0 B12R1.21 CC(=O)CSC1=CC=C(Cl)C=C1 FD-09B-003 [0,0,0,0,0,0|3,0,0]=3 1 B12R1.21 CC(=O)\C=C\C1=CC=C(Br)C=C1 ACI-01232 [0,0,0,0,0,0|2,0,2]=4 2 B12R1.21 CC1=CC=C(OCC(=N)N)C=C1 ACI-05110 [0,0,0,0,0,0|3,0,0]=3 3 B12R1.21 CC1=CC=C(\C=C\C(=O)O)C=C1 ACI-05910 [0,0,0,0,0,0|2,0,2]=4 4 B12R1.21 N=C(N)COC1=CC=C(Br)C=C1 ACI-05156 [0,0,0,0,0,0|3,0,0]=3 5 B12R1.21 N=C(N)COC1=CC=C(Cl)C=C1 ACI-05103 [0,0,0,0,0,0|3,0,0]=3 6 B12R1.21 N=C(N)COC1=CC=C(F)C=C1 ACI-05149 [0,0,0,0,0,0|3,0,0]=3 7 B12R1.21 N=C(N)SCC1=CC=C(Br)C=C1 WS-05C-004 [0,0,0,0,0,0|3,0,0]=3 8 B12R1.21 O=C(O)\C=C\C1=CC=C(Br)C=C1 ACI-05916 [0,0,0,0,0,0|2,0,2]=4 9 B12R1.21 O=C(O)\C=C\C1=CC=C(Cl)C=C1 ACI-05909 [0,0,0,0,0,0|2,0,2]=4 10 B12R1.21 O=C(O)\C=C\C1=CC=C(F)C=C1 ACI-05915 [0,0,0,0,0,0|2,0,2]=4 11 B11R1.91 CC(=O)COC1=CC=CC=C1 ACI-01577 [1,0,0,0,0,0|2,0,0]=3 12 B11R1.91 N=C(N)COC1=CC=CC=C1 ACI-05139 [1,0,0,0,0,0|2,0,0]=3 13 B11R1.91 N=C(N)NCC1=CC=CC=C1 ACI-01687 [1,0,0,0,0,0|2,0,0]=3 14 B11R1.91 NC(N)=NCC1=CC=CC=C1 ACI-00071 [1,0,0,0,0,0|2,0,0]=3 15 B11R1.91 O=C(O)COC1=CC=C[NH+]=C1 WS-05B-008 [1,0,0,0,0,0|3,0,0]=4 16 B13R1.3 COC1=CC=C(OCC(=N)N)C=C1 ACI-05121 [0,1,0,0,0,0|2,0,0]=3 17 B13R1.14 CC1=CC=C(OC\C(N)=N\O)C=C1 ACI-05111 [0,1,0,0,0,0|2,0,1]=4 18 B13R1.14 COC(=O)CCC1=CC=C(O)C=C1 ACI-05249 [0,1,0,0,0,0|1,0,0]=2 19 B13R1.14 COC(=O)COC1=CC=C(O)C=C1 JM-14I-001 [0,1,0,0,0,0|2,0,0]=3 20 B13R1.14 N\C(COC1=CC=C(Br)C=C1)=N/O ACI-05157 [0,1,0,0,0,0|2,0,1]=4 21 B13R1.14 N\C(COC1=CC=C(Cl)C=C1)=N/O ACI-05102 [0,1,0,0,0,0|2,0,1]=4 22 B13R1.14 N\C(COC1=CC=C(F)C=C1)=N/O ACI-05148 [0,1,0,0,0,0|2,0,1]=4 23 B13R1.132 NC(CC(=O)O)C1=CC=C(Cl)N=C1 ACI-01418 [0,1,0,0,0,0|3,0,0]=4 24 B13R1.164 O=C(O)CCC1=CC=C(O)C=C1F ACI-03934 [0,1,0,0,0,0|1,0,0]=2 25 B13R1.164 O=C(O)\C=C\C1=CC=C(O)C=C1F ACI-03933 [0,1,0,0,0,0|1,0,2]=4 26 B13R1.511 N=C(N)SCC1=CC(Cl)=C(Cl)C=C1 ACI-00309 [0,1,0,0,0,0|3,0,0]=4 27 B13R2.155 NC1=CC=C2C=CC(=O)NC2=C1 FD-11C-001 [0,0,0,1,0,0|1,0,2]=4 28 B13R2.155 O=C1CCC2=C(C=C(F)C=C2)N1 ACI-06358 [0,0,0,1,0,0|1,0,0]=2 29 B13R2.155 O=C1COC2=CC=C(O)C=C2N1 JM-08B-002 [0,0,0,1,0,0|1,0,0]=2 30 B13R2.3791 NC1=CC=C2CCS(=O)(=O)C2=C1 ACI-05778 [0,0,0,1,0,0|3,0,0]=4 31 B11R1.20 CC1=CC=C(CC(=N)N)C=C1 ACI-01697 [0,0,0,0,1,0|2,0,0]=3 32 B11R1.20 N=C(N)CC1=CC=C(Cl)C=C1 ACI-01700 [0,0,0,0,1,0|2,0,0]=3 33 B11R1.20 N=C(N)CC1=CC=C(F)C=C1 ACI-01698 [0,0,0,0,1,0|2,0,0]=3 34 B11R1.20 NC(=O)CC1=CC=C(F)C=C1 RH-08K-004 [0,0,0,0,1,0|1,0,0]=2 35 B11R1.20 NC(=S)CC1=CC=C(Br)C=C1 ACI-NI-00199 [0,0,0,0,1,0|1,1,0]=3 36 B11R1.20 NC(N)=NC1=CC=C(Cl)C=C1 ACI-00070 [0,0,0,0,1,0|3,0,0]=4 37 B11R1.20 O=C(Cl)CC1=CC=C(Br)C=C1 ACI-05800 [0,0,0,0,1,0|2,0,0]=3 38 B13R1.513 O=C(O)CCOC1=CC=C(F)C=C1 ACI-04356 [0,0,0,0,0,1|2,0,0]=3 39 B13R1.513 O=C(O)COCC1=CC=C(Br)C=C1 FD-11A-001 [0,0,0,0,0,1|2,0,0]=3 40 B10R1.17 O=CNCC1=NC=CC=C1 ACI-01373 [2,0,0,0,0,0|2,0,0]=4 41 B12R1.71 C=CCNC1=CC=C(OC)C=C1 ACI-02168 [1,1,0,0,0,0|2,0,0]=4 42 B12R1.27 N\C(COC1=CC=CC=C1)=N/O FD-11E-002 [1,1,0,0,0,0|1,0,1]=4 43 B12R1.43 O=C(O)C(=O)CC1=CC=CC=C1 SB-10B-011 [1,1,0,0,0,0|1,0,1]=4 44 B12R1.107 NC(CC(=O)O)C1=CC=CC=C1 ACI-01063 [1,1,0,0,0,0|1,0,0]=3 45 B12R1.107 NC(CC(=O)O)C1=CC=CN=C1 ACI-01419 [1,1,0,0,0,0|2,0,0]=4 46 B12R1.125 CC1=C(CSC(=N)N)C=CC=C1 WS-05G-009 [1,1,0,0,0,0|2,0,0]=4 47 B12R1.125 CC1=C(OCC(=N)N)C=CC=C1 ACI-05104 [1,1,0,0,0,0|2,0,0]=4 48 B12R1.125 N=C(/N)COC1=CC=CC=C1Cl ACI-05097 [1,1,0,0,0,0|2,0,0]=4 49 B12R1.125 N=C(N)COC1=C(Br)C=CC=C1 ACI-05150 [1,1,0,0,0,0|2,0,0]=4 50 B12R1.125 N=C(N)COC1=C(F)C=CC=C1 ACI-05143 [1,1,0,0,0,0|2,0,0]=4 51 B12R1.226 CC1=CC=CC(OCC(=N)N)=C1 ACI-05109 [1,1,0,0,0,0|2,0,0]=4 52 B12R1.226 N=C(/N)COC1=CC=CC(Cl)=C1 ACI-05098 [1,1,0,0,0,0|2,0,0]=4 53 B12R1.226 N=C(N)COC1=CC(Br)=CC=C1 ACI-05155 [1,1,0,0,0,0|2,0,0]=4 54 B12R1.226 N=C(N)COC1=CC(F)=CC=C1 ACI-05144 [1,1,0,0,0,0|2,0,0]=4 55 B12R1.226 O=C(O)COC1=CC(F)=CC=C1 ACI-01604 [1,1,0,0,0,0|2,0,0]=4 56 B12R1.4 COC1=CC=C(CC(C)=O)C=C1 ACI-05058 [0,1,0,0,1,0|1,0,0]=3 57 B12R1.4 COC1=CC=C(NC(=N)N)C=C1 ACI-04703 [0,1,0,0,1,0|2,0,0]=4 58 B12R1.4 N#CC1=CC=C(CC(=O)O)C=C1 ACI-02273 [0,1,0,0,1,0|2,0,0]=4 59 B12R1.106 NS(=O)(=O)CC1=CC=C(Br)C=C1 ACI-04535 [0,1,0,0,1,0|2,0,0]=4 60 B12R1.106 NS(=O)(=O)CC1=CC=C(F)C=C1 ACI-04530 [0,1,0,0,1,0|2,0,0]=4 61 B12R1.233 CC(=O)CC1=C(C)C=C(Cl)C=C1 ACI-05056 [0,1,0,0,1,0|2,0,0]=4 62 B12R1.233 O=C(Cl)CC1=C(F)C=C(F)C=C1 ACI-05792 [0,1,0,0,1,0|2,0,0]=4 63 B12R1.233 O=C(Cl)CC1=CC=C(Cl)C=C1Cl ACI-05796 [0,1,0,0,1,0|2,0,0]=4 64 B14R1.5 COC1=CC=C(OC\C(N)=N\O)C=C1 ACI-05120 [0,2,0,0,0,0|1,0,1]=4 65 B12R2.24 OC1=CC=C2OCCNC2=C1 JM-08B-001 [1,0,0,1,0,0|1,0,1]=4 66 B12R2.132 NC1=CC=C2CCC(=O)C2=C1 ACI-01589 [1,0,0,1,0,0|1,0,0]=3 67 B12R2.132 NC1=CC=C2COC(=O)C2=C1 RH-05C-010 [1,0,0,1,0,0|2,0,0]=4 68 B12R2.606 NC1=NC2=C(C=C(O)C=C2)S1 ACI-00489 [0,0,0,1,1,0|1,1,0]=4 69 B14R2.4513 CN1C(=O)CCC2=C1C=C(F)C=C2 ACI-06359 [0,1,0,1,0,0|1,0,0]=3 70 B14R2.8239 NC1=CC=C2CC(Cl)C(=O)NC2=C1 ACI-NI-00704 [0,1,0,1,0,0|1,0,0]=3 71 B10R1.18 N=C(N)NC1=CC=CC=C1 ACI-04704 [1,0,0,0,1,0|2,0,0]=4 72 B10R1.18 NC(=S)CC1=CC=CC=C1 SB-02C-001 [1,0,0,0,1,0|0,1,0]=3 73 B10R1.18 NC(N)=NC1=CC=CC=C1 ACI-00069 [1,0,0,0,1,0|2,0,0]=4 74 B10R1.13 CC1=CC=C(C(=N)N)C=C1 ACI-00494 [0,0,0,0,2,0|2,0,0]=4 75 B10R1.13 CC1=CC=C(C(N)=O)C=N1 ACI-NI-00764 [0,0,0,0,2,0|2,0,0]=4 76 B10R1.13 N=C(N)C1=CC=C(Br)C=C1 ACI-NI-00221 [0,0,0,0,2,0|2,0,0]=4 77 B10R1.13 N=C(N)C1=CC=C(Cl)C=C1 ACI-01689 [0,0,0,0,2,0|2,0,0]=4 78 B10R1.13 N=C(N)C1=CC=C(F)C=C1 ACI-NI-00230 [0,0,0,0,2,0|2,0,0]=4 79 B10R1.13 NC(=O)C1=CC=C(Cl)N=C1 ACI-05362 [0,0,0,0,2,0|2,0,0]=4 80 B10R1.13 NC(=O)C1=CC=C(F)C=C1 ACI-05410 [0,0,0,0,2,0|1,0,0]=3 81 B10R1.13 NC(=O)C1=CC=C(F)N=C1 ACI-05369 [0,0,0,0,2,0|2,0,0]=4 82 B10R1.13 NC(=O)C1=NC=C(Br)C=C1 ACI-05390 [0,0,0,0,2,0|2,0,0]=4 83 B10R1.13 NC(=O)C1=NC=C(F)C=C1 ACI-05447 [0,0,0,0,2,0|2,0,0]=4 84 B10R1.13 NC(=S)C1=CC=C(Br)C=C1 ACI-NI-00222 [0,0,0,0,2,0|1,1,0]=4 85 B10R1.13 NC(=S)C1=CC=C(F)C=C1 ACI-NI-00231 [0,0,0,0,2,0|1,1,0]=4 86 B10R1.13 NC(=S)C1=CN=C(O)C=C1 SB-16B-002 [0,0,0,0,2,0|1,1,0]=4