 881 B13R1.132 N[C@@H](CC(=O)O)C1=CC=C(C=C1)Br MCULE-6903403380 [0,1,0,0,0,0|1,0,0]=2 882 B13R1.132 N[C@@H](CC(=O)O)C1=CC=C(C=C1)Br MCULE-7166549699 [0,1,0,0,0,0|1,0,0]=2 883 B13R1.132 N[C@@H](CC(=O)O)C1=CC=C(C=C1)Cl MCULE-4628099540 [0,1,0,0,0,0|1,0,0]=2 884 B13R1.132 N[C@@H](CC(=O)O)C1=CC=C(C=C1)Cl MCULE-5508958389 [0,1,0,0,0,0|1,0,0]=2 885 B13R1.132 N[C@@H](CC(=O)O)C1=CC=C(C=C1)Cl MCULE-7286983486 [0,1,0,0,0,0|1,0,0]=2 886 B13R1.132 N[C@@H](CC(=O)O)C1=CC=C(C=C1)Cl MCULE-7838291156 [0,1,0,0,0,0|1,0,0]=2 887 B13R1.132 N[C@@H](CC(=O)O)C1=CC=C(C=C1)F MCULE-1061728753 [0,1,0,0,0,0|1,0,0]=2 888 B13R1.132 N[C@@H](CC(=O)O)C1=CC=C(C=C1)F MCULE-6327368529 [0,1,0,0,0,0|1,0,0]=2 889 B13R1.132 N[C@@H](CC(=O)O)C1=CC=C(C=C1)F MCULE-6947859998 [0,1,0,0,0,0|1,0,0]=2 890 B13R1.132 N[C@@H](CC(=O)O)C1=CC=C(C=C1)F MCULE-7945509136 [0,1,0,0,0,0|1,0,0]=2 891 B13R1.132 N[C@@H](CC(=O)O)C1=CC=C(C=C1)O MCULE-2907878626 [0,1,0,0,0,0|1,0,0]=2 892 B13R1.132 N[C@@H](CC(=O)O)C1=CC=C(C=C1)O MCULE-6136594346 [0,1,0,0,0,0|1,0,0]=2 893 B13R1.132 N[C@@H](CC(=O)O)C1=CC=C(C=C1)O MCULE-8247287459 [0,1,0,0,0,0|1,0,0]=2 894 B13R1.132 N[C@H](CC(=O)O)C1=CC=C(C=C1)Br MCULE-2112390316 [0,1,0,0,0,0|1,0,0]=2 895 B13R1.132 N[C@H](CC(=O)O)C1=CC=C(C=C1)Br MCULE-2269294845 [0,1,0,0,0,0|1,0,0]=2 896 B13R1.132 N[C@H](CC(=O)O)C1=CC=C(C=C1)Br MCULE-6481937572 [0,1,0,0,0,0|1,0,0]=2 897 B13R1.132 N[C@H](CC(=O)O)C1=CC=C(C=C1)Br MCULE-8905067487 [0,1,0,0,0,0|1,0,0]=2 898 B13R1.132 N[C@H](CC(=O)O)C1=CC=C(C=C1)Cl MCULE-2038848679 [0,1,0,0,0,0|1,0,0]=2 899 B13R1.132 N[C@H](CC(=O)O)C1=CC=C(C=C1)Cl MCULE-4123634292 [0,1,0,0,0,0|1,0,0]=2 900 B13R1.132 N[C@H](CC(=O)O)C1=CC=C(C=C1)F MCULE-2375735241 [0,1,0,0,0,0|1,0,0]=2 901 B13R1.132 N[C@H](CC(=O)O)C1=CC=C(C=C1)F MCULE-5721879123 [0,1,0,0,0,0|1,0,0]=2 902 B13R1.132 N[C@H](CC(=O)O)C1=CC=C(C=C1)O MCULE-4604116690 [0,1,0,0,0,0|1,0,0]=2 903 B13R1.132 N[C@H](CC(=O)O)C1=CC=C(C=C1)O MCULE-7232618432 [0,1,0,0,0,0|1,0,0]=2 904 B13R1.132 O=C(O)CC(=O)C1=CC=C(C=C1)F MCULE-8869002731 [0,1,0,0,0,0|1,0,1]=3 905 B13R1.132 O=C(O)CC(=O)C1=CC=C(C=C1)O MCULE-4533243268 [0,1,0,0,0,0|1,0,1]=3 906 B13R1.132 O=C(O)CC(O)C1=CC=C(C=C1)Cl MCULE-2786363573 [0,1,0,0,0,0|1,0,0]=2 907 B13R1.132 O=C(O)CC(O)C1=CC=C(C=C1)F MCULE-7115171473 [0,1,0,0,0,0|1,0,0]=2 908 B13R1.132 O=C(O)CC(O)C1=CC=C(C=C1)O MCULE-7634229278 [0,1,0,0,0,0|1,0,0]=2 909 B13R1.132 O=C(O)CS(=O)C1=CC=C(C=C1)Cl MCULE-3290734367 [0,1,0,0,0,0|2,0,0]=3 910 B13R1.132 O=C(O)NC(=O)C1=CC=C(C=C1)Cl MCULE-6234641378 [0,1,0,0,0,0|2,0,1]=4 911 B13R1.133 C/C(=C\C1=CC=C(C=C1)F)/C(=O)O MCULE-9125817227 [0,1,0,0,0,0|1,0,2]=4 912 B13R1.133 CC(=CC1=CC=C(C=C1)Cl)C(=O)O MCULE-3905010340 [0,1,0,0,0,0|1,0,2]=4 913 B13R1.133 CC(=CC1=CC=C(C=C1)F)C(=O)O MCULE-7582483106 [0,1,0,0,0,0|1,0,2]=4 914 B13R1.133 CC(=O)C(=O)CC1=CC=C(C=C1)Br MCULE-8584708680 [0,1,0,0,0,0|2,0,1]=4 915 B13R1.133 CC(=O)C(=O)CC1=CC=C(C=C1)C MCULE-4909741651 [0,1,0,0,0,0|2,0,1]=4 916 B13R1.133 CC(=O)C(=O)CC1=CC=C(C=C1)Cl MCULE-4851750628 [0,1,0,0,0,0|2,0,1]=4 917 B13R1.133 CC(=O)C(=O)CC1=CC=C(C=C1)F MCULE-6298679807 [0,1,0,0,0,0|2,0,1]=4 918 B13R1.133 CC(=O)C(C)OC1=CC=C(C=C1)C MCULE-9259250951 [0,1,0,0,0,0|3,0,0]=4 919 B13R1.133 CC(=O)C(C)OC1=CC=C(C=C1)Cl MCULE-7117815810 [0,1,0,0,0,0|3,0,0]=4 920 B13R1.133 CC(=O)C(C)OC1=CC=C(C=C1)F MCULE-7163046390 [0,1,0,0,0,0|3,0,0]=4 921 B13R1.133 CC(=O)C(C)OC1=CC=C(C=C1)I MCULE-4130704406 [0,1,0,0,0,0|3,0,0]=4 922 B13R1.133 CC(=O)C(Cl)CC1=CC=C(C=C1)Cl MCULE-1359763762 [0,1,0,0,0,0|2,0,0]=3 923 B13R1.133 CC(=O)N(C)CC1=CC=C(C=C1)Cl MCULE-6733198040 [0,1,0,0,0,0|3,0,0]=4 924 B13R1.133 CC(CC1=CC=C(C=C1)Br)C(=O)O MCULE-6683812666 [0,1,0,0,0,0|1,0,0]=2 925 B13R1.133 CC(CC1=CC=C(C=C1)Cl)C(=O)O MCULE-1280505558 [0,1,0,0,0,0|1,0,0]=2 926 B13R1.133 CC(CC1=CC=C(C=C1)F)C(=O)Cl MCULE-3149956298 [0,1,0,0,0,0|2,0,0]=3 927 B13R1.133 CC(CC1=CC=C(C=C1)F)C(=O)O MCULE-5939301963 [0,1,0,0,0,0|1,0,0]=2 928 B13R1.133 CC(CC1=CC=C(C=C1)N)C(=O)O MCULE-5845815463 [0,1,0,0,0,0|0,0,0]=1 929 B13R1.133 CC(CC1=CC=C(C=C1)N)N(=O)=O MCULE-1213153697 [0,1,0,0,0,0|1,0,1]=3 930 B13R1.133 CC(CC1=CC=C(C=C1)N)N(=O)=O MCULE-3602688869 [0,1,0,0,0,0|1,0,1]=3 931 B13R1.133 CC(CC1=CC=C(C=C1)O)C(=O)O MCULE-2516510846 [0,1,0,0,0,0|1,0,0]=2 932 B13R1.133 CC(NC1=CC=C(C=C1)Br)C(=O)O MCULE-6489432108 [0,1,0,0,0,0|2,0,0]=3 933 B13R1.133 CC(NC1=CC=C(C=C1)Cl)C(=O)O MCULE-8986903361 [0,1,0,0,0,0|2,0,0]=3 934 B13R1.133 CC(NC1=CC=C(C=C1)F)C(=O)O MCULE-6392334081 [0,1,0,0,0,0|2,0,0]=3 935 B13R1.133 CC(O)C(O)CC1=CC=C(C=C1)O MCULE-5873805411 [0,1,0,0,0,0|2,0,1]=4 936 B13R1.133 CC(OC1=CC=C(C=C1)Br)C(=O)Cl MCULE-3314108651 [0,1,0,0,0,0|3,0,0]=4 937 B13R1.133 CC(OC1=CC=C(C=C1)Br)C(=O)N MCULE-4656365645 [0,1,0,0,0,0|3,0,0]=4 938 B13R1.133 CC(OC1=CC=C(C=C1)Br)C(=O)O MCULE-2899606616 [0,1,0,0,0,0|2,0,0]=3 939 B13R1.133 CC(OC1=CC=C(C=C1)Cl)C(=O)O MCULE-2806188004 [0,1,0,0,0,0|2,0,0]=3 940 B13R1.133 CC(OC1=CC=C(C=C1)F)C(=O)Cl MCULE-4300206065 [0,1,0,0,0,0|3,0,0]=4 941 B13R1.133 CC(OC1=CC=C(C=C1)F)C(=O)N MCULE-1211421503 [0,1,0,0,0,0|3,0,0]=4 942 B13R1.133 CC(OC1=CC=C(C=C1)F)C(=O)O MCULE-4636762506 [0,1,0,0,0,0|2,0,0]=3 943 B13R1.133 CC(OC1=CC=C(C=C1)I)C(=O)O MCULE-1220379374 [0,1,0,0,0,0|2,0,0]=3 944 B13R1.133 CC(OC1=CC=C(C=C1)O)C(=O)N MCULE-3442482535 [0,1,0,0,0,0|3,0,0]=4 945 B13R1.133 CC(OC1=CC=C(C=C1)O)C(=O)O MCULE-3910586263 [0,1,0,0,0,0|2,0,0]=3 946 B13R1.133 CC(OC1=CC=C(C=C1)O)C(=O)O MCULE-8109698642 [0,1,0,0,0,0|2,0,0]=3 947 B13R1.133 CC(OC1=NC=C(C=C1)O)C(=O)O MCULE-8981560377 [0,1,0,0,0,0|3,0,0]=4 948 B13R1.133 CC(SC1=CC=C(C=C1)Br)C(=O)O MCULE-1446499549 [0,1,0,0,0,0|2,0,0]=3 949 B13R1.133 CC(SC1=CC=C(C=C1)Cl)C(=O)N MCULE-2070633764 [0,1,0,0,0,0|3,0,0]=4 950 B13R1.133 CC(SC1=CC=C(C=C1)Cl)C(=O)O MCULE-8222588241 [0,1,0,0,0,0|2,0,0]=3 951 B13R1.133 CC(SC1=CC=C(C=C1)F)C(=O)O MCULE-3934690491 [0,1,0,0,0,0|2,0,0]=3 952 B13R1.133 CC(SC1=CC=C(C=C1)N)C(=O)O MCULE-3495898588 [0,1,0,0,0,0|1,0,0]=2 953 B13R1.133 CC(SC1=CC=C(C=C1)N)C(=O)O MCULE-7599867683 [0,1,0,0,0,0|1,0,0]=2 954 B13R1.133 CC(SC1=CC=C(C=N1)Cl)C(=O)O MCULE-2341537081 [0,1,0,0,0,0|3,0,0]=4 955 B13R1.133 CC1=CC=C(C=C1)CC(=O)C(=O)O MCULE-5364836033 [0,1,0,0,0,0|1,0,1]=3 956 B13R1.133 CC1=CC=C(C=C1)CC(C)C(=O)O MCULE-4590037722 [0,1,0,0,0,0|1,0,0]=2 957 B13R1.133 CC1=CC=C(C=C1)CC(N)C(=O)O MCULE-5938013882 [0,1,0,0,0,0|1,0,0]=2 958 B13R1.133 CC1=CC=C(C=C1)CC(N)C(=O)O MCULE-5941415626 [0,1,0,0,0,0|1,0,0]=2 959 B13R1.133 CC1=CC=C(C=C1)C[C@@H](N)C(=O)O MCULE-4074563438 [0,1,0,0,0,0|1,0,0]=2 960 B13R1.133 CC1=CC=C(C=C1)C[C@@H](N)C(=O)O MCULE-6283014667 [0,1,0,0,0,0|1,0,0]=2 961 B13R1.133 CC1=CC=C(C=C1)C[C@H](N)C(=O)O MCULE-4426041269 [0,1,0,0,0,0|1,0,0]=2 962 B13R1.133 CC1=CC=C(C=C1)NC(=O)C(=O)O MCULE-9008357683 [0,1,0,0,0,0|2,0,1]=4 963 B13R1.133 CC1=CC=C(C=C1)NC(C)C(=O)O MCULE-2473610216 [0,1,0,0,0,0|2,0,0]=3 964 B13R1.133 CC1=CC=C(C=C1)N[C@@H](C)C(=O)O MCULE-5578025031 [0,1,0,0,0,0|2,0,0]=3 965 B13R1.133 CC1=CC=C(C=C1)OC(C)C(=O)Cl MCULE-8449908134 [0,1,0,0,0,0|3,0,0]=4 966 B13R1.133 CC1=CC=C(C=C1)OC(C)C(=O)O MCULE-5755742192 [0,1,0,0,0,0|2,0,0]=3 967 B13R1.133 CC1=CC=C(C=C1)SC(=O)C(=O)O MCULE-2944763069 [0,1,0,0,0,0|2,0,1]=4 968 B13R1.133 CC1=CC=C(C=C1)SC(C)C(=O)O MCULE-2194590140 [0,1,0,0,0,0|2,0,0]=3 969 B13R1.133 CC1=CC=C(C=N1)CC(N)C(=O)O MCULE-7515109915 [0,1,0,0,0,0|2,0,0]=3 970 B13R1.133 CC1=CC=C(C=N1)CC(N)C(=O)O MCULE-7970126746 [0,1,0,0,0,0|2,0,0]=3 971 B13R1.133 CC1=CC=C(C=N1)C[C@H](N)C(=O)O MCULE-3552123991 [0,1,0,0,0,0|2,0,0]=3 972 B13R1.133 CC1=CC=C(C=N1)C[C@H](N)C(=O)O MCULE-8500104051 [0,1,0,0,0,0|2,0,0]=3 973 B13R1.133 CC1=CN=C(C=C1)CC(N)C(=O)O MCULE-9990775207 [0,1,0,0,0,0|2,0,0]=3 974 B13R1.133 CC1=NC=C(C=C1)CC(C)C(=O)O MCULE-3690219579 [0,1,0,0,0,0|2,0,0]=3 975 B13R1.133 CN(CC1=CC=C(C=C1)N)C(=N)N MCULE-9591326913 [0,1,0,0,0,0|3,0,0]=4 976 B13R1.133 C[C@@H](OC1=CC=C(C=C1)Br)C(=O)O MCULE-9582407611 [0,1,0,0,0,0|2,0,0]=3 977 B13R1.133 C[C@@H](OC1=CC=C(C=C1)O)C(=O)O MCULE-2306319707 [0,1,0,0,0,0|2,0,0]=3 978 B13R1.133 C[C@@H](OC1=CC=C(C=C1)O)C(=O)O MCULE-2747836834 [0,1,0,0,0,0|2,0,0]=3 979 B13R1.133 C[C@H](OC1=CC=C(C=C1)Br)C(=O)O MCULE-7345498401 [0,1,0,0,0,0|2,0,0]=3 980 B13R1.133 C[C@H](OC1=CC=C(C=C1)Cl)C(=O)O MCULE-5436371376 [0,1,0,0,0,0|2,0,0]=3 981 B13R1.133 C[C@H](OC1=CC=C(C=C1)I)C(=O)O MCULE-7333151537 [0,1,0,0,0,0|2,0,0]=3 982 B13R1.133 C[C@H](OC1=CC=C(C=C1)O)C(=O)O MCULE-3555894490 [0,1,0,0,0,0|2,0,0]=3 983 B13R1.133 NC(=O)C(Br)CC1=CC=C(C=C1)Cl MCULE-9735876861 [0,1,0,0,0,0|2,0,0]=3 984 B13R1.133 NC(=O)C(Br)CC1=CC=C(C=C1)F MCULE-6712170604 [0,1,0,0,0,0|2,0,0]=3 985 B13R1.133 NC(=O)C(N)CC1=CC=C(C=C1)Cl MCULE-3507738342 [0,1,0,0,0,0|2,0,0]=3 986 B13R1.133 NC(=O)C(N)CC1=CC=C(C=C1)Cl MCULE-3797575548 [0,1,0,0,0,0|2,0,0]=3 987 B13R1.133 NC(=O)C(N)CC1=CC=C(C=C1)I MCULE-5322396806 [0,1,0,0,0,0|2,0,0]=3 988 B13R1.133 NC(=O)C(N)CC1=CC=C(C=C1)O MCULE-4534251709 [0,1,0,0,0,0|2,0,0]=3 989 B13R1.133 NC(=O)C(N)CC1=CC=C(C=C1)O MCULE-6666960690 [0,1,0,0,0,0|2,0,0]=3 990 B13R1.133 NC(=O)C(N)CC1=CC=C(C=C1)O MCULE-7581214871 [0,1,0,0,0,0|2,0,0]=3 991 B13R1.133 NC(=O)[C@@H](N)CC1=CC=C(C=C1)O MCULE-2962528193 [0,1,0,0,0,0|2,0,0]=3 992 B13R1.133 NC(=O)[C@@H](N)CC1=CC=C(C=C1)O MCULE-4978506956 [0,1,0,0,0,0|2,0,0]=3 993 B13R1.133 NC(=O)[C@@H](N)CC1=CC=C(C=C1)O MCULE-6881448953 [0,1,0,0,0,0|2,0,0]=3 994 B13R1.133 NC(=O)[C@@H](N)CC1=CC=C(C=C1)O MCULE-8756948838 [0,1,0,0,0,0|2,0,0]=3 995 B13R1.133 NC(=O)[C@H](N)CC1=CC=C(C=C1)O MCULE-3717625016 [0,1,0,0,0,0|2,0,0]=3 996 B13R1.133 NC(=O)[C@H](N)CC1=CC=C(C=C1)O MCULE-5489720734 [0,1,0,0,0,0|2,0,0]=3 997 B13R1.133 NC(=O)[C@H](N)CC1=CC=C(C=C1)O MCULE-6882717101 [0,1,0,0,0,0|2,0,0]=3 998 B13R1.133 NC(CC1=CC=C(C=C1)Br)C(=O)O MCULE-1775451572 [0,1,0,0,0,0|1,0,0]=2 999 B13R1.133 NC(CC1=CC=C(C=C1)Br)C(=O)O MCULE-7470720579 [0,1,0,0,0,0|1,0,0]=2 1000 B13R1.133 NC(CC1=CC=C(C=C1)Cl)C(=O)O MCULE-2078281838 [0,1,0,0,0,0|1,0,0]=2 1001 B13R1.133 NC(CC1=CC=C(C=C1)Cl)C(=O)O MCULE-3147443800 [0,1,0,0,0,0|1,0,0]=2 1002 B13R1.133 NC(CC1=CC=C(C=C1)Cl)C(=O)O MCULE-6446437625 [0,1,0,0,0,0|1,0,0]=2 1003 B13R1.133 NC(CC1=CC=C(C=C1)F)C(=O)O MCULE-1002354431 [0,1,0,0,0,0|1,0,0]=2 1004 B13R1.133 NC(CC1=CC=C(C=C1)F)C(=O)O MCULE-3057881279 [0,1,0,0,0,0|1,0,0]=2 1005 B13R1.133 NC(CC1=CC=C(C=C1)F)C(=O)O MCULE-3274733318 [0,1,0,0,0,0|1,0,0]=2 1006 B13R1.133 NC(CC1=CC=C(C=C1)F)C(=O)O MCULE-9271769862 [0,1,0,0,0,0|1,0,0]=2 1007 B13R1.133 NC(CC1=CC=C(C=C1)I)C(=O)O MCULE-3082140157 [0,1,0,0,0,0|1,0,0]=2 1008 B13R1.133 NC(CC1=CC=C(C=C1)I)C(=O)O MCULE-8666804898 [0,1,0,0,0,0|1,0,0]=2 1009 B13R1.133 NC(CC1=CC=C(C=C1)O)C(=O)O MCULE-1694199256 [0,1,0,0,0,0|1,0,0]=2 1010 B13R1.133 NC(CC1=CC=C(C=C1)O)C(=O)O MCULE-3703416768 [0,1,0,0,0,0|1,0,0]=2 1011 B13R1.133 NC(CC1=CC=C(C=C1)O)C(=O)O MCULE-6898017610 [0,1,0,0,0,0|1,0,0]=2 1012 B13R1.133 NC(CC1=CC=C(C=C1)[O-])C(=O)[O-] MCULE-4113012438 [0,1,0,0,0,0|1,0,1]=3 1013 B13R1.133 NC(CC1=CC=C(C=C1)[O-])C(=O)[O-] MCULE-6004946837 [0,1,0,0,0,0|1,0,1]=3 1014 B13R1.133 NC(CC1=CC=C(C=N1)Cl)C(=O)O MCULE-3104561565 [0,1,0,0,0,0|2,0,0]=3 1015 B13R1.133 NC(CC1=CN=C(C=C1)Cl)C(=O)O MCULE-6144527889 [0,1,0,0,0,0|2,0,0]=3 1016 B13R1.133 NC(CC1=NC=C(C=C1)Br)C(=O)O MCULE-1184762054 [0,1,0,0,0,0|2,0,0]=3 1017 B13R1.133 NC(CC1=NC=C(C=C1)Br)C(=O)O MCULE-3401635049 [0,1,0,0,0,0|2,0,0]=3 1018 B13R1.133 NC(CC1=NC=C(C=C1)Cl)C(=O)O MCULE-7003179779 [0,1,0,0,0,0|2,0,0]=3 1019 B13R1.133 NC1=CC=C(C=C1)CC(=O)C(=O)O MCULE-1860901630 [0,1,0,0,0,0|0,0,1]=2 1020 B13R1.133 NC1=CC=C(C=C1)CC(=O)C(=O)O MCULE-2990155431 [0,1,0,0,0,0|0,0,1]=2 1021 B13R1.133 NC1=CC=C(C=C1)CC(N)C(=O)O MCULE-3239737488 [0,1,0,0,0,0|0,0,0]=1 1022 B13R1.133 NC1=CC=C(C=C1)CC(N)C(=O)O MCULE-6150381462 [0,1,0,0,0,0|0,0,0]=1 1023 B13R1.133 NC1=CC=C(C=C1)CC(N)C(=O)O MCULE-9416228233 [0,1,0,0,0,0|0,0,0]=1 1024 B13R1.133 NC1=CC=C(C=C1)C[C@@H](N)C(=O)O MCULE-1451751780 [0,1,0,0,0,0|0,0,0]=1 1025 B13R1.133 NC1=CC=C(C=C1)C[C@@H](N)C(=O)O MCULE-2816716756 [0,1,0,0,0,0|0,0,0]=1 1026 B13R1.133 NC1=CC=C(C=C1)C[C@@H](N)C(=O)O MCULE-6139445410 [0,1,0,0,0,0|0,0,0]=1 1027 B13R1.133 NC1=CC=C(C=C1)C[C@@H](N)C(=O)O MCULE-9266819464 [0,1,0,0,0,0|0,0,0]=1 1028 B13R1.133 NC1=CC=C(C=C1)C[C@H](N)C(=O)O MCULE-2156725008 [0,1,0,0,0,0|0,0,0]=1 1029 B13R1.133 NC1=CC=C(C=C1)C[C@H](N)C(=O)O MCULE-3637255624 [0,1,0,0,0,0|0,0,0]=1 1030 B13R1.133 NC1=CC=C(C=C1)C[C@H](N)C(=O)O MCULE-4975962563 [0,1,0,0,0,0|0,0,0]=1 1031 B13R1.133 NC1=CC=C(C=C1)NC(=O)C(=O)O MCULE-8962075139 [0,1,0,0,0,0|1,0,1]=3 1032 B13R1.133 N[C@@H](CC1=CC=C(C=C1)Br)C(=O)O MCULE-7143135740 [0,1,0,0,0,0|1,0,0]=2 1033 B13R1.133 N[C@@H](CC1=CC=C(C=C1)Br)C(=O)O MCULE-8089296783 [0,1,0,0,0,0|1,0,0]=2 1034 B13R1.133 N[C@@H](CC1=CC=C(C=C1)Cl)C(=O)O MCULE-4387611400 [0,1,0,0,0,0|1,0,0]=2 1035 B13R1.133 N[C@@H](CC1=CC=C(C=C1)Cl)C(=O)O MCULE-7124632876 [0,1,0,0,0,0|1,0,0]=2 1036 B13R1.133 N[C@@H](CC1=CC=C(C=C1)Cl)C(=O)O MCULE-7237411145 [0,1,0,0,0,0|1,0,0]=2 1037 B13R1.133 N[C@@H](CC1=CC=C(C=C1)Cl)C(=O)O MCULE-9545997189 [0,1,0,0,0,0|1,0,0]=2 1038 B13R1.133 N[C@@H](CC1=CC=C(C=C1)F)C(=O)O MCULE-1704209264 [0,1,0,0,0,0|1,0,0]=2 1039 B13R1.133 N[C@@H](CC1=CC=C(C=C1)F)C(=O)O MCULE-4577062521 [0,1,0,0,0,0|1,0,0]=2 1040 B13R1.133 N[C@@H](CC1=CC=C(C=C1)F)C(=O)O MCULE-8737892544 [0,1,0,0,0,0|1,0,0]=2 1041 B13R1.133 N[C@@H](CC1=CC=C(C=C1)F)C(=O)O MCULE-8976470347 [0,1,0,0,0,0|1,0,0]=2 1042 B13R1.133 N[C@@H](CC1=CC=C(C=C1)I)C(=O)O MCULE-2723914313 [0,1,0,0,0,0|1,0,0]=2 1043 B13R1.133 N[C@@H](CC1=CC=C(C=C1)I)C(=O)O MCULE-6302870801 [0,1,0,0,0,0|1,0,0]=2 1044 B13R1.133 N[C@@H](CC1=CC=C(C=C1)O)C(=O)O MCULE-2932088896 [0,1,0,0,0,0|1,0,0]=2 1045 B13R1.133 N[C@@H](CC1=CC=C(C=C1)O)C(=O)O MCULE-2973514450 [0,1,0,0,0,0|1,0,0]=2 1046 B13R1.133 N[C@@H](CC1=CC=C(C=C1)O)C(=O)O MCULE-6154244493 [0,1,0,0,0,0|1,0,0]=2 1047 B13R1.133 N[C@@H](CC1=CC=C(C=C1)O)C(=O)O MCULE-8059108702 [0,1,0,0,0,0|1,0,0]=2 1048 B13R1.133 N[C@@H](CC1=CC=C(C=C1)O)C(=O)[O-] MCULE-5588166039 [0,1,0,0,0,0|1,0,1]=3 1049 B13R1.133 N[C@@H](CC1=CC=C(C=C1)O)C(=O)[O-] MCULE-6851459722 [0,1,0,0,0,0|1,0,1]=3 1050 B13R1.133 N[C@@H](CC1=CC=C(C=C1)[O-])C(=O)[O-] MCULE-1962102238 [0,1,0,0,0,0|1,0,1]=3 1051 B13R1.133 N[C@@H](CC1=CC=C(C=C1)[O-])C(=O)[O-] MCULE-2311115551 [0,1,0,0,0,0|1,0,1]=3 1052 B13R1.133 N[C@@H](CC1=CC=C(C=N1)Cl)C(=O)O MCULE-8852055943 [0,1,0,0,0,0|2,0,0]=3 1053 B13R1.133 N[C@@H](CC1=CC=C(N=C1)Cl)C(=O)O MCULE-1340381614 [0,1,0,0,0,0|2,0,0]=3 1054 B13R1.133 N[C@@H](CC1=CC=C(N=C1)Cl)C(=O)O MCULE-5029235962 [0,1,0,0,0,0|2,0,0]=3 1055 B13R1.133 N[C@@H](CC1=CN=C(C=C1)Cl)C(=O)O MCULE-5440835507 [0,1,0,0,0,0|2,0,0]=3 1056 B13R1.133 N[C@@H](CC1=CN=C(C=C1)Cl)C(=O)O MCULE-6580710907 [0,1,0,0,0,0|2,0,0]=3 1057 B13R1.133 N[C@@H](CC1=NC=C(C=C1)Br)C(=O)O MCULE-5841875025 [0,1,0,0,0,0|2,0,0]=3 1058 B13R1.133 N[C@@H](CC1=NC=C(C=C1)Br)C(=O)O MCULE-8825878130 [0,1,0,0,0,0|2,0,0]=3 1059 B13R1.133 N[C@@H](CC1=NC=C(C=C1)Cl)C(=O)O MCULE-7695251719 [0,1,0,0,0,0|2,0,0]=3 1060 B13R1.133 N[C@H](CC1=CC=C(C=C1)Br)C(=O)O MCULE-4875394682 [0,1,0,0,0,0|1,0,0]=2 1061 B13R1.133 N[C@H](CC1=CC=C(C=C1)Br)C(=O)O MCULE-8335788231 [0,1,0,0,0,0|1,0,0]=2 1062 B13R1.133 N[C@H](CC1=CC=C(C=C1)Br)C(=O)O MCULE-8515191610 [0,1,0,0,0,0|1,0,0]=2 1063 B13R1.133 N[C@H](CC1=CC=C(C=C1)Cl)C(=O)O MCULE-2834745731 [0,1,0,0,0,0|1,0,0]=2 1064 B13R1.133 N[C@H](CC1=CC=C(C=C1)Cl)C(=O)O MCULE-3982277557 [0,1,0,0,0,0|1,0,0]=2 1065 B13R1.133 N[C@H](CC1=CC=C(C=C1)Cl)C(=O)O MCULE-4128938211 [0,1,0,0,0,0|1,0,0]=2 1066 B13R1.133 N[C@H](CC1=CC=C(C=C1)Cl)C(=O)O MCULE-6437321299 [0,1,0,0,0,0|1,0,0]=2 1067 B13R1.133 N[C@H](CC1=CC=C(C=C1)F)C(=O)O MCULE-1442650276 [0,1,0,0,0,0|1,0,0]=2 1068 B13R1.133 N[C@H](CC1=CC=C(C=C1)F)C(=O)O MCULE-3700362961 [0,1,0,0,0,0|1,0,0]=2 1069 B13R1.133 N[C@H](CC1=CC=C(C=C1)F)C(=O)O MCULE-8139852905 [0,1,0,0,0,0|1,0,0]=2 1070 B13R1.133 N[C@H](CC1=CC=C(C=C1)F)C(=O)O MCULE-9312923607 [0,1,0,0,0,0|1,0,0]=2 1071 B13R1.133 N[C@H](CC1=CC=C(C=C1)I)C(=O)O MCULE-2177794046 [0,1,0,0,0,0|1,0,0]=2 1072 B13R1.133 N[C@H](CC1=CC=C(C=C1)I)C(=O)O MCULE-2766032223 [0,1,0,0,0,0|1,0,0]=2 1073 B13R1.133 N[C@H](CC1=CC=C(C=C1)O)C(=O)O MCULE-6003337645 [0,1,0,0,0,0|1,0,0]=2 1074 B13R1.133 N[C@H](CC1=CC=C(C=C1)O)C(=O)O MCULE-7719741497 [0,1,0,0,0,0|1,0,0]=2 1075 B13R1.133 O=C(O)/C(=C/C1=CC=C(C=C1)I)/S MCULE-5876833956 [0,1,0,0,0,0|1,0,2]=4 1076 B13R1.133 O=C(O)C(=CC1=CC=C(C=C1)Cl)O MCULE-9574800793 [0,1,0,0,0,0|1,0,2]=4 1077 B13R1.133 O=C(O)C(=CC1=CC=C(C=C1)Cl)S MCULE-3713803990 [0,1,0,0,0,0|1,0,2]=4 1078 B13R1.133 O=C(O)C(=CC1=CC=C(C=C1)F)O MCULE-2063307209 [0,1,0,0,0,0|1,0,2]=4 1079 B13R1.133 O=C(O)C(=CC1=CC=C(C=C1)I)S MCULE-6729220491 [0,1,0,0,0,0|1,0,2]=4 1080 B13R1.133 O=C(O)C(=O)CC1=CC=C(C=C1)Br MCULE-3734863861 [0,1,0,0,0,0|1,0,1]=3 1081 B13R1.133 O=C(O)C(=O)CC1=CC=C(C=C1)Cl MCULE-5251292118 [0,1,0,0,0,0|1,0,1]=3 1082 B13R1.133 O=C(O)C(=O)CC1=CC=C(C=C1)F MCULE-8817460511 [0,1,0,0,0,0|1,0,1]=3 1083 B13R1.133 O=C(O)C(=O)CC1=CC=C(C=C1)O MCULE-7014208403 [0,1,0,0,0,0|1,0,1]=3 1084 B13R1.133 O=C(O)C(=O)NC1=CC=C(C=C1)Br MCULE-5018868730 [0,1,0,0,0,0|2,0,1]=4 1085 B13R1.133 O=C(O)C(=O)NC1=CC=C(C=C1)Cl MCULE-7630741687 [0,1,0,0,0,0|2,0,1]=4 1086 B13R1.133 O=C(O)C(=O)NC1=CC=C(C=C1)F MCULE-5875994474 [0,1,0,0,0,0|2,0,1]=4 1087 B13R1.133 O=C(O)C(Br)CC1=CC=C(C=C1)Cl MCULE-5204071465 [0,1,0,0,0,0|1,0,0]=2 1088 B13R1.133 O=C(O)C(Br)CC1=CC=C(C=C1)F MCULE-5681231647 [0,1,0,0,0,0|1,0,0]=2 1089 B13R1.133 O=C(O)C(F)CC1=CC=C(C=C1)O MCULE-6083408945 [0,1,0,0,0,0|1,0,0]=2 1090 B13R1.133 O=C(O)C(O)CC1=CC=C(C=C1)Br MCULE-7943248642 [0,1,0,0,0,0|1,0,0]=2 1091 B13R1.133 O=C(O)C(O)CC1=CC=C(C=C1)Cl MCULE-5286691003 [0,1,0,0,0,0|1,0,0]=2 1092 B13R1.133 O=C(O)C(O)CC1=CC=C(C=C1)F MCULE-6155847565 [0,1,0,0,0,0|1,0,0]=2 1093 B13R1.133 O=C(O)C(O)CC1=CC=C(C=C1)O MCULE-3818086505 [0,1,0,0,0,0|1,0,0]=2 1094 B13R1.133 O=C(O)[C@@H](O)CC1=CC=C(C=C1)Br MCULE-5481131839 [0,1,0,0,0,0|1,0,0]=2 1095 B13R1.133 O=C(O)[C@@H](O)CC1=CC=C(C=C1)Cl MCULE-3794917513 [0,1,0,0,0,0|1,0,0]=2 1096 B13R1.133 O=C(O)[C@@H](O)CC1=CC=C(C=C1)Cl MCULE-8872282292 [0,1,0,0,0,0|1,0,0]=2 1097 B13R1.133 O=C(O)[C@@H](O)CC1=CC=C(C=C1)F MCULE-4209923445 [0,1,0,0,0,0|1,0,0]=2 1098 B13R1.133 O=C(O)[C@@H](O)CC1=CC=C(C=C1)I MCULE-3480936336 [0,1,0,0,0,0|1,0,0]=2 1099 B13R1.133 O=C(O)[C@@H](O)CC1=CC=C(C=C1)I MCULE-5777591096 [0,1,0,0,0,0|1,0,0]=2 1100 B13R1.133 O=C(O)[C@@H](O)CC1=CC=C(C=C1)O MCULE-6006549262 [0,1,0,0,0,0|1,0,0]=2 1101 B13R1.133 O=C(O)[C@@H](O)CC1=CC=C(C=C1)O MCULE-6391958547 [0,1,0,0,0,0|1,0,0]=2 1102 B13R1.133 O=C(O)[C@H](O)CC1=CC=C(C=C1)Br MCULE-2757025614 [0,1,0,0,0,0|1,0,0]=2 1103 B13R1.133 O=C(O)[C@H](O)CC1=CC=C(C=C1)Br MCULE-5816449429 [0,1,0,0,0,0|1,0,0]=2 1104 B13R1.133 O=C(O)[C@H](O)CC1=CC=C(C=C1)Cl MCULE-2366295919 [0,1,0,0,0,0|1,0,0]=2 1105 B13R1.133 O=C(O)[C@H](O)CC1=CC=C(C=C1)Cl MCULE-3979202399 [0,1,0,0,0,0|1,0,0]=2 1106 B13R1.133 O=C(O)[C@H](O)CC1=CC=C(C=C1)F MCULE-2135193623 [0,1,0,0,0,0|1,0,0]=2 1107 B13R1.133 O=C(O)[C@H](O)CC1=CC=C(C=C1)F MCULE-4947433128 [0,1,0,0,0,0|1,0,0]=2 1108 B13R1.133 O=C(O)[C@H](O)CC1=CC=C(C=C1)O MCULE-3449547842 [0,1,0,0,0,0|1,0,0]=2 1109 B13R1.133 O=C(O)[C@H](O)CC1=CC=C(C=C1)O MCULE-5440585564 [0,1,0,0,0,0|1,0,0]=2 1110 B13R1.133 [C@H](N)(CC1=CC=C(C=C1)C)C(=O)O MCULE-6439185943 [0,1,0,0,0,0|1,0,0]=2 1111 B13R1.133 [C@H](N)(CC1=CC=C(C=C1)N)C(=O)O MCULE-5291387050 [0,1,0,0,0,0|0,0,0]=1 1112 B13R1.133 [C@H](N)(CC1=CC=C(C=C1)N)C(=O)O MCULE-6099117172 [0,1,0,0,0,0|0,0,0]=1 1113 B13R1.133 [C@H](N)(CC1=CC=C(C=C1)N)C(=O)O MCULE-7165201455 [0,1,0,0,0,0|0,0,0]=1 1114 B13R1.133 [C@H](N)(CC1=CC=C(C=C1)O)C(=O)N MCULE-1861808000 [0,1,0,0,0,0|2,0,0]=3 1115 B13R1.133 [C@H](N)(CC1=CC=C(C=C1)O)C(=O)N MCULE-5954878034 [0,1,0,0,0,0|2,0,0]=3 1116 B13R1.133 [C@H](O)(CC1=CC=C(C=C1)Br)C(=O)O MCULE-1724377709 [0,1,0,0,0,0|1,0,0]=2 1117 B13R1.133 [NH3+]C(CC1=CC=C(C=C1)Cl)C(=O)O MCULE-2011771181 [0,1,0,0,0,0|1,0,0]=2 1118 B13R1.164 C=C(Br)CCC1=C(C=C(C=C1)C)C MCULE-8185766085 [0,1,0,0,0,0|3,0,0]=4 1119 B13R1.164 C=C(Br)CCC1=C(C=C(C=C1)Cl)Cl MCULE-5964599403 [0,1,0,0,0,0|3,0,0]=4 1120 B13R1.164 C=C(Br)CCC1=C(C=C(C=C1)F)F MCULE-1213032152 [0,1,0,0,0,0|3,0,0]=4 1121 B13R1.164 C=C(Br)CCC1=CC=C(C=C1Br)F MCULE-4232523615 [0,1,0,0,0,0|3,0,0]=4 1122 B13R1.164 C=C(Br)CCC1=CC=C(C=C1C)Cl MCULE-5662506732 [0,1,0,0,0,0|3,0,0]=4 1123 B13R1.164 C=C(Br)CCC1=CC=C(C=C1C)F MCULE-3091757610 [0,1,0,0,0,0|3,0,0]=4 1124 B13R1.164 C=C(Br)CCC1=CC=C(C=C1F)Br MCULE-8212886948 [0,1,0,0,0,0|3,0,0]=4 1125 B13R1.164 C=C(C)CCC1=C(C=C(C=C1)C)C MCULE-4765160818 [0,1,0,0,0,0|3,0,0]=4 1126 B13R1.164 C=C(C)CCC1=C(C=C(C=C1)Cl)Cl MCULE-8013835907 [0,1,0,0,0,0|3,0,0]=4 1127 B13R1.164 C=C(C)CCC1=C(C=C(C=C1)F)F MCULE-6316705153 [0,1,0,0,0,0|3,0,0]=4 1128 B13R1.164 C=C(C)CCC1=CC=C(C=C1Br)F MCULE-5931108352 [0,1,0,0,0,0|3,0,0]=4 1129 B13R1.164 C=C(C)CCC1=CC=C(C=C1C)Cl MCULE-8142636206 [0,1,0,0,0,0|3,0,0]=4 1130 B13R1.164 C=C(C)CCC1=CC=C(C=C1C)F MCULE-3211906247 [0,1,0,0,0,0|3,0,0]=4 1131 B13R1.164 C=C(C)CCC1=CC=C(C=C1Cl)F MCULE-9203963185 [0,1,0,0,0,0|3,0,0]=4 1132 B13R1.164 C=C(C)CCC1=CC=C(C=C1F)Br MCULE-9612485068 [0,1,0,0,0,0|3,0,0]=4 1133 B13R1.164 C=C(C)CCC1=CC=C(C=C1F)Cl MCULE-1409136959 [0,1,0,0,0,0|3,0,0]=4 1134 B13R1.164 C=C(Cl)CCC1=C(C=C(C=C1)C)C MCULE-9207780637 [0,1,0,0,0,0|3,0,0]=4 1135 B13R1.164 C=C(Cl)CCC1=C(C=C(C=C1)Cl)Cl MCULE-8918956506 [0,1,0,0,0,0|3,0,0]=4 1136 B13R1.164 C=C(Cl)CCC1=C(C=C(C=C1)F)F MCULE-1857272450 [0,1,0,0,0,0|3,0,0]=4 1137 B13R1.164 C=C(Cl)CCC1=CC=C(C=C1Br)F MCULE-8626058084 [0,1,0,0,0,0|3,0,0]=4 1138 B13R1.164 C=C(Cl)CCC1=CC=C(C=C1C)Cl MCULE-4437007956 [0,1,0,0,0,0|3,0,0]=4 1139 B13R1.164 C=C(Cl)CCC1=CC=C(C=C1C)F MCULE-4821373710 [0,1,0,0,0,0|3,0,0]=4 1140 B13R1.164 C=C(Cl)CCC1=CC=C(C=C1F)Br MCULE-5613870377 [0,1,0,0,0,0|3,0,0]=4 1141 B13R1.164 CC(=O)CCC1=C(C=C(C=C1)F)F MCULE-6085379794 [0,1,0,0,0,0|2,0,0]=3 1142 B13R1.164 CC(=O)CCC1=CC=C(C=C1F)Cl MCULE-3195778318 [0,1,0,0,0,0|2,0,0]=3 1143 B13R1.164 CC(=O)COC1=C(C=C(C=C1)Cl)Cl MCULE-9195463974 [0,1,0,0,0,0|3,0,0]=4 1144 B13R1.164 CC(=O)NCC1=C(C=C(C=C1)Cl)Cl MCULE-2414570118 [0,1,0,0,0,0|3,0,0]=4 1145 B13R1.164 CC(=O)OCC1=CC=C(C=C1Br)I MCULE-4706978117 [0,1,0,0,0,0|3,0,0]=4 1146 B13R1.164 CC1=C(C=CC(=C1)Br)NCC(=O)O MCULE-2158700604 [0,1,0,0,0,0|2,0,0]=3 1147 B13R1.164 CC1=C(C=CC(=C1)Br)OCC(=O)N MCULE-3025281370 [0,1,0,0,0,0|3,0,0]=4 1148 B13R1.164 CC1=C(C=CC(=C1)Br)OCC(=O)O MCULE-6292271105 [0,1,0,0,0,0|2,0,0]=3 1149 B13R1.164 CC1=C(C=CC(=C1)Cl)C#CC(=O)O MCULE-6751901161 [0,1,0,0,0,0|1,0,2]=4 1150 B13R1.164 CC1=C(C=CC(=C1)Cl)OCC(=O)N MCULE-9968404062 [0,1,0,0,0,0|3,0,0]=4 1151 B13R1.164 CC1=C(C=CC(=C1)Cl)OCC(=O)O MCULE-3405120876 [0,1,0,0,0,0|2,0,0]=3 1152 B13R1.164 CC1=C(C=CC(=C1)Cl)OCC(=O)[O-] MCULE-8822562838 [0,1,0,0,0,0|2,0,1]=4 1153 B13R1.164 CC1=C(C=CC(=C1)F)CCC(=O)O MCULE-1013388620 [0,1,0,0,0,0|1,0,0]=2 1154 B13R1.164 CC1=C(C=CC(=C1)N)OCC(=O)O MCULE-1853093698 [0,1,0,0,0,0|1,0,0]=2 1155 B13R1.164 CC1=CC(=C(C=C1)C#CC(=O)O)C MCULE-8316562714 [0,1,0,0,0,0|1,0,2]=4 1156 B13R1.164 CC1=CC(=C(C=C1)C=CC(=O)O)C MCULE-1694881584 [0,1,0,0,0,0|1,0,2]=4 1157 B13R1.164 CC1=CC(=C(C=C1)C=CC(=O)O)F MCULE-8808633497 [0,1,0,0,0,0|1,0,2]=4 1158 B13R1.164 CC1=CC(=C(C=C1)CCC(=O)O)Br MCULE-6766787776 [0,1,0,0,0,0|1,0,0]=2 1159 B13R1.164 CC1=CC(=C(C=C1)CCC(=O)O)C MCULE-6418950097 [0,1,0,0,0,0|1,0,0]=2 1160 B13R1.164 CC1=CC(=C(C=C1)NCC(=O)O)C MCULE-2134932799 [0,1,0,0,0,0|2,0,0]=3 1161 B13R1.164 CC1=CC(=C(C=C1)OCC(=O)Cl)C MCULE-9756133713 [0,1,0,0,0,0|3,0,0]=4 1162 B13R1.164 CC1=CC(=C(C=C1)OCC(=O)N)Br MCULE-9505961665 [0,1,0,0,0,0|3,0,0]=4 1163 B13R1.164 CC1=CC(=C(C=C1)OCC(=O)N)C MCULE-9697219196 [0,1,0,0,0,0|3,0,0]=4 1164 B13R1.164 CC1=CC(=C(C=C1)SCC(=O)O)C MCULE-7611143326 [0,1,0,0,0,0|2,0,0]=3 1165 B13R1.164 CC1=CC(=CC=C1C#CC(=O)O)F MCULE-3671418886 [0,1,0,0,0,0|1,0,2]=4 1166 B13R1.164 CC1=CC(=CC=C1C=CC(=O)O)F MCULE-5476342488 [0,1,0,0,0,0|1,0,2]=4 1167 B13R1.164 CC1=CC(=CC=C1C=CC(=O)O)O MCULE-1922876294 [0,1,0,0,0,0|1,0,2]=4 1168 B13R1.164 CC1=CC(=CC=C1CCC(=O)O)Br MCULE-8861086857 [0,1,0,0,0,0|1,0,0]=2 1169 B13R1.164 CC1=CC(=CC=C1CCC(=O)O)Cl MCULE-6046464602 [0,1,0,0,0,0|1,0,0]=2 1170 B13R1.164 CC1=CC(=CC=C1OCC(=O)Cl)Cl MCULE-7385167462 [0,1,0,0,0,0|3,0,0]=4 1171 B13R1.164 CC1=CC(=CC=C1OCC(=O)N)N MCULE-2881588201 [0,1,0,0,0,0|2,0,0]=3 1172 B13R1.164 CC1=CC(=CC=C1OCC(=O)O)F MCULE-7359119685 [0,1,0,0,0,0|2,0,0]=3 1173 B13R1.164 CC1=CC(=CC=C1OCC(=O)[O-])Cl MCULE-4971672877 [0,1,0,0,0,0|2,0,1]=4 1174 B13R1.164 CC1=CC(=CC=C1SCC(=O)O)Br MCULE-6865374244 [0,1,0,0,0,0|2,0,0]=3 1175 B13R1.164 CC1=CC(=O)C(=CN1)OCC(=O)O MCULE-1432850427 [0,1,0,0,0,0|3,0,0]=4 1176 B13R1.164 CC1=CC(=O)C(=CO1)OCC(=O)O MCULE-7455315009 [0,1,0,0,0,0|3,0,0]=4 1177 B13R1.164 CC1=CC(=O)N(C=N1)CCC(=O)O MCULE-1921084106 [0,1,0,0,0,0|3,0,0]=4 1178 B13R1.164 CC1=CC(=O)N(C=N1)CCC(=O)O MCULE-4332470110 [0,1,0,0,0,0|3,0,0]=4 1179 B13R1.164 CC1=CC=C(C(=C1)Br)OCC(=O)O MCULE-4948736396 [0,1,0,0,0,0|2,0,0]=3 1180 B13R1.164 CC1=CC=C(C(=C1)C)/C=C/C(=O)O MCULE-5580725255 [0,1,0,0,0,0|1,0,2]=4 1181 B13R1.164 CC1=CC=C(C(=C1)C)OCC(=O)O MCULE-9147952930 [0,1,0,0,0,0|2,0,0]=3 1182 B13R1.164 CC1=CC=C(C(=C1)Cl)OCC(=O)O MCULE-9724689973 [0,1,0,0,0,0|2,0,0]=3 1183 B13R1.164 CC1=CC=C(C(=C1)F)/C=C/C(=O)O MCULE-2061567327 [0,1,0,0,0,0|1,0,2]=4 1184 B13R1.164 CC1=CC=C(C(=C1)F)CCC(=O)O MCULE-4790737763 [0,1,0,0,0,0|1,0,0]=2 1185 B13R1.164 CC1=CC=C(C(=C1)F)NCC(=O)O MCULE-5608789891 [0,1,0,0,0,0|2,0,0]=3 1186 B13R1.164 CC1=CC=C(C(=N1)C)CCC(=O)O MCULE-2624440825 [0,1,0,0,0,0|2,0,0]=3 1187 B13R1.164 NC(=O)CCC1=CC=C(C=C1F)Br MCULE-2294102525 [0,1,0,0,0,0|2,0,0]=3 1188 B13R1.164 NC(=O)COC1=C(C=C(C=C1)Br)Br MCULE-5879690406 [0,1,0,0,0,0|3,0,0]=4 1189 B13R1.164 NC(=O)COC1=C(C=C(C=C1)Br)Cl MCULE-8196782479 [0,1,0,0,0,0|3,0,0]=4 1190 B13R1.164 NC(=O)COC1=C(C=C(C=C1)F)Cl MCULE-1885585060 [0,1,0,0,0,0|3,0,0]=4 1191 B13R1.164 NC(=O)COC1=C(C=C(C=C1)F)F MCULE-5147981868 [0,1,0,0,0,0|3,0,0]=4 1192 B13R1.164 NC(=O)COC1=CC=C(C=C1Br)N MCULE-2767877971 [0,1,0,0,0,0|2,0,0]=3 1193 B13R1.164 NC(=O)COC1=CC=C(C=C1Cl)Cl MCULE-4232728338 [0,1,0,0,0,0|3,0,0]=4 1194 B13R1.164 NC(=O)COC1=CC=C(C=C1F)N MCULE-7230201685 [0,1,0,0,0,0|2,0,0]=3 1195 B13R1.164 NC(=O)NCC1=C(C=C(C=C1)F)F MCULE-1272872650 [0,1,0,0,0,0|3,0,0]=4 1196 B13R1.164 NC1=C(C=CC(=C1)Br)C=CC(=O)O MCULE-5659461895 [0,1,0,0,0,0|1,0,2]=4 1197 B13R1.164 NC1=CC=C(C(=C1)Br)OCC(=O)O MCULE-6678781700 [0,1,0,0,0,0|1,0,0]=2 1198 B13R1.164 NC1=CC=C(C(=C1)F)CCC(=O)O MCULE-3007647292 [0,1,0,0,0,0|0,0,0]=1 1199 B13R1.164 NC1=NN=C(C(=O)N1)CCC(=O)O MCULE-3433231751 [0,1,0,0,0,0|3,0,0]=4 1200 B13R1.164 O=C(Cl)COC1=C(C=C(C=C1)Br)Br MCULE-8041283934 [0,1,0,0,0,0|3,0,0]=4 1201 B13R1.164 O=C(Cl)COC1=C(C=C(C=C1)Cl)Cl MCULE-6311903546 [0,1,0,0,0,0|3,0,0]=4 1202 B13R1.164 O=C(Cl)COC1=C(C=C(C=C1)F)F MCULE-3036083125 [0,1,0,0,0,0|3,0,0]=4 1203 B13R1.164 O=C(Cl)COC1=CC=C(C=C1Cl)Br MCULE-7139290333 [0,1,0,0,0,0|3,0,0]=4 1204 B13R1.164 O=C(Cl)COC1=CC=C(C=C1Cl)F MCULE-4628341214 [0,1,0,0,0,0|3,0,0]=4 1205 B13R1.164 O=C(O)/C=C/C1=C(C=C(C=C1)O)O MCULE-8901806840 [0,1,0,0,0,0|1,0,2]=4 1206 B13R1.164 O=C(O)/C=C/C1=CC=C(C=C1Br)F MCULE-9551168842 [0,1,0,0,0,0|1,0,2]=4 1207 B13R1.164 O=C(O)/C=C/C1=CC=C(C=C1Cl)Br MCULE-7469766132 [0,1,0,0,0,0|1,0,2]=4 1208 B13R1.164 O=C(O)/C=C/C1=CC=C(C=C1Cl)Cl MCULE-8879950993 [0,1,0,0,0,0|1,0,2]=4 1209 B13R1.164 O=C(O)/C=C/C1=CC=C(C=C1Cl)F MCULE-2764533633 [0,1,0,0,0,0|1,0,2]=4 1210 B13R1.164 O=C(O)/C=C/C1=CC=C(C=C1Cl)O MCULE-5108458607 [0,1,0,0,0,0|1,0,2]=4 1211 B13R1.164 O=C(O)/C=C/C1=CC=C(C=C1F)Br MCULE-5377311171 [0,1,0,0,0,0|1,0,2]=4 1212 B13R1.164 O=C(O)/C=C/C1=CC=C(C=C1F)Cl MCULE-2920880729 [0,1,0,0,0,0|1,0,2]=4 1213 B13R1.164 O=C(O)/C=C/C1=CC=C(C=C1F)F MCULE-4700179137 [0,1,0,0,0,0|1,0,2]=4 1214 B13R1.164 O=C(O)/C=C/C1=CC=C(C=C1F)O MCULE-7956565234 [0,1,0,0,0,0|1,0,2]=4 1215 B13R1.164 O=C(O)C#CC1=C(C=C(C=C1)Cl)Cl MCULE-3418456401 [0,1,0,0,0,0|1,0,2]=4 1216 B13R1.164 O=C(O)C#CC1=C(C=C(C=C1)F)F MCULE-8739415657 [0,1,0,0,0,0|1,0,2]=4 1217 B13R1.164 O=C(O)C=CC1=C(C=C(C=C1)Br)Cl MCULE-6413142602 [0,1,0,0,0,0|1,0,2]=4 1218 B13R1.164 O=C(O)C=CC1=C(C=C(C=C1)F)Cl MCULE-6941911399 [0,1,0,0,0,0|1,0,2]=4 1219 B13R1.164 O=C(O)C=CC1=C(C=C(C=C1)O)O MCULE-9716894670 [0,1,0,0,0,0|1,0,2]=4 1220 B13R1.164 O=C(O)C=CC1=CC=C(C=C1Br)F MCULE-4038818020 [0,1,0,0,0,0|1,0,2]=4 1221 B13R1.164 O=C(O)C=CC1=CC=C(C=C1Cl)Cl MCULE-2855191386 [0,1,0,0,0,0|1,0,2]=4 1222 B13R1.164 O=C(O)C=CC1=CC=C(C=C1Cl)O MCULE-4385429603 [0,1,0,0,0,0|1,0,2]=4 1223 B13R1.164 O=C(O)C=CC1=CC=C(C=C1F)Br MCULE-5057667374 [0,1,0,0,0,0|1,0,2]=4 1224 B13R1.164 O=C(O)C=CC1=CC=C(C=C1F)Cl MCULE-1649504536 [0,1,0,0,0,0|1,0,2]=4 1225 B13R1.164 O=C(O)C=CC1=CC=C(C=C1F)F MCULE-6476217219 [0,1,0,0,0,0|1,0,2]=4 1226 B13R1.164 O=C(O)C=CC1=CC=C(C=C1F)O MCULE-4773815421 [0,1,0,0,0,0|1,0,2]=4 1227 B13R1.164 O=C(O)CCC1=C(C=C(C=C1)Br)Br MCULE-2555097895 [0,1,0,0,0,0|1,0,0]=2 1228 B13R1.164 O=C(O)CCC1=C(C=C(C=C1)Br)F MCULE-2307054648 [0,1,0,0,0,0|1,0,0]=2 1229 B13R1.164 O=C(O)CCC1=C(C=C(C=C1)Cl)Cl MCULE-4616446158 [0,1,0,0,0,0|1,0,0]=2 1230 B13R1.164 O=C(O)CCC1=C(C=C(C=C1)Cl)F MCULE-4908436802 [0,1,0,0,0,0|1,0,0]=2 1231 B13R1.164 O=C(O)CCC1=C(C=C(C=C1)Cl)O MCULE-7610233894 [0,1,0,0,0,0|1,0,0]=2 1232 B13R1.164 O=C(O)CCC1=C(C=C(C=C1)F)F MCULE-4713099592 [0,1,0,0,0,0|1,0,0]=2 1233 B13R1.164 O=C(O)CCC1=C(C=C(C=C1)O)Cl MCULE-3999378523 [0,1,0,0,0,0|1,0,0]=2 1234 B13R1.164 O=C(O)CCC1=C(C=C(C=C1)O)F MCULE-3984526308 [0,1,0,0,0,0|1,0,0]=2 1235 B13R1.164 O=C(O)CCC1=CC=C(C=C1Br)Cl MCULE-7576387587 [0,1,0,0,0,0|1,0,0]=2 1236 B13R1.164 O=C(O)CCC1=CC=C(C=C1Br)F MCULE-8205149810 [0,1,0,0,0,0|1,0,0]=2 1237 B13R1.164 O=C(O)CCC1=CC=C(C=C1Cl)Br MCULE-2448713732 [0,1,0,0,0,0|1,0,0]=2 1238 B13R1.164 O=C(O)CCC1=CC=C(C=C1Cl)F MCULE-2575221656 [0,1,0,0,0,0|1,0,0]=2 1239 B13R1.164 O=C(O)CCC1=CC=C(C=C1O)O MCULE-2725234741 [0,1,0,0,0,0|1,0,0]=2 1240 B13R1.164 O=C(O)CCN1C=CC(=O)NC1=O MCULE-2498545168 [0,1,0,0,0,0|3,0,0]=4 1241 B13R1.164 O=C(O)CNC1=CC=C(C=C1F)F MCULE-8553039611 [0,1,0,0,0,0|2,0,0]=3 1242 B13R1.164 O=C(O)COC1=C(C=C(C=C1)Br)Br MCULE-5338022751 [0,1,0,0,0,0|2,0,0]=3 1243 B13R1.164 O=C(O)COC1=C(C=C(C=C1)Br)Cl MCULE-2854812128 [0,1,0,0,0,0|2,0,0]=3 1244 B13R1.164 O=C(O)COC1=C(C=C(C=C1)Br)F MCULE-7103639142 [0,1,0,0,0,0|2,0,0]=3 1245 B13R1.164 O=C(O)COC1=C(C=C(C=C1)Cl)Cl MCULE-7323613760 [0,1,0,0,0,0|2,0,0]=3 1246 B13R1.164 O=C(O)COC1=C(C=C(C=C1)Cl)F MCULE-6325296568 [0,1,0,0,0,0|2,0,0]=3 1247 B13R1.164 O=C(O)COC1=C(C=C(C=C1)F)Br MCULE-2782899090 [0,1,0,0,0,0|2,0,0]=3 1248 B13R1.164 O=C(O)COC1=C(C=C(C=C1)F)Cl MCULE-1850622872 [0,1,0,0,0,0|2,0,0]=3 1249 B13R1.164 O=C(O)COC1=C(C=C(C=C1)F)F MCULE-6142280248 [0,1,0,0,0,0|2,0,0]=3 1250 B13R1.164 O=C(O)COC1=CC=C(C=C1Br)Cl MCULE-9503443931 [0,1,0,0,0,0|2,0,0]=3 1251 B13R1.164 O=C(O)COC1=CC=C(C=C1Cl)Cl MCULE-6841252961 [0,1,0,0,0,0|2,0,0]=3 1252 B13R1.164 O=C(O)COC1=CC=C(C=C1Cl)O MCULE-9424477231 [0,1,0,0,0,0|2,0,0]=3 1253 B13R1.164 O=C(O)COC1=CC=C(C=C1I)Cl MCULE-8358512420 [0,1,0,0,0,0|2,0,0]=3 1254 B13R1.164 O=C(O)COC1=CC=C(C=C1O)Cl MCULE-9623510680 [0,1,0,0,0,0|2,0,0]=3 1255 B13R1.164 O=C(O)COC1=NC=C(C=C1Cl)Cl MCULE-7969184423 [0,1,0,0,0,0|3,0,0]=4 1256 B13R1.164 O=C(O)CSC1=C(C=C(C=C1)F)Cl MCULE-6270813625 [0,1,0,0,0,0|2,0,0]=3 1257 B13R1.164 O=C(O)CSC1=C(C=C(C=C1)F)F MCULE-7511205312 [0,1,0,0,0,0|2,0,0]=3 1258 B13R1.164 O=C(O)CSC1=CC=C(C=C1Cl)Cl MCULE-7751197473 [0,1,0,0,0,0|2,0,0]=3 1259 B13R1.164 O=C([O-])COC1=CC=C(C=C1Cl)Cl MCULE-2432700258 [0,1,0,0,0,0|2,0,1]=4 1260 B13R1.164 O=C([O-])COC1=CC=C(C=C1Cl)Cl MCULE-5459302647 [0,1,0,0,0,0|2,0,1]=4 1261 B13R1.511 C=C(Br)CCC1=CC(=C(C=C1)Br)F MCULE-3976629416 [0,1,0,0,0,0|3,0,0]=4 1262 B13R1.511 C=C(Br)CCC1=CC(=C(C=C1)C)C MCULE-8529910060 [0,1,0,0,0,0|3,0,0]=4 1263 B13R1.511 C=C(Br)CCC1=CC(=C(C=C1)C)F MCULE-4310452346 [0,1,0,0,0,0|3,0,0]=4 1264 B13R1.511 C=C(Br)CCC1=CC(=C(C=C1)Cl)C MCULE-8179465500 [0,1,0,0,0,0|3,0,0]=4 1265 B13R1.511 C=C(Br)CCC1=CC(=C(C=C1)Cl)Cl MCULE-4844667608 [0,1,0,0,0,0|3,0,0]=4 1266 B13R1.511 C=C(Br)CCC1=CC(=C(C=C1)Cl)F MCULE-5312856587 [0,1,0,0,0,0|3,0,0]=4 1267 B13R1.511 C=C(Br)CCC1=CC(=C(C=C1)F)Br MCULE-1521056909 [0,1,0,0,0,0|3,0,0]=4 1268 B13R1.511 C=C(Br)CCC1=CC(=C(C=C1)F)C MCULE-1298387637 [0,1,0,0,0,0|3,0,0]=4 1269 B13R1.511 C=C(Br)CCC1=CC(=C(C=C1)F)Cl MCULE-4223830353 [0,1,0,0,0,0|3,0,0]=4 1270 B13R1.511 C=C(Br)CCC1=CC(=C(C=C1)F)F MCULE-1970453055 [0,1,0,0,0,0|3,0,0]=4 1271 B13R1.511 C=C(C)CCC1=CC(=C(C=C1)Br)F MCULE-6978606601 [0,1,0,0,0,0|3,0,0]=4 1272 B13R1.511 C=C(C)CCC1=CC(=C(C=C1)C)C MCULE-9757583794 [0,1,0,0,0,0|3,0,0]=4 1273 B13R1.511 C=C(C)CCC1=CC(=C(C=C1)C)F MCULE-9127202739 [0,1,0,0,0,0|3,0,0]=4 1274 B13R1.511 C=C(C)CCC1=CC(=C(C=C1)Cl)C MCULE-6628857640 [0,1,0,0,0,0|3,0,0]=4 1275 B13R1.511 C=C(C)CCC1=CC(=C(C=C1)Cl)Cl MCULE-4732438831 [0,1,0,0,0,0|3,0,0]=4 1276 B13R1.511 C=C(C)CCC1=CC(=C(C=C1)Cl)F MCULE-1191961285 [0,1,0,0,0,0|3,0,0]=4 1277 B13R1.511 C=C(C)CCC1=CC(=C(C=C1)F)Br MCULE-6082756524 [0,1,0,0,0,0|3,0,0]=4 1278 B13R1.511 C=C(C)CCC1=CC(=C(C=C1)F)C MCULE-9478434242 [0,1,0,0,0,0|3,0,0]=4 1279 B13R1.511 C=C(C)CCC1=CC(=C(C=C1)F)Cl MCULE-1020016834 [0,1,0,0,0,0|3,0,0]=4 1280 B13R1.511 C=C(C)CCC1=CC(=C(C=C1)F)F MCULE-7159184076 [0,1,0,0,0,0|3,0,0]=4 1281 B13R1.511 C=C(Cl)CCC1=CC(=C(C=C1)Br)F MCULE-9823207356 [0,1,0,0,0,0|3,0,0]=4 1282 B13R1.511 C=C(Cl)CCC1=CC(=C(C=C1)C)C MCULE-9165806735 [0,1,0,0,0,0|3,0,0]=4 1283 B13R1.511 C=C(Cl)CCC1=CC(=C(C=C1)C)F MCULE-2649049250 [0,1,0,0,0,0|3,0,0]=4 1284 B13R1.511 C=C(Cl)CCC1=CC(=C(C=C1)Cl)C MCULE-8584135064 [0,1,0,0,0,0|3,0,0]=4 1285 B13R1.511 C=C(Cl)CCC1=CC(=C(C=C1)Cl)Cl MCULE-4697645038 [0,1,0,0,0,0|3,0,0]=4 1286 B13R1.511 C=C(Cl)CCC1=CC(=C(C=C1)Cl)F MCULE-8959988859 [0,1,0,0,0,0|3,0,0]=4 1287 B13R1.511 C=C(Cl)CCC1=CC(=C(C=C1)F)Br MCULE-9715470316 [0,1,0,0,0,0|3,0,0]=4 1288 B13R1.511 C=C(Cl)CCC1=CC(=C(C=C1)F)C MCULE-7644522670 [0,1,0,0,0,0|3,0,0]=4 1289 B13R1.511 C=C(Cl)CCC1=CC(=C(C=C1)F)Cl MCULE-5704856242 [0,1,0,0,0,0|3,0,0]=4 1290 B13R1.511 C=C(Cl)CCC1=CC(=C(C=C1)F)F MCULE-8427230512 [0,1,0,0,0,0|3,0,0]=4 1291 B13R1.511 CC(=O)CCC1=CC(=C(C=C1)C)N MCULE-4932959317 [0,1,0,0,0,0|2,0,0]=3 1292 B13R1.511 CC(=O)CCC1=CC(=C(C=C1)Cl)Cl MCULE-8129638605 [0,1,0,0,0,0|2,0,0]=3 1293 B13R1.511 CC(=O)CCC1=CC(=C(C=C1)F)F MCULE-1820875347 [0,1,0,0,0,0|2,0,0]=3 1294 B13R1.511 CC(=O)CCC1=CC(=C(C=C1)O)O MCULE-9574412120 [0,1,0,0,0,0|2,0,0]=3 1295 B13R1.511 CC(=O)COC1=CC(=C(C=C1)Cl)Cl MCULE-9213442563 [0,1,0,0,0,0|3,0,0]=4 1296 B13R1.511 CC(=O)COC1=CC(=C(C=C1)F)F MCULE-9703516045 [0,1,0,0,0,0|3,0,0]=4 1297 B13R1.511 CC(=O)NCC1=CC(=C(C=C1)Cl)Cl MCULE-2010730263 [0,1,0,0,0,0|3,0,0]=4 1298 B13R1.511 CC(=O)NCC1=CC=C(C(=C1)C)I MCULE-7713399596 [0,1,0,0,0,0|3,0,0]=4 1299 B13R1.511 CC(=O)NCC1=CC=C(C(=C1)Cl)N MCULE-9661147475 [0,1,0,0,0,0|2,0,0]=3 1300 B13R1.511 CC(=O)OCC1=CC(=C(C=C1)C)Cl MCULE-4940005976 [0,1,0,0,0,0|3,0,0]=4 1301 B13R1.511 CC1=C(C=C(C=C1)/C=C/C(=O)O)C MCULE-8675537801 [0,1,0,0,0,0|1,0,2]=4 1302 B13R1.511 CC1=C(C=C(C=C1)C#CC(=O)O)C MCULE-8213962375 [0,1,0,0,0,0|1,0,2]=4 1303 B13R1.511 CC1=C(C=C(C=C1)C=CC(=O)O)C MCULE-6959300564 [0,1,0,0,0,0|1,0,2]=4 1304 B13R1.511 CC1=C(C=C(C=C1)CCC(=O)O)C MCULE-7369215560 [0,1,0,0,0,0|1,0,0]=2 1305 B13R1.511 CC1=C(C=C(C=C1)CCC(=O)O)Cl MCULE-9054375105 [0,1,0,0,0,0|1,0,0]=2 1306 B13R1.511 CC1=C(C=C(C=C1)CCC(=O)O)F MCULE-9844554977 [0,1,0,0,0,0|1,0,0]=2 1307 B13R1.511 CC1=C(C=C(C=C1)NCC(=O)O)C MCULE-4433663518 [0,1,0,0,0,0|2,0,0]=3 1308 B13R1.511 CC1=C(C=C(C=C1)NCC(=O)O)Cl MCULE-6917920620 [0,1,0,0,0,0|2,0,0]=3 1309 B13R1.511 CC1=C(C=C(C=C1)OCC(=O)O)F MCULE-6615768714 [0,1,0,0,0,0|2,0,0]=3 1310 B13R1.511 CC1=C(C=CC(=C1)/C=C/C(=O)O)F MCULE-5173802637 [0,1,0,0,0,0|1,0,2]=4 1311 B13R1.511 CC1=C(C=CC(=C1)C#CC(=O)O)F MCULE-4022425253 [0,1,0,0,0,0|1,0,2]=4 1312 B13R1.511 CC1=C(C=CC(=C1)C=CC(=O)O)F MCULE-2657198608 [0,1,0,0,0,0|1,0,2]=4 1313 B13R1.511 CC1=C(C=CC(=C1)CCC(=O)O)Br MCULE-9232565026 [0,1,0,0,0,0|1,0,0]=2 1314 B13R1.511 CC1=C(C=CC(=C1)CCC(=O)O)Cl MCULE-3566859648 [0,1,0,0,0,0|1,0,0]=2 1315 B13R1.511 CC1=C(C=CC(=C1)CCC(=O)O)F MCULE-7289492177 [0,1,0,0,0,0|1,0,0]=2 1316 B13R1.511 CC1=C(C=CC(=C1)OCC(=O)Cl)Cl MCULE-5486560530 [0,1,0,0,0,0|3,0,0]=4 1317 B13R1.511 CC1=C(C=CC(=C1)OCC(=O)N)Br MCULE-4877779476 [0,1,0,0,0,0|3,0,0]=4 1318 B13R1.511 CC1=C(C=CC(=C1)OCC(=O)N)Cl MCULE-2263459976 [0,1,0,0,0,0|3,0,0]=4 1319 B13R1.511 CC1=C(C=CC(=C1)OCC(=O)N)N MCULE-9670584356 [0,1,0,0,0,0|2,0,0]=3 1320 B13R1.511 CC1=C(C=CC(=C1)OCC(=O)O)N MCULE-6184550961 [0,1,0,0,0,0|1,0,0]=2 1321 B13R1.511 CC1=CC(=CC=C1Br)CNC(=O)N MCULE-8749221615 [0,1,0,0,0,0|3,0,0]=4 1322 B13R1.511 CC1=CC(=CC=C1Br)OCC(=O)O MCULE-6650767466 [0,1,0,0,0,0|2,0,0]=3 1323 B13R1.511 CC1=CC(=CC=C1Cl)C#CC(=O)O MCULE-7395467159 [0,1,0,0,0,0|1,0,2]=4 1324 B13R1.511 CC1=CC(=CC=C1Cl)OCC(=O)O MCULE-5714027283 [0,1,0,0,0,0|2,0,0]=3 1325 B13R1.511 CC1=CC(=CC=C1O)CCC(=O)O MCULE-3677897760 [0,1,0,0,0,0|1,0,0]=2 1326 B13R1.511 CC1=CC=C(C=C1Br)CCC(=O)O MCULE-8631544438 [0,1,0,0,0,0|1,0,0]=2 1327 B13R1.511 CC1=CC=C(C=C1Br)OCC(=O)N MCULE-7790616171 [0,1,0,0,0,0|3,0,0]=4 1328 B13R1.511 CC1=CC=C(C=C1C)OCC(=O)Cl MCULE-5252260016 [0,1,0,0,0,0|3,0,0]=4 1329 B13R1.511 CC1=CC=C(C=C1C)OCC(=O)O MCULE-8375976395 [0,1,0,0,0,0|2,0,0]=3 1330 B13R1.511 CC1=CC=C(C=C1Cl)C#CC(=O)O MCULE-1674735710 [0,1,0,0,0,0|1,0,2]=4 1331 B13R1.511 CC1=CC=C(C=C1Cl)OCC(=O)O MCULE-5852951057 [0,1,0,0,0,0|2,0,0]=3 1332 B13R1.511 CC1=CC=C(C=C1F)/C=C/C(=O)O MCULE-3854652052 [0,1,0,0,0,0|1,0,2]=4 1333 B13R1.511 CC1=CC=C(C=C1F)C#CC(=O)O MCULE-5011142257 [0,1,0,0,0,0|1,0,2]=4 1334 B13R1.511 CC1=CC=C(C=C1F)C=CC(=O)O MCULE-5209264711 [0,1,0,0,0,0|1,0,2]=4 1335 B13R1.511 CC1=CC=C(C=C1N)CCC(=O)O MCULE-2806484036 [0,1,0,0,0,0|1,0,0]=2 1336 B13R1.511 CC1=CC=C(C=C1O)CCC(=O)O MCULE-7926065965 [0,1,0,0,0,0|1,0,0]=2 1337 B13R1.511 CN1N=C(C=CC1=O)CCC(=O)O MCULE-1729956512 [0,1,0,0,0,0|3,0,0]=4 1338 B13R1.511 NC(=O)COC1=CC(=C(C=C1)F)Cl MCULE-4488545035 [0,1,0,0,0,0|3,0,0]=4 1339 B13R1.511 NC(=O)COC1=CC=C(C(=C1)Br)F MCULE-3325621284 [0,1,0,0,0,0|3,0,0]=4 1340 B13R1.511 NC(=O)NCC1=CC=C(C(=C1)Cl)Br MCULE-7981206804 [0,1,0,0,0,0|3,0,0]=4 1341 B13R1.511 NC(=O)NCC1=CC=C(C(=C1)F)Br MCULE-3784901318 [0,1,0,0,0,0|3,0,0]=4 1342 B13R1.511 NC1=C(C=CC(=C1)C=CC(=O)O)Cl MCULE-1654219778 [0,1,0,0,0,0|1,0,2]=4 1343 B13R1.511 NC1=C(C=CC(=C1)CCC(=O)O)O MCULE-5447737067 [0,1,0,0,0,0|1,0,0]=2 1344 B13R1.511 NC1=CC(=CC=C1Br)CCC(=O)O MCULE-3775547039 [0,1,0,0,0,0|1,0,0]=2 1345 B13R1.511 NC1=CC=C(C=C1Cl)C=CC(=O)O MCULE-6975721435 [0,1,0,0,0,0|0,0,2]=3 1346 B13R1.511 O=C(Cl)CCC1=CC=C(C(=C1)Cl)Cl MCULE-9499710368 [0,1,0,0,0,0|2,0,0]=3 1347 B13R1.511 O=C(Cl)COC1=CC(=C(C=C1)F)Cl MCULE-6805755669 [0,1,0,0,0,0|3,0,0]=4 1348 B13R1.511 O=C(Cl)COC1=CC=C(C(=C1)Cl)Cl MCULE-2733472044 [0,1,0,0,0,0|3,0,0]=4 1349 B13R1.511 O=C(O)/C=C/C1=CC(=C(C=C1)Cl)F MCULE-5576902212 [0,1,0,0,0,0|1,0,2]=4 1350 B13R1.511 O=C(O)/C=C/C1=CC(=C(C=C1)F)F MCULE-3234178172 [0,1,0,0,0,0|1,0,2]=4 1351 B13R1.511 O=C(O)/C=C/C1=CC(=C(C=C1)O)Br MCULE-7396580804 [0,1,0,0,0,0|1,0,2]=4 1352 B13R1.511 O=C(O)/C=C/C1=CC=C(C(=C1)Br)F MCULE-2729340184 [0,1,0,0,0,0|1,0,2]=4 1353 B13R1.511 O=C(O)/C=C/C1=CC=C(C(=C1)Cl)Cl MCULE-8962863133 [0,1,0,0,0,0|1,0,2]=4 1354 B13R1.511 O=C(O)/C=C/C1=CC=C(C(=C1)Cl)F MCULE-2895897404 [0,1,0,0,0,0|1,0,2]=4 1355 B13R1.511 O=C(O)/C=C/C1=CC=C(C(=C1)F)Br MCULE-3222597984 [0,1,0,0,0,0|1,0,2]=4 1356 B13R1.511 O=C(O)/C=C/C1=CC=C(C(=C1)O)Cl MCULE-3292670858 [0,1,0,0,0,0|1,0,2]=4 1357 B13R1.511 O=C(O)/C=C/C1=CC=C(C(=C1)O)O MCULE-7843599914 [0,1,0,0,0,0|1,0,2]=4 1358 B13R1.511 O=C(O)/C=C\C1=CC=C(C(=C1)O)O MCULE-3932376334 [0,1,0,0,0,0|1,0,2]=4 1359 B13R1.511 O=C(O)C#CC1=CC(=C(C=C1)Br)F MCULE-2853233432 [0,1,0,0,0,0|1,0,2]=4 1360 B13R1.511 O=C(O)C#CC1=CC(=C(C=C1)Cl)Cl MCULE-8688045989 [0,1,0,0,0,0|1,0,2]=4 1361 B13R1.511 O=C(O)C#CC1=CC(=C(C=C1)F)Cl MCULE-2771507980 [0,1,0,0,0,0|1,0,2]=4 1362 B13R1.511 O=C(O)C#CC1=CC(=C(C=C1)F)F MCULE-2724448202 [0,1,0,0,0,0|1,0,2]=4 1363 B13R1.511 O=C(O)C#CC1=CC=C(C(=C1)F)Cl MCULE-3440954644 [0,1,0,0,0,0|1,0,2]=4 1364 B13R1.511 O=C(O)C=CC1=CC(=C(C=C1)Br)Cl MCULE-5185847063 [0,1,0,0,0,0|1,0,2]=4 1365 B13R1.511 O=C(O)C=CC1=CC(=C(C=C1)Cl)Cl MCULE-1205886577 [0,1,0,0,0,0|1,0,2]=4 1366 B13R1.511 O=C(O)C=CC1=CC(=C(C=C1)F)Cl MCULE-3526170057 [0,1,0,0,0,0|1,0,2]=4 1367 B13R1.511 O=C(O)C=CC1=CC(=C(C=C1)O)Br MCULE-9742346554 [0,1,0,0,0,0|1,0,2]=4 1368 B13R1.511 O=C(O)C=CC1=CC=C(C(=C1)Br)F MCULE-2097187879 [0,1,0,0,0,0|1,0,2]=4 1369 B13R1.511 O=C(O)C=CC1=CC=C(C(=C1)Cl)O MCULE-4338551904 [0,1,0,0,0,0|1,0,2]=4 1370 B13R1.511 O=C(O)C=CC1=CC=C(C(=C1)F)Br MCULE-1588801458 [0,1,0,0,0,0|1,0,2]=4 1371 B13R1.511 O=C(O)C=CC1=CC=C(C(=C1)F)Cl MCULE-9971364851 [0,1,0,0,0,0|1,0,2]=4 1372 B13R1.511 O=C(O)C=CC1=CC=C(C(=C1)F)F MCULE-9113864590 [0,1,0,0,0,0|1,0,2]=4 1373 B13R1.511 O=C(O)C=CC1=CC=C(C(=C1)F)O MCULE-8266589882 [0,1,0,0,0,0|1,0,2]=4 1374 B13R1.511 O=C(O)C=CC1=CC=C(C(=C1)O)O MCULE-2069871168 [0,1,0,0,0,0|1,0,2]=4 1375 B13R1.511 O=C(O)CCC1=CC(=C(C=C1)Br)Cl MCULE-2058184264 [0,1,0,0,0,0|1,0,0]=2 1376 B13R1.511 O=C(O)CCC1=CC(=C(C=C1)Cl)Cl MCULE-6356184282 [0,1,0,0,0,0|1,0,0]=2 1377 B13R1.511 O=C(O)CCC1=CC(=C(C=C1)Cl)F MCULE-2041860695 [0,1,0,0,0,0|1,0,0]=2 1378 B13R1.511 O=C(O)CCC1=CC(=C(C=C1)F)Cl MCULE-2045173249 [0,1,0,0,0,0|1,0,0]=2 1379 B13R1.511 O=C(O)CCC1=CC(=C(C=C1)F)F MCULE-8785469868 [0,1,0,0,0,0|1,0,0]=2 1380 B13R1.511 O=C(O)CCC1=CC(=C(C=C1)O)Br MCULE-7229181192 [0,1,0,0,0,0|1,0,0]=2 1381 B13R1.511 O=C(O)CCC1=CC(=C(C=C1)O)Cl MCULE-4283987039 [0,1,0,0,0,0|1,0,0]=2 1382 B13R1.511 O=C(O)CCC1=CC(=C(C=C1)O)F MCULE-8491503229 [0,1,0,0,0,0|1,0,0]=2 1383 B13R1.511 O=C(O)CCC1=CC=C(C(=C1)Br)Cl MCULE-3510621934 [0,1,0,0,0,0|1,0,0]=2 1384 B13R1.511 O=C(O)CCC1=CC=C(C(=C1)Br)F MCULE-4528970991 [0,1,0,0,0,0|1,0,0]=2 1385 B13R1.511 O=C(O)CCC1=CC=C(C(=C1)F)Br MCULE-2316980738 [0,1,0,0,0,0|1,0,0]=2 1386 B13R1.511 O=C(O)CCC1=CC=C(C(=C1)O)O MCULE-4912045197 [0,1,0,0,0,0|1,0,0]=2 1387 B13R1.511 O=C(O)CNC1=CC(=C(C=C1)Cl)Cl MCULE-8875316618 [0,1,0,0,0,0|2,0,0]=3 1388 B13R1.511 O=C(O)CNC1=CC(=C(C=C1)F)F MCULE-4047787768 [0,1,0,0,0,0|2,0,0]=3 1389 B13R1.511 O=C(O)COC1=CC(=C(C=C1)Br)Cl MCULE-9988419391 [0,1,0,0,0,0|2,0,0]=3 1390 B13R1.511 O=C(O)COC1=CC(=C(C=C1)Cl)Cl MCULE-6424078403 [0,1,0,0,0,0|2,0,0]=3 1391 B13R1.511 O=C(O)COC1=CC(=C(C=C1)Cl)F MCULE-7352394066 [0,1,0,0,0,0|2,0,0]=3 1392 B13R1.511 O=C(O)COC1=CC(=C(C=C1)F)Cl MCULE-1901057260 [0,1,0,0,0,0|2,0,0]=3 1393 B13R1.511 O=C(O)COC1=CC=C(C(=C1)F)F MCULE-3135417258 [0,1,0,0,0,0|2,0,0]=3 1394 B13R1.511 O=C(O)CSC1=CC(=C(C=C1)F)F MCULE-4600275595 [0,1,0,0,0,0|2,0,0]=3 1395 B13R1.511 O=C(O)CSC1=CC=C(C(=C1)Cl)Cl MCULE-2499846224 [0,1,0,0,0,0|2,0,0]=3 1396 B13R1.511 O=N(=O)CCC1=CC(=C(C=C1)F)F MCULE-9630411940 [0,1,0,0,0,0|2,0,1]=4 1397 B13R1.512 CC(C)(C)CCC1=CC=C(C=C1)N MCULE-7654859631 [0,1,0,0,0,0|2,0,1]=4 1398 B13R1.512 CC(C)(O)CCC1=CC=C(C=C1)Br MCULE-3973368675 [0,1,0,0,0,0|2,0,1]=4 1399 B13R1.512 CC(C)(O)CCC1=CC=C(C=C1)Cl MCULE-3860744962 [0,1,0,0,0,0|2,0,1]=4 1400 B13R1.512 CC(C)(O)CCC1=CC=C(C=C1)F MCULE-5773080540 [0,1,0,0,0,0|2,0,1]=4 1401 B13R1.512 CC(C)(O)COC1=CC=C(C=C1)N MCULE-1728774876 [0,1,0,0,0,0|2,0,1]=4 1402 B13R1.512 CC1=CC=C(C=C1)CCC(C)(C)O MCULE-5054151625 [0,1,0,0,0,0|2,0,1]=4 1403 B13R1.512 CC1=CC=C(C=C1)CCS(=O)(=O)Cl MCULE-2716080948 [0,1,0,0,0,0|2,0,1]=4 1404 B13R1.512 CC1=CC=C(C=C1)CCS(=O)(=O)N MCULE-6201992787 [0,1,0,0,0,0|2,0,1]=4 1405 B13R1.512 CS(=O)(=O)CCC1=CC=C(C=C1)Br MCULE-8702989810 [0,1,0,0,0,0|2,0,1]=4 1406 B13R1.512 CS(=O)(=O)CCC1=CC=C(C=C1)N MCULE-5790342127 [0,1,0,0,0,0|1,0,1]=3 1407 B13R1.512 CS(=O)(=O)CCC1=CC=C(C=N1)N MCULE-2831996456 [0,1,0,0,0,0|2,0,1]=4 1408 B13R1.512 CS(=O)(=O)NCC1=CC=C(C=C1)N MCULE-9630890393 [0,1,0,0,0,0|2,0,1]=4 1409 B13R1.512 CS(=O)(=O)NCC1=CC=C(C=C1)N MCULE-9862719543 [0,1,0,0,0,0|2,0,1]=4 1410 B13R1.512 C[Si](C)(C)CCC1=CC=C(C=C1)N MCULE-3172730284 [0,1,0,0,0,0|2,1,0]=4 1411 B13R1.512 NC1=CC=C(C=C1)CCC(F)(F)F MCULE-8774323070 [0,1,0,0,0,0|2,0,1]=4 1412 B13R1.512 NS(=O)(=O)CCC1=CC=C(C=C1)Br MCULE-7514118089 [0,1,0,0,0,0|2,0,1]=4 1413 B13R1.512 NS(=O)(=O)CCC1=CC=C(C=C1)Cl MCULE-1730187194 [0,1,0,0,0,0|2,0,1]=4 1414 B13R1.512 NS(=O)(=O)CCC1=CC=C(C=C1)F MCULE-9425211049 [0,1,0,0,0,0|2,0,1]=4 1415 B13R1.512 O=S(=O)(Cl)CCC1=CC=C(C=C1)Br MCULE-8775002033 [0,1,0,0,0,0|2,0,1]=4 1416 B13R1.512 O=S(=O)(Cl)CCC1=CC=C(C=C1)Cl MCULE-4565456495 [0,1,0,0,0,0|2,0,1]=4 1417 B13R1.512 O=S(=O)(Cl)CCC1=CC=C(C=C1)F MCULE-5074858710 [0,1,0,0,0,0|2,0,1]=4 1418 B13R1.512 O=S(=O)(O)CCC1=CC=C(C=C1)F MCULE-4097439905 [0,1,0,0,0,0|2,0,0]=3 1419 B13R2.147 CC1=CC=C(C=C1)C2CC(=O)C2 MCULE-4026232897 [0,0,0,1,0,0|2,0,0]=3 1420 B13R2.147 CN1CC(C1)C2=CC=C(C=C2)N MCULE-2366881122 [0,0,0,1,0,0|3,0,0]=4 1421 B13R2.147 NC1=CC=C(C=C1)C2CC(C2)F MCULE-8153280742 [0,0,0,1,0,0|2,0,1]=4 1422 B13R2.147 NC1=CC=C(C=C1)N2CC(C2)O MCULE-8529315435 [0,0,0,1,0,0|2,0,1]=4 1423 B13R2.147 O=C1CC(C1)C2=CC=C(C=C2)Br MCULE-8765362271 [0,0,0,1,0,0|2,0,0]=3 1424 B13R2.147 O=C1CC(C1)C2=CC=C(C=C2)Cl MCULE-7977985405 [0,0,0,1,0,0|2,0,0]=3 1425 B13R2.147 O=C1CC(C1)C2=CC=C(C=C2)F MCULE-1434264849 [0,0,0,1,0,0|2,0,0]=3 1426 B13R2.147 O=C1CC(N1)C2=CC=C(C=C2)Br MCULE-8590646785 [0,0,0,1,0,0|2,0,0]=3 1427 B13R2.147 O=C1CC(N1)C2=CC=C(C=C2)Cl MCULE-3636422819 [0,0,0,1,0,0|2,0,0]=3 1428 B13R2.147 O=C1CC(N1)C2=CC=C(C=C2)F MCULE-7402179724 [0,0,0,1,0,0|2,0,0]=3 1429 B13R2.147 OC1CC(C1)C2=CC=C(C=C2)Br MCULE-5605569852 [0,0,0,1,0,0|2,0,1]=4 1430 B13R2.147 OC1CC(C1)C2=CC=C(C=C2)F MCULE-5819012717 [0,0,0,1,0,0|2,0,1]=4 1431 B13R2.147 O[C@H]1C[C@@H](C1)C2=CC=C(C=C2)Br MCULE-2085030870 [0,0,0,1,0,0|2,0,1]=4 1432 B13R2.155 CC1=CC2=C(C=C1)CCC(=O)C2 MCULE-9987420229 [0,0,0,1,0,0|2,0,0]=3 1433 B13R2.155 CC1=CC2=C(C=C1)CCC(=O)N2 MCULE-2583629561 [0,0,0,1,0,0|2,0,0]=3 1434 B13R2.155 CC1=CC2=C(C=C1)NCC(=O)N2 MCULE-5537583474 [0,0,0,1,0,0|3,0,0]=4 1435 B13R2.155 CC1=CC2=NC(=O)CCN2C=C1 MCULE-6723531523 [0,0,0,1,0,0|3,0,0]=4 1436 B13R2.155 CC1=CC2=NC(=O)CCN2C=C1 MCULE-9651289668 [0,0,0,1,0,0|3,0,0]=4 1437 B13R2.155 CC1=CC=C2C=CC(=O)OC2=C1 MCULE-2415904047 [0,0,0,1,0,0|1,0,2]=4 1438 B13R2.155 CC1=CC=C2OCC(=O)NC2=C1 MCULE-8315381896 [0,0,0,1,0,0|3,0,0]=4 1439 B13R2.155 CC1=NC2=C(C=C1)CCC(=O)N2 MCULE-4469348369 [0,0,0,1,0,0|3,0,0]=4 1440 B13R2.155 CN1CCC2=C(C1)C=C(C=C2)N MCULE-7987773175 [0,0,0,1,0,0|3,0,0]=4 1441 B13R2.155 NC1=CC2=C(C=C1)CCC(=O)N2 MCULE-5996516139 [0,0,0,1,0,0|1,0,0]=2 1442 B13R2.155 NC1=CC2=C(C=C1)CCC(C2)N MCULE-1409586810 [0,0,0,1,0,0|2,0,1]=4 1443 B13R2.155 NC1=CC2=C(C=C1)CCC(C2)N MCULE-7542534612 [0,0,0,1,0,0|2,0,1]=4 1444 B13R2.155 NC1=CC2=C(C=C1)CNC(=O)N2 MCULE-7368346068 [0,0,0,1,0,0|2,0,0]=3 1445 B13R2.155 NC1=CC2=C(C=C1)N=CC(=O)N2 MCULE-8622235464 [0,0,0,1,0,0|2,0,1]=4 1446 B13R2.155 NC1=CC2=C(C=C1)NCC(=O)N2 MCULE-7908943274 [0,0,0,1,0,0|2,0,0]=3 1447 B13R2.155 NC1=CC2=C(C=C1)NCC(=O)N2 MCULE-8074521278 [0,0,0,1,0,0|2,0,0]=3 1448 B13R2.155 NC1=CC2=C(C=C1)SCC(=O)N2 MCULE-2849730220 [0,0,0,1,0,0|2,0,0]=3 1449 B13R2.155 NC1=CC2=C(C=CC(=O)N2)C=C1 MCULE-2598128791 [0,0,0,1,0,0|1,0,2]=4 1450 B13R2.155 NC1=CC2=C(C=CC(=O)O2)C=C1 MCULE-7327867052 [0,0,0,1,0,0|0,0,2]=3 1451 B13R2.155 NC1=CC2=CC(=CC=C2C=C1)O MCULE-6831761510 [0,0,0,1,0,0|1,0,2]=4 1452 B13R2.155 NC1=CC2=NC(=O)CN=C2C=C1 MCULE-8023402073 [0,0,0,1,0,0|2,0,0]=3 1453 B13R2.155 NC1=CC=C2C=CC(=CC2=C1)O MCULE-3647334196 [0,0,0,1,0,0|1,0,2]=4 1454 B13R2.155 NC1=CC=C2CNC(=O)CC2=C1 MCULE-1959501128 [0,0,0,1,0,0|2,0,0]=3 1455 B13R2.155 NC1=CC=C2CNC(=O)CC2=C1 MCULE-4107772488 [0,0,0,1,0,0|2,0,0]=3 1456 B13R2.155 NC1=CC=C2COC(=O)NC2=C1 MCULE-7964785221 [0,0,0,1,0,0|2,0,0]=3 1457 B13R2.155 NC1=CC=C2N=CC(=CC2=C1)O MCULE-7602464848 [0,0,0,1,0,0|2,0,1]=4 1458 B13R2.155 NC1=CC=C2OCC(=O)NC2=C1 MCULE-9546724404 [0,0,0,1,0,0|2,0,0]=3 1459 B13R2.155 NC1=CC=C2OCC(=O)NC2=N1 MCULE-4862318357 [0,0,0,1,0,0|3,0,0]=4 1460 B13R2.155 NC1=CN=C2NCC(=O)NC2=C1 MCULE-8902373516 [0,0,0,1,0,0|3,0,0]=4 1461 B13R2.155 O=C1C=CC2=C(O1)C=C(C=C2)Br MCULE-2559035501 [0,0,0,1,0,0|1,0,2]=4 1462 B13R2.155 O=C1C=CC2=C(O1)C=C(C=C2)Cl MCULE-2787520400 [0,0,0,1,0,0|1,0,2]=4 1463 B13R2.155 O=C1C=CC2=C(O1)C=C(C=C2)F MCULE-9052691894 [0,0,0,1,0,0|1,0,2]=4 1464 B13R2.155 O=C1C=CC2=CC=C(C=C2O1)O MCULE-5007617058 [0,0,0,1,0,0|1,0,2]=4 1465 B13R2.155 O=C1CC2=C(C=CC(=C2)Br)CN1 MCULE-4090426256 [0,0,0,1,0,0|3,0,0]=4 1466 B13R2.155 O=C1CC2=CC(=CC=C2CN1)F MCULE-1924536961 [0,0,0,1,0,0|3,0,0]=4 1467 B13R2.155 O=C1CCC2=C(C1)C=C(C=C2)Br MCULE-5969552506 [0,0,0,1,0,0|2,0,0]=3 1468 B13R2.155 O=C1CCC2=C(C1)C=C(C=C2)F MCULE-4980281115 [0,0,0,1,0,0|2,0,0]=3 1469 B13R2.155 O=C1CCC2=C(C1)C=C(C=C2)O MCULE-5192490745 [0,0,0,1,0,0|2,0,0]=3 1470 B13R2.155 O=C1CCC2=C(N1)C=C(C=C2)Br MCULE-7180144154 [0,0,0,1,0,0|2,0,0]=3 1471 B13R2.155 O=C1CCC2=C(N1)C=C(C=C2)F MCULE-7200338761 [0,0,0,1,0,0|2,0,0]=3 1472 B13R2.155 O=C1CCC2=C(N1)C=C(C=C2)I MCULE-9156103685 [0,0,0,1,0,0|2,0,0]=3 1473 B13R2.155 O=C1CCC2=C(O1)C=C(C=C2)Br MCULE-2010710950 [0,0,0,1,0,0|1,0,0]=2 1474 B13R2.155 O=C1CCC2=C(O1)C=C(C=C2)O MCULE-6746977571 [0,0,0,1,0,0|1,0,0]=2 1475 B13R2.155 O=C1CCC2=CC=C(C=C2C1)Cl MCULE-4787795197 [0,0,0,1,0,0|2,0,0]=3 1476 B13R2.155 O=C1CCC2=CC=C(C=C2N1)Cl MCULE-6670256261 [0,0,0,1,0,0|2,0,0]=3 1477 B13R2.155 O=C1CNC2=C(N1)C=C(C=C2)Br MCULE-9357712212 [0,0,0,1,0,0|3,0,0]=4 1478 B13R2.155 O=C1CNC2=C(N1)C=C(C=C2)Cl MCULE-8194334613 [0,0,0,1,0,0|3,0,0]=4 1479 B13R2.155 O=C1CNC2=C(N1)C=C(C=C2)F MCULE-2256166683 [0,0,0,1,0,0|3,0,0]=4 1480 B13R2.155 O=C1CNC2=CC=C(C=C2O1)Cl MCULE-2950789965 [0,0,0,1,0,0|2,0,0]=3 1481 B13R2.155 O=C1COC2=C(C1)C=C(C=C2)Cl MCULE-9603339872 [0,0,0,1,0,0|3,0,0]=4 1482 B13R2.155 O=C1COC2=C(N1)C=C(C=C2)Br MCULE-6898829857 [0,0,0,1,0,0|3,0,0]=4 1483 B13R2.155 O=C1COC2=CC=C(C=C2C1)Br MCULE-7372377221 [0,0,0,1,0,0|3,0,0]=4 1484 B13R2.155 O=C1COC2=CC=C(C=C2N1)Cl MCULE-7161800064 [0,0,0,1,0,0|3,0,0]=4 1485 B13R2.155 O=C1COC2=CC=C(C=C2N1)F MCULE-6555453006 [0,0,0,1,0,0|3,0,0]=4 1486 B13R2.155 O=C1COC2=CC=C(C=C2N1)O MCULE-9803574556 [0,0,0,1,0,0|3,0,0]=4 1487 B13R2.155 O=C1CSC2=C(N1)C=C(C=C2)Br MCULE-5535689070 [0,0,0,1,0,0|3,0,0]=4 1488 B13R2.155 O=C1CSC2=C(N1)C=C(C=C2)F MCULE-8549069347 [0,0,0,1,0,0|3,0,0]=4 1489 B13R2.155 O=C1NC2=C(C=CC(=C2)Cl)CO1 MCULE-9898362881 [0,0,0,1,0,0|3,0,0]=4 1490 B13R2.155 O=C1NC2=C(C=CC(=C2)F)CO1 MCULE-9107968414 [0,0,0,1,0,0|3,0,0]=4 1491 B13R2.155 O=C1NC2=CC(=CC=C2CO1)Br MCULE-6754987450 [0,0,0,1,0,0|3,0,0]=4 1492 B13R2.155 O=C1NCC2=C(N1)C=C(C=C2)Br MCULE-7421177960 [0,0,0,1,0,0|3,0,0]=4 1493 B13R2.155 O=C1NCC2=C(O1)C=C(C=C2)O MCULE-4827911064 [0,0,0,1,0,0|2,0,0]=3 1494 B13R2.155 OC1=CC=C2CCC(=NC2=C1)O MCULE-7778836604 [0,0,0,1,0,0|2,0,0]=3 1495 B13R2.155 OC1=NC2=CC(=CN=C2CC1)Br MCULE-6144837711 [0,0,0,1,0,0|3,0,0]=4 1496 B13R2.527 NC1=CC=C(C=C1)CCC2CC2 MCULE-1270782462 [0,0,0,1,0,0|2,0,1]=4 1497 B13R2.527 NC1=CC=C(C=C1)CCC2CC2 MCULE-4025755729 [0,0,0,1,0,0|2,0,1]=4 1498 B13R2.527 NC1=CC=C(C=C1)OCC2CO2 MCULE-8558650405 [0,0,0,1,0,0|2,0,1]=4 1499 B13R2.2988 NC1=CC=C(C=C1)C2CC2(Cl)Cl MCULE-8653491246 [0,0,0,1,0,0|2,0,1]=4 1500 B13R2.2988 NC1=CC=C(C=C1)C2CC2(F)F MCULE-1019468925 [0,0,0,1,0,0|2,0,1]=4 1501 B13R2.3791 NC1=CC2=C(C=C1)CCS2(=O)=O MCULE-7937205560 [0,0,0,1,0,0|1,0,1]=3 1502 B13R2.3791 NC1=CC=C2CCC(C2=C1)(F)F MCULE-4680463991 [0,0,0,1,0,0|2,0,1]=4 1503 B13R2.3791 NC1=CC=C2CNS(=O)(=O)C2=C1 MCULE-6196679116 [0,0,0,1,0,0|2,0,1]=4 1504 B13R2.3791 O=S1(=O)CCC2=C1C=C(C=C2)Br MCULE-8880307683 [0,0,0,1,0,0|2,0,1]=4 1505 B13R2.4930 CC1=CC2=C(C=C1)CC2C(=O)O MCULE-7386817391 [0,0,0,1,0,0|1,0,0]=2 1506 B13R2.4930 O=C(O)C1CC2=C1C=C(C=C2)Cl MCULE-5001801283 [0,0,0,1,0,0|1,0,0]=2 1507 B13R2.4930 O=C(O)C1CC2=C1C=C(C=C2)F MCULE-2875865098 [0,0,0,1,0,0|1,0,0]=2 1508 B11R1.20 C=C(Br)CC1=CC=C(C=C1)Br MCULE-4221908700 [0,0,0,0,1,0|3,0,0]=4 1509 B11R1.20 C=C(Br)CC1=CC=C(C=C1)C MCULE-5718685660 [0,0,0,0,1,0|3,0,0]=4 1510 B11R1.20 C=C(Br)CC1=CC=C(C=C1)Cl MCULE-1702761203 [0,0,0,0,1,0|3,0,0]=4 1511 B11R1.20 C=C(Br)CC1=CC=C(C=C1)F MCULE-6620631680 [0,0,0,0,1,0|3,0,0]=4 1512 B11R1.20 C=C(Br)CC1=CC=C(C=C1)O MCULE-4261429252 [0,0,0,0,1,0|3,0,0]=4 1513 B11R1.20 C=C(C)CC1=CC=C(C=C1)Br MCULE-2049078645 [0,0,0,0,1,0|3,0,0]=4 1514 B11R1.20 C=C(C)CC1=CC=C(C=C1)C MCULE-2463949790 [0,0,0,0,1,0|3,0,0]=4 1515 B11R1.20 C=C(C)CC1=CC=C(C=C1)Cl MCULE-3583070094 [0,0,0,0,1,0|3,0,0]=4 1516 B11R1.20 C=C(C)CC1=CC=C(C=C1)F MCULE-5971467670 [0,0,0,0,1,0|3,0,0]=4 1517 B11R1.20 C=C(C)CC1=CC=C(C=C1)O MCULE-5728769328 [0,0,0,0,1,0|3,0,0]=4 1518 B11R1.20 C=C(Cl)CC1=CC=C(C=C1)Br MCULE-6088244763 [0,0,0,0,1,0|3,0,0]=4 1519 B11R1.20 C=C(Cl)CC1=CC=C(C=C1)C MCULE-9883417953 [0,0,0,0,1,0|3,0,0]=4 1520 B11R1.20 C=C(Cl)CC1=CC=C(C=C1)Cl MCULE-8056987339 [0,0,0,0,1,0|3,0,0]=4 1521 B11R1.20 C=C(Cl)CC1=CC=C(C=C1)F MCULE-8804526980 [0,0,0,0,1,0|3,0,0]=4 1522 B11R1.20 CC(=O)CC1=CC=C(C=C1)Br MCULE-2796276312 [0,0,0,0,1,0|2,0,0]=3 1523 B11R1.20 CC(=O)CC1=CC=C(C=C1)C MCULE-9432147559 [0,0,0,0,1,0|2,0,0]=3 1524 B11R1.20 CC(=O)CC1=CC=C(C=C1)Cl MCULE-3336422329 [0,0,0,0,1,0|2,0,0]=3 1525 B11R1.20 CC(=O)CC1=CC=C(C=C1)F MCULE-7867529938 [0,0,0,0,1,0|2,0,0]=3 1526 B11R1.20 CC(=O)CC1=CC=C(C=C1)I MCULE-4302219477 [0,0,0,0,1,0|2,0,0]=3 1527 B11R1.20 CC(=O)CC1=CC=C(C=C1)N MCULE-8992401567 [0,0,0,0,1,0|1,0,0]=2 1528 B11R1.20 CC(=O)CC1=CC=C(C=C1)O MCULE-1295731157 [0,0,0,0,1,0|2,0,0]=3 1529 B11R1.20 CC(=O)CC1=CC=C(C=N1)C MCULE-1729331146 [0,0,0,0,1,0|3,0,0]=4 1530 B11R1.20 CC(=O)CC1=CC=C(N=C1)Cl MCULE-2185292890 [0,0,0,0,1,0|3,0,0]=4 1531 B11R1.20 CC(=O)N=C1C=CC(=O)C=C1 MCULE-9623129492 [0,0,0,0,1,0|3,0,0]=4 1532 B11R1.20 CC(=O)NC1=CC=C(C=C1)Br MCULE-6298046548 [0,0,0,0,1,0|3,0,0]=4 1533 B11R1.20 CC(=O)NC1=CC=C(C=C1)C MCULE-9865765879 [0,0,0,0,1,0|3,0,0]=4 1534 B11R1.20 CC(=O)NC1=CC=C(C=C1)Cl MCULE-5567013952 [0,0,0,0,1,0|3,0,0]=4 1535 B11R1.20 CC(=O)NC1=CC=C(C=C1)F MCULE-8073383231 [0,0,0,0,1,0|3,0,0]=4 1536 B11R1.20 CC(=O)NC1=CC=C(C=C1)I MCULE-2439343180 [0,0,0,0,1,0|3,0,0]=4 1537 B11R1.20 CC(=O)NC1=CC=C(C=C1)N MCULE-7300788800 [0,0,0,0,1,0|2,0,0]=3 1538 B11R1.20 CC(=O)NC1=CC=C(C=C1)N MCULE-8040281733 [0,0,0,0,1,0|2,0,0]=3 1539 B11R1.20 CC(=O)NC1=CC=C(C=C1)O MCULE-3844920617 [0,0,0,0,1,0|3,0,0]=4 1540 B11R1.20 CC(=O)NC1=CC=C(C=C1)O MCULE-7875258536 [0,0,0,0,1,0|3,0,0]=4 1541 B11R1.20 CC(=O)NC1=CC=C(C=C1)S MCULE-9967717204 [0,0,0,0,1,0|3,0,0]=4 1542 B11R1.20 CC(=O)NC1=CN=C(C=C1)N MCULE-7585014068 [0,0,0,0,1,0|3,0,0]=4 1543 B11R1.20 CC(=O)NC1=NC=C(C=C1)N MCULE-9777855890 [0,0,0,0,1,0|3,0,0]=4 1544 B11R1.20 CC(=O)OC1=CC=C(C=C1)Br MCULE-7803021945 [0,0,0,0,1,0|3,0,0]=4 1545 B11R1.20 CC(=O)OC1=CC=C(C=C1)C MCULE-9528048538 [0,0,0,0,1,0|3,0,0]=4 1546 B11R1.20 CC(=O)OC1=CC=C(C=C1)Cl MCULE-3972290585 [0,0,0,0,1,0|3,0,0]=4 1547 B11R1.20 CC(=O)OC1=CC=C(C=C1)F MCULE-5900998246 [0,0,0,0,1,0|3,0,0]=4 1548 B11R1.20 CC(=O)OC1=CC=C(C=C1)I MCULE-3371535842 [0,0,0,0,1,0|3,0,0]=4 1549 B11R1.20 CC(=O)OC1=CC=C(C=C1)N MCULE-3680505336 [0,0,0,0,1,0|2,0,0]=3 1550 B11R1.20 CC(=O)OC1=CC=C(C=C1)N MCULE-5344257874 [0,0,0,0,1,0|2,0,0]=3 1551 B11R1.20 CC(=O)OC1=CC=C(C=C1)O MCULE-1061752766 [0,0,0,0,1,0|3,0,0]=4 1552 B11R1.20 CC(=O)OC1=CC=C(N=C1)N MCULE-6338279647 [0,0,0,0,1,0|3,0,0]=4 1553 B11R1.20 CC(=O)SC1=CC=C(C=C1)Cl MCULE-5795520257 [0,0,0,0,1,0|3,0,0]=4 1554 B11R1.20 CC(=O)SC1=CC=C(C=C1)F MCULE-2664109566 [0,0,0,0,1,0|3,0,0]=4 1555 B11R1.20 CC(C)CC1=CC=C(C=C1)N MCULE-8392779304 [0,0,0,0,1,0|2,0,1]=4 1556 B11R1.20 CC(O)CC1=CC=C(C=C1)Br MCULE-1180789487 [0,0,0,0,1,0|2,0,1]=4 1557 B11R1.20 CC(O)CC1=CC=C(C=C1)Cl MCULE-4333771981 [0,0,0,0,1,0|2,0,1]=4 1558 B11R1.20 CC(O)CC1=CC=C(C=C1)F MCULE-6114218839 [0,0,0,0,1,0|2,0,1]=4 1559 B11R1.20 CC1=CC=C(C=C1)CC(=N)N MCULE-5075929044 [0,0,0,0,1,0|3,0,0]=4 1560 B11R1.20 CC1=CC=C(C=C1)CC(=N)N MCULE-9937084604 [0,0,0,0,1,0|3,0,0]=4 1561 B11R1.20 CC1=CC=C(C=C1)CC(=O)Cl MCULE-8548926281 [0,0,0,0,1,0|2,0,0]=3 1562 B11R1.20 CC1=CC=C(C=C1)CC(=O)O MCULE-7836754263 [0,0,0,0,1,0|1,0,0]=2 1563 B11R1.20 CC1=CC=C(C=C1)CC(=S)N MCULE-8275142300 [0,0,0,0,1,0|2,1,0]=4 1564 B11R1.20 CC1=CC=C(C=C1)CC(C)O MCULE-7671597907 [0,0,0,0,1,0|2,0,1]=4 1565 B11R1.20 CC1=CC=C(C=C1)NC(=O)N MCULE-8260992525 [0,0,0,0,1,0|3,0,0]=4 1566 B11R1.20 CC1=CC=C(C=C1)OC(=O)Cl MCULE-6680728012 [0,0,0,0,1,0|3,0,0]=4 1567 B11R1.20 CC1=CN=C(C=C1)CC(=O)O MCULE-4500305633 [0,0,0,0,1,0|2,0,0]=3 1568 B11R1.20 CC1=CN=C(C=C1)CC(=O)O MCULE-6746029360 [0,0,0,0,1,0|2,0,0]=3 1569 B11R1.20 CC1=CN=C(C=C1)CC(=O)[O-] MCULE-9650379320 [0,0,0,0,1,0|2,0,1]=4 1570 B11R1.20 CC1=CN=C(N=C1)CC(=O)O MCULE-2076483894 [0,0,0,0,1,0|3,0,0]=4 1571 B11R1.20 CC1=NC=C(C=C1)CC(=O)O MCULE-1929752400 [0,0,0,0,1,0|2,0,0]=3 1572 B11R1.20 CC1=NC=C(N=C1)CC(=O)O MCULE-8630828920 [0,0,0,0,1,0|3,0,0]=4 1573 B11R1.20 CC1=NN=C(C=C1)CC(=O)O MCULE-2114198542 [0,0,0,0,1,0|3,0,0]=4 1574 B11R1.20 CN(C)CC1=CC=C(C=C1)N MCULE-4015067972 [0,0,0,0,1,0|3,0,0]=4 1575 B11R1.20 CN(C)CC1=CC=C(C=C1)N MCULE-5128503527 [0,0,0,0,1,0|3,0,0]=4 1576 B11R1.20 CN(C)CC1=CC=C(C=C1)N MCULE-9923964869 [0,0,0,0,1,0|3,0,0]=4 1577 B11R1.20 N=C(N)CC1=CC=C(C=C1)Br MCULE-1307555817 [0,0,0,0,1,0|3,0,0]=4 1578 B11R1.20 N=C(N)CC1=CC=C(C=C1)Br MCULE-1816026163 [0,0,0,0,1,0|3,0,0]=4 1579 B11R1.20 N=C(N)CC1=CC=C(C=C1)Cl MCULE-3668076389 [0,0,0,0,1,0|3,0,0]=4 1580 B11R1.20 N=C(N)CC1=CC=C(C=C1)Cl MCULE-3780079299 [0,0,0,0,1,0|3,0,0]=4 1581 B11R1.20 N=C(N)CC1=CC=C(C=C1)F MCULE-3764956220 [0,0,0,0,1,0|3,0,0]=4 1582 B11R1.20 N=C(N)CC1=CC=C(C=C1)F MCULE-4100385035 [0,0,0,0,1,0|3,0,0]=4 1583 B11R1.20 N=C(N)CC1=CC=C(C=C1)I MCULE-5353962556 [0,0,0,0,1,0|3,0,0]=4 1584 B11R1.20 NC(=O)CC1=CC=C(C=C1)Br MCULE-6494224473 [0,0,0,0,1,0|2,0,0]=3 1585 B11R1.20 NC(=O)CC1=CC=C(C=C1)Cl MCULE-5575880469 [0,0,0,0,1,0|2,0,0]=3 1586 B11R1.20 NC(=O)CC1=CC=C(C=C1)F MCULE-5260225130 [0,0,0,0,1,0|2,0,0]=3 1587 B11R1.20 NC(=O)CC1=CC=C(C=C1)I MCULE-5828221034 [0,0,0,0,1,0|2,0,0]=3 1588 B11R1.20 NC(=O)CC1=CC=C(C=C1)N MCULE-3368755597 [0,0,0,0,1,0|1,0,0]=2 1589 B11R1.20 NC(=O)CC1=CC=C(C=C1)O MCULE-9884834100 [0,0,0,0,1,0|2,0,0]=3 1590 B11R1.20 NC(=O)CC1=CC=C(N=C1)Cl MCULE-3082423480 [0,0,0,0,1,0|3,0,0]=4 1591 B11R1.20 NC(=O)CC1=NC=C(C=C1)Br MCULE-9344744744 [0,0,0,0,1,0|3,0,0]=4 1592 B11R1.20 NC(=O)NC1=CC=C(C=C1)Br MCULE-3213531736 [0,0,0,0,1,0|3,0,0]=4 1593 B11R1.20 NC(=O)NC1=CC=C(C=C1)Cl MCULE-3872752626 [0,0,0,0,1,0|3,0,0]=4 1594 B11R1.20 NC(=O)NC1=CC=C(C=C1)F MCULE-4685624195 [0,0,0,0,1,0|3,0,0]=4 1595 B11R1.20 NC(=O)NC1=CC=C(C=C1)I MCULE-3268113147 [0,0,0,0,1,0|3,0,0]=4 1596 B11R1.20 NC(=O)NC1=CC=C(C=C1)N MCULE-3060690086 [0,0,0,0,1,0|2,0,0]=3 1597 B11R1.20 NC(=O)NC1=CC=C(C=C1)O MCULE-3275391733 [0,0,0,0,1,0|3,0,0]=4 1598 B11R1.20 NC(=S)CC1=CC=C(C=C1)Br MCULE-3865247984 [0,0,0,0,1,0|2,1,0]=4 1599 B11R1.20 NC(=S)CC1=CC=C(C=C1)Cl MCULE-8480210259 [0,0,0,0,1,0|2,1,0]=4 1600 B11R1.20 NC(=S)CC1=CC=C(C=C1)F MCULE-3834710706 [0,0,0,0,1,0|2,1,0]=4 1601 B11R1.20 NC(=S)CC1=CC=C(C=C1)N MCULE-5883810583 [0,0,0,0,1,0|1,1,0]=3 1602 B11R1.20 NC(=S)NC1=CC=C(C=C1)N MCULE-3698459099 [0,0,0,0,1,0|2,1,0]=4 1603 B11R1.20 NC1=CC=C(C=C1)CC(=O)O MCULE-7171963222 [0,0,0,0,1,0|0,0,0]=1 1604 B11R1.20 NC1=CC=C(C=C1)CC(=S)O MCULE-7097123857 [0,0,0,0,1,0|0,1,0]=2 1605 B11R1.20 NC1=CC=C(C=N1)CC(=O)O MCULE-6419974192 [0,0,0,0,1,0|1,0,0]=2 1606 B11R1.20 NC1=CN=C(C=C1)CC(=O)O MCULE-6727372902 [0,0,0,0,1,0|1,0,0]=2 1607 B11R1.20 O=C(Cl)CC1=CC=C(C=C1)Br MCULE-1088437289 [0,0,0,0,1,0|2,0,0]=3 1608 B11R1.20 O=C(Cl)CC1=CC=C(C=C1)Cl MCULE-5852291690 [0,0,0,0,1,0|2,0,0]=3 1609 B11R1.20 O=C(Cl)CC1=CC=C(C=C1)F MCULE-9707670299 [0,0,0,0,1,0|2,0,0]=3 1610 B11R1.20 O=C(Cl)CC1=CC=C(C=C1)I MCULE-1084666200 [0,0,0,0,1,0|2,0,0]=3 1611 B11R1.20 O=C(Cl)OC1=CC=C(C=C1)Br MCULE-7717310235 [0,0,0,0,1,0|3,0,0]=4 1612 B11R1.20 O=C(Cl)OC1=CC=C(C=C1)Cl MCULE-4883955340 [0,0,0,0,1,0|3,0,0]=4 1613 B11R1.20 O=C(Cl)OC1=CC=C(C=C1)F MCULE-2816618476 [0,0,0,0,1,0|3,0,0]=4 1614 B11R1.20 O=C(Cl)SC1=CC=C(C=C1)Cl MCULE-7159685976 [0,0,0,0,1,0|3,0,0]=4 1615 B11R1.20 O=C(O)CC1=CC=C(C=C1)Br MCULE-8300414581 [0,0,0,0,1,0|1,0,0]=2 1616 B11R1.20 O=C(O)CC1=CC=C(C=C1)Cl MCULE-1634058139 [0,0,0,0,1,0|1,0,0]=2 1617 B11R1.20 O=C(O)CC1=CC=C(C=C1)F MCULE-8246447237 [0,0,0,0,1,0|1,0,0]=2 1618 B11R1.20 O=C(O)CC1=CC=C(C=C1)I MCULE-1221154743 [0,0,0,0,1,0|1,0,0]=2 1619 B11R1.20 O=C(O)CC1=CC=C(C=C1)O MCULE-7254180433 [0,0,0,0,1,0|1,0,0]=2 1620 B11R1.20 O=C(O)CC1=CC=C(C=C1)S MCULE-8771795045 [0,0,0,0,1,0|1,0,0]=2 1621 B11R1.20 O=C(O)CC1=CC=C(N=C1)Br MCULE-5955108459 [0,0,0,0,1,0|2,0,0]=3 1622 B11R1.20 O=C(O)CC1=CC=C(N=C1)Cl MCULE-8148043601 [0,0,0,0,1,0|2,0,0]=3 1623 B11R1.20 O=C(O)CC1=CC=C(N=N1)Cl MCULE-7586536505 [0,0,0,0,1,0|3,0,0]=4 1624 B11R1.20 O=C(O)CC1=CN=C(N=C1)Br MCULE-9158651141 [0,0,0,0,1,0|3,0,0]=4 1625 B11R1.20 O=C(O)CC1=CN=C(N=C1)Cl MCULE-5807043956 [0,0,0,0,1,0|3,0,0]=4 1626 B11R1.20 O=C(O)CC1=CNC(=O)C=C1 MCULE-7521356508 [0,0,0,0,1,0|2,0,0]=3 1627 B11R1.20 O=C(O)CC1=NC=C(C=C1)Br MCULE-5682923665 [0,0,0,0,1,0|2,0,0]=3 1628 B11R1.20 O=C(O)CC1=NC=C(C=C1)Br MCULE-6438430612 [0,0,0,0,1,0|2,0,0]=3 1629 B11R1.20 O=C(O)CC1=NC=C(C=C1)Cl MCULE-2200072147 [0,0,0,0,1,0|2,0,0]=3 1630 B11R1.20 O=C(O)CC1=NC=C(C=C1)Cl MCULE-9214741763 [0,0,0,0,1,0|2,0,0]=3 1631 B11R1.20 O=C(O)CC1=NC=C(C=C1)F MCULE-2871798928 [0,0,0,0,1,0|2,0,0]=3 1632 B11R1.20 O=C(O)CC1=NC=C(C=C1)F MCULE-6124722524 [0,0,0,0,1,0|2,0,0]=3 1633 B11R1.20 O=C(O)CC1=NC=C(C=C1)I MCULE-5351430465 [0,0,0,0,1,0|2,0,0]=3 1634 B11R1.20 O=C(O)CC1=NC=C(C=C1)O MCULE-3180190519 [0,0,0,0,1,0|2,0,0]=3 1635 B11R1.20 O=C(O)CC1=NC=C(C=N1)Br MCULE-5896867425 [0,0,0,0,1,0|3,0,0]=4 1636 B11R1.20 O=C(O)CC1=NC=C(C=N1)Cl MCULE-8097765108 [0,0,0,0,1,0|3,0,0]=4 1637 B11R1.20 O=C(O)CC1=NC=C(C=N1)F MCULE-2832353557 [0,0,0,0,1,0|3,0,0]=4 1638 B11R1.20 O=C(O)CC1=NNC(=O)C=C1 MCULE-9531239734 [0,0,0,0,1,0|3,0,0]=4 1639 B11R1.20 O=C([O-])CC1=CC=C(C=C1)F MCULE-7645691765 [0,0,0,0,1,0|1,0,1]=3 1640 B11R1.20 O=C1C=CN(C=C1)CC(=O)O MCULE-1041841208 [0,0,0,0,1,0|2,0,0]=3 1641 B11R1.20 O=N(=O)CC1=CC=C(C=C1)Br MCULE-4369643366 [0,0,0,0,1,0|2,0,1]=4 1642 B11R1.20 O=N(=O)CC1=CC=C(C=C1)Cl MCULE-7645426963 [0,0,0,0,1,0|2,0,1]=4 1643 B11R1.20 O=N(=O)CC1=CC=C(C=C1)F MCULE-9481829769 [0,0,0,0,1,0|2,0,1]=4 1644 B11R1.20 OB(O)CC1=CC=C(C=C1)Br MCULE-5929978710 [0,0,0,0,1,0|2,0,1]=4 1645 B11R1.20 OB(O)CC1=CC=C(C=C1)F MCULE-9217381598 [0,0,0,0,1,0|2,0,1]=4 1646 B11R1.75 CC(=O)CCC1=CC=C(S1)Cl MCULE-1642922072 [0,0,0,0,1,0|3,0,0]=4 1647 B11R1.75 CC1=CC(=NO1)CCC(=O)O MCULE-3378074738 [0,0,0,0,1,0|3,0,0]=4 1648 B11R1.75 CC1=CC=C(O1)CCC(=O)N MCULE-3566354504 [0,0,0,0,1,0|3,0,0]=4 1649 B11R1.75 CC1=CC=C(O1)CCC(=O)O MCULE-6067365329 [0,0,0,0,1,0|2,0,0]=3 1650 B11R1.75 CC1=CC=C(S1)CCC(=O)O MCULE-1322543612 [0,0,0,0,1,0|2,0,0]=3 1651 B11R1.75 CC1=CN(N=C1)CCC(=O)O MCULE-7604509857 [0,0,0,0,1,0|3,0,0]=4 1652 B11R1.75 CC1=CN=C(N1)CCC(=O)O MCULE-3730863195 [0,0,0,0,1,0|3,0,0]=4 1653 B11R1.75 CC1=CN=C(O1)CCC(=O)O MCULE-2444599746 [0,0,0,0,1,0|3,0,0]=4 1654 B11R1.75 CC1=CSC(=C1)CCC(=O)O MCULE-9487444949 [0,0,0,0,1,0|2,0,0]=3 1655 B11R1.75 CC1=CSC(=N1)CCC(=O)O MCULE-4382447299 [0,0,0,0,1,0|3,0,0]=4 1656 B11R1.75 CC1=NC(=CN1)CCC(=O)O MCULE-4312521330 [0,0,0,0,1,0|3,0,0]=4 1657 B11R1.75 CC1=NC(=CS1)CCC(=O)O MCULE-6201333243 [0,0,0,0,1,0|3,0,0]=4 1658 B11R1.75 CC1=NC(=CS1)CCC(=O)O MCULE-7724457432 [0,0,0,0,1,0|3,0,0]=4 1659 B11R1.75 CC1=NC=C(S1)CCC(=O)O MCULE-3350399518 [0,0,0,0,1,0|3,0,0]=4 1660 B11R1.75 CC1=NN(C=C1)CCC(=O)O MCULE-4493982895 [0,0,0,0,1,0|3,0,0]=4 1661 B11R1.75 CC1=NNC(=C1)CCC(=O)O MCULE-6612442548 [0,0,0,0,1,0|3,0,0]=4 1662 B11R1.75 CC1=NOC(=C1)CCC(=O)O MCULE-6454692713 [0,0,0,0,1,0|3,0,0]=4 1663 B11R1.75 CN1C=C(C=N1)CCC(=O)O MCULE-1627544656 [0,0,0,0,1,0|3,0,0]=4 1664 B11R1.75 CN1C=CC(=C1)CCC(=O)O MCULE-4623817123 [0,0,0,0,1,0|2,0,0]=3 1665 B11R1.75 CN1C=CC(=N1)CCC(=O)O MCULE-8327068965 [0,0,0,0,1,0|3,0,0]=4 1666 B11R1.75 NC(=O)CCC1=CSC(=N1)N MCULE-9035946805 [0,0,0,0,1,0|3,0,0]=4 1667 B11R1.75 NC(=O)CCN1C=CC(=N1)N MCULE-5283248909 [0,0,0,0,1,0|3,0,0]=4 1668 B11R1.75 NC1=CN(N=C1)CCC(=O)O MCULE-5141494259 [0,0,0,0,1,0|2,0,0]=3 1669 B11R1.75 NC1=CN(N=C1)CCC(=O)O MCULE-5520811129 [0,0,0,0,1,0|2,0,0]=3 1670 B11R1.75 NC1=NC(=CS1)CCC(=O)O MCULE-1519545014 [0,0,0,0,1,0|2,0,0]=3 1671 B11R1.75 NC1=NC(=CS1)CCC(=O)O MCULE-2497158466 [0,0,0,0,1,0|2,0,0]=3 1672 B11R1.75 NC1=NC(=CS1)CCC(=O)O MCULE-5882922452 [0,0,0,0,1,0|2,0,0]=3 1673 B11R1.75 NC1=NC(=NN1)CCC(=O)O MCULE-5581856354 [0,0,0,0,1,0|3,0,0]=4 1674 B11R1.75 NC1=NC=C(S1)CCC(=O)O MCULE-1788897200 [0,0,0,0,1,0|2,0,0]=3 1675 B11R1.75 NC1=NN(C=C1)CCC(=O)O MCULE-2349651141 [0,0,0,0,1,0|2,0,0]=3 1676 B11R1.75 NC1=NN(C=C1)CCC(=O)O MCULE-5522157737 [0,0,0,0,1,0|2,0,0]=3 1677 B11R1.75 NC1=NN(C=N1)CCC(=O)O MCULE-1018777365 [0,0,0,0,1,0|3,0,0]=4 1678 B11R1.75 NC1=NN(C=N1)CCC(=O)O MCULE-3401110238 [0,0,0,0,1,0|3,0,0]=4 1679 B11R1.75 NC1=NN=C(S1)CCC(=O)O MCULE-4126907880 [0,0,0,0,1,0|3,0,0]=4 1680 B11R1.75 O=C(O)CCC1=CC(=CS1)Br MCULE-2009432961 [0,0,0,0,1,0|2,0,0]=3 1681 B11R1.75 O=C(O)CCC1=CC(=CS1)Cl MCULE-3702716997 [0,0,0,0,1,0|2,0,0]=3 1682 B11R1.75 O=C(O)CCC1=CC(=NO1)Br MCULE-2306740292 [0,0,0,0,1,0|3,0,0]=4 1683 B11R1.75 O=C(O)CCC1=CC(=NO1)Cl MCULE-8953796559 [0,0,0,0,1,0|3,0,0]=4 1684 B11R1.75 O=C(O)CCC1=CC(=O)NO1 MCULE-1230469268 [0,0,0,0,1,0|3,0,0]=4 1685 B11R1.75 O=C(O)CCC1=CC=C(S1)Br MCULE-1504750189 [0,0,0,0,1,0|2,0,0]=3 1686 B11R1.75 O=C(O)CCC1=CC=C(S1)Cl MCULE-8046412357 [0,0,0,0,1,0|2,0,0]=3 1687 B11R1.75 O=C(O)CCC1=CN=C(S1)Br MCULE-8659303793 [0,0,0,0,1,0|3,0,0]=4 1688 B11R1.75 O=C(O)CCC1=CNC(=O)N1 MCULE-2706002292 [0,0,0,0,1,0|3,0,0]=4 1689 B11R1.75 O=C(O)CCC1=CNC(=S)N1 MCULE-3837669031 [0,0,0,0,1,0|3,0,0]=4 1690 B11R1.75 O=C(O)CCC1=CSC(=C1)Br MCULE-4727002489 [0,0,0,0,1,0|2,0,0]=3 1691 B11R1.75 O=C(O)CCN1C=C(C=N1)Br MCULE-2058062625 [0,0,0,0,1,0|3,0,0]=4 1692 B11R1.75 O=C(O)CCN1C=C(C=N1)Br MCULE-7711015175 [0,0,0,0,1,0|3,0,0]=4 1693 B11R1.75 O=C(O)CCN1C=C(C=N1)Cl MCULE-2424288635 [0,0,0,0,1,0|3,0,0]=4 1694 B11R1.75 O=C(O)CCN1C=C(C=N1)F MCULE-7041627124 [0,0,0,0,1,0|3,0,0]=4 1695 B11R1.75 O=C(O)CCN1C=C(C=N1)I MCULE-5094869596 [0,0,0,0,1,0|3,0,0]=4 1696 B11R1.75 O=C(O)CCN1C=CC(=N1)Br MCULE-8600169451 [0,0,0,0,1,0|3,0,0]=4 1697 B11R1.75 O=C(O)CCN1C=CC(=N1)F MCULE-5963463856 [0,0,0,0,1,0|3,0,0]=4 1698 B11R1.75 O=C(O)CCN1C=CC(=N1)I MCULE-1402780610 [0,0,0,0,1,0|3,0,0]=4 1699 B13R1.513 C=C(Br)CCCC1=CC=C(C=C1)Br MCULE-1175892379 [0,0,0,0,0,1|3,0,0]=4 1700 B13R1.513 C=C(Br)CCCC1=CC=C(C=C1)C MCULE-9098531997 [0,0,0,0,0,1|3,0,0]=4 1701 B13R1.513 C=C(Br)CCCC1=CC=C(C=C1)Cl MCULE-3277374953 [0,0,0,0,0,1|3,0,0]=4 1702 B13R1.513 C=C(Br)CCCC1=CC=C(C=C1)F MCULE-9346951687 [0,0,0,0,0,1|3,0,0]=4 1703 B13R1.513 C=C(Br)CNCC1=CC=C(C=C1)Br MCULE-1827211962 [0,0,0,0,0,1|3,0,0]=4 1704 B13R1.513 C=C(Br)CNCC1=CC=C(C=C1)Cl MCULE-6089755749 [0,0,0,0,0,1|3,0,0]=4 1705 B13R1.513 C=C(C)CCCC1=CC=C(C=C1)Br MCULE-8344907129 [0,0,0,0,0,1|3,0,0]=4 1706 B13R1.513 C=C(C)CCCC1=CC=C(C=C1)C MCULE-7371393843 [0,0,0,0,0,1|3,0,0]=4 1707 B13R1.513 C=C(C)CCCC1=CC=C(C=C1)Cl MCULE-3722188377 [0,0,0,0,0,1|3,0,0]=4 1708 B13R1.513 C=C(C)CCCC1=CC=C(C=C1)F MCULE-4284953003 [0,0,0,0,0,1|3,0,0]=4 1709 B13R1.513 C=C(Cl)CCCC1=CC=C(C=C1)Br MCULE-1316248627 [0,0,0,0,0,1|3,0,0]=4 1710 B13R1.513 C=C(Cl)CCCC1=CC=C(C=C1)C MCULE-6707235316 [0,0,0,0,0,1|3,0,0]=4 1711 B13R1.513 C=C(Cl)CCCC1=CC=C(C=C1)Cl MCULE-6439289057 [0,0,0,0,0,1|3,0,0]=4 1712 B13R1.513 C=C(Cl)CCCC1=CC=C(C=C1)F MCULE-7733740249 [0,0,0,0,0,1|3,0,0]=4 1713 B13R1.513 CC(=O)CCCC1=CC=C(C=C1)Cl MCULE-3136579961 [0,0,0,0,0,1|2,0,0]=3 1714 B13R1.513 CC(=O)CCSC1=CC=C(C=C1)F MCULE-9322146570 [0,0,0,0,0,1|2,0,0]=3 1715 B13R1.513 CC(=O)NCCC1=CC=C(C=C1)Br MCULE-9721704177 [0,0,0,0,0,1|2,0,0]=3 1716 B13R1.513 CC(=O)NCCC1=CC=C(C=C1)F MCULE-1646980432 [0,0,0,0,0,1|2,0,0]=3 1717 B13R1.513 CC(=O)NCCC1=CC=C(C=C1)N MCULE-2828641812 [0,0,0,0,0,1|1,0,0]=2 1718 B13R1.513 CC(=O)NCCC1=CC=C(C=C1)O MCULE-9894285650 [0,0,0,0,0,1|2,0,0]=3 1719 B13R1.513 CC(=O)OCCC1=CC=C(C=C1)Br MCULE-8172712996 [0,0,0,0,0,1|2,0,0]=3 1720 B13R1.513 CC(=O)OCCC1=CC=C(C=C1)C MCULE-1494656163 [0,0,0,0,0,1|2,0,0]=3 1721 B13R1.513 CC(=O)OCCC1=CC=C(C=C1)Cl MCULE-6834563121 [0,0,0,0,0,1|2,0,0]=3 1722 B13R1.513 CC(=O)OCCC1=CC=C(C=C1)F MCULE-4832593262 [0,0,0,0,0,1|2,0,0]=3 1723 B13R1.513 CC(=O)OCCC1=CC=C(C=C1)O MCULE-5545902411 [0,0,0,0,0,1|2,0,0]=3 1724 B13R1.513 CC(=O)SCCC1=CC=C(C=C1)Br MCULE-1761773441 [0,0,0,0,0,1|2,0,0]=3 1725 B13R1.513 CC(C)CCOC1=CC=C(C=C1)N MCULE-5310939553 [0,0,0,0,0,1|2,0,1]=4 1726 B13R1.513 CC(C)CCOC1=CC=C(C=C1)N MCULE-6700704639 [0,0,0,0,0,1|2,0,1]=4 1727 B13R1.513 CC(O)CNCC1=CC=C(C=C1)Br MCULE-5334078799 [0,0,0,0,0,1|2,0,1]=4 1728 B13R1.513 CC(O)CNCC1=CC=C(C=C1)Cl MCULE-4238550811 [0,0,0,0,0,1|2,0,1]=4 1729 B13R1.513 CC(O)CNCC1=CC=C(C=C1)F MCULE-1344673941 [0,0,0,0,0,1|2,0,1]=4 1730 B13R1.513 CC1=CC=C(C=C1)CCCC(=O)Cl MCULE-2361950342 [0,0,0,0,0,1|2,0,0]=3 1731 B13R1.513 CC1=CC=C(C=C1)CCCC(=O)O MCULE-9264700102 [0,0,0,0,0,1|1,0,0]=2 1732 B13R1.513 CC1=CC=C(C=C1)CNCC(=O)O MCULE-2470476224 [0,0,0,0,0,1|1,0,0]=2 1733 B13R1.513 CC1=CC=C(C=C1)CNCC(=O)O MCULE-9439243852 [0,0,0,0,0,1|1,0,0]=2 1734 B13R1.513 CC1=CC=C(C=C1)CNCC(C)O MCULE-6747122658 [0,0,0,0,0,1|2,0,1]=4 1735 B13R1.513 CC1=CC=C(C=C1)COCC(=O)O MCULE-9012141447 [0,0,0,0,0,1|1,0,0]=2 1736 B13R1.513 CC1=CC=C(C=C1)CONC(=O)N MCULE-5947278976 [0,0,0,0,0,1|3,0,0]=4 1737 B13R1.513 CC1=CC=C(C=C1)CSCC(=O)O MCULE-1969486511 [0,0,0,0,0,1|1,0,0]=2 1738 B13R1.513 CC1=CC=C(C=C1)NCCC(=O)O MCULE-8652681898 [0,0,0,0,0,1|1,0,0]=2 1739 B13R1.513 CC1=CC=C(C=C1)NCCC(=O)[O-] MCULE-3902274787 [0,0,0,0,0,1|1,0,1]=3 1740 B13R1.513 CC1=CC=C(C=C1)OCCC(=O)Cl MCULE-5057224390 [0,0,0,0,0,1|2,0,0]=3 1741 B13R1.513 CC1=CC=C(C=C1)OCCC(=O)N MCULE-9434397552 [0,0,0,0,0,1|2,0,0]=3 1742 B13R1.513 CC1=CC=C(C=C1)OCCC(=O)O MCULE-9368077352 [0,0,0,0,0,1|1,0,0]=2 1743 B13R1.513 CC1=CC=C(C=C1)SC=CC(=O)O MCULE-5988515588 [0,0,0,0,0,1|1,0,2]=4 1744 B13R1.513 CC1=CC=C(C=C1)SCCC(=O)O MCULE-1755571946 [0,0,0,0,0,1|1,0,0]=2 1745 B13R1.513 CC1=CC=C(C=N1)C=CCC(=O)O MCULE-8641631048 [0,0,0,0,0,1|2,0,1]=4 1746 B13R1.513 CC1=CN=C(C=C1)NCCC(=O)O MCULE-3965306638 [0,0,0,0,0,1|2,0,0]=3 1747 B13R1.513 CN(C)CCCC1=CC=C(C=C1)N MCULE-2701955533 [0,0,0,0,0,1|3,0,0]=4 1748 B13R1.513 CN(C)CCNC1=CC=C(C=C1)N MCULE-9078279097 [0,0,0,0,0,1|3,0,0]=4 1749 B13R1.513 CN(C)CCOC1=CC=C(C=C1)N MCULE-2842437080 [0,0,0,0,0,1|3,0,0]=4 1750 B13R1.513 CN(C)CCOC1=CC=C(C=C1)N MCULE-6250308068 [0,0,0,0,0,1|3,0,0]=4 1751 B13R1.513 CN(C)CCOC1=CC=C(C=C1)N MCULE-9887646982 [0,0,0,0,0,1|3,0,0]=4 1752 B13R1.513 CN(C)CCSC1=CC=C(C=C1)N MCULE-8940945805 [0,0,0,0,0,1|3,0,0]=4 1753 B13R1.513 N(CC1=CC=C(C=C1)Br)CC(C)O MCULE-3861050341 [0,0,0,0,0,1|2,0,1]=4 1754 B13R1.513 N(CC1=CC=C(C=C1)C)CC(C)O MCULE-7337689932 [0,0,0,0,0,1|2,0,1]=4 1755 B13R1.513 N(CC1=CC=C(C=C1)Cl)CC(C)O MCULE-7642879609 [0,0,0,0,0,1|2,0,1]=4 1756 B13R1.513 N(CC1=CC=C(C=C1)F)CC(C)O MCULE-6781272827 [0,0,0,0,0,1|2,0,1]=4 1757 B13R1.513 N=C(N)NCCC1=CC=C(C=C1)F MCULE-2777506156 [0,0,0,0,0,1|3,0,0]=4 1758 B13R1.513 N=C(N)NCCC1=CC=C(C=C1)F MCULE-5064996321 [0,0,0,0,0,1|3,0,0]=4 1759 B13R1.513 NC(=O)CCNC1=CC=C(C=C1)F MCULE-8677295646 [0,0,0,0,0,1|2,0,0]=3 1760 B13R1.513 NC(=O)CCOC1=CC=C(C=C1)N MCULE-8752964019 [0,0,0,0,0,1|1,0,0]=2 1761 B13R1.513 NC(=O)CCSC1=CC=C(C=C1)Cl MCULE-8432992458 [0,0,0,0,0,1|2,0,0]=3 1762 B13R1.513 NC(=O)CNCC1=CC=C(C=C1)Br MCULE-4236748525 [0,0,0,0,0,1|2,0,0]=3 1763 B13R1.513 NC(=O)CNCC1=CC=C(C=C1)F MCULE-4036102959 [0,0,0,0,0,1|2,0,0]=3 1764 B13R1.513 NC(=O)CNCC1=CC=C(C=C1)F MCULE-5274276559 [0,0,0,0,0,1|2,0,0]=3 1765 B13R1.513 NC(=O)CSCC1=CC=C(C=C1)Br MCULE-1262316292 [0,0,0,0,0,1|2,0,0]=3 1766 B13R1.513 NC(=O)CSCC1=CC=C(C=C1)Cl MCULE-6859541782 [0,0,0,0,0,1|2,0,0]=3 1767 B13R1.513 NC(=O)CSCC1=CC=C(C=C1)F MCULE-4681418709 [0,0,0,0,0,1|2,0,0]=3 1768 B13R1.513 NC(=O)NCCC1=CC=C(C=C1)Br MCULE-8411274035 [0,0,0,0,0,1|2,0,0]=3 1769 B13R1.513 NC(=O)NCCC1=CC=C(C=C1)Cl MCULE-5240565199 [0,0,0,0,0,1|2,0,0]=3 1770 B13R1.513 NC(=O)NOCC1=CC=C(C=C1)Cl MCULE-7566963267 [0,0,0,0,0,1|3,0,0]=4 1771 B13R1.513 NC(=O)NOCC1=CC=C(C=C1)F MCULE-2269133201 [0,0,0,0,0,1|3,0,0]=4 1772 B13R1.513 NC1=CC=C(C=C1)CCCC(=O)O MCULE-4534927390 [0,0,0,0,0,1|0,0,0]=1 1773 B13R1.513 NC1=CC=C(C=C1)COCC(F)F MCULE-7137824621 [0,0,0,0,0,1|2,0,1]=4 1774 B13R1.513 NC1=CC=C(C=C1)COCC(F)F MCULE-9969590664 [0,0,0,0,0,1|2,0,1]=4 1775 B13R1.513 NC1=CC=C(C=C1)OCCC(=O)O MCULE-6932857541 [0,0,0,0,0,1|0,0,0]=1 1776 B13R1.513 O=C(Cl)CCCC1=CC=C(C=C1)F MCULE-2536853363 [0,0,0,0,0,1|2,0,0]=3 1777 B13R1.513 O=C(Cl)CCOC1=CC=C(C=C1)Cl MCULE-1254401549 [0,0,0,0,0,1|2,0,0]=3 1778 B13R1.513 O=C(Cl)CCSC1=CC=C(C=C1)F MCULE-2235326995 [0,0,0,0,0,1|2,0,0]=3 1779 B13R1.513 O=C(O)CC=CC1=CC=C(C=C1)F MCULE-6574652903 [0,0,0,0,0,1|1,0,1]=3 1780 B13R1.513 O=C(O)CCCC1=CC=C(C=C1)Br MCULE-3233980702 [0,0,0,0,0,1|1,0,0]=2 1781 B13R1.513 O=C(O)CCCC1=CC=C(C=C1)Cl MCULE-8089882538 [0,0,0,0,0,1|1,0,0]=2 1782 B13R1.513 O=C(O)CCCC1=CC=C(C=C1)F MCULE-6338279408 [0,0,0,0,0,1|1,0,0]=2 1783 B13R1.513 O=C(O)CCCC1=CC=C(C=C1)I MCULE-5120307139 [0,0,0,0,0,1|1,0,0]=2 1784 B13R1.513 O=C(O)CCCC1=CC=C(C=C1)O MCULE-6084225772 [0,0,0,0,0,1|1,0,0]=2 1785 B13R1.513 O=C(O)CCNC1=CC=C(C=C1)Br MCULE-9183981024 [0,0,0,0,0,1|1,0,0]=2 1786 B13R1.513 O=C(O)CCNC1=CC=C(C=C1)Cl MCULE-7907272480 [0,0,0,0,0,1|1,0,0]=2 1787 B13R1.513 O=C(O)CCNC1=CC=C(C=N1)Cl MCULE-4007167787 [0,0,0,0,0,1|2,0,0]=3 1788 B13R1.513 O=C(O)CCNC1=CC=C(N=N1)Cl MCULE-4115944692 [0,0,0,0,0,1|3,0,0]=4 1789 B13R1.513 O=C(O)CCOC1=CC=C(C=C1)Br MCULE-4054160375 [0,0,0,0,0,1|1,0,0]=2 1790 B13R1.513 O=C(O)CCOC1=CC=C(C=C1)Cl MCULE-1925407378 [0,0,0,0,0,1|1,0,0]=2 1791 B13R1.513 O=C(O)CCOC1=CC=C(C=C1)F MCULE-3183471561 [0,0,0,0,0,1|1,0,0]=2 1792 B13R1.513 O=C(O)CCSC1=CC=C(C=C1)Br MCULE-2054430905 [0,0,0,0,0,1|1,0,0]=2 1793 B13R1.513 O=C(O)CCSC1=CC=C(C=C1)Cl MCULE-9176337975 [0,0,0,0,0,1|1,0,0]=2 1794 B13R1.513 O=C(O)CCSC1=CC=C(C=C1)F MCULE-1982470844 [0,0,0,0,0,1|1,0,0]=2 1795 B13R1.513 O=C(O)CNCC1=CC=C(C=C1)Br MCULE-4700701484 [0,0,0,0,0,1|1,0,0]=2 1796 B13R1.513 O=C(O)CNCC1=CC=C(C=C1)Br MCULE-8611912575 [0,0,0,0,0,1|1,0,0]=2 1797 B13R1.513 O=C(O)CNCC1=CC=C(C=C1)Cl MCULE-6575413490 [0,0,0,0,0,1|1,0,0]=2 1798 B13R1.513 O=C(O)CNCC1=CC=C(C=C1)Cl MCULE-6982527308 [0,0,0,0,0,1|1,0,0]=2 1799 B13R1.513 O=C(O)CNCC1=CC=C(C=C1)F MCULE-2442159290 [0,0,0,0,0,1|1,0,0]=2 1800 B13R1.513 O=C(O)CNCC1=CC=C(C=C1)F MCULE-5020020469 [0,0,0,0,0,1|1,0,0]=2 1801 B13R1.513 O=C(O)CNCC1=CC=C(C=C1)O MCULE-6442035108 [0,0,0,0,0,1|1,0,0]=2 1802 B13R1.513 O=C(O)CNCC1=CC=C(C=C1)O MCULE-9086510260 [0,0,0,0,0,1|1,0,0]=2 1803 B13R1.513 O=C(O)CNCC1=CC=C(N=C1)Br MCULE-2198852581 [0,0,0,0,0,1|2,0,0]=3 1804 B13R1.513 O=C(O)CNCC1=CC=C(N=C1)Cl MCULE-5671201532 [0,0,0,0,0,1|2,0,0]=3 1805 B13R1.513 O=C(O)CNCC1=NN=C(C=C1)Cl MCULE-7968305923 [0,0,0,0,0,1|3,0,0]=4 1806 B13R1.513 O=C(O)COCC1=CC=C(C=C1)Br MCULE-8289570060 [0,0,0,0,0,1|1,0,0]=2 1807 B13R1.513 O=C(O)COCC1=CC=C(C=C1)F MCULE-9658760132 [0,0,0,0,0,1|1,0,0]=2 1808 B13R1.513 O=C(O)CSCC1=CC=C(C=C1)Br MCULE-4654048658 [0,0,0,0,0,1|1,0,0]=2 1809 B13R1.513 O=C(O)CSCC1=CC=C(C=C1)Cl MCULE-2783761494 [0,0,0,0,0,1|1,0,0]=2 1810 B13R1.513 O=C(O)CSCC1=CC=C(C=C1)F MCULE-1497978694 [0,0,0,0,0,1|1,0,0]=2 1811 B13R1.513 OB(O)CCCC1=CC=C(C=C1)Cl MCULE-8568898938 [0,0,0,0,0,1|2,0,1]=4 1812 B10R1.1 BrC1=CC=C(C=C1)CCI MCULE-6005604300 [2,0,0,0,0,0|2,0,0]=4 1813 B10R1.1 BrCCC1=CC=C(C=C1)Br MCULE-5417270157 [2,0,0,0,0,0|2,0,0]=4 1814 B10R1.1 C=CCC1=CC=C(C=C1)Br MCULE-3931216831 [2,0,0,0,0,0|1,0,1]=4 1815 B10R1.1 C=CCC1=CC=C(C=C1)C MCULE-7278058379 [2,0,0,0,0,0|1,0,1]=4 1816 B10R1.1 C=CCC1=CC=C(C=C1)Cl MCULE-5225487048 [2,0,0,0,0,0|1,0,1]=4 1817 B10R1.1 C=CCC1=CC=C(C=C1)F MCULE-1570629754 [2,0,0,0,0,0|1,0,1]=4 1818 B10R1.1 C=CCC1=CC=C(C=C1)N MCULE-9132540651 [2,0,0,0,0,0|0,0,1]=3 1819 B10R1.1 C=CCC1=CC=C(C=C1)O MCULE-8960123940 [2,0,0,0,0,0|1,0,1]=4 1820 B10R1.1 C=COC1=CC=C(C=C1)N MCULE-7721091067 [2,0,0,0,0,0|1,0,1]=4 1821 B10R1.1 CC1=CC=C(C=C1)CC=O MCULE-1269191067 [2,0,0,0,0,0|1,0,0]=3 1822 B10R1.1 CC1=CC=C(C=C1)CCBr MCULE-7151285098 [2,0,0,0,0,0|2,0,0]=4 1823 B10R1.1 CC1=CC=C(C=C1)CCCl MCULE-6148273964 [2,0,0,0,0,0|2,0,0]=4 1824 B10R1.1 CC1=CC=C(C=C1)CCI MCULE-6159904646 [2,0,0,0,0,0|2,0,0]=4 1825 B10R1.1 CC1=CC=C(C=C1)CCN MCULE-4507383452 [2,0,0,0,0,0|2,0,0]=4 1826 B10R1.1 CC1=CC=C(C=C1)CCN MCULE-7635707968 [2,0,0,0,0,0|2,0,0]=4 1827 B10R1.1 CC1=CC=C(C=C1)CCO MCULE-6863405049 [2,0,0,0,0,0|1,0,0]=3 1828 B10R1.1 CC1=CC=C(C=C1)CCS MCULE-7720118227 [2,0,0,0,0,0|1,1,0]=4 1829 B10R1.1 CC1=CC=C(C=C1)NC=O MCULE-3959593317 [2,0,0,0,0,0|2,0,0]=4 1830 B10R1.1 CC1=CC=C(C=N1)CCO MCULE-8588686663 [2,0,0,0,0,0|2,0,0]=4 1831 B10R1.1 CC1=CN=C(C=C1)CCO MCULE-7309707524 [2,0,0,0,0,0|2,0,0]=4 1832 B10R1.1 CC=CC1=CC=C(C=C1)N MCULE-1352203679 [2,0,0,0,0,0|1,0,1]=4 1833 B10R1.1 CCCC1=CC=C(C=C1)Br MCULE-8806090674 [2,0,0,0,0,0|1,0,1]=4 1834 B10R1.1 CCCC1=CC=C(C=C1)C MCULE-6546443314 [2,0,0,0,0,0|1,0,1]=4 1835 B10R1.1 CCCC1=CC=C(C=C1)Cl MCULE-6633169017 [2,0,0,0,0,0|1,0,1]=4 1836 B10R1.1 CCCC1=CC=C(C=C1)F MCULE-7057979766 [2,0,0,0,0,0|1,0,1]=4 1837 B10R1.1 CCCC1=CC=C(C=C1)I MCULE-3515833245 [2,0,0,0,0,0|1,0,1]=4 1838 B10R1.1 CCCC1=CC=C(C=C1)N MCULE-8474851940 [2,0,0,0,0,0|0,0,1]=3 1839 B10R1.1 CCCC1=CC=C(C=C1)O MCULE-2958844347 [2,0,0,0,0,0|1,0,1]=4 1840 B10R1.1 CCCC1=CC=C(C=C1)S MCULE-3690331841 [2,0,0,0,0,0|1,0,1]=4 1841 B10R1.1 CCCC1=CN=C(C=C1)N MCULE-9025167397 [2,0,0,0,0,0|1,0,1]=4 1842 B10R1.1 CCCC1=NC=C(C=C1)N MCULE-5383395904 [2,0,0,0,0,0|1,0,1]=4 1843 B10R1.1 CCNC1=CC=C(C=C1)N MCULE-3257855186 [2,0,0,0,0,0|1,0,1]=4 1844 B10R1.1 CCOC1=CC=C(C=C1)N MCULE-4210655477 [2,0,0,0,0,0|1,0,1]=4 1845 B10R1.1 CCOC1=CC=C(C=C1)N MCULE-5015601132 [2,0,0,0,0,0|1,0,1]=4 1846 B10R1.1 CCSC1=CC=C(C=C1)N MCULE-7800721131 [2,0,0,0,0,0|1,0,1]=4 1847 B10R1.1 CCSC1=CC=C(C=C1)N MCULE-9366240435 [2,0,0,0,0,0|1,0,1]=4 1848 B10R1.1 CNCC1=CC=C(C=C1)N MCULE-8138224566 [2,0,0,0,0,0|1,0,1]=4 1849 B10R1.1 COCC1=CC=C(C=C1)N MCULE-5948301745 [2,0,0,0,0,0|1,0,1]=4 1850 B10R1.1 CSCC1=CC=C(C=C1)N MCULE-7912881430 [2,0,0,0,0,0|1,0,1]=4 1851 B10R1.1 ClC1=CC=C(C=C1)CCBr MCULE-2999727623 [2,0,0,0,0,0|2,0,0]=4 1852 B10R1.1 ClCCC1=CC=C(C=C1)Cl MCULE-2499628465 [2,0,0,0,0,0|2,0,0]=4 1853 B10R1.1 FC1=CC=C(C=C1)CCBr MCULE-8341156759 [2,0,0,0,0,0|2,0,0]=4 1854 B10R1.1 FC1=CC=C(C=C1)CCCl MCULE-3550057791 [2,0,0,0,0,0|2,0,0]=4 1855 B10R1.1 FC1=CC=C(C=C1)CCS MCULE-4938936460 [2,0,0,0,0,0|1,1,0]=4 1856 B10R1.1 FCCC1=CC=C(C=C1)Br MCULE-9185022230 [2,0,0,0,0,0|2,0,0]=4 1857 B10R1.1 N#CCC1=CC=C(C=C1)N MCULE-3525121951 [2,0,0,0,0,0|1,0,1]=4 1858 B10R1.1 N#CCC1=CC=C(C=C1)N MCULE-5084500896 [2,0,0,0,0,0|1,0,1]=4 1859 B10R1.1 NC1=CC=C(C=C1)CCBr MCULE-1732815491 [2,0,0,0,0,0|1,0,0]=3 1860 B10R1.1 NC1=CC=C(C=C1)CCBr MCULE-6832420170 [2,0,0,0,0,0|1,0,0]=3 1861 B10R1.1 NC1=CC=C(C=C1)CCBr MCULE-9671904558 [2,0,0,0,0,0|1,0,0]=3 1862 B10R1.1 NC1=CC=C(C=C1)CCCl MCULE-1139159040 [2,0,0,0,0,0|1,0,0]=3 1863 B10R1.1 NC1=CC=C(C=C1)CCCl MCULE-8923278503 [2,0,0,0,0,0|1,0,0]=3 1864 B10R1.1 NC1=CC=C(C=C1)CCF MCULE-6226313061 [2,0,0,0,0,0|1,0,0]=3 1865 B10R1.1 NC1=CC=C(C=C1)CCO MCULE-3479095250 [2,0,0,0,0,0|0,0,0]=2 1866 B10R1.1 NC1=CC=C(C=C1)CCS MCULE-1166360572 [2,0,0,0,0,0|0,1,0]=3 1867 B10R1.1 NC1=CC=C(C=C1)CCS MCULE-5538619271 [2,0,0,0,0,0|0,1,0]=3 1868 B10R1.1 NC1=CC=C(C=C1)OCF MCULE-5631953509 [2,0,0,0,0,0|2,0,0]=4 1869 B10R1.1 NC1=CN=C(C=C1)CCO MCULE-4103570923 [2,0,0,0,0,0|1,0,0]=3 1870 B10R1.1 NCCC1=CC=C(C=C1)Br MCULE-5546297578 [2,0,0,0,0,0|2,0,0]=4 1871 B10R1.1 NCCC1=CC=C(C=C1)Br MCULE-5695520834 [2,0,0,0,0,0|2,0,0]=4 1872 B10R1.1 NCCC1=CC=C(C=C1)Br MCULE-6015072555 [2,0,0,0,0,0|2,0,0]=4 1873 B10R1.1 NCCC1=CC=C(C=C1)Cl MCULE-7851223892 [2,0,0,0,0,0|2,0,0]=4 1874 B10R1.1 NCCC1=CC=C(C=C1)Cl MCULE-9855986724 [2,0,0,0,0,0|2,0,0]=4 1875 B10R1.1 NCCC1=CC=C(C=C1)F MCULE-4966416168 [2,0,0,0,0,0|2,0,0]=4 1876 B10R1.1 NCCC1=CC=C(C=C1)F MCULE-5112631997 [2,0,0,0,0,0|2,0,0]=4 1877 B10R1.1 NCCC1=CC=C(C=C1)F MCULE-8758190976 [2,0,0,0,0,0|2,0,0]=4 1878 B10R1.1 NCCC1=CC=C(C=C1)F MCULE-9502237785 [2,0,0,0,0,0|2,0,0]=4 1879 B10R1.1 NCCC1=CC=C(C=C1)I MCULE-1420598079 [2,0,0,0,0,0|2,0,0]=4 1880 B10R1.1 NCCC1=CC=C(C=C1)I MCULE-5120127039 [2,0,0,0,0,0|2,0,0]=4 1881 B10R1.1 NCCC1=CC=C(C=C1)N MCULE-1689759988 [2,0,0,0,0,0|1,0,0]=3 1882 B10R1.1 NCCC1=CC=C(C=C1)N MCULE-4859196570 [2,0,0,0,0,0|1,0,0]=3 1883 B10R1.1 NCCC1=CC=C(C=C1)N MCULE-8285818354 [2,0,0,0,0,0|1,0,0]=3 1884 B10R1.1 NCCC1=CC=C(C=C1)O MCULE-3986856320 [2,0,0,0,0,0|2,0,0]=4 1885 B10R1.1 NCCC1=CC=C(C=C1)O MCULE-6739710688 [2,0,0,0,0,0|2,0,0]=4 1886 B10R1.1 NCCC1=CC=C(N=C1)N MCULE-1104632277 [2,0,0,0,0,0|2,0,0]=4 1887 B10R1.1 NCCC1=CN=C(C=C1)N MCULE-2613817594 [2,0,0,0,0,0|2,0,0]=4 1888 B10R1.1 O=CCC1=CC=C(C=C1)Br MCULE-3225698059 [2,0,0,0,0,0|1,0,0]=3 1889 B10R1.1 O=CCC1=CC=C(C=C1)Cl MCULE-5241192506 [2,0,0,0,0,0|1,0,0]=3 1890 B10R1.1 O=CCC1=CC=C(C=C1)F MCULE-2512488057 [2,0,0,0,0,0|1,0,0]=3 1891 B10R1.1 O=CCC1=CC=C(C=C1)I MCULE-7314892838 [2,0,0,0,0,0|1,0,0]=3 1892 B10R1.1 O=CCC1=CN=C(C=C1)Br MCULE-3230473804 [2,0,0,0,0,0|2,0,0]=4 1893 B10R1.1 O=CCC1=NC=C(C=C1)F MCULE-3850075645 [2,0,0,0,0,0|2,0,0]=4 1894 B10R1.1 O=CNC1=CC=C(C=C1)Br MCULE-1275620686 [2,0,0,0,0,0|2,0,0]=4 1895 B10R1.1 O=CNC1=CC=C(C=C1)Cl MCULE-5777258494 [2,0,0,0,0,0|2,0,0]=4 1896 B10R1.1 O=CNC1=CC=C(C=C1)F MCULE-4306734090 [2,0,0,0,0,0|2,0,0]=4 1897 B10R1.1 O=CNC1=CC=C(C=C1)O MCULE-8242092478 [2,0,0,0,0,0|2,0,0]=4 1898 B10R1.1 OC1=CC=C(C=C1)CCBr MCULE-5161064921 [2,0,0,0,0,0|2,0,0]=4 1899 B10R1.1 OC1=CC=C(C=C1)CCF MCULE-6799396569 [2,0,0,0,0,0|2,0,0]=4 1900 B10R1.1 OCCC1=CC=C(C=C1)Br MCULE-1200216462 [2,0,0,0,0,0|1,0,0]=3 1901 B10R1.1 OCCC1=CC=C(C=C1)Cl MCULE-3357638321 [2,0,0,0,0,0|1,0,0]=3 1902 B10R1.1 OCCC1=CC=C(C=C1)F MCULE-7177685997 [2,0,0,0,0,0|1,0,0]=3 1903 B10R1.1 OCCC1=CC=C(C=C1)I MCULE-7128287405 [2,0,0,0,0,0|1,0,0]=3 1904 B10R1.1 OCCC1=CC=C(C=C1)O MCULE-9268661621 [2,0,0,0,0,0|1,0,0]=3 1905 B10R1.1 OCCC1=CC=C(N=C1)Br MCULE-9155913017 [2,0,0,0,0,0|2,0,0]=4 1906 B10R1.1 OCCC1=CC=C(N=C1)Cl MCULE-6782885959 [2,0,0,0,0,0|2,0,0]=4 1907 B10R1.1 OCCC1=CN=C(C=C1)F MCULE-4320837794 [2,0,0,0,0,0|2,0,0]=4 1908 B10R1.1 OCCC1=NC=C(C=C1)Br MCULE-1431259942 [2,0,0,0,0,0|2,0,0]=4 1909 B10R1.1 OCCC1=NC=C(C=C1)F MCULE-3892373258 [2,0,0,0,0,0|2,0,0]=4 1910 B10R1.1 ONCC1=CC=C(C=C1)Br MCULE-1431943099 [2,0,0,0,0,0|2,0,0]=4 1911 B10R1.1 ONCC1=CC=C(C=C1)Cl MCULE-8382854440 [2,0,0,0,0,0|2,0,0]=4 1912 B10R1.1 ONCC1=CC=C(C=C1)Cl MCULE-8997725161 [2,0,0,0,0,0|2,0,0]=4 1913 B10R1.1 SCCC1=CC=C(C=C1)Cl MCULE-3147297036 [2,0,0,0,0,0|1,1,0]=4 1914 B10R1.17 BrCCCC1=CC=CC=C1 MCULE-2999027073 [2,0,0,0,0,0|1,0,1]=4 1915 B10R1.17 C#CCCC1=CC=CC=C1 MCULE-5227753401 [2,0,0,0,0,0|1,0,1]=4 1916 B10R1.17 C=CCCC1=CC=CC=C1 MCULE-7260615003 [2,0,0,0,0,0|1,0,0]=3 1917 B10R1.17 C=CCCC1=CC=CN=C1 MCULE-9965082436 [2,0,0,0,0,0|2,0,0]=4 1918 B10R1.17 C=CCNC1=CC=CC=C1 MCULE-5883088335 [2,0,0,0,0,0|2,0,0]=4 1919 B10R1.17 C=CCOC1=CC=CC=C1 MCULE-5408457902 [2,0,0,0,0,0|2,0,0]=4 1920 B10R1.17 C=CCSC1=CC=CC=C1 MCULE-1624527878 [2,0,0,0,0,0|2,0,0]=4 1921 B10R1.17 C=COCC1=CC=CC=C1 MCULE-9410873886 [2,0,0,0,0,0|2,0,0]=4 1922 B10R1.17 CCCCC1=CC=CC=C1 MCULE-5613471292 [2,0,0,0,0,0|1,0,1]=4 1923 B10R1.17 CNCCC1=CC=CC=C1 MCULE-6036180757 [2,0,0,0,0,0|2,0,0]=4 1924 B10R1.17 COCCC1=CC=CC=C1 MCULE-6136429953 [2,0,0,0,0,0|2,0,0]=4 1925 B10R1.17 Cl/C=C/CC1=CC=CC=C1 MCULE-1843709933 [2,0,0,0,0,0|1,0,1]=4 1926 B10R1.17 Cl/C=C/CC1=CC=CC=C1 MCULE-6592014084 [2,0,0,0,0,0|1,0,1]=4 1927 B10R1.17 ClCCCC1=CC=CC=C1 MCULE-8754274548 [2,0,0,0,0,0|1,0,1]=4 1928 B10R1.17 ICCCC1=CC=CC=C1 MCULE-8327261433 [2,0,0,0,0,0|1,0,1]=4 1929 B10R1.17 N#CCCC1=CC=CC=C1 MCULE-1379217564 [2,0,0,0,0,0|1,0,1]=4 1930 B10R1.17 N=COCC1=CC=CC=C1 MCULE-2308132988 [2,0,0,0,0,0|2,0,0]=4 1931 B10R1.17 N=COCC1=CC=CC=C1 MCULE-5990786883 [2,0,0,0,0,0|2,0,0]=4 1932 B10R1.17 NCCCC1=CC=CC=C1 MCULE-1006208888 [2,0,0,0,0,0|1,0,1]=4 1933 B10R1.17 NNCCC1=CC=CC=C1 MCULE-1121090101 [2,0,0,0,0,0|2,0,0]=4 1934 B10R1.17 NNCCC1=CC=CC=C1 MCULE-2765705772 [2,0,0,0,0,0|2,0,0]=4 1935 B10R1.17 NNCCC1=CC=CC=C1 MCULE-2911295500 [2,0,0,0,0,0|2,0,0]=4 1936 B10R1.17 NNCCC1=CC=CC=C1 MCULE-9199344648 [2,0,0,0,0,0|2,0,0]=4 1937 B10R1.17 NOCCC1=CC=CC=C1 MCULE-1051598972 [2,0,0,0,0,0|2,0,0]=4 1938 B10R1.17 NOCCC1=CC=CC=C1 MCULE-2520667671 [2,0,0,0,0,0|2,0,0]=4 1939 B10R1.17 O=C/C=C/C1=CC=CC=C1 MCULE-5082013471 [2,0,0,0,0,0|0,0,2]=4 1940 B10R1.17 O=C=NCC1=CC=CC=C1 MCULE-9188065066 [2,0,0,0,0,0|1,0,1]=4 1941 B10R1.17 O=CC#CC1=CC=CC=C1 MCULE-7707210544 [2,0,0,0,0,0|0,0,2]=4 1942 B10R1.17 O=CC=CC1=CC=CC=C1 MCULE-9193590445 [2,0,0,0,0,0|0,0,2]=4 1943 B10R1.17 O=CCCC1=CC=CC=C1 MCULE-1570695665 [2,0,0,0,0,0|0,0,0]=2 1944 B10R1.17 O=CCCC1=CC=CC=N1 MCULE-5589137170 [2,0,0,0,0,0|1,0,0]=3 1945 B10R1.17 O=CCCC1=CC=CN=C1 MCULE-2958423624 [2,0,0,0,0,0|1,0,0]=3 1946 B10R1.17 O=CCCC1=CC=NC=C1 MCULE-3161870083 [2,0,0,0,0,0|1,0,0]=3 1947 B10R1.17 O=CCCC1=NC=NC=C1 MCULE-9867675443 [2,0,0,0,0,0|2,0,0]=4 1948 B10R1.17 O=CCOC1=CC=CC=C1 MCULE-7737820768 [2,0,0,0,0,0|1,0,0]=3 1949 B10R1.17 O=CNCC1=CC=CC=C1 MCULE-4418545200 [2,0,0,0,0,0|1,0,0]=3 1950 B10R1.17 O=CNCC1=CN=CC=C1 MCULE-7263791001 [2,0,0,0,0,0|2,0,0]=4 1951 B10R1.17 O=CNCC1=NC=CC=C1 MCULE-8606919189 [2,0,0,0,0,0|2,0,0]=4 1952 B10R1.17 O=CNNC1=CC=CC=C1 MCULE-1857874908 [2,0,0,0,0,0|2,0,0]=4 1953 B10R1.17 O=COCC1=CC=CC=C1 MCULE-1298671349 [2,0,0,0,0,0|1,0,0]=3 1954 B10R1.17 OCCCC1=CC=CC=C1 MCULE-7537660546 [2,0,0,0,0,0|0,0,1]=3 1955 B10R1.17 OCCCC1=CC=CN=C1 MCULE-5071672075 [2,0,0,0,0,0|1,0,1]=4 1956 B10R1.17 OCCCC1=CC=NC=C1 MCULE-5029847648 [2,0,0,0,0,0|1,0,1]=4 1957 B10R1.17 OCCCC1=CN=CC=C1 MCULE-1358973438 [2,0,0,0,0,0|1,0,1]=4 1958 B10R1.17 OCCCC1=NC=CC=C1 MCULE-5814318049 [2,0,0,0,0,0|1,0,1]=4 1959 B10R1.17 OCCCC1=NC=CC=C1 MCULE-8674015066 [2,0,0,0,0,0|1,0,1]=4 1960 B10R1.17 OCCNC1=CC=CC=C1 MCULE-8468662163 [2,0,0,0,0,0|1,0,1]=4 1961 B10R1.17 OCCOC1=CC=CC=C1 MCULE-1828011376 [2,0,0,0,0,0|1,0,1]=4 1962 B10R1.17 OCCSC1=CC=CC=C1 MCULE-1168521961 [2,0,0,0,0,0|1,0,1]=4 1963 B10R1.17 ON=CCC1=CC=CC=C1 MCULE-8598025138 [2,0,0,0,0,0|1,0,1]=4 1964 B10R1.17 SCCCC1=CC=CC=C1 MCULE-2446156682 [2,0,0,0,0,0|0,1,1]=4 1965 B12R1.1 C=CCCCC1=CC=C(C=C1)Br MCULE-7934776792 [1,1,0,0,0,0|2,0,0]=4 1966 B12R1.1 C=CCCCC1=CC=C(C=C1)C MCULE-6377480396 [1,1,0,0,0,0|2,0,0]=4 1967 B12R1.1 C=CCCCC1=CC=C(C=C1)Cl MCULE-8420862160 [1,1,0,0,0,0|2,0,0]=4 1968 B12R1.1 C=CCCCC1=CC=C(C=C1)F MCULE-3123342549 [1,1,0,0,0,0|2,0,0]=4 1969 B12R1.1 C=CCCOC1=CC=C(C=C1)Br MCULE-9205866192 [1,1,0,0,0,0|2,0,0]=4 1970 B12R1.1 C=CCCOC1=CC=C(C=C1)I MCULE-3830838207 [1,1,0,0,0,0|2,0,0]=4 1971 B12R1.1 C=CCCOC1=CC=C(C=C1)N MCULE-3018482293 [1,1,0,0,0,0|1,0,0]=3 1972 B12R1.1 C=CCCOC1=CC=C(C=C1)O MCULE-8187531592 [1,1,0,0,0,0|2,0,0]=4 1973 B12R1.1 C=CCNCC1=CC=C(C=C1)Br MCULE-4435608455 [1,1,0,0,0,0|2,0,0]=4 1974 B12R1.1 C=CCNCC1=CC=C(C=C1)Br MCULE-6101895980 [1,1,0,0,0,0|2,0,0]=4 1975 B12R1.1 C=CCNCC1=CC=C(C=C1)C MCULE-4671666325 [1,1,0,0,0,0|2,0,0]=4 1976 B12R1.1 C=CCNCC1=CC=C(C=C1)C MCULE-8547524067 [1,1,0,0,0,0|2,0,0]=4 1977 B12R1.1 C=CCNCC1=CC=C(C=C1)Cl MCULE-1987082200 [1,1,0,0,0,0|2,0,0]=4 1978 B12R1.1 C=CCNCC1=CC=C(C=C1)Cl MCULE-7116227567 [1,1,0,0,0,0|2,0,0]=4 1979 B12R1.1 C=CCNCC1=CC=C(C=C1)F MCULE-8782393138 [1,1,0,0,0,0|2,0,0]=4 1980 B12R1.1 C=CCNCC1=CC=C(C=C1)F MCULE-9559184697 [1,1,0,0,0,0|2,0,0]=4 1981 B12R1.1 C=CCNCC1=CC=C(C=C1)O MCULE-8221962054 [1,1,0,0,0,0|2,0,0]=4 1982 B12R1.1 C=CCNCC1=CC=C(C=C1)O MCULE-8422032197 [1,1,0,0,0,0|2,0,0]=4 1983 B12R1.1 C=CCOCC1=CC=C(C=C1)Br MCULE-4014781166 [1,1,0,0,0,0|2,0,0]=4 1984 B12R1.1 C=CCOCC1=CC=C(C=C1)N MCULE-8915613243 [1,1,0,0,0,0|1,0,0]=3 1985 B12R1.1 C=CCSCC1=CC=C(C=C1)Br MCULE-7553458078 [1,1,0,0,0,0|2,0,0]=4 1986 B12R1.1 CC1=CC=C(C=C1)CNCCO MCULE-5043645456 [1,1,0,0,0,0|1,0,1]=4 1987 B12R1.1 CC1=CC=C(C=C1)CNCCO MCULE-5810967464 [1,1,0,0,0,0|1,0,1]=4 1988 B12R1.1 CC1=CC=C(C=C1)CSCCO MCULE-1725502806 [1,1,0,0,0,0|1,0,1]=4 1989 B12R1.1 CC1=CC=C(C=C1)OCCCO MCULE-7709322159 [1,1,0,0,0,0|1,0,1]=4 1990 B12R1.1 CCCCCC1=CC=C(C=C1)N MCULE-8970105380 [1,1,0,0,0,0|1,0,1]=4 1991 B12R1.1 CCCCOC1=CC=C(C=C1)N MCULE-7144214119 [1,1,0,0,0,0|1,0,1]=4 1992 B12R1.1 CCCCSC1=CC=C(C=C1)N MCULE-3643820895 [1,1,0,0,0,0|1,0,1]=4 1993 B12R1.1 CCCCSC1=CC=C(C=C1)N MCULE-9146644497 [1,1,0,0,0,0|1,0,1]=4 1994 B12R1.1 CNCCOC1=CC=C(C=C1)N MCULE-2859770364 [1,1,0,0,0,0|2,0,0]=4 1995 B12R1.1 CNCCOC1=CC=C(C=C1)N MCULE-8654754918 [1,1,0,0,0,0|2,0,0]=4 1996 B12R1.1 COCCCC1=CC=C(C=C1)Br MCULE-7642477695 [1,1,0,0,0,0|1,0,1]=4 1997 B12R1.1 COCCNC1=CC=C(C=C1)N MCULE-1548230936 [1,1,0,0,0,0|1,0,1]=4 1998 B12R1.1 COCCNC1=CC=C(C=C1)N MCULE-4347573100 [1,1,0,0,0,0|1,0,1]=4 1999 B12R1.1 COCCOC1=CC=C(C=C1)N MCULE-2518862939 [1,1,0,0,0,0|1,0,1]=4 2000 B12R1.1 COCCOC1=CC=C(C=C1)N MCULE-8006382784 [1,1,0,0,0,0|1,0,1]=4 2001 B12R1.1 COCCSC1=CC=C(C=C1)N MCULE-1241439672 [1,1,0,0,0,0|1,0,1]=4 2002 B12R1.1 N(CCO)CC1=CC=C(C=C1)Br MCULE-1782578881 [1,1,0,0,0,0|1,0,1]=4 2003 B12R1.1 NC1=CC=C(C=C1)CCCCO MCULE-3059080015 [1,1,0,0,0,0|0,0,1]=3 2004 B12R1.1 NC1=CC=C(C=C1)COCCO MCULE-8808035118 [1,1,0,0,0,0|0,0,1]=3 2005 B12R1.1 NC1=CC=C(C=C1)OCCCBr MCULE-6988768902 [1,1,0,0,0,0|1,0,1]=4 2006 B12R1.1 NC1=CC=C(C=C1)OCCCO MCULE-1993173792 [1,1,0,0,0,0|0,0,1]=3 2007 B12R1.1 NC1=CC=C(C=C1)SCCCO MCULE-1800885805 [1,1,0,0,0,0|0,0,1]=3 2008 B12R1.1 NC1=CN=C(C=C1)NCCCO MCULE-8822622385 [1,1,0,0,0,0|1,0,1]=4 2009 B12R1.1 NC1=CN=C(C=C1)NCCCO MCULE-9191142868 [1,1,0,0,0,0|1,0,1]=4 2010 B12R1.1 O/C=N/CCC1=CC=C(C=C1)F MCULE-8054783691 [1,1,0,0,0,0|1,0,0]=3 2011 B12R1.1 O=C=NCCC1=CC=C(C=C1)Br MCULE-3615966110 [1,1,0,0,0,0|1,0,1]=4 2012 B12R1.1 O=C=NCCC1=CC=C(C=C1)Cl MCULE-5153722082 [1,1,0,0,0,0|1,0,1]=4 2013 B12R1.1 O=C=NCCC1=CC=C(C=C1)F MCULE-7596846336 [1,1,0,0,0,0|1,0,1]=4 2014 B12R1.1 O=CCCCC1=CC=C(C=C1)Cl MCULE-1857271582 [1,1,0,0,0,0|1,0,0]=3 2015 B12R1.1 O=CCCCC1=CC=C(C=C1)F MCULE-7986353961 [1,1,0,0,0,0|1,0,0]=3 2016 B12R1.1 O=CCCOC1=CC=C(C=C1)Cl MCULE-6678784478 [1,1,0,0,0,0|1,0,0]=3 2017 B12R1.1 O=CNCCC1=CC=C(C=C1)Br MCULE-3848234307 [1,1,0,0,0,0|1,0,0]=3 2018 B12R1.1 O=CNCCC1=CC=C(C=C1)O MCULE-1834594201 [1,1,0,0,0,0|1,0,0]=3 2019 B12R1.1 OCCCCC1=CC=C(C=C1)Br MCULE-6127744393 [1,1,0,0,0,0|1,0,1]=4 2020 B12R1.1 OCCCCC1=CC=C(C=C1)F MCULE-5160690383 [1,1,0,0,0,0|1,0,1]=4 2021 B12R1.1 OCCCCC1=CC=C(C=C1)O MCULE-4460665362 [1,1,0,0,0,0|1,0,1]=4 2022 B12R1.1 OCCCNC1=CC=C(C=C1)Cl MCULE-2660436567 [1,1,0,0,0,0|1,0,1]=4 2023 B12R1.1 OCCCOC1=CC=C(C=C1)Br MCULE-5179754471 [1,1,0,0,0,0|1,0,1]=4 2024 B12R1.1 OCCCOC1=CC=C(C=C1)Cl MCULE-2660721683 [1,1,0,0,0,0|1,0,1]=4 2025 B12R1.1 OCCCOC1=CC=C(C=C1)F MCULE-2279899178 [1,1,0,0,0,0|1,0,1]=4 2026 B12R1.1 OCCCOC1=CC=C(C=C1)I MCULE-1239233152 [1,1,0,0,0,0|1,0,1]=4 2027 B12R1.1 OCCCOC1=CC=C(C=C1)O MCULE-7677000457 [1,1,0,0,0,0|1,0,1]=4 2028 B12R1.1 OCCCSC1=CC=C(C=C1)Br MCULE-7490523123 [1,1,0,0,0,0|1,0,1]=4 2029 B12R1.1 OCCCSC1=CC=C(C=C1)Cl MCULE-8305954042 [1,1,0,0,0,0|1,0,1]=4 2030 B12R1.1 OCCCSC1=CC=C(C=C1)F MCULE-7371521641 [1,1,0,0,0,0|1,0,1]=4 2031 B12R1.1 OCCNCC1=CC=C(C=C1)Br MCULE-9033721938 [1,1,0,0,0,0|1,0,1]=4 2032 B12R1.1 OCCNCC1=CC=C(C=C1)Cl MCULE-1133597542 [1,1,0,0,0,0|1,0,1]=4 2033 B12R1.1 OCCNCC1=CC=C(C=C1)Cl MCULE-7609927332 [1,1,0,0,0,0|1,0,1]=4 2034 B12R1.1 OCCNCC1=CC=C(C=C1)F MCULE-3759160457 [1,1,0,0,0,0|1,0,1]=4 2035 B12R1.1 OCCNCC1=CC=C(C=C1)F MCULE-6800441964 [1,1,0,0,0,0|1,0,1]=4 2036 B12R1.1 OCCOCC1=CC=C(C=C1)Br MCULE-4082736797 [1,1,0,0,0,0|1,0,1]=4 2037 B12R1.1 OCCOCC1=CC=C(C=C1)Cl MCULE-5397647382 [1,1,0,0,0,0|1,0,1]=4 2038 B12R1.1 OCCSCC1=CC=C(C=C1)Br MCULE-2165163590 [1,1,0,0,0,0|1,0,1]=4 2039 B12R1.1 OCCSCC1=CC=C(C=C1)Cl MCULE-4390720537 [1,1,0,0,0,0|1,0,1]=4 2040 B12R1.1 OCCSCC1=CC=C(C=C1)F MCULE-3595880435 [1,1,0,0,0,0|1,0,1]=4 2041 B12R1.16 C=CCC(N)C1=CC=C(C=C1)Br MCULE-8946153022 [1,1,0,0,0,0|2,0,0]=4 2042 B12R1.16 C=CCC(N)C1=CC=C(C=C1)C MCULE-3528581110 [1,1,0,0,0,0|2,0,0]=4 2043 B12R1.16 C=CCC(N)C1=CC=C(C=C1)Cl MCULE-3341380698 [1,1,0,0,0,0|2,0,0]=4 2044 B12R1.16 C=CCC(N)C1=CC=C(C=C1)F MCULE-1623240786 [1,1,0,0,0,0|2,0,0]=4 2045 B12R1.16 C=CCC(N)C1=CC=C(C=C1)F MCULE-6645692181 [1,1,0,0,0,0|2,0,0]=4 2046 B12R1.16 C=CCC(N)C1=CC=C(C=C1)F MCULE-7921749487 [1,1,0,0,0,0|2,0,0]=4 2047 B12R1.16 C=CCC(N)C1=CC=C(C=C1)F MCULE-8309117877 [1,1,0,0,0,0|2,0,0]=4 2048 B12R1.16 C=CCC(N)C1=CC=C(C=C1)N MCULE-3824023801 [1,1,0,0,0,0|1,0,0]=3 2049 B12R1.16 C=CCC(O)C1=CC=C(C=C1)Br MCULE-9339081664 [1,1,0,0,0,0|2,0,0]=4 2050 B12R1.16 C=CCC(O)C1=CC=C(C=C1)Cl MCULE-5019360321 [1,1,0,0,0,0|2,0,0]=4 2051 B12R1.16 C=CCC(O)C1=CC=C(C=C1)F MCULE-5633962987 [1,1,0,0,0,0|2,0,0]=4 2052 B12R1.16 C=CC[C@@H](N)C1=CC=C(C=C1)Br MCULE-2147296684 [1,1,0,0,0,0|2,0,0]=4 2053 B12R1.16 C=CC[C@@H](N)C1=CC=C(C=C1)Br MCULE-6539697721 [1,1,0,0,0,0|2,0,0]=4 2054 B12R1.16 C=CC[C@@H](N)C1=CC=C(C=C1)C MCULE-2131336156 [1,1,0,0,0,0|2,0,0]=4 2055 B12R1.16 C=CC[C@@H](N)C1=CC=C(C=C1)C MCULE-3075831492 [1,1,0,0,0,0|2,0,0]=4 2056 B12R1.16 C=CC[C@@H](N)C1=CC=C(C=C1)Cl MCULE-3226205211 [1,1,0,0,0,0|2,0,0]=4 2057 B12R1.16 C=CC[C@@H](N)C1=CC=C(C=C1)Cl MCULE-9215302052 [1,1,0,0,0,0|2,0,0]=4 2058 B12R1.16 C=CC[C@@H](N)C1=CC=C(C=C1)F MCULE-8204564611 [1,1,0,0,0,0|2,0,0]=4 2059 B12R1.16 C=CC[C@@H](N)C1=CC=C(C=C1)F MCULE-8383051639 [1,1,0,0,0,0|2,0,0]=4 2060 B12R1.16 C=CC[C@@H](N)C1=CC=C(C=C1)F MCULE-8644962440 [1,1,0,0,0,0|2,0,0]=4 2061 B12R1.16 C=CC[C@@H](N)C1=CC=C(C=C1)F MCULE-9263141948 [1,1,0,0,0,0|2,0,0]=4 2062 B12R1.16 C=CC[C@@H](N)C1=CC=C(C=C1)I MCULE-1859465379 [1,1,0,0,0,0|2,0,0]=4 2063 B12R1.16 C=CC[C@@H](N)C1=CC=C(C=C1)I MCULE-7308967313 [1,1,0,0,0,0|2,0,0]=4 2064 B12R1.16 C=CC[C@@H](N)C1=CC=C(C=C1)N MCULE-3078200850 [1,1,0,0,0,0|1,0,0]=3 2065 B12R1.16 C=CC[C@@H](N)C1=CC=C(C=C1)O MCULE-1522223563 [1,1,0,0,0,0|2,0,0]=4 2066 B12R1.16 C=CC[C@@H](N)C1=CC=C(C=C1)O MCULE-5599214208 [1,1,0,0,0,0|2,0,0]=4 2067 B12R1.16 C=CC[C@H](N)C1=CC=C(C=C1)Br MCULE-1263363788 [1,1,0,0,0,0|2,0,0]=4 2068 B12R1.16 C=CC[C@H](N)C1=CC=C(C=C1)Br MCULE-6739625792 [1,1,0,0,0,0|2,0,0]=4 2069 B12R1.16 C=CC[C@H](N)C1=CC=C(C=C1)C MCULE-1823197415 [1,1,0,0,0,0|2,0,0]=4 2070 B12R1.16 C=CC[C@H](N)C1=CC=C(C=C1)C MCULE-9052970713 [1,1,0,0,0,0|2,0,0]=4 2071 B12R1.16 C=CC[C@H](N)C1=CC=C(C=C1)Cl MCULE-3878662223 [1,1,0,0,0,0|2,0,0]=4 2072 B12R1.16 C=CC[C@H](N)C1=CC=C(C=C1)Cl MCULE-4414574513 [1,1,0,0,0,0|2,0,0]=4 2073 B12R1.16 C=CC[C@H](N)C1=CC=C(C=C1)F MCULE-4813531052 [1,1,0,0,0,0|2,0,0]=4 2074 B12R1.16 C=CC[C@H](N)C1=CC=C(C=C1)F MCULE-5283060208 [1,1,0,0,0,0|2,0,0]=4 2075 B12R1.16 C=CC[C@H](N)C1=CC=C(C=C1)F MCULE-5379825593 [1,1,0,0,0,0|2,0,0]=4 2076 B12R1.16 C=CC[C@H](N)C1=CC=C(C=C1)I MCULE-2490044116 [1,1,0,0,0,0|2,0,0]=4 2077 B12R1.16 C=CC[C@H](N)C1=CC=C(C=C1)I MCULE-8081847194 [1,1,0,0,0,0|2,0,0]=4 2078 B12R1.16 C=CC[C@H](N)C1=CC=C(C=C1)N MCULE-3226766230 [1,1,0,0,0,0|1,0,0]=3 2079 B12R1.16 C=CC[C@H](N)C1=CC=C(C=C1)O MCULE-1594831835 [1,1,0,0,0,0|2,0,0]=4 2080 B12R1.16 C=CC[C@H](N)C1=CC=C(C=C1)O MCULE-5347200611 [1,1,0,0,0,0|2,0,0]=4 2081 B12R1.16 CC(CCO)C1=CC=C(C=C1)Br MCULE-8847642251 [1,1,0,0,0,0|1,0,1]=4 2082 B12R1.16 CC(CCO)C1=CC=C(C=C1)F MCULE-3412582279 [1,1,0,0,0,0|1,0,1]=4 2083 B12R1.16 CC(NC=O)C1=CC=C(C=C1)Br MCULE-4085635629 [1,1,0,0,0,0|2,0,0]=4 2084 B12R1.16 CC1=CC=C(C=C1)C(N)CCO MCULE-3214529966 [1,1,0,0,0,0|1,0,1]=4 2085 B12R1.16 CC1=CC=C(C=C1)C(N)CCO MCULE-6073673091 [1,1,0,0,0,0|1,0,1]=4 2086 B12R1.16 CC1=CC=C(C=C1)[C@@H](N)CCO MCULE-2183659717 [1,1,0,0,0,0|1,0,1]=4 2087 B12R1.16 CC1=CC=C(C=C1)[C@@H](N)CCO MCULE-3440294496 [1,1,0,0,0,0|1,0,1]=4 2088 B12R1.16 CC1=CC=C(C=C1)[C@@H](N)CCO MCULE-4702706776 [1,1,0,0,0,0|1,0,1]=4 2089 B12R1.16 CC1=CC=C(C=C1)[C@@H](N)CCO MCULE-8250606828 [1,1,0,0,0,0|1,0,1]=4 2090 B12R1.16 CC1=CC=C(C=C1)[C@H](N)CCO MCULE-6623262089 [1,1,0,0,0,0|1,0,1]=4 2091 B12R1.16 CC1=CC=C(C=C1)[C@H](N)CCO MCULE-6640677286 [1,1,0,0,0,0|1,0,1]=4 2092 B12R1.16 CC1=CC=C(C=C1)[C@H](N)CCO MCULE-8129741421 [1,1,0,0,0,0|1,0,1]=4 2093 B12R1.16 CCCC(N)C1=CC=C(C=C1)N MCULE-5183256852 [1,1,0,0,0,0|1,0,1]=4 2094 B12R1.16 CCC[C@@H](N)C1=CC=C(C=C1)N MCULE-4618238308 [1,1,0,0,0,0|1,0,1]=4 2095 B12R1.16 CCC[C@@H](N)C1=CC=C(C=C1)N MCULE-9329452366 [1,1,0,0,0,0|1,0,1]=4 2096 B12R1.16 CCC[C@H](N)C1=CC=C(C=C1)N MCULE-1138666208 [1,1,0,0,0,0|1,0,1]=4 2097 B12R1.16 CCC[C@H](N)C1=CC=C(C=C1)N MCULE-9548009239 [1,1,0,0,0,0|1,0,1]=4 2098 B12R1.16 CN(CCO)C1=CC=C(C=C1)N MCULE-1896103359 [1,1,0,0,0,0|1,0,1]=4 2099 B12R1.16 NC(CCO)C1=CC=C(C=C1)Br MCULE-2653556045 [1,1,0,0,0,0|1,0,1]=4 2100 B12R1.16 NC(CCO)C1=CC=C(C=C1)Br MCULE-9972559612 [1,1,0,0,0,0|1,0,1]=4 2101 B12R1.16 NC(CCO)C1=CC=C(C=C1)Cl MCULE-5950311661 [1,1,0,0,0,0|1,0,1]=4 2102 B12R1.16 NC(CCO)C1=CC=C(C=C1)Cl MCULE-6465276050 [1,1,0,0,0,0|1,0,1]=4 2103 B12R1.16 NC(CCO)C1=CC=C(C=C1)Cl MCULE-8060395746 [1,1,0,0,0,0|1,0,1]=4 2104 B12R1.16 NC(CCO)C1=CC=C(C=C1)F MCULE-1679707998 [1,1,0,0,0,0|1,0,1]=4 2105 B12R1.16 NC(CCO)C1=CC=C(C=C1)F MCULE-7626324995 [1,1,0,0,0,0|1,0,1]=4 2106 B12R1.16 NC1=CC=C(C=C1)C(N)CCO MCULE-5227829749 [1,1,0,0,0,0|0,0,1]=3 2107 B12R1.16 NC1=CC=C(C=C1)C(N)CCO MCULE-6132387033 [1,1,0,0,0,0|0,0,1]=3 2108 B12R1.16 NC1=CC=C(C=C1)C(N)CCO MCULE-7020156763 [1,1,0,0,0,0|0,0,1]=3 2109 B12R1.16 NC1=CC=C(C=C1)C(N)CCO MCULE-7187945605 [1,1,0,0,0,0|0,0,1]=3 2110 B12R1.16 NC1=CC=C(C=C1)C(N)CCO MCULE-9231065707 [1,1,0,0,0,0|0,0,1]=3 2111 B12R1.16 NC1=CC=C(C=C1)[C@@H](N)CCO MCULE-2546840979 [1,1,0,0,0,0|0,0,1]=3 2112 B12R1.16 NC1=CC=C(C=C1)[C@@H](N)CCO MCULE-4651871503 [1,1,0,0,0,0|0,0,1]=3 2113 B12R1.16 NC1=CC=C(C=C1)[C@@H](N)CCO MCULE-7878135301 [1,1,0,0,0,0|0,0,1]=3 2114 B12R1.16 NC1=CC=C(C=C1)[C@@H](N)CCO MCULE-9346588104 [1,1,0,0,0,0|0,0,1]=3 2115 B12R1.16 N[C@@H](CCO)C1=CC=C(C=C1)Br MCULE-4644401673 [1,1,0,0,0,0|1,0,1]=4 2116 B12R1.16 N[C@@H](CCO)C1=CC=C(C=C1)Br MCULE-5272680599 [1,1,0,0,0,0|1,0,1]=4 2117 B12R1.16 N[C@@H](CCO)C1=CC=C(C=C1)Br MCULE-5935922256 [1,1,0,0,0,0|1,0,1]=4 2118 B12R1.16 N[C@@H](CCO)C1=CC=C(C=C1)Br MCULE-7361316324 [1,1,0,0,0,0|1,0,1]=4 2119 B12R1.16 N[C@@H](CCO)C1=CC=C(C=C1)Cl MCULE-2655673196 [1,1,0,0,0,0|1,0,1]=4 2120 B12R1.16 N[C@@H](CCO)C1=CC=C(C=C1)Cl MCULE-6710536605 [1,1,0,0,0,0|1,0,1]=4 2121 B12R1.16 N[C@@H](CCO)C1=CC=C(C=C1)Cl MCULE-7202676409 [1,1,0,0,0,0|1,0,1]=4 2122 B12R1.16 N[C@@H](CCO)C1=CC=C(C=C1)Cl MCULE-9045775383 [1,1,0,0,0,0|1,0,1]=4 2123 B12R1.16 N[C@@H](CCO)C1=CC=C(C=C1)F MCULE-4503398783 [1,1,0,0,0,0|1,0,1]=4 2124 B12R1.16 N[C@@H](CCO)C1=CC=C(C=C1)F MCULE-6235652691 [1,1,0,0,0,0|1,0,1]=4 2125 B12R1.16 N[C@@H](CCO)C1=CC=C(C=C1)F MCULE-7079398605 [1,1,0,0,0,0|1,0,1]=4 2126 B12R1.16 N[C@@H](CCO)C1=CC=C(C=C1)F MCULE-9136511848 [1,1,0,0,0,0|1,0,1]=4 2127 B12R1.16 N[C@@H](CCO)C1=CC=C(C=C1)I MCULE-1575775090 [1,1,0,0,0,0|1,0,1]=4 2128 B12R1.16 N[C@@H](CCO)C1=CC=C(C=C1)I MCULE-4001369831 [1,1,0,0,0,0|1,0,1]=4 2129 B12R1.16 N[C@@H](CCO)C1=CC=C(C=C1)O MCULE-4627323506 [1,1,0,0,0,0|1,0,1]=4 2130 B12R1.16 N[C@@H](CCO)C1=CC=C(C=C1)O MCULE-7563983695 [1,1,0,0,0,0|1,0,1]=4 2131 B12R1.16 N[C@H](CCO)C1=CC=C(C=C1)Br MCULE-3593888240 [1,1,0,0,0,0|1,0,1]=4 2132 B12R1.16 N[C@H](CCO)C1=CC=C(C=C1)Br MCULE-3735714505 [1,1,0,0,0,0|1,0,1]=4 2133 B12R1.16 N[C@H](CCO)C1=CC=C(C=C1)Br MCULE-8920110714 [1,1,0,0,0,0|1,0,1]=4 2134 B12R1.16 N[C@H](CCO)C1=CC=C(C=C1)Cl MCULE-2690348144 [1,1,0,0,0,0|1,0,1]=4 2135 B12R1.16 N[C@H](CCO)C1=CC=C(C=C1)Cl MCULE-3345178582 [1,1,0,0,0,0|1,0,1]=4 2136 B12R1.16 N[C@H](CCO)C1=CC=C(C=C1)Cl MCULE-4222145038 [1,1,0,0,0,0|1,0,1]=4 2137 B12R1.16 N[C@H](CCO)C1=CC=C(C=C1)F MCULE-1096619541 [1,1,0,0,0,0|1,0,1]=4 2138 B12R1.16 N[C@H](CCO)C1=CC=C(C=C1)F MCULE-5737699235 [1,1,0,0,0,0|1,0,1]=4 2139 B12R1.16 N[C@H](CCO)C1=CC=C(C=C1)F MCULE-8932074629 [1,1,0,0,0,0|1,0,1]=4 2140 B12R1.16 N[C@H](CCO)C1=CC=C(C=C1)F MCULE-9516414106 [1,1,0,0,0,0|1,0,1]=4 2141 B12R1.16 N[C@H](CCO)C1=CC=C(C=C1)I MCULE-3341392368 [1,1,0,0,0,0|1,0,1]=4 2142 B12R1.16 N[C@H](CCO)C1=CC=C(C=C1)I MCULE-5533164822 [1,1,0,0,0,0|1,0,1]=4 2143 B12R1.16 N[C@H](CCO)C1=CC=C(C=C1)O MCULE-7835052667 [1,1,0,0,0,0|1,0,1]=4 2144 B12R1.16 N[C@H](CCO)C1=CC=C(C=C1)O MCULE-9080436199 [1,1,0,0,0,0|1,0,1]=4 2145 B12R1.16 OCCC(O)C1=CC=C(C=C1)Br MCULE-8730124948 [1,1,0,0,0,0|1,0,1]=4 2146 B12R1.49 C(N)(CO)CC1=CC=C(C=C1)O MCULE-4364318479 [1,1,0,0,0,0|1,0,1]=4 2147 B12R1.49 C(N)(CO)CC1=CC=C(C=C1)O MCULE-7731641378 [1,1,0,0,0,0|1,0,1]=4 2148 B12R1.49 C=CC(N)CC1=CC=C(C=C1)Br MCULE-5712461396 [1,1,0,0,0,0|2,0,0]=4 2149 B12R1.49 C=CC(N)CC1=CC=C(C=C1)Br MCULE-7108743115 [1,1,0,0,0,0|2,0,0]=4 2150 B12R1.49 CC(C=O)CC1=CC=C(C=C1)Br MCULE-8562500083 [1,1,0,0,0,0|1,0,0]=3 2151 B12R1.49 CC(CO)CC1=CC=C(C=C1)Br MCULE-4463530757 [1,1,0,0,0,0|1,0,1]=4 2152 B12R1.49 CC(CO)CC1=CC=C(C=C1)Cl MCULE-2757746872 [1,1,0,0,0,0|1,0,1]=4 2153 B12R1.49 CC(CO)CC1=CC=C(C=C1)F MCULE-4088443539 [1,1,0,0,0,0|1,0,1]=4 2154 B12R1.49 CC1=CC=C(C=C1)CC(C)CO MCULE-8274181207 [1,1,0,0,0,0|1,0,1]=4 2155 B12R1.49 CC1=CC=C(C=C1)CC(Cl)C=O MCULE-4762137367 [1,1,0,0,0,0|1,0,0]=3 2156 B12R1.49 CC1=CC=C(C=C1)CC(N)CO MCULE-4779951404 [1,1,0,0,0,0|1,0,1]=4 2157 B12R1.49 CC1=CC=C(C=C1)CC(N)CO MCULE-5830668486 [1,1,0,0,0,0|1,0,1]=4 2158 B12R1.49 NC(CO)CC1=CC=C(C=C1)Cl MCULE-2451229136 [1,1,0,0,0,0|1,0,1]=4 2159 B12R1.49 NC(CO)CC1=CC=C(C=C1)Cl MCULE-5055032465 [1,1,0,0,0,0|1,0,1]=4 2160 B12R1.49 NC(CO)CC1=CC=C(C=C1)Cl MCULE-9478178353 [1,1,0,0,0,0|1,0,1]=4 2161 B12R1.49 NC(CO)CC1=CC=C(C=C1)F MCULE-6787204944 [1,1,0,0,0,0|1,0,1]=4 2162 B12R1.49 NC(CO)CC1=CC=C(C=C1)F MCULE-7862382113 [1,1,0,0,0,0|1,0,1]=4 2163 B12R1.49 NC(CO)CC1=CC=C(C=C1)F MCULE-8412695071 [1,1,0,0,0,0|1,0,1]=4 2164 B12R1.49 NC(CO)CC1=CC=C(C=C1)F MCULE-9886176160 [1,1,0,0,0,0|1,0,1]=4 2165 B12R1.49 NC(CO)CC1=CC=C(C=C1)I MCULE-2322452328 [1,1,0,0,0,0|1,0,1]=4 2166 B12R1.49 N[C@@H](CO)CC1=CC=C(C=C1)Cl MCULE-1948546882 [1,1,0,0,0,0|1,0,1]=4 2167 B12R1.49 N[C@@H](CO)CC1=CC=C(C=C1)F MCULE-3791493238 [1,1,0,0,0,0|1,0,1]=4 2168 B12R1.49 N[C@@H](CO)CC1=CC=C(C=C1)F MCULE-3941031483 [1,1,0,0,0,0|1,0,1]=4 2169 B12R1.49 N[C@@H](CO)CC1=CC=C(C=C1)F MCULE-6839715881 [1,1,0,0,0,0|1,0,1]=4 2170 B12R1.49 N[C@@H](CO)CC1=CC=C(C=C1)F MCULE-7796624646 [1,1,0,0,0,0|1,0,1]=4 2171 B12R1.49 N[C@@H](CO)CC1=CC=C(C=C1)I MCULE-2463014757 [1,1,0,0,0,0|1,0,1]=4 2172 B12R1.49 N[C@@H](CO)CC1=CC=C(C=C1)I MCULE-9894685394 [1,1,0,0,0,0|1,0,1]=4 2173 B12R1.49 N[C@@H](CO)CC1=CC=C(C=C1)O MCULE-3432213644 [1,1,0,0,0,0|1,0,1]=4 2174 B12R1.49 N[C@@H](CO)CC1=CC=C(C=C1)O MCULE-4720290854 [1,1,0,0,0,0|1,0,1]=4 2175 B12R1.49 N[C@@H](CO)CC1=CC=C(C=C1)O MCULE-5805805181 [1,1,0,0,0,0|1,0,1]=4 2176 B12R1.49 N[C@@H](CO)CC1=CC=C(C=C1)O MCULE-7125179229 [1,1,0,0,0,0|1,0,1]=4 2177 B12R1.49 N[C@H](CO)CC1=CC=C(C=C1)Br MCULE-7337035743 [1,1,0,0,0,0|1,0,1]=4 2178 B12R1.49 N[C@H](CO)CC1=CC=C(C=C1)Cl MCULE-2850702380 [1,1,0,0,0,0|1,0,1]=4 2179 B12R1.49 N[C@H](CO)CC1=CC=C(C=C1)Cl MCULE-3670314163 [1,1,0,0,0,0|1,0,1]=4 2180 B12R1.49 N[C@H](CO)CC1=CC=C(C=C1)Cl MCULE-7854906977 [1,1,0,0,0,0|1,0,1]=4 2181 B12R1.49 N[C@H](CO)CC1=CC=C(C=C1)Cl MCULE-8742967393 [1,1,0,0,0,0|1,0,1]=4 2182 B12R1.49 N[C@H](CO)CC1=CC=C(C=C1)F MCULE-3245725968 [1,1,0,0,0,0|1,0,1]=4 2183 B12R1.49 N[C@H](CO)CC1=CC=C(C=C1)F MCULE-4191115900 [1,1,0,0,0,0|1,0,1]=4 2184 B12R1.49 N[C@H](CO)CC1=CC=C(C=C1)O MCULE-4240093020 [1,1,0,0,0,0|1,0,1]=4 2185 B12R1.49 N[C@H](CO)CC1=CC=C(C=C1)O MCULE-5219837114 [1,1,0,0,0,0|1,0,1]=4 2186 B12R1.49 N[C@H](CO)CC1=CC=C(C=C1)O MCULE-6710049160 [1,1,0,0,0,0|1,0,1]=4 2187 B12R1.49 N[C@H](CO)CC1=CC=C(C=C1)O MCULE-7653376778 [1,1,0,0,0,0|1,0,1]=4 2188 B12R1.49 O=CC(Cl)CC1=CC=C(C=C1)Cl MCULE-7350394782 [1,1,0,0,0,0|1,0,0]=3 2189 B12R1.49 [C@@H](N)(CO)CC1=CC=C(C=C1)Br MCULE-7701953937 [1,1,0,0,0,0|1,0,1]=4 2190 B12R1.49 [C@@H](N)(CO)CC1=CC=C(C=C1)Br MCULE-9104846655 [1,1,0,0,0,0|1,0,1]=4 2191 B12R1.69 C=CCCC1=C(C=C(C=C1)C)C MCULE-4402152188 [1,1,0,0,0,0|2,0,0]=4 2192 B12R1.69 C=CCCC1=C(C=C(C=C1)Cl)Cl MCULE-8944177616 [1,1,0,0,0,0|2,0,0]=4 2193 B12R1.69 C=CCCC1=C(C=C(C=C1)F)F MCULE-1719275390 [1,1,0,0,0,0|2,0,0]=4 2194 B12R1.69 C=CCCC1=CC=C(C=C1Br)F MCULE-5702474061 [1,1,0,0,0,0|2,0,0]=4 2195 B12R1.69 C=CCCC1=CC=C(C=C1C)Cl MCULE-8401417983 [1,1,0,0,0,0|2,0,0]=4 2196 B12R1.69 C=CCCC1=CC=C(C=C1C)F MCULE-2719101366 [1,1,0,0,0,0|2,0,0]=4 2197 B12R1.69 C=CCCC1=CC=C(C=C1Cl)F MCULE-8528555595 [1,1,0,0,0,0|2,0,0]=4 2198 B12R1.69 C=CCCC1=CC=C(C=C1F)Br MCULE-2323185656 [1,1,0,0,0,0|2,0,0]=4 2199 B12R1.69 C=CCCC1=CC=C(C=C1F)Cl MCULE-9484238762 [1,1,0,0,0,0|2,0,0]=4 2200 B12R1.69 CC1=C(C=CC(=C1)Br)CCCO MCULE-9540245296 [1,1,0,0,0,0|1,0,1]=4 2201 B12R1.69 CC1=C(C=CC(=C1)Br)OCC=O MCULE-7105294636 [1,1,0,0,0,0|2,0,0]=4 2202 B12R1.69 CC1=C(C=CC(=C1)F)CCCO MCULE-3019627534 [1,1,0,0,0,0|1,0,1]=4 2203 B12R1.69 CC1=C(C=CC(=C1)N)OCCO MCULE-1659621301 [1,1,0,0,0,0|1,0,1]=4 2204 B12R1.69 CC1=CC=C(C(=C1)Br)CCCO MCULE-8447894970 [1,1,0,0,0,0|1,0,1]=4 2205 B12R1.69 CC1=CC=C(C(=C1)N)CCCO MCULE-9241056576 [1,1,0,0,0,0|1,0,1]=4 2206 B12R1.69 NC1=CC(=C(C=C1)NCCO)N MCULE-1194009515 [1,1,0,0,0,0|1,0,1]=4 2207 B12R1.69 NC1=CC(=C(C=C1)NCCO)N MCULE-7555104572 [1,1,0,0,0,0|1,0,1]=4 2208 B12R1.69 NC1=CC(=CC=C1CCCO)F MCULE-2482602481 [1,1,0,0,0,0|1,0,1]=4 2209 B12R1.69 NC1=CC=C(C(=C1)N)OCCO MCULE-3337716434 [1,1,0,0,0,0|1,0,1]=4 2210 B12R1.69 NC1=CC=C(C(=C1)N)OCCO MCULE-4444697887 [1,1,0,0,0,0|1,0,1]=4 2211 B12R1.69 NC1=CC=C(C(=C1)N)OCCO MCULE-7807241153 [1,1,0,0,0,0|1,0,1]=4 2212 B12R1.69 O=CCCC1=C(C=C(C=C1)F)F MCULE-1167111798 [1,1,0,0,0,0|1,0,0]=3 2213 B12R1.69 O=CCOC1=CC=C(C=C1Cl)Br MCULE-4293132587 [1,1,0,0,0,0|2,0,0]=4 2214 B12R1.69 O=CNCC1=C(C=C(C=C1)Cl)Cl MCULE-8875126017 [1,1,0,0,0,0|2,0,0]=4 2215 B12R1.69 OCCCC1=C(C=C(C=C1)Cl)Cl MCULE-9016280037 [1,1,0,0,0,0|1,0,1]=4 2216 B12R1.69 OCCCC1=C(C=C(C=C1)F)F MCULE-5925882733 [1,1,0,0,0,0|1,0,1]=4 2217 B12R1.69 OCCCC1=CC=C(C=C1Cl)F MCULE-9597806456 [1,1,0,0,0,0|1,0,1]=4 2218 B12R1.69 OCCCC1=CC=C(C=C1F)Br MCULE-8871840248 [1,1,0,0,0,0|1,0,1]=4 2219 B12R1.71 C=CCCC1=CC=C(C=C1)C#N MCULE-9035741802 [1,1,0,0,0,0|1,0,1]=4 2220 B12R1.71 C=CCCC1=CC=C(C=C1)C=O MCULE-1972795446 [1,1,0,0,0,0|2,0,0]=4 2221 B12R1.71 C=CCCC1=CC=C(C=C1)CC MCULE-3525376155 [1,1,0,0,0,0|2,0,0]=4 2222 B12R1.71 C=CCCC1=CC=C(C=C1)OC MCULE-6216093201 [1,1,0,0,0,0|2,0,0]=4 2223 B12R1.71 C=CCCC1=CC=C(C=C1)SC MCULE-8054745506 [1,1,0,0,0,0|2,0,0]=4 2224 B12R1.71 C=CCOC1=CC=C(C=C1)CN MCULE-7878034615 [1,1,0,0,0,0|2,0,0]=4 2225 B12R1.71 CCC1=CC=C(C=C1)CCC=O MCULE-6428366585 [1,1,0,0,0,0|1,0,0]=3 2226 B12R1.71 CCC1=CC=C(C=C1)CCCO MCULE-9883158594 [1,1,0,0,0,0|1,0,1]=4 2227 B12R1.71 CCCCC1=CC=C(C=C1)CN MCULE-3819420039 [1,1,0,0,0,0|1,0,1]=4 2228 B12R1.71 CCCCC1=CC=C(C=C1)NC MCULE-3085599613 [1,1,0,0,0,0|1,0,1]=4 2229 B12R1.71 CCCCC1=CC=C(C=C1)NC MCULE-9214351551 [1,1,0,0,0,0|1,0,1]=4 2230 B12R1.71 CCCCC1=CC=C(C=C1)NN MCULE-6313085395 [1,1,0,0,0,0|1,0,1]=4 2231 B12R1.71 CCCCC1=CC=C(C=C1)NN MCULE-8977566602 [1,1,0,0,0,0|1,0,1]=4 2232 B12R1.71 COC1=CC=C(C=C1)CCC=O MCULE-7197170578 [1,1,0,0,0,0|1,0,0]=3 2233 B12R1.71 COC1=CC=C(C=C1)CCCO MCULE-8377781692 [1,1,0,0,0,0|1,0,1]=4 2234 B12R1.71 COC1=CC=C(C=C1)CNC=O MCULE-9952403543 [1,1,0,0,0,0|2,0,0]=4 2235 B12R1.71 COC1=CC=C(C=C1)COC=O MCULE-4555795668 [1,1,0,0,0,0|2,0,0]=4 2236 B12R1.71 COC1=CC=C(C=C1)OCC=O MCULE-3100373893 [1,1,0,0,0,0|2,0,0]=4 2237 B12R1.71 COC1=CC=C(C=C1)SCC=O MCULE-8827024003 [1,1,0,0,0,0|2,0,0]=4 2238 B12R1.71 CSC1=CC=C(C=C1)CNC=O MCULE-3280742295 [1,1,0,0,0,0|2,0,0]=4 2239 B12R1.71 N#CC1=CC=C(C=C1)CCC=O MCULE-5141473860 [1,1,0,0,0,0|0,0,1]=3 2240 B12R1.71 N#CC1=CC=C(C=C1)CCCO MCULE-7827479119 [1,1,0,0,0,0|0,0,2]=4 2241 B12R1.71 NCC1=CC=C(C=C1)CCCO MCULE-8019754587 [1,1,0,0,0,0|0,0,1]=3 2242 B12R1.71 NCC1=CC=C(C=C1)NCCO MCULE-3626213266 [1,1,0,0,0,0|1,0,1]=4 2243 B12R1.71 NCC1=CC=C(C=C1)NCCO MCULE-3852387000 [1,1,0,0,0,0|1,0,1]=4 2244 B12R1.71 NCC1=CC=C(C=C1)OCCO MCULE-1314557732 [1,1,0,0,0,0|1,0,1]=4 2245 B12R1.71 NCC1=CC=C(C=C1)OCCO MCULE-9145022231 [1,1,0,0,0,0|1,0,1]=4 2246 B12R1.385 C=CCCC1=CC(=C(C=C1)Br)F MCULE-8832625980 [1,1,0,0,0,0|2,0,0]=4 2247 B12R1.385 C=CCCC1=CC(=C(C=C1)C)C MCULE-6543291238 [1,1,0,0,0,0|2,0,0]=4 2248 B12R1.385 C=CCCC1=CC(=C(C=C1)C)F MCULE-5403282785 [1,1,0,0,0,0|2,0,0]=4 2249 B12R1.385 C=CCCC1=CC(=C(C=C1)Cl)C MCULE-2032724172 [1,1,0,0,0,0|2,0,0]=4 2250 B12R1.385 C=CCCC1=CC(=C(C=C1)Cl)Cl MCULE-5524584799 [1,1,0,0,0,0|2,0,0]=4 2251 B12R1.385 C=CCCC1=CC(=C(C=C1)Cl)F MCULE-1786903915 [1,1,0,0,0,0|2,0,0]=4 2252 B12R1.385 C=CCCC1=CC(=C(C=C1)F)Br MCULE-4613692466 [1,1,0,0,0,0|2,0,0]=4 2253 B12R1.385 C=CCCC1=CC(=C(C=C1)F)C MCULE-1334440697 [1,1,0,0,0,0|2,0,0]=4 2254 B12R1.385 C=CCCC1=CC(=C(C=C1)F)Cl MCULE-7414101411 [1,1,0,0,0,0|2,0,0]=4 2255 B12R1.385 C=CCCC1=CC(=C(C=C1)F)F MCULE-4967951236 [1,1,0,0,0,0|2,0,0]=4 2256 B12R1.385 C=CCOC1=CC=C(C(=C1)C)N MCULE-5037995757 [1,1,0,0,0,0|2,0,0]=4 2257 B12R1.385 CC1=C(C=C(C=C1)CCCO)C MCULE-3902016795 [1,1,0,0,0,0|1,0,1]=4 2258 B12R1.385 CC1=C(C=C(C=C1)OCC=O)C MCULE-4162760485 [1,1,0,0,0,0|2,0,0]=4 2259 B12R1.385 CC1=C(C=CC(=C1)OCC=O)Br MCULE-8086158173 [1,1,0,0,0,0|2,0,0]=4 2260 B12R1.385 CC1=C(C=CC(=C1)OCCO)N MCULE-2137190554 [1,1,0,0,0,0|1,0,1]=4 2261 B12R1.385 CC1=CC=C(C=C1Br)OCC=O MCULE-6418400892 [1,1,0,0,0,0|2,0,0]=4 2262 B12R1.385 CCCCC1=CC(=C(C=C1)N)C MCULE-6428265464 [1,1,0,0,0,0|1,0,1]=4 2263 B12R1.385 CCCCC1=CC(=C(C=C1)N)I MCULE-2678322650 [1,1,0,0,0,0|1,0,1]=4 2264 B12R1.385 CCCCC1=CC=C(C(=C1)Br)N MCULE-4328421054 [1,1,0,0,0,0|1,0,1]=4 2265 B12R1.385 O=CCCC1=CC(=C(C=C1)Cl)Cl MCULE-4954770246 [1,1,0,0,0,0|1,0,0]=3 2266 B12R1.385 O=CCCC1=CC=C(C(=C1)F)F MCULE-2180875479 [1,1,0,0,0,0|1,0,0]=3 2267 B12R1.385 O=CCOC1=CC(=C(C=C1)Br)F MCULE-4736139524 [1,1,0,0,0,0|2,0,0]=4 2268 B12R1.385 O=CCOC1=CC(=C(C=C1)Cl)Cl MCULE-2767999030 [1,1,0,0,0,0|2,0,0]=4 2269 B12R1.385 O=CCOC1=CC(=C(C=C1)F)Cl MCULE-2037510483 [1,1,0,0,0,0|2,0,0]=4 2270 B12R1.385 O=CCOC1=CC=C(C(=C1)F)F MCULE-9154007645 [1,1,0,0,0,0|2,0,0]=4 2271 B12R1.385 OCCCC1=CC(=C(C=C1)Cl)Cl MCULE-6998025548 [1,1,0,0,0,0|1,0,1]=4 2272 B12R1.385 OCCCC1=CC(=C(C=C1)F)F MCULE-6624805188 [1,1,0,0,0,0|1,0,1]=4 2273 B12R1.27 C#CC(=O)CCC1=CC=CC=C1 MCULE-8515335199 [1,1,0,0,0,0|1,0,0]=3 2274 B12R1.27 C#CC(=O)NCC1=CC=CC=C1 MCULE-1198687722 [1,1,0,0,0,0|2,0,0]=4 2275 B12R1.27 C#CC(=O)OCC1=CC=CC=C1 MCULE-6374995637 [1,1,0,0,0,0|2,0,0]=4 2276 B12R1.27 C#CC(O)CCC1=CC=CC=C1 MCULE-5755162407 [1,1,0,0,0,0|1,0,1]=4 2277 B12R1.27 C#C[C@H](O)CCC1=CC=CC=C1 MCULE-8377014160 [1,1,0,0,0,0|1,0,1]=4 2278 B12R1.27 C=CC(=O)NCC1=CC=CC=C1 MCULE-3032410941 [1,1,0,0,0,0|2,0,0]=4 2279 B12R1.27 C=CC(=O)OCC1=CC=CC=C1 MCULE-9376976489 [1,1,0,0,0,0|2,0,0]=4 2280 B12R1.27 CC(C=O)CCC1=CC=CC=C1 MCULE-9175155992 [1,1,0,0,0,0|1,0,1]=4 2281 B12R1.27 CC(CO)CCC1=CC=CC=C1 MCULE-6469270838 [1,1,0,0,0,0|1,0,1]=4 2282 B12R1.27 CCC(=O)CCC1=CC=CC=C1 MCULE-8657578743 [1,1,0,0,0,0|1,0,0]=3 2283 B12R1.27 CCC(=O)NCC1=CC=CC=C1 MCULE-7839045376 [1,1,0,0,0,0|2,0,0]=4 2284 B12R1.27 CCC(=O)OCC1=CC=CC=C1 MCULE-6579799733 [1,1,0,0,0,0|2,0,0]=4 2285 B12R1.27 CNC(=O)CCC1=CC=CC=C1 MCULE-3807954819 [1,1,0,0,0,0|1,0,0]=3 2286 B12R1.27 CNC(=O)COC1=CC=CC=C1 MCULE-3668298777 [1,1,0,0,0,0|2,0,0]=4 2287 B12R1.27 COC(=O)/C=C/C1=CC=CC=C1 MCULE-2483911454 [1,1,0,0,0,0|0,0,2]=4 2288 B12R1.27 COC(=O)C#CC1=CC=CC=C1 MCULE-9950029181 [1,1,0,0,0,0|0,0,2]=4 2289 B12R1.27 COC(=O)C=CC1=CC=CC=C1 MCULE-1030097873 [1,1,0,0,0,0|0,0,2]=4 2290 B12R1.27 COC(=O)CCC1=CC=CC=C1 MCULE-1647522263 [1,1,0,0,0,0|0,0,0]=2 2291 B12R1.27 COC(=O)CCC1=CC=NC=C1 MCULE-1070035261 [1,1,0,0,0,0|1,0,0]=3 2292 B12R1.27 COC(=O)CCC1=CC=NC=N1 MCULE-2869011674 [1,1,0,0,0,0|2,0,0]=4 2293 B12R1.27 COC(=O)CCC1=CN=CC=C1 MCULE-8699627407 [1,1,0,0,0,0|1,0,0]=3 2294 B12R1.27 COC(=O)CCC1=CN=CN=C1 MCULE-3628429966 [1,1,0,0,0,0|2,0,0]=4 2295 B12R1.27 COC(=O)CCC1=NC=CC=C1 MCULE-2350215112 [1,1,0,0,0,0|1,0,0]=3 2296 B12R1.27 COC(=O)CCC1=NC=CC=N1 MCULE-4741184577 [1,1,0,0,0,0|2,0,0]=4 2297 B12R1.27 COC(=O)CCC1=NC=CN=C1 MCULE-3200681560 [1,1,0,0,0,0|2,0,0]=4 2298 B12R1.27 COC(=O)CNC1=CC=CC=C1 MCULE-3641643918 [1,1,0,0,0,0|1,0,0]=3 2299 B12R1.27 COC(=O)CNC1=CC=CC=C1 MCULE-8918420954 [1,1,0,0,0,0|1,0,0]=3 2300 B12R1.27 COC(=O)CNC1=NC=CC=C1 MCULE-7909156111 [1,1,0,0,0,0|2,0,0]=4 2301 B12R1.27 COC(=O)COC1=CC=CC=C1 MCULE-9625780949 [1,1,0,0,0,0|1,0,0]=3 2302 B12R1.27 COC(=O)CSC1=CC=CC=C1 MCULE-9129768885 [1,1,0,0,0,0|1,0,0]=3 2303 B12R1.27 COC(=O)CSC1=NC=CC=C1 MCULE-3161745821 [1,1,0,0,0,0|2,0,0]=4 2304 B12R1.27 COC(=O)CSC1=NC=CC=C1 MCULE-8731899679 [1,1,0,0,0,0|2,0,0]=4 2305 B12R1.27 COC(=O)NCC1=CC=CC=C1 MCULE-4950997948 [1,1,0,0,0,0|1,0,0]=3 2306 B12R1.27 N#CC(=O)NCC1=CC=CC=C1 MCULE-7415794579 [1,1,0,0,0,0|2,0,0]=4 2307 B12R1.27 N#CC(=O)OCC1=CC=CC=C1 MCULE-8677049666 [1,1,0,0,0,0|2,0,0]=4 2308 B12R1.27 N#CC(O)CCC1=CC=CC=C1 MCULE-6823931694 [1,1,0,0,0,0|1,0,1]=4 2309 B12R1.27 N/C(=N\O)/COC1=CC=CC=C1 MCULE-7017178957 [1,1,0,0,0,0|2,0,0]=4 2310 B12R1.27 NC(CO)CCC1=CC=CC=C1 MCULE-6673850897 [1,1,0,0,0,0|1,0,1]=4 2311 B12R1.27 NCC(=O)CCC1=CC=CC=C1 MCULE-4094656106 [1,1,0,0,0,0|1,0,0]=3 2312 B12R1.27 NCC(=O)CCC1=CC=CC=C1 MCULE-8867640505 [1,1,0,0,0,0|1,0,0]=3 2313 B12R1.27 NCC(=O)NCC1=CC=CC=C1 MCULE-7579204027 [1,1,0,0,0,0|2,0,0]=4 2314 B12R1.27 NCC(=O)NCC1=CC=CC=C1 MCULE-9300471193 [1,1,0,0,0,0|2,0,0]=4 2315 B12R1.27 NCC(=O)OCC1=CC=CC=C1 MCULE-4339891792 [1,1,0,0,0,0|2,0,0]=4 2316 B12R1.27 NCC(=O)OCC1=CC=CC=C1 MCULE-4931378252 [1,1,0,0,0,0|2,0,0]=4 2317 B12R1.27 NCC(=O)OCC1=CC=CC=C1 MCULE-7529657957 [1,1,0,0,0,0|2,0,0]=4 2318 B12R1.27 NCC(=O)SCC1=CC=CC=C1 MCULE-2988812316 [1,1,0,0,0,0|2,0,0]=4 2319 B12R1.27 NCC(O)CCC1=CC=CC=C1 MCULE-1179789034 [1,1,0,0,0,0|1,0,1]=4 2320 B12R1.27 NNC(=O)CCC1=CC=CC=C1 MCULE-6089875983 [1,1,0,0,0,0|1,0,0]=3 2321 B12R1.27 NNC(=O)CCC1=CN=CC=C1 MCULE-6194614277 [1,1,0,0,0,0|2,0,0]=4 2322 B12R1.27 NNC(=O)CNC1=CC=CC=C1 MCULE-4616781095 [1,1,0,0,0,0|2,0,0]=4 2323 B12R1.27 NNC(=O)COC1=CC=CC=C1 MCULE-1692184611 [1,1,0,0,0,0|2,0,0]=4 2324 B12R1.27 NNC(=O)CSC1=CC=CC=C1 MCULE-6152722883 [1,1,0,0,0,0|2,0,0]=4 2325 B12R1.27 NNC(=O)NCC1=CC=CC=C1 MCULE-9850485264 [1,1,0,0,0,0|2,0,0]=4 2326 B12R1.27 NNC(=O)OCC1=CC=CC=C1 MCULE-1650875098 [1,1,0,0,0,0|2,0,0]=4 2327 B12R1.27 NNC(=O)OCC1=CC=CC=C1 MCULE-6569393445 [1,1,0,0,0,0|2,0,0]=4 2328 B12R1.27 N[C@@H](CO)CCC1=CC=CC=C1 MCULE-1937001414 [1,1,0,0,0,0|1,0,1]=4 2329 B12R1.27 N[C@@H](CO)CCC1=CC=CC=C1 MCULE-1994503014 [1,1,0,0,0,0|1,0,1]=4 2330 B12R1.27 N[C@H](CO)CCC1=CC=CC=C1 MCULE-3457504038 [1,1,0,0,0,0|1,0,1]=4 2331 B12R1.27 N[C@H](CO)CCC1=CC=CC=C1 MCULE-9691986906 [1,1,0,0,0,0|1,0,1]=4 2332 B12R1.27 O=C(C=CC1=CC=CC=C1)NO MCULE-6631204989 [1,1,0,0,0,0|0,0,2]=4 2333 B12R1.27 O=C(CBr)CCC1=CC=CC=C1 MCULE-5957115741 [1,1,0,0,0,0|1,0,0]=3 2334 B12R1.27 O=C(CBr)NCC1=CC=CC=C1 MCULE-2602504848 [1,1,0,0,0,0|2,0,0]=4 2335 B12R1.27 O=C(CBr)OCC1=CC=CC=C1 MCULE-8955848365 [1,1,0,0,0,0|2,0,0]=4 2336 B12R1.27 O=C(CCC1=CC=CC=C1)NO MCULE-1964924561 [1,1,0,0,0,0|0,0,0]=2 2337 B12R1.27 O=C(CCl)CCC1=CC=CC=C1 MCULE-3689633288 [1,1,0,0,0,0|1,0,0]=3 2338 B12R1.27 O=C(CCl)COC1=CC=CC=C1 MCULE-6747260923 [1,1,0,0,0,0|2,0,0]=4 2339 B12R1.27 O=C(CCl)NCC1=CC=CC=C1 MCULE-8776040788 [1,1,0,0,0,0|2,0,0]=4 2340 B12R1.27 O=C(CCl)OCC1=CC=CC=C1 MCULE-8284636354 [1,1,0,0,0,0|2,0,0]=4 2341 B12R1.27 O=C(CO)NCC1=CC=CC=C1 MCULE-4708335371 [1,1,0,0,0,0|1,0,0]=3 2342 B12R1.27 O=C(CO)OCC1=CC=CC=C1 MCULE-6868642200 [1,1,0,0,0,0|1,0,0]=3 2343 B12R1.27 O=C(COC1=CC=CC=C1)NO MCULE-9180977721 [1,1,0,0,0,0|1,0,0]=3 2344 B12R1.27 O=C(CS)OCC1=CC=CC=C1 MCULE-6583806514 [1,1,0,0,0,0|1,1,0]=4 2345 B12R1.27 O=C(NO)NNC1=CC=CC=C1 MCULE-1384654171 [1,1,0,0,0,0|2,0,0]=4 2346 B12R1.27 O=C(NO)OCC1=CC=CC=C1 MCULE-1476264710 [1,1,0,0,0,0|1,0,0]=3 2347 B12R1.27 O=CC(=O)OCC1=CC=CC=C1 MCULE-4022615260 [1,1,0,0,0,0|1,0,1]=4 2348 B12R1.43 C/C(=C\C1=CC=CC=C1)/C(=O)O MCULE-2320385089 [1,1,0,0,0,0|0,0,2]=4 2349 B12R1.43 C=C(CC1=CC=CC=C1)C(=O)O MCULE-6200285839 [1,1,0,0,0,0|0,0,1]=3 2350 B12R1.43 CC(=CC1=CC=CC=C1)C(=O)O MCULE-9237421946 [1,1,0,0,0,0|0,0,2]=4 2351 B12R1.43 CC(=O)C(Br)CC1=CC=CC=C1 MCULE-1714878295 [1,1,0,0,0,0|1,0,0]=3 2352 B12R1.43 CC(=O)C(C)CC1=CC=CC=C1 MCULE-9879731396 [1,1,0,0,0,0|1,0,0]=3 2353 B12R1.43 CC(=O)C(C)OC1=CC=CC=C1 MCULE-2440308883 [1,1,0,0,0,0|2,0,0]=4 2354 B12R1.43 CC(=O)C(N)CC1=CC=CC=C1 MCULE-4230256436 [1,1,0,0,0,0|1,0,0]=3 2355 B12R1.43 CC(=O)C(N)CC1=CC=CC=C1 MCULE-7161249545 [1,1,0,0,0,0|1,0,0]=3 2356 B12R1.43 CC(CC1=CC=CC=C1)C(=O)Cl MCULE-6045163933 [1,1,0,0,0,0|1,0,0]=3 2357 B12R1.43 CC(CC1=CC=CC=C1)C(=O)N MCULE-5416273234 [1,1,0,0,0,0|1,0,0]=3 2358 B12R1.43 CC(CC1=CC=CC=C1)C(=O)O MCULE-7326511541 [1,1,0,0,0,0|0,0,0]=2 2359 B12R1.43 CC(CC1=CC=CC=C1)N(=O)=O MCULE-3699420660 [1,1,0,0,0,0|1,0,1]=4 2360 B12R1.43 CC(CC1=CC=CN=C1)C(=O)O MCULE-2945865799 [1,1,0,0,0,0|1,0,0]=3 2361 B12R1.43 CC(CC1=CC=CN=C1)C(=O)O MCULE-5331249082 [1,1,0,0,0,0|1,0,0]=3 2362 B12R1.43 CC(CC1=CC=NC=C1)C(=O)O MCULE-6152899620 [1,1,0,0,0,0|1,0,0]=3 2363 B12R1.43 CC(CC1=CC=NC=N1)C(=O)O MCULE-5948691397 [1,1,0,0,0,0|2,0,0]=4 2364 B12R1.43 CC(CC1=CN=CN=C1)C(=O)O MCULE-3850019109 [1,1,0,0,0,0|2,0,0]=4 2365 B12R1.43 CC(CC1=NC=CC=C1)C(=O)O MCULE-6566847057 [1,1,0,0,0,0|1,0,0]=3 2366 B12R1.43 CC(CC1=NC=CC=N1)C(=O)O MCULE-9423018015 [1,1,0,0,0,0|2,0,0]=4 2367 B12R1.43 CC(NC1=CC=CC=C1)C(=O)O MCULE-7005885995 [1,1,0,0,0,0|1,0,0]=3 2368 B12R1.43 CC(NC1=CC=CN=C1)C(=O)O MCULE-7829627263 [1,1,0,0,0,0|2,0,0]=4 2369 B12R1.43 CC(OC1=CC=CC=C1)C(=O)Cl MCULE-2930639726 [1,1,0,0,0,0|2,0,0]=4 2370 B12R1.43 CC(OC1=CC=CC=C1)C(=O)N MCULE-4078826646 [1,1,0,0,0,0|2,0,0]=4 2371 B12R1.43 CC(OC1=CC=CC=C1)C(=O)O MCULE-3922404950 [1,1,0,0,0,0|1,0,0]=3 2372 B12R1.43 CC(OC1=CN=CC=C1)C(=O)O MCULE-9438736579 [1,1,0,0,0,0|2,0,0]=4 2373 B12R1.43 CC(OC1=NC=CC=C1)C(=O)O MCULE-8335834842 [1,1,0,0,0,0|2,0,0]=4 2374 B12R1.43 CC(SC1=CC=CC=C1)C(=O)O MCULE-9280194220 [1,1,0,0,0,0|1,0,0]=3 2375 B12R1.43 CC(SC1=CC=NC=C1)C(=O)O MCULE-6570780253 [1,1,0,0,0,0|2,0,0]=4 2376 B12R1.43 CC(SC1=NC=CC=C1)C(=O)O MCULE-1835508382 [1,1,0,0,0,0|2,0,0]=4 2377 B12R1.43 CN(CC1=CC=CC=C1)C(=O)Cl MCULE-2535776595 [1,1,0,0,0,0|2,0,0]=4 2378 B12R1.43 C[C@@H](CC1=CC=CC=C1)C(=O)O MCULE-2382098458 [1,1,0,0,0,0|0,0,0]=2 2379 B12R1.43 C[C@@H](CC1=CC=CC=C1)C(=O)O MCULE-3028530630 [1,1,0,0,0,0|0,0,0]=2 2380 B12R1.43 C[C@@H](OC1=CC=CC=C1)C(=O)O MCULE-2381911676 [1,1,0,0,0,0|1,0,0]=3 2381 B12R1.43 C[C@@H](OC1=CC=CC=C1)C(=O)O MCULE-5540145744 [1,1,0,0,0,0|1,0,0]=3 2382 B12R1.43 C[C@H](CC1=CC=CC=C1)C(=O)O MCULE-5116283906 [1,1,0,0,0,0|0,0,0]=2 2383 B12R1.43 C[C@H](NC1=CC=CC=C1)C(=O)O MCULE-1832900891 [1,1,0,0,0,0|1,0,0]=3 2384 B12R1.43 C[C@H](NC1=CC=NC=C1)C(=O)O MCULE-6289170240 [1,1,0,0,0,0|2,0,0]=4 2385 B12R1.43 C[C@H](NC1=CC=NC=C1)C(=O)O MCULE-7122084450 [1,1,0,0,0,0|2,0,0]=4 2386 B12R1.43 C[C@H](OC1=CC=CC=C1)C(=O)O MCULE-1535867362 [1,1,0,0,0,0|1,0,0]=3 2387 B12R1.43 C[C@H](OC1=CC=CC=C1)C(=O)O MCULE-6976463834 [1,1,0,0,0,0|1,0,0]=3 2388 B12R1.43 C[C@H](SC1=NC=CC=C1)C(=O)O MCULE-8631279326 [1,1,0,0,0,0|2,0,0]=4 2389 B12R1.43 NC(=O)C(Br)CC1=CC=CC=C1 MCULE-8335898952 [1,1,0,0,0,0|1,0,0]=3 2390 B12R1.43 NC(=O)C(N)CC1=CC=CC=C1 MCULE-2161822841 [1,1,0,0,0,0|1,0,0]=3 2391 B12R1.43 NC(=O)C(N)CC1=CC=CC=C1 MCULE-2610261909 [1,1,0,0,0,0|1,0,0]=3 2392 B12R1.43 NC(=O)C(N)CC1=CC=CC=C1 MCULE-9345667353 [1,1,0,0,0,0|1,0,0]=3 2393 B12R1.43 NC(=O)C(N)CC1=CC=CC=C1 MCULE-9732246414 [1,1,0,0,0,0|1,0,0]=3 2394 B12R1.43 NC(=O)C(O)CC1=CC=CC=C1 MCULE-2820917516 [1,1,0,0,0,0|1,0,0]=3 2395 B12R1.43 NC(=O)[C@@H](N)CC1=CC=CC=C1 MCULE-6548337580 [1,1,0,0,0,0|1,0,0]=3 2396 B12R1.43 NC(=O)[C@@H](N)CC1=CC=CC=C1 MCULE-7119612436 [1,1,0,0,0,0|1,0,0]=3 2397 B12R1.43 NC(=O)[C@@H](N)CC1=CC=CC=C1 MCULE-9635114334 [1,1,0,0,0,0|1,0,0]=3 2398 B12R1.43 NC(=O)[C@H](N)CC1=CC=CC=C1 MCULE-3676093786 [1,1,0,0,0,0|1,0,0]=3 2399 B12R1.43 NC(=O)[C@H](N)CC1=CC=CC=C1 MCULE-5027501057 [1,1,0,0,0,0|1,0,0]=3 2400 B12R1.43 NC(=O)[C@H](N)CC1=CC=CC=C1 MCULE-5946837057 [1,1,0,0,0,0|1,0,0]=3 2401 B12R1.43 NC(=O)[C@H](N)CC1=CC=CC=C1 MCULE-8948644005 [1,1,0,0,0,0|1,0,0]=3 2402 B12R1.43 NC(CC1=CC=CC=C1)C(=O)O MCULE-4509365715 [1,1,0,0,0,0|0,0,0]=2 2403 B12R1.43 NC(CC1=CC=CC=C1)C(=O)O MCULE-9481096822 [1,1,0,0,0,0|0,0,0]=2 2404 B12R1.43 NC(CC1=CC=CN=C1)C(=O)O MCULE-3369503748 [1,1,0,0,0,0|1,0,0]=3 2405 B12R1.43 NC(CC1=CC=CN=C1)C(=O)O MCULE-4500681212 [1,1,0,0,0,0|1,0,0]=3 2406 B12R1.43 NC(CC1=CC=NC=C1)C(=O)O MCULE-3037053990 [1,1,0,0,0,0|1,0,0]=3 2407 B12R1.43 NC(CC1=CC=NC=C1)C(=O)O MCULE-3740298834 [1,1,0,0,0,0|1,0,0]=3 2408 B12R1.43 NC(CC1=CC=NC=C1)C(=O)O MCULE-4165068673 [1,1,0,0,0,0|1,0,0]=3 2409 B12R1.43 NC(CC1=CC=NC=C1)C(=O)O MCULE-8377448441 [1,1,0,0,0,0|1,0,0]=3 2410 B12R1.43 NC(CC1=CC=NC=C1)C(=O)O MCULE-9526041825 [1,1,0,0,0,0|1,0,0]=3 2411 B12R1.43 NC(CC1=CN=CC=C1)C(=O)O MCULE-2658135318 [1,1,0,0,0,0|1,0,0]=3 2412 B12R1.43 NC(CC1=CN=CC=C1)C(=O)O MCULE-4065287784 [1,1,0,0,0,0|1,0,0]=3 2413 B12R1.43 NC(CC1=CN=CC=C1)C(=O)O MCULE-4169399134 [1,1,0,0,0,0|1,0,0]=3 2414 B12R1.43 NC(CC1=NC=CC=C1)C(=O)O MCULE-2466401514 [1,1,0,0,0,0|1,0,0]=3 2415 B12R1.43 NC(CC1=NC=CC=C1)C(=O)O MCULE-7994000866 [1,1,0,0,0,0|1,0,0]=3 2416 B12R1.43 NC(CC1=NC=CC=N1)C(=O)O MCULE-3988060033 [1,1,0,0,0,0|2,0,0]=4 2417 B12R1.43 NC(CC1=NC=CC=N1)C(=O)O MCULE-6011199658 [1,1,0,0,0,0|2,0,0]=4 2418 B12R1.43 NC(CC1=NC=NC=C1)C(=O)O MCULE-3627790030 [1,1,0,0,0,0|2,0,0]=4 2419 B12R1.43 NC(CC1=NC=NC=C1)C(=O)O MCULE-8971528550 [1,1,0,0,0,0|2,0,0]=4 2420 B12R1.43 NC(CC1=NN=CC=C1)C(=O)O MCULE-3486949364 [1,1,0,0,0,0|2,0,0]=4 2421 B12R1.43 NC(CC1=NN=CC=C1)C(=O)O MCULE-9714711796 [1,1,0,0,0,0|2,0,0]=4 2422 B12R1.43 N[C@@H](CC1=CC=CC=C1)C(=O)O MCULE-1311765992 [1,1,0,0,0,0|0,0,0]=2 2423 B12R1.43 N[C@@H](CC1=CC=CC=C1)C(=O)O MCULE-4249753593 [1,1,0,0,0,0|0,0,0]=2 2424 B12R1.43 N[C@@H](CC1=CC=CC=C1)C(=O)O MCULE-5960921520 [1,1,0,0,0,0|0,0,0]=2 2425 B12R1.43 N[C@@H](CC1=CC=CC=C1)C(=O)O MCULE-9410526237 [1,1,0,0,0,0|0,0,0]=2 2426 B12R1.43 N[C@@H](CC1=CC=CN=C1)C(=O)O MCULE-1318776684 [1,1,0,0,0,0|1,0,0]=3 2427 B12R1.43 N[C@@H](CC1=CC=CN=C1)C(=O)O MCULE-2756511850 [1,1,0,0,0,0|1,0,0]=3 2428 B12R1.43 N[C@@H](CC1=CC=CN=C1)C(=O)O MCULE-6450114631 [1,1,0,0,0,0|1,0,0]=3 2429 B12R1.43 N[C@@H](CC1=CC=CN=C1)C(=O)O MCULE-6451205573 [1,1,0,0,0,0|1,0,0]=3 2430 B12R1.43 N[C@@H](CC1=CC=CN=C1)C(=O)O MCULE-6819782094 [1,1,0,0,0,0|1,0,0]=3 2431 B12R1.43 N[C@@H](CC1=CC=CN=C1)C(=O)O MCULE-7779462392 [1,1,0,0,0,0|1,0,0]=3 2432 B12R1.43 N[C@@H](CC1=CC=NC=C1)C(=O)O MCULE-1319584746 [1,1,0,0,0,0|1,0,0]=3 2433 B12R1.43 N[C@@H](CC1=CC=NC=C1)C(=O)O MCULE-4038860269 [1,1,0,0,0,0|1,0,0]=3 2434 B12R1.43 N[C@@H](CC1=CC=NC=C1)C(=O)O MCULE-5445835001 [1,1,0,0,0,0|1,0,0]=3 2435 B12R1.43 N[C@@H](CC1=CC=NC=C1)C(=O)O MCULE-9469765262 [1,1,0,0,0,0|1,0,0]=3 2436 B12R1.43 N[C@@H](CC1=NC=CC=C1)C(=O)O MCULE-1225994987 [1,1,0,0,0,0|1,0,0]=3 2437 B12R1.43 N[C@@H](CC1=NC=CC=C1)C(=O)O MCULE-1559053573 [1,1,0,0,0,0|1,0,0]=3 2438 B12R1.43 N[C@@H](CC1=NC=CC=C1)C(=O)O MCULE-2320178150 [1,1,0,0,0,0|1,0,0]=3 2439 B12R1.43 N[C@@H](CC1=NN=CC=C1)C(=O)O MCULE-1359394268 [1,1,0,0,0,0|2,0,0]=4 2440 B12R1.43 N[C@@H](CC1=NN=CC=C1)C(=O)O MCULE-2088497949 [1,1,0,0,0,0|2,0,0]=4 2441 B12R1.43 N[C@@H](CC1=NN=CC=C1)C(=O)O MCULE-3144048553 [1,1,0,0,0,0|2,0,0]=4 2442 B12R1.43 N[C@@H](CC1=NN=CC=C1)C(=O)O MCULE-6040113143 [1,1,0,0,0,0|2,0,0]=4 2443 B12R1.43 N[C@H](CC1=CC=CC=C1)C(=O)O MCULE-2148272872 [1,1,0,0,0,0|0,0,0]=2 2444 B12R1.43 N[C@H](CC1=CC=CC=C1)C(=O)O MCULE-2197316791 [1,1,0,0,0,0|0,0,0]=2 2445 B12R1.43 N[C@H](CC1=CC=CC=C1)C(=O)O MCULE-2827782619 [1,1,0,0,0,0|0,0,0]=2 2446 B12R1.43 N[C@H](CC1=CC=CC=C1)C(=O)O MCULE-3011969403 [1,1,0,0,0,0|0,0,0]=2 2447 B12R1.43 N[C@H](CC1=CC=CN=C1)C(=O)O MCULE-3394687698 [1,1,0,0,0,0|1,0,0]=3 2448 B12R1.43 N[C@H](CC1=CC=CN=C1)C(=O)O MCULE-4997997022 [1,1,0,0,0,0|1,0,0]=3 2449 B12R1.43 N[C@H](CC1=CC=CN=C1)C(=O)O MCULE-5673410743 [1,1,0,0,0,0|1,0,0]=3 2450 B12R1.43 N[C@H](CC1=CC=CN=C1)C(=O)O MCULE-8503334355 [1,1,0,0,0,0|1,0,0]=3 2451 B12R1.43 N[C@H](CC1=CC=CN=C1)C(=O)O MCULE-9702283993 [1,1,0,0,0,0|1,0,0]=3 2452 B12R1.43 N[C@H](CC1=CC=NC=C1)C(=O)O MCULE-1530965630 [1,1,0,0,0,0|1,0,0]=3 2453 B12R1.43 N[C@H](CC1=CC=NC=C1)C(=O)O MCULE-2261526216 [1,1,0,0,0,0|1,0,0]=3 2454 B12R1.43 N[C@H](CC1=CC=NC=C1)C(=O)O MCULE-5458063668 [1,1,0,0,0,0|1,0,0]=3 2455 B12R1.43 N[C@H](CC1=CC=NC=C1)C(=O)O MCULE-8584771604 [1,1,0,0,0,0|1,0,0]=3 2456 B12R1.43 N[C@H](CC1=NC=CC=C1)C(=O)O MCULE-2767701043 [1,1,0,0,0,0|1,0,0]=3 2457 B12R1.43 N[C@H](CC1=NC=CC=C1)C(=O)O MCULE-3184854322 [1,1,0,0,0,0|1,0,0]=3 2458 B12R1.43 N[C@H](CC1=NC=CC=C1)C(=O)O MCULE-5316652497 [1,1,0,0,0,0|1,0,0]=3 2459 B12R1.43 N[C@H](CC1=NC=CC=C1)C(=O)O MCULE-8407561976 [1,1,0,0,0,0|1,0,0]=3 2460 B12R1.43 O=C(Cl)C(Br)CC1=CC=CC=C1 MCULE-8151311396 [1,1,0,0,0,0|1,0,0]=3 2461 B12R1.43 O=C(O)/C(=C/C1=CC=CC=C1)/Cl MCULE-5967816434 [1,1,0,0,0,0|0,0,2]=4 2462 B12R1.43 O=C(O)/C(=C/C1=CC=CC=C1)/F MCULE-1278212404 [1,1,0,0,0,0|0,0,2]=4 2463 B12R1.43 O=C(O)/C(=C/C1=CC=CC=C1)/O MCULE-9639825195 [1,1,0,0,0,0|0,0,2]=4 2464 B12R1.43 O=C(O)C(=CC1=CC=CC=C1)Cl MCULE-1012118487 [1,1,0,0,0,0|0,0,2]=4 2465 B12R1.43 O=C(O)C(=CC1=CC=CC=C1)F MCULE-5587932542 [1,1,0,0,0,0|0,0,2]=4 2466 B12R1.43 O=C(O)C(=CC1=CC=CC=C1)O MCULE-9904864252 [1,1,0,0,0,0|0,0,2]=4 2467 B12R1.43 O=C(O)C(=CC1=CC=CC=C1)S MCULE-7966134349 [1,1,0,0,0,0|0,0,2]=4 2468 B12R1.43 O=C(O)C(=O)CC1=CC=CC=C1 MCULE-9935480822 [1,1,0,0,0,0|0,0,1]=3 2469 B12R1.43 O=C(O)C(=O)NC1=CC=CC=C1 MCULE-2107757064 [1,1,0,0,0,0|1,0,1]=4 2470 B12R1.43 O=C(O)C(Br)CC1=CC=CC=C1 MCULE-1864489061 [1,1,0,0,0,0|0,0,0]=2 2471 B12R1.43 O=C(O)C(Br)CC1=CC=CC=C1 MCULE-5141593227 [1,1,0,0,0,0|0,0,0]=2 2472 B12R1.43 O=C(O)C(Br)C[N+]1=CC=CC=C1 MCULE-5162156323 [1,1,0,0,0,0|1,0,0]=3 2473 B12R1.43 O=C(O)C(Br)C[N+]1=CC=CC=C1 MCULE-5251609604 [1,1,0,0,0,0|1,0,0]=3 2474 B12R1.43 O=C(O)C(F)CC1=CC=CC=C1 MCULE-9166012619 [1,1,0,0,0,0|0,0,0]=2 2475 B12R1.43 O=C(O)C(O)CC1=CC=CC=C1 MCULE-8315491131 [1,1,0,0,0,0|0,0,0]=2 2476 B12R1.43 O=C(O)C(O)CC1=CC=CC=C1 MCULE-9508817950 [1,1,0,0,0,0|0,0,0]=2 2477 B12R1.43 O=C(O)C(O)CC1=CC=CN=C1 MCULE-6280644145 [1,1,0,0,0,0|1,0,0]=3 2478 B12R1.43 O=C(O)C(S)CC1=CC=CC=C1 MCULE-2786315780 [1,1,0,0,0,0|0,0,0]=2 2479 B12R1.43 O=C(O)[C@@H](Br)CC1=CC=CC=C1 MCULE-4327885480 [1,1,0,0,0,0|0,0,0]=2 2480 B12R1.43 O=C(O)[C@@H](Br)CC1=CC=CC=C1 MCULE-7060788630 [1,1,0,0,0,0|0,0,0]=2 2481 B12R1.43 O=C(O)[C@@H](Cl)CC1=CC=CC=C1 MCULE-1955124001 [1,1,0,0,0,0|0,0,0]=2 2482 B12R1.43 O=C(O)[C@@H](Cl)CC1=CC=CC=C1 MCULE-2054040205 [1,1,0,0,0,0|0,0,0]=2 2483 B12R1.43 O=C(O)[C@@H](O)CC1=CC=CC=C1 MCULE-1839486703 [1,1,0,0,0,0|0,0,0]=2 2484 B12R1.43 O=C(O)[C@@H](O)CC1=CC=CC=C1 MCULE-4919076158 [1,1,0,0,0,0|0,0,0]=2 2485 B12R1.43 O=C(O)[C@H](Br)CC1=CC=CC=C1 MCULE-7765977229 [1,1,0,0,0,0|0,0,0]=2 2486 B12R1.43 O=C(O)[C@H](Br)CC1=CC=CC=C1 MCULE-9087197160 [1,1,0,0,0,0|0,0,0]=2 2487 B12R1.43 O=C(O)[C@H](Cl)CC1=CC=CC=C1 MCULE-1353432482 [1,1,0,0,0,0|0,0,0]=2 2488 B12R1.43 O=C(O)[C@H](Cl)CC1=CC=CC=C1 MCULE-5962224015 [1,1,0,0,0,0|0,0,0]=2 2489 B12R1.43 O=C(O)[C@H](O)CC1=CC=CC=C1 MCULE-2910632779 [1,1,0,0,0,0|0,0,0]=2 2490 B12R1.43 O=C(O)[C@H](O)CC1=CC=CC=C1 MCULE-9829239357 [1,1,0,0,0,0|0,0,0]=2 2491 B12R1.43 O=C(O)[C@H](S)CC1=CC=CC=C1 MCULE-6360971092 [1,1,0,0,0,0|0,0,0]=2 2492 B12R1.43 O=C([O-])C(=O)CC1=CC=CC=C1 MCULE-2474116698 [1,1,0,0,0,0|0,0,2]=4 2493 B12R1.43 [C@@H](C)(NC1=CC=CN=C1)C(=O)O MCULE-1618208931 [1,1,0,0,0,0|2,0,0]=4 2494 B12R1.43 [C@H](N)(CC1=CC=CC=C1)C(=O)N MCULE-5599449655 [1,1,0,0,0,0|1,0,0]=3 2495 B12R1.107 C/C(=C\C(=O)O)/C1=CC=CC=C1 MCULE-7874888021 [1,1,0,0,0,0|0,0,2]=4 2496 B12R1.107 C=C(C)C[C@@H](N)C1=CC=CC=C1 MCULE-6104053205 [1,1,0,0,0,0|2,0,0]=4 2497 B12R1.107 C=C(C)C[C@@H](N)C1=CC=CC=C1 MCULE-6881905979 [1,1,0,0,0,0|2,0,0]=4 2498 B12R1.107 C=C(C)C[C@H](N)C1=CC=CC=C1 MCULE-6633658670 [1,1,0,0,0,0|2,0,0]=4 2499 B12R1.107 C=C(C)C[C@H](N)C1=CC=CC=C1 MCULE-9710674460 [1,1,0,0,0,0|2,0,0]=4 2500 B12R1.107 CC(=CC(=O)O)C1=CC=CC=C1 MCULE-4290555990 [1,1,0,0,0,0|0,0,2]=4 2501 B12R1.107 CC(=O)CC(=O)C1=CC=CC=C1 MCULE-5543155182 [1,1,0,0,0,0|1,0,1]=4 2502 B12R1.107 CC(=O)CC(C)C1=CC=CC=C1 MCULE-9238946189 [1,1,0,0,0,0|1,0,0]=3 2503 B12R1.107 CC(=O)CC(O)C1=CC=CC=N1 MCULE-4578524434 [1,1,0,0,0,0|2,0,0]=4 2504 B12R1.107 CC(=O)C[C@@H](O)C1=CC=[NH+]C=C1 MCULE-5834701488 [1,1,0,0,0,0|2,0,0]=4 2505 B12R1.107 CC(=O)C[C@@H](O)C1=CC=[NH+]C=C1 MCULE-9298145324 [1,1,0,0,0,0|2,0,0]=4 2506 B12R1.107 CC(=O)NC(C)C1=CC=CC=C1 MCULE-1517039596 [1,1,0,0,0,0|2,0,0]=4 2507 B12R1.107 CC(=O)NC(C)C1=CC=CC=C1 MCULE-7308870082 [1,1,0,0,0,0|2,0,0]=4 2508 B12R1.107 CC(=O)N[C@@H](C)C1=CC=CC=C1 MCULE-3728241344 [1,1,0,0,0,0|2,0,0]=4 2509 B12R1.107 CC(=O)N[C@@H](C)C1=CC=CC=C1 MCULE-9566820496 [1,1,0,0,0,0|2,0,0]=4 2510 B12R1.107 CC(=O)N[C@H](C)C1=CC=CC=C1 MCULE-3913313961 [1,1,0,0,0,0|2,0,0]=4 2511 B12R1.107 CC(=O)N[C@H](C)C1=CC=CC=C1 MCULE-4525565637 [1,1,0,0,0,0|2,0,0]=4 2512 B12R1.107 CC(=O)OC(C)C1=CC=CC=C1 MCULE-4422609619 [1,1,0,0,0,0|2,0,0]=4 2513 B12R1.107 CC(CC(=O)Cl)C1=CC=CC=C1 MCULE-4708189102 [1,1,0,0,0,0|1,0,0]=3 2514 B12R1.107 CC(CC(=O)N)C1=CC=CC=C1 MCULE-3754045547 [1,1,0,0,0,0|1,0,0]=3 2515 B12R1.107 CC(CC(=O)N)C1=CN=CC=C1 MCULE-9915486688 [1,1,0,0,0,0|2,0,0]=4 2516 B12R1.107 CC(CC(=O)N)C1=NC=CC=C1 MCULE-7939509598 [1,1,0,0,0,0|2,0,0]=4 2517 B12R1.107 CC(CC(=O)O)C1=CC=CC=C1 MCULE-1818982541 [1,1,0,0,0,0|0,0,0]=2 2518 B12R1.107 CC(CC(=O)O)C1=CC=CC=C1 MCULE-9130531300 [1,1,0,0,0,0|0,0,0]=2 2519 B12R1.107 CC(CC(=O)O)C1=CC=NC=C1 MCULE-1879755739 [1,1,0,0,0,0|1,0,0]=3 2520 B12R1.107 CC(CC(=O)O)C1=CC=NC=C1 MCULE-8728544232 [1,1,0,0,0,0|1,0,0]=3 2521 B12R1.107 CC(CC(=O)O)C1=CN=CC=C1 MCULE-4344627167 [1,1,0,0,0,0|1,0,0]=3 2522 B12R1.107 CC(CC(=O)O)C1=NC=CC=C1 MCULE-9337822764 [1,1,0,0,0,0|1,0,0]=3 2523 B12R1.107 CC(NC(=O)N)C1=CC=CC=C1 MCULE-8086419212 [1,1,0,0,0,0|2,0,0]=4 2524 B12R1.107 CC(OC(=O)Cl)C1=CC=CC=C1 MCULE-8877097978 [1,1,0,0,0,0|2,0,0]=4 2525 B12R1.107 CN(CC(=O)O)C1=CC=CC=C1 MCULE-4486543495 [1,1,0,0,0,0|1,0,0]=3 2526 B12R1.107 CN(CC(=O)O)C1=CC=CC=C1 MCULE-8724497404 [1,1,0,0,0,0|1,0,0]=3 2527 B12R1.107 CN(CC(=O)O)C1=CC=NC=C1 MCULE-7087808449 [1,1,0,0,0,0|2,0,0]=4 2528 B12R1.107 CN(CC(=O)O)C1=NC=CC=C1 MCULE-3489834774 [1,1,0,0,0,0|2,0,0]=4 2529 B12R1.107 CN(CC(=O)O)C1=NC=CC=C1 MCULE-4695582212 [1,1,0,0,0,0|2,0,0]=4 2530 B12R1.107 CS(=O)CC(N)C1=CC=CC=C1 MCULE-8811129743 [1,1,0,0,0,0|2,0,0]=4 2531 B12R1.107 C[C@@H](CC(=O)O)C1=CC=CC=C1 MCULE-6537602947 [1,1,0,0,0,0|0,0,0]=2 2532 B12R1.107 C[C@@H](NC(=O)N)C1=CC=CC=C1 MCULE-1375538673 [1,1,0,0,0,0|2,0,0]=4 2533 B12R1.107 C[C@@H](NC(=O)N)C1=CC=CC=C1 MCULE-2337945690 [1,1,0,0,0,0|2,0,0]=4 2534 B12R1.107 C[C@H](CC(=O)O)C1=CC=CC=C1 MCULE-1783067351 [1,1,0,0,0,0|0,0,0]=2 2535 B12R1.107 C[C@H](NC(=O)N)C1=CC=CC=C1 MCULE-3644769281 [1,1,0,0,0,0|2,0,0]=4 2536 B12R1.107 C[C@H](NC(=O)N)C1=CC=CC=C1 MCULE-4403427847 [1,1,0,0,0,0|2,0,0]=4 2537 B12R1.107 NC(=O)CC(=O)C1=CC=CC=C1 MCULE-9691688431 [1,1,0,0,0,0|1,0,1]=4 2538 B12R1.107 NC(=O)C[C@H](N)C1=NC=CC=C1 MCULE-2055508769 [1,1,0,0,0,0|2,0,0]=4 2539 B12R1.107 NC(CC(=O)O)C1=CC=CC=C1 MCULE-2945759933 [1,1,0,0,0,0|0,0,0]=2 2540 B12R1.107 NC(CC(=O)O)C1=CC=CC=C1 MCULE-3660219565 [1,1,0,0,0,0|0,0,0]=2 2541 B12R1.107 NC(CC(=O)O)C1=CC=CC=C1 MCULE-5669000935 [1,1,0,0,0,0|0,0,0]=2 2542 B12R1.107 NC(CC(=O)O)C1=CC=CC=C1 MCULE-6127429811 [1,1,0,0,0,0|0,0,0]=2 2543 B12R1.107 NC(CC(=O)O)C1=CC=NC=C1 MCULE-5271217908 [1,1,0,0,0,0|1,0,0]=3 2544 B12R1.107 NC(CC(=O)O)C1=CC=NC=C1 MCULE-8367527410 [1,1,0,0,0,0|1,0,0]=3 2545 B12R1.107 NC(CC(=O)O)C1=CN=CC=C1 MCULE-7701521233 [1,1,0,0,0,0|1,0,0]=3 2546 B12R1.107 NC(CC(=O)O)C1=CN=CN=C1 MCULE-3825595101 [1,1,0,0,0,0|2,0,0]=4 2547 B12R1.107 NC(CC(=O)O)C1=NC=CC=C1 MCULE-8197120685 [1,1,0,0,0,0|1,0,0]=3 2548 B12R1.107 NC(CC(=O)O)C1=NC=CC=C1 MCULE-8978093399 [1,1,0,0,0,0|1,0,0]=3 2549 B12R1.107 NN(CC(=O)O)C1=CC=CC=C1 MCULE-6961208756 [1,1,0,0,0,0|1,0,0]=3 2550 B12R1.107 N[C@@H](CC(=O)O)C1=CC=CC=C1 MCULE-2881987414 [1,1,0,0,0,0|0,0,0]=2 2551 B12R1.107 N[C@@H](CC(=O)O)C1=CC=CC=C1 MCULE-4499633586 [1,1,0,0,0,0|0,0,0]=2 2552 B12R1.107 N[C@@H](CC(=O)O)C1=CC=CC=C1 MCULE-8154475618 [1,1,0,0,0,0|0,0,0]=2 2553 B12R1.107 N[C@@H](CC(=O)O)C1=CC=CC=C1 MCULE-9668897685 [1,1,0,0,0,0|0,0,0]=2 2554 B12R1.107 N[C@@H](CC(=O)O)C1=CC=NC=C1 MCULE-8008871735 [1,1,0,0,0,0|1,0,0]=3 2555 B12R1.107 N[C@@H](CC(=O)O)C1=CN=CC=C1 MCULE-1818764556 [1,1,0,0,0,0|1,0,0]=3 2556 B12R1.107 N[C@@H](CC(=O)O)C1=CN=CC=C1 MCULE-7993134271 [1,1,0,0,0,0|1,0,0]=3 2557 B12R1.107 N[C@@H](CC(=O)O)C1=CN=CN=C1 MCULE-4442420704 [1,1,0,0,0,0|2,0,0]=4 2558 B12R1.107 N[C@@H](CC(=O)O)C1=CN=CN=C1 MCULE-7438862396 [1,1,0,0,0,0|2,0,0]=4 2559 B12R1.107 N[C@@H](CC(=O)O)C1=NC=CC=C1 MCULE-6104330998 [1,1,0,0,0,0|1,0,0]=3 2560 B12R1.107 N[C@H](CC(=O)O)C1=CC=CC=C1 MCULE-1696975646 [1,1,0,0,0,0|0,0,0]=2 2561 B12R1.107 N[C@H](CC(=O)O)C1=CC=CC=C1 MCULE-4246457220 [1,1,0,0,0,0|0,0,0]=2 2562 B12R1.107 N[C@H](CC(=O)O)C1=CC=CC=C1 MCULE-6312772741 [1,1,0,0,0,0|0,0,0]=2 2563 B12R1.107 N[C@H](CC(=O)O)C1=CC=CC=C1 MCULE-9809220026 [1,1,0,0,0,0|0,0,0]=2 2564 B12R1.107 N[C@H](CC(=O)O)C1=CC=NC=C1 MCULE-3085105624 [1,1,0,0,0,0|1,0,0]=3 2565 B12R1.107 N[C@H](CC(=O)O)C1=CN=CC=C1 MCULE-5358734090 [1,1,0,0,0,0|1,0,0]=3 2566 B12R1.107 N[C@H](CC(=O)O)C1=CN=CC=C1 MCULE-8892846784 [1,1,0,0,0,0|1,0,0]=3 2567 B12R1.107 N[C@H](CC(=O)O)C1=CN=CN=C1 MCULE-4414160773 [1,1,0,0,0,0|2,0,0]=4 2568 B12R1.107 N[C@H](CC(=O)O)C1=CN=CN=C1 MCULE-6487106562 [1,1,0,0,0,0|2,0,0]=4 2569 B12R1.107 N[C@H](CC(=O)O)C1=NC=CC=C1 MCULE-4188239090 [1,1,0,0,0,0|1,0,0]=3 2570 B12R1.107 N[C@H](CC(=O)O)C1=NC=CC=C1 MCULE-4969866976 [1,1,0,0,0,0|1,0,0]=3 2571 B12R1.107 N[C@H](CC(=O)O)C1=NC=CC=C1 MCULE-5722712432 [1,1,0,0,0,0|1,0,0]=3 2572 B12R1.107 N[C@H](CC(=O)O)C1=NC=CC=C1 MCULE-8127179594 [1,1,0,0,0,0|1,0,0]=3 2573 B12R1.107 O=C(O)CC(=O)C1=CC=CC=C1 MCULE-6221631058 [1,1,0,0,0,0|0,0,1]=3 2574 B12R1.107 O=C(O)CC(Br)C1=CC=CC=C1 MCULE-7295763261 [1,1,0,0,0,0|0,0,0]=2 2575 B12R1.107 O=C(O)CC(O)C1=CC=CC=C1 MCULE-3174091335 [1,1,0,0,0,0|0,0,0]=2 2576 B12R1.107 O=C(O)C[C@@H](O)C1=CC=CC=C1 MCULE-8184353492 [1,1,0,0,0,0|0,0,0]=2 2577 B12R1.107 O=C(O)C[C@H](O)C1=CC=CC=C1 MCULE-5469995618 [1,1,0,0,0,0|0,0,0]=2 2578 B12R1.107 O=C([O-])CC(=O)C1=CC=CC=C1 MCULE-2660128967 [1,1,0,0,0,0|0,0,2]=4 2579 B12R1.107 O=N(=O)CC(O)C1=CC=CC=C1 MCULE-4840150320 [1,1,0,0,0,0|1,0,1]=4 2580 B12R1.107 [C@@H](C)(CC(=O)O)C1=CC=CC=C1 MCULE-2554692536 [1,1,0,0,0,0|0,0,0]=2 2581 B12R1.107 [NH+]1=CC=CC=C1C(O)CC(=O)C MCULE-4067045723 [1,1,0,0,0,0|2,0,0]=4 2582 B12R1.125 C=C(Br)CCC1=CC=CC=C1C MCULE-8948786636 [1,1,0,0,0,0|2,0,0]=4 2583 B12R1.125 C=C(Br)CCC1=CC=CC=C1Cl MCULE-4206978882 [1,1,0,0,0,0|2,0,0]=4 2584 B12R1.125 C=C(Br)CCC1=CC=CC=C1F MCULE-1829414348 [1,1,0,0,0,0|2,0,0]=4 2585 B12R1.125 C=C(C)CCC1=C(C=CC=C1)Br MCULE-8843013552 [1,1,0,0,0,0|2,0,0]=4 2586 B12R1.125 C=C(C)CCC1=CC=CC=C1C MCULE-2436819965 [1,1,0,0,0,0|2,0,0]=4 2587 B12R1.125 C=C(C)CCC1=CC=CC=C1Cl MCULE-8517504422 [1,1,0,0,0,0|2,0,0]=4 2588 B12R1.125 C=C(C)CCC1=CC=CC=C1F MCULE-9740922546 [1,1,0,0,0,0|2,0,0]=4 2589 B12R1.125 C=C(Cl)CCC1=CC=CC=C1C MCULE-3281714771 [1,1,0,0,0,0|2,0,0]=4 2590 B12R1.125 C=C(Cl)CCC1=CC=CC=C1Cl MCULE-6417918605 [1,1,0,0,0,0|2,0,0]=4 2591 B12R1.125 C=C(Cl)CCC1=CC=CC=C1F MCULE-2789632372 [1,1,0,0,0,0|2,0,0]=4 2592 B12R1.125 CC(=O)CCC1=C(C=CC=C1)F MCULE-3742205438 [1,1,0,0,0,0|1,0,0]=3 2593 B12R1.125 CC(=O)CCC1=CC=CC=C1Cl MCULE-4579663497 [1,1,0,0,0,0|1,0,0]=3 2594 B12R1.125 CC(=O)CCC1=CC=CC=[N+]1C MCULE-3656536333 [1,1,0,0,0,0|2,0,0]=4 2595 B12R1.125 CC(=O)CCC1=CC=CC=[N+]1C MCULE-7419011539 [1,1,0,0,0,0|2,0,0]=4 2596 B12R1.125 CC(=O)COC1=C(C=CC=C1)Br MCULE-1661012462 [1,1,0,0,0,0|2,0,0]=4 2597 B12R1.125 CC(=O)COC1=C(C=CC=C1)Cl MCULE-9411965008 [1,1,0,0,0,0|2,0,0]=4 2598 B12R1.125 CC(=O)NCC1=C(C=CC=C1)Br MCULE-9227086288 [1,1,0,0,0,0|2,0,0]=4 2599 B12R1.125 CC(=O)NCC1=C(C=CC=C1)Cl MCULE-3269066882 [1,1,0,0,0,0|2,0,0]=4 2600 B12R1.125 CC(=O)NCC1=CC=CC=C1O MCULE-4833566471 [1,1,0,0,0,0|2,0,0]=4 2601 B12R1.125 CC(=O)OCC1=C(C=CC=C1)Br MCULE-8061911311 [1,1,0,0,0,0|2,0,0]=4 2602 B12R1.125 CC(=O)SCC1=CC=CC=C1Cl MCULE-3653281165 [1,1,0,0,0,0|2,0,0]=4 2603 B12R1.125 CC(O)CCC1=CC=CC=C1F MCULE-1346776751 [1,1,0,0,0,0|1,0,1]=4 2604 B12R1.125 CC1=C(C=CC=C1)C#CC(=O)O MCULE-2914054144 [1,1,0,0,0,0|0,0,2]=4 2605 B12R1.125 CC1=C(C=CC=C1)CCC(=O)O MCULE-1863841147 [1,1,0,0,0,0|0,0,0]=2 2606 B12R1.125 CC1=C(C=CC=C1)COC(=O)Cl MCULE-8254375691 [1,1,0,0,0,0|2,0,0]=4 2607 B12R1.125 CC1=C(C=CC=C1)OCC(=O)O MCULE-7437954656 [1,1,0,0,0,0|1,0,0]=3 2608 B12R1.125 CC1=C(C=CC=C1)SCC(=O)O MCULE-3348543127 [1,1,0,0,0,0|1,0,0]=3 2609 B12R1.125 CC1=C(C=CN=C1)CCC(=O)O MCULE-7877508148 [1,1,0,0,0,0|1,0,0]=3 2610 B12R1.125 CC1=C(C=NC=C1)CCC(=O)O MCULE-5337466065 [1,1,0,0,0,0|1,0,0]=3 2611 B12R1.125 CC1=C(N=CC=C1)CCC(=O)O MCULE-3173547421 [1,1,0,0,0,0|1,0,0]=3 2612 B12R1.125 CC1=CC=CC=C1/C=C/C(=O)O MCULE-4568393226 [1,1,0,0,0,0|0,0,2]=4 2613 B12R1.125 CC1=CC=CC=C1C=CC(=O)O MCULE-7568109044 [1,1,0,0,0,0|0,0,2]=4 2614 B12R1.125 CC1=CC=CC=C1CCC(=O)Cl MCULE-5434283461 [1,1,0,0,0,0|1,0,0]=3 2615 B12R1.125 CC1=CC=CC=C1NCC(=O)O MCULE-9934026722 [1,1,0,0,0,0|1,0,0]=3 2616 B12R1.125 CC1=CC=CC=C1OCC(=O)Cl MCULE-5287648365 [1,1,0,0,0,0|2,0,0]=4 2617 B12R1.125 CC1=CC=CC=C1OCC(=O)N MCULE-7049614745 [1,1,0,0,0,0|2,0,0]=4 2618 B12R1.125 CC1=NC=CC=C1CCC(=O)O MCULE-3519127515 [1,1,0,0,0,0|1,0,0]=3 2619 B12R1.125 CC1=NC=CC=C1CCC(=O)O MCULE-7810332925 [1,1,0,0,0,0|1,0,0]=3 2620 B12R1.125 NC(=O)CCC1=C(C=CC=C1)F MCULE-3464151618 [1,1,0,0,0,0|1,0,0]=3 2621 B12R1.125 NC(=O)CCC1=C(C=CC=C1)N MCULE-7163988486 [1,1,0,0,0,0|1,0,0]=3 2622 B12R1.125 NC(=O)CCC1=CC=CC=C1Cl MCULE-7359271020 [1,1,0,0,0,0|1,0,0]=3 2623 B12R1.125 NC(=O)CCC1=CC=CC=C1O MCULE-6563350140 [1,1,0,0,0,0|1,0,0]=3 2624 B12R1.125 NC(=O)CCC1=CC=NC=C1F MCULE-1562673480 [1,1,0,0,0,0|2,0,0]=4 2625 B12R1.125 NC(=O)COC1=C(C=CC=C1)Br MCULE-6843547928 [1,1,0,0,0,0|2,0,0]=4 2626 B12R1.125 NC(=O)COC1=C(C=CC=C1)I MCULE-2786204561 [1,1,0,0,0,0|2,0,0]=4 2627 B12R1.125 NC(=O)COC1=C(C=CC=C1)O MCULE-2154592280 [1,1,0,0,0,0|2,0,0]=4 2628 B12R1.125 NC(=O)COC1=CC=CC=C1Cl MCULE-6372008313 [1,1,0,0,0,0|2,0,0]=4 2629 B12R1.125 NC(=O)COC1=CC=CC=C1F MCULE-8187026469 [1,1,0,0,0,0|2,0,0]=4 2630 B12R1.125 NC(=O)CSC1=CC=CC=C1N MCULE-8446030479 [1,1,0,0,0,0|2,0,0]=4 2631 B12R1.125 NC(=O)NCC1=C(C=CC=C1)Cl MCULE-7305737655 [1,1,0,0,0,0|2,0,0]=4 2632 B12R1.125 NC(=O)NCC1=C(C=CC=C1)F MCULE-8258130726 [1,1,0,0,0,0|2,0,0]=4 2633 B12R1.125 NC1=C(C=CC=C1)C=CC(=O)O MCULE-1813623710 [1,1,0,0,0,0|0,0,2]=4 2634 B12R1.125 NC1=C(C=CC=C1)SCC(=O)O MCULE-2684589425 [1,1,0,0,0,0|1,0,0]=3 2635 B12R1.125 O=C(Cl)CCC1=C(C=CC=C1)Cl MCULE-6612912792 [1,1,0,0,0,0|1,0,0]=3 2636 B12R1.125 O=C(Cl)CCC1=CC=CC=C1F MCULE-6200765385 [1,1,0,0,0,0|1,0,0]=3 2637 B12R1.125 O=C(Cl)COC1=C(C=CC=C1)Cl MCULE-7639131412 [1,1,0,0,0,0|2,0,0]=4 2638 B12R1.125 O=C(Cl)COC1=CC=CC=C1Br MCULE-2315611440 [1,1,0,0,0,0|2,0,0]=4 2639 B12R1.125 O=C(Cl)COC1=CC=CC=C1F MCULE-5828946736 [1,1,0,0,0,0|2,0,0]=4 2640 B12R1.125 O=C(Cl)OCC1=C(C=CC=C1)F MCULE-4555584500 [1,1,0,0,0,0|2,0,0]=4 2641 B12R1.125 O=C(Cl)OCC1=CC=CC=C1Cl MCULE-6877605611 [1,1,0,0,0,0|2,0,0]=4 2642 B12R1.125 O=C(O)/C=C/C1=C(C=CC=C1)Br MCULE-9715214740 [1,1,0,0,0,0|0,0,2]=4 2643 B12R1.125 O=C(O)/C=C/C1=C(C=CC=C1)F MCULE-5550079587 [1,1,0,0,0,0|0,0,2]=4 2644 B12R1.125 O=C(O)/C=C/C1=C(C=CC=C1)O MCULE-5451854573 [1,1,0,0,0,0|0,0,2]=4 2645 B12R1.125 O=C(O)/C=C/C1=CC=CC=C1Cl MCULE-6586897772 [1,1,0,0,0,0|0,0,2]=4 2646 B12R1.125 O=C(O)/C=C/C1=CC=CC=C1I MCULE-4367628203 [1,1,0,0,0,0|0,0,2]=4 2647 B12R1.125 O=C(O)C#CC1=CC=CC=C1Cl MCULE-3348013518 [1,1,0,0,0,0|0,0,2]=4 2648 B12R1.125 O=C(O)C#CC1=CC=CC=C1F MCULE-2294922933 [1,1,0,0,0,0|0,0,2]=4 2649 B12R1.125 O=C(O)C=CC1=C(C=CC=C1)Br MCULE-1992481262 [1,1,0,0,0,0|0,0,2]=4 2650 B12R1.125 O=C(O)C=CC1=C(C=CC=C1)F MCULE-2337664175 [1,1,0,0,0,0|0,0,2]=4 2651 B12R1.125 O=C(O)C=CC1=C(C=CC=C1)I MCULE-8228854548 [1,1,0,0,0,0|0,0,2]=4 2652 B12R1.125 O=C(O)C=CC1=C(C=CC=C1)O MCULE-7485332494 [1,1,0,0,0,0|0,0,2]=4 2653 B12R1.125 O=C(O)C=CC1=CC=CC=C1Cl MCULE-7865645572 [1,1,0,0,0,0|0,0,2]=4 2654 B12R1.125 O=C(O)CCC1=C(C=CC=C1)Br MCULE-8663170653 [1,1,0,0,0,0|0,0,0]=2 2655 B12R1.125 O=C(O)CCC1=C(C=CC=C1)Cl MCULE-2881103060 [1,1,0,0,0,0|0,0,0]=2 2656 B12R1.125 O=C(O)CCC1=C(C=CC=C1)F MCULE-6298600610 [1,1,0,0,0,0|0,0,0]=2 2657 B12R1.125 O=C(O)CCC1=C(C=CC=C1)O MCULE-1055140821 [1,1,0,0,0,0|0,0,0]=2 2658 B12R1.125 O=C(O)CCC1=C(C=NC=C1)Cl MCULE-2478028837 [1,1,0,0,0,0|1,0,0]=3 2659 B12R1.125 O=C(O)CCC1=C(C=NC=C1)F MCULE-6252605434 [1,1,0,0,0,0|1,0,0]=3 2660 B12R1.125 O=C(O)CCC1=C(N=CC=C1)Cl MCULE-4820330692 [1,1,0,0,0,0|1,0,0]=3 2661 B12R1.125 O=C(O)CCC1=C(N=CC=C1)F MCULE-6425720730 [1,1,0,0,0,0|1,0,0]=3 2662 B12R1.125 O=C(O)CCC1=CC=CC=C1I MCULE-2650420493 [1,1,0,0,0,0|0,0,0]=2 2663 B12R1.125 O=C(O)CCC1=CC=CN=C1Br MCULE-2674571642 [1,1,0,0,0,0|1,0,0]=3 2664 B12R1.125 O=C(O)CCC1=CN=CN=C1O MCULE-3946323716 [1,1,0,0,0,0|2,0,0]=4 2665 B12R1.125 O=C(O)CCC1=NC=CC=C1Br MCULE-1356656825 [1,1,0,0,0,0|1,0,0]=3 2666 B12R1.125 O=C(O)CCN1C=CC=CC1=O MCULE-4101713123 [1,1,0,0,0,0|1,0,0]=3 2667 B12R1.125 O=C(O)CCN1C=CC=CC1=O MCULE-5586331788 [1,1,0,0,0,0|1,0,0]=3 2668 B12R1.125 O=C(O)CCN1C=NC=CC1=O MCULE-1041979899 [1,1,0,0,0,0|2,0,0]=4 2669 B12R1.125 O=C(O)CNC1=C(C=CC=C1)Br MCULE-2469324501 [1,1,0,0,0,0|1,0,0]=3 2670 B12R1.125 O=C(O)CNC1=C(C=CC=C1)Cl MCULE-3724211762 [1,1,0,0,0,0|1,0,0]=3 2671 B12R1.125 O=C(O)CNC1=C(C=CC=C1)F MCULE-7862978402 [1,1,0,0,0,0|1,0,0]=3 2672 B12R1.125 O=C(O)COC1=C(C=CC=C1)Br MCULE-6691121226 [1,1,0,0,0,0|1,0,0]=3 2673 B12R1.125 O=C(O)COC1=C(C=CC=C1)I MCULE-8125182578 [1,1,0,0,0,0|1,0,0]=3 2674 B12R1.125 O=C(O)COC1=C(C=CC=N1)F MCULE-5006742111 [1,1,0,0,0,0|2,0,0]=4 2675 B12R1.125 O=C(O)COC1=C(N=CC=C1)Cl MCULE-7753759406 [1,1,0,0,0,0|2,0,0]=4 2676 B12R1.125 O=C(O)COC1=CC=CC=C1Cl MCULE-3851170810 [1,1,0,0,0,0|1,0,0]=3 2677 B12R1.125 O=C(O)COC1=CC=CC=C1F MCULE-6414470288 [1,1,0,0,0,0|1,0,0]=3 2678 B12R1.125 O=C(O)COC1=CC=CC=C1O MCULE-3539626165 [1,1,0,0,0,0|1,0,0]=3 2679 B12R1.125 O=C(O)COC1=CC=CN=C1Br MCULE-1340033620 [1,1,0,0,0,0|2,0,0]=4 2680 B12R1.125 O=C(O)CSC1=C(C=CC=C1)Br MCULE-6245797989 [1,1,0,0,0,0|1,0,0]=3 2681 B12R1.125 O=C(O)CSC1=C(C=CC=C1)Cl MCULE-8471018138 [1,1,0,0,0,0|1,0,0]=3 2682 B12R1.125 O=C(O)CSC1=C(C=CC=C1)F MCULE-6358016234 [1,1,0,0,0,0|1,0,0]=3 2683 B12R1.125 O=C(O)CSC1=C(C=CC=C1)O MCULE-9851363930 [1,1,0,0,0,0|1,0,0]=3 2684 B12R1.125 O=C(O)CSC1=C(N=CC=C1)Cl MCULE-5539998802 [1,1,0,0,0,0|2,0,0]=4 2685 B12R1.125 O=C(O)CSC1=CC=CC=[N+]1[O-] MCULE-7774881227 [1,1,0,0,0,0|2,0,0]=4 2686 B12R1.125 O=N(=O)CCC1=C(C=CC=C1)Cl MCULE-9266355197 [1,1,0,0,0,0|1,0,1]=4 2687 B12R1.226 C=C(Br)CCC1=CC=CC(=C1)Br MCULE-6145483367 [1,1,0,0,0,0|2,0,0]=4 2688 B12R1.226 C=C(Br)CCC1=CC=CC(=C1)C MCULE-9352855416 [1,1,0,0,0,0|2,0,0]=4 2689 B12R1.226 C=C(Br)CCC1=CC=CC(=C1)Cl MCULE-5544071865 [1,1,0,0,0,0|2,0,0]=4 2690 B12R1.226 C=C(Br)CCC1=CC=CC(=C1)F MCULE-2253897320 [1,1,0,0,0,0|2,0,0]=4 2691 B12R1.226 C=C(C)CCC1=CC=CC(=C1)Br MCULE-8291028195 [1,1,0,0,0,0|2,0,0]=4 2692 B12R1.226 C=C(C)CCC1=CC=CC(=C1)C MCULE-8368790541 [1,1,0,0,0,0|2,0,0]=4 2693 B12R1.226 C=C(C)CCC1=CC=CC(=C1)Cl MCULE-4308144438 [1,1,0,0,0,0|2,0,0]=4 2694 B12R1.226 C=C(C)CCC1=CC=CC(=C1)F MCULE-6908507987 [1,1,0,0,0,0|2,0,0]=4 2695 B12R1.226 C=C(Cl)CCC1=CC=CC(=C1)Br MCULE-8761708216 [1,1,0,0,0,0|2,0,0]=4 2696 B12R1.226 C=C(Cl)CCC1=CC=CC(=C1)C MCULE-5044258761 [1,1,0,0,0,0|2,0,0]=4 2697 B12R1.226 C=C(Cl)CCC1=CC=CC(=C1)Cl MCULE-2746000412 [1,1,0,0,0,0|2,0,0]=4 2698 B12R1.226 C=C(Cl)CCC1=CC=CC(=C1)F MCULE-7707009414 [1,1,0,0,0,0|2,0,0]=4 2699 B12R1.226 CC(=O)CCC1=CC(=CC=C1)Br MCULE-6542929800 [1,1,0,0,0,0|1,0,0]=3 2700 B12R1.226 CC(=O)CCC1=CC(=CC=C1)C MCULE-3521864248 [1,1,0,0,0,0|1,0,0]=3 2701 B12R1.226 CC(=O)CCC1=CC(=CC=C1)Cl MCULE-2707623461 [1,1,0,0,0,0|1,0,0]=3 2702 B12R1.226 CC(=O)CCC1=CC(=CC=C1)F MCULE-5772196572 [1,1,0,0,0,0|1,0,0]=3 2703 B12R1.226 CC(=O)COC1=CC=CC(=C1)Br MCULE-6070183225 [1,1,0,0,0,0|2,0,0]=4 2704 B12R1.226 CC(=O)COC1=CC=CC(=C1)Cl MCULE-9740762730 [1,1,0,0,0,0|2,0,0]=4 2705 B12R1.226 CC(=O)NCC1=CC(=CC=C1)Br MCULE-1264689257 [1,1,0,0,0,0|2,0,0]=4 2706 B12R1.226 CC(=O)NCC1=CC(=CC=C1)Cl MCULE-7152116575 [1,1,0,0,0,0|2,0,0]=4 2707 B12R1.226 CC(=O)NCC1=CC(=CC=C1)N MCULE-6571557011 [1,1,0,0,0,0|2,0,0]=4 2708 B12R1.226 CC(=O)OCC1=CC(=CC=C1)Br MCULE-4822291356 [1,1,0,0,0,0|2,0,0]=4 2709 B12R1.226 CC(=O)OCC1=CC(=CC=C1)F MCULE-7638715445 [1,1,0,0,0,0|2,0,0]=4 2710 B12R1.226 CC(=O)SCC1=CC=CC(=C1)I MCULE-7492884889 [1,1,0,0,0,0|2,0,0]=4 2711 B12R1.226 CC(O)CCC1=CC(=CC=C1)O MCULE-3666157410 [1,1,0,0,0,0|1,0,1]=4 2712 B12R1.226 CC1=CC(=CC=C1)C#CC(=O)O MCULE-9892332522 [1,1,0,0,0,0|0,0,2]=4 2713 B12R1.226 CC1=CC(=CC=C1)CCC(=O)O MCULE-1135918013 [1,1,0,0,0,0|0,0,0]=2 2714 B12R1.226 CC1=CC(=CC=C1)NCC(=O)O MCULE-5930632711 [1,1,0,0,0,0|1,0,0]=3 2715 B12R1.226 CC1=CC(=CC=C1)SCC(=O)O MCULE-3532314065 [1,1,0,0,0,0|1,0,0]=3 2716 B12R1.226 CC1=CC(=CN=C1)CCC(=O)O MCULE-2635499592 [1,1,0,0,0,0|1,0,0]=3 2717 B12R1.226 CC1=CC=CC(=C1)/C=C/C(=O)O MCULE-8374932634 [1,1,0,0,0,0|0,0,2]=4 2718 B12R1.226 CC1=CC=CC(=C1)C=CC(=O)O MCULE-3959203742 [1,1,0,0,0,0|0,0,2]=4 2719 B12R1.226 CC1=CC=CC(=C1)OCC(=O)Cl MCULE-2151338569 [1,1,0,0,0,0|2,0,0]=4 2720 B12R1.226 CC1=CC=CC(=C1)OCC(=O)N MCULE-5811350103 [1,1,0,0,0,0|2,0,0]=4 2721 B12R1.226 CC1=CC=CC(=C1)OCC(=O)O MCULE-4819867371 [1,1,0,0,0,0|1,0,0]=3 2722 B12R1.226 CC1=CC=NC(=C1)CCC(=O)O MCULE-3968146261 [1,1,0,0,0,0|1,0,0]=3 2723 B12R1.226 CC1=NC(=CC=C1)CCC(=O)O MCULE-4154819422 [1,1,0,0,0,0|1,0,0]=3 2724 B12R1.226 CC1=NC(=CC=N1)CCC(=O)O MCULE-2101570080 [1,1,0,0,0,0|2,0,0]=4 2725 B12R1.226 CC1=NC=CC(=C1)CCC(=O)O MCULE-2315188887 [1,1,0,0,0,0|1,0,0]=3 2726 B12R1.226 NC(=O)CCC1=CC(=CC=C1)Br MCULE-4306965044 [1,1,0,0,0,0|1,0,0]=3 2727 B12R1.226 NC(=O)CNC1=CC(=CC=C1)N MCULE-1480169269 [1,1,0,0,0,0|2,0,0]=4 2728 B12R1.226 NC(=O)COC1=CC(=CC=C1)N MCULE-2900381533 [1,1,0,0,0,0|2,0,0]=4 2729 B12R1.226 NC(=O)COC1=CC(=CC=C1)O MCULE-8746010774 [1,1,0,0,0,0|2,0,0]=4 2730 B12R1.226 NC(=O)COC1=CC=CC(=C1)Br MCULE-2708015846 [1,1,0,0,0,0|2,0,0]=4 2731 B12R1.226 NC(=O)COC1=CC=CC(=C1)Cl MCULE-6543180781 [1,1,0,0,0,0|2,0,0]=4 2732 B12R1.226 NC(=O)NCC1=CC(=CC=C1)F MCULE-1971307249 [1,1,0,0,0,0|2,0,0]=4 2733 B12R1.226 NC(=O)NCC1=CC=CC(=C1)Br MCULE-1774177997 [1,1,0,0,0,0|2,0,0]=4 2734 B12R1.226 NC(=O)NCC1=CC=CC(=C1)Cl MCULE-6966740480 [1,1,0,0,0,0|2,0,0]=4 2735 B12R1.226 NC(=O)NCC1=CC=CC(=C1)I MCULE-7873410427 [1,1,0,0,0,0|2,0,0]=4 2736 B12R1.226 NC1=CC(=CC=C1)/C=C/C(=O)O MCULE-7167283449 [1,1,0,0,0,0|0,0,2]=4 2737 B12R1.226 NC1=CC(=CC=C1)C=CC(=O)O MCULE-5453082320 [1,1,0,0,0,0|0,0,2]=4 2738 B12R1.226 NC1=CC(=CC=C1)CCC(=O)O MCULE-7356050025 [1,1,0,0,0,0|0,0,0]=2 2739 B12R1.226 NC1=CC(=CC=C1)OCC(=O)O MCULE-2485459917 [1,1,0,0,0,0|1,0,0]=3 2740 B12R1.226 NC1=CC=CC(=C1)CCC(=O)O MCULE-4812854870 [1,1,0,0,0,0|0,0,0]=2 2741 B12R1.226 NC1=CC=CC(=C1)CCC(=O)[O-] MCULE-7775985988 [1,1,0,0,0,0|0,0,1]=3 2742 B12R1.226 NC1=NC(=CC=C1)CCC(=O)O MCULE-4208257532 [1,1,0,0,0,0|1,0,0]=3 2743 B12R1.226 NC1=NC=CC(=C1)CCC(=O)O MCULE-1236038184 [1,1,0,0,0,0|1,0,0]=3 2744 B12R1.226 O=C(Cl)CCC1=CC=CC(=C1)F MCULE-9631550886 [1,1,0,0,0,0|1,0,0]=3 2745 B12R1.226 O=C(Cl)COC1=CC(=CC=C1)Cl MCULE-7835137479 [1,1,0,0,0,0|2,0,0]=4 2746 B12R1.226 O=C(Cl)COC1=CC=CC(=C1)Br MCULE-3834796286 [1,1,0,0,0,0|2,0,0]=4 2747 B12R1.226 O=C(Cl)COC1=CC=CC(=C1)F MCULE-5915351589 [1,1,0,0,0,0|2,0,0]=4 2748 B12R1.226 O=C(Cl)OCC1=CC(=CC=C1)Cl MCULE-7723287716 [1,1,0,0,0,0|2,0,0]=4 2749 B12R1.226 O=C(O)/C=C/C1=CC(=CC=C1)Cl MCULE-1720842356 [1,1,0,0,0,0|0,0,2]=4 2750 B12R1.226 O=C(O)/C=C/C1=CC(=CC=C1)F MCULE-2603258292 [1,1,0,0,0,0|0,0,2]=4 2751 B12R1.226 O=C(O)/C=C/C1=CC(=CC=C1)I MCULE-9847298098 [1,1,0,0,0,0|0,0,2]=4 2752 B12R1.226 O=C(O)/C=C/C1=CC(=CC=C1)O MCULE-5006038728 [1,1,0,0,0,0|0,0,2]=4 2753 B12R1.226 O=C(O)/C=C/C1=CC=CC(=C1)Br MCULE-4180809927 [1,1,0,0,0,0|0,0,2]=4 2754 B12R1.226 O=C(O)C#CC1=CC(=CC=C1)Br MCULE-1979469603 [1,1,0,0,0,0|0,0,2]=4 2755 B12R1.226 O=C(O)C#CC1=CC(=CC=C1)Cl MCULE-8610286601 [1,1,0,0,0,0|0,0,2]=4 2756 B12R1.226 O=C(O)C#CC1=CC(=CC=C1)F MCULE-2901902642 [1,1,0,0,0,0|0,0,2]=4 2757 B12R1.226 O=C(O)C#CC1=CC(=CC=C1)O MCULE-4469582708 [1,1,0,0,0,0|0,0,2]=4 2758 B12R1.226 O=C(O)C=CC1=CC(=CC=C1)Cl MCULE-5483586899 [1,1,0,0,0,0|0,0,2]=4 2759 B12R1.226 O=C(O)C=CC1=CC(=CC=C1)I MCULE-7006843197 [1,1,0,0,0,0|0,0,2]=4 2760 B12R1.226 O=C(O)C=CC1=CC(=CC=C1)O MCULE-2569094851 [1,1,0,0,0,0|0,0,2]=4 2761 B12R1.226 O=C(O)C=CC1=CC=CC(=C1)Br MCULE-1630202729 [1,1,0,0,0,0|0,0,2]=4 2762 B12R1.226 O=C(O)C=CC1=CC=CC(=C1)F MCULE-6918071243 [1,1,0,0,0,0|0,0,2]=4 2763 B12R1.226 O=C(O)CCC1=CC(=CC=C1)Br MCULE-4003740082 [1,1,0,0,0,0|0,0,0]=2 2764 B12R1.226 O=C(O)CCC1=CC(=CC=C1)Cl MCULE-9048428251 [1,1,0,0,0,0|0,0,0]=2 2765 B12R1.226 O=C(O)CCC1=CC(=CC=C1)F MCULE-7735397189 [1,1,0,0,0,0|0,0,0]=2 2766 B12R1.226 O=C(O)CCC1=CC(=CN=C1)Br MCULE-6729572879 [1,1,0,0,0,0|1,0,0]=3 2767 B12R1.226 O=C(O)CCC1=CC(=CN=C1)F MCULE-3377468418 [1,1,0,0,0,0|1,0,0]=3 2768 B12R1.226 O=C(O)CCC1=CC(=CN=C1)O MCULE-3919717539 [1,1,0,0,0,0|1,0,0]=3 2769 B12R1.226 O=C(O)CCC1=CC=CC(=C1)I MCULE-6646964002 [1,1,0,0,0,0|0,0,0]=2 2770 B12R1.226 O=C(O)CCC1=CC=CC(=C1)O MCULE-1658802071 [1,1,0,0,0,0|0,0,0]=2 2771 B12R1.226 O=C(O)CCC1=NC=CC(=C1)F MCULE-2169921217 [1,1,0,0,0,0|1,0,0]=3 2772 B12R1.226 O=C(O)CNC1=CC(=CC=C1)Br MCULE-2611691189 [1,1,0,0,0,0|1,0,0]=3 2773 B12R1.226 O=C(O)CNC1=CC(=CC=C1)Cl MCULE-2547382165 [1,1,0,0,0,0|1,0,0]=3 2774 B12R1.226 O=C(O)CNC1=CC(=CC=C1)Cl MCULE-8758239278 [1,1,0,0,0,0|1,0,0]=3 2775 B12R1.226 O=C(O)CNC1=CC(=CC=C1)F MCULE-5946551254 [1,1,0,0,0,0|1,0,0]=3 2776 B12R1.226 O=C(O)COC1=CC(=CC=C1)Cl MCULE-4334617880 [1,1,0,0,0,0|1,0,0]=3 2777 B12R1.226 O=C(O)COC1=CC(=CC=C1)F MCULE-1373769050 [1,1,0,0,0,0|1,0,0]=3 2778 B12R1.226 O=C(O)COC1=CC(=CC=C1)I MCULE-3501566853 [1,1,0,0,0,0|1,0,0]=3 2779 B12R1.226 O=C(O)COC1=CC(=CC=N1)Cl MCULE-7424672060 [1,1,0,0,0,0|2,0,0]=4 2780 B12R1.226 O=C(O)COC1=CC(=CN=C1)Br MCULE-6809951685 [1,1,0,0,0,0|2,0,0]=4 2781 B12R1.226 O=C(O)COC1=CC=CC(=C1)Br MCULE-8990205761 [1,1,0,0,0,0|1,0,0]=3 2782 B12R1.226 O=C(O)COC1=CC=CC(=C1)O MCULE-9388645499 [1,1,0,0,0,0|1,0,0]=3 2783 B12R1.226 O=C(O)COC1=NC=CC(=C1)Br MCULE-3678792472 [1,1,0,0,0,0|2,0,0]=4 2784 B12R1.226 O=C(O)CSC1=CC(=CC=C1)Br MCULE-4691915845 [1,1,0,0,0,0|1,0,0]=3 2785 B12R1.226 O=C(O)CSC1=CC(=CC=C1)Cl MCULE-6197561520 [1,1,0,0,0,0|1,0,0]=3 2786 B12R1.226 O=C(O)CSC1=CC=CC(=C1)F MCULE-1669031717 [1,1,0,0,0,0|1,0,0]=3 2787 B12R1.226 O=N(=O)CCC1=CC(=CC=C1)Cl MCULE-6829325651 [1,1,0,0,0,0|1,0,1]=4 2788 B12R1.226 O=N(=O)CCC1=CC(=CC=C1)F MCULE-1574288719 [1,1,0,0,0,0|1,0,1]=4 2789 B12R1.891 CC(C)(O)CCC1=CC=CC=C1 MCULE-7291109100 [1,1,0,0,0,0|1,0,1]=4 2790 B12R1.891 NS(=O)(=O)CCC1=CC=CC=C1 MCULE-6721103901 [1,1,0,0,0,0|1,0,1]=4 2791 B12R1.891 O=P(O)(O)CCC1=CC=CC=C1 MCULE-6257929637 [1,1,0,0,0,0|1,0,0]=3 2792 B12R1.891 O=P(O)(O)OCC1=CC=CC=C1 MCULE-9230520372 [1,1,0,0,0,0|2,0,0]=4 2793 B12R1.891 O=S(=O)(Cl)CCC1=CC=CC=C1 MCULE-5286971788 [1,1,0,0,0,0|1,0,1]=4 2794 B12R1.891 O=S(=O)(F)CCC1=CC=CC=C1 MCULE-3994247878 [1,1,0,0,0,0|1,0,1]=4 2795 B12R1.891 O=S(=O)(O)CCC1=CC=CC=C1 MCULE-8029828252 [1,1,0,0,0,0|1,0,0]=3 2796 B12R1.891 O=S(=O)(O)CCC1=CC=CC=N1 MCULE-4896379727 [1,1,0,0,0,0|2,0,0]=4 2797 B12R1.891 O=S(=O)(O)CCC1=CC=NC=C1 MCULE-7795125957 [1,1,0,0,0,0|2,0,0]=4 2798 B12R1.891 O=S(=O)([O-])CCC1=CC=CC=C1 MCULE-5808639412 [1,1,0,0,0,0|1,0,1]=4 2799 B12R1.4 C#CC1=CC=C(C=C1)CC(=O)O MCULE-5692158567 [0,1,0,0,1,0|1,0,0]=3 2800 B12R1.4 CC(=O)CC1=CC=C(C=C1)C#N MCULE-3910151752 [0,1,0,0,1,0|1,0,1]=4 2801 B12R1.4 CC(=O)CC1=CC=C(C=C1)CBr MCULE-6808288658 [0,1,0,0,1,0|2,0,0]=4 2802 B12R1.4 CC(=O)NC1=CC=C(C=C1)CN MCULE-4979285210 [0,1,0,0,1,0|2,0,0]=4 2803 B12R1.4 CC(=O)NC1=CC=C(C=C1)CN MCULE-6710009656 [0,1,0,0,1,0|2,0,0]=4 2804 B12R1.4 CC(=O)NC1=CC=C(C=C1)NN MCULE-7286466463 [0,1,0,0,1,0|2,0,0]=4 2805 B12R1.4 CC(=O)OC1=CC=C(C=C1)CN MCULE-2782299884 [0,1,0,0,1,0|2,0,0]=4 2806 B12R1.4 CC(=O)OC1=CC=C(C=C1)CN MCULE-3897296977 [0,1,0,0,1,0|2,0,0]=4 2807 B12R1.4 CCC1=CC=C(C=C1)CC(=O)C MCULE-9486373464 [0,1,0,0,1,0|2,0,0]=4 2808 B12R1.4 CCC1=CC=C(C=C1)CC(=O)N MCULE-4163968051 [0,1,0,0,1,0|2,0,0]=4 2809 B12R1.4 CCC1=CC=C(C=C1)CC(=O)O MCULE-3821428381 [0,1,0,0,1,0|1,0,0]=3 2810 B12R1.4 CCC1=CN=C(C=C1)CC(=O)O MCULE-4030216819 [0,1,0,0,1,0|2,0,0]=4 2811 B12R1.4 CCC1=CN=C(C=C1)CC(=O)O MCULE-5174930559 [0,1,0,0,1,0|2,0,0]=4 2812 B12R1.4 CNC1=CC=C(C=C1)CC(=O)O MCULE-2193745710 [0,1,0,0,1,0|0,0,0]=2 2813 B12R1.4 CNC1=CC=C(C=C1)CC(=O)O MCULE-7752411908 [0,1,0,0,1,0|0,0,0]=2 2814 B12R1.4 CNC1=CC=C(C=C1)CC(=S)N MCULE-3635370484 [0,1,0,0,1,0|1,1,0]=4 2815 B12R1.4 CNC1=CC=C(C=C1)NC(=O)C MCULE-1271646142 [0,1,0,0,1,0|2,0,0]=4 2816 B12R1.4 CNC1=CC=C(C=C1)NC(=O)C MCULE-4849402761 [0,1,0,0,1,0|2,0,0]=4 2817 B12R1.4 COC1=CC=C(C=C1)CC(=O)C MCULE-8607795744 [0,1,0,0,1,0|2,0,0]=4 2818 B12R1.4 COC1=CC=C(C=C1)CC(=O)Cl MCULE-7782557628 [0,1,0,0,1,0|2,0,0]=4 2819 B12R1.4 COC1=CC=C(C=C1)CC(=O)N MCULE-2396420706 [0,1,0,0,1,0|2,0,0]=4 2820 B12R1.4 COC1=CC=C(C=C1)CC(=O)O MCULE-9247963107 [0,1,0,0,1,0|1,0,0]=3 2821 B12R1.4 COC1=CC=C(C=N1)CC(=O)O MCULE-7948548499 [0,1,0,0,1,0|2,0,0]=4 2822 B12R1.4 COC1=CN=C(C=C1)CC(=O)O MCULE-1208251865 [0,1,0,0,1,0|2,0,0]=4 2823 B12R1.4 COC1=CN=C(C=C1)CC(=O)O MCULE-9358056696 [0,1,0,0,1,0|2,0,0]=4 2824 B12R1.4 CS(=O)CC1=CC=C(C=C1)CN MCULE-2051034894 [0,1,0,0,1,0|2,0,0]=4 2825 B12R1.4 CS(=O)CC1=CC=C(C=C1)CN MCULE-7734378063 [0,1,0,0,1,0|2,0,0]=4 2826 B12R1.4 CSC1=CC=C(C=C1)CC(=O)C MCULE-6332095977 [0,1,0,0,1,0|2,0,0]=4 2827 B12R1.4 CSC1=CC=C(C=C1)CC(=O)Cl MCULE-9425466185 [0,1,0,0,1,0|2,0,0]=4 2828 B12R1.4 CSC1=CC=C(C=C1)CC(=O)O MCULE-6921616947 [0,1,0,0,1,0|1,0,0]=3 2829 B12R1.4 N#CC1=CC=C(C=C1)CC(=O)Cl MCULE-2362407758 [0,1,0,0,1,0|1,0,1]=4 2830 B12R1.4 N#CC1=CC=C(C=C1)CC(=O)N MCULE-9840686428 [0,1,0,0,1,0|1,0,1]=4 2831 B12R1.4 N#CC1=CC=C(C=C1)CC(=O)O MCULE-1048335212 [0,1,0,0,1,0|0,0,1]=3 2832 B12R1.4 N#CC1=CN=C(C=C1)CC(=O)O MCULE-2251389493 [0,1,0,0,1,0|1,0,1]=4 2833 B12R1.4 N#CC1=NC=C(C=C1)CC(=O)O MCULE-3595894927 [0,1,0,0,1,0|1,0,1]=4 2834 B12R1.4 NCC1=CC=C(C=C1)CC(=O)N MCULE-8145698570 [0,1,0,0,1,0|1,0,0]=3 2835 B12R1.4 NCC1=CC=C(C=C1)CC(=O)O MCULE-7737351701 [0,1,0,0,1,0|0,0,0]=2 2836 B12R1.4 NCC1=CC=C(C=C1)CC(=O)O MCULE-8802844200 [0,1,0,0,1,0|0,0,0]=2 2837 B12R1.4 NCC1=CC=C(C=C1)NC(=O)N MCULE-9543999073 [0,1,0,0,1,0|2,0,0]=4 2838 B12R1.4 NNC1=CC=C(C=C1)CC(=O)N MCULE-2173208157 [0,1,0,0,1,0|1,0,0]=3 2839 B12R1.4 NNC1=CC=C(C=C1)CC(=O)N MCULE-3131016027 [0,1,0,0,1,0|1,0,0]=3 2840 B12R1.4 NNC1=CC=C(C=C1)CC(=O)O MCULE-2250489951 [0,1,0,0,1,0|0,0,0]=2 2841 B12R1.4 NNC1=CC=C(C=C1)CC(=O)O MCULE-6326870019 [0,1,0,0,1,0|0,0,0]=2 2842 B12R1.4 NNC1=CC=C(C=C1)CC(=O)O MCULE-9524713590 [0,1,0,0,1,0|0,0,0]=2 2843 B12R1.4 O=C(O)CC1=CC=C(C=C1)CBr MCULE-9880773558 [0,1,0,0,1,0|1,0,0]=3 2844 B12R1.4 O=C(O)CC1=CC=C(C=C1)CCl MCULE-4471576860 [0,1,0,0,1,0|1,0,0]=3 2845 B12R1.4 O=C(O)CC1=CC=C(C=C1)CO MCULE-9150949915 [0,1,0,0,1,0|1,0,0]=3 2846 B12R1.4 O=C=C1C=CC(=CC1)CC(=O)O MCULE-8693772412 [0,1,0,0,1,0|1,0,1]=4 2847 B12R1.4 O=CC1=CC=C(C=C1)CC(=O)O MCULE-6530164917 [0,1,0,0,1,0|1,0,0]=3 2848 B12R1.19 CC(=O)CC1=CC(=C(C=C1)Br)F MCULE-3137299317 [0,1,0,0,1,0|2,0,0]=4 2849 B12R1.19 CC(=O)CC1=CC(=C(C=C1)C)Br MCULE-9644055534 [0,1,0,0,1,0|2,0,0]=4 2850 B12R1.19 CC(=O)CC1=CC(=C(C=C1)C)C MCULE-7996261771 [0,1,0,0,1,0|2,0,0]=4 2851 B12R1.19 CC(=O)CC1=CC(=C(C=C1)F)Cl MCULE-9947495886 [0,1,0,0,1,0|2,0,0]=4 2852 B12R1.19 CC(=O)CC1=CC(=C(C=C1)F)F MCULE-4013034406 [0,1,0,0,1,0|2,0,0]=4 2853 B12R1.19 CC(=O)CC1=CC(=C(C=C1)O)Cl MCULE-2223860850 [0,1,0,0,1,0|2,0,0]=4 2854 B12R1.19 CC(=O)CC1=CC=C(C(=C1)Br)F MCULE-9621787612 [0,1,0,0,1,0|2,0,0]=4 2855 B12R1.19 CC(=O)CC1=CC=C(C(=C1)Br)O MCULE-6123354502 [0,1,0,0,1,0|2,0,0]=4 2856 B12R1.19 CC(=O)CC1=CC=C(C(=C1)Cl)Cl MCULE-2987774481 [0,1,0,0,1,0|2,0,0]=4 2857 B12R1.19 CC(=O)CC1=CC=C(C(=C1)F)C MCULE-5003671936 [0,1,0,0,1,0|2,0,0]=4 2858 B12R1.19 CC(=O)CC1=CC=C(C(=C1)F)Cl MCULE-6072607608 [0,1,0,0,1,0|2,0,0]=4 2859 B12R1.19 CC(=O)CC1=CC=C(C(=C1)O)Cl MCULE-5165302372 [0,1,0,0,1,0|2,0,0]=4 2860 B12R1.19 CC(=O)CC1=CC=C(C(=C1)O)O MCULE-4321537730 [0,1,0,0,1,0|2,0,0]=4 2861 B12R1.19 CC(=O)NC1=CC(=C(C=C1)N)Br MCULE-1708945176 [0,1,0,0,1,0|2,0,0]=4 2862 B12R1.19 CC(=O)NC1=CC(=C(C=C1)N)Cl MCULE-8306580751 [0,1,0,0,1,0|2,0,0]=4 2863 B12R1.19 CC(=O)NC1=CC=C(C(=C1)C)N MCULE-8808494780 [0,1,0,0,1,0|2,0,0]=4 2864 B12R1.19 CC1=C(C=C(C=C1)CC(=O)O)Br MCULE-5038914253 [0,1,0,0,1,0|1,0,0]=3 2865 B12R1.19 CC1=C(C=C(C=C1)CC(=O)O)C MCULE-3719890588 [0,1,0,0,1,0|1,0,0]=3 2866 B12R1.19 CC1=C(C=C(C=C1)CC(=O)O)Cl MCULE-1424983219 [0,1,0,0,1,0|1,0,0]=3 2867 B12R1.19 CC1=C(C=C(C=C1)CC(=O)O)F MCULE-5576591559 [0,1,0,0,1,0|1,0,0]=3 2868 B12R1.19 CC1=C(C=C(C=C1)CC(=O)O)O MCULE-1358387629 [0,1,0,0,1,0|1,0,0]=3 2869 B12R1.19 CC1=C(C=C(C=N1)CC(=O)O)F MCULE-7363965470 [0,1,0,0,1,0|2,0,0]=4 2870 B12R1.19 CC1=C(C=CC(=C1)CC(=O)O)Br MCULE-6529953652 [0,1,0,0,1,0|1,0,0]=3 2871 B12R1.19 CC1=C(C=CC(=C1)CC(=O)O)O MCULE-6531233125 [0,1,0,0,1,0|1,0,0]=3 2872 B12R1.19 CC1=C(C=NC(=C1)CC(=O)O)Cl MCULE-1186267057 [0,1,0,0,1,0|2,0,0]=4 2873 B12R1.19 CC1=C(C=NC(=C1)CC(=O)O)Cl MCULE-7250955595 [0,1,0,0,1,0|2,0,0]=4 2874 B12R1.19 CC1=C(N=CC(=C1)CC(=O)O)Cl MCULE-1119631234 [0,1,0,0,1,0|2,0,0]=4 2875 B12R1.19 CC1=CC(=CC=C1Cl)CC(=O)O MCULE-3192750595 [0,1,0,0,1,0|1,0,0]=3 2876 B12R1.19 CC1=CC(=CC=C1F)CC(=O)O MCULE-2972135857 [0,1,0,0,1,0|1,0,0]=3 2877 B12R1.19 CC1=CC(=CC=C1N)CC(=O)O MCULE-9605842705 [0,1,0,0,1,0|0,0,0]=2 2878 B12R1.19 CC1=CC=C(C=C1C)CC(=O)N MCULE-8761927653 [0,1,0,0,1,0|2,0,0]=4 2879 B12R1.19 CC1=CC=C(C=C1N)CC(=O)O MCULE-2212583738 [0,1,0,0,1,0|1,0,0]=3 2880 B12R1.19 N=C(O)CC1=CC=C(C(=C1)F)F MCULE-1181732410 [0,1,0,0,1,0|2,0,0]=4 2881 B12R1.19 NC(=O)CC1=CC(=C(C=C1)Cl)Cl MCULE-1138051773 [0,1,0,0,1,0|2,0,0]=4 2882 B12R1.19 NC(=O)CC1=CC(=C(C=C1)O)O MCULE-7391504351 [0,1,0,0,1,0|2,0,0]=4 2883 B12R1.19 NC(=O)CC1=CC=C(C(=C1)Br)F MCULE-6514113444 [0,1,0,0,1,0|2,0,0]=4 2884 B12R1.19 NC1=C(C=C(C=C1)CC(=O)O)Br MCULE-7916679832 [0,1,0,0,1,0|0,0,0]=2 2885 B12R1.19 NC1=C(C=C(C=C1)CC(=O)O)F MCULE-6800285077 [0,1,0,0,1,0|0,0,0]=2 2886 B12R1.19 NC1=C(C=C(C=C1)CC(=O)O)N MCULE-3417935732 [0,1,0,0,1,0|0,0,0]=2 2887 B12R1.19 NC1=C(C=CC(=C1)CC(=O)O)O MCULE-2662944477 [0,1,0,0,1,0|1,0,0]=3 2888 B12R1.19 NC1=C(N=C(C=C1)CC(=O)O)Br MCULE-9728806322 [0,1,0,0,1,0|1,0,0]=3 2889 B12R1.19 NC1=CC(=CC=C1Br)CC(=O)O MCULE-2646838701 [0,1,0,0,1,0|1,0,0]=3 2890 B12R1.19 NC1=CC(=CC=C1Cl)CC(=O)O MCULE-6446988245 [0,1,0,0,1,0|1,0,0]=3 2891 B12R1.19 NC1=CC(=CC=C1F)CC(=O)O MCULE-5686279212 [0,1,0,0,1,0|1,0,0]=3 2892 B12R1.19 NC1=CC=C(C=C1Cl)CC(=O)O MCULE-7324329037 [0,1,0,0,1,0|0,0,0]=2 2893 B12R1.19 NC1=CC=C(C=C1I)CC(=O)O MCULE-8184213751 [0,1,0,0,1,0|0,0,0]=2 2894 B12R1.19 O=C(Cl)CC1=CC(=C(C=C1)Br)F MCULE-5871839490 [0,1,0,0,1,0|2,0,0]=4 2895 B12R1.19 O=C(Cl)CC1=CC=C(C(=C1)Cl)Cl MCULE-1818516546 [0,1,0,0,1,0|2,0,0]=4 2896 B12R1.19 O=C(Cl)CC1=CC=C(C(=C1)F)F MCULE-1161012851 [0,1,0,0,1,0|2,0,0]=4 2897 B12R1.19 O=C(O)CC1=CC(=C(C=C1)Br)Br MCULE-4676835162 [0,1,0,0,1,0|1,0,0]=3 2898 B12R1.19 O=C(O)CC1=CC(=C(C=C1)Br)Cl MCULE-2709276564 [0,1,0,0,1,0|1,0,0]=3 2899 B12R1.19 O=C(O)CC1=CC(=C(C=C1)Br)F MCULE-2526464624 [0,1,0,0,1,0|1,0,0]=3 2900 B12R1.19 O=C(O)CC1=CC(=C(C=C1)Cl)F MCULE-1360772119 [0,1,0,0,1,0|1,0,0]=3 2901 B12R1.19 O=C(O)CC1=CC(=C(C=C1)F)Br MCULE-6750073135 [0,1,0,0,1,0|1,0,0]=3 2902 B12R1.19 O=C(O)CC1=CC(=C(C=C1)F)Cl MCULE-7662816251 [0,1,0,0,1,0|1,0,0]=3 2903 B12R1.19 O=C(O)CC1=CC(=C(C=C1)F)F MCULE-2574567970 [0,1,0,0,1,0|1,0,0]=3 2904 B12R1.19 O=C(O)CC1=CC(=C(C=C1)I)Br MCULE-2481722540 [0,1,0,0,1,0|1,0,0]=3 2905 B12R1.19 O=C(O)CC1=CC(=C(C=C1)O)Br MCULE-1154165426 [0,1,0,0,1,0|1,0,0]=3 2906 B12R1.19 O=C(O)CC1=CC(=C(C=C1)O)Cl MCULE-7769730698 [0,1,0,0,1,0|1,0,0]=3 2907 B12R1.19 O=C(O)CC1=CC(=C(N=C1)Br)F MCULE-6325579095 [0,1,0,0,1,0|2,0,0]=4 2908 B12R1.19 O=C(O)CC1=CC(=C(N=C1)Cl)Cl MCULE-1683979976 [0,1,0,0,1,0|2,0,0]=4 2909 B12R1.19 O=C(O)CC1=CC=C(C(=C1)Br)Cl MCULE-6614148079 [0,1,0,0,1,0|1,0,0]=3 2910 B12R1.19 O=C(O)CC1=CC=C(C(=C1)Cl)Cl MCULE-1698590133 [0,1,0,0,1,0|1,0,0]=3 2911 B12R1.19 O=C(O)CC1=CC=C(C(=C1)F)I MCULE-9013627654 [0,1,0,0,1,0|1,0,0]=3 2912 B12R1.19 O=C(O)CC1=CC=C(C(=C1)F)O MCULE-3629510280 [0,1,0,0,1,0|1,0,0]=3 2913 B12R1.19 O=C(O)CC1=CC=C(C(=C1)O)Cl MCULE-1312147529 [0,1,0,0,1,0|1,0,0]=3 2914 B12R1.19 O=C(O)CC1=CC=C(C(=C1)O)F MCULE-2949001254 [0,1,0,0,1,0|1,0,0]=3 2915 B12R1.19 O=C(O)CC1=CC=C(C(=C1)O)O MCULE-3883489471 [0,1,0,0,1,0|1,0,0]=3 2916 B12R1.19 O=C([O-])CC1=CC=C(C(=C1)F)F MCULE-7383335936 [0,1,0,0,1,0|1,0,1]=4 2917 B12R1.20 C=C(C(=O)O)C1=CC=C(C=C1)Cl MCULE-9979377927 [0,1,0,0,1,0|1,0,1]=4 2918 B12R1.20 CC(=O)C(Br)C1=CC=C(C=C1)C MCULE-2925370614 [0,1,0,0,1,0|2,0,0]=4 2919 B12R1.20 CC(=O)C(Br)C1=CC=C(C=C1)O MCULE-2034293234 [0,1,0,0,1,0|2,0,0]=4 2920 B12R1.20 CC(=O)C(C)C1=CC=C(C=C1)Cl MCULE-6044023986 [0,1,0,0,1,0|2,0,0]=4 2921 B12R1.20 CC(=O)C(Cl)C1=CC=C(C=C1)F MCULE-3045755021 [0,1,0,0,1,0|2,0,0]=4 2922 B12R1.20 CC(=O)C(N)C1=CC=C(C=C1)Cl MCULE-6614878079 [0,1,0,0,1,0|2,0,0]=4 2923 B12R1.20 CC(=O)C(N)C1=CC=C(C=C1)F MCULE-4668708358 [0,1,0,0,1,0|2,0,0]=4 2924 B12R1.20 CC(=O)C(N)C1=CC=C(C=C1)F MCULE-5871797074 [0,1,0,0,1,0|2,0,0]=4 2925 B12R1.20 CC(=O)N(C)C1=CC=C(C=C1)N MCULE-8953157038 [0,1,0,0,1,0|2,0,0]=4 2926 B12R1.20 CC(C(=O)Cl)C1=CC=C(C=C1)Cl MCULE-4969606912 [0,1,0,0,1,0|2,0,0]=4 2927 B12R1.20 CC(C(=O)N)C1=CC=C(C=C1)Br MCULE-1261041897 [0,1,0,0,1,0|2,0,0]=4 2928 B12R1.20 CC(C(=O)N)C1=CC=C(C=C1)F MCULE-8529966004 [0,1,0,0,1,0|2,0,0]=4 2929 B12R1.20 CC(C(=O)O)C1=CC=C(C=C1)Br MCULE-3856011157 [0,1,0,0,1,0|1,0,0]=3 2930 B12R1.20 CC(C(=O)O)C1=CC=C(C=C1)Cl MCULE-2769553332 [0,1,0,0,1,0|1,0,0]=3 2931 B12R1.20 CC(C(=O)O)C1=CC=C(C=C1)F MCULE-2156675573 [0,1,0,0,1,0|1,0,0]=3 2932 B12R1.20 CC(C(=O)O)C1=CC=C(C=C1)I MCULE-7770256839 [0,1,0,0,1,0|1,0,0]=3 2933 B12R1.20 CC(C(=O)O)C1=CC=C(C=C1)N MCULE-3310260159 [0,1,0,0,1,0|0,0,0]=2 2934 B12R1.20 CC(C(=O)O)C1=CC=C(C=C1)N MCULE-4466911405 [0,1,0,0,1,0|0,0,0]=2 2935 B12R1.20 CC(C(=O)O)C1=CC=C(C=C1)O MCULE-6886271028 [0,1,0,0,1,0|1,0,0]=3 2936 B12R1.20 CC(C(=O)O)C1=CC=C(C=C1)O MCULE-9438249577 [0,1,0,0,1,0|1,0,0]=3 2937 B12R1.20 CC(C(=O)O)C1=CC=C(N=C1)Cl MCULE-3769981492 [0,1,0,0,1,0|2,0,0]=4 2938 B12R1.20 CC(C(=O)O)C1=NC=C(C=C1)N MCULE-1842626917 [0,1,0,0,1,0|1,0,0]=3 2939 B12R1.20 CC(C(=O)[O-])C1=NC=C(C=C1)N MCULE-4972430500 [0,1,0,0,1,0|1,0,1]=4 2940 B12R1.20 CC1=CC=C(C=C1)C(=O)C(=O)O MCULE-3817789770 [0,1,0,0,1,0|1,0,1]=4 2941 B12R1.20 CC1=CC=C(C=C1)C(C)C(=O)Cl MCULE-5223762590 [0,1,0,0,1,0|2,0,0]=4 2942 B12R1.20 CC1=CC=C(C=C1)C(C)C(=O)O MCULE-3998271570 [0,1,0,0,1,0|1,0,0]=3 2943 B12R1.20 CC1=CC=C(C=C1)C(F)C(=O)O MCULE-2629016483 [0,1,0,0,1,0|1,0,0]=3 2944 B12R1.20 CC1=CC=C(C=C1)C(N)C(=O)N MCULE-6716790662 [0,1,0,0,1,0|2,0,0]=4 2945 B12R1.20 CC1=CC=C(C=C1)C(N)C(=O)O MCULE-1587277093 [0,1,0,0,1,0|1,0,0]=3 2946 B12R1.20 CC1=CC=C(C=C1)C(N)C(=O)O MCULE-3506021190 [0,1,0,0,1,0|1,0,0]=3 2947 B12R1.20 CC1=CC=C(C=C1)C(O)C(=O)N MCULE-8939242856 [0,1,0,0,1,0|2,0,0]=4 2948 B12R1.20 CC1=CC=C(C=C1)C(O)C(=O)O MCULE-4822757366 [0,1,0,0,1,0|1,0,0]=3 2949 B12R1.20 CC1=CC=C(C=C1)[C@@H](C)C(=O)O MCULE-8067162948 [0,1,0,0,1,0|1,0,0]=3 2950 B12R1.20 CC1=CC=C(C=C1)[C@@H](N)C(=O)O MCULE-4506752241 [0,1,0,0,1,0|1,0,0]=3 2951 B12R1.20 CC1=CC=C(C=C1)[C@@H](O)C(=O)O MCULE-3737866831 [0,1,0,0,1,0|1,0,0]=3 2952 B12R1.20 CC1=CC=C(C=C1)[C@@H](O)C(=O)O MCULE-7880826722 [0,1,0,0,1,0|1,0,0]=3 2953 B12R1.20 CC1=CC=C(C=C1)[C@H](C)C(=O)O MCULE-9094858000 [0,1,0,0,1,0|1,0,0]=3 2954 B12R1.20 CC1=CC=C(C=C1)[C@H](N)C(=O)O MCULE-3376830033 [0,1,0,0,1,0|1,0,0]=3 2955 B12R1.20 CC1=CC=C(C=C1)[C@H](N)C(=O)O MCULE-5116557466 [0,1,0,0,1,0|1,0,0]=3 2956 B12R1.20 CC1=CC=C(C=C1)[C@H](N)C(=O)O MCULE-6528465386 [0,1,0,0,1,0|1,0,0]=3 2957 B12R1.20 CC1=CC=C(C=C1)[C@H](N)C(=O)O MCULE-7928906966 [0,1,0,0,1,0|1,0,0]=3 2958 B12R1.20 C[C@@H](C(=O)O)C1=CC=C(C=C1)Br MCULE-5166574874 [0,1,0,0,1,0|1,0,0]=3 2959 B12R1.20 C[C@@H](C(=O)O)C1=CC=C(C=C1)Br MCULE-7554347918 [0,1,0,0,1,0|1,0,0]=3 2960 B12R1.20 C[C@@H](C(=O)O)C1=CC=C(C=C1)F MCULE-1429593854 [0,1,0,0,1,0|1,0,0]=3 2961 B12R1.20 C[C@@H](C(=O)O)C1=CC=C(C=C1)F MCULE-7919985541 [0,1,0,0,1,0|1,0,0]=3 2962 B12R1.20 C[C@@H](C(=O)O)C1=CC=C(C=C1)O MCULE-4207098314 [0,1,0,0,1,0|1,0,0]=3 2963 B12R1.20 C[C@@H](C(=O)O)C1=CC=C(C=C1)O MCULE-5888945014 [0,1,0,0,1,0|1,0,0]=3 2964 B12R1.20 C[C@H](C(=O)O)C1=CC=C(C=C1)Br MCULE-5245847689 [0,1,0,0,1,0|1,0,0]=3 2965 B12R1.20 C[C@H](C(=O)O)C1=CC=C(C=C1)O MCULE-3937861865 [0,1,0,0,1,0|1,0,0]=3 2966 B12R1.20 NC(=O)C(Br)C1=CC=C(C=C1)F MCULE-7124248926 [0,1,0,0,1,0|2,0,0]=4 2967 B12R1.20 NC(=O)C(Cl)C1=CC=C(C=C1)Br MCULE-6980825973 [0,1,0,0,1,0|2,0,0]=4 2968 B12R1.20 NC(=O)C(Cl)C1=CC=C(C=C1)F MCULE-1859977358 [0,1,0,0,1,0|2,0,0]=4 2969 B12R1.20 NC(=O)C(N)C1=CC=C(C=C1)Br MCULE-1311901956 [0,1,0,0,1,0|2,0,0]=4 2970 B12R1.20 NC(=O)C(N)C1=CC=C(C=C1)Cl MCULE-2425582122 [0,1,0,0,1,0|2,0,0]=4 2971 B12R1.20 NC(=O)C(N)C1=CC=C(C=C1)Cl MCULE-6213390094 [0,1,0,0,1,0|2,0,0]=4 2972 B12R1.20 NC(=O)C(N)C1=CC=C(C=C1)F MCULE-8526588875 [0,1,0,0,1,0|2,0,0]=4 2973 B12R1.20 NC(=O)C(N)C1=CC=C(C=C1)O MCULE-1782414943 [0,1,0,0,1,0|2,0,0]=4 2974 B12R1.20 NC(=O)C(O)C1=CC=C(C=C1)Br MCULE-2717407059 [0,1,0,0,1,0|2,0,0]=4 2975 B12R1.20 NC(=O)C(O)C1=CC=C(C=C1)Cl MCULE-8596223220 [0,1,0,0,1,0|2,0,0]=4 2976 B12R1.20 NC(=O)C(O)C1=CC=C(C=C1)F MCULE-3003916599 [0,1,0,0,1,0|2,0,0]=4 2977 B12R1.20 NC(=O)[C@H](N)C1=CC=C(C=C1)O MCULE-1162353979 [0,1,0,0,1,0|2,0,0]=4 2978 B12R1.20 NC(C(=O)O)C1=CC=C(C=C1)Br MCULE-4068820589 [0,1,0,0,1,0|1,0,0]=3 2979 B12R1.20 NC(C(=O)O)C1=CC=C(C=C1)Br MCULE-4284243502 [0,1,0,0,1,0|1,0,0]=3 2980 B12R1.20 NC(C(=O)O)C1=CC=C(C=C1)Cl MCULE-3056854629 [0,1,0,0,1,0|1,0,0]=3 2981 B12R1.20 NC(C(=O)O)C1=CC=C(C=C1)Cl MCULE-4019160873 [0,1,0,0,1,0|1,0,0]=3 2982 B12R1.20 NC(C(=O)O)C1=CC=C(C=C1)Cl MCULE-9766592325 [0,1,0,0,1,0|1,0,0]=3 2983 B12R1.20 NC(C(=O)O)C1=CC=C(C=C1)F MCULE-5503473156 [0,1,0,0,1,0|1,0,0]=3 2984 B12R1.20 NC(C(=O)O)C1=CC=C(C=C1)F MCULE-6541399593 [0,1,0,0,1,0|1,0,0]=3 2985 B12R1.20 NC(C(=O)O)C1=CC=C(C=C1)F MCULE-8780261595 [0,1,0,0,1,0|1,0,0]=3 2986 B12R1.20 NC(C(=O)O)C1=CC=C(C=C1)I MCULE-7335173971 [0,1,0,0,1,0|1,0,0]=3 2987 B12R1.20 NC(C(=O)O)C1=CC=C(C=C1)O MCULE-3401679688 [0,1,0,0,1,0|1,0,0]=3 2988 B12R1.20 NC(C(=O)O)C1=CC=C(C=C1)O MCULE-5835109660 [0,1,0,0,1,0|1,0,0]=3 2989 B12R1.20 NC1=CC=C(C=C1)C(N)C(=O)O MCULE-2950897906 [0,1,0,0,1,0|0,0,0]=2 2990 B12R1.20 NC1=CC=C(C=C1)C(N)C(=O)O MCULE-3993003300 [0,1,0,0,1,0|0,0,0]=2 2991 B12R1.20 NC1=CC=C(C=C1)C(O)C(=O)O MCULE-3485303182 [0,1,0,0,1,0|0,0,0]=2 2992 B12R1.20 NC1=CC=C(C=C1)[C@@H](N)C(=O)O MCULE-5248016997 [0,1,0,0,1,0|0,0,0]=2 2993 B12R1.20 NC1=CC=C(C=C1)[C@@H](N)C(=O)O MCULE-5710978804 [0,1,0,0,1,0|0,0,0]=2 2994 B12R1.20 NC1=CC=C(C=C1)[C@@H](N)C(=O)O MCULE-7216555315 [0,1,0,0,1,0|0,0,0]=2 2995 B12R1.20 NC1=CC=C(C=C1)[C@@H](N)C(=O)O MCULE-9432239375 [0,1,0,0,1,0|0,0,0]=2 2996 B12R1.20 NC1=CC=C(C=C1)[C@@H](O)C(=O)O MCULE-8807693274 [0,1,0,0,1,0|0,0,0]=2 2997 B12R1.20 N[C@@H](C(=O)O)C1=CC=C(C=C1)Br MCULE-1841593478 [0,1,0,0,1,0|1,0,0]=3 2998 B12R1.20 N[C@@H](C(=O)O)C1=CC=C(C=C1)Br MCULE-3449066230 [0,1,0,0,1,0|1,0,0]=3 2999 B12R1.20 N[C@@H](C(=O)O)C1=CC=C(C=C1)Br MCULE-5518874265 [0,1,0,0,1,0|1,0,0]=3 3000 B12R1.20 N[C@@H](C(=O)O)C1=CC=C(C=C1)Br MCULE-7725592732 [0,1,0,0,1,0|1,0,0]=3 3001 B12R1.20 N[C@@H](C(=O)O)C1=CC=C(C=C1)Cl MCULE-3811128026 [0,1,0,0,1,0|1,0,0]=3 3002 B12R1.20 N[C@@H](C(=O)O)C1=CC=C(C=C1)Cl MCULE-4244546160 [0,1,0,0,1,0|1,0,0]=3 3003 B12R1.20 N[C@@H](C(=O)O)C1=CC=C(C=C1)Cl MCULE-6404239502 [0,1,0,0,1,0|1,0,0]=3 3004 B12R1.20 N[C@@H](C(=O)O)C1=CC=C(C=C1)Cl MCULE-6945755808 [0,1,0,0,1,0|1,0,0]=3 3005 B12R1.20 N[C@@H](C(=O)O)C1=CC=C(C=C1)F MCULE-1941413906 [0,1,0,0,1,0|1,0,0]=3 3006 B12R1.20 N[C@@H](C(=O)O)C1=CC=C(C=C1)F MCULE-6586219982 [0,1,0,0,1,0|1,0,0]=3 3007 B12R1.20 N[C@@H](C(=O)O)C1=CC=C(C=C1)F MCULE-7464615223 [0,1,0,0,1,0|1,0,0]=3 3008 B12R1.20 N[C@@H](C(=O)O)C1=CC=C(C=C1)F MCULE-7795254631 [0,1,0,0,1,0|1,0,0]=3 3009 B12R1.20 N[C@@H](C(=O)O)C1=CC=C(C=C1)I MCULE-2074138900 [0,1,0,0,1,0|1,0,0]=3 3010 B12R1.20 N[C@@H](C(=O)O)C1=CC=C(C=C1)O MCULE-3842441492 [0,1,0,0,1,0|1,0,0]=3 3011 B12R1.20 N[C@@H](C(=O)O)C1=CC=C(C=C1)O MCULE-7930915902 [0,1,0,0,1,0|1,0,0]=3 3012 B12R1.20 N[C@@H](C(=O)O)C1=NC=C(C=C1)Br MCULE-4675370174 [0,1,0,0,1,0|2,0,0]=4 3013 B12R1.20 N[C@@H](C(=O)O)C1=NC=C(C=C1)Br MCULE-5624262303 [0,1,0,0,1,0|2,0,0]=4 3014 B12R1.20 N[C@H](C(=O)O)C1=CC=C(C=C1)Br MCULE-2463683867 [0,1,0,0,1,0|1,0,0]=3 3015 B12R1.20 N[C@H](C(=O)O)C1=CC=C(C=C1)Br MCULE-4008918455 [0,1,0,0,1,0|1,0,0]=3 3016 B12R1.20 N[C@H](C(=O)O)C1=CC=C(C=C1)Br MCULE-4037080447 [0,1,0,0,1,0|1,0,0]=3 3017 B12R1.20 N[C@H](C(=O)O)C1=CC=C(C=C1)Br MCULE-6684337430 [0,1,0,0,1,0|1,0,0]=3 3018 B12R1.20 N[C@H](C(=O)O)C1=CC=C(C=C1)Cl MCULE-2822483467 [0,1,0,0,1,0|1,0,0]=3 3019 B12R1.20 N[C@H](C(=O)O)C1=CC=C(C=C1)Cl MCULE-5986270862 [0,1,0,0,1,0|1,0,0]=3 3020 B12R1.20 N[C@H](C(=O)O)C1=CC=C(C=C1)F MCULE-1999690769 [0,1,0,0,1,0|1,0,0]=3 3021 B12R1.20 N[C@H](C(=O)O)C1=CC=C(C=C1)F MCULE-2503602546 [0,1,0,0,1,0|1,0,0]=3 3022 B12R1.20 N[C@H](C(=O)O)C1=CC=C(C=C1)F MCULE-4023441343 [0,1,0,0,1,0|1,0,0]=3 3023 B12R1.20 N[C@H](C(=O)O)C1=CC=C(C=C1)F MCULE-4787106343 [0,1,0,0,1,0|1,0,0]=3 3024 B12R1.20 N[C@H](C(=O)O)C1=CC=C(C=C1)O MCULE-3619505381 [0,1,0,0,1,0|1,0,0]=3 3025 B12R1.20 N[C@H](C(=O)O)C1=CC=C(C=C1)O MCULE-5839165135 [0,1,0,0,1,0|1,0,0]=3 3026 B12R1.20 N[C@H](C(=O)O)C1=NC=C(C=C1)Br MCULE-3537276610 [0,1,0,0,1,0|2,0,0]=4 3027 B12R1.20 N[C@H](C(=O)O)C1=NC=C(C=C1)Br MCULE-7673451569 [0,1,0,0,1,0|2,0,0]=4 3028 B12R1.20 O=C(Cl)C(Cl)C1=CC=C(C=C1)F MCULE-5417220341 [0,1,0,0,1,0|2,0,0]=4 3029 B12R1.20 O=C(O)C(=O)C1=CC=C(C=C1)Br MCULE-9463589270 [0,1,0,0,1,0|1,0,1]=4 3030 B12R1.20 O=C(O)C(=O)C1=CC=C(C=C1)Cl MCULE-1231250867 [0,1,0,0,1,0|1,0,1]=4 3031 B12R1.20 O=C(O)C(=O)C1=CC=C(C=C1)F MCULE-3191036747 [0,1,0,0,1,0|1,0,1]=4 3032 B12R1.20 O=C(O)C(=O)C1=CC=C(C=C1)O MCULE-6708689901 [0,1,0,0,1,0|1,0,1]=4 3033 B12R1.20 O=C(O)C(Br)C1=CC=C(C=C1)Cl MCULE-8324791611 [0,1,0,0,1,0|1,0,0]=3 3034 B12R1.20 O=C(O)C(Br)C1=CC=C(C=C1)F MCULE-1001343874 [0,1,0,0,1,0|1,0,0]=3 3035 B12R1.20 O=C(O)C(Cl)C1=CC=C(C=C1)Cl MCULE-1960477145 [0,1,0,0,1,0|1,0,0]=3 3036 B12R1.20 O=C(O)C(F)C1=CC=C(C=C1)Br MCULE-8921014439 [0,1,0,0,1,0|1,0,0]=3 3037 B12R1.20 O=C(O)C(F)C1=CC=C(C=C1)Cl MCULE-7083049660 [0,1,0,0,1,0|1,0,0]=3 3038 B12R1.20 O=C(O)C(F)C1=CC=C(C=C1)F MCULE-5455404268 [0,1,0,0,1,0|1,0,0]=3 3039 B12R1.20 O=C(O)C(O)C1=CC=C(C=C1)Br MCULE-6560372222 [0,1,0,0,1,0|1,0,0]=3 3040 B12R1.20 O=C(O)C(O)C1=CC=C(C=C1)Cl MCULE-1787123081 [0,1,0,0,1,0|1,0,0]=3 3041 B12R1.20 O=C(O)C(O)C1=CC=C(C=C1)Cl MCULE-8938500812 [0,1,0,0,1,0|1,0,0]=3 3042 B12R1.20 O=C(O)C(O)C1=CC=C(C=C1)F MCULE-8562671113 [0,1,0,0,1,0|1,0,0]=3 3043 B12R1.20 O=C(O)C(O)C1=CC=C(C=C1)O MCULE-4331565630 [0,1,0,0,1,0|1,0,0]=3 3044 B12R1.20 O=C(O)[C@@H](O)C1=CC=C(C=C1)Br MCULE-3898515959 [0,1,0,0,1,0|1,0,0]=3 3045 B12R1.20 O=C(O)[C@@H](O)C1=CC=C(C=C1)Br MCULE-8468373165 [0,1,0,0,1,0|1,0,0]=3 3046 B12R1.20 O=C(O)[C@@H](O)C1=CC=C(C=C1)Cl MCULE-2017991060 [0,1,0,0,1,0|1,0,0]=3 3047 B12R1.20 O=C(O)[C@@H](O)C1=CC=C(C=C1)Cl MCULE-8113669937 [0,1,0,0,1,0|1,0,0]=3 3048 B12R1.20 O=C(O)[C@@H](O)C1=CC=C(C=C1)F MCULE-7253640949 [0,1,0,0,1,0|1,0,0]=3 3049 B12R1.20 O=C(O)[C@@H](O)C1=CC=C(C=C1)F MCULE-7875959296 [0,1,0,0,1,0|1,0,0]=3 3050 B12R1.20 O=C(O)[C@@H](O)C1=CC=C(C=C1)O MCULE-3531357053 [0,1,0,0,1,0|1,0,0]=3 3051 B12R1.20 O=C(O)[C@@H](O)C1=CC=C(C=C1)O MCULE-9803313467 [0,1,0,0,1,0|1,0,0]=3 3052 B12R1.20 O=C(O)[C@H](O)C1=CC=C(C=C1)Br MCULE-5848880566 [0,1,0,0,1,0|1,0,0]=3 3053 B12R1.20 O=C(O)[C@H](O)C1=CC=C(C=C1)Br MCULE-6800801358 [0,1,0,0,1,0|1,0,0]=3 3054 B12R1.20 O=C(O)[C@H](O)C1=CC=C(C=C1)Cl MCULE-2645498390 [0,1,0,0,1,0|1,0,0]=3 3055 B12R1.20 O=C(O)[C@H](O)C1=CC=C(C=C1)Cl MCULE-2778556406 [0,1,0,0,1,0|1,0,0]=3 3056 B12R1.20 O=C(O)[C@H](O)C1=CC=C(C=C1)F MCULE-3500055666 [0,1,0,0,1,0|1,0,0]=3 3057 B12R1.20 O=C(O)[C@H](O)C1=CC=C(C=C1)F MCULE-9723473790 [0,1,0,0,1,0|1,0,0]=3 3058 B12R1.20 O=C(O)[C@H](O)C1=CC=C(C=C1)O MCULE-2873155115 [0,1,0,0,1,0|1,0,0]=3 3059 B12R1.20 O=C(O)[C@H](O)C1=CC=C(C=C1)O MCULE-6216776706 [0,1,0,0,1,0|1,0,0]=3 3060 B12R1.20 O=C([O-])C(O)C1=CC=C(C=C1)O MCULE-7699468372 [0,1,0,0,1,0|1,0,1]=4 3061 B12R1.20 [C@@H](C)(C(=O)O)C1=CC=C(C=C1)F MCULE-6240848266 [0,1,0,0,1,0|1,0,0]=3 3062 B12R1.20 [C@H](C)(C(=O)O)C1=CC=C(C=C1)C MCULE-7422640666 [0,1,0,0,1,0|1,0,0]=3 3063 B12R1.106 CS(=O)(=O)CC1=CC=C(C=C1)N MCULE-6801008124 [0,1,0,0,1,0|1,0,1]=4 3064 B12R1.106 CS(=O)(=O)CC1=CC=C(C=C1)N MCULE-8940908015 [0,1,0,0,1,0|1,0,1]=4 3065 B12R1.106 NC1=CC=C(C=C1)CP(=O)(O)O MCULE-5840524615 [0,1,0,0,1,0|1,0,0]=3 3066 B12R1.106 NC1=CC=C(C=C1)CS(=O)(=O)N MCULE-6967015379 [0,1,0,0,1,0|1,0,1]=4 3067 B12R1.106 NC1=CC=C(C=C1)CS(=O)(=O)O MCULE-6405860023 [0,1,0,0,1,0|1,0,0]=3 3068 B12R1.106 NC1=CC=C(C=C1)OP(=O)([O-])O MCULE-1381481127 [0,1,0,0,1,0|2,0,0]=4 3069 B12R1.106 NC1=CC=C(C=C1)OP(=O)([O-])O MCULE-9899526439 [0,1,0,0,1,0|2,0,0]=4 3070 B12R1.106 NC1=CC=C(C=C1)OS(=O)(=O)O MCULE-6552228938 [0,1,0,0,1,0|2,0,0]=4 3071 B12R1.106 NC1=CC=C(C=C1)SS(=O)(=O)O MCULE-5898239148 [0,1,0,0,1,0|2,0,0]=4 3072 B12R1.106 O=P(O)(O)CC1=CC=C(C=C1)Br MCULE-7313420453 [0,1,0,0,1,0|2,0,0]=4 3073 B12R1.106 O=P(O)(O)CC1=CC=C(C=C1)Cl MCULE-5776435261 [0,1,0,0,1,0|2,0,0]=4 3074 B12R1.106 O=P(O)(O)CC1=CC=C(C=C1)F MCULE-6210315884 [0,1,0,0,1,0|2,0,0]=4 3075 B12R1.106 O=P(O)(O)CC1=CC=C(C=C1)O MCULE-1502207290 [0,1,0,0,1,0|2,0,0]=4 3076 B12R1.106 O=S(=O)(O)CC1=CC=C(C=C1)Br MCULE-3769985211 [0,1,0,0,1,0|2,0,0]=4 3077 B12R1.106 O=S(=O)(O)CC1=CC=C(C=C1)F MCULE-7116712817 [0,1,0,0,1,0|2,0,0]=4 3078 B12R1.233 CC(=O)CC1=C(C=C(C=C1)Br)F MCULE-7434599905 [0,1,0,0,1,0|2,0,0]=4 3079 B12R1.233 CC(=O)CC1=C(C=C(C=C1)Cl)Br MCULE-4064732053 [0,1,0,0,1,0|2,0,0]=4 3080 B12R1.233 CC(=O)CC1=C(C=C(C=C1)F)Br MCULE-5178200142 [0,1,0,0,1,0|2,0,0]=4 3081 B12R1.233 CC(=O)CC1=C(C=C(C=C1)F)Cl MCULE-2985574769 [0,1,0,0,1,0|2,0,0]=4 3082 B12R1.233 CC(=O)CC1=CC=C(C=C1C)C MCULE-4450708390 [0,1,0,0,1,0|2,0,0]=4 3083 B12R1.233 CC(=O)CC1=CC=C(C=C1C)Cl MCULE-2730603057 [0,1,0,0,1,0|2,0,0]=4 3084 B12R1.233 CC(=O)CC1=CC=C(C=C1Cl)Cl MCULE-3801315677 [0,1,0,0,1,0|2,0,0]=4 3085 B12R1.233 CC(=O)CC1=CC=C(C=C1F)Cl MCULE-2226024456 [0,1,0,0,1,0|2,0,0]=4 3086 B12R1.233 CC(=O)CC1=CC=C(C=C1F)F MCULE-8555099681 [0,1,0,0,1,0|2,0,0]=4 3087 B12R1.233 CC(=O)NC1=C(C=C(C=C1)N)Cl MCULE-1874085638 [0,1,0,0,1,0|2,0,0]=4 3088 B12R1.233 CC(=O)NC1=C(C=C(C=C1)N)F MCULE-1780622289 [0,1,0,0,1,0|2,0,0]=4 3089 B12R1.233 CC(=O)NC1=CC=C(C=C1C)N MCULE-4958357149 [0,1,0,0,1,0|2,0,0]=4 3090 B12R1.233 CC1=C(C=CC(=C1)Br)CC(=O)N MCULE-1428934759 [0,1,0,0,1,0|2,0,0]=4 3091 B12R1.233 CC1=C(C=CC(=C1)Br)CC(=O)O MCULE-5972568517 [0,1,0,0,1,0|1,0,0]=3 3092 B12R1.233 CC1=C(C=CC(=C1)Cl)CC(=O)O MCULE-5121930711 [0,1,0,0,1,0|1,0,0]=3 3093 B12R1.233 CC1=C(C=CC(=C1)F)CC(=O)O MCULE-3725443030 [0,1,0,0,1,0|1,0,0]=3 3094 B12R1.233 CC1=C(C=CC(=C1)O)CC(=O)O MCULE-8065523243 [0,1,0,0,1,0|1,0,0]=3 3095 B12R1.233 CC1=C(C=CC(=N1)Cl)CC(=O)O MCULE-5929082188 [0,1,0,0,1,0|2,0,0]=4 3096 B12R1.233 CC1=C(C=NC(=C1)Cl)CC(=O)O MCULE-9200749582 [0,1,0,0,1,0|2,0,0]=4 3097 B12R1.233 CC1=CC(=C(C=C1)CC(=O)Cl)C MCULE-7538561042 [0,1,0,0,1,0|2,0,0]=4 3098 B12R1.233 CC1=CC(=C(C=C1)CC(=O)O)Br MCULE-1338763573 [0,1,0,0,1,0|1,0,0]=3 3099 B12R1.233 CC1=CC(=C(C=C1)CC(=O)O)C MCULE-5790920589 [0,1,0,0,1,0|1,0,0]=3 3100 B12R1.233 CC1=CC(=C(C=C1)CC(=O)O)Cl MCULE-7067379766 [0,1,0,0,1,0|1,0,0]=3 3101 B12R1.233 CC1=CC(=C(C=C1)CC(=O)O)F MCULE-8631108950 [0,1,0,0,1,0|1,0,0]=3 3102 B12R1.233 CC1=CC(=C(C=N1)CC(=O)O)C MCULE-8254971416 [0,1,0,0,1,0|2,0,0]=4 3103 B12R1.233 CC1=CC(=C(N=C1)CC(=O)O)C MCULE-7736112559 [0,1,0,0,1,0|2,0,0]=4 3104 B12R1.233 CC1=CC(=CC=C1CC(=O)O)N MCULE-9777002519 [0,1,0,0,1,0|0,0,0]=2 3105 B12R1.233 CC1=CC(=O)N(C=C1)CC(=O)O MCULE-7679052009 [0,1,0,0,1,0|2,0,0]=4 3106 B12R1.233 CC1=NC(=C(C=C1)CC(=O)O)C MCULE-9860380257 [0,1,0,0,1,0|2,0,0]=4 3107 B12R1.233 CC1=NC(=C(C=C1)CC(=O)O)Cl MCULE-8467917267 [0,1,0,0,1,0|2,0,0]=4 3108 B12R1.233 NC(=O)CC1=C(C=C(C=C1)Br)F MCULE-4043276076 [0,1,0,0,1,0|2,0,0]=4 3109 B12R1.233 NC(=O)CC1=C(C=C(C=C1)Br)O MCULE-6067087314 [0,1,0,0,1,0|2,0,0]=4 3110 B12R1.233 NC(=O)CC1=C(C=C(C=C1)Cl)Cl MCULE-1172227633 [0,1,0,0,1,0|2,0,0]=4 3111 B12R1.233 NC(=O)CC1=C(C=C(C=C1)F)Cl MCULE-8709663761 [0,1,0,0,1,0|2,0,0]=4 3112 B12R1.233 NC(=O)CC1=C(C=C(C=C1)F)F MCULE-5881961240 [0,1,0,0,1,0|2,0,0]=4 3113 B12R1.233 NC(=O)CC1=CC=C(C=C1Br)F MCULE-5750848529 [0,1,0,0,1,0|2,0,0]=4 3114 B12R1.233 NC(=O)CC1=CC=C(C=C1Cl)Br MCULE-2962554658 [0,1,0,0,1,0|2,0,0]=4 3115 B12R1.233 NC(=O)CC1=CC=C(C=C1F)Cl MCULE-9323786573 [0,1,0,0,1,0|2,0,0]=4 3116 B12R1.233 NC1=CC(=C(C=C1)CC(=O)O)N MCULE-7333730188 [0,1,0,0,1,0|0,0,0]=2 3117 B12R1.233 NC1=CC(=CC=C1CC(=O)O)Br MCULE-4890242933 [0,1,0,0,1,0|1,0,0]=3 3118 B12R1.233 NC1=CC(=CC=C1CC(=O)O)Cl MCULE-9674631801 [0,1,0,0,1,0|1,0,0]=3 3119 B12R1.233 NC1=CC(=CN=C1CC(=O)O)Br MCULE-1394234074 [0,1,0,0,1,0|2,0,0]=4 3120 B12R1.233 NC1=CC=C(C(=C1)Cl)CC(=O)O MCULE-6691246040 [0,1,0,0,1,0|0,0,0]=2 3121 B12R1.233 NC1=CC=C(C(=C1)F)CC(=O)O MCULE-5634740386 [0,1,0,0,1,0|0,0,0]=2 3122 B12R1.233 NC1=NC=C(C(=N1)O)CC(=O)O MCULE-1838161084 [0,1,0,0,1,0|2,0,0]=4 3123 B12R1.233 NC1=NC=C(C(=O)N1)CC(=O)O MCULE-5319226343 [0,1,0,0,1,0|2,0,0]=4 3124 B12R1.233 O=C(Cl)CC1=C(C=C(C=C1)Br)F MCULE-7959991222 [0,1,0,0,1,0|2,0,0]=4 3125 B12R1.233 O=C(Cl)CC1=C(C=C(C=C1)F)F MCULE-3443667244 [0,1,0,0,1,0|2,0,0]=4 3126 B12R1.233 O=C(Cl)CC1=CC=C(C=C1Cl)Cl MCULE-3710058642 [0,1,0,0,1,0|2,0,0]=4 3127 B12R1.233 O=C(Cl)CC1=CC=C(C=C1Cl)F MCULE-6316251407 [0,1,0,0,1,0|2,0,0]=4 3128 B12R1.233 O=C(Cl)CC1=CC=C(C=C1F)Cl MCULE-1413298983 [0,1,0,0,1,0|2,0,0]=4 3129 B12R1.233 O=C(O)CC1=C(C=C(C=C1)Br)Cl MCULE-3021722692 [0,1,0,0,1,0|1,0,0]=3 3130 B12R1.233 O=C(O)CC1=C(C=C(C=C1)Br)F MCULE-4227535213 [0,1,0,0,1,0|1,0,0]=3 3131 B12R1.233 O=C(O)CC1=C(C=C(C=C1)Br)I MCULE-2247999003 [0,1,0,0,1,0|1,0,0]=3 3132 B12R1.233 O=C(O)CC1=C(C=C(C=C1)Br)O MCULE-4669631181 [0,1,0,0,1,0|1,0,0]=3 3133 B12R1.233 O=C(O)CC1=C(C=C(C=C1)Cl)Br MCULE-7803992342 [0,1,0,0,1,0|1,0,0]=3 3134 B12R1.233 O=C(O)CC1=C(C=C(C=C1)Cl)Cl MCULE-8695394446 [0,1,0,0,1,0|1,0,0]=3 3135 B12R1.233 O=C(O)CC1=C(C=C(C=C1)F)Br MCULE-3695187673 [0,1,0,0,1,0|1,0,0]=3 3136 B12R1.233 O=C(O)CC1=C(C=C(C=C1)F)F MCULE-4465762639 [0,1,0,0,1,0|1,0,0]=3 3137 B12R1.233 O=C(O)CC1=C(C=C(C=C1)O)Br MCULE-6508107467 [0,1,0,0,1,0|1,0,0]=3 3138 B12R1.233 O=C(O)CC1=C(C=C(C=C1)O)Cl MCULE-8508417408 [0,1,0,0,1,0|1,0,0]=3 3139 B12R1.233 O=C(O)CC1=C(C=C(C=C1)O)O MCULE-3032878286 [0,1,0,0,1,0|1,0,0]=3 3140 B12R1.233 O=C(O)CC1=C(C=C(C=N1)Cl)Cl MCULE-8343298009 [0,1,0,0,1,0|2,0,0]=4 3141 B12R1.233 O=C(O)CC1=C(C=C(N=C1)Cl)Cl MCULE-5864737089 [0,1,0,0,1,0|2,0,0]=4 3142 B12R1.233 O=C(O)CC1=C(N=C(C=C1)Cl)Cl MCULE-7009367523 [0,1,0,0,1,0|2,0,0]=4 3143 B12R1.233 O=C(O)CC1=CC=C(C=C1Br)Br MCULE-2370705020 [0,1,0,0,1,0|1,0,0]=3 3144 B12R1.233 O=C(O)CC1=CC=C(C=C1Cl)F MCULE-3290525297 [0,1,0,0,1,0|1,0,0]=3 3145 B12R1.233 O=C(O)CC1=CC=C(C=C1F)Cl MCULE-9603805917 [0,1,0,0,1,0|1,0,0]=3 3146 B12R1.233 O=C(O)CC1=CC=C(C=C1F)I MCULE-1590103308 [0,1,0,0,1,0|1,0,0]=3 3147 B12R1.233 O=C(O)CC1=CC=C(C=C1F)O MCULE-2606626672 [0,1,0,0,1,0|1,0,0]=3 3148 B12R1.233 O=C(O)CC1=CC=C(C=C1O)F MCULE-1778883844 [0,1,0,0,1,0|1,0,0]=3 3149 B12R1.233 O=C(O)CC1=NC=C(C=C1Br)Cl MCULE-5510813913 [0,1,0,0,1,0|2,0,0]=4 3150 B12R1.233 O=C(O)CC1=NC=C(C=C1Br)F MCULE-7511131176 [0,1,0,0,1,0|2,0,0]=4 3151 B12R1.233 O=C(O)CC1=NC=C(C=C1F)Cl MCULE-1883381360 [0,1,0,0,1,0|2,0,0]=4 3152 B12R1.233 O=C(O)CN1C=CC(=CC1=O)Br MCULE-8317357510 [0,1,0,0,1,0|2,0,0]=4 3153 B12R1.233 OC(=S)CC1=CC=C(C=C1F)F MCULE-2085105888 [0,1,0,0,1,0|1,1,0]=4 3154 B12R1.26 COC(=O)CCC1=CN=C(S1)N MCULE-1046160508 [0,1,0,0,1,0|2,0,0]=4 3155 B12R1.26 COC(=O)CCC1=CSC(=N1)N MCULE-1223783639 [0,1,0,0,1,0|2,0,0]=4 3156 B12R1.26 COC(=O)CCC1=CSC(=N1)N MCULE-3947798981 [0,1,0,0,1,0|2,0,0]=4 3157 B12R1.26 COC(=O)CCC1=CSC(=N1)N MCULE-6685275538 [0,1,0,0,1,0|2,0,0]=4 3158 B12R1.26 COC(=O)CCN1C=CC(=N1)N MCULE-2579531596 [0,1,0,0,1,0|2,0,0]=4 3159 B12R1.59 CCC1=CC=C(O1)CCC(=O)O MCULE-3027738741 [0,1,0,0,1,0|2,0,0]=4 3160 B12R1.59 O=CC1=CN(C=C1)CCC(=O)O MCULE-8258734089 [0,1,0,0,1,0|2,0,0]=4 3161 B12R1.103 CC(CC(=O)O)N1C=C(C=N1)N MCULE-7721605361 [0,1,0,0,1,0|2,0,0]=4 3162 B12R1.103 CC(CC(=O)O)N1C=CC(=N1)N MCULE-6256831001 [0,1,0,0,1,0|2,0,0]=4 3163 B12R1.103 CC1=CC=C(O1)C(N)CC(=O)O MCULE-8580844075 [0,1,0,0,1,0|2,0,0]=4 3164 B12R1.103 CC1=CC=C(S1)C(N)CC(=O)O MCULE-4101944902 [0,1,0,0,1,0|2,0,0]=4 3165 B12R1.103 NC(CC(=O)O)C1=CC=C(O1)Br MCULE-7021694299 [0,1,0,0,1,0|2,0,0]=4 3166 B12R1.103 NC(CC(=O)O)C1=CC=C(S1)Br MCULE-4445497018 [0,1,0,0,1,0|2,0,0]=4 3167 B12R1.104 CC(CC1=CC=C(S1)Cl)C(=O)O MCULE-8162537073 [0,1,0,0,1,0|2,0,0]=4 3168 B12R1.104 CC(CN1C=C(C=N1)N)C(=O)O MCULE-9174895404 [0,1,0,0,1,0|2,0,0]=4 3169 B12R1.104 CC(CN1C=CC(=N1)N)C(=O)O MCULE-6683388855 [0,1,0,0,1,0|2,0,0]=4 3170 B12R1.104 CC1=CC=C(O1)CC(C)C(=O)O MCULE-9134789589 [0,1,0,0,1,0|2,0,0]=4 3171 B12R1.104 CC1=CC=C(S1)CC(C)C(=O)O MCULE-3637404220 [0,1,0,0,1,0|2,0,0]=4 3172 B12R1.104 CC1=CC=C(S1)CC(N)C(=O)O MCULE-7413117787 [0,1,0,0,1,0|2,0,0]=4 3173 B12R1.104 NC(CC1=CC=C(S1)Br)C(=O)O MCULE-5965522969 [0,1,0,0,1,0|2,0,0]=4 3174 B12R1.104 NC(CC1=CC=C(S1)Br)C(=O)O MCULE-6703511722 [0,1,0,0,1,0|2,0,0]=4 3175 B12R1.104 NC1=NC(=CN1)C[C@H](N)C(=O)O MCULE-6106532520 [0,1,0,0,1,0|2,0,0]=4 3176 B12R1.104 N[C@@H](CC1=CC(=CS1)Br)C(=O)O MCULE-8498566253 [0,1,0,0,1,0|2,0,0]=4 3177 B12R1.104 N[C@@H](CC1=CC=C(S1)Br)C(=O)O MCULE-3463438713 [0,1,0,0,1,0|2,0,0]=4 3178 B12R1.104 N[C@@H](CC1=CC=C(S1)Br)C(=O)O MCULE-7727496077 [0,1,0,0,1,0|2,0,0]=4 3179 B12R1.104 N[C@H](CC1=CC=C(S1)Br)C(=O)O MCULE-3916316552 [0,1,0,0,1,0|2,0,0]=4 3180 B12R1.104 N[C@H](CC1=CC=C(S1)Br)C(=O)O MCULE-9244913261 [0,1,0,0,1,0|2,0,0]=4 3181 B12R1.110 NC1=NN(C=C1Br)CCC(=O)O MCULE-1019971638 [0,1,0,0,1,0|2,0,0]=4 3182 B12R1.110 NC1=NN(C=C1Br)CCC(=O)O MCULE-4078796386 [0,1,0,0,1,0|2,0,0]=4 3183 B12R1.110 NC1=NN(C=C1Cl)CCC(=O)O MCULE-3815175417 [0,1,0,0,1,0|2,0,0]=4 3184 B12R1.110 NC1=NN(C=C1I)CCC(=O)O MCULE-1345526196 [0,1,0,0,1,0|2,0,0]=4 3185 B12R1.110 NC1=NN(C=C1I)CCC(=O)O MCULE-7619638340 [0,1,0,0,1,0|2,0,0]=4 3186 B12R1.110 O=C(O)CCC1=CC(=C(O1)Cl)Br MCULE-9794877177 [0,1,0,0,1,0|2,0,0]=4 3187 B12R1.110 O=C(O)CCC1=CC(=C(S1)Br)Br MCULE-8376778937 [0,1,0,0,1,0|2,0,0]=4 3188 B12R1.861 CC1=CC(=C(S1)C)CCC(=O)O MCULE-6277062283 [0,1,0,0,1,0|2,0,0]=4 3189 B12R1.861 CC1=CC(=NN1CCC(=O)O)N MCULE-3864420957 [0,1,0,0,1,0|2,0,0]=4 3190 B12R1.861 CC1=CC(=NN1CCC(=O)O)N MCULE-6021368488 [0,1,0,0,1,0|2,0,0]=4 3191 B14R1.4 CCC1=CC=C(C=C1)CCCC(=O)Cl MCULE-5017037270 [0,1,0,0,0,1|2,0,0]=4 3192 B14R1.4 CCC1=CC=C(C=C1)CCCC(=O)O MCULE-1239593413 [0,1,0,0,0,1|1,0,0]=3 3193 B14R1.4 COC1=CC=C(C=C1)C=CCC(=O)O MCULE-9925377647 [0,1,0,0,0,1|1,0,1]=4 3194 B14R1.4 COC1=CC=C(C=C1)CCCC(=O)Cl MCULE-4702760762 [0,1,0,0,0,1|2,0,0]=4 3195 B14R1.4 COC1=CC=C(C=C1)CCCC(=O)O MCULE-5632676722 [0,1,0,0,0,1|1,0,0]=3 3196 B14R1.4 COC1=CC=C(C=C1)CCNC(=O)C MCULE-7433095797 [0,1,0,0,0,1|2,0,0]=4 3197 B14R1.4 COC1=CC=C(C=C1)CCNC(=O)N MCULE-9025698235 [0,1,0,0,0,1|2,0,0]=4 3198 B14R1.4 COC1=CC=C(C=C1)CCOC(=O)C MCULE-4291079278 [0,1,0,0,0,1|2,0,0]=4 3199 B14R1.4 COC1=CC=C(C=C1)CNCC(=O)O MCULE-6634837056 [0,1,0,0,0,1|1,0,0]=3 3200 B14R1.4 COC1=CC=C(C=C1)CNCC(=O)O MCULE-7938154613 [0,1,0,0,0,1|1,0,0]=3 3201 B14R1.4 COC1=CC=C(C=C1)COCC(=O)O MCULE-9764156781 [0,1,0,0,0,1|1,0,0]=3 3202 B14R1.4 COC1=CC=C(C=C1)CSCC(=O)O MCULE-3811621174 [0,1,0,0,0,1|1,0,0]=3 3203 B14R1.4 COC1=CC=C(C=C1)NCCC(=O)N MCULE-1102695649 [0,1,0,0,0,1|2,0,0]=4 3204 B14R1.4 COC1=CC=C(C=C1)NCCC(=O)O MCULE-6010838619 [0,1,0,0,0,1|1,0,0]=3 3205 B14R1.4 COC1=CC=C(C=C1)OCCC(=O)O MCULE-1562208054 [0,1,0,0,0,1|1,0,0]=3 3206 B14R1.4 COC1=CC=C(C=C1)SCCC(=O)O MCULE-2816541318 [0,1,0,0,0,1|1,0,0]=3 3207 B14R1.4 COC1=NC=C(C=C1)COCC(=O)O MCULE-4438174939 [0,1,0,0,0,1|2,0,0]=4 3208 B14R1.4 CSC1=CC=C(C=C1)CCCC(=O)O MCULE-8185770628 [0,1,0,0,0,1|1,0,0]=3 3209 B14R1.4 CSC1=CC=C(C=C1)CCOC(=O)C MCULE-4941256336 [0,1,0,0,0,1|2,0,0]=4 3210 B14R1.4 CSC1=CC=C(C=C1)CNCC(=O)O MCULE-8063568141 [0,1,0,0,0,1|1,0,0]=3 3211 B14R1.4 CSC1=CC=C(C=C1)OCCC(=O)O MCULE-5036914212 [0,1,0,0,0,1|1,0,0]=3 3212 B14R1.4 N#CC1=CC=C(C=C1)CNCC(=O)O MCULE-6260948963 [0,1,0,0,0,1|0,0,1]=3 3213 B14R1.4 N#CC1=CC=C(C=C1)CSCC(=O)O MCULE-9050458410 [0,1,0,0,0,1|0,0,1]=3 3214 B14R1.4 N#CC1=CC=C(C=C1)OCCC(=O)O MCULE-9749770715 [0,1,0,0,0,1|0,0,1]=3 3215 B14R1.4 N#CC1=CC=C(C=C1)SCCC(=O)O MCULE-4260551232 [0,1,0,0,0,1|0,0,1]=3 3216 B14R1.4 O=C(O)CCOC1=CC=C(C=C1)CO MCULE-8406587577 [0,1,0,0,0,1|1,0,0]=3 3217 B14R1.4 O=CC1=CC=C(C=C1)OCCC(=O)O MCULE-2918023484 [0,1,0,0,0,1|1,0,0]=3 3218 B14R1.13 C=CC(=O)NCCC1=CC=C(C=C1)F MCULE-1263644752 [0,1,0,0,0,1|2,0,0]=4 3219 B14R1.13 CC1=CC=C(C=C1)CCNC(=O)CCl MCULE-9874287249 [0,1,0,0,0,1|2,0,0]=4 3220 B14R1.13 CC1=CC=C(C=C1)CSCC(=O)NN MCULE-1331406285 [0,1,0,0,0,1|2,0,0]=4 3221 B14R1.13 CCC(=O)NCCC1=CC=C(C=C1)F MCULE-2547648258 [0,1,0,0,0,1|2,0,0]=4 3222 B14R1.13 CNC(=O)CCOC1=CC=C(C=C1)F MCULE-1117075319 [0,1,0,0,0,1|2,0,0]=4 3223 B14R1.13 CNC(=O)CCOC1=CC=C(C=C1)N MCULE-2181882253 [0,1,0,0,0,1|1,0,0]=3 3224 B14R1.13 CNC(=O)CCSC1=CC=C(C=C1)C MCULE-3987819704 [0,1,0,0,0,1|2,0,0]=4 3225 B14R1.13 CNC(=O)CCSC1=CC=C(C=C1)Cl MCULE-5052716710 [0,1,0,0,0,1|2,0,0]=4 3226 B14R1.13 CNC(=O)COCC1=CC=C(C=C1)N MCULE-1691480400 [0,1,0,0,0,1|1,0,0]=3 3227 B14R1.13 CNC(=O)CSCC1=CC=C(C=C1)C MCULE-3094727988 [0,1,0,0,0,1|2,0,0]=4 3228 B14R1.13 CNC(=O)CSCC1=CC=C(C=C1)F MCULE-3962864175 [0,1,0,0,0,1|2,0,0]=4 3229 B14R1.13 CNC(=O)NCCC1=CC=C(C=C1)Cl MCULE-1379864116 [0,1,0,0,0,1|2,0,0]=4 3230 B14R1.13 CNC(=O)NCCC1=CC=C(C=C1)F MCULE-1795236573 [0,1,0,0,0,1|2,0,0]=4 3231 B14R1.13 COC(=O)C=CCC1=CC=C(C=C1)O MCULE-1543613311 [0,1,0,0,0,1|1,0,1]=4 3232 B14R1.13 COC(=O)CC=CC1=CC=C(C=C1)F MCULE-2299104838 [0,1,0,0,0,1|1,0,1]=4 3233 B14R1.13 COC(=O)CCCC1=CC=C(C=C1)Br MCULE-2246889753 [0,1,0,0,0,1|1,0,0]=3 3234 B14R1.13 COC(=O)CCCC1=CC=C(C=C1)Cl MCULE-6137132166 [0,1,0,0,0,1|1,0,0]=3 3235 B14R1.13 COC(=O)CCCC1=CC=C(C=C1)F MCULE-4094669343 [0,1,0,0,0,1|1,0,0]=3 3236 B14R1.13 COC(=O)CCCC1=CC=C(C=C1)N MCULE-2842202286 [0,1,0,0,0,1|0,0,0]=2 3237 B14R1.13 COC(=O)CCCC1=CC=C(C=C1)N MCULE-4551733534 [0,1,0,0,0,1|0,0,0]=2 3238 B14R1.13 COC(=O)CCNC1=CC=C(C=C1)Cl MCULE-6345647383 [0,1,0,0,0,1|1,0,0]=3 3239 B14R1.13 COC(=O)CCNC1=CC=C(C=C1)F MCULE-6840660329 [0,1,0,0,0,1|1,0,0]=3 3240 B14R1.13 COC(=O)CCNC1=CC=C(C=C1)O MCULE-5201369574 [0,1,0,0,0,1|1,0,0]=3 3241 B14R1.13 COC(=O)CCOC1=CC=C(C=C1)N MCULE-7022162324 [0,1,0,0,0,1|0,0,0]=2 3242 B14R1.13 COC(=O)CCSC1=CC=C(C=C1)Br MCULE-1785884752 [0,1,0,0,0,1|1,0,0]=3 3243 B14R1.13 COC(=O)CCSC1=CC=C(C=C1)N MCULE-8617161563 [0,1,0,0,0,1|0,0,0]=2 3244 B14R1.13 COC(=O)CNCC1=CC=C(C=C1)Cl MCULE-5439882204 [0,1,0,0,0,1|1,0,0]=3 3245 B14R1.13 COC(=O)CNCC1=CC=C(C=C1)Cl MCULE-9075777469 [0,1,0,0,0,1|1,0,0]=3 3246 B14R1.13 COC(=O)CSCC1=CC=C(C=C1)Br MCULE-9519529788 [0,1,0,0,0,1|1,0,0]=3 3247 B14R1.13 COC(=O)CSCC1=CC=C(C=C1)C MCULE-8436569200 [0,1,0,0,0,1|1,0,0]=3 3248 B14R1.13 COC(=O)CSCC1=CC=C(C=C1)Cl MCULE-1461872395 [0,1,0,0,0,1|1,0,0]=3 3249 B14R1.13 COC(=O)CSCC1=CC=C(C=C1)F MCULE-8252573448 [0,1,0,0,0,1|1,0,0]=3 3250 B14R1.13 COC(=O)NCCC1=CC=C(C=C1)C MCULE-5802888529 [0,1,0,0,0,1|1,0,0]=3 3251 B14R1.13 COC(=O)NCCC1=CC=C(C=C1)Cl MCULE-3085748761 [0,1,0,0,0,1|1,0,0]=3 3252 B14R1.13 NNC(=O)CCCC1=CC=C(C=C1)O MCULE-9261218729 [0,1,0,0,0,1|2,0,0]=4 3253 B14R1.13 NNC(=O)CCSC1=CC=C(C=C1)F MCULE-9036523282 [0,1,0,0,0,1|2,0,0]=4 3254 B14R1.13 NNC(=O)CSCC1=CC=C(C=C1)Br MCULE-2675414027 [0,1,0,0,0,1|2,0,0]=4 3255 B14R1.13 NNC(=O)CSCC1=CC=C(C=C1)Cl MCULE-8918007371 [0,1,0,0,0,1|2,0,0]=4 3256 B14R1.13 NNC(=O)CSCC1=CC=C(C=C1)F MCULE-3254823621 [0,1,0,0,0,1|2,0,0]=4 3257 B14R1.13 O=C(CCl)NCCC1=CC=C(C=C1)Br MCULE-1001834907 [0,1,0,0,0,1|2,0,0]=4 3258 B14R1.13 O=C(CCl)NCCC1=CC=C(C=C1)Cl MCULE-1354517017 [0,1,0,0,0,1|2,0,0]=4 3259 B14R1.13 O=C(CCl)NCCC1=CC=C(C=C1)F MCULE-4611015157 [0,1,0,0,0,1|2,0,0]=4 3260 B14R1.13 O=C(CI)NCCC1=CC=C(C=C1)O MCULE-3065570603 [0,1,0,0,0,1|2,0,0]=4 3261 B14R1.131 CS(=O)(=O)CCOC1=CC=C(C=C1)N MCULE-5800961840 [0,1,0,0,0,1|1,0,1]=4 3262 B14R1.131 CS(=O)(=O)NCCC1=CC=C(C=C1)N MCULE-3755361088 [0,1,0,0,0,1|1,0,1]=4 3263 B14R1.131 O=S(=O)(O)CCCC1=CC=C(C=C1)F MCULE-6327298190 [0,1,0,0,0,1|2,0,0]=4 3264 B14R1.678 C=C(CCC(=O)O)C1=CC=C(C=C1)C MCULE-6477245701 [0,1,0,0,0,1|1,0,0]=3 3265 B14R1.678 CC(=O)CCC(=O)C1=CC=C(C=C1)Br MCULE-8774984944 [0,1,0,0,0,1|2,0,0]=4 3266 B14R1.678 CC(=O)CCC(=O)C1=CC=C(C=C1)Cl MCULE-2365620842 [0,1,0,0,0,1|2,0,0]=4 3267 B14R1.678 CC(=O)NCC(O)C1=CC=C(C=C1)Cl MCULE-9993520858 [0,1,0,0,0,1|2,0,0]=4 3268 B14R1.678 CC(CCC(=O)O)C1=CC=C(C=C1)Br MCULE-6606857325 [0,1,0,0,0,1|1,0,0]=3 3269 B14R1.678 CC(NCC(=O)O)C1=CC=C(C=C1)F MCULE-4649233803 [0,1,0,0,0,1|1,0,0]=3 3270 B14R1.678 CC1=CC=C(C=C1)C(=O)CCC(=O)O MCULE-9689572088 [0,1,0,0,0,1|1,0,0]=3 3271 B14R1.678 CC1=CC=C(C=C1)C(=O)NCC(=O)O MCULE-8012658303 [0,1,0,0,0,1|1,0,1]=4 3272 B14R1.678 CC1=CC=C(C=C1)C(=S)CCC(=O)O MCULE-3272818527 [0,1,0,0,0,1|1,0,0]=3 3273 B14R1.678 CC1=CC=C(C=C1)C(=S)SCC(=O)O MCULE-7049275296 [0,1,0,0,0,1|1,0,1]=4 3274 B14R1.678 CC1=CC=C(C=C1)C(C)CCC(=O)O MCULE-9424902827 [0,1,0,0,0,1|1,0,0]=3 3275 B14R1.678 CC1=CC=C(C=C1)C(N)CCC(=O)O MCULE-6534537933 [0,1,0,0,0,1|1,0,0]=3 3276 B14R1.678 CC1=CC=C(C=C1)C(N)CCC(=O)O MCULE-8934648795 [0,1,0,0,0,1|1,0,0]=3 3277 B14R1.678 CC1=CC=C(C=C1)C(O)CCC(=O)O MCULE-7019370248 [0,1,0,0,0,1|1,0,0]=3 3278 B14R1.678 CN(CCC(=O)O)C1=CC=C(C=C1)F MCULE-5738325558 [0,1,0,0,0,1|1,0,0]=3 3279 B14R1.678 NC(=O)CNC(=O)C1=CC=C(C=C1)N MCULE-8031535339 [0,1,0,0,0,1|1,0,1]=4 3280 B14R1.678 NC(CCC(=O)O)C1=CC=C(C=C1)Br MCULE-5646613493 [0,1,0,0,0,1|1,0,0]=3 3281 B14R1.678 NC(CCC(=O)O)C1=CC=C(C=C1)Br MCULE-8459699060 [0,1,0,0,0,1|1,0,0]=3 3282 B14R1.678 NC(CCC(=O)O)C1=CC=C(C=C1)F MCULE-6014730188 [0,1,0,0,0,1|1,0,0]=3 3283 B14R1.678 NC1=CC=C(C=C1)C(=O)CCC(=O)O MCULE-1176356517 [0,1,0,0,0,1|0,0,0]=2 3284 B14R1.678 NC1=CC=C(C=C1)C(=O)NCC(=O)O MCULE-9532170257 [0,1,0,0,0,1|0,0,1]=3 3285 B14R1.678 NC1=CC=C(C=C1)C(=O)NCC(=O)[O-] MCULE-8947422149 [0,1,0,0,0,1|0,0,2]=4 3286 B14R1.678 O=C(O)CCC(=O)C1=CC=C(C=C1)Br MCULE-7627185295 [0,1,0,0,0,1|1,0,0]=3 3287 B14R1.678 O=C(O)CCC(=O)C1=CC=C(C=C1)Cl MCULE-8379277055 [0,1,0,0,0,1|1,0,0]=3 3288 B14R1.678 O=C(O)CCC(=O)C1=CC=C(C=C1)F MCULE-5194103569 [0,1,0,0,0,1|1,0,0]=3 3289 B14R1.678 O=C(O)CCC(=O)C1=CC=C(C=C1)I MCULE-4939970301 [0,1,0,0,0,1|1,0,0]=3 3290 B14R1.678 O=C(O)CCC(=O)C1=CC=C(C=C1)O MCULE-5425938673 [0,1,0,0,0,1|1,0,0]=3 3291 B14R1.678 O=C(O)CCC(=O)C1=NC=C(C=C1)Cl MCULE-5504476126 [0,1,0,0,0,1|2,0,0]=4 3292 B14R1.678 O=C(O)CCC(O)C1=CC=C(C=C1)F MCULE-3515269984 [0,1,0,0,0,1|1,0,0]=3 3293 B14R1.678 O=C(O)CNC(=O)C1=CC=C(C=C1)Br MCULE-8295376799 [0,1,0,0,0,1|1,0,1]=4 3294 B14R1.678 O=C(O)CNC(=O)C1=CC=C(C=C1)Cl MCULE-8225197193 [0,1,0,0,0,1|1,0,1]=4 3295 B14R1.678 O=C(O)CNC(=O)C1=CC=C(C=C1)F MCULE-3478810812 [0,1,0,0,0,1|1,0,1]=4 3296 B14R1.678 O=C(O)CNC(=O)C1=CC=C(C=C1)I MCULE-1965812925 [0,1,0,0,0,1|1,0,1]=4 3297 B14R1.678 O=C(O)CNC(=O)C1=CC=C(C=C1)O MCULE-6228249828 [0,1,0,0,0,1|1,0,1]=4 3298 B14R1.679 CC(CCC1=CC=C(C=C1)F)C(=O)O MCULE-7601347469 [0,1,0,0,0,1|1,0,0]=3 3299 B14R1.679 CC(CSC1=CC=C(C=C1)Cl)C(=O)O MCULE-3112521304 [0,1,0,0,0,1|1,0,0]=3 3300 B14R1.679 CC(CSC1=CC=C(C=C1)F)C(=O)O MCULE-2133274606 [0,1,0,0,0,1|1,0,0]=3 3301 B14R1.679 CC(NCC1=CC=C(C=C1)Br)C(=O)O MCULE-2384168801 [0,1,0,0,0,1|1,0,0]=3 3302 B14R1.679 CC(NCC1=CC=C(C=C1)Br)C(=O)O MCULE-8448967366 [0,1,0,0,0,1|1,0,0]=3 3303 B14R1.679 CC(NCC1=CC=C(C=C1)Cl)C(=O)O MCULE-7840473961 [0,1,0,0,0,1|1,0,0]=3 3304 B14R1.679 CC(NCC1=CC=C(C=C1)Cl)C(=O)O MCULE-8055402228 [0,1,0,0,0,1|1,0,0]=3 3305 B14R1.679 CC(NCC1=CC=C(C=C1)F)C(=O)O MCULE-4397654115 [0,1,0,0,0,1|1,0,0]=3 3306 B14R1.679 CC(OCC1=CC=C(C=C1)F)C(=O)O MCULE-9307795119 [0,1,0,0,0,1|1,0,0]=3 3307 B14R1.679 CC(SCC1=CC=C(C=C1)Cl)C(=O)O MCULE-5546707192 [0,1,0,0,0,1|1,0,0]=3 3308 B14R1.679 CC(SCC1=CC=C(C=C1)F)C(=O)O MCULE-2671725709 [0,1,0,0,0,1|1,0,0]=3 3309 B14R1.679 CC1=CC=C(C=C1)CCC(N)C(=O)O MCULE-7593182446 [0,1,0,0,0,1|1,0,0]=3 3310 B14R1.679 CC1=CC=C(C=C1)CC[C@@H](N)C(=O)O MCULE-7553433191 [0,1,0,0,0,1|1,0,0]=3 3311 B14R1.679 CC1=CC=C(C=C1)CC[C@H](N)C(=O)O MCULE-2577430347 [0,1,0,0,0,1|1,0,0]=3 3312 B14R1.679 CC1=CC=C(C=C1)CC[C@H](N)C(=O)O MCULE-9957009794 [0,1,0,0,0,1|1,0,0]=3 3313 B14R1.679 CC1=CC=C(C=C1)CNC(C)C(=O)O MCULE-5506818457 [0,1,0,0,0,1|1,0,0]=3 3314 B14R1.679 CC1=CC=C(C=C1)CNC(C)C(=O)O MCULE-6661778351 [0,1,0,0,0,1|1,0,0]=3 3315 B14R1.679 CC1=CC=C(C=C1)COC(C)C(=O)O MCULE-8717484967 [0,1,0,0,0,1|1,0,0]=3 3316 B14R1.679 CC1=CC=C(C=C1)CSC(C)C(=O)O MCULE-8260964496 [0,1,0,0,0,1|1,0,0]=3 3317 B14R1.679 C[C@H](NCC1=CC=C(C=C1)Cl)C(=O)O MCULE-7323499288 [0,1,0,0,0,1|1,0,0]=3 3318 B14R1.679 NC(CCC1=CC=C(C=C1)Br)C(=O)O MCULE-5822068495 [0,1,0,0,0,1|1,0,0]=3 3319 B14R1.679 NC(CCC1=CC=C(C=C1)Cl)C(=O)O MCULE-3171400958 [0,1,0,0,0,1|1,0,0]=3 3320 B14R1.679 NC(CCC1=CC=C(C=C1)F)C(=O)O MCULE-2338285469 [0,1,0,0,0,1|1,0,0]=3 3321 B14R1.679 NC(CCC1=CC=C(C=C1)O)C(=O)O MCULE-6451884872 [0,1,0,0,0,1|1,0,0]=3 3322 B14R1.679 NC(CCC1=CC=C(C=C1)O)C(=O)O MCULE-9678967324 [0,1,0,0,0,1|1,0,0]=3 3323 B14R1.679 NC1=CC=C(C=C1)SCC(N)C(=O)O MCULE-2391910456 [0,1,0,0,0,1|0,0,0]=2 3324 B14R1.679 NC1C=CC(C=C1)CCC(N)C(=O)O MCULE-8753475299 [0,1,0,0,0,1|0,0,2]=4 3325 B14R1.679 N[C@@H](CCC1=CC=C(C=C1)Br)C(=O)O MCULE-9265991531 [0,1,0,0,0,1|1,0,0]=3 3326 B14R1.679 N[C@@H](CCC1=CC=C(C=C1)Br)C(=O)O MCULE-9859600565 [0,1,0,0,0,1|1,0,0]=3 3327 B14R1.679 N[C@@H](CCC1=CC=C(C=C1)Cl)C(=O)O MCULE-6279196888 [0,1,0,0,0,1|1,0,0]=3 3328 B14R1.679 N[C@@H](CCC1=CC=C(C=C1)Cl)C(=O)O MCULE-9257393922 [0,1,0,0,0,1|1,0,0]=3 3329 B14R1.679 N[C@@H](CCC1=CC=C(C=C1)F)C(=O)O MCULE-7504967309 [0,1,0,0,0,1|1,0,0]=3 3330 B14R1.679 N[C@@H](CCC1=CC=C(C=C1)F)C(=O)O MCULE-7706306422 [0,1,0,0,0,1|1,0,0]=3 3331 B14R1.679 N[C@@H](CCC1=CC=C(C=C1)O)C(=O)O MCULE-2626477375 [0,1,0,0,0,1|1,0,0]=3 3332 B14R1.679 N[C@@H](CCC1=CC=C(C=C1)O)C(=O)O MCULE-3675336952 [0,1,0,0,0,1|1,0,0]=3 3333 B14R1.679 N[C@@H](CCC1=CC=C(C=C1)O)C(=O)O MCULE-5741036033 [0,1,0,0,0,1|1,0,0]=3 3334 B14R1.679 N[C@@H](CCC1=CC=C(C=C1)O)C(=O)O MCULE-8049928811 [0,1,0,0,0,1|1,0,0]=3 3335 B14R1.679 N[C@@H](CCC1=CCC(=O)C=C1)C(=O)O MCULE-3740503720 [0,1,0,0,0,1|1,0,1]=4 3336 B14R1.679 N[C@@H](CCC1=CCC(=O)C=C1)C(=O)O MCULE-8182393913 [0,1,0,0,0,1|1,0,1]=4 3337 B14R1.679 N[C@H](CCC1=CC=C(C=C1)F)C(=O)O MCULE-2837159214 [0,1,0,0,0,1|1,0,0]=3 3338 B14R1.679 N[C@H](CCC1=CC=C(C=C1)F)C(=O)O MCULE-3930641365 [0,1,0,0,0,1|1,0,0]=3 3339 B14R1.679 N[C@H](CCC1=CC=C(C=C1)O)C(=O)O MCULE-1730710037 [0,1,0,0,0,1|1,0,0]=3 3340 B14R1.679 N[C@H](CCC1=CC=C(C=C1)O)C(=O)O MCULE-3217987468 [0,1,0,0,0,1|1,0,0]=3 3341 B14R1.679 N[C@H](CCC1=CC=C(C=C1)O)C(=O)O MCULE-5615474996 [0,1,0,0,0,1|1,0,0]=3 3342 B14R1.679 N[C@H](CCC1=CC=C(C=C1)O)C(=O)O MCULE-6439403951 [0,1,0,0,0,1|1,0,0]=3 3343 B14R1.679 O=C(O)C(=O)NCC1=CC=C(C=C1)F MCULE-1132731064 [0,1,0,0,0,1|1,0,1]=4 3344 B14R1.687 CC(=O)NCCC1=CC=C(C(=C1)O)O MCULE-5502584068 [0,1,0,0,0,1|2,0,0]=4 3345 B14R1.687 CC(=O)OCCC1=CC(=C(C=C1)C)C MCULE-8115528094 [0,1,0,0,0,1|2,0,0]=4 3346 B14R1.687 CC(=O)OCCC1=CC(=C(C=C1)C)Cl MCULE-3070189871 [0,1,0,0,0,1|2,0,0]=4 3347 B14R1.687 CC(=O)OCCC1=CC(=C(C=C1)C)F MCULE-7434278371 [0,1,0,0,0,1|2,0,0]=4 3348 B14R1.687 CC(=O)OCCC1=CC(=C(C=C1)Cl)C MCULE-1176026764 [0,1,0,0,0,1|2,0,0]=4 3349 B14R1.687 CC(=O)OCCC1=CC(=C(C=C1)Cl)Cl MCULE-4821754024 [0,1,0,0,0,1|2,0,0]=4 3350 B14R1.687 CC(=O)OCCC1=CC(=C(C=C1)Cl)F MCULE-7801395298 [0,1,0,0,0,1|2,0,0]=4 3351 B14R1.687 CC(=O)OCCC1=CC(=C(C=C1)F)C MCULE-3013424122 [0,1,0,0,0,1|2,0,0]=4 3352 B14R1.687 CC(=O)OCCC1=CC(=C(C=C1)F)Cl MCULE-9935033539 [0,1,0,0,0,1|2,0,0]=4 3353 B14R1.687 CC(=O)OCCC1=CC(=C(C=C1)F)F MCULE-6690539001 [0,1,0,0,0,1|2,0,0]=4 3354 B14R1.687 CC(=O)OCCC1=CC(=C(C=C1)O)O MCULE-4175187037 [0,1,0,0,0,1|2,0,0]=4 3355 B14R1.687 CC1=C(C=C(C=C1)NCCC(=O)O)Cl MCULE-6084064902 [0,1,0,0,0,1|1,0,0]=3 3356 B14R1.687 CC1=C(C=C(C=C1)OCCC(=O)O)C MCULE-9574936062 [0,1,0,0,0,1|1,0,0]=3 3357 B14R1.687 CC1=C(C=C(C=C1)SCCC(=O)O)C MCULE-5903675690 [0,1,0,0,0,1|1,0,0]=3 3358 B14R1.687 CC1=C(C=CC(=C1)OCCC(=O)N)N MCULE-2716118763 [0,1,0,0,0,1|1,0,0]=3 3359 B14R1.687 CC1=C(C=CC(=C1)OCCC(=O)N)N MCULE-4553283087 [0,1,0,0,0,1|1,0,0]=3 3360 B14R1.687 CC1=C(C=CC(=C1)OCCC(=O)O)Cl MCULE-4858161102 [0,1,0,0,0,1|1,0,0]=3 3361 B14R1.687 CC1=CC(=CC=C1F)/C=C/CC(=O)O MCULE-8370825154 [0,1,0,0,0,1|1,0,1]=4 3362 B14R1.687 CC1=CC(=CC=C1F)CCCC(=O)O MCULE-3603644626 [0,1,0,0,0,1|1,0,0]=3 3363 B14R1.687 CC1=CC=C(C=C1Br)CCCC(=O)O MCULE-2903245343 [0,1,0,0,0,1|1,0,0]=3 3364 B14R1.687 CC1=CC=C(C=C1C)CCCC(=O)O MCULE-8685488359 [0,1,0,0,0,1|1,0,0]=3 3365 B14R1.687 CC1=CC=C(C=C1F)OCCC(=O)O MCULE-6767494075 [0,1,0,0,0,1|1,0,0]=3 3366 B14R1.687 NC(=O)CNCC1=CC=C(C(=C1)F)Br MCULE-5367016740 [0,1,0,0,0,1|2,0,0]=4 3367 B14R1.687 O=C(O)CCCC1=CC(=C(C=C1)Cl)Cl MCULE-3721556783 [0,1,0,0,0,1|1,0,0]=3 3368 B14R1.687 O=C(O)CCCC1=CC(=C(C=C1)F)F MCULE-7710428932 [0,1,0,0,0,1|1,0,0]=3 3369 B14R1.687 O=C(O)CCCC1=CC(=C(C=C1)O)F MCULE-5641742594 [0,1,0,0,0,1|1,0,0]=3 3370 B14R1.687 O=C(O)CCNC1=CC(=C(C=C1)Br)F MCULE-9717969883 [0,1,0,0,0,1|1,0,0]=3 3371 B14R1.687 O=C(O)CCOC1=CC(=C(C=C1)Cl)Cl MCULE-7972602691 [0,1,0,0,0,1|1,0,0]=3 3372 B14R1.687 O=C(O)CCOC1=CC(=C(C=C1)Cl)F MCULE-9114694165 [0,1,0,0,0,1|1,0,0]=3 3373 B14R1.687 O=C(O)CCOC1=CC(=C(C=C1)F)Cl MCULE-9420332952 [0,1,0,0,0,1|1,0,0]=3 3374 B14R1.687 O=C(O)CCOC1=CC(=C(C=C1)F)F MCULE-4911855292 [0,1,0,0,0,1|1,0,0]=3 3375 B14R1.687 O=C(O)CCOC1=CC=C(C(=C1)F)Br MCULE-3383444113 [0,1,0,0,0,1|1,0,0]=3 3376 B14R1.687 O=C(O)CCSC1=CC(=C(C=C1)F)F MCULE-8872730518 [0,1,0,0,0,1|1,0,0]=3 3377 B14R1.687 O=C(O)CNCC1=CC=C(C(=C1)Cl)Cl MCULE-6042602272 [0,1,0,0,0,1|1,0,0]=3 3378 B14R1.687 O=C(O)COCC1=CC(=C(C=C1)Cl)Cl MCULE-9519870724 [0,1,0,0,0,1|1,0,0]=3 3379 B14R1.687 O=C(O)CSCC1=CC=C(C(=C1)Cl)Cl MCULE-3841373405 [0,1,0,0,0,1|1,0,0]=3 3380 B14R1.698 CC(=O)NC(C)CC1=CC=C(C=C1)O MCULE-2890211848 [0,1,0,0,0,1|2,0,0]=4 3381 B14R1.698 CC(CC(=O)O)CC1=CC=C(C=C1)Cl MCULE-9529138287 [0,1,0,0,0,1|1,0,0]=3 3382 B14R1.698 CC(CC(=O)O)SC1=CC=C(C=C1)Cl MCULE-5685775413 [0,1,0,0,0,1|1,0,0]=3 3383 B14R1.698 CC1=CC=C(C=C1)CC(=O)CC(=O)Cl MCULE-1815927553 [0,1,0,0,0,1|2,0,0]=4 3384 B14R1.698 CC1=CC=C(C=C1)CC(=O)CC(=O)O MCULE-8624469597 [0,1,0,0,0,1|1,0,0]=3 3385 B14R1.698 CC1=CC=C(C=C1)CC(N)CC(=O)O MCULE-6353710442 [0,1,0,0,0,1|1,0,0]=3 3386 B14R1.698 CC1=CC=C(C=C1)CC(N)CC(=O)O MCULE-9504398730 [0,1,0,0,0,1|1,0,0]=3 3387 B14R1.698 CC1=CC=C(C=C1)CN(C)CC(=O)O MCULE-4250763131 [0,1,0,0,0,1|1,0,0]=3 3388 B14R1.698 CC1=CC=C(C=C1)CN(C)CC(=O)O MCULE-8499867866 [0,1,0,0,0,1|1,0,0]=3 3389 B14R1.698 CC1=CC=C(C=C1)C[C@@H](N)CC(=O)O MCULE-1265682222 [0,1,0,0,0,1|1,0,0]=3 3390 B14R1.698 CC1=CC=C(C=C1)C[C@@H](N)CC(=O)O MCULE-2802558766 [0,1,0,0,0,1|1,0,0]=3 3391 B14R1.698 CC1=CC=C(C=C1)C[C@@H](N)CC(=O)O MCULE-6445530808 [0,1,0,0,0,1|1,0,0]=3 3392 B14R1.698 CC1=CC=C(C=C1)C[C@@H](N)CC(=O)O MCULE-6976449659 [0,1,0,0,0,1|1,0,0]=3 3393 B14R1.698 CC1=CC=C(C=C1)C[C@H](N)CC(=O)O MCULE-3158215549 [0,1,0,0,0,1|1,0,0]=3 3394 B14R1.698 CC1=CC=C(C=C1)C[C@H](N)CC(=O)O MCULE-3271897565 [0,1,0,0,0,1|1,0,0]=3 3395 B14R1.698 CC1=CC=C(C=C1)C[C@H](N)CC(=O)O MCULE-3358498761 [0,1,0,0,0,1|1,0,0]=3 3396 B14R1.698 CC1=CC=C(C=C1)C[C@H](N)CC(=O)O MCULE-5208172708 [0,1,0,0,0,1|1,0,0]=3 3397 B14R1.698 CC1=CC=C(C=C1)NC(=O)CC(=O)O MCULE-3853963836 [0,1,0,0,0,1|1,0,1]=4 3398 B14R1.698 CN(CC(=O)O)CC1=CC=C(C=C1)Br MCULE-3604092040 [0,1,0,0,0,1|1,0,0]=3 3399 B14R1.698 CN(CC(=O)O)CC1=CC=C(C=C1)Cl MCULE-9469432220 [0,1,0,0,0,1|1,0,0]=3 3400 B14R1.698 CN(CC(=O)O)CC1=CC=C(C=C1)F MCULE-1797270627 [0,1,0,0,0,1|1,0,0]=3 3401 B14R1.698 CN(CC(=O)O)CC1=CC=C(C=C1)F MCULE-8562834841 [0,1,0,0,0,1|1,0,0]=3 3402 B14R1.698 CN(CC(=O)O)CC1=CC=C(N=C1)Br MCULE-6402479299 [0,1,0,0,0,1|2,0,0]=4 3403 B14R1.698 CN(CC(=O)O)CC1=CC=C(N=C1)Cl MCULE-5931611934 [0,1,0,0,0,1|2,0,0]=4 3404 B14R1.698 NC(CC(=O)O)CC1=CC=C(C=C1)Br MCULE-1974214582 [0,1,0,0,0,1|1,0,0]=3 3405 B14R1.698 NC(CC(=O)O)CC1=CC=C(C=C1)Br MCULE-9984331080 [0,1,0,0,0,1|1,0,0]=3 3406 B14R1.698 NC(CC(=O)O)CC1=CC=C(C=C1)Cl MCULE-1228143086 [0,1,0,0,0,1|1,0,0]=3 3407 B14R1.698 NC(CC(=O)O)CC1=CC=C(C=C1)Cl MCULE-3935388999 [0,1,0,0,0,1|1,0,0]=3 3408 B14R1.698 NC(CC(=O)O)CC1=CC=C(C=C1)F MCULE-3423605097 [0,1,0,0,0,1|1,0,0]=3 3409 B14R1.698 NC(CC(=O)O)CC1=CC=C(C=C1)F MCULE-5859176812 [0,1,0,0,0,1|1,0,0]=3 3410 B14R1.698 NC(CC(=O)O)CC1=CC=C(C=C1)I MCULE-3591042703 [0,1,0,0,0,1|1,0,0]=3 3411 B14R1.698 NC(CC(=O)O)CC1=CC=C(C=C1)I MCULE-5049438759 [0,1,0,0,0,1|1,0,0]=3 3412 B14R1.698 NC(CC(=O)O)CC1=CC=C(C=C1)O MCULE-4129702473 [0,1,0,0,0,1|1,0,0]=3 3413 B14R1.698 NC(CC(=O)O)CC1=CC=C(C=C1)O MCULE-7647363388 [0,1,0,0,0,1|1,0,0]=3 3414 B14R1.698 N[C@@H](CC(=O)O)CC1=CC=C(C=C1)Br MCULE-4945653014 [0,1,0,0,0,1|1,0,0]=3 3415 B14R1.698 N[C@@H](CC(=O)O)CC1=CC=C(C=C1)Br MCULE-5453470367 [0,1,0,0,0,1|1,0,0]=3 3416 B14R1.698 N[C@@H](CC(=O)O)CC1=CC=C(C=C1)Br MCULE-7920013203 [0,1,0,0,0,1|1,0,0]=3 3417 B14R1.698 N[C@@H](CC(=O)O)CC1=CC=C(C=C1)Br MCULE-9322823350 [0,1,0,0,0,1|1,0,0]=3 3418 B14R1.698 N[C@@H](CC(=O)O)CC1=CC=C(C=C1)Cl MCULE-1983299574 [0,1,0,0,0,1|1,0,0]=3 3419 B14R1.698 N[C@@H](CC(=O)O)CC1=CC=C(C=C1)Cl MCULE-3332084066 [0,1,0,0,0,1|1,0,0]=3 3420 B14R1.698 N[C@@H](CC(=O)O)CC1=CC=C(C=C1)Cl MCULE-5183250192 [0,1,0,0,0,1|1,0,0]=3 3421 B14R1.698 N[C@@H](CC(=O)O)CC1=CC=C(C=C1)Cl MCULE-8706330527 [0,1,0,0,0,1|1,0,0]=3 3422 B14R1.698 N[C@@H](CC(=O)O)CC1=CC=C(C=C1)F MCULE-2957364999 [0,1,0,0,0,1|1,0,0]=3 3423 B14R1.698 N[C@@H](CC(=O)O)CC1=CC=C(C=C1)F MCULE-3763118774 [0,1,0,0,0,1|1,0,0]=3 3424 B14R1.698 N[C@@H](CC(=O)O)CC1=CC=C(C=C1)F MCULE-3973372859 [0,1,0,0,0,1|1,0,0]=3 3425 B14R1.698 N[C@@H](CC(=O)O)CC1=CC=C(C=C1)F MCULE-6337039742 [0,1,0,0,0,1|1,0,0]=3 3426 B14R1.698 N[C@@H](CC(=O)O)CC1=CC=C(C=C1)I MCULE-1176602478 [0,1,0,0,0,1|1,0,0]=3 3427 B14R1.698 N[C@@H](CC(=O)O)CC1=CC=C(C=C1)I MCULE-3352593168 [0,1,0,0,0,1|1,0,0]=3 3428 B14R1.698 N[C@@H](CC(=O)O)CC1=CC=C(C=C1)I MCULE-7598774388 [0,1,0,0,0,1|1,0,0]=3 3429 B14R1.698 N[C@@H](CC(=O)O)CC1=CC=C(C=C1)I MCULE-9899950488 [0,1,0,0,0,1|1,0,0]=3 3430 B14R1.698 N[C@H](CC(=O)O)CC1=CC=C(C=C1)Br MCULE-2748291502 [0,1,0,0,0,1|1,0,0]=3 3431 B14R1.698 N[C@H](CC(=O)O)CC1=CC=C(C=C1)Br MCULE-4447023550 [0,1,0,0,0,1|1,0,0]=3 3432 B14R1.698 N[C@H](CC(=O)O)CC1=CC=C(C=C1)Br MCULE-5867611218 [0,1,0,0,0,1|1,0,0]=3 3433 B14R1.698 N[C@H](CC(=O)O)CC1=CC=C(C=C1)Br MCULE-9536655725 [0,1,0,0,0,1|1,0,0]=3 3434 B14R1.698 N[C@H](CC(=O)O)CC1=CC=C(C=C1)Cl MCULE-2582093229 [0,1,0,0,0,1|1,0,0]=3 3435 B14R1.698 N[C@H](CC(=O)O)CC1=CC=C(C=C1)Cl MCULE-3433994818 [0,1,0,0,0,1|1,0,0]=3 3436 B14R1.698 N[C@H](CC(=O)O)CC1=CC=C(C=C1)Cl MCULE-7136667972 [0,1,0,0,0,1|1,0,0]=3 3437 B14R1.698 N[C@H](CC(=O)O)CC1=CC=C(C=C1)Cl MCULE-8484541043 [0,1,0,0,0,1|1,0,0]=3 3438 B14R1.698 N[C@H](CC(=O)O)CC1=CC=C(C=C1)F MCULE-1175787305 [0,1,0,0,0,1|1,0,0]=3 3439 B14R1.698 N[C@H](CC(=O)O)CC1=CC=C(C=C1)F MCULE-3064488499 [0,1,0,0,0,1|1,0,0]=3 3440 B14R1.698 N[C@H](CC(=O)O)CC1=CC=C(C=C1)F MCULE-4826661458 [0,1,0,0,0,1|1,0,0]=3 3441 B14R1.698 N[C@H](CC(=O)O)CC1=CC=C(C=C1)F MCULE-5537812689 [0,1,0,0,0,1|1,0,0]=3 3442 B14R1.698 N[C@H](CC(=O)O)CC1=CC=C(C=C1)I MCULE-2263852417 [0,1,0,0,0,1|1,0,0]=3 3443 B14R1.698 N[C@H](CC(=O)O)CC1=CC=C(C=C1)I MCULE-3574988594 [0,1,0,0,0,1|1,0,0]=3 3444 B14R1.698 N[C@H](CC(=O)O)CC1=CC=C(C=C1)I MCULE-4802649525 [0,1,0,0,0,1|1,0,0]=3 3445 B14R1.698 N[C@H](CC(=O)O)CC1=CC=C(C=C1)I MCULE-6577170232 [0,1,0,0,0,1|1,0,0]=3 3446 B14R1.698 N[C@H](CC(=O)O)CC1=CC=C(C=C1)O MCULE-6164100507 [0,1,0,0,0,1|1,0,0]=3 3447 B14R1.698 N[C@H](CC(=O)O)CC1=CC=C(C=C1)O MCULE-7138328950 [0,1,0,0,0,1|1,0,0]=3 3448 B14R1.698 N[C@H](CC(=O)O)CC1=CC=C(C=C1)O MCULE-7211522132 [0,1,0,0,0,1|1,0,0]=3 3449 B14R1.698 N[C@H](CC(=O)O)CC1=CC=C(C=C1)O MCULE-8499920438 [0,1,0,0,0,1|1,0,0]=3 3450 B14R1.698 O=C(Cl)CC(=O)CC1=CC=C(C=C1)Cl MCULE-8640743692 [0,1,0,0,0,1|2,0,0]=4 3451 B14R1.698 O=C(Cl)CC(=O)CC1=CC=C(C=C1)F MCULE-7923051834 [0,1,0,0,0,1|2,0,0]=4 3452 B14R1.698 O=C(O)CC(=O)CC1=CC=C(C=C1)Cl MCULE-9912857653 [0,1,0,0,0,1|1,0,0]=3 3453 B14R1.698 O=C(O)CC(=O)CC1=CC=C(C=C1)F MCULE-9649309247 [0,1,0,0,0,1|1,0,0]=3 3454 B14R1.698 O=C(O)CC(=O)NC1=CC=C(C=C1)Br MCULE-6792198523 [0,1,0,0,0,1|1,0,1]=4 3455 B14R1.698 O=C(O)CC(=O)NC1=CC=C(C=C1)Cl MCULE-2661843013 [0,1,0,0,0,1|1,0,1]=4 3456 B14R1.698 O=C(O)CC(=O)NC1=CC=C(C=C1)F MCULE-2071362837 [0,1,0,0,0,1|1,0,1]=4 3457 B14R1.698 O=C(O)CC(=O)NC1=CC=C(C=C1)O MCULE-3903375021 [0,1,0,0,0,1|1,0,1]=4 3458 B14R1.698 O=C(O)CC(=O)OC1=CC=C(C=C1)Cl MCULE-6701789757 [0,1,0,0,0,1|1,0,1]=4 3459 B14R1.698 O=C(O)CC(=O)OC1=CC=C(C=C1)F MCULE-6337240419 [0,1,0,0,0,1|1,0,1]=4 3460 B14R1.698 O=C(O)CS(=O)CC1=CC=C(C=C1)Br MCULE-1528193590 [0,1,0,0,0,1|1,0,0]=3 3461 B14R1.4464 CC(=O)OCCC1=C(C=C(C=C1)Cl)C MCULE-3446706494 [0,1,0,0,0,1|2,0,0]=4 3462 B14R1.4464 CC(=O)OCCC1=C(C=C(C=C1)F)C MCULE-9546509368 [0,1,0,0,0,1|2,0,0]=4 3463 B14R1.4464 CC(=O)OCCC1=CC=C(C=C1C)C MCULE-4148788484 [0,1,0,0,0,1|2,0,0]=4 3464 B14R1.4464 CC1=C(C=CC(=O)O1)CCCC(=O)O MCULE-3728750785 [0,1,0,0,0,1|2,0,0]=4 3465 B14R1.4464 CC1=CC(=C(C=C1)CCCC(=O)O)C MCULE-6429348347 [0,1,0,0,0,1|1,0,0]=3 3466 B14R1.4464 CC1=CC(=C(C=C1)NCCC(=O)O)C MCULE-8937929472 [0,1,0,0,0,1|1,0,0]=3 3467 B14R1.4464 CC1=CC(=C(C=C1)OCCC(=O)O)Br MCULE-1569138367 [0,1,0,0,0,1|1,0,0]=3 3468 B14R1.4464 CC1=CC(=C(C=C1)OCCC(=O)O)C MCULE-8861685281 [0,1,0,0,0,1|1,0,0]=3 3469 B14R1.4464 CC1=CC(=C(C=C1)OCCC(=O)O)Cl MCULE-1775946448 [0,1,0,0,0,1|1,0,0]=3 3470 B14R1.4464 CC1=CC=C(C(=C1)C)CSCC(=O)O MCULE-7999070379 [0,1,0,0,0,1|1,0,0]=3 3471 B14R1.4464 CC1=CC=C(C(=C1)N)CCCC(=O)O MCULE-6287309653 [0,1,0,0,0,1|1,0,0]=3 3472 B14R1.4464 NC(=O)CCCC1=CC=C(C=C1F)Br MCULE-8956550042 [0,1,0,0,0,1|2,0,0]=4 3473 B14R1.4464 NC(=O)CNCC1=CC=C(C=C1Br)F MCULE-5427582059 [0,1,0,0,0,1|2,0,0]=4 3474 B14R1.4464 O=C(O)CC=CC1=C(C=C(C=C1)F)F MCULE-9044702043 [0,1,0,0,0,1|1,0,1]=4 3475 B14R1.4464 O=C(O)CCCC1=C(C=C(C=C1)F)F MCULE-9598853751 [0,1,0,0,0,1|1,0,0]=3 3476 B14R1.4464 O=C(O)CCCC1=CC=C(C=C1Cl)Cl MCULE-7859824346 [0,1,0,0,0,1|1,0,0]=3 3477 B14R1.4464 O=C(O)CCNC1=C(C=C(C=C1)Br)Br MCULE-4348866063 [0,1,0,0,0,1|1,0,0]=3 3478 B14R1.4464 O=C(O)CCOC1=C(C=C(C=C1)Br)F MCULE-1885140852 [0,1,0,0,0,1|1,0,0]=3 3479 B14R1.4464 O=C(O)CCOC1=C(C=C(C=C1)Cl)Br MCULE-5896288418 [0,1,0,0,0,1|1,0,0]=3 3480 B14R1.4464 O=C(O)CCOC1=C(C=C(C=C1)Cl)Cl MCULE-8424249224 [0,1,0,0,0,1|1,0,0]=3 3481 B14R1.4464 O=C(O)CCOC1=C(C=C(C=C1)F)Cl MCULE-2527512254 [0,1,0,0,0,1|1,0,0]=3 3482 B14R1.4464 O=C(O)CCOC1=C(C=C(C=C1)F)F MCULE-5054937813 [0,1,0,0,0,1|1,0,0]=3 3483 B14R1.4464 O=C(O)CN=CC1=C(C=C(C=C1)O)O MCULE-1393417872 [0,1,0,0,0,1|1,0,1]=4 3484 B14R1.4464 O=C(O)CNCC1=C(C=C(C=C1)Cl)Cl MCULE-3425323285 [0,1,0,0,0,1|1,0,0]=3 3485 B14R1.4464 O=C(O)CNCC1=CC=C(C=C1Cl)Cl MCULE-7687146597 [0,1,0,0,0,1|1,0,0]=3 3486 B14R1.4464 O=C(O)CSCC1=C(C=C(C=C1)Br)F MCULE-7838645189 [0,1,0,0,0,1|1,0,0]=3 3487 B14R1.4464 O=C(O)CSCC1=C(C=C(C=C1)Cl)Cl MCULE-7733755757 [0,1,0,0,0,1|1,0,0]=3 3488 B14R1.2 CCC1=CC=C(C=C1)C(C)CC(=O)Cl MCULE-4100088683 [0,2,0,0,0,0|2,0,0]=4 3489 B14R1.2 CCC1=CC=C(C=C1)C(C)CC(=O)O MCULE-1027477779 [0,2,0,0,0,0|1,0,0]=3 3490 B14R1.2 CCC1=CC=C(C=C1)C(N)CC(=O)O MCULE-1402837319 [0,2,0,0,0,0|1,0,0]=3 3491 B14R1.2 CCC1=CC=C(C=C1)C(N)CC(=O)O MCULE-8716705127 [0,2,0,0,0,0|1,0,0]=3 3492 B14R1.2 CCC1=CC=C(C=C1)[C@@H](N)CC(=O)O MCULE-3274804710 [0,2,0,0,0,0|1,0,0]=3 3493 B14R1.2 CCC1=CC=C(C=C1)[C@@H](N)CC(=O)O MCULE-3396442991 [0,2,0,0,0,0|1,0,0]=3 3494 B14R1.2 CCC1=CC=C(C=C1)[C@@H](N)CC(=O)O MCULE-4305049490 [0,2,0,0,0,0|1,0,0]=3 3495 B14R1.2 CCC1=CC=C(C=C1)[C@@H](N)CC(=O)O MCULE-8892281063 [0,2,0,0,0,0|1,0,0]=3 3496 B14R1.2 CCC1=CC=C(C=C1)[C@H](N)CC(=O)O MCULE-3682890825 [0,2,0,0,0,0|1,0,0]=3 3497 B14R1.2 CCC1=CC=C(C=C1)[C@H](N)CC(=O)O MCULE-4954055928 [0,2,0,0,0,0|1,0,0]=3 3498 B14R1.2 CCC1=CC=C(C=C1)[C@H](N)CC(=O)O MCULE-6859473787 [0,2,0,0,0,0|1,0,0]=3 3499 B14R1.2 CCC1=CC=C(C=C1)[C@H](N)CC(=O)O MCULE-7522732567 [0,2,0,0,0,0|1,0,0]=3 3500 B14R1.2 CN(CC(=O)O)C1=CC=C(C=C1)C=O MCULE-9885874668 [0,2,0,0,0,0|2,0,0]=4 3501 B14R1.2 COC1=CC=C(C=C1)C(C)CC(=O)N MCULE-3401893194 [0,2,0,0,0,0|2,0,0]=4 3502 B14R1.2 COC1=CC=C(C=C1)C(C)CC(=O)O MCULE-2901963818 [0,2,0,0,0,0|1,0,0]=3 3503 B14R1.2 COC1=CC=C(C=C1)C(N)CC(=O)O MCULE-1417323379 [0,2,0,0,0,0|1,0,0]=3 3504 B14R1.2 COC1=CC=C(C=C1)C(N)CC(=O)O MCULE-1419236168 [0,2,0,0,0,0|1,0,0]=3 3505 B14R1.2 COC1=CC=C(C=C1)C(N)CC(=O)O MCULE-1449619305 [0,2,0,0,0,0|1,0,0]=3 3506 B14R1.2 COC1=CC=C(C=C1)C(O)CC(=O)O MCULE-3811211060 [0,2,0,0,0,0|1,0,0]=3 3507 B14R1.2 COC1=CC=C(C=C1)[C@@H](N)CC(=O)O MCULE-4530719110 [0,2,0,0,0,0|1,0,0]=3 3508 B14R1.2 COC1=CC=C(C=C1)[C@@H](N)CC(=O)O MCULE-5597055272 [0,2,0,0,0,0|1,0,0]=3 3509 B14R1.2 COC1=CC=C(C=C1)[C@H](N)CC(=O)O MCULE-3956873654 [0,2,0,0,0,0|1,0,0]=3 3510 B14R1.2 COC1=CC=C(C=C1)[C@H](N)CC(=O)O MCULE-5995676075 [0,2,0,0,0,0|1,0,0]=3 3511 B14R1.2 COC1=CC=C(C=N1)C(N)CC(=O)O MCULE-7266264817 [0,2,0,0,0,0|2,0,0]=4 3512 B14R1.2 COC1=CC=C(C=N1)C(N)CC(=O)O MCULE-7856414413 [0,2,0,0,0,0|2,0,0]=4 3513 B14R1.2 COC1=CC=C(C=N1)[C@@H](N)CC(=O)O MCULE-1661205396 [0,2,0,0,0,0|2,0,0]=4 3514 B14R1.2 COC1=CC=C(C=N1)[C@@H](N)CC(=O)O MCULE-1940635096 [0,2,0,0,0,0|2,0,0]=4 3515 B14R1.2 COC1=CC=C(C=N1)[C@@H](N)CC(=O)O MCULE-9081805927 [0,2,0,0,0,0|2,0,0]=4 3516 B14R1.2 COC1=CC=C(C=N1)[C@H](N)CC(=O)O MCULE-5662082570 [0,2,0,0,0,0|2,0,0]=4 3517 B14R1.2 COC1=NC=C(C=C1)[C@@H](N)CC(=O)O MCULE-7104653042 [0,2,0,0,0,0|2,0,0]=4 3518 B14R1.2 COC1=NC=C(C=C1)[C@H](N)CC(=O)O MCULE-8312791192 [0,2,0,0,0,0|2,0,0]=4 3519 B14R1.2 CSC1=CC=C(C=C1)C(N)CC(=O)O MCULE-9121210002 [0,2,0,0,0,0|1,0,0]=3 3520 B14R1.2 N#CC1=CC=C(C=C1)C(N)CC(=O)O MCULE-2126604515 [0,2,0,0,0,0|0,0,1]=3 3521 B14R1.2 N#CC1=CC=C(C=C1)C(N)CC(=O)O MCULE-4471155507 [0,2,0,0,0,0|0,0,1]=3 3522 B14R1.2 N#CC1=CC=C(C=C1)[C@@H](N)CC(=O)O MCULE-5310170309 [0,2,0,0,0,0|0,0,1]=3 3523 B14R1.2 N#CC1=CC=C(C=C1)[C@@H](N)CC(=O)O MCULE-9103721862 [0,2,0,0,0,0|0,0,1]=3 3524 B14R1.2 N#CC1=CC=C(C=C1)[C@H](N)CC(=O)O MCULE-7246140569 [0,2,0,0,0,0|0,0,1]=3 3525 B14R1.2 N#CC1=CC=C(C=C1)[C@H](N)CC(=O)O MCULE-9060140757 [0,2,0,0,0,0|0,0,1]=3 3526 B14R1.3 C#CC1=CC=C(C=C1)C[C@H](N)C(=O)O MCULE-1757013063 [0,2,0,0,0,0|1,0,0]=3 3527 B14R1.3 C#CC1=CC=C(C=C1)C[C@H](N)C(=O)O MCULE-5096512203 [0,2,0,0,0,0|1,0,0]=3 3528 B14R1.3 C#CC1=CC=C(C=C1)C[C@H](N)C(=O)O MCULE-6388344702 [0,2,0,0,0,0|1,0,0]=3 3529 B14R1.3 C#CC1=CC=C(C=C1)C[C@H](N)C(=O)O MCULE-6865167163 [0,2,0,0,0,0|1,0,0]=3 3530 B14R1.3 C=CC1=CC=C(C=C1)CC(N)C(=O)O MCULE-3640424940 [0,2,0,0,0,0|1,0,0]=3 3531 B14R1.3 C=CC1=CC=C(C=C1)CC(N)C(=O)O MCULE-4919162155 [0,2,0,0,0,0|1,0,0]=3 3532 B14R1.3 C=CC1=CC=C(C=C1)C[C@@H](N)C(=O)O MCULE-1388766528 [0,2,0,0,0,0|1,0,0]=3 3533 B14R1.3 C=CC1=CC=C(C=C1)C[C@@H](N)C(=O)O MCULE-5394373702 [0,2,0,0,0,0|1,0,0]=3 3534 B14R1.3 C=CC1=CC=C(C=C1)C[C@@H](N)C(=O)O MCULE-8116782854 [0,2,0,0,0,0|1,0,0]=3 3535 B14R1.3 C=CC1=CC=C(C=C1)C[C@@H](N)C(=O)O MCULE-8542266874 [0,2,0,0,0,0|1,0,0]=3 3536 B14R1.3 C=CC1=CC=C(C=C1)C[C@H](N)C(=O)O MCULE-2125734382 [0,2,0,0,0,0|1,0,0]=3 3537 B14R1.3 C=CC1=CC=C(C=C1)C[C@H](N)C(=O)O MCULE-7672762061 [0,2,0,0,0,0|1,0,0]=3 3538 B14R1.3 CC(CC1=CC=C(C=C1)C#N)C(=O)O MCULE-7266176141 [0,2,0,0,0,0|0,0,1]=3 3539 B14R1.3 CC(OC1=CC=C(C=C1)C#N)C(=O)O MCULE-9523498429 [0,2,0,0,0,0|1,0,1]=4 3540 B14R1.3 CC(OC1=CC=C(C=C1)C=O)C(=O)O MCULE-2388554867 [0,2,0,0,0,0|2,0,0]=4 3541 B14R1.3 CC(OC1=CC=C(C=C1)CO)C(=O)O MCULE-2572638120 [0,2,0,0,0,0|2,0,0]=4 3542 B14R1.3 CC(SC1=CC=C(C=C1)C#N)C(=O)O MCULE-5023923026 [0,2,0,0,0,0|1,0,1]=4 3543 B14R1.3 CCC1=CC=C(C=C1)CC(C)C(=O)O MCULE-9431759688 [0,2,0,0,0,0|1,0,0]=3 3544 B14R1.3 CCC1=CC=C(C=C1)CC(N)C(=O)O MCULE-7690560565 [0,2,0,0,0,0|1,0,0]=3 3545 B14R1.3 CCC1=CC=C(C=C1)C[C@@H](N)C(=O)O MCULE-1435129050 [0,2,0,0,0,0|1,0,0]=3 3546 B14R1.3 CCC1=CC=C(C=C1)C[C@@H](N)C(=O)O MCULE-4566380869 [0,2,0,0,0,0|1,0,0]=3 3547 B14R1.3 CCC1=CC=C(C=C1)C[C@@H](N)C(=O)O MCULE-5659780827 [0,2,0,0,0,0|1,0,0]=3 3548 B14R1.3 CCC1=CC=C(C=C1)C[C@H](N)C(=O)O MCULE-3694773827 [0,2,0,0,0,0|1,0,0]=3 3549 B14R1.3 CCC1=CC=C(C=C1)C[C@H](N)C(=O)O MCULE-8607327458 [0,2,0,0,0,0|1,0,0]=3 3550 B14R1.3 CCC1=CC=C(C=C1)OC(C)C(=O)O MCULE-6248564395 [0,2,0,0,0,0|2,0,0]=4 3551 B14R1.3 COC1=CC=C(C=C1)CC(=O)C(=O)O MCULE-3122064559 [0,2,0,0,0,0|1,0,1]=4 3552 B14R1.3 COC1=CC=C(C=C1)CC(C)C(=O)O MCULE-9567428925 [0,2,0,0,0,0|1,0,0]=3 3553 B14R1.3 COC1=CC=C(C=C1)CC(N)C(=O)O MCULE-7401424887 [0,2,0,0,0,0|1,0,0]=3 3554 B14R1.3 COC1=CC=C(C=C1)CC(N)C(=O)O MCULE-8554887653 [0,2,0,0,0,0|1,0,0]=3 3555 B14R1.3 COC1=CC=C(C=C1)CC(O)C(=O)O MCULE-4892673092 [0,2,0,0,0,0|1,0,0]=3 3556 B14R1.3 COC1=CC=C(C=C1)C[C@@H](N)C(=O)O MCULE-2276110349 [0,2,0,0,0,0|1,0,0]=3 3557 B14R1.3 COC1=CC=C(C=C1)C[C@@H](N)C(=O)O MCULE-2601900678 [0,2,0,0,0,0|1,0,0]=3 3558 B14R1.3 COC1=CC=C(C=C1)C[C@@H](N)C(=O)O MCULE-2987428820 [0,2,0,0,0,0|1,0,0]=3 3559 B14R1.3 COC1=CC=C(C=C1)C[C@@H](N)C(=O)O MCULE-9469633282 [0,2,0,0,0,0|1,0,0]=3 3560 B14R1.3 COC1=CC=C(C=C1)C[C@H](N)C(=O)O MCULE-6625925075 [0,2,0,0,0,0|1,0,0]=3 3561 B14R1.3 COC1=CC=C(C=C1)C[C@H](N)C(=O)O MCULE-8125565254 [0,2,0,0,0,0|1,0,0]=3 3562 B14R1.3 COC1=CC=C(C=C1)NC(C)C(=O)O MCULE-7049509949 [0,2,0,0,0,0|2,0,0]=4 3563 B14R1.3 COC1=CC=C(C=C1)OC(C)C(=O)O MCULE-7847969583 [0,2,0,0,0,0|2,0,0]=4 3564 B14R1.3 COC1=CC=C(C=C1)SC(C)C(=O)O MCULE-3244503249 [0,2,0,0,0,0|2,0,0]=4 3565 B14R1.3 COC1=NC=C(C=C1)CC(C)C(=O)O MCULE-1408314610 [0,2,0,0,0,0|2,0,0]=4 3566 B14R1.3 CSC1=CC=C(C=C1)CC(N)C(=O)O MCULE-6278962041 [0,2,0,0,0,0|1,0,0]=3 3567 B14R1.3 CSC1=CC=C(C=C1)CC(N)C(=O)O MCULE-9887520668 [0,2,0,0,0,0|1,0,0]=3 3568 B14R1.3 CSC1=CC=C(C=C1)OC(C)C(=O)O MCULE-9329361362 [0,2,0,0,0,0|2,0,0]=4 3569 B14R1.3 N#CC1=CC=C(C=C1)CC(=O)C(=O)O MCULE-9473978771 [0,2,0,0,0,0|0,0,2]=4 3570 B14R1.3 N#CC1=CC=C(C=C1)CC(N)C(=O)O MCULE-2547457737 [0,2,0,0,0,0|0,0,1]=3 3571 B14R1.3 N#CC1=CC=C(C=C1)CC(N)C(=O)O MCULE-3009591757 [0,2,0,0,0,0|0,0,1]=3 3572 B14R1.3 N#CC1=CC=C(C=C1)C[C@@H](N)C(=O)O MCULE-2188384722 [0,2,0,0,0,0|0,0,1]=3 3573 B14R1.3 N#CC1=CC=C(C=C1)C[C@@H](N)C(=O)O MCULE-5084246856 [0,2,0,0,0,0|0,0,1]=3 3574 B14R1.3 N#CC1=CC=C(C=C1)C[C@H](N)C(=O)O MCULE-2956238382 [0,2,0,0,0,0|0,0,1]=3 3575 B14R1.3 N#CC1=CC=C(C=C1)C[C@H](N)C(=O)O MCULE-3981584975 [0,2,0,0,0,0|0,0,1]=3 3576 B14R1.3 N#CC1=CC=C(C=C1)C[C@H](N)C(=O)O MCULE-8429770618 [0,2,0,0,0,0|0,0,1]=3 3577 B14R1.3 NC(CC1=CC=C(C=C1)CO)C(=O)O MCULE-3608351255 [0,2,0,0,0,0|1,0,0]=3 3578 B14R1.3 NC(CC1=CC=C(C=C1)CO)C(=O)O MCULE-6159646419 [0,2,0,0,0,0|1,0,0]=3 3579 B14R1.3 NCC1=CC=C(C=C1)CC(N)C(=O)O MCULE-6360591560 [0,2,0,0,0,0|0,0,0]=2 3580 B14R1.3 NCC1=CC=C(C=C1)C[C@@H](N)C(=O)O MCULE-5019687348 [0,2,0,0,0,0|0,0,0]=2 3581 B14R1.3 NCC1=CC=C(C=C1)C[C@@H](N)C(=O)O MCULE-9173684952 [0,2,0,0,0,0|0,0,0]=2 3582 B14R1.3 NCC1=CC=C(C=C1)C[C@H](N)C(=O)O MCULE-3908937850 [0,2,0,0,0,0|0,0,0]=2 3583 B14R1.3 NCC1=CC=C(C=C1)C[C@H](N)C(=O)O MCULE-7207044550 [0,2,0,0,0,0|0,0,0]=2 3584 B14R1.3 N[C@@H](CC1=CC=C(C=C1)CO)C(=O)O MCULE-7079640926 [0,2,0,0,0,0|1,0,0]=3 3585 B14R1.3 N[C@@H](CC1=CC=C(C=C1)CO)C(=O)O MCULE-7607638377 [0,2,0,0,0,0|1,0,0]=3 3586 B14R1.3 N[C@@H](CC1=CC=C(C=C1)CO)C(=O)O MCULE-9438903936 [0,2,0,0,0,0|1,0,0]=3 3587 B14R1.3 N[C@@H](CC1=CC=C(C=C1)CO)C(=O)O MCULE-9488539878 [0,2,0,0,0,0|1,0,0]=3 3588 B14R1.3 N[C@H](CC1=CC=C(C=C1)CO)C(=O)O MCULE-8826940922 [0,2,0,0,0,0|1,0,0]=3 3589 B14R1.3 [C@H](N)(CC1=CC=C(C=C1)OC)C(=O)O MCULE-9599742463 [0,2,0,0,0,0|1,0,0]=3 3590 B14R1.5 C#CC1=CC=C(C=C1)CCC(=O)OC MCULE-1296515127 [0,2,0,0,0,0|1,0,0]=3 3591 B14R1.5 C#CC1=CC=C(C=C1)OCC(=O)OC MCULE-4583029831 [0,2,0,0,0,0|2,0,0]=4 3592 B14R1.5 CCC(=O)CCC1=CC=C(C=C1)OC MCULE-8841204212 [0,2,0,0,0,0|2,0,0]=4 3593 B14R1.5 CNC(=O)CCC1=CC=C(C=C1)OC MCULE-7602410764 [0,2,0,0,0,0|2,0,0]=4 3594 B14R1.5 CNC1=CC=C(C=C1)OCC(=O)OC MCULE-2957684894 [0,2,0,0,0,0|1,0,0]=3 3595 B14R1.5 CNC1=CC=C(C=C1)OCC(=O)OC MCULE-4305143103 [0,2,0,0,0,0|1,0,0]=3 3596 B14R1.5 COC(=O)CCC1=CC=C(C=C1)C#N MCULE-7806400477 [0,2,0,0,0,0|0,0,1]=3 3597 B14R1.5 COC(=O)CCC1=CC=C(C=C1)CN MCULE-1409600683 [0,2,0,0,0,0|0,0,0]=2 3598 B14R1.5 COC(=O)CCC1=CC=C(C=C1)CN MCULE-3309302536 [0,2,0,0,0,0|0,0,0]=2 3599 B14R1.5 COC(=O)CCC1=CC=C(C=C1)OC MCULE-9334337987 [0,2,0,0,0,0|1,0,0]=3 3600 B14R1.5 COC(=O)CNC1=CC=C(C=C1)OC MCULE-4109165503 [0,2,0,0,0,0|2,0,0]=4 3601 B14R1.5 COC(=O)COC1=CC=C(C=C1)C#N MCULE-2818641284 [0,2,0,0,0,0|1,0,1]=4 3602 B14R1.5 COC(=O)COC1=CC=C(C=C1)C=O MCULE-5516916015 [0,2,0,0,0,0|2,0,0]=4 3603 B14R1.5 COC(=O)COC1=CC=C(C=C1)CO MCULE-2366538191 [0,2,0,0,0,0|2,0,0]=4 3604 B14R1.5 COC(=O)COC1=CC=C(C=C1)OC MCULE-2173584762 [0,2,0,0,0,0|2,0,0]=4 3605 B14R1.5 COC(=O)CSC1=CC=C(C=C1)OC MCULE-6737828062 [0,2,0,0,0,0|2,0,0]=4 3606 B14R1.5 COC1=CC=C(C=C1)CCC(=NO)C MCULE-8629055162 [0,2,0,0,0,0|2,0,0]=4 3607 B14R1.5 COC1=CC=C(C=C1)CCC(=O)NN MCULE-3583237368 [0,2,0,0,0,0|2,0,0]=4 3608 B14R1.5 COC1=CC=C(C=C1)CCC(=O)NO MCULE-7652063629 [0,2,0,0,0,0|1,0,0]=3 3609 B14R1.103 CCC1=CC(=C(C=C1)OCC(=O)O)Cl MCULE-5865019153 [0,2,0,0,0,0|2,0,0]=4 3610 B14R1.103 CCC1=CC=C(C(=C1)Br)OCC(=O)O MCULE-5240808273 [0,2,0,0,0,0|2,0,0]=4 3611 B14R1.103 COC1=CC(=C(C=C1)CCC(=O)C)C MCULE-3054250286 [0,2,0,0,0,0|2,0,0]=4 3612 B14R1.103 COC1=CC(=C(C=C1)CCC(=O)O)Br MCULE-6732256381 [0,2,0,0,0,0|1,0,0]=3 3613 B14R1.103 COC1=CC(=C(C=C1)CCC(=O)O)F MCULE-1536293291 [0,2,0,0,0,0|1,0,0]=3 3614 B14R1.103 COC1=CC(=C(C=C1)CCC(=O)O)O MCULE-4193849301 [0,2,0,0,0,0|1,0,0]=3 3615 B14R1.103 COC1=CC=C(C(=C1)C)CCC(=O)O MCULE-2799084425 [0,2,0,0,0,0|1,0,0]=3 3616 B14R1.103 COC1=CC=C(C(=C1)Cl)OCC(=O)O MCULE-3288409944 [0,2,0,0,0,0|2,0,0]=4 3617 B14R1.103 N#CC1=CC(=C(C=C1)CCC(=O)O)Br MCULE-4779419581 [0,2,0,0,0,0|0,0,1]=3 3618 B14R1.103 N#CC1=CC(=C(C=C1)CCC(=O)O)F MCULE-8619737412 [0,2,0,0,0,0|0,0,1]=3 3619 B14R1.103 N#CC1=CC(=C(C=C1)OCC(=O)O)Br MCULE-2425712388 [0,2,0,0,0,0|1,0,1]=4 3620 B14R1.103 N#CC1=CC(=C(C=C1)OCC(=O)O)Cl MCULE-1564302844 [0,2,0,0,0,0|1,0,1]=4 3621 B14R1.103 O=CC1=CC(=C(C=C1)OCC(=O)O)Br MCULE-1966804270 [0,2,0,0,0,0|2,0,0]=4 3622 B14R1.103 O=CC1=CC=C(C(=C1)Cl)OCC(=O)O MCULE-4336387774 [0,2,0,0,0,0|2,0,0]=4 3623 B14R1.103 O=CC1=CC=C(C(=C1)I)OCC(=O)O MCULE-3191095686 [0,2,0,0,0,0|2,0,0]=4 3624 B14R1.142 CCCC1=CC=C(C=C1)CCC(=O)O MCULE-1317239116 [0,2,0,0,0,0|1,0,0]=3 3625 B14R1.142 CCCC1=CC=C(C=C1)OCC(=O)O MCULE-2905460525 [0,2,0,0,0,0|2,0,0]=4 3626 B14R1.142 CCOC1=CC=C(C=C1)CCC(=O)C MCULE-6441233353 [0,2,0,0,0,0|2,0,0]=4 3627 B14R1.142 CCOC1=CC=C(C=C1)CCC(=O)O MCULE-9998839199 [0,2,0,0,0,0|1,0,0]=3 3628 B14R1.142 CCOC1=CC=C(C=C1)NCC(=O)O MCULE-9806738013 [0,2,0,0,0,0|2,0,0]=4 3629 B14R1.142 CCOC1=CC=C(C=C1)OCC(=O)O MCULE-5705601801 [0,2,0,0,0,0|2,0,0]=4 3630 B14R1.142 CCOC1=CC=C(C=C1)SCC(=O)O MCULE-2198148787 [0,2,0,0,0,0|2,0,0]=4 3631 B14R1.142 N#CCC1=CC=C(C=C1)OCC(=O)O MCULE-7951387700 [0,2,0,0,0,0|1,0,1]=4 3632 B14R1.142 N#N=NC1=CC=C(C=C1)CCC(=O)O MCULE-2494010411 [0,2,0,0,0,0|0,0,1]=3 3633 B14R1.142 NCCC1=CC=C(C=C1)CCC(=O)O MCULE-3524638555 [0,2,0,0,0,0|0,0,0]=2 3634 B14R1.142 NCCC1=CC=C(C=C1)CCC(=O)O MCULE-4237590328 [0,2,0,0,0,0|0,0,0]=2 3635 B14R1.142 NCCC1=CC=C(C=C1)OCC(=O)O MCULE-6825070614 [0,2,0,0,0,0|1,0,0]=3 3636 B14R1.142 NCCC1=CC=C(C=C1)OCC(=O)O MCULE-6971407343 [0,2,0,0,0,0|1,0,0]=3 3637 B14R1.142 O=C(O)COC1=CC=C(C=C1)C=NO MCULE-1818277871 [0,2,0,0,0,0|1,0,1]=4 3638 B14R1.419 CC(=O)C1=CC=C(C=C1)CCC(=O)O MCULE-6606465558 [0,2,0,0,0,0|1,0,0]=3 3639 B14R1.419 CC(=O)C1=CC=C(C=C1)NCC(=O)O MCULE-6308989130 [0,2,0,0,0,0|2,0,0]=4 3640 B14R1.419 CC(=O)C1=CC=C(C=C1)OCC(=O)O MCULE-1748099805 [0,2,0,0,0,0|2,0,0]=4 3641 B14R1.419 CC(=O)CCC1=CC=C(C=C1)C(=O)O MCULE-9852688164 [0,2,0,0,0,0|2,0,0]=4 3642 B14R1.419 CC(=O)CCC1=CC=C(C=C1)N(=O)=O MCULE-3942852091 [0,2,0,0,0,0|1,0,1]=4 3643 B14R1.419 CC(=O)COC1=CC=C(C=C1)C(=O)N MCULE-1657329216 [0,2,0,0,0,0|2,0,0]=4 3644 B14R1.419 CC(C)C1=CC=C(C=C1)CCC(=O)O MCULE-3538060424 [0,2,0,0,0,0|1,0,0]=3 3645 B14R1.419 CC(C)C1=CC=C(C=C1)OCC(=O)O MCULE-7142642080 [0,2,0,0,0,0|2,0,0]=4 3646 B14R1.419 CC(C)C1=CC=C(C=C1)SCC(=O)O MCULE-5029055380 [0,2,0,0,0,0|2,0,0]=4 3647 B14R1.419 CC(N)C1=CC=C(C=C1)OCC(=O)N MCULE-6363797862 [0,2,0,0,0,0|2,0,0]=4 3648 B14R1.419 CC(O)CCC1=CC=C(C=C1)N(C)C MCULE-8703049231 [0,2,0,0,0,0|1,0,1]=4 3649 B14R1.419 CN(C)C1=CC=C(C=C1)/C=C/C(=O)O MCULE-2384930729 [0,2,0,0,0,0|0,0,2]=4 3650 B14R1.419 CN(C)C1=CC=C(C=C1)C#CC(=O)O MCULE-7307452889 [0,2,0,0,0,0|0,0,2]=4 3651 B14R1.419 CN(C)C1=CC=C(C=C1)C=CC(=O)O MCULE-1730398956 [0,2,0,0,0,0|0,0,2]=4 3652 B14R1.419 CN(C)C1=CC=C(C=C1)C=CC(=O)O MCULE-7857746470 [0,2,0,0,0,0|0,0,2]=4 3653 B14R1.419 CN(C)C1=CC=C(C=C1)CCC(=O)O MCULE-3604664882 [0,2,0,0,0,0|0,0,0]=2 3654 B14R1.419 CN(C)C1=CC=C(C=C1)CCC(=O)O MCULE-9421060777 [0,2,0,0,0,0|0,0,0]=2 3655 B14R1.419 CS(=O)C1=CC=C(C=C1)OCC(=O)O MCULE-4112594230 [0,2,0,0,0,0|2,0,0]=4 3656 B14R1.419 NC(=O)C1=CC=C(C=C1)C=CC(=O)O MCULE-3221603484 [0,2,0,0,0,0|0,0,2]=4 3657 B14R1.419 NC(=O)C1=CC=C(C=C1)CCC(=O)O MCULE-1942357944 [0,2,0,0,0,0|0,0,0]=2 3658 B14R1.419 NC(=O)C1=CC=C(C=C1)NCC(=O)O MCULE-7853749088 [0,2,0,0,0,0|1,0,0]=3 3659 B14R1.419 NC(=O)C1=CC=C(C=C1)OCC(=O)O MCULE-1220330631 [0,2,0,0,0,0|1,0,0]=3 3660 B14R1.419 NC(=O)C1=CN=C(C=C1)NCC(=O)O MCULE-9663263895 [0,2,0,0,0,0|2,0,0]=4 3661 B14R1.419 NC(=O)CCC1=CC=C(C=C1)C(=O)O MCULE-9635325999 [0,2,0,0,0,0|2,0,0]=4 3662 B14R1.419 NC(=O)CCC1=CC=C(C=C1)N(=O)=O MCULE-6043062927 [0,2,0,0,0,0|1,0,1]=4 3663 B14R1.419 NC(=O)COC1=CC=C(C=C1)C(=O)N MCULE-8335796005 [0,2,0,0,0,0|2,0,0]=4 3664 B14R1.419 O=C(Cl)CCC1=CC=C(C=C1)N(=O)=O MCULE-5123598647 [0,2,0,0,0,0|1,0,1]=4 3665 B14R1.419 O=C(O)CCC1=CC=C(C=C1)B(O)O MCULE-4027092502 [0,2,0,0,0,0|1,0,0]=3 3666 B14R1.419 O=C(O)CCC1=CC=C(C=C1)C(=O)O MCULE-9352979588 [0,2,0,0,0,0|1,0,0]=3 3667 B14R1.419 O=C(O)CCC1=CC=C(C=C1)C(F)F MCULE-4816732931 [0,2,0,0,0,0|1,0,0]=3 3668 B14R1.419 O=C(O)CCC1=CC=C(C=C1)N(=O)=O MCULE-7564556532 [0,2,0,0,0,0|0,0,1]=3 3669 B14R1.419 O=C(O)CNC1=CC=C(C=C1)C(=O)O MCULE-7640246804 [0,2,0,0,0,0|2,0,0]=4 3670 B14R1.419 O=C(O)CNC1=CC=C(C=C1)C(=O)O MCULE-8996993209 [0,2,0,0,0,0|2,0,0]=4 3671 B14R1.419 O=C(O)CNC1=CC=C(C=C1)N(=O)=O MCULE-3622411298 [0,2,0,0,0,0|1,0,1]=4 3672 B14R1.419 O=C(O)COC1=CC=C(C=C1)B(O)O MCULE-8102752710 [0,2,0,0,0,0|2,0,0]=4 3673 B14R1.419 O=C(O)COC1=CC=C(C=C1)C(=O)O MCULE-2855315257 [0,2,0,0,0,0|2,0,0]=4 3674 B14R1.419 O=C(O)COC1=CC=C(C=C1)N(=O)=O MCULE-4354028178 [0,2,0,0,0,0|1,0,1]=4 3675 B14R1.419 O=C(O)CSC1=CC=C(C=C1)N(=O)=O MCULE-4016627330 [0,2,0,0,0,0|1,0,1]=4 3676 B14R1.3653 CNC1=C(C=C(C=C1)/C=C/C(=O)O)O MCULE-9192115439 [0,2,0,0,0,0|0,0,2]=4 3677 B14R1.3653 COC1=C(C=C(C=C1)CCC(=O)C)Br MCULE-1125670726 [0,2,0,0,0,0|2,0,0]=4 3678 B14R1.3653 COC1=C(C=C(C=C1)CCC(=O)C)O MCULE-5790380759 [0,2,0,0,0,0|2,0,0]=4 3679 B14R1.3653 COC1=C(C=C(C=C1)CCC(=O)O)Br MCULE-8865828779 [0,2,0,0,0,0|1,0,0]=3 3680 B14R1.3653 COC1=C(C=C(C=C1)CCC(=O)O)C MCULE-8573336707 [0,2,0,0,0,0|1,0,0]=3 3681 B14R1.3653 COC1=C(C=C(C=C1)CCC(=O)O)Cl MCULE-5350814939 [0,2,0,0,0,0|1,0,0]=3 3682 B14R1.3653 COC1=C(C=C(C=C1)CCC(=O)O)F MCULE-5135516709 [0,2,0,0,0,0|1,0,0]=3 3683 B14R1.3653 COC1=C(C=C(C=C1)CCC(=O)O)N MCULE-7911059841 [0,2,0,0,0,0|1,0,0]=3 3684 B14R1.3653 COC1=C(C=C(C=C1)CCC(=O)O)O MCULE-9703563699 [0,2,0,0,0,0|1,0,0]=3 3685 B14R1.3653 COC1=C(C=C(C=C1)OCC(=O)O)Br MCULE-5337357656 [0,2,0,0,0,0|2,0,0]=4 3686 B14R1.3653 COC1=C(C=C(C=C1)OCC(=O)O)F MCULE-8360636080 [0,2,0,0,0,0|2,0,0]=4 3687 B14R1.3653 CSC1=CC=C(C=C1C)OCC(=O)O MCULE-4377794218 [0,2,0,0,0,0|2,0,0]=4 3688 B14R1.3653 N#CC1=C(C=C(C=C1)OCC(=O)O)Br MCULE-9760811342 [0,2,0,0,0,0|1,0,1]=4 3689 B14R1.3653 N#CC1=CC=C(C=C1F)OCC(=O)O MCULE-9701802479 [0,2,0,0,0,0|1,0,1]=4 3690 B14R1.10 COC(=O)CC(=O)C1=CC=C(C=C1)Br MCULE-8784579085 [0,2,0,0,0,0|1,0,1]=4 3691 B14R1.10 COC(=O)CC(=O)C1=CC=C(C=C1)C MCULE-4636257596 [0,2,0,0,0,0|1,0,1]=4 3692 B14R1.10 COC(=O)CC(=O)C1=CC=C(C=C1)Cl MCULE-1142637611 [0,2,0,0,0,0|1,0,1]=4 3693 B14R1.10 COC(=O)CC(=O)C1=CC=C(C=C1)F MCULE-2965321221 [0,2,0,0,0,0|1,0,1]=4 3694 B14R1.10 COC(=O)CC(=O)C1=CC=C(C=C1)I MCULE-1158965711 [0,2,0,0,0,0|1,0,1]=4 3695 B14R1.10 COC(=O)CC(=O)C1=CC=C(C=C1)O MCULE-9713752547 [0,2,0,0,0,0|1,0,1]=4 3696 B14R1.10 COC(=O)CC(C)C1=CC=C(C=C1)Br MCULE-3141291316 [0,2,0,0,0,0|1,0,0]=3 3697 B14R1.10 COC(=O)CC(C)C1=CC=C(C=C1)N MCULE-9274860436 [0,2,0,0,0,0|0,0,0]=2 3698 B14R1.10 COC(=O)CC(N)C1=CC=C(C=C1)Br MCULE-2592210155 [0,2,0,0,0,0|1,0,0]=3 3699 B14R1.10 COC(=O)CC(N)C1=CC=C(C=C1)Br MCULE-3242152942 [0,2,0,0,0,0|1,0,0]=3 3700 B14R1.10 COC(=O)CC(N)C1=CC=C(C=C1)Br MCULE-4772157078 [0,2,0,0,0,0|1,0,0]=3 3701 B14R1.10 COC(=O)CC(N)C1=CC=C(C=C1)Br MCULE-5291424115 [0,2,0,0,0,0|1,0,0]=3 3702 B14R1.10 COC(=O)CC(N)C1=CC=C(C=C1)C MCULE-4808374310 [0,2,0,0,0,0|1,0,0]=3 3703 B14R1.10 COC(=O)CC(N)C1=CC=C(C=C1)C MCULE-6597338177 [0,2,0,0,0,0|1,0,0]=3 3704 B14R1.10 COC(=O)CC(N)C1=CC=C(C=C1)Cl MCULE-4102991502 [0,2,0,0,0,0|1,0,0]=3 3705 B14R1.10 COC(=O)CC(N)C1=CC=C(C=C1)Cl MCULE-5091188677 [0,2,0,0,0,0|1,0,0]=3 3706 B14R1.10 COC(=O)CC(N)C1=CC=C(C=C1)F MCULE-2486449706 [0,2,0,0,0,0|1,0,0]=3 3707 B14R1.10 COC(=O)CC(N)C1=CC=C(C=C1)F MCULE-6939459936 [0,2,0,0,0,0|1,0,0]=3 3708 B14R1.10 COC(=O)CC(N)C1=CC=C(C=C1)O MCULE-6910962360 [0,2,0,0,0,0|1,0,0]=3 3709 B14R1.10 COC(=O)CC(N)C1=CC=C(C=C1)O MCULE-7611694192 [0,2,0,0,0,0|1,0,0]=3 3710 B14R1.10 COC(=O)CC(O)C1=CC=C(C=C1)Cl MCULE-3540623980 [0,2,0,0,0,0|1,0,0]=3 3711 B14R1.10 COC(=O)CS(=O)C1=CC=C(C=C1)Br MCULE-1739999506 [0,2,0,0,0,0|2,0,0]=4 3712 B14R1.10 COC(=O)C[C@@H](N)C1=CC=C(C=C1)Br MCULE-4697039089 [0,2,0,0,0,0|1,0,0]=3 3713 B14R1.10 COC(=O)C[C@@H](N)C1=CC=C(C=C1)Br MCULE-5076308863 [0,2,0,0,0,0|1,0,0]=3 3714 B14R1.10 COC(=O)C[C@@H](N)C1=CC=C(C=C1)Br MCULE-7085256892 [0,2,0,0,0,0|1,0,0]=3 3715 B14R1.10 COC(=O)C[C@@H](N)C1=CC=C(C=C1)Br MCULE-8375946856 [0,2,0,0,0,0|1,0,0]=3 3716 B14R1.10 COC(=O)C[C@@H](N)C1=CC=C(C=C1)C MCULE-1419064436 [0,2,0,0,0,0|1,0,0]=3 3717 B14R1.10 COC(=O)C[C@@H](N)C1=CC=C(C=C1)C MCULE-8411729229 [0,2,0,0,0,0|1,0,0]=3 3718 B14R1.10 COC(=O)C[C@@H](N)C1=CC=C(C=C1)Cl MCULE-2443032657 [0,2,0,0,0,0|1,0,0]=3 3719 B14R1.10 COC(=O)C[C@@H](N)C1=CC=C(C=C1)Cl MCULE-7404866075 [0,2,0,0,0,0|1,0,0]=3 3720 B14R1.10 COC(=O)C[C@@H](N)C1=CC=C(C=C1)F MCULE-1438468828 [0,2,0,0,0,0|1,0,0]=3 3721 B14R1.10 COC(=O)C[C@@H](N)C1=CC=C(C=C1)F MCULE-3453591234 [0,2,0,0,0,0|1,0,0]=3 3722 B14R1.10 COC(=O)C[C@@H](N)C1=CC=C(C=C1)I MCULE-2175981954 [0,2,0,0,0,0|1,0,0]=3 3723 B14R1.10 COC(=O)C[C@@H](N)C1=CC=C(C=C1)I MCULE-5470845351 [0,2,0,0,0,0|1,0,0]=3 3724 B14R1.10 COC(=O)C[C@@H](N)C1=CC=C(C=C1)O MCULE-4165538788 [0,2,0,0,0,0|1,0,0]=3 3725 B14R1.10 COC(=O)C[C@@H](N)C1=CC=C(C=C1)O MCULE-8273129151 [0,2,0,0,0,0|1,0,0]=3 3726 B14R1.10 COC(=O)C[C@@H](N)C1=CC=C(N=C1)Cl MCULE-1276200647 [0,2,0,0,0,0|2,0,0]=4 3727 B14R1.10 COC(=O)C[C@@H](N)C1=CC=C(N=C1)Cl MCULE-6012571508 [0,2,0,0,0,0|2,0,0]=4 3728 B14R1.10 COC(=O)C[C@@H](N)C1=CN=C(C=C1)Br MCULE-1577229901 [0,2,0,0,0,0|2,0,0]=4 3729 B14R1.10 COC(=O)C[C@@H](N)C1=CN=C(C=C1)Br MCULE-6098010430 [0,2,0,0,0,0|2,0,0]=4 3730 B14R1.10 COC(=O)C[C@@H](N)C1=NC=C(C=C1)Br MCULE-1762690124 [0,2,0,0,0,0|2,0,0]=4 3731 B14R1.10 COC(=O)C[C@@H](N)C1=NC=C(C=C1)Br MCULE-6255577323 [0,2,0,0,0,0|2,0,0]=4 3732 B14R1.10 COC(=O)C[C@H](N)C1=CC=C(C=C1)Br MCULE-5059603871 [0,2,0,0,0,0|1,0,0]=3 3733 B14R1.10 COC(=O)C[C@H](N)C1=CC=C(C=C1)Br MCULE-5194715030 [0,2,0,0,0,0|1,0,0]=3 3734 B14R1.10 COC(=O)C[C@H](N)C1=CC=C(C=C1)Br MCULE-8241192960 [0,2,0,0,0,0|1,0,0]=3 3735 B14R1.10 COC(=O)C[C@H](N)C1=CC=C(C=C1)Br MCULE-9100051851 [0,2,0,0,0,0|1,0,0]=3 3736 B14R1.10 COC(=O)C[C@H](N)C1=CC=C(C=C1)C MCULE-4600957666 [0,2,0,0,0,0|1,0,0]=3 3737 B14R1.10 COC(=O)C[C@H](N)C1=CC=C(C=C1)C MCULE-5916340076 [0,2,0,0,0,0|1,0,0]=3 3738 B14R1.10 COC(=O)C[C@H](N)C1=CC=C(C=C1)Cl MCULE-1739582096 [0,2,0,0,0,0|1,0,0]=3 3739 B14R1.10 COC(=O)C[C@H](N)C1=CC=C(C=C1)Cl MCULE-5156620838 [0,2,0,0,0,0|1,0,0]=3 3740 B14R1.10 COC(=O)C[C@H](N)C1=CC=C(C=C1)Cl MCULE-8385881422 [0,2,0,0,0,0|1,0,0]=3 3741 B14R1.10 COC(=O)C[C@H](N)C1=CC=C(C=C1)F MCULE-2741534794 [0,2,0,0,0,0|1,0,0]=3 3742 B14R1.10 COC(=O)C[C@H](N)C1=CC=C(C=C1)F MCULE-4103137834 [0,2,0,0,0,0|1,0,0]=3 3743 B14R1.10 COC(=O)C[C@H](N)C1=CC=C(C=C1)F MCULE-6584715435 [0,2,0,0,0,0|1,0,0]=3 3744 B14R1.10 COC(=O)C[C@H](N)C1=CC=C(C=C1)F MCULE-7517676618 [0,2,0,0,0,0|1,0,0]=3 3745 B14R1.10 COC(=O)C[C@H](N)C1=CC=C(C=C1)I MCULE-7846787216 [0,2,0,0,0,0|1,0,0]=3 3746 B14R1.10 COC(=O)C[C@H](N)C1=CC=C(C=C1)I MCULE-8993891470 [0,2,0,0,0,0|1,0,0]=3 3747 B14R1.10 COC(=O)C[C@H](N)C1=CC=C(C=C1)O MCULE-2331471125 [0,2,0,0,0,0|1,0,0]=3 3748 B14R1.10 COC(=O)C[C@H](N)C1=CC=C(C=C1)O MCULE-6017478446 [0,2,0,0,0,0|1,0,0]=3 3749 B14R1.10 COC(=O)C[C@H](N)C1=CC=C(C=C1)O MCULE-7057610955 [0,2,0,0,0,0|1,0,0]=3 3750 B14R1.10 COC(=O)C[C@H](N)C1=CC=C(C=C1)O MCULE-8006208351 [0,2,0,0,0,0|1,0,0]=3 3751 B14R1.10 COC(=O)C[C@H](N)C1=CC=C(N=C1)Cl MCULE-6824943114 [0,2,0,0,0,0|2,0,0]=4 3752 B14R1.10 COC(=O)C[C@H](N)C1=CC=C(N=C1)Cl MCULE-7244895162 [0,2,0,0,0,0|2,0,0]=4 3753 B14R1.10 COC(=O)C[C@H](N)C1=CN=C(C=C1)Br MCULE-4330567023 [0,2,0,0,0,0|2,0,0]=4 3754 B14R1.10 COC(=O)C[C@H](N)C1=CN=C(C=C1)Br MCULE-7664802421 [0,2,0,0,0,0|2,0,0]=4 3755 B14R1.10 COC(=O)C[C@H](N)C1=NC=C(C=C1)Br MCULE-3389614691 [0,2,0,0,0,0|2,0,0]=4 3756 B14R1.10 COC(=O)C[C@H](N)C1=NC=C(C=C1)Br MCULE-6091888146 [0,2,0,0,0,0|2,0,0]=4 3757 B14R1.134 CC(CC1=CC=C(C=C1)Br)C(=O)CBr MCULE-4801833946 [0,2,0,0,0,0|2,0,0]=4 3758 B14R1.134 CNC(=O)C(C)OC1=CC=C(C=C1)N MCULE-3032274285 [0,2,0,0,0,0|2,0,0]=4 3759 B14R1.134 COC(=O)C(Br)CC1=CC=C(C=C1)Br MCULE-6722551698 [0,2,0,0,0,0|1,0,0]=3 3760 B14R1.134 COC(=O)C(Br)CC1=CC=C(C=C1)C MCULE-4210711151 [0,2,0,0,0,0|1,0,0]=3 3761 B14R1.134 COC(=O)C(Br)CC1=CC=C(C=C1)Cl MCULE-4689477249 [0,2,0,0,0,0|1,0,0]=3 3762 B14R1.134 COC(=O)C(Br)CC1=CC=C(C=C1)F MCULE-6449732387 [0,2,0,0,0,0|1,0,0]=3 3763 B14R1.134 COC(=O)C(C)CC1=CC=C(C=C1)Br MCULE-4830330081 [0,2,0,0,0,0|1,0,0]=3 3764 B14R1.134 COC(=O)C(C)CC1=CC=C(C=C1)N MCULE-5118670543 [0,2,0,0,0,0|0,0,0]=2 3765 B14R1.134 COC(=O)C(C)NC1=CC=C(C=C1)C MCULE-7848254534 [0,2,0,0,0,0|2,0,0]=4 3766 B14R1.134 COC(=O)C(C)OC1=CC=C(C=C1)Br MCULE-6025368048 [0,2,0,0,0,0|2,0,0]=4 3767 B14R1.134 COC(=O)C(C)OC1=CC=C(C=C1)C MCULE-2315995249 [0,2,0,0,0,0|2,0,0]=4 3768 B14R1.134 COC(=O)C(C)OC1=CC=C(C=C1)F MCULE-9619000211 [0,2,0,0,0,0|2,0,0]=4 3769 B14R1.134 COC(=O)C(C)OC1=CC=C(C=C1)O MCULE-2057747341 [0,2,0,0,0,0|2,0,0]=4 3770 B14R1.134 COC(=O)C(C)OC1=CC=C(C=C1)O MCULE-3003338705 [0,2,0,0,0,0|2,0,0]=4 3771 B14R1.134 COC(=O)C(C)SC1=CC=C(C=C1)Cl MCULE-4378943942 [0,2,0,0,0,0|2,0,0]=4 3772 B14R1.134 COC(=O)C(Cl)CC1=CC=C(C=C1)Cl MCULE-7887294909 [0,2,0,0,0,0|1,0,0]=3 3773 B14R1.134 COC(=O)C(N)CC1=CC=C(C=C1)Br MCULE-4453490191 [0,2,0,0,0,0|1,0,0]=3 3774 B14R1.134 COC(=O)C(N)CC1=CC=C(C=C1)Br MCULE-5316696256 [0,2,0,0,0,0|1,0,0]=3 3775 B14R1.134 COC(=O)C(N)CC1=CC=C(C=C1)Br MCULE-7648103670 [0,2,0,0,0,0|1,0,0]=3 3776 B14R1.134 COC(=O)C(N)CC1=CC=C(C=C1)Br MCULE-8441655828 [0,2,0,0,0,0|1,0,0]=3 3777 B14R1.134 COC(=O)C(N)CC1=CC=C(C=C1)Cl MCULE-6839240703 [0,2,0,0,0,0|1,0,0]=3 3778 B14R1.134 COC(=O)C(N)CC1=CC=C(C=C1)Cl MCULE-8104723034 [0,2,0,0,0,0|1,0,0]=3 3779 B14R1.134 COC(=O)C(N)CC1=CC=C(C=C1)F MCULE-1562203633 [0,2,0,0,0,0|1,0,0]=3 3780 B14R1.134 COC(=O)C(N)CC1=CC=C(C=C1)F MCULE-3191771687 [0,2,0,0,0,0|1,0,0]=3 3781 B14R1.134 COC(=O)C(N)CC1=CC=C(C=C1)I MCULE-2377081706 [0,2,0,0,0,0|1,0,0]=3 3782 B14R1.134 COC(=O)C(N)CC1=CC=C(C=C1)I MCULE-2964435216 [0,2,0,0,0,0|1,0,0]=3 3783 B14R1.134 COC(=O)C(N)CC1=CC=C(C=C1)I MCULE-4835326324 [0,2,0,0,0,0|1,0,0]=3 3784 B14R1.134 COC(=O)C(N)CC1=CC=C(C=C1)I MCULE-5309031724 [0,2,0,0,0,0|1,0,0]=3 3785 B14R1.134 COC(=O)C(N)CC1=CC=C(C=C1)N MCULE-6946906482 [0,2,0,0,0,0|0,0,0]=2 3786 B14R1.134 COC(=O)C(N)CC1=CC=C(C=C1)N MCULE-9427412001 [0,2,0,0,0,0|0,0,0]=2 3787 B14R1.134 COC(=O)C(N)CC1=CC=C(C=C1)O MCULE-3134871970 [0,2,0,0,0,0|1,0,0]=3 3788 B14R1.134 COC(=O)C(N)CC1=CC=C(C=C1)O MCULE-5868680507 [0,2,0,0,0,0|1,0,0]=3 3789 B14R1.134 COC(=O)C(N)CC1=CC=C(C=C1)O MCULE-6387792600 [0,2,0,0,0,0|1,0,0]=3 3790 B14R1.134 COC(=O)C(N)CC1=CN=C(C=C1)Cl MCULE-3364356357 [0,2,0,0,0,0|2,0,0]=4 3791 B14R1.134 COC(=O)C(N)CC1=CN=C(C=C1)Cl MCULE-9341955116 [0,2,0,0,0,0|2,0,0]=4 3792 B14R1.134 COC(=O)C(N)CC1=NC=C(C=C1)Br MCULE-1812810082 [0,2,0,0,0,0|2,0,0]=4 3793 B14R1.134 COC(=O)C(N)CC1=NC=C(C=C1)Br MCULE-2426735865 [0,2,0,0,0,0|2,0,0]=4 3794 B14R1.134 COC(=O)C(N)CC1=NC=C(C=C1)C MCULE-1627995430 [0,2,0,0,0,0|2,0,0]=4 3795 B14R1.134 COC(=O)C(N)CC1=NC=C(C=C1)C MCULE-2880018302 [0,2,0,0,0,0|2,0,0]=4 3796 B14R1.134 COC(=O)C(N)CC1=NC=C(C=C1)C MCULE-8561758172 [0,2,0,0,0,0|2,0,0]=4 3797 B14R1.134 COC(=O)C(N)CC1=NC=C(C=C1)C MCULE-9752820537 [0,2,0,0,0,0|2,0,0]=4 3798 B14R1.134 COC(=O)C(N)CC1=NC=C(C=C1)Cl MCULE-1056382674 [0,2,0,0,0,0|2,0,0]=4 3799 B14R1.134 COC(=O)C(N)CC1=NC=C(C=C1)Cl MCULE-2812240661 [0,2,0,0,0,0|2,0,0]=4 3800 B14R1.134 COC(=O)C(N)CC1=NC=C(C=C1)Cl MCULE-4453509131 [0,2,0,0,0,0|2,0,0]=4 3801 B14R1.134 COC(=O)C(N)CC1=NC=C(C=C1)Cl MCULE-9245799286 [0,2,0,0,0,0|2,0,0]=4 3802 B14R1.134 COC(=O)C(O)CC1=CC=C(C=C1)Br MCULE-5530619123 [0,2,0,0,0,0|1,0,0]=3 3803 B14R1.134 COC(=O)C(O)CC1=CC=C(C=C1)F MCULE-5413234804 [0,2,0,0,0,0|1,0,0]=3 3804 B14R1.134 COC(=O)C(O)CC1=CC=C(C=C1)O MCULE-2030545561 [0,2,0,0,0,0|1,0,0]=3 3805 B14R1.134 COC(=O)C(S)CC1=CC=C(C=C1)C MCULE-1777576195 [0,2,0,0,0,0|1,0,0]=3 3806 B14R1.134 COC(=O)N(C)CC1=CC=C(C=C1)Br MCULE-1949892337 [0,2,0,0,0,0|2,0,0]=4 3807 B14R1.134 COC(=O)N(C)CC1=CC=C(C=C1)I MCULE-7018860726 [0,2,0,0,0,0|2,0,0]=4 3808 B14R1.134 COC(=O)N(C)CC1=CC=C(C=C1)N MCULE-6643535158 [0,2,0,0,0,0|1,0,0]=3 3809 B14R1.134 COC(=O)[C@@H](C)OC1=CC=C(C=C1)O MCULE-3363629646 [0,2,0,0,0,0|2,0,0]=4 3810 B14R1.134 COC(=O)[C@@H](C)OC1=CC=C(C=C1)O MCULE-7901123572 [0,2,0,0,0,0|2,0,0]=4 3811 B14R1.134 COC(=O)[C@@H](N)CC1=CC=C(C=C1)Br MCULE-6477916312 [0,2,0,0,0,0|1,0,0]=3 3812 B14R1.134 COC(=O)[C@@H](N)CC1=CC=C(C=C1)Br MCULE-7378001414 [0,2,0,0,0,0|1,0,0]=3 3813 B14R1.134 COC(=O)[C@@H](N)CC1=CC=C(C=C1)Br MCULE-8028581609 [0,2,0,0,0,0|1,0,0]=3 3814 B14R1.134 COC(=O)[C@@H](N)CC1=CC=C(C=C1)Br MCULE-8185896840 [0,2,0,0,0,0|1,0,0]=3 3815 B14R1.134 COC(=O)[C@@H](N)CC1=CC=C(C=C1)C MCULE-3508969395 [0,2,0,0,0,0|1,0,0]=3 3816 B14R1.134 COC(=O)[C@@H](N)CC1=CC=C(C=C1)Cl MCULE-4822053024 [0,2,0,0,0,0|1,0,0]=3 3817 B14R1.134 COC(=O)[C@@H](N)CC1=CC=C(C=C1)Cl MCULE-6642463013 [0,2,0,0,0,0|1,0,0]=3 3818 B14R1.134 COC(=O)[C@@H](N)CC1=CC=C(C=C1)Cl MCULE-8432858363 [0,2,0,0,0,0|1,0,0]=3 3819 B14R1.134 COC(=O)[C@@H](N)CC1=CC=C(C=C1)Cl MCULE-9157540742 [0,2,0,0,0,0|1,0,0]=3 3820 B14R1.134 COC(=O)[C@@H](N)CC1=CC=C(C=C1)F MCULE-3285651731 [0,2,0,0,0,0|1,0,0]=3 3821 B14R1.134 COC(=O)[C@@H](N)CC1=CC=C(C=C1)F MCULE-3517710524 [0,2,0,0,0,0|1,0,0]=3 3822 B14R1.134 COC(=O)[C@@H](N)CC1=CC=C(C=C1)F MCULE-5880009120 [0,2,0,0,0,0|1,0,0]=3 3823 B14R1.134 COC(=O)[C@@H](N)CC1=CC=C(C=C1)F MCULE-9683439667 [0,2,0,0,0,0|1,0,0]=3 3824 B14R1.134 COC(=O)[C@@H](N)CC1=CC=C(C=C1)I MCULE-4896055111 [0,2,0,0,0,0|1,0,0]=3 3825 B14R1.134 COC(=O)[C@@H](N)CC1=CC=C(C=C1)I MCULE-6654309833 [0,2,0,0,0,0|1,0,0]=3 3826 B14R1.134 COC(=O)[C@@H](N)CC1=CC=C(C=C1)I MCULE-9059949052 [0,2,0,0,0,0|1,0,0]=3 3827 B14R1.134 COC(=O)[C@@H](N)CC1=CC=C(C=C1)I MCULE-9569962973 [0,2,0,0,0,0|1,0,0]=3 3828 B14R1.134 COC(=O)[C@@H](N)CC1=CC=C(C=C1)N MCULE-5231688460 [0,2,0,0,0,0|0,0,0]=2 3829 B14R1.134 COC(=O)[C@@H](N)CC1=CC=C(C=C1)O MCULE-3639081318 [0,2,0,0,0,0|1,0,0]=3 3830 B14R1.134 COC(=O)[C@@H](N)CC1=CC=C(C=C1)O MCULE-4891329972 [0,2,0,0,0,0|1,0,0]=3 3831 B14R1.134 COC(=O)[C@@H](N)CC1=CC=C(C=C1)O MCULE-5488527585 [0,2,0,0,0,0|1,0,0]=3 3832 B14R1.134 COC(=O)[C@@H](N)CC1=CC=C(C=C1)O MCULE-6767520425 [0,2,0,0,0,0|1,0,0]=3 3833 B14R1.134 COC(=O)[C@@H](N)CC1=CC=C(C=N1)N MCULE-1328382406 [0,2,0,0,0,0|1,0,0]=3 3834 B14R1.134 COC(=O)[C@@H](N)CC1=CC=C(N=C1)Cl MCULE-2900864554 [0,2,0,0,0,0|2,0,0]=4 3835 B14R1.134 COC(=O)[C@@H](N)CC1=CC=C(N=C1)F MCULE-2657036630 [0,2,0,0,0,0|2,0,0]=4 3836 B14R1.134 COC(=O)[C@@H](N)CC1=CC=C(N=C1)N MCULE-1905035771 [0,2,0,0,0,0|1,0,0]=3 3837 B14R1.134 COC(=O)[C@@H](N)CC1=CN=C(C=C1)O MCULE-7417631332 [0,2,0,0,0,0|2,0,0]=4 3838 B14R1.134 COC(=O)[C@@H](N)CC1=CN=C(N=C1)N MCULE-6967615967 [0,2,0,0,0,0|2,0,0]=4 3839 B14R1.134 COC(=O)[C@@H](N)CC1=NC=C(C=C1)Br MCULE-3347873646 [0,2,0,0,0,0|2,0,0]=4 3840 B14R1.134 COC(=O)[C@@H](N)CC1=NC=C(C=C1)Br MCULE-5010999008 [0,2,0,0,0,0|2,0,0]=4 3841 B14R1.134 COC(=O)[C@@H](N)CC1=NC=C(C=C1)Br MCULE-5302238686 [0,2,0,0,0,0|2,0,0]=4 3842 B14R1.134 COC(=O)[C@@H](N)CC1=NC=C(C=C1)Br MCULE-5700103721 [0,2,0,0,0,0|2,0,0]=4 3843 B14R1.134 COC(=O)[C@@H](N)CC1=NC=C(C=C1)Br MCULE-7665487974 [0,2,0,0,0,0|2,0,0]=4 3844 B14R1.134 COC(=O)[C@@H](N)CC1=NC=C(C=C1)C MCULE-4762729046 [0,2,0,0,0,0|2,0,0]=4 3845 B14R1.134 COC(=O)[C@@H](N)CC1=NC=C(C=C1)C MCULE-6264124334 [0,2,0,0,0,0|2,0,0]=4 3846 B14R1.134 COC(=O)[C@@H](N)CC1=NC=C(C=C1)C MCULE-7922080289 [0,2,0,0,0,0|2,0,0]=4 3847 B14R1.134 COC(=O)[C@@H](N)CC1=NC=C(C=C1)C MCULE-9922952846 [0,2,0,0,0,0|2,0,0]=4 3848 B14R1.134 COC(=O)[C@@H](N)CC1=NC=C(C=C1)Cl MCULE-2366181072 [0,2,0,0,0,0|2,0,0]=4 3849 B14R1.134 COC(=O)[C@@H](N)CC1=NC=C(C=C1)Cl MCULE-2760247057 [0,2,0,0,0,0|2,0,0]=4 3850 B14R1.134 COC(=O)[C@@H](N)CC1=NC=C(C=C1)Cl MCULE-2923371127 [0,2,0,0,0,0|2,0,0]=4 3851 B14R1.134 COC(=O)[C@@H](N)CC1=NC=C(C=C1)Cl MCULE-3840225952 [0,2,0,0,0,0|2,0,0]=4 3852 B14R1.134 COC(=O)[C@H](N)CC1=CC=C(C=C1)Br MCULE-3736546940 [0,2,0,0,0,0|1,0,0]=3 3853 B14R1.134 COC(=O)[C@H](N)CC1=CC=C(C=C1)Br MCULE-4142566227 [0,2,0,0,0,0|1,0,0]=3 3854 B14R1.134 COC(=O)[C@H](N)CC1=CC=C(C=C1)Br MCULE-8389307720 [0,2,0,0,0,0|1,0,0]=3 3855 B14R1.134 COC(=O)[C@H](N)CC1=CC=C(C=C1)Br MCULE-9236511141 [0,2,0,0,0,0|1,0,0]=3 3856 B14R1.134 COC(=O)[C@H](N)CC1=CC=C(C=C1)C MCULE-1534800369 [0,2,0,0,0,0|1,0,0]=3 3857 B14R1.134 COC(=O)[C@H](N)CC1=CC=C(C=C1)Cl MCULE-8104662010 [0,2,0,0,0,0|1,0,0]=3 3858 B14R1.134 COC(=O)[C@H](N)CC1=CC=C(C=C1)Cl MCULE-8509190814 [0,2,0,0,0,0|1,0,0]=3 3859 B14R1.134 COC(=O)[C@H](N)CC1=CC=C(C=C1)Cl MCULE-8584379578 [0,2,0,0,0,0|1,0,0]=3 3860 B14R1.134 COC(=O)[C@H](N)CC1=CC=C(C=C1)Cl MCULE-9988362367 [0,2,0,0,0,0|1,0,0]=3 3861 B14R1.134 COC(=O)[C@H](N)CC1=CC=C(C=C1)F MCULE-2754376227 [0,2,0,0,0,0|1,0,0]=3 3862 B14R1.134 COC(=O)[C@H](N)CC1=CC=C(C=C1)F MCULE-4353621391 [0,2,0,0,0,0|1,0,0]=3 3863 B14R1.134 COC(=O)[C@H](N)CC1=CC=C(C=C1)F MCULE-4741818495 [0,2,0,0,0,0|1,0,0]=3 3864 B14R1.134 COC(=O)[C@H](N)CC1=CC=C(C=C1)F MCULE-7907570619 [0,2,0,0,0,0|1,0,0]=3 3865 B14R1.134 COC(=O)[C@H](N)CC1=CC=C(C=C1)N MCULE-2340604471 [0,2,0,0,0,0|0,0,0]=2 3866 B14R1.134 COC(=O)[C@H](N)CC1=CC=C(C=C1)N MCULE-8798277614 [0,2,0,0,0,0|0,0,0]=2 3867 B14R1.134 COC(=O)[C@H](N)CC1=CC=C(C=C1)N MCULE-8894936334 [0,2,0,0,0,0|0,0,0]=2 3868 B14R1.134 COC(=O)[C@H](N)CC1=CC=C(C=C1)O MCULE-1093244420 [0,2,0,0,0,0|1,0,0]=3 3869 B14R1.134 COC(=O)[C@H](N)CC1=CC=C(C=C1)O MCULE-3459932306 [0,2,0,0,0,0|1,0,0]=3 3870 B14R1.134 COC(=O)[C@H](N)CC1=CC=C(C=N1)N MCULE-2915930027 [0,2,0,0,0,0|1,0,0]=3 3871 B14R1.134 COC(=O)[C@H](N)CC1=CC=C(N=C1)Cl MCULE-2953687650 [0,2,0,0,0,0|2,0,0]=4 3872 B14R1.134 COC(=O)[C@H](N)CC1=CC=C(N=C1)F MCULE-4150954455 [0,2,0,0,0,0|2,0,0]=4 3873 B14R1.134 COC(=O)[C@H](N)CC1=CN=C(C=C1)N MCULE-5287437653 [0,2,0,0,0,0|1,0,0]=3 3874 B14R1.134 COC(=O)[C@H](N)CC1=CN=C(C=C1)O MCULE-6480591517 [0,2,0,0,0,0|2,0,0]=4 3875 B14R1.134 COC(=O)[C@H](N)CC1=CN=C(N=C1)N MCULE-7186770681 [0,2,0,0,0,0|2,0,0]=4 3876 B14R1.134 COC(=O)[C@H](O)CC1=CC=C(C=C1)Br MCULE-3458354643 [0,2,0,0,0,0|1,0,0]=3 3877 B14R1.134 COC(=O)[C@H](O)CC1=CC=C(C=C1)F MCULE-7469100858 [0,2,0,0,0,0|1,0,0]=3 3878 B14R1.134 COC(=O)[C@H](O)CC1=CC=C(C=C1)F MCULE-9469164096 [0,2,0,0,0,0|1,0,0]=3 3879 B14R1.134 NNC(=O)C(N)CC1=CC=C(C=C1)O MCULE-5024166912 [0,2,0,0,0,0|2,0,0]=4 3880 B14R1.134 NNC(=O)[C@@H](N)CC1=CC=C(C=C1)O MCULE-4956549262 [0,2,0,0,0,0|2,0,0]=4 3881 B14R1.134 NNC(=O)[C@@H](N)CC1=CC=C(C=C1)O MCULE-6195685530 [0,2,0,0,0,0|2,0,0]=4 3882 B14R1.134 [C@@H](C)(OC1=CC=C(C=C1)O)C(=O)OC MCULE-3474934829 [0,2,0,0,0,0|2,0,0]=4 3883 B14R1.134 [C@@H](N)(CC1=CC=C(C=C1)N)C(=O)OC MCULE-7022848005 [0,2,0,0,0,0|0,0,0]=2 3884 B14R1.134 [C@@H](N)(CC1=CC=C(C=C1)O)C(=O)OC MCULE-3211279606 [0,2,0,0,0,0|1,0,0]=3 3885 B14R1.134 [C@@H](N)(CC1=CC=C(C=C1)O)C(=O)OC MCULE-9433306799 [0,2,0,0,0,0|1,0,0]=3 3886 B14R1.293 CNS(=O)(=O)CCC1=CC=C(C=C1)N MCULE-2362545674 [0,2,0,0,0,0|1,0,1]=4 3887 B14R1.502 CCNC(=O)CCC1=CC=C(C=C1)F MCULE-4315183093 [0,2,0,0,0,0|2,0,0]=4 3888 B14R1.502 CCNC(=O)CCC1=CC=C(C=C1)I MCULE-1134499992 [0,2,0,0,0,0|2,0,0]=4 3889 B14R1.502 CCNC(=O)COC1=CC=C(C=C1)N MCULE-8182711287 [0,2,0,0,0,0|2,0,0]=4 3890 B14R1.502 CCNC(=O)NCC1=CC=C(C=C1)N MCULE-2544035306 [0,2,0,0,0,0|2,0,0]=4 3891 B14R1.502 CCOC(=O)/C=C/C1=CC=C(C=C1)N MCULE-2870787615 [0,2,0,0,0,0|0,0,2]=4 3892 B14R1.502 CCOC(=O)C=CC1=CC=C(C=C1)N MCULE-5512198276 [0,2,0,0,0,0|0,0,2]=4 3893 B14R1.502 CCOC(=O)CCC1=CC=C(C=C1)Br MCULE-2649536847 [0,2,0,0,0,0|1,0,0]=3 3894 B14R1.502 CCOC(=O)CCC1=CC=C(C=C1)C MCULE-3490922661 [0,2,0,0,0,0|1,0,0]=3 3895 B14R1.502 CCOC(=O)CCC1=CC=C(C=C1)Cl MCULE-9138171217 [0,2,0,0,0,0|1,0,0]=3 3896 B14R1.502 CCOC(=O)CCC1=CC=C(C=C1)F MCULE-2994577343 [0,2,0,0,0,0|1,0,0]=3 3897 B14R1.502 CCOC(=O)CCC1=CC=C(C=C1)N MCULE-1054193893 [0,2,0,0,0,0|0,0,0]=2 3898 B14R1.502 CCOC(=O)CCC1=CC=C(C=C1)N MCULE-1232818667 [0,2,0,0,0,0|0,0,0]=2 3899 B14R1.502 CCOC(=O)CCC1=CC=C(C=C1)O MCULE-8967853929 [0,2,0,0,0,0|1,0,0]=3 3900 B14R1.502 CCOC(=O)CCC1=CC=C(N=C1)Br MCULE-8217330722 [0,2,0,0,0,0|2,0,0]=4 3901 B14R1.502 CCOC(=O)CCC1=CC=C(N=C1)F MCULE-2419717515 [0,2,0,0,0,0|2,0,0]=4 3902 B14R1.502 CCOC(=O)CCC1=CC=C(N=C1)N MCULE-7385517421 [0,2,0,0,0,0|1,0,0]=3 3903 B14R1.502 CCOC(=O)CCC1=NC=C(C=C1)Br MCULE-4315106179 [0,2,0,0,0,0|2,0,0]=4 3904 B14R1.502 CCOC(=O)CNC1=CC=C(C=C1)Br MCULE-7403967980 [0,2,0,0,0,0|2,0,0]=4 3905 B14R1.502 CCOC(=O)CNC1=CC=C(C=C1)C MCULE-7729989314 [0,2,0,0,0,0|2,0,0]=4 3906 B14R1.502 CCOC(=O)CNC1=CC=C(C=C1)Cl MCULE-7505203206 [0,2,0,0,0,0|2,0,0]=4 3907 B14R1.502 CCOC(=O)CNC1=CC=C(C=C1)F MCULE-8266153304 [0,2,0,0,0,0|2,0,0]=4 3908 B14R1.502 CCOC(=O)CNC1=CC=C(C=C1)I MCULE-7378164425 [0,2,0,0,0,0|2,0,0]=4 3909 B14R1.502 CCOC(=O)CNC1=CC=C(C=C1)I MCULE-7616755082 [0,2,0,0,0,0|2,0,0]=4 3910 B14R1.502 CCOC(=O)CNC1=CC=C(C=C1)O MCULE-9072560768 [0,2,0,0,0,0|2,0,0]=4 3911 B14R1.502 CCOC(=O)COC1=CC=C(C=C1)Br MCULE-6273937866 [0,2,0,0,0,0|2,0,0]=4 3912 B14R1.502 CCOC(=O)COC1=CC=C(C=C1)C MCULE-2171978933 [0,2,0,0,0,0|2,0,0]=4 3913 B14R1.502 CCOC(=O)COC1=CC=C(C=C1)Cl MCULE-9387657861 [0,2,0,0,0,0|2,0,0]=4 3914 B14R1.502 CCOC(=O)COC1=CC=C(C=C1)F MCULE-9963405269 [0,2,0,0,0,0|2,0,0]=4 3915 B14R1.502 CCOC(=O)COC1=CC=C(C=C1)I MCULE-6848509425 [0,2,0,0,0,0|2,0,0]=4 3916 B14R1.502 CCOC(=O)COC1=CC=C(C=C1)N MCULE-4502877690 [0,2,0,0,0,0|1,0,0]=3 3917 B14R1.502 CCOC(=O)COC1=CC=C(C=C1)O MCULE-9937421120 [0,2,0,0,0,0|2,0,0]=4 3918 B14R1.502 CCOC(=O)COC1=CN=C(C=C1)N MCULE-8821194356 [0,2,0,0,0,0|2,0,0]=4 3919 B14R1.502 CCOC(=O)CSC1=CC=C(C=C1)Br MCULE-8379387539 [0,2,0,0,0,0|2,0,0]=4 3920 B14R1.502 CCOC(=O)CSC1=CC=C(C=C1)C MCULE-4652519777 [0,2,0,0,0,0|2,0,0]=4 3921 B14R1.502 CCOC(=O)CSC1=CC=C(C=C1)Cl MCULE-1175485104 [0,2,0,0,0,0|2,0,0]=4 3922 B14R1.502 CCOC(=O)CSC1=CC=C(C=C1)F MCULE-4682941775 [0,2,0,0,0,0|2,0,0]=4 3923 B14R1.502 CCOC(=O)CSC1=CC=C(C=C1)O MCULE-3228792586 [0,2,0,0,0,0|2,0,0]=4 3924 B14R1.502 CCOC(=O)NCC1=CC=C(C=C1)Cl MCULE-7074786909 [0,2,0,0,0,0|2,0,0]=4 3925 B14R1.502 COCC(=O)NCC1=CC=C(C=C1)Cl MCULE-1053574066 [0,2,0,0,0,0|2,0,0]=4 3926 B14R1.502 COCC(=O)NCC1=CC=C(C=C1)F MCULE-2769404692 [0,2,0,0,0,0|2,0,0]=4 3927 B14R1.502 NOCC(=O)NCC1=CC=C(C=C1)Cl MCULE-8280170430 [0,2,0,0,0,0|2,0,0]=4 3928 B14R1.502 NOCC(=O)NCC1=CC=C(C=C1)Cl MCULE-8440253997 [0,2,0,0,0,0|2,0,0]=4 3929 B14R1.727 CNC(=O)COC1=CC=C(C=C1Br)N MCULE-7226886081 [0,2,0,0,0,0|2,0,0]=4 3930 B14R1.727 CNC(=O)COC1=CC=C(C=C1C)N MCULE-6848783435 [0,2,0,0,0,0|2,0,0]=4 3931 B14R1.727 CNC(=O)COC1=CC=C(C=C1Cl)N MCULE-8210441889 [0,2,0,0,0,0|2,0,0]=4 3932 B14R1.727 COC(=O)CCC1=C(C=C(C=C1)Br)F MCULE-5599057413 [0,2,0,0,0,0|1,0,0]=3 3933 B14R1.727 COC(=O)CCC1=CC=C(C=C1C)O MCULE-5404010783 [0,2,0,0,0,0|1,0,0]=3 3934 B14R1.727 COC(=O)CCC1=CC=C(C=C1F)N MCULE-8019934405 [0,2,0,0,0,0|0,0,0]=2 3935 B14R1.727 COC(=O)CCC1=CC=C(C=C1F)O MCULE-1094481148 [0,2,0,0,0,0|1,0,0]=3 3936 B14R1.727 COC(=O)CCC1=CC=C(C=C1N)Br MCULE-3004148573 [0,2,0,0,0,0|1,0,0]=3 3937 B14R1.727 COC(=O)CCC1=CC=C(C=C1N)Br MCULE-3156855499 [0,2,0,0,0,0|1,0,0]=3 3938 B14R1.727 COC(=O)CCC1=CC=C(C=C1N)Cl MCULE-8652868775 [0,2,0,0,0,0|1,0,0]=3 3939 B14R1.727 COC(=O)CCC1=CC=C(C=C1O)Br MCULE-2046547148 [0,2,0,0,0,0|1,0,0]=3 3940 B14R1.727 COC(=O)CCC1=CC=C(C=C1O)O MCULE-3234016164 [0,2,0,0,0,0|1,0,0]=3 3941 B14R1.727 COC(=O)COC1=C(C=C(C=C1)C)C MCULE-1766902741 [0,2,0,0,0,0|2,0,0]=4 3942 B14R1.727 COC(=O)COC1=C(C=C(C=C1)Cl)C MCULE-2053345958 [0,2,0,0,0,0|2,0,0]=4 3943 B14R1.727 COC(=O)COC1=C(C=C(C=C1)Cl)Cl MCULE-4563470246 [0,2,0,0,0,0|2,0,0]=4 3944 B14R1.727 COC(=O)COC1=C(C=C(C=C1)F)F MCULE-9095418123 [0,2,0,0,0,0|2,0,0]=4 3945 B14R1.727 COC(=O)COC1=C(C=C(C=C1)N)Cl MCULE-7693842156 [0,2,0,0,0,0|1,0,0]=3 3946 B14R1.727 COC(=O)COC1=CC=C(C=C1C)N MCULE-1992199896 [0,2,0,0,0,0|1,0,0]=3 3947 B14R1.727 COC(=O)COC1=CC=C(C=C1C)O MCULE-8607397973 [0,2,0,0,0,0|2,0,0]=4 3948 B14R1.727 COC(=O)COC1=CC=C(C=C1Cl)I MCULE-4892806503 [0,2,0,0,0,0|2,0,0]=4 3949 B14R1.727 COC(=O)CSC1=C(C=C(C=C1)Cl)Cl MCULE-8238278200 [0,2,0,0,0,0|2,0,0]=4 3950 B14R1.727 COC(=O)NCC1=C(C=C(C=C1)Cl)Cl MCULE-5706422231 [0,2,0,0,0,0|2,0,0]=4 3951 B14R1.727 O=C(COC1=C(C=C(C=C1)Cl)Cl)NO MCULE-6309848033 [0,2,0,0,0,0|2,0,0]=4 3952 B14R1.833 CNC(=O)COC1=CC(=C(C=C1)N)C MCULE-3533387182 [0,2,0,0,0,0|2,0,0]=4 3953 B14R1.833 CNC(=O)COC1=CC(=C(C=C1)N)F MCULE-6927313997 [0,2,0,0,0,0|2,0,0]=4 3954 B14R1.833 CNC(=O)COC1=CC=C(C(=C1)Cl)N MCULE-2412560769 [0,2,0,0,0,0|2,0,0]=4 3955 B14R1.833 COC(=O)C=CC1=CC=C(C(=C1)O)N MCULE-1811724576 [0,2,0,0,0,0|0,0,2]=4 3956 B14R1.833 COC(=O)CCC1=CC(=C(C=C1)O)C MCULE-2231272128 [0,2,0,0,0,0|1,0,0]=3 3957 B14R1.833 COC(=O)CCC1=CC(=C(C=C1)O)Cl MCULE-3425984228 [0,2,0,0,0,0|1,0,0]=3 3958 B14R1.833 COC(=O)CCC1=CC(=C(C=C1)O)N MCULE-6886622323 [0,2,0,0,0,0|1,0,0]=3 3959 B14R1.833 COC(=O)CCC1=CC=C(C(=C1)C)C MCULE-7641046378 [0,2,0,0,0,0|1,0,0]=3 3960 B14R1.833 COC(=O)CCC1=CC=C(C(=C1)F)Br MCULE-5266202972 [0,2,0,0,0,0|1,0,0]=3 3961 B14R1.833 COC(=O)CCC1=CC=C(C(=C1)N)C MCULE-2605526215 [0,2,0,0,0,0|1,0,0]=3 3962 B14R1.833 COC(=O)CCC1=CC=C(C(=C1)O)O MCULE-7293268100 [0,2,0,0,0,0|1,0,0]=3 3963 B14R1.833 COC(=O)CNC1=CC(=C(C=C1)Cl)Cl MCULE-9618703931 [0,2,0,0,0,0|2,0,0]=4 3964 B14R1.833 COC(=O)CNC1=CC=C(C(=C1)C)C MCULE-5371858517 [0,2,0,0,0,0|2,0,0]=4 3965 B14R1.833 COC(=O)COC1=CC(=C(C=C1)Br)N MCULE-8770674858 [0,2,0,0,0,0|2,0,0]=4 3966 B14R1.833 COC(=O)COC1=CC(=C(C=C1)Cl)F MCULE-7247006258 [0,2,0,0,0,0|2,0,0]=4 3967 B14R1.833 COC(=O)COC1=CC(=C(C=C1)Cl)N MCULE-2622745578 [0,2,0,0,0,0|2,0,0]=4 3968 B14R1.833 COC(=O)COC1=CC(=C(C=C1)N)C MCULE-7932421058 [0,2,0,0,0,0|1,0,0]=3 3969 B14R1.833 COC(=O)COC1=CC=C(C(=C1)F)Br MCULE-6137350100 [0,2,0,0,0,0|2,0,0]=4 3970 B14R1.833 COC(=O)COC1=CC=C(C(=C1)N)C MCULE-7624914996 [0,2,0,0,0,0|2,0,0]=4 3971 B14R1.833 COC(=O)NCC1=CC(=C(C=C1)Cl)Cl MCULE-2270298821 [0,2,0,0,0,0|2,0,0]=4 3972 B14R1.833 NNC(=O)CCC1=CC=C(C(=C1)O)O MCULE-3981176591 [0,2,0,0,0,0|2,0,0]=4 3973 B14R1.132 CC(=O)C(Br)C(Br)C1=CC=C(C=C1)Cl MCULE-1559770938 [0,2,0,0,0,0|2,0,0]=4 3974 B14R1.132 CC(C(=O)O)C(C)C1=CC=C(C=C1)F MCULE-5595206749 [0,2,0,0,0,0|1,0,0]=3 3975 B14R1.132 CC(C(=O)O)C(N)C1=CC=C(C=C1)Br MCULE-8207953282 [0,2,0,0,0,0|1,0,0]=3 3976 B14R1.132 CC(C(=O)O)C(N)C1=CC=C(C=C1)Br MCULE-9356450624 [0,2,0,0,0,0|1,0,0]=3 3977 B14R1.132 CC(C(=O)O)C(N)C1=CC=C(C=C1)Cl MCULE-2249037524 [0,2,0,0,0,0|1,0,0]=3 3978 B14R1.132 CC(C1=CC=C(C=C1)O)C(N)C(=O)O MCULE-6259455399 [0,2,0,0,0,0|1,0,0]=3 3979 B14R1.132 CC(C1=CC=C(C=C1)O)C(N)C(=O)O MCULE-8474638573 [0,2,0,0,0,0|1,0,0]=3 3980 B14R1.132 CC1=CC=C(C=C1)C(C)C(O)C(=O)O MCULE-3645039704 [0,2,0,0,0,0|1,0,0]=3 3981 B14R1.132 CC1=CC=C(C=C1)C(N)C(O)C(=O)O MCULE-8086249372 [0,2,0,0,0,0|1,0,0]=3 3982 B14R1.132 CC1=CC=C(C=C1)C(O)C(C)C(=O)O MCULE-3320701404 [0,2,0,0,0,0|1,0,0]=3 3983 B14R1.132 CC1=CC=C(C=C1)[C@@H](N)[C@@H](O)C(=O)O MCULE-1489001694 [0,2,0,0,0,0|1,0,0]=3 3984 B14R1.132 CC1=CC=C(C=C1)[C@H](N)[C@H](O)C(=O)O MCULE-4257660990 [0,2,0,0,0,0|1,0,0]=3 3985 B14R1.132 C[C@@H](C1=CC=C(C=C1)O)[C@@H](N)C(=O)O MCULE-4164369820 [0,2,0,0,0,0|1,0,0]=3 3986 B14R1.132 C[C@@H](C1=CC=C(C=C1)O)[C@@H](N)C(=O)O MCULE-9153572827 [0,2,0,0,0,0|1,0,0]=3 3987 B14R1.132 C[C@@H](C1=CC=C(C=C1)O)[C@H](N)C(=O)O MCULE-1338232690 [0,2,0,0,0,0|1,0,0]=3 3988 B14R1.132 C[C@@H](C1=CC=C(C=C1)O)[C@H](N)C(=O)O MCULE-2704583999 [0,2,0,0,0,0|1,0,0]=3 3989 B14R1.132 C[C@H](C1=CC=C(C=C1)O)[C@@H](N)C(=O)O MCULE-3516148226 [0,2,0,0,0,0|1,0,0]=3 3990 B14R1.132 C[C@H](C1=CC=C(C=C1)O)[C@@H](N)C(=O)O MCULE-5568245506 [0,2,0,0,0,0|1,0,0]=3 3991 B14R1.132 C[C@H](C1=CC=C(C=C1)O)[C@H](N)C(=O)O MCULE-4556854678 [0,2,0,0,0,0|1,0,0]=3 3992 B14R1.132 C[C@H](C1=CC=C(C=C1)O)[C@H](N)C(=O)O MCULE-7902457386 [0,2,0,0,0,0|1,0,0]=3 3993 B14R1.132 NC(C1=CC=C(C=C1)F)C(O)C(=O)O MCULE-9502027591 [0,2,0,0,0,0|1,0,0]=3 3994 B14R1.132 N[C@@H](C1=CC=C(C=C1)F)[C@H](O)C(=O)O MCULE-9946682486 [0,2,0,0,0,0|1,0,0]=3 3995 B14R1.132 N[C@H](C(=O)O)[C@H](O)C1=CC=C(C=C1)O MCULE-7692262067 [0,2,0,0,0,0|1,0,0]=3 3996 B14R1.132 N[C@H](C1=CC=C(C=C1)F)[C@@H](O)C(=O)O MCULE-4222545875 [0,2,0,0,0,0|1,0,0]=3 3997 B14R1.132 O=C(O)C(=O)C(O)C1=CC=C(C=C1)O MCULE-1954387232 [0,2,0,0,0,0|1,0,1]=4 3998 B14R1.132 O=C(O)C(Br)C(Br)C1=CC=C(C=C1)Cl MCULE-7064644960 [0,2,0,0,0,0|1,0,0]=3 3999 B14R1.132 O=C(O)C(Br)C(Br)C1=CC=C(C=C1)F MCULE-6848465312 [0,2,0,0,0,0|1,0,0]=3 4000 B14R1.132 O=C(O)C(O)C(O)C1=CC=C(C=C1)O MCULE-6635032478 [0,2,0,0,0,0|1,0,0]=3 4001 B14R1.683 CS(=O)(=O)CC(O)C1=CC=C(C=C1)N MCULE-2395186992 [0,2,0,0,0,0|1,0,1]=4 4002 B14R1.685 CC(CC(=O)O)C1=CC(=C(C=C1)F)Br MCULE-6731789737 [0,2,0,0,0,0|1,0,0]=3 4003 B14R1.685 CC(CC(=O)O)C1=CC(=C(C=C1)F)F MCULE-5191925703 [0,2,0,0,0,0|1,0,0]=3 4004 B14R1.685 CC1=C(C=C(C=C1)C(C)CC(=O)O)C MCULE-3075072518 [0,2,0,0,0,0|1,0,0]=3 4005 B14R1.685 CC1=C(C=C(C=C1)C(N)CC(=O)O)C MCULE-3627468510 [0,2,0,0,0,0|1,0,0]=3 4006 B14R1.685 CC1=C(C=C(C=C1)C(N)CC(=O)O)C MCULE-5730650626 [0,2,0,0,0,0|1,0,0]=3 4007 B14R1.685 CC1=C(C=C(C=C1)C(N)CC(=O)O)C MCULE-7244344096 [0,2,0,0,0,0|1,0,0]=3 4008 B14R1.685 CC1=C(C=CC(=C1)C(C)CC(=O)O)F MCULE-3893747443 [0,2,0,0,0,0|1,0,0]=3 4009 B14R1.685 CC1=CC=C(C=C1C)C(N)CC(=O)O MCULE-3559463111 [0,2,0,0,0,0|1,0,0]=3 4010 B14R1.685 CC1=CC=C(C=C1C)[C@H](N)CC(=O)O MCULE-1585011194 [0,2,0,0,0,0|1,0,0]=3 4011 B14R1.685 CC1=CC=C(C=C1C)[C@H](N)CC(=O)O MCULE-3067637460 [0,2,0,0,0,0|1,0,0]=3 4012 B14R1.685 CC1=CC=C(C=C1C)[C@H](N)CC(=O)O MCULE-8091124430 [0,2,0,0,0,0|1,0,0]=3 4013 B14R1.685 CC1=CC=C(C=C1C)[C@H](N)CC(=O)O MCULE-9509486588 [0,2,0,0,0,0|1,0,0]=3 4014 B14R1.685 CC1=CC=C(C=C1F)C(N)CC(=O)O MCULE-4219900739 [0,2,0,0,0,0|1,0,0]=3 4015 B14R1.685 NC(CC(=O)O)C1=CC(=C(C=C1)Cl)Cl MCULE-4008073985 [0,2,0,0,0,0|1,0,0]=3 4016 B14R1.685 NC(CC(=O)O)C1=CC(=C(C=C1)Cl)Cl MCULE-5863470522 [0,2,0,0,0,0|1,0,0]=3 4017 B14R1.685 NC(CC(=O)O)C1=CC(=C(C=C1)Cl)Cl MCULE-9969089040 [0,2,0,0,0,0|1,0,0]=3 4018 B14R1.685 NC(CC(=O)O)C1=CC(=C(C=C1)F)Cl MCULE-7733375262 [0,2,0,0,0,0|1,0,0]=3 4019 B14R1.685 NC(CC(=O)O)C1=CC(=C(C=C1)O)F MCULE-9375455284 [0,2,0,0,0,0|1,0,0]=3 4020 B14R1.685 NC(CC(=O)O)C1=CC(=C(C=C1)O)O MCULE-9101817162 [0,2,0,0,0,0|1,0,0]=3 4021 B14R1.685 NC(CC(=O)O)C1=CC=C(C(=C1)Br)F MCULE-3620079983 [0,2,0,0,0,0|1,0,0]=3 4022 B14R1.685 NC(CC(=O)O)C1=CC=C(C(=C1)Br)O MCULE-8348396513 [0,2,0,0,0,0|1,0,0]=3 4023 B14R1.685 NC(CC(=O)O)C1=CC=C(C(=C1)Cl)Cl MCULE-7471386964 [0,2,0,0,0,0|1,0,0]=3 4024 B14R1.685 NC(CC(=O)O)C1=CC=C(C(=C1)F)Br MCULE-4304048995 [0,2,0,0,0,0|1,0,0]=3 4025 B14R1.685 NC(CC(=O)O)C1=CC=C(C(=C1)F)Br MCULE-6617565377 [0,2,0,0,0,0|1,0,0]=3 4026 B14R1.685 NC(CC(=O)O)C1=CC=C(C(=C1)F)F MCULE-2061577739 [0,2,0,0,0,0|1,0,0]=3 4027 B14R1.685 NC(CC(=O)O)C1=CC=C(C(=C1)F)F MCULE-3564647536 [0,2,0,0,0,0|1,0,0]=3 4028 B14R1.685 NC(CC(=O)O)C1=CC=C(C(=C1)F)O MCULE-6567660688 [0,2,0,0,0,0|1,0,0]=3 4029 B14R1.685 N[C@@H](CC(=O)O)C1=CC(=C(C=C1)Cl)Cl MCULE-2561569564 [0,2,0,0,0,0|1,0,0]=3 4030 B14R1.685 N[C@@H](CC(=O)O)C1=CC(=C(C=C1)Cl)Cl MCULE-3754418076 [0,2,0,0,0,0|1,0,0]=3 4031 B14R1.685 N[C@@H](CC(=O)O)C1=CC=C(C(=C1)F)F MCULE-1836012618 [0,2,0,0,0,0|1,0,0]=3 4032 B14R1.685 N[C@@H](CC(=O)O)C1=CC=C(C(=C1)F)F MCULE-2102518281 [0,2,0,0,0,0|1,0,0]=3 4033 B14R1.685 N[C@@H](CC(=O)O)C1=CC=C(C(=C1)F)F MCULE-6845732565 [0,2,0,0,0,0|1,0,0]=3 4034 B14R1.685 N[C@H](CC(=O)O)C1=CC(=C(C=C1)Cl)Cl MCULE-9928618976 [0,2,0,0,0,0|1,0,0]=3 4035 B14R1.685 N[C@H](CC(=O)O)C1=CC(=C(C=C1)F)F MCULE-3919975063 [0,2,0,0,0,0|1,0,0]=3 4036 B14R1.685 N[C@H](CC(=O)O)C1=CC=C(C(=C1)Cl)Cl MCULE-2184659854 [0,2,0,0,0,0|1,0,0]=3 4037 B14R1.685 N[C@H](CC(=O)O)C1=CC=C(C(=C1)Cl)Cl MCULE-3124236631 [0,2,0,0,0,0|1,0,0]=3 4038 B14R1.685 N[C@H](CC(=O)O)C1=CC=C(C(=C1)Cl)Cl MCULE-5895623767 [0,2,0,0,0,0|1,0,0]=3 4039 B14R1.685 N[C@H](CC(=O)O)C1=CC=C(C(=C1)F)F MCULE-9189799173 [0,2,0,0,0,0|1,0,0]=3 4040 B14R1.694 CC(=O)CC(C)(C)C1=CC=C(C=C1)C MCULE-6481581484 [0,2,0,0,0,0|2,0,0]=4 4041 B14R1.694 CC(=O)CC(C)(C)C1=CC=C(C=C1)Cl MCULE-7760338163 [0,2,0,0,0,0|2,0,0]=4 4042 B14R1.694 CC(C)(CC(=O)O)C1=CC=C(C=C1)Br MCULE-5739520416 [0,2,0,0,0,0|1,0,0]=3 4043 B14R1.694 CC(C)(CC(=O)O)C1=CC=C(C=C1)Cl MCULE-7229043791 [0,2,0,0,0,0|1,0,0]=3 4044 B14R1.694 CC(C)(CC(=O)O)C1=CC=C(C=C1)F MCULE-5641085017 [0,2,0,0,0,0|1,0,0]=3 4045 B14R1.694 CC(C)(CC(=O)O)C1=CC=C(C=C1)N MCULE-4175276373 [0,2,0,0,0,0|0,0,0]=2 4046 B14R1.694 CC(C)(CC(=O)O)C1=CC=C(C=C1)O MCULE-8856595939 [0,2,0,0,0,0|1,0,0]=3 4047 B14R1.694 CC1=CC=C(C=C1)C(C)(C)CC(=O)O MCULE-7195220091 [0,2,0,0,0,0|1,0,0]=3 4048 B14R1.694 CC1=CC=C(C=C1)S(=O)(=O)CC(=O)O MCULE-2466714868 [0,2,0,0,0,0|2,0,0]=4 4049 B14R1.694 O=C(O)CC(F)(F)C1=CC=C(C=C1)F MCULE-3599415396 [0,2,0,0,0,0|1,0,0]=3 4050 B14R1.694 O=C(O)CP(=O)(O)C1=CC=C(C=C1)Cl MCULE-6895418851 [0,2,0,0,0,0|2,0,0]=4 4051 B14R1.694 O=C(O)CS(=O)(=O)C1=CC=C(C=C1)Br MCULE-9504121909 [0,2,0,0,0,0|2,0,0]=4 4052 B14R1.694 O=C(O)CS(=O)(=O)C1=CC=C(C=C1)Cl MCULE-2235498628 [0,2,0,0,0,0|2,0,0]=4 4053 B14R1.694 O=C(O)CS(=O)(=O)C1=CC=C(C=C1)F MCULE-6764463071 [0,2,0,0,0,0|2,0,0]=4 4054 B14R1.1019 CC1=CC=C(C=C1)C(CN)CC(=O)O MCULE-6826485315 [0,2,0,0,0,0|1,0,0]=3 4055 B14R1.1019 CC1=CC=C(C=C1)C(CN)CC(=O)O MCULE-9769489437 [0,2,0,0,0,0|1,0,0]=3 4056 B14R1.1019 CC1=CC=C(C=C1)[C@@H](CN)CC(=O)O MCULE-3255865193 [0,2,0,0,0,0|1,0,0]=3 4057 B14R1.1019 CC1=CC=C(C=C1)[C@H](CN)CC(=O)O MCULE-2316285973 [0,2,0,0,0,0|1,0,0]=3 4058 B14R1.1019 CCC(CC(=O)O)C1=CC=C(C=C1)C MCULE-7103519000 [0,2,0,0,0,0|1,0,0]=3 4059 B14R1.1019 CCC(CC(=O)O)C1=CC=C(C=C1)F MCULE-6068172841 [0,2,0,0,0,0|1,0,0]=3 4060 B14R1.1019 CN[C@@H](CC(=O)O)C1=CC=C(C=C1)O MCULE-6969289416 [0,2,0,0,0,0|1,0,0]=3 4061 B14R1.1019 N#CC(CC(=O)O)C1=CC=C(C=C1)Br MCULE-6417077264 [0,2,0,0,0,0|1,0,0]=3 4062 B14R1.1019 N#CC(CC(=O)O)C1=CC=C(C=C1)Cl MCULE-9921201880 [0,2,0,0,0,0|1,0,0]=3 4063 B14R1.1019 N#CC(CC(=O)O)C1=CC=C(C=C1)F MCULE-7576020220 [0,2,0,0,0,0|1,0,0]=3 4064 B14R1.1019 NCC(CC(=O)O)C1=CC=C(C=C1)Cl MCULE-2275748923 [0,2,0,0,0,0|1,0,0]=3 4065 B14R1.1019 NCC(CC(=O)O)C1=CC=C(C=C1)Cl MCULE-4066377889 [0,2,0,0,0,0|1,0,0]=3 4066 B14R1.1019 NCC(CC(=O)O)C1=CC=C(C=C1)F MCULE-1489437371 [0,2,0,0,0,0|1,0,0]=3 4067 B14R1.1019 NCC(CC(=O)O)C1=CC=C(C=C1)F MCULE-1964980329 [0,2,0,0,0,0|1,0,0]=3 4068 B14R1.1019 NC[C@@H](CC(=O)O)C1=CC=C(C=C1)Cl MCULE-1204887578 [0,2,0,0,0,0|1,0,0]=3 4069 B14R1.1019 NC[C@@H](CC(=O)O)C1=CC=C(C=C1)Cl MCULE-6753582017 [0,2,0,0,0,0|1,0,0]=3 4070 B14R1.1019 NC[C@@H](CC(=O)O)C1=CC=C(C=C1)Cl MCULE-8553382917 [0,2,0,0,0,0|1,0,0]=3 4071 B14R1.1019 NC[C@@H](CC(=O)O)C1=CC=C(C=C1)F MCULE-4597767488 [0,2,0,0,0,0|1,0,0]=3 4072 B14R1.1019 NC[C@@H](CC(=O)O)C1=CC=C(C=C1)F MCULE-6686995956 [0,2,0,0,0,0|1,0,0]=3 4073 B14R1.1019 NC[C@H](CC(=O)O)C1=CC=C(C=C1)Cl MCULE-6457876112 [0,2,0,0,0,0|1,0,0]=3 4074 B14R1.1019 NC[C@H](CC(=O)O)C1=CC=C(C=C1)F MCULE-6712694713 [0,2,0,0,0,0|1,0,0]=3 4075 B14R1.1019 NC[C@H](CC(=O)O)C1=CC=C(C=C1)F MCULE-7949849581 [0,2,0,0,0,0|1,0,0]=3 4076 B14R1.1019 O=C(O)CC(CO)C1=CC=C(C=C1)Cl MCULE-1532930084 [0,2,0,0,0,0|1,0,0]=3 4077 B14R1.1019 O=C([O-])CC(CO)C1=CC=C(C=C1)Cl MCULE-8826882796 [0,2,0,0,0,0|1,0,1]=4 4078 B14R1.1019 [C@@H](CN)(CC(=O)O)C1=CC=C(C=C1)Cl MCULE-5448996279 [0,2,0,0,0,0|1,0,0]=3 4079 B14R1.1019 [C@@H](CN)(CC(=O)O)C1=CC=C(C=C1)Cl MCULE-7598463157 [0,2,0,0,0,0|1,0,0]=3 4080 B14R1.1019 [C@@H](CN)(CC(=O)O)C1=CC=C(C=C1)Cl MCULE-8004972280 [0,2,0,0,0,0|1,0,0]=3 4081 B14R1.6048 CC(CC(=O)O)C1=C(C=C(C=C1)F)F MCULE-2905530947 [0,2,0,0,0,0|1,0,0]=3 4082 B14R1.6048 CC1=C(C=CC(=C1)Br)C(N)CC(=O)O MCULE-5465957494 [0,2,0,0,0,0|1,0,0]=3 4083 B14R1.6048 CC1=C(C=CC(=C1)Br)C(O)CC(=O)O MCULE-2363491273 [0,2,0,0,0,0|1,0,0]=3 4084 B14R1.6048 CC1=CC(=C(C=C1)C(N)CC(=O)O)C MCULE-1988677976 [0,2,0,0,0,0|1,0,0]=3 4085 B14R1.6048 NC(CC(=O)O)C1=C(C=C(C=C1)Cl)Br MCULE-3058956146 [0,2,0,0,0,0|1,0,0]=3 4086 B14R1.6048 NC(CC(=O)O)C1=C(C=C(C=C1)Cl)Cl MCULE-8675087298 [0,2,0,0,0,0|1,0,0]=3 4087 B14R1.6048 NC(CC(=O)O)C1=C(C=C(C=C1)F)Br MCULE-5788393457 [0,2,0,0,0,0|1,0,0]=3 4088 B14R1.6048 NC(CC(=O)O)C1=C(C=C(C=C1)F)F MCULE-2377672133 [0,2,0,0,0,0|1,0,0]=3 4089 B14R1.6048 NC(CC(=O)O)C1=C(C=C(C=C1)F)F MCULE-6502494552 [0,2,0,0,0,0|1,0,0]=3 4090 B14R1.6048 NC(CC(=O)O)C1=CC=C(C=C1F)Br MCULE-5289919141 [0,2,0,0,0,0|1,0,0]=3 4091 B14R1.6048 NC(CC(=O)O)C1=CC=C(C=C1F)Cl MCULE-3718462805 [0,2,0,0,0,0|1,0,0]=3 4092 B14R1.6048 NC(CC(=O)O)C1=CC=C(C=C1F)Cl MCULE-4027561733 [0,2,0,0,0,0|1,0,0]=3 4093 B14R1.6048 NC(CC(=O)O)C1=CC=C(C=C1O)O MCULE-5865140027 [0,2,0,0,0,0|1,0,0]=3 4094 B14R1.6048 N[C@@H](CC(=O)O)C1=C(C=C(C=C1)Cl)Cl MCULE-6942364069 [0,2,0,0,0,0|1,0,0]=3 4095 B14R1.6048 N[C@@H](CC(=O)O)C1=C(C=C(C=C1)F)F MCULE-1039838136 [0,2,0,0,0,0|1,0,0]=3 4096 B14R1.6048 N[C@@H](CC(=O)O)C1=C(C=C(C=C1)F)F MCULE-5281810391 [0,2,0,0,0,0|1,0,0]=3 4097 B14R1.6048 N[C@@H](CC(=O)O)C1=C(C=C(C=C1)F)F MCULE-8117390345 [0,2,0,0,0,0|1,0,0]=3 4098 B14R1.6048 N[C@@H](CC(=O)O)C1=CC=C(C=C1Cl)Cl MCULE-1674101825 [0,2,0,0,0,0|1,0,0]=3 4099 B14R1.6048 N[C@@H](CC(=O)O)C1=CC=C(C=C1F)Br MCULE-2200756461 [0,2,0,0,0,0|1,0,0]=3 4100 B14R1.6048 N[C@@H](CC(=O)O)C1=CC=C(C=C1F)Br MCULE-5038532744 [0,2,0,0,0,0|1,0,0]=3 4101 B14R1.6048 N[C@@H](CC(=O)O)C1=CC=C(C=C1F)Br MCULE-6561886328 [0,2,0,0,0,0|1,0,0]=3 4102 B14R1.6048 N[C@@H](CC(=O)O)C1=CC=C(C=C1F)Br MCULE-7045791400 [0,2,0,0,0,0|1,0,0]=3 4103 B14R1.6048 N[C@H](CC(=O)O)C1=C(C=C(C=C1)Cl)Cl MCULE-2799755736 [0,2,0,0,0,0|1,0,0]=3 4104 B14R1.6048 N[C@H](CC(=O)O)C1=C(C=C(C=C1)F)F MCULE-5749465074 [0,2,0,0,0,0|1,0,0]=3 4105 B14R1.6048 N[C@H](CC(=O)O)C1=C(C=C(C=C1)F)F MCULE-8965550249 [0,2,0,0,0,0|1,0,0]=3 4106 B14R1.6048 N[C@H](CC(=O)O)C1=CC=C(C=C1Cl)Cl MCULE-1181157769 [0,2,0,0,0,0|1,0,0]=3 4107 B14R1.6048 N[C@H](CC(=O)O)C1=CC=C(C=C1Cl)Cl MCULE-8184423251 [0,2,0,0,0,0|1,0,0]=3 4108 B14R1.6048 N[C@H](CC(=O)O)C1=CC=C(C=C1F)Br MCULE-4101554747 [0,2,0,0,0,0|1,0,0]=3 4109 B14R1.6048 N[C@H](CC(=O)O)C1=CC=C(C=C1F)Br MCULE-4814905609 [0,2,0,0,0,0|1,0,0]=3 4110 B14R1.6048 N[C@H](CC(=O)O)C1=CC=C(C=C1F)Br MCULE-8168833222 [0,2,0,0,0,0|1,0,0]=3 4111 B14R1.6048 N[C@H](CC(=O)O)C1=CC=C(C=C1F)Br MCULE-9496629980 [0,2,0,0,0,0|1,0,0]=3 4112 B14R1.536 CC1=CC=C(C=C1)CC(C#N)C(=O)O MCULE-1894224996 [0,2,0,0,0,0|1,0,0]=3 4113 B14R1.536 CC1=CC=C(C=C1)CC(CN)C(=O)O MCULE-1451782887 [0,2,0,0,0,0|1,0,0]=3 4114 B14R1.536 CCC(CC1=CC=C(C=C1)Br)C(=O)O MCULE-6740784033 [0,2,0,0,0,0|1,0,0]=3 4115 B14R1.536 CCC(CC1=CC=C(C=C1)C)C(=O)O MCULE-7457602483 [0,2,0,0,0,0|1,0,0]=3 4116 B14R1.536 CCC(CC1=CC=C(C=C1)Cl)C(=O)O MCULE-7742496130 [0,2,0,0,0,0|1,0,0]=3 4117 B14R1.536 CCC(CC1=CC=C(C=C1)F)C(=O)O MCULE-9892655610 [0,2,0,0,0,0|1,0,0]=3 4118 B14R1.536 CCC(CC1=CC=C(C=C1)N)C(=O)O MCULE-7865652921 [0,2,0,0,0,0|0,0,0]=2 4119 B14R1.536 CCC(NC1=CC=C(C=C1)F)C(=O)O MCULE-9863981045 [0,2,0,0,0,0|2,0,0]=4 4120 B14R1.536 CCC(OC1=CC=C(C=C1)Br)C(=O)O MCULE-3254428515 [0,2,0,0,0,0|2,0,0]=4 4121 B14R1.536 CCC(OC1=CC=C(C=C1)C)C(=O)O MCULE-3063647187 [0,2,0,0,0,0|2,0,0]=4 4122 B14R1.536 CCC(OC1=CC=C(C=C1)Cl)C(=O)O MCULE-4592400851 [0,2,0,0,0,0|2,0,0]=4 4123 B14R1.536 CCC(OC1=CC=C(C=C1)F)C(=O)O MCULE-5541949223 [0,2,0,0,0,0|2,0,0]=4 4124 B14R1.536 CCC(SC1=CC=C(C=C1)Cl)C(=O)O MCULE-4328219998 [0,2,0,0,0,0|2,0,0]=4 4125 B14R1.536 CNC(CC1=CC=C(C=C1)C)C(=O)O MCULE-3868754382 [0,2,0,0,0,0|1,0,0]=3 4126 B14R1.536 CNC(CC1=CC=C(C=C1)O)C(=O)O MCULE-4915385045 [0,2,0,0,0,0|1,0,0]=3 4127 B14R1.536 CNC(CC1=CC=C(C=C1)O)C(=O)O MCULE-5989624134 [0,2,0,0,0,0|1,0,0]=3 4128 B14R1.536 CN[C@@H](CC1=CC=C(C=C1)Cl)C(=O)O MCULE-6220584417 [0,2,0,0,0,0|1,0,0]=3 4129 B14R1.536 CN[C@@H](CC1=CC=C(C=C1)O)C(=O)N MCULE-1114775968 [0,2,0,0,0,0|2,0,0]=4 4130 B14R1.536 CN[C@@H](CC1=CC=C(C=C1)O)C(=O)O MCULE-1741566078 [0,2,0,0,0,0|1,0,0]=3 4131 B14R1.536 CN[C@@H](CC1=CC=C(C=C1)O)C(=O)O MCULE-3490713321 [0,2,0,0,0,0|1,0,0]=3 4132 B14R1.536 CN[C@@H](CC1=CC=C(C=C1)O)C(=O)O MCULE-6295936475 [0,2,0,0,0,0|1,0,0]=3 4133 B14R1.536 CN[C@H](CC1=CC=C(C=C1)O)C(=O)O MCULE-2534527150 [0,2,0,0,0,0|1,0,0]=3 4134 B14R1.536 CN[C@H](CC1=CC=C(C=C1)O)C(=O)O MCULE-4678653994 [0,2,0,0,0,0|1,0,0]=3 4135 B14R1.536 CN[C@H](CC1=CC=C(C=C1)O)C(=O)O MCULE-8279485946 [0,2,0,0,0,0|1,0,0]=3 4136 B14R1.536 COC(CC1=CC=C(C=C1)Cl)C(=O)O MCULE-1129173640 [0,2,0,0,0,0|1,0,0]=3 4137 B14R1.536 COC(CC1=CC=C(C=C1)N)C(=O)O MCULE-5033901014 [0,2,0,0,0,0|0,0,0]=2 4138 B14R1.536 CO[C@@H](CC1=CC=C(C=C1)N)C(=O)O MCULE-3782971437 [0,2,0,0,0,0|0,0,0]=2 4139 B14R1.536 CO[C@@H](CC1=CC=C(C=C1)N)C(=O)O MCULE-9950103334 [0,2,0,0,0,0|0,0,0]=2 4140 B14R1.536 CO[C@H](CC1=CC=C(C=C1)N)C(=O)O MCULE-2158549290 [0,2,0,0,0,0|0,0,0]=2 4141 B14R1.536 N#CC(CC1=CC=C(C=C1)Br)C(=O)O MCULE-1276923020 [0,2,0,0,0,0|1,0,0]=3 4142 B14R1.536 N#CC(CC1=CC=C(C=C1)Cl)C(=O)O MCULE-6269830869 [0,2,0,0,0,0|1,0,0]=3 4143 B14R1.536 N#CC(CC1=CC=C(C=C1)F)C(=O)O MCULE-3865939485 [0,2,0,0,0,0|1,0,0]=3 4144 B14R1.536 N#CC(CC1=CC=C(C=C1)O)C(=O)O MCULE-9480095788 [0,2,0,0,0,0|1,0,0]=3 4145 B14R1.536 NCC(CC1=CC=C(C=C1)Br)C(=O)O MCULE-4763732976 [0,2,0,0,0,0|1,0,0]=3 4146 B14R1.536 NCC(CC1=CC=C(C=C1)Cl)C(=O)N MCULE-4761474817 [0,2,0,0,0,0|2,0,0]=4 4147 B14R1.536 NCC(CC1=CC=C(C=C1)Cl)C(=O)O MCULE-1221408402 [0,2,0,0,0,0|1,0,0]=3 4148 B14R1.536 NCC(CC1=CC=C(C=C1)Cl)C(=O)O MCULE-3172537591 [0,2,0,0,0,0|1,0,0]=3 4149 B14R1.536 NCC(CC1=CC=C(C=C1)F)C(=O)N MCULE-3503967655 [0,2,0,0,0,0|2,0,0]=4 4150 B14R1.536 NCC(CC1=CC=C(C=C1)F)C(=O)O MCULE-1762036914 [0,2,0,0,0,0|1,0,0]=3 4151 B14R1.536 NCC(CC1=CC=C(C=C1)F)C(=O)O MCULE-4958634262 [0,2,0,0,0,0|1,0,0]=3 4152 B14R1.536 NC[C@@H](CC1=CC=C(C=C1)Br)C(=O)O MCULE-5588247937 [0,2,0,0,0,0|1,0,0]=3 4153 B14R1.686 C(N)(CC1=CC(=C(C=C1)O)I)C(=O)O MCULE-7084802066 [0,2,0,0,0,0|1,0,0]=3 4154 B14R1.686 C(N)(CN1C=CC(=O)C(=C1)O)C(=O)O MCULE-6953076060 [0,2,0,0,0,0|2,0,0]=4 4155 B14R1.686 CC(CC1=CC(=C(C=C1)Cl)Cl)C(=O)O MCULE-6725921355 [0,2,0,0,0,0|1,0,0]=3 4156 B14R1.686 CC(CC1=CC(=C(C=C1)F)Br)C(=O)O MCULE-3047358340 [0,2,0,0,0,0|1,0,0]=3 4157 B14R1.686 CC(CC1=CC(=C(C=C1)O)F)C(=O)O MCULE-6959946695 [0,2,0,0,0,0|1,0,0]=3 4158 B14R1.686 CC(CC1=CC(=C(C=C1)O)O)C(=O)O MCULE-2053486794 [0,2,0,0,0,0|1,0,0]=3 4159 B14R1.686 CC(CC1=CC=C(C(=C1)F)F)C(=O)O MCULE-4053843521 [0,2,0,0,0,0|1,0,0]=3 4160 B14R1.686 CC(NC1=CC=C(C(=C1)Cl)F)C(=O)O MCULE-6370853810 [0,2,0,0,0,0|2,0,0]=4 4161 B14R1.686 CC(OC1=CC(=C(C=C1)Cl)Cl)C(=O)O MCULE-9424919348 [0,2,0,0,0,0|2,0,0]=4 4162 B14R1.686 CC(OC1=CC(=C(C=C1)F)F)C(=O)O MCULE-1162870251 [0,2,0,0,0,0|2,0,0]=4 4163 B14R1.686 CC(OC1=CC=C(C(=C1)Br)F)C(=O)O MCULE-8976416203 [0,2,0,0,0,0|2,0,0]=4 4164 B14R1.686 CC(OC1=CC=C(C(=C1)Cl)Br)C(=O)O MCULE-6488359021 [0,2,0,0,0,0|2,0,0]=4 4165 B14R1.686 CC(OC1=CC=C(C(=C1)Cl)F)C(=O)O MCULE-9282889995 [0,2,0,0,0,0|2,0,0]=4 4166 B14R1.686 CC(OC1=CC=C(C(=C1)F)Cl)C(=O)O MCULE-1582720211 [0,2,0,0,0,0|2,0,0]=4 4167 B14R1.686 CC1=C(C=C(C=C1)CC(C)C(=O)O)C MCULE-8631606062 [0,2,0,0,0,0|1,0,0]=3 4168 B14R1.686 CC1=C(C=C(C=C1)CC(N)C(=O)O)C MCULE-1439517832 [0,2,0,0,0,0|1,0,0]=3 4169 B14R1.686 CC1=C(C=C(C=C1)CC(N)C(=O)O)C MCULE-1710593369 [0,2,0,0,0,0|1,0,0]=3 4170 B14R1.686 CC1=C(C=C(C=C1)CC(S)C(=O)O)C MCULE-4221203832 [0,2,0,0,0,0|1,0,0]=3 4171 B14R1.686 CC1=C(C=C(C=C1)NC(C)C(=O)O)C MCULE-1761004393 [0,2,0,0,0,0|2,0,0]=4 4172 B14R1.686 CC1=C(C=CC(=C1)CC(C)C(=O)O)F MCULE-4616134999 [0,2,0,0,0,0|1,0,0]=3 4173 B14R1.686 CC1=C(C=CC(=C1)OC(C)C(=O)O)Br MCULE-7933645709 [0,2,0,0,0,0|2,0,0]=4 4174 B14R1.686 CC1=C(C=CC(=C1)OC(C)C(=O)O)Cl MCULE-3899360586 [0,2,0,0,0,0|2,0,0]=4 4175 B14R1.686 CC1=CC(=CC=C1F)CC(N)C(=O)O MCULE-9969422282 [0,2,0,0,0,0|1,0,0]=3 4176 B14R1.686 CC1=CC(=CC=C1O)CC(C)C(=O)O MCULE-4345156007 [0,2,0,0,0,0|1,0,0]=3 4177 B14R1.686 CC1=CC(=CC=C1O)CC(N)C(=O)O MCULE-7114179615 [0,2,0,0,0,0|1,0,0]=3 4178 B14R1.686 CC1=CC(=CC=C1O)C[C@H](N)C(=O)O MCULE-1725367272 [0,2,0,0,0,0|1,0,0]=3 4179 B14R1.686 CC1=CC(=CC=C1O)C[C@H](N)C(=O)O MCULE-8823796667 [0,2,0,0,0,0|1,0,0]=3 4180 B14R1.686 CC1=CC=C(C=C1Br)OC(C)C(=O)O MCULE-6068428927 [0,2,0,0,0,0|2,0,0]=4 4181 B14R1.686 CC1=CC=C(C=C1Br)O[C@H](C)C(=O)O MCULE-2610910604 [0,2,0,0,0,0|2,0,0]=4 4182 B14R1.686 CC1=CC=C(C=C1C)C[C@H](N)C(=O)O MCULE-4068626034 [0,2,0,0,0,0|1,0,0]=3 4183 B14R1.686 CC1=CC=C(C=C1C)OC(C)C(=O)O MCULE-1590548133 [0,2,0,0,0,0|2,0,0]=4 4184 B14R1.686 CC1=CC=C(C=C1Cl)OC(C)C(=O)O MCULE-9673073562 [0,2,0,0,0,0|2,0,0]=4 4185 B14R1.686 CC1=CC=C(C=C1F)CC(C)C(=O)O MCULE-3294121728 [0,2,0,0,0,0|1,0,0]=3 4186 B14R1.686 CC1=CC=C(C=C1F)CC(N)C(=O)O MCULE-7233171438 [0,2,0,0,0,0|1,0,0]=3 4187 B14R1.686 CC1=CC=C(C=C1N)CC(C)C(=O)O MCULE-8573761389 [0,2,0,0,0,0|1,0,0]=3 4188 B14R1.686 NC(=O)C(N)CC1=CC=C(C(=C1)O)O MCULE-2648430513 [0,2,0,0,0,0|2,0,0]=4 4189 B14R1.686 NC(=O)C(N)CC1=CC=C(C(=C1)O)O MCULE-4964600533 [0,2,0,0,0,0|2,0,0]=4 4190 B14R1.686 NC(=O)[C@@H](N)CC1=CC(=C(C=C1)O)O MCULE-2150001812 [0,2,0,0,0,0|2,0,0]=4 4191 B14R1.686 NC(=O)[C@@H](N)CC1=CC=C(C(=C1)O)O MCULE-1018551198 [0,2,0,0,0,0|2,0,0]=4 4192 B14R1.686 NC(=O)[C@@H](N)CC1=CC=C(C(=C1)O)O MCULE-5047112016 [0,2,0,0,0,0|2,0,0]=4 4193 B14R1.686 NC(=O)[C@@H](N)CC1=CC=C(C(=C1)O)O MCULE-5589713302 [0,2,0,0,0,0|2,0,0]=4 4194 B14R1.686 NC(CC1=CC(=C(C=C1)Cl)Cl)C(=O)O MCULE-8087658877 [0,2,0,0,0,0|1,0,0]=3 4195 B14R1.686 NC(CC1=CC(=C(C=C1)F)Cl)C(=O)O MCULE-7264527288 [0,2,0,0,0,0|1,0,0]=3 4196 B14R1.686 NC(CC1=CC(=C(C=C1)F)F)C(=O)O MCULE-6760740668 [0,2,0,0,0,0|1,0,0]=3 4197 B14R1.686 NC(CC1=CC(=C(C=C1)F)F)C(=O)O MCULE-6967691364 [0,2,0,0,0,0|1,0,0]=3 4198 B14R1.686 NC(CC1=CC(=C(C=C1)O)Br)C(=O)O MCULE-3374977523 [0,2,0,0,0,0|1,0,0]=3 4199 B14R1.686 NC(CC1=CC(=C(C=C1)O)Br)C(=O)O MCULE-6181724347 [0,2,0,0,0,0|1,0,0]=3 4200 B14R1.686 NC(CC1=CC(=C(C=C1)O)Cl)C(=O)O MCULE-2697786754 [0,2,0,0,0,0|1,0,0]=3 4201 B14R1.686 NC(CC1=CC(=C(C=C1)O)Cl)C(=O)O MCULE-5698335509 [0,2,0,0,0,0|1,0,0]=3 4202 B14R1.686 NC(CC1=CC=C(C(=C1)F)Cl)C(=O)O MCULE-5096730112 [0,2,0,0,0,0|1,0,0]=3 4203 B14R1.686 NC(CC1=CC=C(C(=C1)F)O)C(=O)O MCULE-6834620182 [0,2,0,0,0,0|1,0,0]=3 4204 B14R1.686 NC(CC1=CC=C(C(=C1)F)O)C(=O)O MCULE-9537492620 [0,2,0,0,0,0|1,0,0]=3 4205 B14R1.686 NC(CC1=CC=C(C(=C1)O)F)C(=O)O MCULE-1976200660 [0,2,0,0,0,0|1,0,0]=3 4206 B14R1.686 NC(CC1=CC=C(C(=C1)O)F)C(=O)O MCULE-7333560025 [0,2,0,0,0,0|1,0,0]=3 4207 B14R1.686 NC(CC1=CC=C(C(=C1)O)O)C(=O)O MCULE-6834245595 [0,2,0,0,0,0|1,0,0]=3 4208 B14R1.686 NC(CC1=CC=C(C(=C1)O)O)C(=O)[O-] MCULE-9471283867 [0,2,0,0,0,0|1,0,1]=4 4209 B14R1.686 NC1=C(C=CC(=C1)CC(N)C(=O)O)O MCULE-2557670465 [0,2,0,0,0,0|1,0,0]=3 4210 B14R1.686 NC1=C(C=CC(=C1)CC(N)C(=O)O)O MCULE-5549889238 [0,2,0,0,0,0|1,0,0]=3 4211 B14R1.686 NC1=C(C=CC(=C1)C[C@H](N)C(=O)O)O MCULE-3775294936 [0,2,0,0,0,0|1,0,0]=3 4212 B14R1.686 NC1=C(C=CC(=C1)C[C@H](N)C(=O)O)O MCULE-6839040671 [0,2,0,0,0,0|1,0,0]=3 4213 B14R1.686 NC1=CC(=CC=C1O)C[C@H](N)C(=O)O MCULE-9607907699 [0,2,0,0,0,0|1,0,0]=3 4214 B14R1.686 NC1=CC=C(C=C1O)C[C@H](N)C(=O)O MCULE-9600560994 [0,2,0,0,0,0|0,0,0]=2 4215 B14R1.686 N[C@@H](CC1=CC(=C(C=C1)Cl)Cl)C(=O)O MCULE-1204635145 [0,2,0,0,0,0|1,0,0]=3 4216 B14R1.686 N[C@@H](CC1=CC(=C(C=C1)F)F)C(=O)O MCULE-9674100333 [0,2,0,0,0,0|1,0,0]=3 4217 B14R1.686 N[C@@H](CC1=CC(=C(C=C1)O)Cl)C(=O)O MCULE-1164805788 [0,2,0,0,0,0|1,0,0]=3 4218 B14R1.686 N[C@@H](CC1=CC(=C(C=C1)O)Cl)C(=O)O MCULE-6365431286 [0,2,0,0,0,0|1,0,0]=3 4219 B14R1.686 N[C@@H](CC1=CC(=C(C=C1)O)F)C(=O)O MCULE-2345671151 [0,2,0,0,0,0|1,0,0]=3 4220 B14R1.686 N[C@@H](CC1=CC(=C(C=C1)O)I)C(=O)O MCULE-4703706022 [0,2,0,0,0,0|1,0,0]=3 4221 B14R1.686 N[C@@H](CC1=CC(=C(C=C1)O)O)C(=O)O MCULE-7571765742 [0,2,0,0,0,0|1,0,0]=3 4222 B14R1.686 N[C@@H](CC1=CC=C(C(=C1)Br)F)C(=O)O MCULE-3066216517 [0,2,0,0,0,0|1,0,0]=3 4223 B14R1.686 N[C@@H](CC1=CC=C(C(=C1)Cl)Cl)C(=O)O MCULE-8168956702 [0,2,0,0,0,0|1,0,0]=3 4224 B14R1.686 N[C@@H](CC1=CC=C(C(=C1)F)F)C(=O)O MCULE-9200119733 [0,2,0,0,0,0|1,0,0]=3 4225 B14R1.686 N[C@@H](CC1=CC=C(C(=C1)F)O)C(=O)O MCULE-1794626616 [0,2,0,0,0,0|1,0,0]=3 4226 B14R1.686 N[C@@H](CC1=CC=C(C(=C1)F)O)C(=O)O MCULE-7896954993 [0,2,0,0,0,0|1,0,0]=3 4227 B14R1.686 N[C@@H](CC1=CC=C(C(=C1)F)O)C(=O)O MCULE-8926188460 [0,2,0,0,0,0|1,0,0]=3 4228 B14R1.686 N[C@@H](CC1=CC=C(C(=C1)I)O)C(=O)O MCULE-7914019816 [0,2,0,0,0,0|1,0,0]=3 4229 B14R1.686 N[C@@H](CC1=CC=C(C(=C1)O)F)C(=O)O MCULE-2715592533 [0,2,0,0,0,0|1,0,0]=3 4230 B14R1.686 N[C@@H](CC1=CC=C(C(=C1)O)F)C(=O)O MCULE-3218547043 [0,2,0,0,0,0|1,0,0]=3 4231 B14R1.686 N[C@@H](CC1=CC=C(C(=C1)O)F)C(=O)O MCULE-3340290734 [0,2,0,0,0,0|1,0,0]=3 4232 B14R1.686 N[C@@H](CC1=CC=C(C(=C1)O)F)C(=O)O MCULE-6453108778 [0,2,0,0,0,0|1,0,0]=3 4233 B14R1.686 N[C@@H](CC1=CC=C(C(=C1)O)O)C(=O)O MCULE-4743781842 [0,2,0,0,0,0|1,0,0]=3 4234 B14R1.686 N[C@@H](CC1=CC=C(C(=C1)O)O)C(=O)O MCULE-8112075430 [0,2,0,0,0,0|1,0,0]=3 4235 B14R1.686 N[C@@H](CN1C=CC(=O)C(=C1)O)C(=O)O MCULE-2538604003 [0,2,0,0,0,0|2,0,0]=4 4236 B14R1.686 N[C@@H](CN1C=CC(=O)C(=C1)O)C(=O)O MCULE-5494372638 [0,2,0,0,0,0|2,0,0]=4 4237 B14R1.686 N[C@H](CC1=CC(=C(C=C1)Cl)Cl)C(=O)O MCULE-6868231956 [0,2,0,0,0,0|1,0,0]=3 4238 B14R1.686 N[C@H](CC1=CC(=C(C=C1)O)Cl)C(=O)O MCULE-1399466309 [0,2,0,0,0,0|1,0,0]=3 4239 B14R1.686 N[C@H](CC1=CC(=C(C=C1)O)Cl)C(=O)O MCULE-1686922215 [0,2,0,0,0,0|1,0,0]=3 4240 B14R1.686 N[C@H](CC1=CC(=C(C=C1)O)F)C(=O)O MCULE-2789104977 [0,2,0,0,0,0|1,0,0]=3 4241 B14R1.686 N[C@H](CC1=CC(=C(C=C1)O)O)C(=O)O MCULE-3946263529 [0,2,0,0,0,0|1,0,0]=3 4242 B14R1.686 N[C@H](CC1=CC=C(C(=C1)Br)O)C(=O)O MCULE-3413267848 [0,2,0,0,0,0|1,0,0]=3 4243 B14R1.686 N[C@H](CC1=CC=C(C(=C1)Br)O)C(=O)O MCULE-9740236562 [0,2,0,0,0,0|1,0,0]=3 4244 B14R1.686 N[C@H](CC1=CC=C(C(=C1)Cl)Cl)C(=O)O MCULE-1947805662 [0,2,0,0,0,0|1,0,0]=3 4245 B14R1.686 N[C@H](CC1=CC=C(C(=C1)F)F)C(=O)O MCULE-4871068130 [0,2,0,0,0,0|1,0,0]=3 4246 B14R1.686 N[C@H](CC1=CC=C(C(=C1)F)F)C(=O)O MCULE-8950844474 [0,2,0,0,0,0|1,0,0]=3 4247 B14R1.686 N[C@H](CC1=CC=C(C(=C1)F)O)C(=O)O MCULE-8414400766 [0,2,0,0,0,0|1,0,0]=3 4248 B14R1.686 N[C@H](CC1=CC=C(C(=C1)I)O)C(=O)O MCULE-3992386719 [0,2,0,0,0,0|1,0,0]=3 4249 B14R1.686 N[C@H](CC1=CC=C(C(=C1)I)O)C(=O)O MCULE-7020255208 [0,2,0,0,0,0|1,0,0]=3 4250 B14R1.686 N[C@H](CC1=CC=C(C(=C1)O)O)C(=O)O MCULE-2909167188 [0,2,0,0,0,0|1,0,0]=3 4251 B14R1.686 O=C(O)C(=O)CC1=CC=C(C(=C1)O)O MCULE-6532951024 [0,2,0,0,0,0|1,0,1]=4 4252 B14R1.686 O=C(O)C(Br)CC1=CC=C(C(=C1)Cl)Cl MCULE-8870603954 [0,2,0,0,0,0|1,0,0]=3 4253 B14R1.686 O=C(O)C(O)CC1=CC(=C(C=C1)O)O MCULE-1331401569 [0,2,0,0,0,0|1,0,0]=3 4254 B14R1.686 O=C(O)[C@H](O)CC1=CC(=C(C=C1)O)O MCULE-4395140487 [0,2,0,0,0,0|1,0,0]=3 4255 B14R1.686 O=C(O)[C@H](O)CC1=CC(=C(C=C1)O)O MCULE-9485459217 [0,2,0,0,0,0|1,0,0]=3 4256 B14R1.686 O=C([O-])C(O)CC1=CC(=C(C=C1)O)O MCULE-9830082207 [0,2,0,0,0,0|1,0,1]=4 4257 B14R1.686 O=C([O-])[C@H](O)CC1=CC(=C(C=C1)O)O MCULE-1155965360 [0,2,0,0,0,0|1,0,1]=4 4258 B14R1.686 O=C([O-])[C@H](O)CC1=CC(=C(C=C1)O)O MCULE-9062505748 [0,2,0,0,0,0|1,0,1]=4 4259 B14R1.686 [C@@H](N)(CN1C=CC(=O)C(=C1)O)C(=O)O MCULE-2886907026 [0,2,0,0,0,0|2,0,0]=4 4260 B14R1.686 [C@H](N)(CC1=CC(=C(C=C1)O)Br)C(=O)O MCULE-3725297150 [0,2,0,0,0,0|1,0,0]=3 4261 B14R1.686 [C@H](N)(CC1=CC(=C(C=C1)O)N)C(=O)O MCULE-4265042292 [0,2,0,0,0,0|1,0,0]=3 4262 B14R1.686 [C@H](N)(CC1=CC=C(C(=C1)Br)O)C(=O)O MCULE-8641777132 [0,2,0,0,0,0|1,0,0]=3 4263 B14R1.6049 CC(=O)C(Br)CC1=C(C=C(C=C1)Cl)F MCULE-6484951335 [0,2,0,0,0,0|2,0,0]=4 4264 B14R1.6049 CC(=O)C(Br)CC1=C(C=C(C=C1)F)F MCULE-3674560560 [0,2,0,0,0,0|2,0,0]=4 4265 B14R1.6049 CC(CC1=C(C=C(C=C1)Cl)Cl)C(=O)O MCULE-4560531869 [0,2,0,0,0,0|1,0,0]=3 4266 B14R1.6049 CC(CC1=C(C=C(C=C1)F)F)C(=O)O MCULE-3991090994 [0,2,0,0,0,0|1,0,0]=3 4267 B14R1.6049 CC(NC1=C(C=C(C=C1)Cl)Cl)C(=O)O MCULE-5948120385 [0,2,0,0,0,0|2,0,0]=4 4268 B14R1.6049 CC(OC1=C(C=C(C=C1)Br)F)C(=O)O MCULE-8364541785 [0,2,0,0,0,0|2,0,0]=4 4269 B14R1.6049 CC(OC1=C(C=C(C=C1)Cl)Br)C(=O)O MCULE-9823365914 [0,2,0,0,0,0|2,0,0]=4 4270 B14R1.6049 CC(OC1=C(C=C(C=C1)F)Br)C(=O)O MCULE-4225280155 [0,2,0,0,0,0|2,0,0]=4 4271 B14R1.6049 CC(OC1=C(C=C(C=C1)F)Cl)C(=O)O MCULE-1964679320 [0,2,0,0,0,0|2,0,0]=4 4272 B14R1.6049 CC(OC1=C(C=C(C=C1)F)F)C(=O)O MCULE-1808499177 [0,2,0,0,0,0|2,0,0]=4 4273 B14R1.6049 CC(OC1=CC=C(C=C1Br)Br)C(=O)O MCULE-7045767881 [0,2,0,0,0,0|2,0,0]=4 4274 B14R1.6049 CC(OC1=CC=C(C=C1Cl)Br)C(=O)O MCULE-4118942196 [0,2,0,0,0,0|2,0,0]=4 4275 B14R1.6049 CC(OC1=CC=C(C=C1Cl)Cl)C(=O)O MCULE-9665038741 [0,2,0,0,0,0|2,0,0]=4 4276 B14R1.6049 CC(SC1=CC=C(C=C1Cl)Cl)C(=O)O MCULE-8090231338 [0,2,0,0,0,0|2,0,0]=4 4277 B14R1.6049 CC1=C(C=CC(=C1)Br)CC(N)C(=O)O MCULE-6034051738 [0,2,0,0,0,0|1,0,0]=3 4278 B14R1.6049 CC1=C(C=CC(=C1)Cl)O[C@@H](C)C(=O)O MCULE-8980005839 [0,2,0,0,0,0|2,0,0]=4 4279 B14R1.6049 CC1=C(C=CC(=C1)F)CC(N)C(=O)O MCULE-9023496359 [0,2,0,0,0,0|1,0,0]=3 4280 B14R1.6049 CC1=C(C=CC(=C1)F)C[C@@H](N)C(=O)O MCULE-6447750504 [0,2,0,0,0,0|1,0,0]=3 4281 B14R1.6049 CC1=C(C=CC(=C1)F)C[C@H](N)C(=O)O MCULE-9093360606 [0,2,0,0,0,0|1,0,0]=3 4282 B14R1.6049 CC1=CC(=C(C=C1)CC(C)C(=O)O)C MCULE-4362364605 [0,2,0,0,0,0|1,0,0]=3 4283 B14R1.6049 CC1=CC(=C(C=C1)CC(N)C(=O)O)Br MCULE-8346800201 [0,2,0,0,0,0|1,0,0]=3 4284 B14R1.6049 CC1=CC(=C(C=C1)CC(N)C(=O)O)Cl MCULE-4640242910 [0,2,0,0,0,0|1,0,0]=3 4285 B14R1.6049 CC1=CC(=C(C=C1)C[C@@H](N)C(=O)O)F MCULE-5807965189 [0,2,0,0,0,0|1,0,0]=3 4286 B14R1.6049 CC1=CC(=C(C=C1)C[C@H](N)C(=O)O)C MCULE-6159563785 [0,2,0,0,0,0|1,0,0]=3 4287 B14R1.6049 CC1=CC(=C(C=C1)C[C@H](N)C(=O)O)F MCULE-7582261370 [0,2,0,0,0,0|1,0,0]=3 4288 B14R1.6049 CC1=CC(=C(C=C1)OC(C)C(=O)O)Br MCULE-4860133180 [0,2,0,0,0,0|2,0,0]=4 4289 B14R1.6049 CC1=CC(=C(C=C1)OC(C)C(=O)O)C MCULE-1530765033 [0,2,0,0,0,0|2,0,0]=4 4290 B14R1.6049 CC1=CC(=CC=C1CC(C)C(=O)O)F MCULE-9118496054 [0,2,0,0,0,0|1,0,0]=3 4291 B14R1.6049 CC1=CC(=CC=C1C[C@@H](N)C(=O)O)Cl MCULE-1002585890 [0,2,0,0,0,0|1,0,0]=3 4292 B14R1.6049 CC1=CC(=CC=C1C[C@H](N)C(=O)O)Cl MCULE-1772548941 [0,2,0,0,0,0|1,0,0]=3 4293 B14R1.6049 CC1=CC(=CC=C1C[C@H](N)C(=O)O)Cl MCULE-5868047166 [0,2,0,0,0,0|1,0,0]=3 4294 B14R1.6049 CC1=CC(=CC=C1OC(C)C(=O)O)Cl MCULE-5901282849 [0,2,0,0,0,0|2,0,0]=4 4295 B14R1.6049 CC1=CC(=CC=C1OC(C)C(=O)O)Cl MCULE-7976077440 [0,2,0,0,0,0|2,0,0]=4 4296 B14R1.6049 CC1=CC=C(C(=C1)C)CC(N)C(=O)O MCULE-8036731257 [0,2,0,0,0,0|1,0,0]=3 4297 B14R1.6049 CC1=CC=C(C(=C1)C)C[C@@H](N)C(=O)O MCULE-2678912652 [0,2,0,0,0,0|1,0,0]=3 4298 B14R1.6049 CC1=CC=C(C(=C1)C)C[C@@H](N)C(=O)O MCULE-4617067389 [0,2,0,0,0,0|1,0,0]=3 4299 B14R1.6049 CC1=CC=C(C(=C1)C)C[C@H](N)C(=O)O MCULE-2182724258 [0,2,0,0,0,0|1,0,0]=3 4300 B14R1.6049 CC1=CC=C(C(=C1)C)C[C@H](N)C(=O)O MCULE-2493165040 [0,2,0,0,0,0|1,0,0]=3 4301 B14R1.6049 CC1=CC=C(C(=C1)C)C[C@H](N)C(=O)O MCULE-8954624870 [0,2,0,0,0,0|1,0,0]=3 4302 B14R1.6049 CC1=CC=C(C(=C1)F)CC(C)C(=O)O MCULE-9506504429 [0,2,0,0,0,0|1,0,0]=3 4303 B14R1.6049 CC1=CC=C(C(=C1)F)CC(N)C(=O)O MCULE-4036470152 [0,2,0,0,0,0|1,0,0]=3 4304 B14R1.6049 C[C@@H](OC1=C(C=C(C=C1)Cl)Cl)C(=O)O MCULE-3617733851 [0,2,0,0,0,0|2,0,0]=4 4305 B14R1.6049 C[C@H](OC1=C(C=C(C=C1)Cl)Cl)C(=O)O MCULE-1021263381 [0,2,0,0,0,0|2,0,0]=4 4306 B14R1.6049 C[C@H](OC1=CC=C(C=C1Cl)Cl)C(=O)O MCULE-6636410804 [0,2,0,0,0,0|2,0,0]=4 4307 B14R1.6049 NC(CC1=C(C=C(C=C1)Br)Cl)C(=O)O MCULE-8668407366 [0,2,0,0,0,0|1,0,0]=3 4308 B14R1.6049 NC(CC1=C(C=C(C=C1)Br)F)C(=O)O MCULE-4672380991 [0,2,0,0,0,0|1,0,0]=3 4309 B14R1.6049 NC(CC1=C(C=C(C=C1)Cl)Cl)C(=O)O MCULE-5114979925 [0,2,0,0,0,0|1,0,0]=3 4310 B14R1.6049 NC(CC1=C(C=C(C=C1)Cl)Cl)C(=O)O MCULE-6327442292 [0,2,0,0,0,0|1,0,0]=3 4311 B14R1.6049 NC(CC1=C(C=C(C=C1)F)F)C(=O)O MCULE-6072609804 [0,2,0,0,0,0|1,0,0]=3 4312 B14R1.6049 NC(CC1=C(C=C(C=C1)F)F)C(=O)O MCULE-6881817955 [0,2,0,0,0,0|1,0,0]=3 4313 B14R1.6049 NC(CC1=C(C=C(C=C1)O)Cl)C(=O)O MCULE-2921958983 [0,2,0,0,0,0|1,0,0]=3 4314 B14R1.6049 NC(CC1=C(C=C(C=C1)O)F)C(=O)O MCULE-3109401325 [0,2,0,0,0,0|1,0,0]=3 4315 B14R1.6049 NC(CC1=C(C=C(C=C1)O)O)C(=O)O MCULE-7962902478 [0,2,0,0,0,0|1,0,0]=3 4316 B14R1.6049 NC(CC1=CC=C(C=C1Cl)F)C(=O)O MCULE-8537044576 [0,2,0,0,0,0|1,0,0]=3 4317 B14R1.6049 NC(CC1=CC=C(C=C1Cl)O)C(=O)O MCULE-2256739100 [0,2,0,0,0,0|1,0,0]=3 4318 B14R1.6049 NC(CC1=CC=C(C=C1F)Cl)C(=O)O MCULE-1150187820 [0,2,0,0,0,0|1,0,0]=3 4319 B14R1.6049 NC(CC1=CC=C(C=C1F)O)C(=O)O MCULE-4021052103 [0,2,0,0,0,0|1,0,0]=3 4320 B14R1.6049 NC1=CC(=CC=C1C[C@H](N)C(=O)O)F MCULE-1958188301 [0,2,0,0,0,0|1,0,0]=3 4321 B14R1.6049 NC1=CC(=CC=C1C[C@H](N)C(=O)O)F MCULE-5650081399 [0,2,0,0,0,0|1,0,0]=3 4322 B14R1.6049 N[C@@H](CC1=C(C=C(C=C1)Br)F)C(=O)O MCULE-9898110769 [0,2,0,0,0,0|1,0,0]=3 4323 B14R1.6049 N[C@@H](CC1=C(C=C(C=C1)Cl)Cl)C(=O)O MCULE-3098807866 [0,2,0,0,0,0|1,0,0]=3 4324 B14R1.6049 N[C@@H](CC1=C(C=C(C=C1)F)Cl)C(=O)O MCULE-4083921627 [0,2,0,0,0,0|1,0,0]=3 4325 B14R1.6049 N[C@@H](CC1=C(C=C(C=C1)O)F)C(=O)O MCULE-5550182466 [0,2,0,0,0,0|1,0,0]=3 4326 B14R1.6049 N[C@@H](CC1=C(C=C(C=C1)O)F)C(=O)O MCULE-6359920112 [0,2,0,0,0,0|1,0,0]=3 4327 B14R1.6049 N[C@@H](CC1=C(C=C(C=C1)O)I)C(=O)O MCULE-7882200481 [0,2,0,0,0,0|1,0,0]=3 4328 B14R1.6049 N[C@@H](CC1=CC=C(C=C1Cl)Br)C(=O)O MCULE-5338377818 [0,2,0,0,0,0|1,0,0]=3 4329 B14R1.6049 N[C@@H](CC1=CC=C(C=C1Cl)Cl)C(=O)O MCULE-2417736401 [0,2,0,0,0,0|1,0,0]=3 4330 B14R1.6049 N[C@@H](CC1=CC=C(C=C1Cl)O)C(=O)O MCULE-3109796033 [0,2,0,0,0,0|1,0,0]=3 4331 B14R1.6049 N[C@@H](CC1=CC=C(C=C1Cl)O)C(=O)O MCULE-6959551384 [0,2,0,0,0,0|1,0,0]=3 4332 B14R1.6049 N[C@@H](CC1=CC=C(C=C1Cl)O)C(=O)O MCULE-8555611273 [0,2,0,0,0,0|1,0,0]=3 4333 B14R1.6049 N[C@@H](CC1=CC=C(C=C1Cl)O)C(=O)O MCULE-8736759724 [0,2,0,0,0,0|1,0,0]=3 4334 B14R1.6049 N[C@@H](CC1=CC=C(C=C1F)Cl)C(=O)O MCULE-9128897230 [0,2,0,0,0,0|1,0,0]=3 4335 B14R1.6049 N[C@@H](CC1=CC=C(C=C1F)F)C(=O)O MCULE-1930794331 [0,2,0,0,0,0|1,0,0]=3 4336 B14R1.6049 N[C@@H](CC1=CC=C(C=C1F)F)C(=O)O MCULE-3003882189 [0,2,0,0,0,0|1,0,0]=3 4337 B14R1.6049 N[C@@H](CC1=CC=C(C=C1F)F)C(=O)O MCULE-8956153283 [0,2,0,0,0,0|1,0,0]=3 4338 B14R1.6049 N[C@@H](CC1=CC=C(C=C1F)O)C(=O)O MCULE-5441549629 [0,2,0,0,0,0|1,0,0]=3 4339 B14R1.6049 N[C@@H](CC1=CC=C(C=C1F)O)C(=O)O MCULE-6957202412 [0,2,0,0,0,0|1,0,0]=3 4340 B14R1.6049 N[C@@H](CC1=CC=C(C=C1O)F)C(=O)O MCULE-8244759081 [0,2,0,0,0,0|1,0,0]=3 4341 B14R1.6049 N[C@@H](CC1=CC=C(C=C1O)O)C(=O)O MCULE-7696755502 [0,2,0,0,0,0|1,0,0]=3 4342 B14R1.6049 N[C@@H](CC1=CC=C(N=C1F)F)C(=O)O MCULE-2263756494 [0,2,0,0,0,0|2,0,0]=4 4343 B14R1.6049 N[C@@H](CC1=CC=C(N=C1F)F)C(=O)O MCULE-2943862392 [0,2,0,0,0,0|2,0,0]=4 4344 B14R1.6049 N[C@H](CC1=C(C=C(C=C1)Cl)Cl)C(=O)O MCULE-2223544843 [0,2,0,0,0,0|1,0,0]=3 4345 B14R1.6049 N[C@H](CC1=C(C=C(C=C1)Cl)Cl)C(=O)O MCULE-9659627302 [0,2,0,0,0,0|1,0,0]=3 4346 B14R1.6049 N[C@H](CC1=C(C=C(C=C1)Cl)F)C(=O)O MCULE-4914693738 [0,2,0,0,0,0|1,0,0]=3 4347 B14R1.6049 N[C@H](CC1=C(C=C(C=C1)F)Cl)C(=O)O MCULE-3374036323 [0,2,0,0,0,0|1,0,0]=3 4348 B14R1.6049 N[C@H](CC1=C(C=C(C=C1)F)F)C(=O)O MCULE-9956438755 [0,2,0,0,0,0|1,0,0]=3 4349 B14R1.6049 N[C@H](CC1=C(C=C(C=C1)O)F)C(=O)O MCULE-2515957835 [0,2,0,0,0,0|1,0,0]=3 4350 B14R1.6049 N[C@H](CC1=C(C=C(C=C1)O)F)C(=O)O MCULE-3080221011 [0,2,0,0,0,0|1,0,0]=3 4351 B14R1.6049 N[C@H](CC1=C(C=C(C=C1)O)I)C(=O)O MCULE-9035255629 [0,2,0,0,0,0|1,0,0]=3 4352 B14R1.6049 N[C@H](CC1=CC=C(C=C1Cl)Br)C(=O)O MCULE-3154387192 [0,2,0,0,0,0|1,0,0]=3 4353 B14R1.6049 N[C@H](CC1=CC=C(C=C1Cl)Br)C(=O)O MCULE-5498008986 [0,2,0,0,0,0|1,0,0]=3 4354 B14R1.6049 N[C@H](CC1=CC=C(C=C1F)F)C(=O)O MCULE-3400145832 [0,2,0,0,0,0|1,0,0]=3 4355 B14R1.6049 N[C@H](CC1=CC=C(C=C1F)F)C(=O)O MCULE-6022690956 [0,2,0,0,0,0|1,0,0]=3 4356 B14R1.6049 N[C@H](CC1=CC=C(C=C1F)F)C(=O)O MCULE-7464010527 [0,2,0,0,0,0|1,0,0]=3 4357 B14R1.6049 O=C(O)C(=O)CC1=C(C=C(C=C1)F)F MCULE-9470090897 [0,2,0,0,0,0|1,0,1]=4 4358 B14R1.6049 O=C(O)C(Br)CC1=C(C=C(C=C1)Cl)Cl MCULE-9975513527 [0,2,0,0,0,0|1,0,0]=3 4359 B14R1.6049 O=C(O)C(O)CC1=CC=C(C=C1Cl)Cl MCULE-3687692582 [0,2,0,0,0,0|1,0,0]=3 4360 B14R1.7626 CC(C)(CC1=CC=C(C=C1)Br)C(=O)O MCULE-7412446178 [0,2,0,0,0,0|1,0,0]=3 4361 B14R1.7626 CC(C)(CC1=CC=C(C=C1)Cl)C(=O)O MCULE-9552026568 [0,2,0,0,0,0|1,0,0]=3 4362 B14R1.7626 CC(C)(CC1=CC=C(C=C1)F)C(=O)O MCULE-6047776217 [0,2,0,0,0,0|1,0,0]=3 4363 B14R1.7626 CC(C)(CC1=CC=C(C=C1)O)C(=O)O MCULE-9335199083 [0,2,0,0,0,0|1,0,0]=3 4364 B14R1.7626 CC(C)(NC1=CC=C(C=C1)Cl)C(=O)O MCULE-3719098417 [0,2,0,0,0,0|2,0,0]=4 4365 B14R1.7626 CC(C)(NC1=CC=C(C=C1)F)C(=O)O MCULE-3444957288 [0,2,0,0,0,0|2,0,0]=4 4366 B14R1.7626 CC(C)(OC1=CC=C(C=C1)Br)C(=O)O MCULE-4114784506 [0,2,0,0,0,0|2,0,0]=4 4367 B14R1.7626 CC(C)(OC1=CC=C(C=C1)Cl)C(=O)O MCULE-3964453066 [0,2,0,0,0,0|2,0,0]=4 4368 B14R1.7626 CC(C)(OC1=CC=C(C=C1)F)C(=O)O MCULE-3271128100 [0,2,0,0,0,0|2,0,0]=4 4369 B14R1.7626 CC(C)(OC1=CC=C(C=C1)N)C(=O)O MCULE-4765647589 [0,2,0,0,0,0|1,0,0]=3 4370 B14R1.7626 CC(C)(OC1=CC=C(C=C1)N)C(=O)O MCULE-7049757442 [0,2,0,0,0,0|1,0,0]=3 4371 B14R1.7626 CC(C)(SC1=CC=C(C=C1)Br)C(=O)O MCULE-3306550658 [0,2,0,0,0,0|2,0,0]=4 4372 B14R1.7626 CC(N)(CC1=CC=C(C=C1)Br)C(=O)O MCULE-7076296146 [0,2,0,0,0,0|1,0,0]=3 4373 B14R1.7626 CC(N)(CC1=CC=C(C=C1)Br)C(=O)O MCULE-7302845887 [0,2,0,0,0,0|1,0,0]=3 4374 B14R1.7626 CC(N)(CC1=CC=C(C=C1)Cl)C(=O)O MCULE-2953142942 [0,2,0,0,0,0|1,0,0]=3 4375 B14R1.7626 CC(N)(CC1=CC=C(C=C1)Cl)C(=O)O MCULE-5172974897 [0,2,0,0,0,0|1,0,0]=3 4376 B14R1.7626 CC(N)(CC1=CC=C(C=C1)F)C(=O)O MCULE-2384275519 [0,2,0,0,0,0|1,0,0]=3 4377 B14R1.7626 CC(N)(CC1=CC=C(C=C1)F)C(=O)O MCULE-3083862489 [0,2,0,0,0,0|1,0,0]=3 4378 B14R1.7626 CC(N)(CC1=CC=C(C=C1)O)C(=O)O MCULE-1700935161 [0,2,0,0,0,0|1,0,0]=3 4379 B14R1.7626 CC(N)(CC1=CC=C(C=C1)O)C(=O)O MCULE-9990457253 [0,2,0,0,0,0|1,0,0]=3 4380 B14R1.7626 CC(O)(CC1=CC=C(C=C1)F)C(=O)O MCULE-2850291067 [0,2,0,0,0,0|1,0,0]=3 4381 B14R1.7626 CC1=CC=C(C=C1)CC(C)(C)C(=O)N MCULE-3219067506 [0,2,0,0,0,0|2,0,0]=4 4382 B14R1.7626 CC1=CC=C(C=C1)CC(C)(C)C(=O)O MCULE-1069788086 [0,2,0,0,0,0|1,0,0]=3 4383 B14R1.7626 CC1=CC=C(C=C1)NC(C)(C)C(=O)O MCULE-7059709125 [0,2,0,0,0,0|2,0,0]=4 4384 B14R1.7626 CC1=CC=C(C=C1)OC(C)(C)C(=O)O MCULE-2103839269 [0,2,0,0,0,0|2,0,0]=4 4385 B14R1.7626 C[C@@](N)(CC1=CC=C(C=C1)Br)C(=O)O MCULE-5521094663 [0,2,0,0,0,0|1,0,0]=3 4386 B14R1.7626 C[C@@](N)(CC1=CC=C(C=C1)Br)C(=O)O MCULE-9054126131 [0,2,0,0,0,0|1,0,0]=3 4387 B14R1.7626 C[C@@](N)(CC1=CC=C(C=C1)F)C(=O)O MCULE-6352802974 [0,2,0,0,0,0|1,0,0]=3 4388 B14R1.7626 C[C@@](N)(CC1=CC=C(C=C1)F)C(=O)O MCULE-9883397867 [0,2,0,0,0,0|1,0,0]=3 4389 B14R1.7626 C[C@@](N)(CC1=CC=C(C=C1)O)C(=O)O MCULE-2159877207 [0,2,0,0,0,0|1,0,0]=3 4390 B14R1.7626 C[C@@](N)(CC1=CC=C(C=C1)O)C(=O)O MCULE-8334397996 [0,2,0,0,0,0|1,0,0]=3 4391 B14R1.7626 C[C@](N)(CC1=CC=C(C=C1)Br)C(=O)O MCULE-2994810034 [0,2,0,0,0,0|1,0,0]=3 4392 B14R1.7626 C[C@](N)(CC1=CC=C(C=C1)F)C(=O)O MCULE-8733293904 [0,2,0,0,0,0|1,0,0]=3 4393 B14R1.7626 C[C@](N)(CC1=CC=C(C=C1)F)C(=O)O MCULE-9306116320 [0,2,0,0,0,0|1,0,0]=3 4394 B14R1.7626 C[C@](N)(CC1=CC=C(C=C1)I)C(=O)O MCULE-7973579575 [0,2,0,0,0,0|1,0,0]=3 4395 B14R1.7626 C[C@](N)(CC1=CC=C(C=C1)O)C(=O)O MCULE-4720986345 [0,2,0,0,0,0|1,0,0]=3 4396 B14R1.7626 C[C@](N)(CC1=CC=C(C=C1)O)C(=O)O MCULE-5340647798 [0,2,0,0,0,0|1,0,0]=3 4397 B14R1.7626 O=C(O)C(F)(F)CC1=CC=C(C=C1)Br MCULE-1726007905 [0,2,0,0,0,0|1,0,0]=3 4398 B14R1.7626 O=C(O)C(F)(F)OC1=CC=C(C=C1)Br MCULE-1063082141 [0,2,0,0,0,0|2,0,0]=4 4399 B14R1.7626 O=C(O)C(F)(F)OC1=CC=C(C=C1)F MCULE-3716389094 [0,2,0,0,0,0|2,0,0]=4 4400 B14R1.1600 CC1=CC(=C(C=C1)OCC(=O)O)C=O MCULE-6188698048 [0,2,0,0,0,0|2,0,0]=4 4401 B14R1.1600 CCC1=CC(=CC=C1OCC(=O)O)Br MCULE-1813534967 [0,2,0,0,0,0|2,0,0]=4 4402 B14R1.1600 CCC1=CC(=CC=C1OCC(=O)O)F MCULE-5458549802 [0,2,0,0,0,0|2,0,0]=4 4403 B14R1.1600 COC1=C(C=CC(=C1)Br)CCC(=O)C MCULE-9739101943 [0,2,0,0,0,0|2,0,0]=4 4404 B14R1.1600 COC1=C(C=CC(=C1)Br)CCC(=O)O MCULE-6135802905 [0,2,0,0,0,0|1,0,0]=3 4405 B14R1.1600 COC1=C(C=CC(=C1)F)CCC(=O)O MCULE-5808602873 [0,2,0,0,0,0|1,0,0]=3 4406 B14R1.1600 COC1=C(C=CC(=C1)F)OCC(=O)O MCULE-7404098468 [0,2,0,0,0,0|2,0,0]=4 4407 B14R1.1600 COC1=C(C=CC(=C1)N)OCC(=O)N MCULE-9268377853 [0,2,0,0,0,0|2,0,0]=4 4408 B14R1.1600 COC1=CC(=CC=C1OCC(=O)O)C MCULE-4060985766 [0,2,0,0,0,0|2,0,0]=4 4409 B14R1.1600 COC1=CC(=CC=C1OCC(=O)O)Cl MCULE-2277744510 [0,2,0,0,0,0|2,0,0]=4 4410 B14R1.1600 N#CC1=CC(=CC=C1OCC(=O)O)Br MCULE-8096207417 [0,2,0,0,0,0|2,0,0]=4 4411 B14R1.1600 N#CC1=CC(=CC=C1OCC(=O)O)Cl MCULE-3429630711 [0,2,0,0,0,0|2,0,0]=4 4412 B14R1.1600 O=C(O)COC1=C(C=C(C=C1)Cl)CCl MCULE-3489141424 [0,2,0,0,0,0|2,0,0]=4 4413 B14R1.1600 O=C(O)COC1=CC=C(C=C1CO)Br MCULE-6729250214 [0,2,0,0,0,0|2,0,0]=4 4414 B14R1.1600 O=C(O)COC1=CC=C(C=C1CO)Cl MCULE-3483771527 [0,2,0,0,0,0|2,0,0]=4 4415 B14R1.1600 O=CC1=C(C=CC(=C1)Br)OCC(=O)O MCULE-3263948503 [0,2,0,0,0,0|2,0,0]=4 4416 B14R1.1600 O=CC1=CC(=CC=C1OCC(=O)O)Cl MCULE-8000316948 [0,2,0,0,0,0|2,0,0]=4 4417 B14R1.1600 O=CC1=CC(=CC=C1OCC(=O)O)F MCULE-5123617200 [0,2,0,0,0,0|2,0,0]=4 4418 B14R1.3152 CC1=C(C(=CC(=C1)Br)Cl)OCC(=O)O MCULE-7407259512 [0,2,0,0,0,0|2,0,0]=4 4419 B14R1.3152 CC1=C(C(=NC(=N1)N)O)CCC(=O)O MCULE-2683408301 [0,2,0,0,0,0|2,0,0]=4 4420 B14R1.3152 CC1=CC(=C(C(=C1)C)OCC(=O)O)Br MCULE-7504766046 [0,2,0,0,0,0|2,0,0]=4 4421 B14R1.3152 CC1=CC(=C(C(=C1)C)OCC(=O)O)C MCULE-5733040549 [0,2,0,0,0,0|2,0,0]=4 4422 B14R1.3152 CC1=CC(=C(C(=C1)C)OCC(=O)O)Cl MCULE-6584885690 [0,2,0,0,0,0|2,0,0]=4 4423 B14R1.3152 CC1=CC(=CC(=C1OCC(=O)O)Br)Br MCULE-2389185644 [0,2,0,0,0,0|2,0,0]=4 4424 B14R1.3152 CC1=CC(=CC(=C1OCC(=O)O)C)Br MCULE-8341489885 [0,2,0,0,0,0|2,0,0]=4 4425 B14R1.3152 CC1=CC(=CC(=C1OCC(=O)O)C)Cl MCULE-8715719886 [0,2,0,0,0,0|2,0,0]=4 4426 B14R1.3152 CC1=CC(=CC(=C1OCC(=O)O)Cl)Cl MCULE-8157003687 [0,2,0,0,0,0|2,0,0]=4 4427 B14R1.3152 CC1=CC(=CC(=O)N1CCC(=O)O)Cl MCULE-5966177862 [0,2,0,0,0,0|2,0,0]=4 4428 B14R1.3152 CC1=CC(=CC(=O)N1CCC(=O)O)O MCULE-2638342485 [0,2,0,0,0,0|2,0,0]=4 4429 B14R1.3152 CC1=CC(=O)NC(=C1CCC(=O)O)C MCULE-1408371788 [0,2,0,0,0,0|2,0,0]=4 4430 B14R1.3152 CC1=CC(=[N+](C(=C1)C)CCC(=O)O)C MCULE-1443430614 [0,2,0,0,0,0|2,0,0]=4 4431 B14R1.3152 CC1=CC(=[N+](C(=C1)C)CCC(=O)O)C MCULE-3381524373 [0,2,0,0,0,0|2,0,0]=4 4432 B14R1.3152 CC1=NC(=NC(=C1CCC(=O)O)C)N MCULE-8853189812 [0,2,0,0,0,0|2,0,0]=4 4433 B14R1.3152 O=C(O)CCC1=C(C=C(C=C1F)Br)F MCULE-7902017062 [0,2,0,0,0,0|1,0,0]=3 4434 B14R1.3152 O=C(O)CCC1=C(C=C(C=C1O)O)O MCULE-4892964005 [0,2,0,0,0,0|1,0,0]=3 4435 B14R1.3152 O=C(O)COC1=C(C=C(C=C1Br)Cl)Cl MCULE-7919164207 [0,2,0,0,0,0|2,0,0]=4 4436 B14R1.3152 O=C(O)COC1=C(C=C(C=C1Cl)Cl)Cl MCULE-9411161830 [0,2,0,0,0,0|2,0,0]=4 4437 B14R1.3152 O=C(O)CSC1=C(C=C(C=C1Cl)Cl)Cl MCULE-2845100007 [0,2,0,0,0,0|2,0,0]=4 4438 B14R1.6036 CC1=C(C=C(C(=C1)SCC(=O)O)Cl)Cl MCULE-1805470043 [0,2,0,0,0,0|2,0,0]=4 4439 B14R1.6036 CC1=CC(=C(C=C1Br)F)OCC(=O)O MCULE-3323685659 [0,2,0,0,0,0|2,0,0]=4 4440 B14R1.6036 CC1=CC(=C(C=C1OCC(=O)O)C)Cl MCULE-2664977117 [0,2,0,0,0,0|2,0,0]=4 4441 B14R1.6036 CC1=CC(=C(C=C1SCC(=O)O)C)Br MCULE-5284263740 [0,2,0,0,0,0|2,0,0]=4 4442 B14R1.6036 CC1=CC(=C(C=C1SCC(=O)O)C)Cl MCULE-3359571721 [0,2,0,0,0,0|2,0,0]=4 4443 B14R1.6036 O=C(O)CCC1=CC(=C(C=C1F)F)F MCULE-9986540205 [0,2,0,0,0,0|1,0,0]=3 4444 B14R1.6036 O=C(O)COC1=C(C=C(C(=C1)Cl)Cl)Cl MCULE-5451577697 [0,2,0,0,0,0|2,0,0]=4 4445 B14R1.6036 O=C(O)COC1=CC(=C(C=C1Cl)Br)Cl MCULE-7765857897 [0,2,0,0,0,0|2,0,0]=4 4446 B14R1.6059 CC1=C(C(=CC=C1CCC(=O)O)N)O MCULE-7830689786 [0,2,0,0,0,0|0,0,0]=2 4447 B14R1.6059 CC1=CC=C(C(=C1F)F)CCC(=O)O MCULE-4668798335 [0,2,0,0,0,0|1,0,0]=3 4448 B14R1.6059 O=C(O)CCC1=CC=C(C(=C1F)F)F MCULE-5658281696 [0,2,0,0,0,0|1,0,0]=3 4449 B14R1.6059 O=C(O)CSC1=CC=C(C(=C1Cl)Cl)Cl MCULE-6693564862 [0,2,0,0,0,0|2,0,0]=4 4450 B14R1.42 CCC1=C(C=CC(=C1)OCC(=O)O)Cl MCULE-4755477488 [0,2,0,0,0,0|2,0,0]=4 4451 B14R1.42 COC1=C(C=CC(=C1)CCC(=O)C)O MCULE-3189604755 [0,2,0,0,0,0|2,0,0]=4 4452 B14R1.42 COC1=C(C=CC(=C1)CCC(=O)O)C MCULE-9028033518 [0,2,0,0,0,0|1,0,0]=3 4453 B14R1.42 COC1=C(C=CC(=C1)CCC(=O)O)Cl MCULE-1402123706 [0,2,0,0,0,0|1,0,0]=3 4454 B14R1.42 COC1=C(C=CC(=C1)CCC(=O)O)F MCULE-4035483921 [0,2,0,0,0,0|1,0,0]=3 4455 B14R1.42 COC1=C(C=CC(=C1)CCC(=O)O)O MCULE-6192664785 [0,2,0,0,0,0|1,0,0]=3 4456 B14R1.42 COC1=C(C=CC(=C1)OCC(=O)O)Cl MCULE-2450701203 [0,2,0,0,0,0|2,0,0]=4 4457 B14R1.42 N#CC1=C(C=CC(=C1)CCC(=O)O)F MCULE-5610571509 [0,2,0,0,0,0|1,0,0]=3 4458 B14R1.42 O=CC1=C(C=CC(=C1)CCC(=O)O)O MCULE-1261376235 [0,2,0,0,0,0|1,0,0]=3 4459 B14R1.15552 CC1=CC(=CC(=C1Cl)C)OCC(=O)O MCULE-8692905904 [0,2,0,0,0,0|2,0,0]=4 4460 B14R1.15552 CC1=CC(=CC(=C1F)C)CCC(=O)O MCULE-6098002998 [0,2,0,0,0,0|1,0,0]=3 4461 B14R1.15552 CC1=CC(=CC(=C1O)C)CCC(=O)O MCULE-8327481910 [0,2,0,0,0,0|1,0,0]=3 4462 B14R1.15552 O=C(O)CCC1=CC(=C(C(=C1)Br)O)Br MCULE-6845594960 [0,2,0,0,0,0|1,0,0]=3 4463 B14R1.15552 O=C(O)CCC1=CC(=C(C(=C1)F)F)F MCULE-8100309874 [0,2,0,0,0,0|1,0,0]=3 4464 B14R1.15552 O=C(O)CCC1=CC(=C(C(=C1)I)O)I MCULE-6755842452 [0,2,0,0,0,0|1,0,0]=3 4465 B14R1.15552 O=C(O)COC1=CC(=C(C(=C1)Br)O)Br MCULE-8551291150 [0,2,0,0,0,0|2,0,0]=4 4466 B12R1.127 NC1=CC(=C(C=C1)F)CC(=O)O MCULE-2350995799 [0,0,1,1,0,0|1,0,1]=4 4467 B12R1.224 CC1=C(C=CC=C1CC(=O)O)N MCULE-1243968923 [0,0,1,1,0,0|0,0,2]=4 4468 B12R1.224 NC1=CC=CN(C1=O)CC(=O)O MCULE-4116808126 [0,0,1,1,0,0|2,0,0]=4 4469 B12R1.224 NC1=CC=CN(C1=O)CC(=O)O MCULE-6522081632 [0,0,1,1,0,0|2,0,0]=4 4470 B12R2.24 BrC1=CC2=C(C=C1)CCC=C2 MCULE-1099504485 [1,0,0,1,0,0|2,0,0]=4 4471 B12R2.24 BrC1=CC2=C(C=C1)CCCO2 MCULE-9761128663 [1,0,0,1,0,0|1,0,1]=4 4472 B12R2.24 ClC1=CC2=C(C=C1)CCCO2 MCULE-8318105514 [1,0,0,1,0,0|1,0,1]=4 4473 B12R2.24 FC1=CC2=C(C=C1)CCCO2 MCULE-2552981560 [1,0,0,1,0,0|1,0,1]=4 4474 B12R2.24 NC1=CC2=C(C=C1)CCCC2 MCULE-9139960873 [1,0,0,1,0,0|1,0,1]=4 4475 B12R2.24 NC1=CC2=C(C=C1)CCCN2 MCULE-2741838880 [1,0,0,1,0,0|1,0,1]=4 4476 B12R2.24 NC1=CC2=C(C=C1)CCCO2 MCULE-9412463492 [1,0,0,1,0,0|0,0,1]=3 4477 B12R2.24 NC1=CC2=C(C=C1)CCNC2 MCULE-1814598768 [1,0,0,1,0,0|2,0,0]=4 4478 B12R2.24 NC1=CC2=C(C=C1)CCOC2 MCULE-1394310074 [1,0,0,1,0,0|2,0,0]=4 4479 B12R2.24 NC1=CC2=C(C=C1)OCCO2 MCULE-6677874603 [1,0,0,1,0,0|1,0,1]=4 4480 B12R2.24 NC1=CC=C2CCCNC2=C1 MCULE-2585738741 [1,0,0,1,0,0|1,0,1]=4 4481 B12R2.24 NC1=CC=C2CCCNC2=C1 MCULE-2921370094 [1,0,0,1,0,0|1,0,1]=4 4482 B12R2.24 NC1=CC=C2CCNCC2=C1 MCULE-3806453662 [1,0,0,1,0,0|2,0,0]=4 4483 B12R2.24 NC1=CC=C2CCNCC2=C1 MCULE-5720422671 [1,0,0,1,0,0|2,0,0]=4 4484 B12R2.24 NC1=CC=C2NCCOC2=C1 MCULE-8138869195 [1,0,0,1,0,0|1,0,1]=4 4485 B12R2.24 NC1=CC=C2OCCOC2=C1 MCULE-4828466721 [1,0,0,1,0,0|1,0,1]=4 4486 B12R2.24 OC1=CC2=C(C=C1)CCCO2 MCULE-9344776795 [1,0,0,1,0,0|1,0,1]=4 4487 B12R2.132 CC1=CC2=C(C=C1)CCC2=O MCULE-7931236286 [1,0,0,1,0,0|1,0,0]=3 4488 B12R2.132 CC1=CC2=C(C=C1)COC2=O MCULE-4100051500 [1,0,0,1,0,0|2,0,0]=4 4489 B12R2.132 CC1=CC=C2CCC(C2=C1)O MCULE-9022129670 [1,0,0,1,0,0|1,0,1]=4 4490 B12R2.132 CC1=CC=C2CNC(=O)C2=C1 MCULE-3208100621 [1,0,0,1,0,0|2,0,0]=4 4491 B12R2.132 CC1=CC=C2OCC(=O)C2=C1 MCULE-5367143988 [1,0,0,1,0,0|2,0,0]=4 4492 B12R2.132 CC1=CC=C2SCC(=O)C2=C1 MCULE-7887908036 [1,0,0,1,0,0|2,0,0]=4 4493 B12R2.132 CN1CCC2=C1C=C(C=C2)N MCULE-3475214578 [1,0,0,1,0,0|2,0,0]=4 4494 B12R2.132 CN1CCC2=C1C=C(C=C2)N MCULE-7122405422 [1,0,0,1,0,0|2,0,0]=4 4495 B12R2.132 NC1=CC2=C(C=C1)CCC2N MCULE-4516626856 [1,0,0,1,0,0|1,0,1]=4 4496 B12R2.132 NC1=CC2=C(C=C1)CCC2N MCULE-6363697664 [1,0,0,1,0,0|1,0,1]=4 4497 B12R2.132 NC1=CC2=C(C=C1)CCC2O MCULE-6583720830 [1,0,0,1,0,0|0,0,1]=3 4498 B12R2.132 NC1=CC2=C(C=C1)CNC2=O MCULE-9672856804 [1,0,0,1,0,0|1,0,0]=3 4499 B12R2.132 NC1=CC2=C(C=C1)COC2=O MCULE-1549045022 [1,0,0,1,0,0|1,0,0]=3 4500 B12R2.132 NC1=CC2=C(C=C1)COC2=O MCULE-2283466825 [1,0,0,1,0,0|1,0,0]=3 4501 B12R2.132 NC1=CC2=C(C=C1)NN=C2O MCULE-1833937560 [1,0,0,1,0,0|2,0,0]=4 4502 B12R2.132 NC1=CC2=C(C=C1)NN=C2O MCULE-3557522093 [1,0,0,1,0,0|2,0,0]=4 4503 B12R2.132 NC1=CC2=C(C=C1)OCC2=O MCULE-6643049220 [1,0,0,1,0,0|1,0,0]=3 4504 B12R2.132 NC1=CC=C2CCC(=O)C2=C1 MCULE-3422437125 [1,0,0,1,0,0|0,0,0]=2 4505 B12R2.132 NC1=CC=C2CC[C@@H](C2=C1)N MCULE-3183545476 [1,0,0,1,0,0|1,0,1]=4 4506 B12R2.132 NC1=CC=C2CC[C@H](C2=C1)N MCULE-3460006248 [1,0,0,1,0,0|1,0,1]=4 4507 B12R2.132 NC1=CC=C2COB(C2=C1)O MCULE-5400990112 [1,0,0,1,0,0|2,0,0]=4 4508 B12R2.132 NC1=CC=C2COB(C2=C1)O MCULE-7590243691 [1,0,0,1,0,0|2,0,0]=4 4509 B12R2.132 NC1=CC=C2ONC(=O)C2=C1 MCULE-1504455473 [1,0,0,1,0,0|2,0,0]=4 4510 B12R2.132 O=C1CCC2=C1C=C(C=C2)F MCULE-9548509498 [1,0,0,1,0,0|1,0,0]=3 4511 B12R2.132 O=C1CCC2=C1C=C(C=C2)I MCULE-1148520302 [1,0,0,1,0,0|1,0,0]=3 4512 B12R2.132 O=C1CCC2=C1C=C(C=C2)O MCULE-5421157613 [1,0,0,1,0,0|1,0,0]=3 4513 B12R2.132 O=C1CCC2=CC=C(C=C12)Br MCULE-2790940094 [1,0,0,1,0,0|1,0,0]=3 4514 B12R2.132 O=C1CCC2=CC=C(C=C12)Cl MCULE-2493018969 [1,0,0,1,0,0|1,0,0]=3 4515 B12R2.132 O=C1CCC2=CC=C(N=C12)Br MCULE-5097715365 [1,0,0,1,0,0|2,0,0]=4 4516 B12R2.132 O=C1CCC2=CC=C(N=C12)Cl MCULE-3672983458 [1,0,0,1,0,0|2,0,0]=4 4517 B12R2.132 O=C1CCC2=NC=C(C=C12)Br MCULE-7911489420 [1,0,0,1,0,0|2,0,0]=4 4518 B12R2.132 O=C1CCC2=NC=C(C=C12)Cl MCULE-5011032052 [1,0,0,1,0,0|2,0,0]=4 4519 B12R2.132 O=C1CCC2=NC=C(C=C12)F MCULE-5357578906 [1,0,0,1,0,0|2,0,0]=4 4520 B12R2.132 O=C1CCC2=NC=C(C=C12)O MCULE-5682377590 [1,0,0,1,0,0|2,0,0]=4 4521 B12R2.132 O=C1CNC2=C1C=C(C=C2)Br MCULE-5180736809 [1,0,0,1,0,0|2,0,0]=4 4522 B12R2.132 O=C1COC2=C1C=C(C=C2)Cl MCULE-5035207051 [1,0,0,1,0,0|2,0,0]=4 4523 B12R2.132 O=C1COC2=C1C=C(C=C2)F MCULE-5767138623 [1,0,0,1,0,0|2,0,0]=4 4524 B12R2.132 O=C1COC2=CC=C(C=C12)Br MCULE-7508641196 [1,0,0,1,0,0|2,0,0]=4 4525 B12R2.132 O=C1COC2=CC=C(C=C12)I MCULE-9878086145 [1,0,0,1,0,0|2,0,0]=4 4526 B12R2.132 O=C1COC2=CC=C(C=C12)O MCULE-1073944454 [1,0,0,1,0,0|2,0,0]=4 4527 B12R2.132 O=C1CSC2=CC=C(C=C12)Br MCULE-8629373004 [1,0,0,1,0,0|2,0,0]=4 4528 B12R2.132 O=C1CSC2=CC=C(C=C12)Cl MCULE-9180688383 [1,0,0,1,0,0|2,0,0]=4 4529 B12R2.132 O=C1CSC2=CC=C(C=C12)F MCULE-1844251562 [1,0,0,1,0,0|2,0,0]=4 4530 B12R2.132 O=C1NCC2=C1C=C(C=C2)Br MCULE-9167729735 [1,0,0,1,0,0|2,0,0]=4 4531 B12R2.132 O=C1NCC2=C1C=C(C=C2)Cl MCULE-6271426575 [1,0,0,1,0,0|2,0,0]=4 4532 B12R2.132 O=C1NCC2=C1C=C(C=C2)O MCULE-6029443180 [1,0,0,1,0,0|2,0,0]=4 4533 B12R2.132 O=C1NCC2=CC=C(C=C12)F MCULE-5910049565 [1,0,0,1,0,0|2,0,0]=4 4534 B12R2.132 O=C1NCC2=CC=C(C=C12)I MCULE-3559738270 [1,0,0,1,0,0|2,0,0]=4 4535 B12R2.132 O=C1OCC2=C1C=C(C=C2)Br MCULE-5984511571 [1,0,0,1,0,0|2,0,0]=4 4536 B12R2.132 O=C1OCC2=C1C=C(C=C2)Cl MCULE-2616562505 [1,0,0,1,0,0|2,0,0]=4 4537 B12R2.132 O=C1OCC2=C1C=C(C=C2)O MCULE-3533740523 [1,0,0,1,0,0|2,0,0]=4 4538 B12R2.132 O=C1OCC2=CC=C(C=C12)F MCULE-3327536162 [1,0,0,1,0,0|2,0,0]=4 4539 B12R2.132 O=C1OCC2=CC=C(C=C12)I MCULE-5798750224 [1,0,0,1,0,0|2,0,0]=4 4540 B12R2.132 OC1CCC2=C1C=C(C=C2)Cl MCULE-2014853722 [1,0,0,1,0,0|1,0,1]=4 4541 B12R2.132 OC1CCC2=C1C=C(C=C2)F MCULE-4615852579 [1,0,0,1,0,0|1,0,1]=4 4542 B12R2.132 OC1CCC2=CC=C(C=C12)Br MCULE-9656119986 [1,0,0,1,0,0|1,0,1]=4 4543 B12R2.132 O[C@H]1CCC2=C1C=C(C=C2)Br MCULE-2470155500 [1,0,0,1,0,0|1,0,1]=4 4544 B12R2.294 FC1=CC=C(C=C1)CC2CO2 MCULE-7248162103 [1,0,0,1,0,0|1,0,1]=4 4545 B12R2.2302 BrC1=CC=C(C=C1)C2CCO2 MCULE-8910004917 [1,0,0,1,0,0|1,0,1]=4 4546 B12R2.2302 NC1=CC=C(C=C1)C2CCC2 MCULE-4520010326 [1,0,0,1,0,0|1,0,1]=4 4547 B12R2.2302 NC1=CC=C(C=C1)C2CCC2 MCULE-5959462247 [1,0,0,1,0,0|1,0,1]=4 4548 B12R2.2302 NC1=CC=C(C=C1)C2CNC2 MCULE-3420130193 [1,0,0,1,0,0|2,0,0]=4 4549 B12R2.2302 NC1=CC=C(C=C1)C2CNC2 MCULE-7496276362 [1,0,0,1,0,0|2,0,0]=4 4550 B12R2.2302 NC1=CC=C(C=C1)C2COC2 MCULE-5879597202 [1,0,0,1,0,0|2,0,0]=4 4551 B12R2.22 O=C1CC(C1)C2=CC=CC=C2 MCULE-6796648829 [1,0,0,1,0,0|1,0,0]=3 4552 B12R2.22 O=C1CC(C1)C2=CC=CN=C2 MCULE-4428408766 [1,0,0,1,0,0|2,0,0]=4 4553 B12R2.22 O=C1CC(C1)C2=CC=NC=C2 MCULE-4667895627 [1,0,0,1,0,0|2,0,0]=4 4554 B12R2.22 O=C1CC(C1)C2=CC=NC=C2 MCULE-8264377270 [1,0,0,1,0,0|2,0,0]=4 4555 B12R2.22 O=C1CC(C1)C2=CN=CC=C2 MCULE-9165131942 [1,0,0,1,0,0|2,0,0]=4 4556 B12R2.22 O=C1CC(C1)C2=NC=CC=C2 MCULE-2228364883 [1,0,0,1,0,0|2,0,0]=4 4557 B12R2.22 O=C1CC(C1)C2=NC=CC=C2 MCULE-7989460331 [1,0,0,1,0,0|2,0,0]=4 4558 B12R2.22 O=C1CC(N1)C2=CC=CC=C2 MCULE-8124490179 [1,0,0,1,0,0|1,0,0]=3 4559 B12R2.22 OC1CC(C1)C2=CC=CC=C2 MCULE-7157925775 [1,0,0,1,0,0|1,0,1]=4 4560 B12R2.22 O[C@H]1C[C@@H](C1)C2=CC=CC=C2 MCULE-9927500490 [1,0,0,1,0,0|1,0,1]=4 4561 B12R2.22 O[C@H]1C[C@H](C1)C2=CC=CC=C2 MCULE-3362065123 [1,0,0,1,0,0|1,0,1]=4 4562 B12R2.2057 C1=CC=C(C=C1)CCC2CO2 MCULE-9524558320 [1,0,0,1,0,0|1,0,1]=4 4563 B12R2.2403 CC1(CCC2=C1C=CC=C2)O MCULE-2973643520 [1,0,0,1,0,0|1,0,1]=4 4564 B12R2.2403 N=S1(=O)CCC2=C1C=CC=C2 MCULE-6661644695 [1,0,0,1,0,0|2,0,0]=4 4565 B12R2.2403 NC1(CCC2=C1C=CC=C2)O MCULE-1844967572 [1,0,0,1,0,0|1,0,1]=4 4566 B12R2.2403 O=P1(COC2=C1C=CC=C2)O MCULE-7019498696 [1,0,0,1,0,0|2,0,0]=4 4567 B12R2.2403 O=S1(=O)CCC2=C1C=CC=C2 MCULE-9177566119 [1,0,0,1,0,0|1,0,1]=4 4568 B12R2.3190 O=C(O)C1=CC2=CC=CC=C12 MCULE-4865410555 [1,0,0,1,0,0|0,0,2]=4 4569 B12R2.3190 O=C(O)C1CC2=C1C=CC=C2 MCULE-2291823504 [1,0,0,1,0,0|0,0,0]=2 4570 B12R2.606 CC1=CC=C2CC(=O)NC2=C1 MCULE-4712274099 [0,0,0,1,1,0|2,0,0]=4 4571 B12R2.606 CC1=CC=C2NC(=O)OC2=C1 MCULE-2110711808 [0,0,0,1,1,0|2,0,0]=4 4572 B12R2.606 CC1=NC2=C(O1)C=C(C=C2)N MCULE-2575947894 [0,0,0,1,1,0|2,0,0]=4 4573 B12R2.606 NC1=CC2=C(C=C1)CC(=O)C2 MCULE-8740705898 [0,0,0,1,1,0|1,0,0]=3 4574 B12R2.606 NC1=CC2=C(C=C1)CC(=O)C2 MCULE-9410312687 [0,0,0,1,1,0|1,0,0]=3 4575 B12R2.606 NC1=CC2=C(C=C1)CC(=O)N2 MCULE-4416389474 [0,0,0,1,1,0|1,0,0]=3 4576 B12R2.606 NC1=CC2=C(C=C1)CC(=O)N2 MCULE-9234071253 [0,0,0,1,1,0|1,0,0]=3 4577 B12R2.606 NC1=CC2=C(C=C1)CC(C2)O MCULE-7036762300 [0,0,0,1,1,0|1,0,1]=4 4578 B12R2.606 NC1=CC2=C(C=C1)N=C(O2)S MCULE-8182036179 [0,0,0,1,1,0|1,1,0]=4 4579 B12R2.606 NC1=CC2=C(C=C1)NC(=O)N2 MCULE-3584969743 [0,0,0,1,1,0|2,0,0]=4 4580 B12R2.606 NC1=CC2=C(C=C1)NC(=O)S2 MCULE-6553401348 [0,0,0,1,1,0|1,1,0]=4 4581 B12R2.606 NC1=CC2=C(C=C1)OC(=O)N2 MCULE-1557147556 [0,0,0,1,1,0|2,0,0]=4 4582 B12R2.606 NC1=CC2=C(C=C1)OC(=O)N2 MCULE-1704419264 [0,0,0,1,1,0|2,0,0]=4 4583 B12R2.606 NC1=CC2=C(C=C1)SC(=N2)O MCULE-6332655403 [0,0,0,1,1,0|2,0,0]=4 4584 B12R2.606 NC1=CC2=C(CC(=O)N2)N=C1 MCULE-3965659611 [0,0,0,1,1,0|2,0,0]=4 4585 B12R2.606 NC1=CC=C2N=C(OC2=C1)Cl MCULE-7045216449 [0,0,0,1,1,0|2,0,0]=4 4586 B12R2.606 NC1=CC=C2N=C(OC2=C1)N MCULE-8355810216 [0,0,0,1,1,0|2,0,0]=4 4587 B12R2.606 NC1=CC=C2NC(=O)CC2=C1 MCULE-3410048932 [0,0,0,1,1,0|2,0,0]=4 4588 B12R2.606 NC1=CC=C2NC(=O)CC2=C1 MCULE-8734785363 [0,0,0,1,1,0|2,0,0]=4 4589 B12R2.606 NC1=CC=C2NC(=O)NC2=C1 MCULE-7217189722 [0,0,0,1,1,0|2,0,0]=4 4590 B12R2.606 NC1=CC=C2NC(=O)OC2=C1 MCULE-6045842657 [0,0,0,1,1,0|1,0,0]=3 4591 B12R2.606 NC1=CC=C2OC(=O)CC2=C1 MCULE-9710396364 [0,0,0,1,1,0|2,0,0]=4 4592 B12R2.606 O=C1CC2=C(C1)C=C(C=C2)Br MCULE-7139491061 [0,0,0,1,1,0|2,0,0]=4 4593 B12R2.606 O=C1CC2=C(C1)C=C(C=C2)Cl MCULE-1502550864 [0,0,0,1,1,0|2,0,0]=4 4594 B12R2.606 O=C1CC2=C(C1)C=C(C=C2)F MCULE-8139703686 [0,0,0,1,1,0|2,0,0]=4 4595 B12R2.606 O=C1CC2=C(N1)C=C(C=C2)Br MCULE-3938791272 [0,0,0,1,1,0|2,0,0]=4 4596 B12R2.606 O=C1CC2=C(N1)C=C(C=C2)Cl MCULE-4425259060 [0,0,0,1,1,0|2,0,0]=4 4597 B12R2.606 O=C1CC2=C(N1)C=C(C=C2)F MCULE-2759055018 [0,0,0,1,1,0|2,0,0]=4 4598 B12R2.606 O=C1CC2=C(N1)C=C(C=C2)I MCULE-3993358412 [0,0,0,1,1,0|2,0,0]=4 4599 B12R2.606 O=C1CC2=C(N1)C=C(C=C2)O MCULE-4456071084 [0,0,0,1,1,0|2,0,0]=4 4600 B12R2.606 O=C1CC2=C(O1)C=C(C=C2)Br MCULE-2409010753 [0,0,0,1,1,0|1,0,0]=3 4601 B12R2.606 O=C1CC2=CC=C(C=C2O1)O MCULE-9882520071 [0,0,0,1,1,0|1,0,0]=3 4602 B12R2.606 O=C1CC2=CC=C(C=C2S1)Br MCULE-7792279893 [0,0,0,1,1,0|1,1,0]=4 4603 B12R2.606 O=C1NC2=C(O1)C=C(C=C2)Cl MCULE-1133497396 [0,0,0,1,1,0|2,0,0]=4 4604 B12R2.606 O=C1NC2=C(O1)C=C(C=C2)O MCULE-9227104342 [0,0,0,1,1,0|2,0,0]=4 4605 B12R2.606 O=C1NC2=CC=C(C=C2O1)Br MCULE-8491907777 [0,0,0,1,1,0|2,0,0]=4 4606 B12R2.606 O=C1NC2=CC=C(C=C2O1)F MCULE-5308556987 [0,0,0,1,1,0|2,0,0]=4 4607 B12R2.606 O=C1NC2=CC=C(C=C2O1)I MCULE-2057406479 [0,0,0,1,1,0|2,0,0]=4 4608 B12R2.606 O=C1OC2=C(O1)C=C(C=C2)O MCULE-7358665603 [0,0,0,1,1,0|2,0,0]=4 4609 B12R2.606 O=C1OC2=C(S1)C=CC(=C2)O MCULE-4750186509 [0,0,0,1,1,0|2,0,0]=4 4610 B12R2.606 O=C1OC2=CC=C(C=C2O1)Br MCULE-2424436519 [0,0,0,1,1,0|2,0,0]=4 4611 B14R2.20 CC1=CC=C(C=C1)C2=CC(=O)CC2 MCULE-8749961946 [0,0,0,1,0,1|2,0,0]=4 4612 B14R2.20 CC1=CC=C(C=C1)C2CCC(=O)C2 MCULE-6610559625 [0,0,0,1,0,1|2,0,0]=4 4613 B14R2.20 CC1=CC=C(C=C1)C2CCC(=O)N2 MCULE-9036214470 [0,0,0,1,0,1|2,0,0]=4 4614 B14R2.20 CC1=CC=C(C=C1)C2CNC(=O)C2 MCULE-4384148692 [0,0,0,1,0,1|2,0,0]=4 4615 B14R2.20 CC1=CC=C(C=C1)C2NC(=O)CS2 MCULE-7467432698 [0,0,0,1,0,1|2,0,0]=4 4616 B14R2.20 CC1=CC=C(C=C1)C2OC(=O)CS2 MCULE-8874099607 [0,0,0,1,0,1|1,0,0]=3 4617 B14R2.20 CC1=CC=C(C=C1)N2CCC(=O)N2 MCULE-8758834521 [0,0,0,1,0,1|2,0,0]=4 4618 B14R2.20 CC1=CC=C(C=C1)[C@@H]2CNC(=O)N2 MCULE-3350113775 [0,0,0,1,0,1|2,0,0]=4 4619 B14R2.20 CC1=CC=C(C=C1)[C@@H]2COC(=O)N2 MCULE-1446705376 [0,0,0,1,0,1|2,0,0]=4 4620 B14R2.20 CC1=CC=C(C=C1)[C@@H]2COC(=O)N2 MCULE-8675692534 [0,0,0,1,0,1|2,0,0]=4 4621 B14R2.20 CC1=CC=C(C=C1)[C@H]2CNC(=O)N2 MCULE-7334894317 [0,0,0,1,0,1|2,0,0]=4 4622 B14R2.20 CC1=CC=C(C=C1)[C@H]2COC(=O)N2 MCULE-3831959198 [0,0,0,1,0,1|2,0,0]=4 4623 B14R2.20 CC1=CC=C(C=C1)[C@H]2COC(=O)N2 MCULE-5320095889 [0,0,0,1,0,1|2,0,0]=4 4624 B14R2.20 NC1=CC=C(C=C1)C2=NNC(=O)O2 MCULE-3042296698 [0,0,0,1,0,1|1,0,1]=4 4625 B14R2.20 NC1=CC=C(C=C1)C2CCC(=O)N2 MCULE-8217764899 [0,0,0,1,0,1|1,0,0]=3 4626 B14R2.20 NC1=CC=C(C=C1)C2CNC(=O)C2 MCULE-1299399770 [0,0,0,1,0,1|1,0,0]=3 4627 B14R2.20 NC1=CC=C(C=C1)C2COC(=O)N2 MCULE-1986685378 [0,0,0,1,0,1|1,0,0]=3 4628 B14R2.20 NC1=CC=C(C=C1)N2CCC(=N2)N MCULE-1701899856 [0,0,0,1,0,1|2,0,0]=4 4629 B14R2.20 NC1=CC=C(C=C1)N2CCC(=N2)N MCULE-2903031509 [0,0,0,1,0,1|2,0,0]=4 4630 B14R2.20 NC1=CC=C(C=C1)N2CCC(C2)O MCULE-5158422836 [0,0,0,1,0,1|1,0,1]=4 4631 B14R2.20 NC1=CC=C(C=C1)[C@@H]2COC(=O)N2 MCULE-4015874240 [0,0,0,1,0,1|1,0,0]=3 4632 B14R2.20 NC1=CC=C(C=C1)[C@@H]2COC(=O)N2 MCULE-4475005811 [0,0,0,1,0,1|1,0,0]=3 4633 B14R2.20 NC1=NCC(O1)C2=CC=C(C=C2)Br MCULE-5637477990 [0,0,0,1,0,1|2,0,0]=4 4634 B14R2.20 O=C1CC(CN1)C2=CC=C(C=C2)Br MCULE-9508766371 [0,0,0,1,0,1|2,0,0]=4 4635 B14R2.20 O=C1CC(CN1)C2=CC=C(C=C2)Cl MCULE-9554371571 [0,0,0,1,0,1|2,0,0]=4 4636 B14R2.20 O=C1CC(CN1)C2=CC=C(C=C2)F MCULE-4243410397 [0,0,0,1,0,1|2,0,0]=4 4637 B14R2.20 O=C1CC(CN1)C2=CC=C(C=C2)O MCULE-3803285960 [0,0,0,1,0,1|2,0,0]=4 4638 B14R2.20 O=C1CC=C(O1)C2=CC=C(C=C2)Br MCULE-4232391666 [0,0,0,1,0,1|1,0,1]=4 4639 B14R2.20 O=C1CCC(C1)C2=CC=C(C=C2)Br MCULE-6364196186 [0,0,0,1,0,1|2,0,0]=4 4640 B14R2.20 O=C1CCC(C1)C2=CC=C(C=C2)Cl MCULE-1867475494 [0,0,0,1,0,1|2,0,0]=4 4641 B14R2.20 O=C1CCC(C1)C2=CC=C(C=C2)F MCULE-8744764424 [0,0,0,1,0,1|2,0,0]=4 4642 B14R2.20 O=C1CCC(N1)C2=CC=C(C=C2)Br MCULE-8194383793 [0,0,0,1,0,1|2,0,0]=4 4643 B14R2.20 O=C1CCC(N1)C2=CC=C(C=C2)Cl MCULE-9585273718 [0,0,0,1,0,1|2,0,0]=4 4644 B14R2.20 O=C1CCC(N1)C2=CC=C(C=C2)F MCULE-6597704927 [0,0,0,1,0,1|2,0,0]=4 4645 B14R2.20 O=C1CCC(N1)C2=CC=C(C=C2)O MCULE-5258551213 [0,0,0,1,0,1|2,0,0]=4 4646 B14R2.20 O=C1CCC(O1)C2=CC=C(C=C2)Br MCULE-4562948394 [0,0,0,1,0,1|1,0,0]=3 4647 B14R2.20 O=C1CCC(O1)C2=CC=C(C=C2)F MCULE-1774159402 [0,0,0,1,0,1|1,0,0]=3 4648 B14R2.20 O=C1CCN(C1)C2=CC=C(C=C2)F MCULE-7140904332 [0,0,0,1,0,1|2,0,0]=4 4649 B14R2.20 O=C1CCN(N1)C2=CC=C(C=C2)Br MCULE-5528294865 [0,0,0,1,0,1|2,0,0]=4 4650 B14R2.20 O=C1CCN(N1)C2=CC=C(C=C2)Cl MCULE-2628804005 [0,0,0,1,0,1|2,0,0]=4 4651 B14R2.20 O=C1CSC(N1)C2=CC=C(C=C2)Br MCULE-7926593938 [0,0,0,1,0,1|2,0,0]=4 4652 B14R2.20 O=C1CSC(N1)C2=CC=C(C=C2)Cl MCULE-6751101358 [0,0,0,1,0,1|2,0,0]=4 4653 B14R2.20 O=C1CSC(N1)C2=CC=C(C=C2)F MCULE-7375031528 [0,0,0,1,0,1|2,0,0]=4 4654 B14R2.20 O=C1C[C@H](CN1)C2=CC=C(C=C2)Cl MCULE-4218390574 [0,0,0,1,0,1|2,0,0]=4 4655 B14R2.20 O=C1C[C@H](CN1)C2=CC=C(C=C2)Cl MCULE-8607868515 [0,0,0,1,0,1|2,0,0]=4 4656 B14R2.20 O=C1C[C@H](CN1)C2=CC=C(C=C2)F MCULE-5238256678 [0,0,0,1,0,1|2,0,0]=4 4657 B14R2.20 O=C1C[C@H](CN1)C2=CC=C(C=C2)F MCULE-6636322660 [0,0,0,1,0,1|2,0,0]=4 4658 B14R2.20 O=C1NC(CO1)C2=CC=C(C=C2)Br MCULE-1209337263 [0,0,0,1,0,1|2,0,0]=4 4659 B14R2.20 O=C1NC(CO1)C2=CC=C(C=C2)Cl MCULE-6262064197 [0,0,0,1,0,1|2,0,0]=4 4660 B14R2.20 O=C1NCC(O1)C2=CC=C(C=C2)Br MCULE-6896657401 [0,0,0,1,0,1|1,0,0]=3 4661 B14R2.20 O=C1NCC(O1)C2=CC=C(C=C2)Cl MCULE-3971849888 [0,0,0,1,0,1|1,0,0]=3 4662 B14R2.20 O=C1NC[C@@H](N1)C2=CC=C(C=C2)Br MCULE-9368823092 [0,0,0,1,0,1|2,0,0]=4 4663 B14R2.20 O=C1NC[C@@H](N1)C2=CC=C(C=C2)Cl MCULE-3402967803 [0,0,0,1,0,1|2,0,0]=4 4664 B14R2.20 O=C1NC[C@@H](N1)C2=CC=C(C=C2)F MCULE-6778138683 [0,0,0,1,0,1|2,0,0]=4 4665 B14R2.20 O=C1NC[C@@H](N1)C2=CC=C(C=C2)I MCULE-2893681603 [0,0,0,1,0,1|2,0,0]=4 4666 B14R2.20 O=C1NC[C@@H](N1)C2=CC=C(C=C2)O MCULE-4085605276 [0,0,0,1,0,1|2,0,0]=4 4667 B14R2.20 O=C1NC[C@@H](O1)C2=CC=C(C=C2)Br MCULE-7871798410 [0,0,0,1,0,1|1,0,0]=3 4668 B14R2.20 O=C1NC[C@H](N1)C2=CC=C(C=C2)Br MCULE-2528421572 [0,0,0,1,0,1|2,0,0]=4 4669 B14R2.20 O=C1NC[C@H](N1)C2=CC=C(C=C2)Cl MCULE-4730713983 [0,0,0,1,0,1|2,0,0]=4 4670 B14R2.20 O=C1NC[C@H](N1)C2=CC=C(C=C2)F MCULE-6679784073 [0,0,0,1,0,1|2,0,0]=4 4671 B14R2.20 O=C1NC[C@H](N1)C2=CC=C(C=C2)I MCULE-2732881820 [0,0,0,1,0,1|2,0,0]=4 4672 B14R2.20 O=C1NC[C@H](N1)C2=CC=C(C=C2)O MCULE-6962864324 [0,0,0,1,0,1|2,0,0]=4 4673 B14R2.20 O=C1N[C@@H](CO1)C2=CC=C(C=C2)Br MCULE-2023324814 [0,0,0,1,0,1|2,0,0]=4 4674 B14R2.20 O=C1N[C@@H](CO1)C2=CC=C(C=C2)Br MCULE-4651319054 [0,0,0,1,0,1|2,0,0]=4 4675 B14R2.20 O=C1N[C@@H](CO1)C2=CC=C(C=C2)Cl MCULE-2448436713 [0,0,0,1,0,1|2,0,0]=4 4676 B14R2.20 O=C1N[C@@H](CO1)C2=CC=C(C=C2)Cl MCULE-4873459790 [0,0,0,1,0,1|2,0,0]=4 4677 B14R2.20 O=C1N[C@@H](CO1)C2=CC=C(C=C2)Cl MCULE-8858055801 [0,0,0,1,0,1|2,0,0]=4 4678 B14R2.20 O=C1N[C@@H](CO1)C2=CC=C(C=C2)F MCULE-1842232966 [0,0,0,1,0,1|2,0,0]=4 4679 B14R2.20 O=C1N[C@@H](CO1)C2=CC=C(C=C2)F MCULE-5329339756 [0,0,0,1,0,1|2,0,0]=4 4680 B14R2.20 O=C1N[C@@H](CO1)C2=CC=C(C=C2)I MCULE-1251658250 [0,0,0,1,0,1|2,0,0]=4 4681 B14R2.20 O=C1N[C@@H](CO1)C2=CC=C(C=C2)I MCULE-2086688434 [0,0,0,1,0,1|2,0,0]=4 4682 B14R2.20 O=C1N[C@@H](CO1)C2=CC=C(C=C2)O MCULE-2437054943 [0,0,0,1,0,1|2,0,0]=4 4683 B14R2.20 O=C1N[C@@H](CO1)C2=CC=C(C=C2)O MCULE-9019871175 [0,0,0,1,0,1|2,0,0]=4 4684 B14R2.20 O=C1N[C@H](CO1)C2=CC=C(C=C2)Br MCULE-8165030483 [0,0,0,1,0,1|2,0,0]=4 4685 B14R2.20 O=C1N[C@H](CO1)C2=CC=C(C=C2)Br MCULE-9375586164 [0,0,0,1,0,1|2,0,0]=4 4686 B14R2.20 O=C1N[C@H](CO1)C2=CC=C(C=C2)Cl MCULE-4194192129 [0,0,0,1,0,1|2,0,0]=4 4687 B14R2.20 O=C1N[C@H](CO1)C2=CC=C(C=C2)Cl MCULE-5576870904 [0,0,0,1,0,1|2,0,0]=4 4688 B14R2.20 O=C1N[C@H](CO1)C2=CC=C(C=C2)F MCULE-6126426821 [0,0,0,1,0,1|2,0,0]=4 4689 B14R2.20 O=C1N[C@H](CO1)C2=CC=C(C=C2)F MCULE-7155628127 [0,0,0,1,0,1|2,0,0]=4 4690 B14R2.20 O=C1N[C@H](CO1)C2=CC=C(C=C2)I MCULE-6006192587 [0,0,0,1,0,1|2,0,0]=4 4691 B14R2.20 O=C1N[C@H](CO1)C2=CC=C(C=C2)I MCULE-7845145683 [0,0,0,1,0,1|2,0,0]=4 4692 B14R2.20 O=C1N[C@H](CO1)C2=CC=C(C=C2)O MCULE-3275797928 [0,0,0,1,0,1|2,0,0]=4 4693 B14R2.20 O=C1N[C@H](CO1)C2=CC=C(C=C2)O MCULE-8175760132 [0,0,0,1,0,1|2,0,0]=4 4694 B14R2.20 OC1=NN(CC1)C2=CC=C(C=C2)F MCULE-3478469595 [0,0,0,1,0,1|2,0,0]=4 4695 B14R2.380 CC1=CC2=C(C=C1)CCCC(=O)N2 MCULE-6092742104 [0,0,0,1,0,1|2,0,0]=4 4696 B14R2.380 CC1=CC2=C(C=C1)SCCC(=O)N2 MCULE-1868689016 [0,0,0,1,0,1|2,0,0]=4 4697 B14R2.380 NC1=CC=C2CCCC(=O)NC2=C1 MCULE-7619858802 [0,0,0,1,0,1|1,0,0]=3 4698 B14R2.380 O=C1CC2=C(C=CC(=C2)O)CCN1 MCULE-3824021377 [0,0,0,1,0,1|2,0,0]=4 4699 B14R2.380 O=C1CCCC2=C(N1)C=C(C=C2)Br MCULE-3672683469 [0,0,0,1,0,1|2,0,0]=4 4700 B14R2.380 O=C1CCCC2=CC=C(C=C2C1)Br MCULE-1454350093 [0,0,0,1,0,1|2,0,0]=4 4701 B14R2.380 O=C1CCCC2=CC=C(C=C2N1)Cl MCULE-1281609235 [0,0,0,1,0,1|2,0,0]=4 4702 B14R2.380 O=C1CCNC2=C(N1)C=C(C=C2)Br MCULE-7673921536 [0,0,0,1,0,1|2,0,0]=4 4703 B14R2.380 O=C1CCNC2=C(N1)C=C(C=C2)Cl MCULE-7389896413 [0,0,0,1,0,1|2,0,0]=4 4704 B14R2.380 O=C1CCNC2=C(N1)C=C(C=C2)F MCULE-6578784484 [0,0,0,1,0,1|2,0,0]=4 4705 B14R2.380 O=C1CCOC2=CC=C(C=C2N1)Br MCULE-6391155971 [0,0,0,1,0,1|2,0,0]=4 4706 B14R2.947 NC1=CC=C(C=C1)CN2CC(C2)O MCULE-8463721913 [0,0,0,1,0,1|1,0,1]=4 4707 B14R2.947 NC1=CC=C(C=C1)OC2CC(=O)N2 MCULE-8550334861 [0,0,0,1,0,1|1,0,0]=3 4708 B14R2.947 O=C1CC(N1)CC2=CC=C(C=C2)F MCULE-8110817484 [0,0,0,1,0,1|2,0,0]=4 4709 B14R2.947 O=C1CC(N1)OC2=CC=C(C=C2)Br MCULE-7044567370 [0,0,0,1,0,1|2,0,0]=4 4710 B14R2.4402 CC(=O)C1CC1C2=CC=C(C=C2)Br MCULE-8475354591 [0,0,0,1,0,1|2,0,0]=4 4711 B14R2.4402 CC(=O)C1CC1C2=CC=C(C=C2)C MCULE-6079672336 [0,0,0,1,0,1|2,0,0]=4 4712 B14R2.4402 CC(=O)C1CC1C2=CC=C(C=C2)Cl MCULE-7275116912 [0,0,0,1,0,1|2,0,0]=4 4713 B14R2.4402 CC(=O)C1CC1C2=CC=C(C=C2)F MCULE-3888320308 [0,0,0,1,0,1|2,0,0]=4 4714 B14R2.4402 CC1=CC=C(C=C1)C2CC2C(=O)O MCULE-5478837666 [0,0,0,1,0,1|1,0,0]=3 4715 B14R2.4402 CC1=CC=C(C=C1)C2OC2C(=O)O MCULE-3930695248 [0,0,0,1,0,1|1,0,0]=3 4716 B14R2.4402 CC1=CC=C(C=C1)[C@@H]2C[C@H]2C(=O)O MCULE-9103873740 [0,0,0,1,0,1|1,0,0]=3 4717 B14R2.4402 CC1=CC=C(C=C1)[C@H]2C[C@@H]2C(=O)O MCULE-3312418051 [0,0,0,1,0,1|1,0,0]=3 4718 B14R2.4402 NC(=O)C1CC1C2=CC=C(C=C2)Br MCULE-3185002135 [0,0,0,1,0,1|2,0,0]=4 4719 B14R2.4402 NC(=O)C1CC1C2=CC=C(C=C2)Cl MCULE-6087973115 [0,0,0,1,0,1|2,0,0]=4 4720 B14R2.4402 NC(=O)C1CC1C2=CC=C(C=C2)F MCULE-8998979296 [0,0,0,1,0,1|2,0,0]=4 4721 B14R2.4402 NC1=CC=C(C=C1)[C@@H]2C[C@H]2C(=O)O MCULE-8773254908 [0,0,0,1,0,1|0,0,0]=2 4722 B14R2.4402 O=C(O)C1CC1C2=CC=C(C=C2)Br MCULE-6449774338 [0,0,0,1,0,1|1,0,0]=3 4723 B14R2.4402 O=C(O)C1CC1C2=CC=C(C=C2)Cl MCULE-2373959507 [0,0,0,1,0,1|1,0,0]=3 4724 B14R2.4402 O=C(O)C1CC1C2=CC=C(C=C2)F MCULE-6485779532 [0,0,0,1,0,1|1,0,0]=3 4725 B14R2.4402 O=C(O)C1CC1C2=CC=C(C=C2)O MCULE-1775280332 [0,0,0,1,0,1|1,0,0]=3 4726 B14R2.4402 O=C(O)C1CC1C2=CN=C(C=C2)Br MCULE-8030485803 [0,0,0,1,0,1|2,0,0]=4 4727 B14R2.4402 O=C(O)C1OC1C2=CC=C(C=C2)Br MCULE-4225001597 [0,0,0,1,0,1|1,0,0]=3 4728 B14R2.4402 O=C(O)C1OC1C2=CC=C(C=C2)Cl MCULE-6686127170 [0,0,0,1,0,1|1,0,0]=3 4729 B14R2.4402 O=C(O)C1OC1C2=CC=C(C=C2)F MCULE-3922099734 [0,0,0,1,0,1|1,0,0]=3 4730 B14R2.4402 O=C(O)[C@@H]1C[C@H]1C2=CC=C(C=C2)Br MCULE-2286228969 [0,0,0,1,0,1|1,0,0]=3 4731 B14R2.4402 O=C(O)[C@@H]1C[C@H]1C2=CC=C(C=C2)Br MCULE-9099675007 [0,0,0,1,0,1|1,0,0]=3 4732 B14R2.4402 O=C(O)[C@@H]1C[C@H]1C2=CC=C(C=C2)Cl MCULE-1997210651 [0,0,0,1,0,1|1,0,0]=3 4733 B14R2.4402 O=C(O)[C@@H]1C[C@H]1C2=CC=C(C=C2)Cl MCULE-5798927297 [0,0,0,1,0,1|1,0,0]=3 4734 B14R2.4402 O=C(O)[C@@H]1C[C@H]1C2=CC=C(C=C2)Cl MCULE-9207601985 [0,0,0,1,0,1|1,0,0]=3 4735 B14R2.4402 O=C(O)[C@@H]1C[C@H]1C2=CC=C(C=C2)F MCULE-4968377749 [0,0,0,1,0,1|1,0,0]=3 4736 B14R2.4402 O=C(O)[C@@H]1C[C@H]1C2=CC=C(C=C2)F MCULE-7739400514 [0,0,0,1,0,1|1,0,0]=3 4737 B14R2.4402 O=C(O)[C@@H]1C[C@H]1C2=CC=C(C=C2)F MCULE-9334740390 [0,0,0,1,0,1|1,0,0]=3 4738 B14R2.4402 O=C(O)[C@H]1C[C@@H]1C2=CC=C(C=C2)Br MCULE-4829789877 [0,0,0,1,0,1|1,0,0]=3 4739 B14R2.4402 O=C(O)[C@H]1C[C@@H]1C2=CC=C(C=C2)Cl MCULE-2848575365 [0,0,0,1,0,1|1,0,0]=3 4740 B14R2.4402 O=C(O)[C@H]1C[C@@H]1C2=CC=C(C=C2)Cl MCULE-7325969282 [0,0,0,1,0,1|1,0,0]=3 4741 B14R2.4402 O=C(O)[C@H]1C[C@@H]1C2=CC=C(C=C2)F MCULE-3588874389 [0,0,0,1,0,1|1,0,0]=3 4742 B14R2.4402 O=C(O)[C@H]1C[C@@H]1C2=CC=C(C=C2)F MCULE-8376029588 [0,0,0,1,0,1|1,0,0]=3 4743 B14R2.4402 O=C(O)[C@H]1C[C@@H]1C2=CC=C(C=C2)O MCULE-3254632134 [0,0,0,1,0,1|1,0,0]=3 4744 B14R2.4402 O=C(O)[C@H]1C[C@@H]1C2=CC=C(C=C2)O MCULE-4081465116 [0,0,0,1,0,1|1,0,0]=3 4745 B14R2.4402 O=C(O)[C@H]1C[C@@H]1C2=CC=C(N=C2)Br MCULE-2291540664 [0,0,0,1,0,1|2,0,0]=4 4746 B14R2.4402 O=C(O)[C@H]1C[C@@H]1C2=CN=C(C=C2)Br MCULE-7025539623 [0,0,0,1,0,1|2,0,0]=4 4747 B14R2.4402 [C@@H]1(C[C@@H]1C2=CC=C(C=C2)Br)C(=O)O MCULE-5770487637 [0,0,0,1,0,1|1,0,0]=3 4748 B14R2.4402 [C@H]1(C[C@H]1C2=CC=C(C=C2)O)C(=O)O MCULE-6807862077 [0,0,0,1,0,1|1,0,0]=3 4749 B14R2.5816 CC(=O)N1CCC2=C1C=C(C=C2)Br MCULE-6139493827 [0,0,0,1,0,1|2,0,0]=4 4750 B14R2.5816 CC(=O)N1CCC2=C1C=C(C=C2)Cl MCULE-3734227130 [0,0,0,1,0,1|2,0,0]=4 4751 B14R2.5816 CC(=O)N1CCC2=C1C=C(C=C2)F MCULE-7978918633 [0,0,0,1,0,1|2,0,0]=4 4752 B14R2.5816 CC(=O)N1CCC2=CC=C(C=C12)I MCULE-7550059895 [0,0,0,1,0,1|2,0,0]=4 4753 B14R2.5816 CC(=O)N1CCC2=CC=C(C=C12)N MCULE-1027863461 [0,0,0,1,0,1|1,0,0]=3 4754 B14R2.5816 NC(=O)N1CCC2=C1C=C(C=C2)N MCULE-5065456708 [0,0,0,1,0,1|1,0,0]=3 4755 B14R2.5816 NC1=CC2=C(C=C1)NC=C2C(=O)O MCULE-4652622749 [0,0,0,1,0,1|0,0,2]=4 4756 B14R2.5816 NC1=CC2=C(C=C1)NN=C2C(=O)O MCULE-5005425774 [0,0,0,1,0,1|1,0,1]=4 4757 B14R2.5816 NC1=CC2=C(C=C1)NN=C2C(=O)O MCULE-6689333592 [0,0,0,1,0,1|1,0,1]=4 4758 B14R2.5816 O=C(O)C1CCC2=C1C=C(C=C2)Br MCULE-2686579137 [0,0,0,1,0,1|1,0,0]=3 4759 B14R2.5816 O=C(O)C1CCC2=C1C=C(C=C2)Cl MCULE-7463362563 [0,0,0,1,0,1|1,0,0]=3 4760 B14R2.5816 O=C(O)C1CCC2=C1C=C(C=C2)F MCULE-2853603493 [0,0,0,1,0,1|1,0,0]=3 4761 B14R2.5816 O=C(O)C1CCC2=C1C=C(C=C2)O MCULE-5396303067 [0,0,0,1,0,1|1,0,0]=3 4762 B14R2.5816 O=C(O)C1COC2=C1C=C(C=C2)Br MCULE-8961611452 [0,0,0,1,0,1|1,0,0]=3 4763 B14R2.5816 O=C(O)C1COC2=C1C=C(C=C2)Cl MCULE-6089452456 [0,0,0,1,0,1|1,0,0]=3 4764 B14R2.5816 O=C(O)C1COC2=CC=C(C=C12)F MCULE-5991895811 [0,0,0,1,0,1|1,0,0]=3 4765 B14R2.27 COC1=CC=C(C=C1)C2CC(=O)C2 MCULE-4373786886 [0,1,0,1,0,0|2,0,0]=4 4766 B14R2.27 O=C1CC(C1)C2=CC=C(C=C2)CCl MCULE-6682898952 [0,1,0,1,0,0|2,0,0]=4 4767 B14R2.134 COC1=CC2=C(C=C1)CCC(=O)C2 MCULE-6814451226 [0,1,0,1,0,0|2,0,0]=4 4768 B14R2.134 COC1=CC=C2CCC(=O)NC2=C1 MCULE-3602239046 [0,1,0,1,0,0|2,0,0]=4 4769 B14R2.134 N#CC1=CC2=C(C=C1)CCC(=O)N2 MCULE-3731973227 [0,1,0,1,0,0|1,0,1]=4 4770 B14R2.134 NCC1=CC2=C(C=C1)CCC(=O)N2 MCULE-2251300811 [0,1,0,1,0,0|1,0,0]=3 4771 B14R2.134 NCC1=CC=C2OCC(=O)NC2=C1 MCULE-4526785086 [0,1,0,1,0,0|2,0,0]=4 4772 B14R2.134 NCC1=CC=C2OCC(=O)NC2=C1 MCULE-8600406870 [0,1,0,1,0,0|2,0,0]=4 4773 B14R2.134 O=C1CCC2=C(N1)C=C(C=C2)CO MCULE-3320143695 [0,1,0,1,0,0|2,0,0]=4 4774 B14R2.2496 NCC1=CC=C2CCS(=O)(=O)C2=C1 MCULE-5514491036 [0,1,0,1,0,0|1,0,1]=4 4775 B14R2.4513 CC1=C(C=CC2=C1NC(=O)CC2)Br MCULE-6998564705 [0,1,0,1,0,0|2,0,0]=4 4776 B14R2.4513 CN1C(=O)CCC2=C1C=C(C=C2)Br MCULE-3085380096 [0,1,0,1,0,0|2,0,0]=4 4777 B14R2.4513 CN1C(=O)CCC2=C1C=C(C=C2)F MCULE-7992163115 [0,1,0,1,0,0|2,0,0]=4 4778 B14R2.4513 CN1C(=O)COC2=C1C=C(C=C2)N MCULE-9720776572 [0,1,0,1,0,0|2,0,0]=4 4779 B14R2.4513 CN1C(=O)COC2=CC=C(C=C12)N MCULE-8389632672 [0,1,0,1,0,0|2,0,0]=4 4780 B14R2.4513 CN1C(=O)CSC2=CC=C(C=C12)N MCULE-3793593690 [0,1,0,1,0,0|2,0,0]=4 4781 B14R2.4513 CN1C(=O)NCC2=CC=C(C=C12)N MCULE-4807751868 [0,1,0,1,0,0|2,0,0]=4 4782 B14R2.4513 CN1CCC2=C(C1=O)C=C(C=C2)N MCULE-1172294786 [0,1,0,1,0,0|2,0,0]=4 4783 B14R2.4513 O=C1CCC2=C(C1)C(=C(C=C2)F)F MCULE-4139826449 [0,1,0,1,0,0|2,0,0]=4 4784 B14R2.4513 O=C1CCC2=CC=C(C(=C2N1)Br)F MCULE-6452786425 [0,1,0,1,0,0|2,0,0]=4 4785 B14R2.29365 CC1=C2OCC(=O)NC2=CC(=C1)N MCULE-1563392713 [0,1,0,1,0,0|2,0,0]=4 4786 B14R2.29365 CC1=C2OCC(=O)NC2=CC(=C1)N MCULE-4537668684 [0,1,0,1,0,0|2,0,0]=4 4787 B14R2.29365 CC1=CC(=O)OC2=C1C=CC(=C2)N MCULE-1617391219 [0,1,0,1,0,0|0,0,2]=4 4788 B14R2.29365 CC1CC(=O)OC2=C1C=CC(=C2)O MCULE-6024404425 [0,1,0,1,0,0|1,0,0]=3 4789 B14R2.29365 NC1=CC(=C2OCC(=O)NC2=C1)Cl MCULE-1177050331 [0,1,0,1,0,0|2,0,0]=4 4790 B14R2.29365 NC1=CC(=C2OCC(=O)NC2=C1)Cl MCULE-6262370824 [0,1,0,1,0,0|2,0,0]=4 4791 B14R2.29365 NC1=CC(=C2OCC(=O)NC2=C1)F MCULE-2023143646 [0,1,0,1,0,0|2,0,0]=4 4792 B14R2.29365 NC1=CC(=C2OCC(=O)NC2=C1)F MCULE-9520613028 [0,1,0,1,0,0|2,0,0]=4 4793 B14R2.29365 O=C1CC(=O)C2=CC=C(C=C2O1)F MCULE-1349141286 [0,1,0,1,0,0|1,0,1]=4 4794 B14R2.29365 O=C1CCC2=C(C1)C=C(C=C2Cl)Cl MCULE-9809048835 [0,1,0,1,0,0|2,0,0]=4 4795 B14R2.29365 O=C1CCC2=C(C=C(C=C2C1)Br)Br MCULE-3645795950 [0,1,0,1,0,0|2,0,0]=4 4796 B14R2.29365 O=C1CCC2=C(C=C(C=C2C1)F)F MCULE-4859919376 [0,1,0,1,0,0|2,0,0]=4 4797 B14R2.29365 O=C1CCC2=C(C=C(C=C2N1)Br)Br MCULE-8244719827 [0,1,0,1,0,0|2,0,0]=4 4798 B14R2.29365 O=C1CCC2=C(C=C(C=C2N1)F)Br MCULE-4023344181 [0,1,0,1,0,0|2,0,0]=4 4799 B14R2.29365 O=C1CCC2=C(C=C(C=C2O1)O)O MCULE-9107917367 [0,1,0,1,0,0|1,0,0]=3 4800 B14R2.29365 O=C1CCC2=C(N1)C=C(C=C2F)Br MCULE-1179553816 [0,1,0,1,0,0|2,0,0]=4 4801 B14R2.29365 O=C1COC2=C(O1)C=C(C=C2Br)Br MCULE-5063848433 [0,1,0,1,0,0|2,0,0]=4 4802 B14R2.4529 CC(=O)C1CC2=C(C1)C=C(C=C2)F MCULE-9720155376 [0,1,0,1,0,0|2,0,0]=4 4803 B14R2.4529 CC(=O)N1CC2=C(C1)C=C(C=C2)N MCULE-3351666044 [0,1,0,1,0,0|2,0,0]=4 4804 B14R2.4529 CC1=CC2=C(C=C1)CC(S2)C(=O)O MCULE-4983434982 [0,1,0,1,0,0|1,0,0]=3 4805 B14R2.4529 CC1=CC2=C(C=C1)NC(C2)C(=O)O MCULE-7947693922 [0,1,0,1,0,0|2,0,0]=4 4806 B14R2.4529 CC1=CC2=C(C=C1)NC(C2)C(=O)O MCULE-9020477458 [0,1,0,1,0,0|2,0,0]=4 4807 B14R2.4529 CC1=CC2=C(C=C1)SC(C2)C(=O)O MCULE-6732342331 [0,1,0,1,0,0|2,0,0]=4 4808 B14R2.4529 CC1=CC=C2CC(OC2=C1)C(=O)O MCULE-8483507196 [0,1,0,1,0,0|1,0,0]=3 4809 B14R2.4529 NC1=CC2=C(C=C1)C=C(N2)C(=O)O MCULE-4660368633 [0,1,0,1,0,0|0,0,2]=4 4810 B14R2.4529 NC1=CC2=C(C=C1)NC(=C2)C(=O)O MCULE-5175411843 [0,1,0,1,0,0|1,0,1]=4 4811 B14R2.4529 NC1=CC2=C(C=C1)OC(=C2)C(=O)O MCULE-8615601257 [0,1,0,1,0,0|1,0,1]=4 4812 B14R2.4529 NC1=CC2=C(C=C1)SC(=C2)C(=O)O MCULE-5906324784 [0,1,0,1,0,0|1,0,1]=4 4813 B14R2.4529 NC1=CC=C2C=C(SC2=C1)C(=O)O MCULE-7279247306 [0,1,0,1,0,0|0,0,2]=4 4814 B14R2.4529 NC1=CC=C2CC(NC2=C1)C(=O)O MCULE-2176604106 [0,1,0,1,0,0|0,0,0]=2 4815 B14R2.4529 NC1=CC=C2NC(=NC2=C1)C(=O)O MCULE-4621552067 [0,1,0,1,0,0|1,0,1]=4 4816 B14R2.4529 NC1=CC=C2NC(=NC2=C1)C(=O)O MCULE-5432106577 [0,1,0,1,0,0|1,0,1]=4 4817 B14R2.4529 NC1=CC=C2OC(=NC2=C1)C(=O)O MCULE-1324277435 [0,1,0,1,0,0|1,0,1]=4 4818 B14R2.4529 NC1=CC=C2SC(=CC2=C1)C(=O)O MCULE-4554933261 [0,1,0,1,0,0|1,0,1]=4 4819 B14R2.4529 O=C(O)C1CC2=C(O1)C=CC(=C2)Br MCULE-3511426825 [0,1,0,1,0,0|2,0,0]=4 4820 B14R2.4529 O=C(O)C1CC2=C(O1)C=CC(=C2)Cl MCULE-2604063055 [0,1,0,1,0,0|2,0,0]=4 4821 B14R2.4529 O=C(O)C1CC2=C(O1)C=CC(=C2)F MCULE-8917946645 [0,1,0,1,0,0|2,0,0]=4 4822 B14R2.4529 O=C(O)C1CC2=C(S1)C=C(C=C2)Cl MCULE-2795593466 [0,1,0,1,0,0|1,0,0]=3 4823 B14R2.4529 O=C(O)C1CC2=CC(=CC=C2N1)Cl MCULE-5016436634 [0,1,0,1,0,0|2,0,0]=4 4824 B14R2.4529 O=C(O)C1CC2=CC(=CC=C2N1)F MCULE-3089296217 [0,1,0,1,0,0|2,0,0]=4 4825 B14R2.4529 O=C(O)C1CC2=CC(=CC=C2O1)I MCULE-7925385370 [0,1,0,1,0,0|2,0,0]=4 4826 B14R2.4529 O=C(O)C1CC2=CC(=CC=C2O1)O MCULE-3013096351 [0,1,0,1,0,0|2,0,0]=4 4827 B14R2.4529 O=C(O)C1CC2=CC=C(C=C2C1)Br MCULE-2843651169 [0,1,0,1,0,0|1,0,0]=3 4828 B14R2.4529 O=C(O)C1CC2=CC=C(C=C2C1)F MCULE-3982875810 [0,1,0,1,0,0|1,0,0]=3 4829 B14R2.4529 O=C(O)C1CC2=CC=C(C=C2O1)F MCULE-4764190520 [0,1,0,1,0,0|1,0,0]=3 4830 B14R2.4529 O=C(O)C1CC2=CC=C(C=C2O1)O MCULE-9098976055 [0,1,0,1,0,0|1,0,0]=3 4831 B14R2.4529 O=C(O)C1CC2=CC=C(C=C2S1)F MCULE-5815762143 [0,1,0,1,0,0|1,0,0]=3 4832 B14R2.8239 CC1=CC2=C(C=C1N)NC(=O)CO2 MCULE-2397105534 [0,1,0,1,0,0|2,0,0]=4 4833 B14R2.8239 CC1NC2=C(C=C(C=C2)N)NC1=O MCULE-7872331863 [0,1,0,1,0,0|2,0,0]=4 4834 B14R2.8239 CC1OC2=C(C=C(C=C2)N)NC1=O MCULE-7021924450 [0,1,0,1,0,0|2,0,0]=4 4835 B14R2.8239 CC1OC2=CC=C(C=C2NC1=O)N MCULE-8273035540 [0,1,0,1,0,0|2,0,0]=4 4836 B14R2.8239 CC1SC2=CC=C(C=C2NC1=O)N MCULE-9390143365 [0,1,0,1,0,0|2,0,0]=4 4837 B14R2.8239 CN1CC2=CC=C(C=C2NC1=O)N MCULE-2868426099 [0,1,0,1,0,0|2,0,0]=4 4838 B14R2.8239 CN1CC2=CC=C(C=C2OC1=O)Br MCULE-3211537982 [0,1,0,1,0,0|2,0,0]=4 4839 B14R2.8239 NC1=C(C=C2CCC(=O)NC2=C1)Br MCULE-5680890463 [0,1,0,1,0,0|1,0,0]=3 4840 B14R2.8239 NC1=C(C=C2CCC(=O)NC2=C1)Br MCULE-6722428119 [0,1,0,1,0,0|1,0,0]=3 4841 B14R2.8239 NC1=C(C=C2CCC(=O)NC2=C1)F MCULE-5219762072 [0,1,0,1,0,0|1,0,0]=3 4842 B14R2.8239 NC1=C(C=C2NC(=O)CCC2=C1)F MCULE-5979639674 [0,1,0,1,0,0|2,0,0]=4 4843 B14R2.8239 NC1=C(C=C2NC(=O)CCC2=C1)O MCULE-6649946909 [0,1,0,1,0,0|2,0,0]=4 4844 B14R2.8239 NC1=C(C=C2OCC(=O)NC2=C1)N MCULE-6240473860 [0,1,0,1,0,0|2,0,0]=4 4845 B14R2.8239 NC1=CC2=C(C=C1)CC(C(=O)N2)Cl MCULE-7428727982 [0,1,0,1,0,0|1,0,0]=3 4846 B14R2.8239 NC1CC2=C(C=C(C=C2)Br)NC1=O MCULE-2895737876 [0,1,0,1,0,0|2,0,0]=4 4847 B14R2.8239 NC1CC2=C(C=C(C=C2)Br)NC1=O MCULE-7898313797 [0,1,0,1,0,0|2,0,0]=4 4848 B14R2.8239 NC1CC2=C(C=C(C=C2)Cl)NC1=O MCULE-1754706476 [0,1,0,1,0,0|2,0,0]=4 4849 B14R2.8239 O=C1CCC2=C(C1)C=C(C(=C2)F)Br MCULE-4611192552 [0,1,0,1,0,0|2,0,0]=4 4850 B14R2.8239 O=C1CCC2=C(N1)C=C(C(=C2)Br)Cl MCULE-9532027023 [0,1,0,1,0,0|2,0,0]=4 4851 B14R2.8239 O=C1CCC2=C(N1)C=C(C(=C2)Br)O MCULE-8960614966 [0,1,0,1,0,0|2,0,0]=4 4852 B14R2.8239 O=C1CCC2=C(N1)C=C(C(=C2)I)O MCULE-6061281232 [0,1,0,1,0,0|2,0,0]=4 4853 B14R2.8239 O=C1CCC2=CC(=C(C=C2C1)Cl)Cl MCULE-1838259083 [0,1,0,1,0,0|2,0,0]=4 4854 B14R2.8239 O=C1CCC2=CC(=C(C=C2C1)F)F MCULE-2220806937 [0,1,0,1,0,0|2,0,0]=4 4855 B14R2.8239 O=C1CCC2=CC(=C(C=C2N1)Cl)Cl MCULE-5102085396 [0,1,0,1,0,0|2,0,0]=4 4856 B14R2.8239 O=C1CCC2=CC(=C(C=C2N1)F)Br MCULE-2067344206 [0,1,0,1,0,0|2,0,0]=4 4857 B14R2.9193 O=C1CC(C1)C2=C(C=C(C=C2)Br)F MCULE-8760312581 [0,1,0,1,0,0|2,0,0]=4 4858 B14R2.9193 O=C1CC(C1)C2=C(C=C(C=C2)F)F MCULE-7379938699 [0,1,0,1,0,0|2,0,0]=4 4859 B14R2.5806 NC1=C(C2=C(C=C1)CCS2(=O)=O)Br MCULE-6825490831 [0,1,0,1,0,0|1,0,1]=4 4860 B10R1.16 CC1=CC=C(O1)CCC=O MCULE-6278960480 [1,0,0,0,1,0|2,0,0]=4 4861 B10R1.18 C=C(Br)CC1=CC=CC=C1 MCULE-9592322415 [1,0,0,0,1,0|2,0,0]=4 4862 B10R1.18 C=C(C)CC1=CC=CC=C1 MCULE-8065314565 [1,0,0,0,1,0|2,0,0]=4 4863 B10R1.18 C=C(Cl)CC1=CC=CC=C1 MCULE-3377597261 [1,0,0,0,1,0|2,0,0]=4 4864 B10R1.18 CC(=O)CC1=CC=CC=C1 MCULE-2102027204 [1,0,0,0,1,0|1,0,0]=3 4865 B10R1.18 CC(=O)CC1=CC=CN=C1 MCULE-4376271458 [1,0,0,0,1,0|2,0,0]=4 4866 B10R1.18 CC(=O)CC1=CC=CN=C1 MCULE-6272069358 [1,0,0,0,1,0|2,0,0]=4 4867 B10R1.18 CC(=O)CC1=CC=NC=C1 MCULE-5471990345 [1,0,0,0,1,0|2,0,0]=4 4868 B10R1.18 CC(=O)CC1=CC=NC=C1 MCULE-6085085905 [1,0,0,0,1,0|2,0,0]=4 4869 B10R1.18 CC(=O)CC1=NC=CC=C1 MCULE-6150090454 [1,0,0,0,1,0|2,0,0]=4 4870 B10R1.18 CC(=O)C[N+]1=CC=CC=C1 MCULE-1423922869 [1,0,0,0,1,0|2,0,0]=4 4871 B10R1.18 CC(=O)C[N+]1=CC=CC=C1 MCULE-4109246086 [1,0,0,0,1,0|2,0,0]=4 4872 B10R1.18 CC(=O)C[N+]1=CC=CC=C1 MCULE-7915513624 [1,0,0,0,1,0|2,0,0]=4 4873 B10R1.18 CC(=O)NC1=CC=CC=C1 MCULE-1268638727 [1,0,0,0,1,0|2,0,0]=4 4874 B10R1.18 CC(=O)OC1=CC=CC=C1 MCULE-3760278339 [1,0,0,0,1,0|2,0,0]=4 4875 B10R1.18 CC(=O)OC1=CC=CC=C1 MCULE-9633533770 [1,0,0,0,1,0|2,0,0]=4 4876 B10R1.18 CC(=O)SC1=CC=CC=C1 MCULE-5781494641 [1,0,0,0,1,0|2,0,0]=4 4877 B10R1.18 CC(O)CC1=CC=CC=C1 MCULE-8121299105 [1,0,0,0,1,0|1,0,1]=4 4878 B10R1.18 CS(=O)CC1=CC=CC=C1 MCULE-5549767016 [1,0,0,0,1,0|2,0,0]=4 4879 B10R1.18 C[C@@H](O)CC1=CC=CC=C1 MCULE-5690434931 [1,0,0,0,1,0|1,0,1]=4 4880 B10R1.18 C[C@@H](O)CC1=CC=CC=C1 MCULE-8821166486 [1,0,0,0,1,0|1,0,1]=4 4881 B10R1.18 C[C@H](O)CC1=CC=CC=C1 MCULE-1903929610 [1,0,0,0,1,0|1,0,1]=4 4882 B10R1.18 C[C@H](O)CC1=CC=CC=C1 MCULE-7919501471 [1,0,0,0,1,0|1,0,1]=4 4883 B10R1.18 N=C(N)CC1=CC=CC=C1 MCULE-2811298666 [1,0,0,0,1,0|2,0,0]=4 4884 B10R1.18 N=C(N)CC1=CC=CC=C1 MCULE-3137787244 [1,0,0,0,1,0|2,0,0]=4 4885 B10R1.18 N=C(N)CC1=CC=CC=C1 MCULE-9347338913 [1,0,0,0,1,0|2,0,0]=4 4886 B10R1.18 NC(=O)CC1=CC=CC=C1 MCULE-8226590608 [1,0,0,0,1,0|1,0,0]=3 4887 B10R1.18 NC(=O)CC1=CC=CC=N1 MCULE-4945228013 [1,0,0,0,1,0|2,0,0]=4 4888 B10R1.18 NC(=O)CC1=CC=CN=C1 MCULE-8050501584 [1,0,0,0,1,0|2,0,0]=4 4889 B10R1.18 NC(=O)CC1=CC=NC=C1 MCULE-8398784775 [1,0,0,0,1,0|2,0,0]=4 4890 B10R1.18 NC(=O)C[N+]1=CC=CC=C1 MCULE-9230893232 [1,0,0,0,1,0|2,0,0]=4 4891 B10R1.18 NC(=O)NC1=CC=CC=C1 MCULE-5805888733 [1,0,0,0,1,0|2,0,0]=4 4892 B10R1.18 NC(=O)OC1=CC=CC=C1 MCULE-7641090814 [1,0,0,0,1,0|2,0,0]=4 4893 B10R1.18 NC(=S)CC1=CC=CC=C1 MCULE-5460442793 [1,0,0,0,1,0|1,1,0]=4 4894 B10R1.18 NC(O)CC1=CC=CC=C1 MCULE-5797891184 [1,0,0,0,1,0|1,0,1]=4 4895 B10R1.18 O=C(Cl)CC1=CC=CC=C1 MCULE-9204048837 [1,0,0,0,1,0|1,0,0]=3 4896 B10R1.18 O=C(Cl)CC1=CC=CN=C1 MCULE-2590747143 [1,0,0,0,1,0|2,0,0]=4 4897 B10R1.18 O=C(Cl)CC1=CC=CN=C1 MCULE-9011561830 [1,0,0,0,1,0|2,0,0]=4 4898 B10R1.18 O=C(Cl)CC1=CC=NC=C1 MCULE-2503504370 [1,0,0,0,1,0|2,0,0]=4 4899 B10R1.18 O=C(Cl)CC1=CC=NC=C1 MCULE-3913890613 [1,0,0,0,1,0|2,0,0]=4 4900 B10R1.18 O=C(Cl)NC1=CC=CC=C1 MCULE-6097393916 [1,0,0,0,1,0|2,0,0]=4 4901 B10R1.18 O=C(Cl)OC1=CC=CC=C1 MCULE-6466757200 [1,0,0,0,1,0|2,0,0]=4 4902 B10R1.18 O=C(Cl)SC1=CC=CC=C1 MCULE-1615169698 [1,0,0,0,1,0|2,0,0]=4 4903 B10R1.18 O=C(Cl)[NH2+]C1=CC=CC=C1 MCULE-9302675370 [1,0,0,0,1,0|2,0,0]=4 4904 B10R1.18 O=C(O)CC1=CC=CC=C1 MCULE-6701370784 [1,0,0,0,1,0|0,0,0]=2 4905 B10R1.18 O=C(O)CC1=CC=CN=C1 MCULE-5025740933 [1,0,0,0,1,0|1,0,0]=3 4906 B10R1.18 O=C(O)CC1=CC=NC=C1 MCULE-6196505642 [1,0,0,0,1,0|1,0,0]=3 4907 B10R1.18 O=C(O)CC1=CC=NC=C1 MCULE-6918467554 [1,0,0,0,1,0|1,0,0]=3 4908 B10R1.18 O=C(O)CC1=CC=NN=C1 MCULE-7498559885 [1,0,0,0,1,0|2,0,0]=4 4909 B10R1.18 O=C(O)CC1=CN=CC=C1 MCULE-7568450264 [1,0,0,0,1,0|1,0,0]=3 4910 B10R1.18 O=C(O)CC1=CN=CN=C1 MCULE-5355497283 [1,0,0,0,1,0|2,0,0]=4 4911 B10R1.18 O=C(O)CC1=CN=CN=C1 MCULE-7234097881 [1,0,0,0,1,0|2,0,0]=4 4912 B10R1.18 O=C(O)CC1=NC=CC=C1 MCULE-3223507615 [1,0,0,0,1,0|1,0,0]=3 4913 B10R1.18 O=C(O)CC1=NC=CC=C1 MCULE-6540788884 [1,0,0,0,1,0|1,0,0]=3 4914 B10R1.18 O=C(O)CC1=NC=CC=N1 MCULE-6964698565 [1,0,0,0,1,0|2,0,0]=4 4915 B10R1.18 O=C(O)CC1=NC=CN=C1 MCULE-6028395313 [1,0,0,0,1,0|2,0,0]=4 4916 B10R1.18 O=C(O)CC1=NC=NC=C1 MCULE-5590967773 [1,0,0,0,1,0|2,0,0]=4 4917 B10R1.18 O=C(O)CC1=NN=CC=C1 MCULE-7921775623 [1,0,0,0,1,0|2,0,0]=4 4918 B10R1.18 O=C(O)C[N+]1=CC=CC=C1 MCULE-1872926300 [1,0,0,0,1,0|1,0,0]=3 4919 B10R1.18 O=C(O)C[N+]1=CC=CC=C1 MCULE-2546054544 [1,0,0,0,1,0|1,0,0]=3 4920 B10R1.18 O=C(O)C[N+]1=CC=CC=C1 MCULE-3638787563 [1,0,0,0,1,0|1,0,0]=3 4921 B10R1.18 O=C([O-])CC1=CC=CC=C1 MCULE-1279909315 [1,0,0,0,1,0|0,0,1]=3 4922 B10R1.18 O=C([O-])CC1=CC=CC=C1 MCULE-8694767355 [1,0,0,0,1,0|0,0,1]=3 4923 B10R1.18 O=C([O-])CC1=CC=CC=N1 MCULE-3799853278 [1,0,0,0,1,0|1,0,1]=4 4924 B10R1.18 O=C([O-])CC1=NC=CC=C1 MCULE-3032808165 [1,0,0,0,1,0|1,0,1]=4 4925 B10R1.18 O=C([O-])C[N+]1=CC=CC=C1 MCULE-3384906896 [1,0,0,0,1,0|1,0,1]=4 4926 B10R1.18 O=N(=O)CC1=CC=CC=C1 MCULE-6563703169 [1,0,0,0,1,0|1,0,1]=4 4927 B10R1.18 O=S(O)CC1=CC=CC=C1 MCULE-5212762313 [1,0,0,0,1,0|1,0,0]=3 4928 B10R1.18 O=S([O-])CC1=CC=CC=C1 MCULE-2485703250 [1,0,0,0,1,0|1,0,1]=4 4929 B10R1.18 OB(O)CC1=CC=CC=C1 MCULE-9416724672 [1,0,0,0,1,0|1,0,1]=4 4930 B10R1.66 CC(=O)CCC1=CC=CO1 MCULE-2101099047 [1,0,0,0,1,0|2,0,0]=4 4931 B10R1.66 CC(=O)CCC1=CSC=C1 MCULE-1818012086 [1,0,0,0,1,0|2,0,0]=4 4932 B10R1.66 O=C(Cl)CCC1=CC=CS1 MCULE-7371256050 [1,0,0,0,1,0|2,0,0]=4 4933 B10R1.66 O=C(O)CCC1=CC=CN1 MCULE-8495580718 [1,0,0,0,1,0|1,0,0]=3 4934 B10R1.66 O=C(O)CCC1=CC=CO1 MCULE-3535606082 [1,0,0,0,1,0|1,0,0]=3 4935 B10R1.66 O=C(O)CCC1=CC=CS1 MCULE-3548538547 [1,0,0,0,1,0|1,0,0]=3 4936 B10R1.66 O=C(O)CCC1=CC=NO1 MCULE-2698728972 [1,0,0,0,1,0|2,0,0]=4 4937 B10R1.66 O=C(O)CCC1=CN=CS1 MCULE-2668820713 [1,0,0,0,1,0|2,0,0]=4 4938 B10R1.66 O=C(O)CCC1=CN=CS1 MCULE-7272215073 [1,0,0,0,1,0|2,0,0]=4 4939 B10R1.66 O=C(O)CCC1=CNC=C1 MCULE-9116858435 [1,0,0,0,1,0|1,0,0]=3 4940 B10R1.66 O=C(O)CCC1=CNC=N1 MCULE-3618491840 [1,0,0,0,1,0|2,0,0]=4 4941 B10R1.66 O=C(O)CCC1=CNC=N1 MCULE-8133590347 [1,0,0,0,1,0|2,0,0]=4 4942 B10R1.66 O=C(O)CCC1=CNN=C1 MCULE-1705333891 [1,0,0,0,1,0|2,0,0]=4 4943 B10R1.66 O=C(O)CCC1=CNN=C1 MCULE-4996856052 [1,0,0,0,1,0|2,0,0]=4 4944 B10R1.66 O=C(O)CCC1=COC=C1 MCULE-6225332803 [1,0,0,0,1,0|1,0,0]=3 4945 B10R1.66 O=C(O)CCC1=CON=C1 MCULE-7141916112 [1,0,0,0,1,0|2,0,0]=4 4946 B10R1.66 O=C(O)CCC1=CSC=C1 MCULE-5919306548 [1,0,0,0,1,0|1,0,0]=3 4947 B10R1.66 O=C(O)CCC1=CSC=N1 MCULE-3188158342 [1,0,0,0,1,0|2,0,0]=4 4948 B10R1.66 O=C(O)CCC1=NC=CN1 MCULE-8831721107 [1,0,0,0,1,0|2,0,0]=4 4949 B10R1.66 O=C(O)CCC1=NC=CN1 MCULE-8898977198 [1,0,0,0,1,0|2,0,0]=4 4950 B10R1.66 O=C(O)CCC1=NC=CO1 MCULE-8621379865 [1,0,0,0,1,0|2,0,0]=4 4951 B10R1.66 O=C(O)CCC1=NC=CS1 MCULE-2473180013 [1,0,0,0,1,0|2,0,0]=4 4952 B10R1.66 O=C(O)CCC1=NOC=C1 MCULE-7542127444 [1,0,0,0,1,0|2,0,0]=4 4953 B10R1.66 O=C(O)CCN1C=CC=C1 MCULE-8640172862 [1,0,0,0,1,0|1,0,0]=3 4954 B10R1.66 O=C(O)CCN1C=CC=N1 MCULE-3245420562 [1,0,0,0,1,0|2,0,0]=4 4955 B10R1.66 O=C(O)CCN1C=CC=N1 MCULE-7345461411 [1,0,0,0,1,0|2,0,0]=4 4956 B10R1.66 O=C(O)CCN1C=CN=C1 MCULE-9380136310 [1,0,0,0,1,0|2,0,0]=4 4957 B10R1.66 O=C(O)CCN1C=C[NH+]=C1 MCULE-7376823159 [1,0,0,0,1,0|2,0,0]=4 4958 B10R1.66 O=C(O)CNC1=CSC=C1 MCULE-7792185653 [1,0,0,0,1,0|2,0,0]=4 4959 B10R1.66 O=C(O)COC1=CSC=C1 MCULE-1973135166 [1,0,0,0,1,0|2,0,0]=4 4960 B10R1.66 O=C(O)CSC1=CC=CS1 MCULE-4950567579 [1,0,0,0,1,0|2,0,0]=4 4961 B10R1.13 CC(=O)C1=CC=C(C=C1)Br MCULE-1037313916 [0,0,0,0,2,0|2,0,0]=4 4962 B10R1.13 CC(=O)C1=CC=C(C=C1)C MCULE-5591471266 [0,0,0,0,2,0|2,0,0]=4 4963 B10R1.13 CC(=O)C1=CC=C(C=C1)Cl MCULE-1728385439 [0,0,0,0,2,0|2,0,0]=4 4964 B10R1.13 CC(=O)C1=CC=C(C=C1)F MCULE-5731734533 [0,0,0,0,2,0|2,0,0]=4 4965 B10R1.13 CC(=O)C1=CC=C(C=C1)I MCULE-3852519586 [0,0,0,0,2,0|2,0,0]=4 4966 B10R1.13 CC(=O)C1=CC=C(C=C1)N MCULE-4764145437 [0,0,0,0,2,0|1,0,0]=3 4967 B10R1.13 CC(=O)C1=CC=C(C=C1)N MCULE-6769994880 [0,0,0,0,2,0|1,0,0]=3 4968 B10R1.13 CC(=O)C1=CC=C(C=C1)O MCULE-6065587915 [0,0,0,0,2,0|2,0,0]=4 4969 B10R1.13 CC(=O)C1=CC=C(C=C1)S MCULE-6735923539 [0,0,0,0,2,0|2,0,0]=4 4970 B10R1.13 CC(=O)C1=CC=C(N=C1)N MCULE-1327073980 [0,0,0,0,2,0|2,0,0]=4 4971 B10R1.13 CC(=O)C1=NC=C(C=C1)N MCULE-7876075775 [0,0,0,0,2,0|2,0,0]=4 4972 B10R1.13 CC(O)C1=CC=C(C=C1)N MCULE-4002619592 [0,0,0,0,2,0|1,0,1]=4 4973 B10R1.13 CC1=CC=C(C=C1)C(=O)Cl MCULE-9978317250 [0,0,0,0,2,0|2,0,0]=4 4974 B10R1.13 CC1=CC=C(C=C1)C(=O)N MCULE-7438268859 [0,0,0,0,2,0|2,0,0]=4 4975 B10R1.13 CC1=CC=C(C=C1)C(=O)O MCULE-2497536187 [0,0,0,0,2,0|1,0,0]=3 4976 B10R1.13 CC1=CC=C(C=C1)C(=O)[O-] MCULE-2420193887 [0,0,0,0,2,0|1,0,1]=4 4977 B10R1.13 CC1=CC=C(C=C1)S(=O)O MCULE-1991276884 [0,0,0,0,2,0|2,0,0]=4 4978 B10R1.13 CC1=CC=C(C=N1)C(=O)O MCULE-5464563726 [0,0,0,0,2,0|2,0,0]=4 4979 B10R1.13 CC1=CN=C(C=C1)C(=O)O MCULE-3552865301 [0,0,0,0,2,0|2,0,0]=4 4980 B10R1.13 CC1=CN=C(C=C1)C(=O)O MCULE-9478432207 [0,0,0,0,2,0|2,0,0]=4 4981 B10R1.13 CS(=O)C1=CC=C(C=C1)N MCULE-3065186334 [0,0,0,0,2,0|2,0,0]=4 4982 B10R1.13 C[C@@H](O)C1=CC=C(C=C1)N MCULE-1100503726 [0,0,0,0,2,0|1,0,1]=4 4983 B10R1.13 C[C@H](O)C1=CC=C(C=C1)N MCULE-3889603697 [0,0,0,0,2,0|1,0,1]=4 4984 B10R1.13 C[N+]1=CC=C(C=C1)C(=O)O MCULE-2821947139 [0,0,0,0,2,0|2,0,0]=4 4985 B10R1.13 N=C(N)C1=CC=C(C=C1)N MCULE-2082087373 [0,0,0,0,2,0|2,0,0]=4 4986 B10R1.13 N=C(N)C1=CC=C(C=C1)N MCULE-8670381944 [0,0,0,0,2,0|2,0,0]=4 4987 B10R1.13 NC(=O)C1=CC=C(C=C1)Br MCULE-2481755947 [0,0,0,0,2,0|2,0,0]=4 4988 B10R1.13 NC(=O)C1=CC=C(C=C1)Cl MCULE-1584747431 [0,0,0,0,2,0|2,0,0]=4 4989 B10R1.13 NC(=O)C1=CC=C(C=C1)F MCULE-5735061019 [0,0,0,0,2,0|2,0,0]=4 4990 B10R1.13 NC(=O)C1=CC=C(C=C1)I MCULE-1138775800 [0,0,0,0,2,0|2,0,0]=4 4991 B10R1.13 NC(=O)C1=CC=C(C=C1)N MCULE-3871926059 [0,0,0,0,2,0|1,0,0]=3 4992 B10R1.13 NC(=O)C1=CC=C(C=C1)O MCULE-2259075244 [0,0,0,0,2,0|2,0,0]=4 4993 B10R1.13 NC(=O)C1=CC=C(C=C1)S MCULE-3805881173 [0,0,0,0,2,0|2,0,0]=4 4994 B10R1.13 NC(=O)C1=CC=C(N=C1)N MCULE-4611667997 [0,0,0,0,2,0|2,0,0]=4 4995 B10R1.13 NC(=O)C1=NC=C(C=C1)N MCULE-1536380312 [0,0,0,0,2,0|2,0,0]=4 4996 B10R1.13 NC(=S)C1=CC=C(C=C1)N MCULE-2373377487 [0,0,0,0,2,0|1,1,0]=4 4997 B10R1.13 NC1=CC=C(C=C1)B(O)O MCULE-2550132364 [0,0,0,0,2,0|1,0,1]=4 4998 B10R1.13 NC1=CC=C(C=C1)B(O)O MCULE-5333535892 [0,0,0,0,2,0|1,0,1]=4 4999 B10R1.13 NC1=CC=C(C=C1)C(=O)Cl MCULE-4097655973 [0,0,0,0,2,0|1,0,0]=3 5000 B10R1.13 NC1=CC=C(C=C1)C(=O)O MCULE-1312588393 [0,0,0,0,2,0|0,0,0]=2 5001 B10R1.13 NC1=CC=C(C=C1)C(=O)O MCULE-3535374816 [0,0,0,0,2,0|0,0,0]=2 5002 B10R1.13 NC1=CC=C(C=C1)C(=O)[O-] MCULE-6177914685 [0,0,0,0,2,0|0,0,1]=3 5003 B10R1.13 NC1=CC=C(C=C1)C(=O)[O-] MCULE-9904366802 [0,0,0,0,2,0|0,0,1]=3 5004 B10R1.13 NC1=CC=C(C=C1)N(=O)=O MCULE-4310869465 [0,0,0,0,2,0|1,0,1]=4 5005 B10R1.13 NC1=CC=C(C=C1)N(=O)=O MCULE-6905427394 [0,0,0,0,2,0|1,0,1]=4 5006 B10R1.13 NC1=CC=C(C=C1)S(=O)O MCULE-3653704440 [0,0,0,0,2,0|1,0,0]=3 5007 B10R1.13 NC1=CC=C(C=N1)C(=O)Cl MCULE-1419590685 [0,0,0,0,2,0|2,0,0]=4 5008 B10R1.13 NC1=CN=C(C=C1)C(=O)O MCULE-3661537145 [0,0,0,0,2,0|1,0,0]=3 5009 B10R1.13 NC1=CN=C(C=C1)C(=O)O MCULE-4737233687 [0,0,0,0,2,0|1,0,0]=3 5010 B10R1.13 NC1=CN=C(C=N1)C(=O)O MCULE-3348804227 [0,0,0,0,2,0|2,0,0]=4 5011 B10R1.13 NC1=CN=C(N=C1)C(=O)O MCULE-3657143364 [0,0,0,0,2,0|2,0,0]=4 5012 B10R1.13 NC1=CN=C(N=C1)C(=O)O MCULE-4402256251 [0,0,0,0,2,0|2,0,0]=4 5013 B10R1.13 NC1=NC=C(C=C1)C(=O)O MCULE-7790559176 [0,0,0,0,2,0|1,0,0]=3 5014 B10R1.13 NC1=NC=C(C=C1)C(=O)O MCULE-9531923741 [0,0,0,0,2,0|1,0,0]=3 5015 B10R1.13 NC1=NC=C(C=N1)C(=O)O MCULE-9108053340 [0,0,0,0,2,0|2,0,0]=4 5016 B10R1.13 NC1=NN=C(C=C1)C(=O)O MCULE-8056644881 [0,0,0,0,2,0|2,0,0]=4 5017 B10R1.13 N[N+]1=CC=C(C=C1)C(=O)[O-] MCULE-6973535130 [0,0,0,0,2,0|1,0,1]=4 5018 B10R1.13 O=C(Cl)C1=CC=C(C=C1)Br MCULE-7045913116 [0,0,0,0,2,0|2,0,0]=4 5019 B10R1.13 O=C(Cl)C1=CC=C(C=C1)Cl MCULE-4899598601 [0,0,0,0,2,0|2,0,0]=4 5020 B10R1.13 O=C(Cl)C1=CC=C(C=C1)F MCULE-9744643519 [0,0,0,0,2,0|2,0,0]=4 5021 B10R1.13 O=C(Cl)C1=CC=C(C=C1)I MCULE-6093809747 [0,0,0,0,2,0|2,0,0]=4 5022 B10R1.13 O=C(F)C1=CC=C(C=C1)Br MCULE-2359012741 [0,0,0,0,2,0|2,0,0]=4 5023 B10R1.13 O=C(F)C1=CC=C(C=C1)I MCULE-8353413747 [0,0,0,0,2,0|2,0,0]=4 5024 B10R1.13 O=C(O)C1=CC=C(C=C1)Br MCULE-8812168827 [0,0,0,0,2,0|1,0,0]=3 5025 B10R1.13 O=C(O)C1=CC=C(C=C1)Cl MCULE-2882010588 [0,0,0,0,2,0|1,0,0]=3 5026 B10R1.13 O=C(O)C1=CC=C(C=C1)F MCULE-8450862504 [0,0,0,0,2,0|1,0,0]=3 5027 B10R1.13 O=C(O)C1=CC=C(C=C1)I MCULE-5643610100 [0,0,0,0,2,0|1,0,0]=3 5028 B10R1.13 O=C(O)C1=CC=C(C=C1)O MCULE-1367764897 [0,0,0,0,2,0|1,0,0]=3 5029 B10R1.13 O=C(O)C1=CC=C(C=C1)S MCULE-9342507054 [0,0,0,0,2,0|1,0,0]=3 5030 B10R1.13 O=C(O)C1=CC=C(C=N1)O MCULE-4924797784 [0,0,0,0,2,0|2,0,0]=4 5031 B10R1.13 O=C(O)C1=CC=C(N=C1)Cl MCULE-2921354079 [0,0,0,0,2,0|2,0,0]=4 5032 B10R1.13 O=C(O)C1=CC=C(N=C1)O MCULE-8547168855 [0,0,0,0,2,0|2,0,0]=4 5033 B10R1.13 O=C(O)C1=CC=N(=O)C=C1 MCULE-6664353188 [0,0,0,0,2,0|2,0,0]=4 5034 B10R1.13 O=C(O)C1=CN=C(C=C1)Br MCULE-7251747001 [0,0,0,0,2,0|2,0,0]=4 5035 B10R1.13 O=C(O)C1=CN=C(C=C1)F MCULE-2050221449 [0,0,0,0,2,0|2,0,0]=4 5036 B10R1.13 O=C(O)C1=CN=C(C=C1)I MCULE-7670666785 [0,0,0,0,2,0|2,0,0]=4 5037 B10R1.13 O=C(O)C1=CN=C(C=C1)S MCULE-9782817249 [0,0,0,0,2,0|2,0,0]=4 5038 B10R1.13 O=C(O)C1=NC=C(C=C1)Br MCULE-6501819231 [0,0,0,0,2,0|2,0,0]=4 5039 B10R1.13 O=C(O)C1=NC=C(C=C1)Cl MCULE-8875788252 [0,0,0,0,2,0|2,0,0]=4 5040 B10R1.13 O=C(O)C1=NC=C(C=C1)F MCULE-2128607104 [0,0,0,0,2,0|2,0,0]=4 5041 B10R1.13 O=C(O)C1=NC=C(C=C1)F MCULE-2798554650 [0,0,0,0,2,0|2,0,0]=4 5042 B10R1.13 O=C(O)C1=NC=C(C=C1)I MCULE-1702439933 [0,0,0,0,2,0|2,0,0]=4 5043 B10R1.13 O=C(O)C1=NC=C(C=C1)O MCULE-4623282930 [0,0,0,0,2,0|2,0,0]=4 5044 B10R1.13 O=C([O-])C1=CC=C(C=C1)Cl MCULE-1384581808 [0,0,0,0,2,0|1,0,1]=4 5045 B10R1.13 O=C([O-])C1=CC=C(C=C1)F MCULE-8396535794 [0,0,0,0,2,0|1,0,1]=4 5046 B10R1.13 O=C([O-])C1=CC=C(C=C1)O MCULE-2900979171 [0,0,0,0,2,0|1,0,1]=4 5047 B10R1.13 O=C1C=CC(=CO1)C(=O)O MCULE-9279858523 [0,0,0,0,2,0|2,0,0]=4 5048 B10R1.13 O=S(O)C1=CC=C(C=C1)Br MCULE-7416924047 [0,0,0,0,2,0|2,0,0]=4 5049 B10R1.13 O=S(O)C1=CC=C(C=C1)Cl MCULE-9311769182 [0,0,0,0,2,0|2,0,0]=4 5050 B10R1.13 O=S(O)C1=CC=C(C=C1)F MCULE-3043920742 [0,0,0,0,2,0|2,0,0]=4 5051 B10R1.13 O=[Se](O)C1=CC=C(C=C1)Cl MCULE-3596841204 [0,0,0,0,2,0|2,0,0]=4 5052 B10R1.54 CC1=CC(=CS1)CC(=O)O MCULE-8700180303 [0,0,0,0,2,0|2,0,0]=4 5053 B10R1.54 CC1=CC=C(O1)CC(=O)O MCULE-4642905149 [0,0,0,0,2,0|2,0,0]=4 5054 B10R1.54 CC1=CC=C(S1)CC(=O)O MCULE-6426499804 [0,0,0,0,2,0|2,0,0]=4 5055 B10R1.54 CC1=CSC(=C1)CC(=O)O MCULE-6328016056 [0,0,0,0,2,0|2,0,0]=4 5056 B10R1.54 CN1C=CC(=C1)CC(=O)O MCULE-7960244777 [0,0,0,0,2,0|2,0,0]=4 5057 B10R1.54 NC1=CN(N=C1)CC(=O)O MCULE-4753559059 [0,0,0,0,2,0|2,0,0]=4 5058 B10R1.54 NC1=CN(N=C1)CC(=O)O MCULE-5962884751 [0,0,0,0,2,0|2,0,0]=4 5059 B10R1.54 NC1=CN(N=C1)CC(=O)O MCULE-7761217092 [0,0,0,0,2,0|2,0,0]=4 5060 B10R1.54 NC1=NC(=CS1)CC(=O)O MCULE-6777008327 [0,0,0,0,2,0|2,0,0]=4 5061 B10R1.54 NC1=NC(=CS1)CC(=O)O MCULE-9454800245 [0,0,0,0,2,0|2,0,0]=4 5062 B10R1.54 NC1=NC=C(S1)CC(=O)O MCULE-1412802881 [0,0,0,0,2,0|2,0,0]=4 5063 B10R1.54 NC1=NN(C=C1)CC(=O)O MCULE-2354372151 [0,0,0,0,2,0|2,0,0]=4 5064 B10R1.54 NC1=NN(C=C1)CC(=O)O MCULE-8633925365 [0,0,0,0,2,0|2,0,0]=4 5065 B10R1.54 NC1=NNC(=C1)CC(=O)O MCULE-3869915440 [0,0,0,0,2,0|2,0,0]=4 5066 B10R1.54 O=C(O)CC1=CC(=CS1)Br MCULE-8160824250 [0,0,0,0,2,0|2,0,0]=4 5067 B10R1.54 O=C(O)CC1=CC=C(S1)Br MCULE-3689606723 [0,0,0,0,2,0|2,0,0]=4 5068 B10R1.54 O=C(O)CC1=CC=C(S1)Cl MCULE-3750481360 [0,0,0,0,2,0|2,0,0]=4 5069 B10R1.54 O=C(O)CC1=CC=C(S1)F MCULE-8890895288 [0,0,0,0,2,0|2,0,0]=4 5070 B10R1.54 O=C(O)CC1=CSC(=C1)Br MCULE-2092123395 [0,0,0,0,2,0|2,0,0]=4 5071 B10R1.54 O=C(O)CC1=CSC(=C1)Cl MCULE-5249616412 [0,0,0,0,2,0|2,0,0]=4 5072 B12R1.252 C=C(Br)CCCC1=CC=CC=C1 MCULE-9256726211 [1,0,0,0,0,1|2,0,0]=4 5073 B12R1.252 C=C(Br)CNCC1=CC=CC=C1 MCULE-4898082214 [1,0,0,0,0,1|2,0,0]=4 5074 B12R1.252 C=C(Br)CNCC1=CC=CC=C1 MCULE-7520026962 [1,0,0,0,0,1|2,0,0]=4 5075 B12R1.252 C=C(Br)COCC1=CC=CC=C1 MCULE-7212037038 [1,0,0,0,0,1|2,0,0]=4 5076 B12R1.252 C=C(C)CCCC1=CC=CC=C1 MCULE-1334491812 [1,0,0,0,0,1|2,0,0]=4 5077 B12R1.252 C=C(C)CNCC1=CC=CC=C1 MCULE-5016928491 [1,0,0,0,0,1|2,0,0]=4 5078 B12R1.252 C=C(C)CNCC1=CC=CC=C1 MCULE-9199638747 [1,0,0,0,0,1|2,0,0]=4 5079 B12R1.252 C=C(Cl)CCCC1=CC=CC=C1 MCULE-7115429182 [1,0,0,0,0,1|2,0,0]=4 5080 B12R1.252 CC(=O)CCCC1=CC=CC=C1 MCULE-2310771684 [1,0,0,0,0,1|1,0,0]=3 5081 B12R1.252 CC(=O)CCCC1=CC=CC=N1 MCULE-1269205900 [1,0,0,0,0,1|2,0,0]=4 5082 B12R1.252 CC(=O)CCCC1=CC=CC=N1 MCULE-8865358008 [1,0,0,0,0,1|2,0,0]=4 5083 B12R1.252 CC(=O)CCCC1=CN=CC=C1 MCULE-4927787423 [1,0,0,0,0,1|2,0,0]=4 5084 B12R1.252 CC(=O)CCSC1=CC=CC=C1 MCULE-5300990067 [1,0,0,0,0,1|1,0,0]=3 5085 B12R1.252 CC(=O)CCSC1=CC=CC=N1 MCULE-1216484037 [1,0,0,0,0,1|2,0,0]=4 5086 B12R1.252 CC(=O)COCC1=CC=CC=C1 MCULE-4274476993 [1,0,0,0,0,1|1,0,0]=3 5087 B12R1.252 CC(=O)CSCC1=CC=CC=C1 MCULE-4925526123 [1,0,0,0,0,1|1,0,0]=3 5088 B12R1.252 CC(=O)NCCC1=CC=CC=C1 MCULE-5686427771 [1,0,0,0,0,1|1,0,0]=3 5089 B12R1.252 CC(=O)NCCC1=CC=NC=C1 MCULE-9746342115 [1,0,0,0,0,1|2,0,0]=4 5090 B12R1.252 CC(=O)OCCC1=CC=CC=C1 MCULE-2877884154 [1,0,0,0,0,1|1,0,0]=3 5091 B12R1.252 CC(=O)SCCC1=CC=NC=C1 MCULE-4317238290 [1,0,0,0,0,1|2,0,0]=4 5092 B12R1.252 CC(O)CNCC1=CC=CC=C1 MCULE-1474712042 [1,0,0,0,0,1|1,0,1]=4 5093 B12R1.252 CC(O)COCC1=CC=CC=C1 MCULE-4915425239 [1,0,0,0,0,1|1,0,1]=4 5094 B12R1.252 C[C@@H](O)CNCC1=CC=CC=C1 MCULE-2854453727 [1,0,0,0,0,1|1,0,1]=4 5095 B12R1.252 C[C@@H](O)COCC1=CC=CC=C1 MCULE-3498599598 [1,0,0,0,0,1|1,0,1]=4 5096 B12R1.252 C[C@@H](O)COCC1=CC=CC=C1 MCULE-9422203676 [1,0,0,0,0,1|1,0,1]=4 5097 B12R1.252 C[C@H](O)CNCC1=CC=CC=C1 MCULE-2306437084 [1,0,0,0,0,1|1,0,1]=4 5098 B12R1.252 C[C@H](O)COCC1=CC=CC=C1 MCULE-7109663495 [1,0,0,0,0,1|1,0,1]=4 5099 B12R1.252 C[C@H](O)COCC1=CC=CC=C1 MCULE-7489065076 [1,0,0,0,0,1|1,0,1]=4 5100 B12R1.252 N=C(N)CCCC1=CC=CC=C1 MCULE-1691158103 [1,0,0,0,0,1|2,0,0]=4 5101 B12R1.252 N=C(N)CCCC1=CC=CC=C1 MCULE-8425972210 [1,0,0,0,0,1|2,0,0]=4 5102 B12R1.252 N=C(N)CCOC1=CC=CC=C1 MCULE-7113358614 [1,0,0,0,0,1|2,0,0]=4 5103 B12R1.252 N=C(N)CCOC1=CC=CC=C1 MCULE-9435429546 [1,0,0,0,0,1|2,0,0]=4 5104 B12R1.252 N=C(N)NCCC1=CC=CC=C1 MCULE-5787654277 [1,0,0,0,0,1|2,0,0]=4 5105 B12R1.252 N=C(N)NCCC1=CC=CC=C1 MCULE-6600118628 [1,0,0,0,0,1|2,0,0]=4 5106 B12R1.252 N=C(N)NCCC1=CC=CC=C1 MCULE-7862388098 [1,0,0,0,0,1|2,0,0]=4 5107 B12R1.252 N=C(N)NCCC1=CC=CC=C1 MCULE-8733349393 [1,0,0,0,0,1|2,0,0]=4 5108 B12R1.252 N=C(N)SCCC1=CC=CC=C1 MCULE-4854423587 [1,0,0,0,0,1|2,0,0]=4 5109 B12R1.252 N=C(N)SCCC1=CC=CC=C1 MCULE-7222961686 [1,0,0,0,0,1|2,0,0]=4 5110 B12R1.252 N=C(N)SCCC1=CC=CC=C1 MCULE-9094071409 [1,0,0,0,0,1|2,0,0]=4 5111 B12R1.252 NC(=O)CCCC1=CC=CC=C1 MCULE-1491500210 [1,0,0,0,0,1|1,0,0]=3 5112 B12R1.252 NC(=O)CCNC1=CC=CC=C1 MCULE-4122162754 [1,0,0,0,0,1|1,0,0]=3 5113 B12R1.252 NC(=O)CCOC1=CC=CC=C1 MCULE-9532260813 [1,0,0,0,0,1|1,0,0]=3 5114 B12R1.252 NC(=O)CNCC1=CC=CC=C1 MCULE-6930976713 [1,0,0,0,0,1|1,0,0]=3 5115 B12R1.252 NC(=O)COCC1=CC=CC=C1 MCULE-2043276412 [1,0,0,0,0,1|1,0,0]=3 5116 B12R1.252 NC(=O)CSCC1=CC=CC=C1 MCULE-6240151575 [1,0,0,0,0,1|1,0,0]=3 5117 B12R1.252 NC(=O)NCCC1=CC=CC=C1 MCULE-2812694735 [1,0,0,0,0,1|1,0,0]=3 5118 B12R1.252 NC(=O)NCCC1=NC=CC=C1 MCULE-1115159286 [1,0,0,0,0,1|2,0,0]=4 5119 B12R1.252 NC(=O)NOCC1=CC=CC=C1 MCULE-4552434209 [1,0,0,0,0,1|2,0,0]=4 5120 B12R1.252 NC(=S)CCCC1=CC=CC=C1 MCULE-1468346906 [1,0,0,0,0,1|1,1,0]=4 5121 B12R1.252 NC(=S)COCC1=CC=CC=C1 MCULE-6057888442 [1,0,0,0,0,1|1,1,0]=4 5122 B12R1.252 NC(=S)NCCC1=CC=CC=C1 MCULE-2932414196 [1,0,0,0,0,1|1,1,0]=4 5123 B12R1.252 O=C(Cl)CCCC1=CC=CC=C1 MCULE-6473558795 [1,0,0,0,0,1|1,0,0]=3 5124 B12R1.252 O=C(Cl)CCOC1=CC=CC=C1 MCULE-5733419248 [1,0,0,0,0,1|1,0,0]=3 5125 B12R1.252 O=C(Cl)COCC1=CC=CC=C1 MCULE-5801667907 [1,0,0,0,0,1|1,0,0]=3 5126 B12R1.252 O=C(Cl)OCCC1=CC=CC=C1 MCULE-3585566884 [1,0,0,0,0,1|1,0,0]=3 5127 B12R1.252 O=C(O)C/C=C/C1=CC=CC=C1 MCULE-5944027373 [1,0,0,0,0,1|0,0,1]=3 5128 B12R1.252 O=C(O)C=CCC1=CC=CC=C1 MCULE-5534408884 [1,0,0,0,0,1|0,0,1]=3 5129 B12R1.252 O=C(O)C=CSC1=CC=CC=C1 MCULE-6409148074 [1,0,0,0,0,1|0,0,2]=4 5130 B12R1.252 O=C(O)CC#CC1=CC=CC=C1 MCULE-2602661708 [1,0,0,0,0,1|0,0,1]=3 5131 B12R1.252 O=C(O)CC=CC1=CC=CC=C1 MCULE-4504838602 [1,0,0,0,0,1|0,0,1]=3 5132 B12R1.252 O=C(O)CCCC1=CC=CC=C1 MCULE-6322732346 [1,0,0,0,0,1|0,0,0]=2 5133 B12R1.252 O=C(O)CCCC1=CC=CC=N1 MCULE-8215039373 [1,0,0,0,0,1|1,0,0]=3 5134 B12R1.252 O=C(O)CCCC1=CC=CN=C1 MCULE-6410810610 [1,0,0,0,0,1|1,0,0]=3 5135 B12R1.252 O=C(O)CCCC1=CC=NC=C1 MCULE-4546370034 [1,0,0,0,0,1|1,0,0]=3 5136 B12R1.252 O=C(O)CCCC1=CC=NC=C1 MCULE-8739058216 [1,0,0,0,0,1|1,0,0]=3 5137 B12R1.252 O=C(O)CCCC1=CCC=CC1 MCULE-7532829438 [1,0,0,0,0,1|0,0,2]=4 5138 B12R1.252 O=C(O)CCCC1=CN=CC=C1 MCULE-7663521567 [1,0,0,0,0,1|1,0,0]=3 5139 B12R1.252 O=C(O)CCCC1=NC=CC=C1 MCULE-7143898162 [1,0,0,0,0,1|1,0,0]=3 5140 B12R1.252 O=C(O)CCCC1=NC=CN=C1 MCULE-2539718357 [1,0,0,0,0,1|2,0,0]=4 5141 B12R1.252 O=C(O)CCNC1=CC=CC=C1 MCULE-3569266068 [1,0,0,0,0,1|0,0,0]=2 5142 B12R1.252 O=C(O)CCNC1=NC=CC=C1 MCULE-4522939150 [1,0,0,0,0,1|1,0,0]=3 5143 B12R1.252 O=C(O)CCNC1=NC=CC=C1 MCULE-9700879062 [1,0,0,0,0,1|1,0,0]=3 5144 B12R1.252 O=C(O)CCNC1=NC=CC=N1 MCULE-4241796415 [1,0,0,0,0,1|2,0,0]=4 5145 B12R1.252 O=C(O)CCOC1=CC=CC=C1 MCULE-4275468983 [1,0,0,0,0,1|0,0,0]=2 5146 B12R1.252 O=C(O)CCOC1=CN=CC=C1 MCULE-1674086947 [1,0,0,0,0,1|1,0,0]=3 5147 B12R1.252 O=C(O)CCSC1=CC=CC=C1 MCULE-5630558008 [1,0,0,0,0,1|0,0,0]=2 5148 B12R1.252 O=C(O)CCSC1=NC=CC=C1 MCULE-5537797131 [1,0,0,0,0,1|1,0,0]=3 5149 B12R1.252 O=C(O)CCSC1=NC=CC=N1 MCULE-9070638246 [1,0,0,0,0,1|2,0,0]=4 5150 B12R1.252 O=C(O)CC[Te]C1=CC=CC=C1 MCULE-5107484134 [1,0,0,0,0,1|0,0,0]=2 5151 B12R1.252 O=C(O)CNCC1=CC=CC=C1 MCULE-6444716880 [1,0,0,0,0,1|0,0,0]=2 5152 B12R1.252 O=C(O)CNCC1=CC=CC=C1 MCULE-9697304880 [1,0,0,0,0,1|0,0,0]=2 5153 B12R1.252 O=C(O)CNCC1=CC=NC=C1 MCULE-8366348691 [1,0,0,0,0,1|1,0,0]=3 5154 B12R1.252 O=C(O)CNCC1=CC=NC=C1 MCULE-9179755168 [1,0,0,0,0,1|1,0,0]=3 5155 B12R1.252 O=C(O)CNCC1=CN=CC=C1 MCULE-1177119055 [1,0,0,0,0,1|1,0,0]=3 5156 B12R1.252 O=C(O)CNCC1=CN=CC=C1 MCULE-1301219082 [1,0,0,0,0,1|1,0,0]=3 5157 B12R1.252 O=C(O)CNCC1=NC=CC=C1 MCULE-1384516500 [1,0,0,0,0,1|1,0,0]=3 5158 B12R1.252 O=C(O)CNCC1=NC=CC=C1 MCULE-7028735277 [1,0,0,0,0,1|1,0,0]=3 5159 B12R1.252 O=C(O)CNCC1=NC=CN=C1 MCULE-1740822854 [1,0,0,0,0,1|2,0,0]=4 5160 B12R1.252 O=C(O)COCC1=CC=CC=C1 MCULE-7716016814 [1,0,0,0,0,1|0,0,0]=2 5161 B12R1.252 O=C(O)COCC1=CC=NC=C1 MCULE-1365429527 [1,0,0,0,0,1|1,0,0]=3 5162 B12R1.252 O=C(O)COCC1=CN=CC=C1 MCULE-8341575448 [1,0,0,0,0,1|1,0,0]=3 5163 B12R1.252 O=C(O)COCC1=NC=CC=C1 MCULE-2623120562 [1,0,0,0,0,1|1,0,0]=3 5164 B12R1.252 O=C(O)COCC1=NC=CC=C1 MCULE-9421727381 [1,0,0,0,0,1|1,0,0]=3 5165 B12R1.252 O=C(O)CSCC1=CC=CC=C1 MCULE-4184308941 [1,0,0,0,0,1|0,0,0]=2 5166 B12R1.252 O=C(O)CSCC1=CC=NC=C1 MCULE-1014408883 [1,0,0,0,0,1|1,0,0]=3 5167 B12R1.252 O=C(O)CSCC1=CN=CC=C1 MCULE-9319249639 [1,0,0,0,0,1|1,0,0]=3 5168 B12R1.252 O=C(O)CSCC1=NC=CC=C1 MCULE-7368438673 [1,0,0,0,0,1|1,0,0]=3 5169 B12R1.252 O=C([O-])CCCC1=CC=CC=C1 MCULE-5819625540 [1,0,0,0,0,1|0,0,1]=3 5170 B12R1.252 O=N(=O)CCCC1=CC=CC=C1 MCULE-2770204782 [1,0,0,0,0,1|1,0,1]=4 5171 B12R1.252 OB(O)CCCC1=CC=CC=C1 MCULE-2154603458 [1,0,0,0,0,1|1,0,1]=4 5172 B14R1.677 CC(=O)NCCOC1=CC=C(C=C1)Br MCULE-3169500402 [0,0,0,0,0,2|2,0,0]=4 5173 B14R1.677 CC(=O)NCCOC1=CC=C(C=C1)C MCULE-8209376709 [0,0,0,0,0,2|2,0,0]=4 5174 B14R1.677 CC(=O)NCCOC1=CC=C(C=C1)Cl MCULE-1749676706 [0,0,0,0,0,2|2,0,0]=4 5175 B14R1.677 CC(=O)NCCOC1=CC=C(C=C1)F MCULE-6206607257 [0,0,0,0,0,2|2,0,0]=4 5176 B14R1.677 CC(=O)NCCOC1=CC=C(C=C1)I MCULE-3276318476 [0,0,0,0,0,2|2,0,0]=4 5177 B14R1.677 CC(=O)NCCOC1=CC=C(C=C1)N MCULE-5218074043 [0,0,0,0,0,2|1,0,0]=3 5178 B14R1.677 CC(=O)NCCOC1=CC=C(C=C1)O MCULE-3577686789 [0,0,0,0,0,2|2,0,0]=4 5179 B14R1.677 CC(=O)NCCSC1=CC=C(C=C1)C MCULE-6525930917 [0,0,0,0,0,2|2,0,0]=4 5180 B14R1.677 CC(=O)NCCSC1=CC=C(C=C1)O MCULE-5123776945 [0,0,0,0,0,2|2,0,0]=4 5181 B14R1.677 CC(=O)OCCCC1=CC=C(C=C1)Br MCULE-4213069880 [0,0,0,0,0,2|2,0,0]=4 5182 B14R1.677 CC(=O)OCCOC1=CC=C(C=C1)Br MCULE-2977338590 [0,0,0,0,0,2|2,0,0]=4 5183 B14R1.677 CC(=O)OCCOC1=CC=C(C=C1)C MCULE-7148823377 [0,0,0,0,0,2|2,0,0]=4 5184 B14R1.677 CC1=CC=C(C=C1)CCCCC(=O)O MCULE-5505798835 [0,0,0,0,0,2|1,0,0]=3 5185 B14R1.677 CC1=CC=C(C=C1)CNCCC(=O)O MCULE-1316015865 [0,0,0,0,0,2|1,0,0]=3 5186 B14R1.677 CC1=CC=C(C=C1)CNCCC(=O)O MCULE-5304575155 [0,0,0,0,0,2|1,0,0]=3 5187 B14R1.677 CC1=CC=C(C=C1)CSCCC(=O)O MCULE-8229705274 [0,0,0,0,0,2|1,0,0]=3 5188 B14R1.677 CC1=CC=C(C=C1)OCC=CC(=O)O MCULE-7168820377 [0,0,0,0,0,2|1,0,1]=4 5189 B14R1.677 CC1=CC=C(C=C1)OCCCC(=O)O MCULE-8122841775 [0,0,0,0,0,2|1,0,0]=3 5190 B14R1.677 CC1=CC=C(C=C1)OCCNC(=O)N MCULE-3141307594 [0,0,0,0,0,2|2,0,0]=4 5191 B14R1.677 CC1=CC=C(C=C1)OCCOC(=O)N MCULE-1148102898 [0,0,0,0,0,2|2,0,0]=4 5192 B14R1.677 CC1=CC=C(C=C1)SCCCC(=O)O MCULE-4445079115 [0,0,0,0,0,2|1,0,0]=3 5193 B14R1.677 CC1=CC=[N+](C=C1)CCCCC(=O)O MCULE-9342064513 [0,0,0,0,0,2|2,0,0]=4 5194 B14R1.677 CC1=CC=[N+](C=C1)CCCCC(=O)O MCULE-9482368994 [0,0,0,0,0,2|2,0,0]=4 5195 B14R1.677 CC1=NC=C(C=C1)CCSCC(=O)O MCULE-9047444105 [0,0,0,0,0,2|2,0,0]=4 5196 B14R1.677 NC(=O)CCCOC1=CC=C(C=C1)Br MCULE-9160217513 [0,0,0,0,0,2|2,0,0]=4 5197 B14R1.677 NC(=O)CCCOC1=CC=C(C=C1)Cl MCULE-5950344991 [0,0,0,0,0,2|2,0,0]=4 5198 B14R1.677 NC(=O)CCCSC1=CC=C(C=C1)Cl MCULE-7549690841 [0,0,0,0,0,2|2,0,0]=4 5199 B14R1.677 NC1=CC=C(C=C1)NCCCC(=O)O MCULE-5341934171 [0,0,0,0,0,2|0,0,0]=2 5200 B14R1.677 NC1=CC=C(C=C1)OCCCC(=O)O MCULE-8032917013 [0,0,0,0,0,2|0,0,0]=2 5201 B14R1.677 O=C(Cl)CCCCC1=CC=C(C=C1)F MCULE-9015949146 [0,0,0,0,0,2|2,0,0]=4 5202 B14R1.677 O=C(Cl)CCCSC1=CC=C(C=C1)Cl MCULE-6367995821 [0,0,0,0,0,2|2,0,0]=4 5203 B14R1.677 O=C(O)C=CCOC1=CC=C(C=C1)Br MCULE-3793045591 [0,0,0,0,0,2|1,0,1]=4 5204 B14R1.677 O=C(O)C=CCOC1=CC=C(C=C1)Cl MCULE-3116182454 [0,0,0,0,0,2|1,0,1]=4 5205 B14R1.677 O=C(O)C=CCOC1=CC=C(C=C1)F MCULE-8385510714 [0,0,0,0,0,2|1,0,1]=4 5206 B14R1.677 O=C(O)CCC=CC1=CC=C(C=C1)F MCULE-9450681882 [0,0,0,0,0,2|1,0,0]=3 5207 B14R1.677 O=C(O)CCCCC1=CC=C(C=C1)Br MCULE-5795538347 [0,0,0,0,0,2|1,0,0]=3 5208 B14R1.677 O=C(O)CCCCC1=CC=C(C=C1)Cl MCULE-7732755765 [0,0,0,0,0,2|1,0,0]=3 5209 B14R1.677 O=C(O)CCCCC1=CC=C(C=C1)F MCULE-7597451454 [0,0,0,0,0,2|1,0,0]=3 5210 B14R1.677 O=C(O)CCCCC1=CC=C(C=C1)I MCULE-8575617498 [0,0,0,0,0,2|1,0,0]=3 5211 B14R1.677 O=C(O)CCCCC1=CC=C(C=C1)O MCULE-5009178631 [0,0,0,0,0,2|1,0,0]=3 5212 B14R1.677 O=C(O)CCCOC1=CC=C(C=C1)Br MCULE-9161164297 [0,0,0,0,0,2|1,0,0]=3 5213 B14R1.677 O=C(O)CCCOC1=CC=C(C=C1)Cl MCULE-9657014918 [0,0,0,0,0,2|1,0,0]=3 5214 B14R1.677 O=C(O)CCCOC1=CC=C(C=C1)F MCULE-5070746749 [0,0,0,0,0,2|1,0,0]=3 5215 B14R1.677 O=C(O)CCCOC1=CC=C(C=C1)I MCULE-4714998652 [0,0,0,0,0,2|1,0,0]=3 5216 B14R1.677 O=C(O)CCCSC1=CC=C(C=C1)Br MCULE-4980660863 [0,0,0,0,0,2|1,0,0]=3 5217 B14R1.677 O=C(O)CCCSC1=CC=C(C=C1)Cl MCULE-4942310930 [0,0,0,0,0,2|1,0,0]=3 5218 B14R1.677 O=C(O)CCCSC1=CC=C(C=C1)F MCULE-2643085919 [0,0,0,0,0,2|1,0,0]=3 5219 B14R1.677 O=C(O)CCNCC1=CC=C(C=C1)Br MCULE-8298038100 [0,0,0,0,0,2|1,0,0]=3 5220 B14R1.677 O=C(O)CCNCC1=CC=C(C=C1)Br MCULE-8784753607 [0,0,0,0,0,2|1,0,0]=3 5221 B14R1.677 O=C(O)CCNCC1=CC=C(C=C1)Cl MCULE-1115726045 [0,0,0,0,0,2|1,0,0]=3 5222 B14R1.677 O=C(O)CCNCC1=CC=C(C=C1)Cl MCULE-7266492418 [0,0,0,0,0,2|1,0,0]=3 5223 B14R1.677 O=C(O)CCNCC1=CC=C(C=C1)F MCULE-3024010035 [0,0,0,0,0,2|1,0,0]=3 5224 B14R1.677 O=C(O)CCNCC1=CC=C(C=C1)F MCULE-8067575966 [0,0,0,0,0,2|1,0,0]=3 5225 B14R1.677 O=C(O)CCSCC1=CC=C(C=C1)Br MCULE-6476373786 [0,0,0,0,0,2|1,0,0]=3 5226 B14R1.677 O=C(O)CCSCC1=CC=C(C=C1)Cl MCULE-4688157536 [0,0,0,0,0,2|1,0,0]=3 5227 B14R1.677 O=C(O)CCSCC1=CC=C(C=C1)F MCULE-3109167340 [0,0,0,0,0,2|1,0,0]=3 5228 B14R1.677 O=C(O)COCCC1=CC=C(C=C1)Br MCULE-7526368784 [0,0,0,0,0,2|1,0,0]=3 5229 B14R1.677 O=C(O)CON=CC1=CC=C(C=C1)Br MCULE-3853429466 [0,0,0,0,0,2|1,0,1]=4