0 B9R1.6 N=C(N)C1=CC=CC=N1 ACI-NI-00265 [0,0,0,0,0,0|3,0,0]=3 1 B9R1.6 N=C(N)C1=CC=CN=C1 ACI-00003 [0,0,0,0,0,0|3,0,0]=3 2 B9R1.6 N=C(N)C1=CC=NC=C1 ACI-NI-00269 [0,0,0,0,0,0|3,0,0]=3 3 B9R1.6 N=C(N)C1=CN=CN=C1 RH-06K-003 [0,0,0,0,0,0|4,0,0]=4 4 B9R1.6 NC(=S)C1=CC=CC=N1 ACI-NI-00266 [0,0,0,0,0,0|2,1,0]=3 5 B8R1.2 ClCC1=NC=CC=C1 ACI-00989 [1,0,0,0,0,0|2,0,1]=4 6 B8R1.2 NNC1=CC=CN=C1 ACI-04199 [1,0,0,0,0,0|3,0,0]=4 7 B10R1.13 CC(=O)C1=CC=C(Cl)N=C1 ACI-NI-00400 [0,1,0,0,0,0|1,0,0]=2 8 B10R1.13 CC(C)C1=CC=[N+]([O-])C=C1 ACI-05159 [0,1,0,0,0,0|2,0,1]=4 9 B10R1.13 CC1=CC=C(C(=N)N)C=C1 ACI-00494 [0,1,0,0,0,0|2,0,0]=3 10 B10R1.13 CC1=CC=C(C(=N)N)C=N1 ACI-02505 [0,1,0,0,0,0|3,0,0]=4 11 B10R1.13 CC1=CC=C(C(N)=O)C=N1 ACI-NI-00764 [0,1,0,0,0,0|2,0,0]=3 12 B10R1.13 CC1=CN=C(C(=N)N)C=C1 RH-08K-006 [0,1,0,0,0,0|3,0,0]=4 13 B10R1.13 CC1=CN=C(C(=O)O)C=C1 RH-05J-001 [0,1,0,0,0,0|2,0,0]=3 14 B10R1.13 CC1=NC=C([N+](=O)[O-])C=C1 ACI-01779 [0,1,0,0,0,0|3,0,0]=4 15 B10R1.13 N=C(N)C1=CC=C(Br)C=C1 ACI-NI-00221 [0,1,0,0,0,0|2,0,0]=3 16 B10R1.13 N=C(N)C1=CC=C(Cl)C=C1 ACI-01689 [0,1,0,0,0,0|2,0,0]=3 17 B10R1.13 N=C(N)C1=CC=C(F)C=C1 ACI-NI-00230 [0,1,0,0,0,0|2,0,0]=3 18 B10R1.13 N=C(N)C1=CN=C(Cl)C=C1 ACI-NI-00209 [0,1,0,0,0,0|3,0,0]=4 19 B10R1.13 NC(=O)C1=CC=C(Cl)N=C1 ACI-05362 [0,1,0,0,0,0|2,0,0]=3 20 B10R1.13 NC(=O)C1=CC=C(F)C=C1 ACI-05410 [0,1,0,0,0,0|1,0,0]=2 21 B10R1.13 NC(=O)C1=CC=C(F)N=C1 ACI-05369 [0,1,0,0,0,0|2,0,0]=3 22 B10R1.13 NC(=O)C1=NC=C(Br)C=C1 ACI-05390 [0,1,0,0,0,0|2,0,0]=3 23 B10R1.13 NC(=O)C1=NC=C(F)C=C1 ACI-05447 [0,1,0,0,0,0|2,0,0]=3 24 B10R1.13 NC(=S)C1=CC=C(Br)C=C1 ACI-NI-00222 [0,1,0,0,0,0|1,1,0]=3 25 B10R1.13 NC(=S)C1=CC=C(F)C=C1 ACI-NI-00231 [0,1,0,0,0,0|1,1,0]=3 26 B10R1.13 NC(=S)C1=CN=C(Cl)C=C1 ACI-NI-00213 [0,1,0,0,0,0|2,1,0]=4 27 B10R1.13 NC(=S)C1=CN=C(O)C=C1 SB-16B-002 [0,1,0,0,0,0|2,1,0]=4 28 B10R1.13 O=C(Cl)C1=CC=C(Cl)N=C1 ACI-00319 [0,1,0,0,0,0|2,0,0]=3 29 B10R1.13 O=C(Cl)C1=CN=C(F)C=C1 ACI-00437 [0,1,0,0,0,0|2,0,0]=3 30 B10R1.13 O=C(Cl)C1=NC=C(Br)C=C1 ACI-01622 [0,1,0,0,0,0|2,0,0]=3 31 B10R1.13 O=C(Cl)C1=NC=C(F)C=C1 ACI-03847 [0,1,0,0,0,0|2,0,0]=3 32 B10R1.13 O=C(O)C1=CC=C(I)N=C1 ACI-05589 [0,1,0,0,0,0|2,0,0]=3 33 B10R1.13 O=C(O)C1=CC=C(O)N=N1 JL-11I-004 [0,1,0,0,0,0|3,0,0]=4 34 B10R1.13 O=C(O)C1=CN=C(F)C=C1 ACI-00439 [0,1,0,0,0,0|2,0,0]=3 35 B10R1.13 O=C(O)C1=NC=C(Br)C=C1 ACI-01682 [0,1,0,0,0,0|2,0,0]=3 36 B10R1.15 COC(=N)C1=CC=CC=C1 ACI-15283 [0,1,0,0,0,0|1,0,0]=2 37 B10R1.15 NNC(=O)C1=CC=CC=C1 ACI-01630 [0,1,0,0,0,0|1,0,0]=2 38 B10R1.15 N\C(=N/O)C1=CC=CC=C1 ACI-00072 [0,1,0,0,0,0|1,0,1]=3 39 B10R1.15 N\C(=N/O)C1=CC=CC=N1 ACI-NI-00264 [0,1,0,0,0,0|2,0,1]=4 40 B10R1.15 N\C(=N/O)C1=CC=CN=C1 ACI-00002 [0,1,0,0,0,0|2,0,1]=4 41 B10R1.15 N\C(=N\O)C1=CC=NC=C1 ACI-NI-00268 [0,1,0,0,0,0|2,0,1]=4 42 B10R1.15 O=C(CBr)C1=CC=CN=C1 ACI-NI-00021 [0,1,0,0,0,0|1,0,0]=2 43 B10R1.15 O=C(CBr)C1=CC=NC=C1 ACI-NI-00022 [0,1,0,0,0,0|1,0,0]=2 44 B10R1.15 O=C(CBr)C1=NC=CC=C1 ACI-NI-00023 [0,1,0,0,0,0|1,0,0]=2 45 B10R1.15 O=C(NO)C1=CC=CC=C1 ACI-01576 [0,1,0,0,0,0|1,0,0]=2 46 B10R1.15 O\N=C(/Cl)C1=CC=CC=C1 RH-11K-001 [0,1,0,0,0,0|1,0,1]=3 47 B10R1.61 CC1=C(C(N)=O)C=NC=C1 JM-11J-002 [0,1,0,0,0,0|2,0,0]=3 48 B10R1.61 CC1=CC=CN=C1C(=N)N ACI-02503 [0,1,0,0,0,0|3,0,0]=4 49 B10R1.61 CC1=CC=CN=C1C(N)=O ACI-01402 [0,1,0,0,0,0|2,0,0]=3 50 B10R1.61 CC1=CN=CC=C1C(=N)N ACI-02506 [0,1,0,0,0,0|3,0,0]=4 51 B10R1.61 CC1=NC=CN=C1C(=O)O ACI-02629 [0,1,0,0,0,0|3,0,0]=4 52 B10R1.61 CS(=O)C1=C(I)C=CC=C1 RH-10K-001 [0,1,0,0,0,0|1,0,0]=2 53 B10R1.61 N=C(N)C1=C(Br)C=CC=C1 ACI-NI-00396 [0,1,0,0,0,0|2,0,0]=3 54 B10R1.61 N=C(N)C1=C(F)C=CC=C1 ACI-NI-00227 [0,1,0,0,0,0|2,0,0]=3 55 B10R1.61 NC(=O)C1=C(Cl)C=CC=N1 ACI-05458 [0,1,0,0,0,0|2,0,0]=3 56 B10R1.61 NC(=O)C1=CC=CC=C1Br ACI-05397 [0,1,0,0,0,0|1,0,0]=2 57 B10R1.61 NC(=O)C1=CC=CN=C1Cl ACI-05357 [0,1,0,0,0,0|2,0,0]=3 58 B10R1.61 NC(=O)C1=CC=CN=C1F ACI-05446 [0,1,0,0,0,0|2,0,0]=3 59 B10R1.61 NC(=O)C1=CC=NC=C1F ACI-05445 [0,1,0,0,0,0|2,0,0]=3 60 B10R1.61 NC(=O)C1=NC=CC=C1F ACI-05448 [0,1,0,0,0,0|2,0,0]=3 61 B10R1.61 NC(=S)C1=C(Br)C=CC=C1 ACI-NI-00219 [0,1,0,0,0,0|1,1,0]=3 62 B10R1.61 NC(=S)C1=C(F)C=CC=C1 ACI-NI-00228 [0,1,0,0,0,0|1,1,0]=3 63 B10R1.61 NC1=C(C(=O)O)C=CN=C1 ACI-00348 [0,1,0,0,0,0|2,0,0]=3 64 B10R1.61 NC1=NC=CC=C1C(=O)O ACI-04973 [0,1,0,0,0,0|2,0,0]=3 65 B10R1.61 O=C(Cl)C1=CC=CC=C1Br ACI-01723 [0,1,0,0,0,0|1,0,0]=2 66 B10R1.61 O=C(Cl)C1=CC=CN=C1Cl ACI-NI-00466 [0,1,0,0,0,0|2,0,0]=3 67 B10R1.61 O=C(Cl)C1=CC=CN=C1F ACI-03845 [0,1,0,0,0,0|2,0,0]=3 68 B10R1.61 O=C(Cl)C1=CC=NC=C1F ACI-03843 [0,1,0,0,0,0|2,0,0]=3 69 B10R1.61 O=C(Cl)C1=NC=CC=C1Cl ACI-04861 [0,1,0,0,0,0|2,0,0]=3 70 B10R1.61 O=C(Cl)C1=NC=CC=C1F ACI-03849 [0,1,0,0,0,0|2,0,0]=3 71 B10R1.61 O=C(O)C1=C(Cl)C=CN=C1 ACI-00044 [0,1,0,0,0,0|2,0,0]=3 72 B10R1.61 O=C(O)C1=CC=CN=C1O ACI-01430 [0,1,0,0,0,0|2,0,0]=3 73 B10R1.61 O=[N+]([O-])C1=C(Cl)C=CN=C1 ACI-00997 [0,1,0,0,0,0|3,0,0]=4 74 B10R1.61 O=[N+]([O-])C1=CC=CN=C1S WS-04C-008 [0,1,0,0,0,0|3,0,0]=4 75 B10R1.113 CC(=O)C1=CC=NC(N)=N1 ACI-05038 [0,1,0,0,0,0|2,0,0]=3 76 B10R1.113 CC(=O)C1=NC(Br)=CC=C1 WS-05F-004 [0,1,0,0,0,0|1,0,0]=2 77 B10R1.113 CC(=O)C1=NC=CC(Br)=C1 ACI-04001 [0,1,0,0,0,0|1,0,0]=2 78 B10R1.113 CC(=O)C1=NC=CC(Cl)=C1 ACI-00417 [0,1,0,0,0,0|1,0,0]=2 79 B10R1.113 CC1=CC(C(=N)N)=CC=N1 ACI-02507 [0,1,0,0,0,0|3,0,0]=4 80 B10R1.113 CC1=CC(C(=N)N)=NC=C1 ACI-02502 [0,1,0,0,0,0|3,0,0]=4 81 B10R1.113 CC1=CN=CC(C(=O)O)=N1 ACI-02630 [0,1,0,0,0,0|3,0,0]=4 82 B10R1.113 CC1=NC(C(=N)N)=CC=C1 ACI-00468 [0,1,0,0,0,0|3,0,0]=4 83 B10R1.113 N=C(N)C1=CC(Br)=CN=C1 RH-06K-004 [0,1,0,0,0,0|3,0,0]=4 84 B10R1.113 N=C(N)C1=CC(Cl)=NC=C1 ACI-NI-00208 [0,1,0,0,0,0|3,0,0]=4 85 B10R1.113 N=C(N)C1=CC=CC(=O)N1 ACI-06427 [0,1,0,0,0,0|3,0,0]=4 86 B10R1.113 N=C(N)C1=CC=CC(Br)=C1 ACI-NI-00224 [0,1,0,0,0,0|2,0,0]=3 87 B10R1.113 N=C(N)C1=CC=CC(Cl)=C1 ACI-NI-00236 [0,1,0,0,0,0|2,0,0]=3 88 B10R1.113 N=C(N)C1=CC=CC(F)=C1 ACI-NI-00233 [0,1,0,0,0,0|2,0,0]=3 89 B10R1.113 NC(=O)C1=CC(Br)=CN=C1 ACI-00462 [0,1,0,0,0,0|2,0,0]=3 90 B10R1.113 NC(=O)C1=CC(Cl)=NC=C1 ACI-05361 [0,1,0,0,0,0|2,0,0]=3 91 B10R1.113 NC(=O)C1=CC(F)=CC=C1 ACI-03952 [0,1,0,0,0,0|1,0,0]=2 92 B10R1.113 NC(=O)C1=CC(F)=NC=C1 ACI-05368 [0,1,0,0,0,0|2,0,0]=3 93 B10R1.113 NC(=O)C1=NC(F)=CC=C1 ACI-05444 [0,1,0,0,0,0|2,0,0]=3 94 B10R1.113 NC(=S)C1=CC=CC(Br)=C1 ACI-NI-00225 [0,1,0,0,0,0|1,1,0]=3 95 B10R1.113 NC(=S)C1=CC=CC(Cl)=C1 ACI-NI-00237 [0,1,0,0,0,0|1,1,0]=3 96 B10R1.113 NC(=S)C1=CC=CC(F)=C1 ACI-NI-00234 [0,1,0,0,0,0|1,1,0]=3 97 B10R1.113 NC1=NC(C(=O)O)=CC=C1 ACI-04969 [0,1,0,0,0,0|2,0,0]=3 98 B10R1.113 O=C(Cl)C1=CC(Cl)=NC=C1 ACI-00306 [0,1,0,0,0,0|2,0,0]=3 99 B10R1.113 O=C(Cl)C1=CC(F)=CC=C1 ACI-03964 [0,1,0,0,0,0|1,0,0]=2 100 B10R1.113 O=C(Cl)C1=CC(F)=CN=C1 ACI-05622 [0,1,0,0,0,0|2,0,0]=3 101 B10R1.113 O=C(Cl)C1=CC(F)=NC=C1 ACI-00434 [0,1,0,0,0,0|2,0,0]=3 102 B10R1.113 O=C(Cl)C1=NC(F)=CC=C1 ACI-03839 [0,1,0,0,0,0|2,0,0]=3 103 B10R1.113 O=C(O)C1=CC(Cl)=NC=C1 ACI-00312 [0,1,0,0,0,0|2,0,0]=3 104 B10R1.113 O=C(O)C1=CC(F)=NC=C1 ACI-00436 [0,1,0,0,0,0|2,0,0]=3 105 B10R1.113 O=C(O)C1=NC(F)=CC=C1 ACI-02728 [0,1,0,0,0,0|2,0,0]=3 106 B8R1.7 CC(=O)C1=CC=NN1 ACI-NI-00192 [0,0,0,0,1,0|2,0,0]=3 107 B8R1.7 N=C(N)C1=CC=CS1 ACI-NI-00211 [0,0,0,0,1,0|3,0,0]=4 108 B8R1.7 N=C(N)C1=CSC=C1 ACI-NI-00212 [0,0,0,0,1,0|3,0,0]=4 109 B8R1.7 NC(=O)C1=CC=CO1 ACI-02007 [0,0,0,0,1,0|2,0,0]=3 110 B8R1.7 NC(=O)C1=CC=NO1 ACI-05366 [0,0,0,0,1,0|3,0,0]=4 111 B8R1.7 NC(=O)C1=CC=NS1 ACI-05371 [0,0,0,0,1,0|3,0,0]=4 112 B8R1.7 NC(=O)C1=COC=C1 ACI-02522 [0,0,0,0,1,0|2,0,0]=3 113 B8R1.7 NC(=O)C1=CSC=C1 JM-03G-005 [0,0,0,0,1,0|2,0,0]=3 114 B8R1.7 NC(=O)C1=NC=CS1 ACI-05426 [0,0,0,0,1,0|3,0,0]=4 115 B8R1.7 NC(=S)C1=CC=CS1 ACI-NI-00215 [0,0,0,0,1,0|2,1,0]=4 116 B8R1.7 NC(=S)C1=CSC=C1 ACI-NI-00216 [0,0,0,0,1,0|2,1,0]=4 117 B8R1.7 O=C(Cl)C1=CC=NO1 ACI-00386 [0,0,0,0,1,0|3,0,0]=4 118 B8R1.7 O=C(Cl)C1=COC=C1 ACI-00295 [0,0,0,0,1,0|2,0,0]=3 119 B8R1.7 O=C(Cl)C1=CSC=C1 ACI-00297 [0,0,0,0,1,0|2,0,0]=3 120 B8R1.7 O=C(Cl)C1=NC=CS1 ACI-02388 [0,0,0,0,1,0|3,0,0]=4 121 B8R1.7 O=C(O)C1=CC=NO1 ACI-02588 [0,0,0,0,1,0|3,0,0]=4 122 B8R1.7 O=C(O)C1=NC=CS1 ACI-02389 [0,0,0,0,1,0|3,0,0]=4 123 B8R1.7 O=C(O)C1=NNC=C1 ACI-02623 [0,0,0,0,1,0|3,0,0]=4 124 B8R1.7 O=C(O)C1=NOC=C1 ACI-05095 [0,0,0,0,1,0|3,0,0]=4 125 B8R1.7 O=C(O)C1=NSC=C1 ACI-NI-00755 [0,0,0,0,1,0|3,0,0]=4 126 B10R1.18 N=C(N)NC1=CC=CC=C1 ACI-04704 [0,0,0,0,0,1|2,0,0]=3 127 B10R1.18 NC(=S)CC1=CC=CC=C1 SB-02C-001 [0,0,0,0,0,1|1,1,0]=3 128 B10R1.18 NC(N)=NC1=CC=CC=C1 ACI-00069 [0,0,0,0,0,1|2,0,0]=3 129 B9R1.1 COC1=CC=[N+]([O-])C=C1 WS-03E-001 [1,1,0,0,0,0|2,0,0]=4 130 B9R1.1 FC1=CC=C(CS)C=C1 ACI-01597 [1,1,0,0,0,0|0,1,1]=4 131 B9R1.1 NNC1=CC=C(I)C=C1 ACI-00329 [1,1,0,0,0,0|2,0,0]=4 132 B9R1.1 O=CC1=CC=C(Br)C=N1 ACI-04980 [1,1,0,0,0,0|1,0,0]=3 133 B9R1.1 O=CC1=CC=C(Cl)N=N1 ACI-02604 [1,1,0,0,0,0|2,0,0]=4 134 B9R1.2 COC1=CC(Br)=CN=C1 ACI-05645 [1,1,0,0,0,0|2,0,0]=4 135 B9R1.2 O=CC1=CC(Cl)=NC=C1 ACI-00432 [1,1,0,0,0,0|1,0,0]=3 136 B9R1.2 O=CC1=NC(Br)=CC=C1 TB-05D-001 [1,1,0,0,0,0|1,0,0]=3 137 B9R1.8 NOCC1=CC=CC=C1 ACI-01578 [1,1,0,0,0,0|0,0,2]=4 138 B9R1.8 O=CNC1=CC=CC=C1 ACI-01582 [1,1,0,0,0,0|0,0,0]=2 139 B9R1.15 CNC1=CC=CC=C1O ACI-05339 [1,1,0,0,0,0|1,0,0]=3 140 B9R1.15 COC1=C(Br)C=NC=C1 ACI-06376 [1,1,0,0,0,0|2,0,0]=4 141 B9R1.15 COC1=C(Br)C=NC=C1 ACI-06377 [1,1,0,0,0,0|2,0,0]=4 142 B9R1.15 COC1=CC=CN=C1Br ACI-01447 [1,1,0,0,0,0|2,0,0]=4 143 B9R1.15 ClCC1=CC=CC=C1Br ACI-03860 [1,1,0,0,0,0|1,0,1]=4 144 B9R1.15 NCC1=CC=CC=C1O ACI-02209 [1,1,0,0,0,0|1,0,1]=4 145 B9R1.15 O=CC1=CC=CN=C1Br WS-02K-001 [1,1,0,0,0,0|1,0,0]=3 146 B9R1.15 O=CC1=CC=CN=C1Cl WS-02I-001 [1,1,0,0,0,0|1,0,0]=3 147 B9R1.11 COC(=N)C1=CC=CS1 WS-04A-006 [0,1,0,0,1,0|2,0,0]=4 148 B9R1.11 COC(=O)C1=CNC=C1 ACI-05835 [0,1,0,0,1,0|1,0,0]=3 149 B9R1.11 O=C(CBr)C1=CC=CS1 ACI-01812 [0,1,0,0,1,0|1,0,0]=3 150 B9R1.11 O=C(CBr)C1=CSC=C1 ACI-05846 [0,1,0,0,1,0|1,0,0]=3 151 B9R1.35 CC(=O)C1=CC(C)=NS1 ACI-NI-00751 [0,1,0,0,1,0|2,0,0]=4 152 B9R1.35 CC1=CSC(C(=O)Cl)=C1 RH-06B-005 [0,1,0,0,1,0|2,0,0]=4 153 B9R1.35 CC1=CSC(C(N)=O)=C1 ACI-05409 [0,1,0,0,1,0|2,0,0]=4 154 B9R1.35 NC(=O)C1=CC(Br)=CO1 JM-10G-001 [0,1,0,0,1,0|2,0,0]=4 155 B9R1.35 NC(=O)C1=CC=C(Br)O1 ACI-05421 [0,1,0,0,1,0|2,0,0]=4 156 B9R1.35 O=C(Cl)C1=CC=C(Br)O1 ACI-02130 [0,1,0,0,1,0|2,0,0]=4 157 B9R1.35 O=C(O)C1=CC=C(Br)O1 ACI-04649 [0,1,0,0,1,0|2,0,0]=4 158 B9R1.41 CC1=C(C(=O)Cl)C=CO1 RH-11J-001 [0,1,0,0,1,0|2,0,0]=4 159 B9R1.41 CC1=C(C(N)=O)C=CO1 RH-11A-003 [0,1,0,0,1,0|2,0,0]=4 160 B9R1.41 CC1=C(C(N)=O)OC=C1 JM-11A-005 [0,1,0,0,1,0|2,0,0]=4 161 B9R1.41 O=C(O)C1=C(Br)C=CS1 ACI-00956 [0,1,0,0,1,0|2,0,0]=4 162 B11R1.20 CC1=CC=C(CC(=N)N)C=C1 ACI-01697 [0,1,0,0,0,1|2,0,0]=4 163 B11R1.20 N=C(N)CC1=CC=C(Cl)C=C1 ACI-01700 [0,1,0,0,0,1|2,0,0]=4 164 B11R1.20 N=C(N)CC1=CC=C(F)C=C1 ACI-01698 [0,1,0,0,0,1|2,0,0]=4 165 B11R1.20 NC(=O)CC1=CC=C(F)C=C1 RH-08K-004 [0,1,0,0,0,1|1,0,0]=3 166 B11R1.20 NC(=S)CC1=CC=C(Br)C=C1 ACI-NI-00199 [0,1,0,0,0,1|1,1,0]=4 167 B11R1.20 NC(N)=NC1=CC=C(Cl)C=C1 ACI-00070 [0,1,0,0,0,1|2,0,0]=4 168 B11R1.20 O=C(Cl)CC1=CC=C(Br)C=C1 ACI-05800 [0,1,0,0,0,1|1,0,0]=3 169 B11R1.36 CN(C(N)=S)C1=CC=CC=C1 ACI-01570 [0,1,0,0,0,1|1,1,0]=4 170 B11R1.40 N\C(CC1=CC=CC=C1)=N/O ACI-00152 [0,1,0,0,0,1|1,0,1]=4 171 B11R1.40 O=C(CBr)NC1=CC=CC=C1 ACI-01811 [0,1,0,0,0,1|0,0,0]=2 172 B11R1.40 O=C(CCl)NC1=CC=CC=C1 ACI-05777 [0,1,0,0,0,1|0,0,0]=2 173 B11R1.86 CC(=O)CC1=C(C)C=CC=C1 ACI-05057 [0,1,0,0,0,1|0,0,0]=2 174 B11R1.86 CC1=CC=CC=C1CC(=O)Cl ACI-05798 [0,1,0,0,0,1|1,0,0]=3 175 B11R1.86 NC(=O)CC1=C(I)C=CC=C1 ACI-05460 [0,1,0,0,0,1|1,0,0]=3 176 B11R1.86 NC(=S)CC1=CC=CC=C1Br ACI-NI-00198 [0,1,0,0,0,1|1,1,0]=4 177 B11R1.86 NC(=S)NC1=CC=CC=C1Cl ACI-00828 [0,1,0,0,0,1|1,1,0]=4 178 B11R1.86 O=C(Cl)CC1=C(F)C=CC=C1 ACI-05793 [0,1,0,0,0,1|1,0,0]=3 179 B11R1.86 O=C(Cl)CC1=C(I)C=CC=C1 ACI-05161 [0,1,0,0,0,1|1,0,0]=3 180 B11R1.157 N=C(N)CC1=CC(Cl)=CC=C1 ACI-01701 [0,1,0,0,0,1|2,0,0]=4 181 B11R1.157 NC(=O)CC1=CC(Br)=CC=C1 ACI-05461 [0,1,0,0,0,1|1,0,0]=3 182 B11R1.157 O=C(Cl)CC1=CC=CC(Br)=C1 ACI-05162 [0,1,0,0,0,1|1,0,0]=3 183 B11R1.157 O=C(Cl)CC1=CC=CC(Cl)=C1 ACI-05795 [0,1,0,0,0,1|1,0,0]=3 184 B11R1.157 O=C(Cl)CC1=CC=CC(F)=C1 ACI-05799 [0,1,0,0,0,1|1,0,0]=3 185 B11R1.3 COC1=CC=C(C(=N)N)C=C1 ACI-NI-00262 [0,2,0,0,0,0|2,0,0]=4 186 B11R1.3 COC1=CC=C(C(N)=S)C=C1 ACI-NI-00263 [0,2,0,0,0,0|1,1,0]=4 187 B11R1.3 NC(=O)C1=CC=C(CBr)C=C1 ACI-05253 [0,2,0,0,0,0|1,0,0]=3 188 B11R1.21 CC(=O)C1=CC=C(N)C(N)=C1 JM-11E-001 [0,2,0,0,0,0|0,0,0]=2 189 B11R1.21 CC1=C(Br)C=CC(C(=N)N)=C1 ACI-03943 [0,2,0,0,0,0|2,0,0]=4 190 B11R1.21 CC1=C(Br)C=CC(C(=O)Cl)=C1 ACI-03963 [0,2,0,0,0,0|1,0,0]=3 191 B11R1.21 CC1=C(Br)C=CC(C(N)=O)=C1 ACI-03954 [0,2,0,0,0,0|1,0,0]=3 192 B11R1.21 CC1=C(C)C=C(C(=N)N)C=C1 ACI-03942 [0,2,0,0,0,0|2,0,0]=4 193 B11R1.21 CC1=C(C)C=C(C(N)=O)C=C1 ACI-03953 [0,2,0,0,0,0|1,0,0]=3 194 B11R1.21 CC1=CC=C(C(N)=S)C=C1F WS-04A-009 [0,2,0,0,0,0|1,1,0]=4 195 B11R1.21 N=C(N)C1=CC(F)=C(Br)C=C1 ACI-03946 [0,2,0,0,0,0|2,0,0]=4 196 B11R1.21 N=C(N)C1=CC(F)=C(F)C=C1 ACI-01052 [0,2,0,0,0,0|2,0,0]=4 197 B11R1.21 NC(=O)C1=CC(F)=C(Br)C=C1 ACI-02957 [0,2,0,0,0,0|1,0,0]=3 198 B11R1.21 NC(=O)C1=CC=C(Br)C(Cl)=C1 ACI-05401 [0,2,0,0,0,0|1,0,0]=3 199 B11R1.21 NC(=O)C1=CC=C(Cl)C(Br)=C1 ACI-05400 [0,2,0,0,0,0|1,0,0]=3 200 B11R1.21 NC1=C(Br)C=C(C(=O)O)C=N1 RJC-03C-003 [0,2,0,0,0,0|2,0,0]=4 201 B11R1.21 O=C(Cl)C1=CC(Br)=C(Cl)C=C1 ACI-01748 [0,2,0,0,0,0|1,0,0]=3 202 B11R1.21 O=C(Cl)C1=CC(Cl)=C(Br)C=C1 ACI-01750 [0,2,0,0,0,0|1,0,0]=3 203 B11R1.21 O=C(Cl)C1=CC(F)=C(Br)C=C1 ACI-03967 [0,2,0,0,0,0|1,0,0]=3 204 B11R1.21 O=C(O)C1=CC(Br)=C(Cl)N=C1 ACI-00869 [0,2,0,0,0,0|2,0,0]=4 205 B11R1.21 O=C(O)C1=CC(Br)=C(O)N=C1 ACI-00122 [0,2,0,0,0,0|2,0,0]=4 206 B11R1.21 O=C(O)C1=CC(Cl)=C(O)N=C1 ACI-01690 [0,2,0,0,0,0|2,0,0]=4 207 B11R1.21 O=C(O)C1=CC=C(O)C(I)=C1 ACI-02694 [0,2,0,0,0,0|1,0,0]=3 208 B11R1.22 COC(=N)C1=CC=C(C)C=C1 ACI-01594 [0,2,0,0,0,0|1,0,0]=3 209 B11R1.22 COC(=O)C1=CC=C(C)N=C1 ACI-01120 [0,2,0,0,0,0|1,0,0]=3 210 B11R1.22 COC(=O)C1=CC=C(Cl)C=N1 ACI-04825 [0,2,0,0,0,0|1,0,0]=3 211 B11R1.22 COC(=O)C1=CC=C(N)N=C1 SB-07E-003 [0,2,0,0,0,0|1,0,0]=3 212 B11R1.22 COC(=O)C1=NC=C(O)C=C1 JM-05D-002 [0,2,0,0,0,0|1,0,0]=3 213 B11R1.22 NNC(=O)C1=CC=C(Br)C=C1 ACI-01724 [0,2,0,0,0,0|1,0,0]=3 214 B11R1.22 NNC(=O)C1=CC=C(Cl)N=C1 ACI-02020 [0,2,0,0,0,0|2,0,0]=4 215 B11R1.22 N\C(=N/O)C1=CC=C(Br)C=C1 ACI-NI-00220 [0,2,0,0,0,0|1,0,1]=4 216 B11R1.22 N\C(=N/O)C1=CC=C(Cl)C=C1 ACI-01635 [0,2,0,0,0,0|1,0,1]=4 217 B11R1.22 N\C(=N/O)C1=CC=C(F)C=C1 ACI-NI-00229 [0,2,0,0,0,0|1,0,1]=4 218 B11R1.22 O=C(CBr)C1=CC=C(F)C=C1 ACI-00490 [0,2,0,0,0,0|0,0,0]=2 219 B11R1.22 O\N=C(/Cl)C1=CC=C(Cl)C=C1 ACI-NI-00061 [0,2,0,0,0,0|1,0,1]=4 220 B11R1.166 CC(=O)C1=CN=C(N)N=C1C ACI-00090 [0,2,0,0,0,0|2,0,0]=4 221 B11R1.166 CC1=C(C(=N)N)C=CC(Br)=C1 ACI-03944 [0,2,0,0,0,0|2,0,0]=4 222 B11R1.166 CC1=C(C(=O)Cl)C=CC(Br)=C1 ACI-03965 [0,2,0,0,0,0|1,0,0]=3 223 B11R1.166 CC1=C(C(N)=O)C=CC(Br)=C1 ACI-03955 [0,2,0,0,0,0|1,0,0]=3 224 B11R1.166 CC1=C(N(C)C)C=CC(Br)=C1 ACI-06402 [0,2,0,0,0,0|2,0,0]=4 225 B11R1.166 CC1=CC=C(C(=O)Cl)C(Br)=C1 ACI-01767 [0,2,0,0,0,0|1,0,0]=3 226 B11R1.166 CC1=CC=C(C(N)=O)C(Br)=C1 ACI-05403 [0,2,0,0,0,0|1,0,0]=3 227 B11R1.166 CC1=CC=C(C(N)=O)C(Cl)=N1 ACI-05353 [0,2,0,0,0,0|2,0,0]=4 228 B11R1.166 CC1=CN=C(C(N)=O)C(N)=C1 WS-03K-001 [0,2,0,0,0,0|2,0,0]=4 229 B11R1.166 N=C(N)C1=C(F)C=C(Br)C=C1 ACI-03945 [0,2,0,0,0,0|2,0,0]=4 230 B11R1.166 N=C(N)C1=C(F)C=C(F)C=C1 ACI-00232 [0,2,0,0,0,0|2,0,0]=4 231 B11R1.166 NC(=O)C1=C(F)C=C(Br)C=C1 ACI-03956 [0,2,0,0,0,0|1,0,0]=3 232 B11R1.166 NC(=O)C1=CC=C(Br)C=C1Cl ACI-05399 [0,2,0,0,0,0|1,0,0]=3 233 B11R1.166 O=C(Cl)C1=C(F)C=C(Br)C=C1 ACI-03966 [0,2,0,0,0,0|1,0,0]=3 234 B11R1.166 O=C(Cl)C1=CC=C(Br)C=C1Cl ACI-01735 [0,2,0,0,0,0|1,0,0]=3 235 B11R1.166 O=C(O)C1=CC=C(O)N=C1Cl ACI-00424 [0,2,0,0,0,0|2,0,0]=4 236 B11R1.166 O=[N+]([O-])C1=C(Br)C=C(Cl)C=C1 ACI-02454 [0,2,0,0,0,0|2,0,0]=4 237 B11R1.12 C(C#N)(NC)C1=CC=CC=C1 ACI-NI-00463 [0,2,0,0,0,0|1,0,1]=4 238 B11R1.12 N#C\C(=C/O)C1=CC=CC=C1 ACI-04944 [0,2,0,0,0,0|0,0,2]=4 239 B11R1.23 CC(C=O)C1=CC=CC(Br)=C1 ACI-05596 [0,2,0,0,0,0|0,0,1]=3 240 B11R1.23 CC1=CC=CC(\C(N)=N\O)=C1 ACI-00825 [0,2,0,0,0,0|1,0,1]=4 241 B11R1.23 CCC(=O)C1=NC(C)=CC=C1 ACI-05706 [0,2,0,0,0,0|1,0,0]=3 242 B11R1.23 COC(=O)C1=CC(F)=CN=C1 RJC-04K-001 [0,2,0,0,0,0|1,0,0]=3 243 B11R1.23 NCC(=O)C1=CC(Cl)=CC=C1 SB-05H-089 [0,2,0,0,0,0|0,0,0]=2 244 B11R1.23 NNC(=O)C1=CC(Br)=CC=C1 ACI-01721 [0,2,0,0,0,0|1,0,0]=3 245 B11R1.23 NNC(=O)C1=CC(F)=CC=C1 ACI-01728 [0,2,0,0,0,0|1,0,0]=3 246 B11R1.23 N\C(=N/O)C1=CC=CC(Br)=C1 ACI-NI-00223 [0,2,0,0,0,0|1,0,1]=4 247 B11R1.23 N\C(=N/O)C1=CC=CC(Cl)=C1 ACI-NI-00235 [0,2,0,0,0,0|1,0,1]=4 248 B11R1.23 N\C(=N/O)C1=CC=CC(F)=C1 ACI-NI-00232 [0,2,0,0,0,0|1,0,1]=4 249 B11R1.23 O=C(CBr)C1=CC(Cl)=CC=C1 ACI-01709 [0,2,0,0,0,0|0,0,0]=2 250 B11R1.23 O=C(CBr)C1=CC(F)=CC=C1 ACI-01713 [0,2,0,0,0,0|0,0,0]=2 251 B11R1.222 CCC(=O)C1=CC=CC=C1Br ACI-04019 [0,2,0,0,0,0|0,0,0]=2 252 B11R1.222 CCC(=O)C1=CC=CC=C1Cl ACI-04018 [0,2,0,0,0,0|0,0,0]=2 253 B11R1.222 COC(=O)C1=C(Cl)C=CN=C1 ACI-NI-00119 [0,2,0,0,0,0|1,0,0]=3 254 B11R1.222 COC(=O)C1=C(N)C=NC=C1 SB-05G-001 [0,2,0,0,0,0|1,0,0]=3 255 B11R1.222 COC(=O)C1=CC=CN=C1Br ACI-01378 [0,2,0,0,0,0|1,0,0]=3 256 B11R1.222 COC(=O)C1=CC=CN=C1Cl ACI-01376 [0,2,0,0,0,0|1,0,0]=3 257 B11R1.222 COC(=O)C1=CC=CN=C1O JM-04F-050 [0,2,0,0,0,0|1,0,0]=3 258 B11R1.222 NNC(=O)C1=CC=CC=C1Br ACI-01722 [0,2,0,0,0,0|1,0,0]=3 259 B11R1.222 NNC(=O)C1=CC=CC=C1F ACI-01726 [0,2,0,0,0,0|1,0,0]=3 260 B11R1.87 NS(=O)(=O)C1=CC=CC=C1Br ACI-04503 [0,2,0,0,0,0|2,0,0]=4 261 B11R1.87 NS(=O)(=O)C1=CC=CC=C1F ACI-04508 [0,2,0,0,0,0|2,0,0]=4 262 B11R1.87 NS(=O)(=O)C1=CC=CC=C1I ACI-04502 [0,2,0,0,0,0|2,0,0]=4 263 B11R1.87 O=S(=O)(Cl)C1=CC=CC=C1Br ACI-NI-00185 [0,2,0,0,0,0|2,0,0]=4 264 B11R1.87 O=S(=O)(Cl)C1=CC=CC=C1F ACI-NI-00276 [0,2,0,0,0,0|2,0,0]=4 265 B11R1.87 O=S(=O)(Cl)C1=CC=CC=C1I ACI-NI-00057 [0,2,0,0,0,0|2,0,0]=4 266 B11R1.155 CC(C)(C)C1=CC(N)=CC=C1 SB-05K-002 [0,2,0,0,0,0|1,0,1]=4 267 B11R1.53 CCC1=CC=CC=C1C(=O)Cl FD-10K-001 [0,2,0,0,0,0|1,0,0]=3 268 B11R1.53 CCC1=CC=CC=C1C(N)=O ACI-05454 [0,2,0,0,0,0|1,0,0]=3 269 B11R1.53 COC1=C(C(=N)N)C=CC=C1 ACI-NI-00256 [0,2,0,0,0,0|2,0,0]=4 270 B11R1.53 COC1=C(C(N)=S)C=CC=C1 ACI-NI-00257 [0,2,0,0,0,0|1,1,0]=4 271 B11R1.53 COC1=CC=CC=C1C(C)=O ACI-05712 [0,2,0,0,0,0|0,0,0]=2 272 B11R1.53 COC1=NC=CC=C1C(=O)O WS-05C-008 [0,2,0,0,0,0|2,0,0]=4 273 B11R1.53 CSC1=NC=CC=C1C(=O)O ACI-01817 [0,2,0,0,0,0|2,0,0]=4 274 B11R1.53 O=C(Cl)C1=CC=CC=C1CCl ACI-01786 [0,2,0,0,0,0|1,0,0]=3 275 B11R1.156 CC1=C(C(=O)Cl)C(Cl)=NC=C1 WS-04B-006 [0,2,0,0,0,0|2,0,0]=4 276 B11R1.156 CC1=C(C(=O)O)C(Br)=NC=C1 WS-04F-001 [0,2,0,0,0,0|2,0,0]=4 277 B11R1.156 CC1=C(C(=O)O)C(Cl)=NC=C1 ACI-00846 [0,2,0,0,0,0|2,0,0]=4 278 B11R1.156 CC1=C(C(=O)O)C(O)=NC=C1 ACI-01234 [0,2,0,0,0,0|2,0,0]=4 279 B11R1.156 CC1=C(C(N)=O)C(Cl)=NC=C1 ACI-05383 [0,2,0,0,0,0|2,0,0]=4 280 B11R1.159 N=C(N)C1=C(Cl)C(Cl)=CC=C1 ACI-03947 [0,2,0,0,0,0|2,0,0]=4 281 B11R1.159 NC(=O)C1=C(Cl)C(Cl)=CC=C1 ACI-03957 [0,2,0,0,0,0|1,0,0]=3 282 B11R1.159 O=C(Cl)C1=C(Cl)C(Cl)=CC=C1 ACI-03968 [0,2,0,0,0,0|1,0,0]=3 283 B11R1.159 O=C(O)C1=CC=CC(I)=C1F ACI-06373 [0,2,0,0,0,0|1,0,0]=3 284 B11R1.167 N=C(N)C1=C(F)C=CC(Cl)=C1 ACI-03948 [0,2,0,0,0,0|2,0,0]=4 285 B11R1.167 NC(=O)C1=C(F)C=CC(Cl)=C1 ACI-03958 [0,2,0,0,0,0|1,0,0]=3 286 B11R1.167 NC(=O)C1=CC(Br)=CC=C1Cl ACI-05398 [0,2,0,0,0,0|1,0,0]=3 287 B11R1.167 NC(=O)C1=CC(Br)=CN=C1Cl ACI-05394 [0,2,0,0,0,0|2,0,0]=4 288 B11R1.167 NC(=O)C1=CC(Cl)=CN=C1Cl ACI-05358 [0,2,0,0,0,0|2,0,0]=4 289 B11R1.167 NC1=C(C(=O)O)C=C(Br)C=N1 ACI-00984 [0,2,0,0,0,0|2,0,0]=4 290 B11R1.167 NC1=C(C(=O)O)C=C(F)N=C1 ACI-06269 [0,2,0,0,0,0|2,0,0]=4 291 B11R1.167 NC1=CC=C(I)C=C1[N+](=O)[O-] ACI-01595 [0,2,0,0,0,0|2,0,0]=4 292 B11R1.167 NC1=CN=C(Cl)C=C1C(=O)O JM-04I-008 [0,2,0,0,0,0|2,0,0]=4 293 B11R1.167 NC1=NC=C(Br)C=C1C(=O)O WS-02D-005 [0,2,0,0,0,0|2,0,0]=4 294 B11R1.167 NC1=NC=C(I)C=C1C(=O)O WS-02E-004 [0,2,0,0,0,0|2,0,0]=4 295 B11R1.167 O=C(Cl)C1=C(F)C=CC(Cl)=C1 ACI-03970 [0,2,0,0,0,0|1,0,0]=3 296 B11R1.167 O=C(Cl)C1=CC(Br)=CC=C1Cl ACI-01732 [0,2,0,0,0,0|1,0,0]=3 297 B11R1.167 O=C(Cl)C1=CC(Br)=CN=C1Cl WS-02E-092 [0,2,0,0,0,0|2,0,0]=4 298 B11R1.167 O=C(Cl)C1=CC(Cl)=CN=C1Cl ACI-00222 [0,2,0,0,0,0|2,0,0]=4 299 B11R1.167 O=C(O)C1=CC(Br)=CN=C1Cl WS-02E-001 [0,2,0,0,0,0|2,0,0]=4 300 B11R1.167 O=C(O)C1=CC(Br)=CN=C1O ACI-00110 [0,2,0,0,0,0|2,0,0]=4 301 B11R1.167 O=C(O)C1=CC(Cl)=CN=C1Cl ACI-00301 [0,2,0,0,0,0|2,0,0]=4 302 B11R1.167 O=C(O)C1=CC(Cl)=CN=C1O WS-01E-001 [0,2,0,0,0,0|2,0,0]=4 303 B11R1.167 O=C(O)C1=CC(F)=CN=C1Cl ACI-00426 [0,2,0,0,0,0|2,0,0]=4 304 B11R1.167 O=[N+]([O-])C1=C(O)C=CC(O)=C1 ACI-06427a [0,2,0,0,0,0|2,0,0]=4 305 B11R1.74 CC1=CC(C(=O)O)=CC(Cl)=N1 ACI-NI-00398 [0,2,0,0,0,0|2,0,0]=4 306 B11R1.74 NC(=O)C1=CC(Cl)=NC(Cl)=C1 ACI-05360 [0,2,0,0,0,0|2,0,0]=4 307 B11R1.74 O=C(Cl)C1=CC(Cl)=NC(Cl)=C1 ACI-00299 [0,2,0,0,0,0|2,0,0]=4 308 B11R1.74 O=C(O)C1=CC(Cl)=NC(Cl)=C1 ACI-01834 [0,2,0,0,0,0|2,0,0]=4 309 B11R1.266 COC1=CC(C(=N)N)=CC=C1 ACI-NI-00259 [0,2,0,0,0,0|2,0,0]=4 310 B11R1.266 COC1=CC(C(C)=O)=NC=C1 ACI-00419 [0,2,0,0,0,0|1,0,0]=3 311 B11R1.266 COC1=CC(C(N)=S)=CC=C1 ACI-NI-00260 [0,2,0,0,0,0|1,1,0]=4 312 B11R1.266 COC1=CC=NC(C(=O)O)=C1 ACI-NI-00709 [0,2,0,0,0,0|2,0,0]=4 313 B11R1.266 N#CC1=CC(C(=N)N)=CC=C1 RH-08J-001 [0,2,0,0,0,0|2,0,0]=4 314 B11R1.266 N#CC1=CC=CC(C(=N)N)=C1 ACI-00228 [0,2,0,0,0,0|2,0,0]=4 315 B11R1.266 NC(=O)C1=CC(CCl)=CC=C1 ACI-00304 [0,2,0,0,0,0|1,0,0]=3 316 B11R1.266 O=C(Cl)C1=CC=CC(CCl)=C1 ACI-01623 [0,2,0,0,0,0|1,0,0]=3 317 B11R2.10 ClC1=NC2=C(C=CC=C2)N1 ACI-00930 [0,0,0,1,0,1|2,0,0]=4 318 B11R2.10 S=C1CC2=CC=CC=C2N1 ACI-00937 [0,0,0,1,0,1|0,1,0]=3 319 B11R2.10 SC1=NC2=C(C=CC=C2)S1 ACI-01509 [0,0,0,1,0,1|1,1,0]=4 320 B11R2.1 BrC1=CSC2=C1C=CC=C2 ACI-00699 [0,1,0,1,0,0|1,0,1]=4 321 B11R2.1 CC1=COC2=C1C=CC=C2 ACI-01521 [0,1,0,1,0,0|0,0,1]=3 322 B11R2.1 CC1=CSC2=C1C=CC=C2 ACI-02476 [0,1,0,1,0,0|0,1,0]=3 323 B11R2.1 CN1CCC2=CC=CC=C21 JM-06J-001 [0,1,0,1,0,0|2,0,0]=4 324 B11R2.1 NC1=NNC2=C1C=CC=C2 ACI-NI-00387 [0,1,0,1,0,0|2,0,0]=4 325 B11R2.1 OC1=NOC2=C1C=CC=C2 ACI-00380 [0,1,0,1,0,0|1,0,1]=4 326 B7R1.1 O=CC1=CC=NO1 ACI-04961 [1,0,0,0,1,0|2,0,0]=4 327 B7R1.1 O=CC1=CC=NS1 ACI-NI-00774 [1,0,0,0,1,0|2,0,0]=4 328 B11R1.91 CC(=O)COC1=CC=CC=C1 ACI-01577 [0,0,0,0,0,2|0,0,0]=2 329 B11R1.91 N=C(N)COC1=CC=CC=C1 ACI-05139 [0,0,0,0,0,2|2,0,0]=4 330 B11R1.91 N=C(N)NCC1=CC=CC=C1 ACI-01687 [0,0,0,0,0,2|2,0,0]=4 331 B11R1.91 NC(N)=NCC1=CC=CC=C1 ACI-00071 [0,0,0,0,0,2|2,0,0]=4 332 B11R1.91 O=C(O)COC1=CC=C[NH+]=C1 WS-05B-008 [0,0,0,0,0,2|2,0,0]=4 333 B11R1.91 O=C(O)\C=C\C1=CC=NC=C1 ACI-01372 [0,0,0,0,0,2|2,0,0]=4