0 B12R1.16 CCOC(=N)C1=CC=C(Br)C=C1 ACI-01058 [0,0,0,0,0,0|2,0,0]=2 1 B12R1.16 CCOC(=N)C1=CC=C(F)C=C1 ACI-01059 [0,0,0,0,0,0|2,0,0]=2 2 B12R1.16 CCOC(=O)C1=CC=C(Cl)N=C1 ACI-00479 [0,0,0,0,0,0|2,0,0]=2 3 B12R1.16 CCOC(=O)C1=CC=C(Cl)N=N1 JL-11I-002 [0,0,0,0,0,0|3,0,0]=3 4 B12R1.16 CCOC(=O)C1=CC=C(N)C=N1 ACI-03797 [0,0,0,0,0,0|1,0,0]=1 5 B12R1.16 CCOC(=O)C1=CC=C(N)N=C1 RH-05K-012 [0,0,0,0,0,0|1,0,0]=1 6 B12R1.16 CCOC(=O)C1=CC=C(O)N=N1 JL-11I-003 [0,0,0,0,0,0|3,0,0]=3 7 B12R1.16 CCOC(=O)C1=CN=C(Cl)N=C1 ACI-NI-00399 [0,0,0,0,0,0|3,0,0]=3 8 B12R1.16 CCOC(=O)C1=CNC(=O)N=C1 ACI-01214 [0,0,0,0,0,0|3,0,0]=3 9 B12R1.16 N#CCC(=O)C1=CC=C(Br)C=C1 ACI-01091 [0,0,0,0,0,0|3,0,1]=4 10 B12R1.16 N#CCC(=O)C1=CC=C(F)C=C1 ACI-00486 [0,0,0,0,0,0|3,0,1]=4 11 B11R1.1 CC1=CC=C(\C=C\CO)C=C1 ACI-05923 [1,0,0,0,0,0|3,0,0]=4 12 B11R1.1 OC\C=C\C1=CC=C(Br)C=C1 ACI-05929 [1,0,0,0,0,0|3,0,0]=4 13 B11R1.1 OC\C=C\C1=CC=C(Cl)C=C1 ACI-05922 [1,0,0,0,0,0|3,0,0]=4 14 B11R1.1 OC\C=C\C1=CC=C(F)C=C1 ACI-05928 [1,0,0,0,0,0|3,0,0]=4 15 B11R1.22 COC(=N)C1=CC=C(C)C=C1 ACI-01594 [1,0,0,0,0,0|2,0,0]=3 16 B11R1.22 COC(=O)C1=CC=C(C)N=C1 ACI-01120 [1,0,0,0,0,0|2,0,0]=3 17 B11R1.22 COC(=O)C1=CC=C(Cl)C=N1 ACI-04825 [1,0,0,0,0,0|2,0,0]=3 18 B11R1.22 COC(=O)C1=CC=C(N)N=C1 SB-07E-003 [1,0,0,0,0,0|1,0,0]=2 19 B11R1.22 COC(=O)C1=NC=C(O)C=C1 JM-05D-002 [1,0,0,0,0,0|2,0,0]=3 20 B11R1.22 NNC(=O)C1=CC=C(Br)C=C1 ACI-01724 [1,0,0,0,0,0|3,0,0]=4 21 B11R1.22 O=C(CBr)C1=CC=C(F)C=C1 ACI-00490 [1,0,0,0,0,0|2,0,0]=3 22 B13R1.452 CCOC(=O)C1=CC=C(CBr)N=C1 ACI-01004 [0,1,0,0,0,0|2,0,0]=3 23 B13R1.452 CCOC(=O)C1=CC=C(CO)N=C1 ACI-01005 [0,1,0,0,0,0|2,0,0]=3 24 B13R1.466 CCOC(=N)C1=CC(F)=C(F)C=C1 ACI-01056 [0,1,0,0,0,0|2,0,0]=3 25 B13R1.466 CCOC(=O)C1=CC(Br)=C(Cl)C=C1 ACI-01747 [0,1,0,0,0,0|1,0,0]=2 26 B13R1.466 CCOC(=O)C1=CC(Cl)=C(Br)C=C1 ACI-01751 [0,1,0,0,0,0|1,0,0]=2 27 B13R1.466 CCOC(=O)C1=CC(Cl)=C(N)C=C1 ACI-04607 [0,1,0,0,0,0|0,0,0]=1 28 B13R1.466 CCOC(=O)C1=CNC(=O)C(I)=C1 ACI-05327 [0,1,0,0,0,0|2,0,0]=3 29 B13R1.1511 CCOC(=O)C1=C(Cl)C=C(Cl)N=C1 ACI-01833 [0,1,0,0,0,0|2,0,0]=3 30 B13R1.1511 CCOC(=O)C1=C(F)C=C(F)C=C1 ACI-01741 [0,1,0,0,0,0|1,0,0]=2 31 B13R1.1511 CCOC(=O)C1=C(N)C=C(Cl)N=C1 FD-10K-004 [0,1,0,0,0,0|2,0,0]=3 32 B13R1.1511 CCOC(=O)C1=CC=C(Br)C=C1Cl ACI-01734 [0,1,0,0,0,0|1,0,0]=2 33 B13R1.1511 CCOC(=O)C1=CC=C(C)C=C1Br ACI-01766 [0,1,0,0,0,0|1,0,0]=2 34 B13R1.1511 CCOC(=O)C1=CN=C(Cl)N=C1C ACI-01346 [0,1,0,0,0,0|3,0,0]=4 35 B13R1.1511 CCOC(=O)C1=CN=C(O)C=C1O ACI-04958 [0,1,0,0,0,0|2,0,0]=3 36 B13R1.1511 CCOC(=O)C1=CN=C(O)N=C1C ACI-01034 [0,1,0,0,0,0|3,0,0]=4 37 B13R1.1511 CCOC(=O)C1=CN=C([O-])N=C1C SB-09A-002 [0,1,0,0,0,0|3,0,0]=4 38 B13R2.12 NC1=CC=C(C2=CN=CO2)C=C1 ACI-01365 [0,0,0,1,0,0|2,0,1]=4 39 B13R2.12 NC1=CC=C(C2=NCCO2)C=C1 ACI-06423 [0,0,0,1,0,0|1,0,0]=2 40 B13R2.12 OC1=CC=C(C2=NCCS2)C=C1 ACI-00316 [0,0,0,1,0,0|2,1,0]=4 41 B11R1.15 CCOC(=O)C1=CC(C)=NN1 ACI-00406 [0,0,0,0,1,0|3,0,0]=4 42 B11R1.15 CCOC(=O)C1=CC(C)=NO1 RH-06C-003 [0,0,0,0,1,0|3,0,0]=4 43 B11R1.15 CCOC(=O)C1=CN=C(N)S1 ACI-00690 [0,0,0,0,1,0|2,0,0]=3 44 B11R1.15 CCOC(=O)C1=CN=C(N)S1 ACI-00691 [0,0,0,0,1,0|2,0,0]=3 45 B11R1.15 CCOC(=O)C1=CNC(C)=N1 ACI-04662 [0,0,0,0,1,0|3,0,0]=4 46 B11R1.15 CCOC(=O)C1=CNC(S)=N1 ACI-00362 [0,0,0,0,1,0|3,0,0]=4 47 B11R1.15 CCOC(=O)C1=COC(N)=N1 ACI-01361 [0,0,0,0,1,0|2,0,0]=3 48 B11R1.15 CCOC(=O)C1=CSC(Br)=N1 ACI-01288 [0,0,0,0,1,0|3,0,0]=4 49 B11R1.15 CCOC(=O)C1=CSC(C)=N1 ACI-NI-00046 [0,0,0,0,1,0|3,0,0]=4 50 B11R1.15 CCOC(=O)C1=CSC(N)=N1 ACI-00576 [0,0,0,0,1,0|2,0,0]=3 51 B11R1.15 CCOC(=O)C1=CSC(N)=N1 ACI-00973 [0,0,0,0,1,0|2,0,0]=3 52 B11R1.15 CCOC(=O)C1=NN=C(N)O1 ACI-02712 [0,0,0,0,1,0|3,0,0]=4 53 B11R1.15 CCOC(=O)C1=NNC(O)=C1 SB-04E-002 [0,0,0,0,1,0|3,0,0]=4 54 B11R1.15 CCOC(=O)C1=NOC(C)=C1 ACI-NI-00049 [0,0,0,0,1,0|3,0,0]=4 55 B10R1.15 COC(=N)C1=CC=CC=C1 ACI-15283 [2,0,0,0,0,0|1,0,0]=3 56 B10R1.15 NNC(=O)C1=CC=CC=C1 ACI-01630 [2,0,0,0,0,0|2,0,0]=4 57 B10R1.15 O=C(CBr)C1=CC=CN=C1 ACI-NI-00021 [2,0,0,0,0,0|2,0,0]=4 58 B10R1.15 O=C(CBr)C1=CC=NC=C1 ACI-NI-00022 [2,0,0,0,0,0|2,0,0]=4 59 B10R1.15 O=C(CBr)C1=NC=CC=C1 ACI-NI-00023 [2,0,0,0,0,0|2,0,0]=4 60 B10R1.15 O=C(NO)C1=CC=CC=C1 ACI-01576 [2,0,0,0,0,0|2,0,0]=4 61 B10R1.13 CC(=O)C1=CC=C(Cl)N=C1 ACI-NI-00400 [2,0,0,0,0,0|2,0,0]=4 62 B10R1.13 CC1=CN=C(C(=O)O)C=C1 RH-05J-001 [2,0,0,0,0,0|2,0,0]=4 63 B10R1.13 NC(=O)C1=CC=C(F)C=C1 ACI-05410 [2,0,0,0,0,0|2,0,0]=4 64 B10R1.13 O=C(O)C1=CC=C(I)N=C1 ACI-05589 [2,0,0,0,0,0|2,0,0]=4 65 B10R1.13 O=C(O)C1=CN=C(F)C=C1 ACI-00439 [2,0,0,0,0,0|2,0,0]=4 66 B10R1.13 O=C(O)C1=NC=C(Br)C=C1 ACI-01682 [2,0,0,0,0,0|2,0,0]=4 67 B12R0.8 CCOC(=O)\C(C#N)=C(C)/C=C/N ACI-01638 [0,1,1,0,0,0|1,0,1]=4 68 B12R1.17 CCOC(=N)C1=CC(Br)=CC=C1 SB-10F-002 [1,1,0,0,0,0|1,0,0]=3 69 B12R1.17 CCOC(=N)C1=CC(Cl)=CC=C1 ACI-01057 [1,1,0,0,0,0|1,0,0]=3 70 B12R1.17 CCOC(=O)C1=CC(Br)=CN=C1 ACI-02048 [1,1,0,0,0,0|1,0,0]=3 71 B12R1.17 CCOC(=O)C1=CC(N)=CN=C1 ACI-00473 [1,1,0,0,0,0|1,0,0]=3 72 B12R1.17 CCOC(=O)C1=CC=CC(N)=N1 ACI-04970 [1,1,0,0,0,0|1,0,0]=3 73 B12R1.17 CCOC(=O)C1=CN=NC(Cl)=C1 ACI-04741 [1,1,0,0,0,0|2,0,0]=4 74 B12R1.17 CCOC(=O)C1=NC(Br)=CC=C1 ACI-01380 [1,1,0,0,0,0|1,0,0]=3 75 B12R1.308 CCOC(=O)C1=C(Cl)N=CN=C1 ACI-02683 [1,1,0,0,0,0|2,0,0]=4 76 B12R1.308 CCOC(=O)C1=CC=CN=C1Cl ACI-01386 [1,1,0,0,0,0|1,0,0]=3 77 B12R1.308 CCOC(=O)C1=CC=CN=C1N ACI-04974 [1,1,0,0,0,0|1,0,0]=3 78 B12R1.308 CCOC(=O)C1=NC=CN=C1Cl ACI-00519 [1,1,0,0,0,0|2,0,0]=4 79 B12R1.5 COC(=O)C1=CC=C(C=O)C=C1 SB-05K-003 [1,1,0,0,0,0|1,0,0]=3 80 B12R1.5 COC(=O)C1=CC=C(CBr)N=C1 ACI-00476 [1,1,0,0,0,0|2,0,0]=4 81 B12R1.5 COC(=O)C1=CC=C(CN)C=C1 ACI-05864 [1,1,0,0,0,0|0,0,0]=2 82 B12R1.5 COC(=O)C1=CN=C(CO)C=C1 RH-06F-002 [1,1,0,0,0,0|2,0,0]=4 83 B12R1.5 N#CC1=CC=C(C(=O)CBr)C=C1 ACI-00325 [1,1,0,0,0,0|1,0,1]=4 84 B12R1.20 CC(Br)C(=O)C1=CC=C(Br)C=C1 ACI-04028 [1,1,0,0,0,0|1,0,0]=3 85 B12R1.20 CC(Br)C(=O)C1=CC=C(Cl)C=C1 ACI-04024 [1,1,0,0,0,0|1,0,0]=3 86 B12R1.20 CC(Br)C(=O)C1=CC=C(F)C=C1 ACI-04023 [1,1,0,0,0,0|1,0,0]=3 87 B12R1.367 CC1=C(Cl)C=CC(C(=O)CBr)=C1 JL-10G-002 [1,1,0,0,0,0|2,0,0]=4 88 B12R1.367 CC1=CC(C(=O)CBr)=CC=C1F SB-07D-001 [1,1,0,0,0,0|2,0,0]=4 89 B12R1.367 COC(=O)C1=CC(Br)=C(O)N=C1 ACI-00135 [1,1,0,0,0,0|2,0,0]=4 90 B12R1.367 COC(=O)C1=CC(Cl)=C(Br)C=C1 RH-14B-002 [1,1,0,0,0,0|1,0,0]=3 91 B12R1.367 COC(=O)C1=CC(Cl)=C(Cl)N=C1 RH-12K-001 [1,1,0,0,0,0|2,0,0]=4 92 B12R1.367 COC(=O)C1=CC(I)=C(N)C=C1 ACI-01781 [1,1,0,0,0,0|0,0,0]=2 93 B12R1.367 COC(=O)C1=CC=C(N)C(O)=C1 ACI-05637 [1,1,0,0,0,0|0,0,0]=2 94 B12R1.367 COC(=O)C1=CC=C(O)C(N)=C1 ACI-03869 [1,1,0,0,0,0|1,0,0]=3 95 B12R1.367 COC(=O)C1=CN=C(F)C(Cl)=C1 RH-12B-001 [1,1,0,0,0,0|2,0,0]=4 96 B12R1.367 COC(=O)C1=CN=C(O)C(I)=C1 ACI-05549 [1,1,0,0,0,0|2,0,0]=4 97 B12R1.367 O=C(CBr)C1=CC=C(Cl)C(Cl)=C1 ACI-01710 [1,1,0,0,0,0|2,0,0]=4 98 B12R1.1703 COC(=O)C1=C(Br)C=C(F)C=C1 RH-15H-001 [1,1,0,0,0,0|1,0,0]=3 99 B12R1.1703 COC(=O)C1=C(Cl)C=C(Cl)C=N1 ACI-04831 [1,1,0,0,0,0|2,0,0]=4 100 B12R1.1703 COC(=O)C1=C(F)C=C(F)C=N1 ACI-04828 [1,1,0,0,0,0|2,0,0]=4 101 B12R1.1703 COC(=O)C1=C(O)C=C(Cl)C=C1 SB-12E-001 [1,1,0,0,0,0|1,0,0]=3 102 B12R1.1703 COC(=O)C1=CC=C(Br)C=C1F SB-05B-001 [1,1,0,0,0,0|1,0,0]=3 103 B12R1.1703 COC(=O)C1=CC=C(Br)C=C1O ACI-05682 [1,1,0,0,0,0|1,0,0]=3 104 B12R1.1703 COC(=O)C1=CC=C(C)C=C1O ACI-05673 [1,1,0,0,0,0|1,0,0]=3 105 B12R1.1703 COC(=O)C1=CC=C(C)N=C1Cl ACI-00873 [1,1,0,0,0,0|2,0,0]=4 106 B12R1.1703 COC(=O)C1=CC=C(F)C=C1O ACI-05670 [1,1,0,0,0,0|1,0,0]=3 107 B12R1.1703 COC(=O)C1=CC=C(F)N=C1F ACI-00472 [1,1,0,0,0,0|2,0,0]=4 108 B12R1.1703 COC(=O)C1=CC=C(O)C=C1O ACI-05671 [1,1,0,0,0,0|1,0,0]=3 109 B12R1.312 CCOC(=O)C1=CSC(CC)=C1 JL-14K-006 [0,1,0,0,1,0|2,0,0]=4 110 B12R1.313 CCOC(=O)C1=C(C)N=C(N)O1 WS-05I-029 [0,1,0,0,1,0|2,0,0]=4 111 B12R1.313 CCOC(=O)C1=C(C)N=C(N)S1 ACI-00311 [0,1,0,0,1,0|2,0,0]=4 112 B12R1.313 CCOC(=O)C1=C(C)N=C(N)S1 ACI-00972 [0,1,0,0,1,0|2,0,0]=4 113 B12R1.1579 CCOC(=O)C1=CNC(Br)=C1C ACI-05840 [0,1,0,0,1,0|2,0,0]=4 114 B14R1.683 CC(C)(C)OC(=O)C1=CC=C(F)N=C1 ACI-03840 [0,2,0,0,0,0|2,0,0]=4 115 B14R1.683 CC(C)(C)OC(=O)C1=NC=C(F)C=C1 ACI-03848 [0,2,0,0,0,0|2,0,0]=4 116 B14R1.7265 CCOC(=O)C1=CN=C(O)C(C)=C1O ACI-04379 [0,2,0,0,0,0|2,0,0]=4 117 B14R1.18811 CCOC(=O)C1=C(O)C=C(C)N=C1O SB-07F-001 [0,2,0,0,0,0|2,0,0]=4 118 B12R2.1081 S=C1NCCC2=CC=CC=C12 FD-10F-003 [1,0,0,1,0,0|1,1,0]=4 119 B12R2.2028 CC1CC(=O)C2=CC=CC=C21 JM-04K-002 [1,0,0,1,0,0|1,0,0]=3 120 B10R1.11 CCOC(=N)C1=CC=CS1 ACI-00584 [1,0,0,0,1,0|2,0,0]=4 121 B10R1.11 CCOC(=O)C1=CC=CN1 ACI-00655 [1,0,0,0,1,0|1,0,0]=3 122 B10R1.11 CCOC(=O)C1=CC=NN1 WS-04J-001 [1,0,0,0,1,0|2,0,0]=4 123 B10R1.11 CCOC(=O)C1=CN=CS1 ACI-00692 [1,0,0,0,1,0|2,0,0]=4 124 B10R1.14 COC(=O)C1=CC(Br)=CN1 ACI-00657 [1,0,0,0,1,0|2,0,0]=4 125 B10R1.14 COC(=O)C1=CC=C(Br)S1 ACI-02359 [1,0,0,0,1,0|2,0,0]=4 126 B10R1.14 COC(=O)C1=CNC(Br)=C1 ACI-05836 [1,0,0,0,1,0|2,0,0]=4 127 B14R1.502 CCOC(=O)\C=C\C1=CC=C(Br)C=C1 ACI-05903 [0,0,0,0,0,2|1,0,0]=3 128 B14R1.502 CCOC(=O)\C=C\C1=CC=C(C)C=C1 ACI-05897 [0,0,0,0,0,2|1,0,0]=3 129 B14R1.502 CCOC(=O)\C=C\C1=CC=C(Cl)C=C1 ACI-05896 [0,0,0,0,0,2|1,0,0]=3 130 B14R1.502 CCOC(=O)\C=C\C1=CC=C(F)C=C1 ACI-05902 [0,0,0,0,0,2|1,0,0]=3