0 B10R1.1 O\N=C\C1=CC=C(Cl)C=C1 FD-09D-001 [0,0,0,0,0,0|3,0,1]=4 1 B9R1.1 COC1=CC=[N+]([O-])C=C1 WS-03E-001 [1,0,0,0,0,0|2,0,1]=4 2 B9R1.1 ClCC1=CC=C(Cl)C=N1 ACI-04823 [1,0,0,0,0,0|3,0,0]=4 3 B9R1.1 ClCC1=CC=C(Cl)C=N1 JM-011C-001 [1,0,0,0,0,0|3,0,0]=4 4 B9R1.1 ClCC1=CN=C(Cl)C=C1 ACI-01442 [1,0,0,0,0,0|3,0,0]=4 5 B9R1.1 FC1=CC=C(CS)C=C1 ACI-01597 [1,0,0,0,0,0|2,0,0]=3 6 B9R1.1 NCC1=CC=C(Cl)N=C1 ACI-01399 [1,0,0,0,0,0|2,0,0]=3 7 B9R1.1 NCC1=NC=C(Cl)C=N1 ACI-02636 [1,0,0,0,0,0|3,0,0]=4 8 B9R1.1 NNC1=CC=C(F)N=C1 ACI-04198 [1,0,0,0,0,0|3,0,0]=4 9 B9R1.1 NNC1=CC=C(I)C=C1 ACI-00329 [1,0,0,0,0,0|2,0,0]=3 10 B9R1.1 OCC1=CC=C(Cl)C=N1 ACI-04824 [1,0,0,0,0,0|3,0,0]=4 11 B9R1.1 OCC1=CN=C(Cl)C=C1 ACI-00428 [1,0,0,0,0,0|3,0,0]=4 12 B9R1.8 NOCC1=CC=CC=C1 ACI-01578 [1,0,0,0,0,0|1,0,0]=2 13 B9R1.8 O=CNC1=CC=CC=C1 ACI-01582 [1,0,0,0,0,0|2,0,1]=4 14 B11R1.1 CC1=CC=C(OCC#N)C=C1 ACI-05112 [0,1,0,0,0,0|1,0,2]=4 15 B11R1.1 CC1=CC=C(\C=C\CO)C=C1 ACI-05923 [0,1,0,0,0,0|2,0,1]=4 16 B11R1.1 FC1=CC=C(CN=C=S)C=C1 JL-10F-002 [0,1,0,0,0,0|2,0,1]=4 17 B11R1.1 N#CCOC1=CC=C(Br)C=C1 ACI-05158 [0,1,0,0,0,0|1,0,2]=4 18 B11R1.1 N#CCOC1=CC=C(Cl)C=C1 ACI-05101 [0,1,0,0,0,0|1,0,2]=4 19 B11R1.1 N#CCOC1=CC=C(F)C=C1 ACI-05147 [0,1,0,0,0,0|1,0,2]=4 20 B11R1.1 OC\C=C\C1=CC=C(Br)C=C1 ACI-05929 [0,1,0,0,0,0|2,0,1]=4 21 B11R1.1 OC\C=C\C1=CC=C(Cl)C=C1 ACI-05922 [0,1,0,0,0,0|2,0,1]=4 22 B11R1.1 OC\C=C\C1=CC=C(F)C=C1 ACI-05928 [0,1,0,0,0,0|2,0,1]=4 23 B11R1.20 CC1=CC=C(CC(=N)N)C=C1 ACI-01697 [0,1,0,0,0,0|1,0,1]=3 24 B11R1.20 N=C(N)CC1=CC=C(Cl)C=C1 ACI-01700 [0,1,0,0,0,0|1,0,1]=3 25 B11R1.20 N=C(N)CC1=CC=C(F)C=C1 ACI-01698 [0,1,0,0,0,0|1,0,1]=3 26 B11R1.20 NC(=O)CC1=CC=C(F)C=C1 RH-08K-004 [0,1,0,0,0,0|1,0,1]=3 27 B11R1.20 NC(=S)CC1=CC=C(Br)C=C1 ACI-NI-00199 [0,1,0,0,0,0|1,0,1]=3 28 B11R1.20 NC(N)=NC1=CC=C(Cl)C=C1 ACI-00070 [0,1,0,0,0,0|2,0,1]=4 29 B11R1.20 O=C(Cl)CC1=CC=C(Br)C=C1 ACI-05800 [0,1,0,0,0,0|2,0,1]=4 30 B11R1.22 NNC(=O)C1=CC=C(Br)C=C1 ACI-01724 [0,1,0,0,0,0|2,0,1]=4 31 B11R1.22 O=C(CBr)C1=CC=C(F)C=C1 ACI-00490 [0,1,0,0,0,0|2,0,1]=4 32 B11R1.83 CNCC1=CC=C(OC)C=C1 WS-05I-015 [0,1,0,0,0,0|2,0,0]=3 33 B11R1.83 COC1=CC=C(\C=N\O)C=C1 ACI-01782 [0,1,0,0,0,0|2,0,1]=4 34 B11R2.36 OC1=CC2=C(C=C1)OC=C2 ACI-05787 [0,0,0,1,0,0|2,0,1]=4 35 B8R1.2 ClCC1=NC=CC=C1 ACI-00989 [2,0,0,0,0,0|2,0,0]=4 36 B8R1.2 NNC1=CC=CN=C1 ACI-04199 [2,0,0,0,0,0|2,0,0]=4 37 B8R1.3 CC1=CN=C(Br)C=C1 ACI-01445 [2,0,0,0,0,0|2,0,0]=4 38 B8R1.3 CC1=CN=C(F)C=C1 ACI-00442 [2,0,0,0,0,0|2,0,0]=4 39 B8R1.3 NC1=NC=C(I)C=C1 ACI-00985 [2,0,0,0,0,0|2,0,0]=4 40 B10R1.3 C#CC1=CC=C(CO)C=C1 ACI-05708 [1,1,0,0,0,0|0,0,2]=4 41 B10R1.3 O=CC1=CC=C(CBr)C=C1 ACI-02372 [1,1,0,0,0,0|1,0,1]=4 42 B10R1.3 OCC1=CC=C(CCl)C=C1 ACI-03865 [1,1,0,0,0,0|1,0,0]=3 43 B10R1.13 CC(C)C1=CC=[N+]([O-])C=C1 ACI-05159 [1,1,0,0,0,0|1,0,1]=4 44 B10R1.13 CC1=CC=C(C(=N)N)C=C1 ACI-00494 [1,1,0,0,0,0|1,0,1]=4 45 B10R1.13 N=C(N)C1=CC=C(Br)C=C1 ACI-NI-00221 [1,1,0,0,0,0|1,0,1]=4 46 B10R1.13 N=C(N)C1=CC=C(Cl)C=C1 ACI-01689 [1,1,0,0,0,0|1,0,1]=4 47 B10R1.13 N=C(N)C1=CC=C(F)C=C1 ACI-NI-00230 [1,1,0,0,0,0|1,0,1]=4 48 B10R1.13 NC(=O)C1=CC=C(F)C=C1 ACI-05410 [1,1,0,0,0,0|1,0,1]=4 49 B10R1.13 NC(=S)C1=CC=C(Br)C=C1 ACI-NI-00222 [1,1,0,0,0,0|1,0,1]=4 50 B10R1.13 NC(=S)C1=CC=C(F)C=C1 ACI-NI-00231 [1,1,0,0,0,0|1,0,1]=4 51 B10R1.13 NC(=S)C1=CN=C(O)C=C1 SB-16B-002 [1,1,0,0,0,0|1,0,1]=4 52 B10R1.25 CC1=C(NN)C=CC(Cl)=C1 FD-10E-004 [1,1,0,0,0,0|2,0,0]=4 53 B10R1.25 CC1=C(NN)C=CC(F)=C1 ACI-04083 [1,1,0,0,0,0|2,0,0]=4 54 B10R1.25 NNC1=C(Br)C=C(F)C=C1 ACI-02453 [1,1,0,0,0,0|2,0,0]=4 55 B10R1.25 NNC1=C(Cl)C=C(F)C=C1 ACI-03975 [1,1,0,0,0,0|2,0,0]=4 56 B10R1.25 NNC1=CC=C(F)C=C1F ACI-00273 [1,1,0,0,0,0|2,0,0]=4 57 B10R1.176 CC1=C(I)C=C(CO)C=C1 ACI-05610 [1,1,0,0,0,0|2,0,0]=4 58 B10R1.176 CC1=CC(NN)=CC=C1Cl FD-10E-001 [1,1,0,0,0,0|2,0,0]=4 59 B10R1.176 CC1=CC=C(CBr)C=C1I ACI-05617 [1,1,0,0,0,0|2,0,0]=4 60 B10R1.176 ClC1=CC=C(CBr)C=C1I ACI-05618 [1,1,0,0,0,0|2,0,0]=4 61 B10R1.176 OCC1=CC(I)=C(Cl)C=C1 ACI-05611 [1,1,0,0,0,0|2,0,0]=4 62 B10R1.15 NNC(=O)C1=CC=CC=C1 ACI-01630 [1,1,0,0,0,0|1,0,1]=4 63 B10R1.17 BrCCOC1=CC=CC=C1 ACI-01603 [1,1,0,0,0,0|1,0,0]=3 64 B10R1.17 N#CCOC1=CC=CC=C1 ACI-05140 [1,1,0,0,0,0|0,0,2]=4 65 B10R1.17 OCCSC1=CC=CC=C1 ACI-02409 [1,1,0,0,0,0|1,0,0]=3 66 B10R1.18 N=C(N)NC1=CC=CC=C1 ACI-04704 [1,1,0,0,0,0|1,0,1]=4 67 B10R1.18 NC(=S)CC1=CC=CC=C1 SB-02C-001 [1,1,0,0,0,0|0,0,1]=3 68 B10R1.18 NC(N)=NC1=CC=CC=C1 ACI-00069 [1,1,0,0,0,0|1,0,1]=4 69 B12R1.1 N#CCCOC1=CC=C(F)C=C1 ACI-04357 [0,2,0,0,0,0|1,0,1]=4 70 B12R1.21 CC1=CC=C(OCC(=N)N)C=C1 ACI-05110 [0,2,0,0,0,0|1,0,1]=4 71 B12R1.21 N=C(N)COC1=CC=C(Br)C=C1 ACI-05156 [0,2,0,0,0,0|1,0,1]=4 72 B12R1.21 N=C(N)COC1=CC=C(Cl)C=C1 ACI-05103 [0,2,0,0,0,0|1,0,1]=4 73 B12R1.21 N=C(N)COC1=CC=C(F)C=C1 ACI-05149 [0,2,0,0,0,0|1,0,1]=4 74 B12R1.21 N=C(N)SCC1=CC=C(Br)C=C1 WS-05C-004 [0,2,0,0,0,0|1,0,1]=4 75 B12R1.49 N\C(CC1=CC=C(Br)C=C1)=N/O ACI-00154 [0,2,0,0,0,0|1,0,1]=4 76 B12R1.49 N\C(CC1=CC=C(F)C=C1)=N/O RH-08K-002 [0,2,0,0,0,0|1,0,1]=4 77 B12R1.69 CC1=CC(Br)=C(SCCO)C=C1 ACI-02407 [0,2,0,0,0,0|2,0,0]=4 78 B12R1.71 C=CCNC1=CC=C(OC)C=C1 ACI-02168 [0,2,0,0,0,0|1,0,1]=4 79 B12R1.71 COC1=CC=C(OCC#N)C=C1 ACI-05119 [0,2,0,0,0,0|0,0,2]=4 80 B12R1.385 CC1=CC(SCCO)=CC=C1Br ACI-02414 [0,2,0,0,0,0|2,0,0]=4 81 B12R1.385 CC1=CC=C(SCCO)C=C1Br ACI-02351 [0,2,0,0,0,0|2,0,0]=4 82 B12R1.4 COC1=CC=C(CC(C)=O)C=C1 ACI-05058 [0,2,0,0,0,0|1,0,1]=4 83 B12R1.4 COC1=CC=C(NC(=N)N)C=C1 ACI-04703 [0,2,0,0,0,0|1,0,1]=4 84 B12R1.106 NS(=O)(=O)CC1=CC=C(Br)C=C1 ACI-04535 [0,2,0,0,0,0|2,0,0]=4 85 B12R1.106 NS(=O)(=O)CC1=CC=C(F)C=C1 ACI-04530 [0,2,0,0,0,0|2,0,0]=4 86 B12R1.113 NC(=O)C1=CC=C(CCCl)C=C1 ACI-04715 [0,2,0,0,0,0|1,0,1]=4 87 B12R2.24 BrC1=NC2=C(C=C1)OCCN2 ACI-03796 [0,1,0,1,0,0|2,0,0]=4 88 B12R2.24 OC1=CC=C2OCCNC2=C1 JM-08B-001 [0,1,0,1,0,0|0,0,0]=2 89 B12R2.132 NC1=CC=C2CCC(=O)C2=C1 ACI-01589 [0,1,0,1,0,0|2,0,0]=4 90 B12R2.606 NC1=NC2=C(C=C(O)C=C2)S1 ACI-00489 [0,1,0,1,0,0|1,0,1]=4 91 B12R2.291 NC1=CC=C(C2CC2)C=C1F ACI-06430 [0,1,0,1,0,0|2,0,0]=4 92 B8R1.8 NCCC1=CC=CS1 SB-11D-001 [1,0,0,0,1,0|1,0,0]=3