0 B10R1.61 CC1=C(C(N)=O)C=NC=C1 JM-11J-002 [0,0,0,0,0,0|3,0,0]=3 1 B10R1.61 CC1=CC=CN=C1C(=N)N ACI-02503 [0,0,0,0,0,0|4,0,0]=4 2 B10R1.61 CC1=CC=CN=C1C(N)=O ACI-01402 [0,0,0,0,0,0|3,0,0]=3 3 B10R1.61 CC1=CN=CC=C1C(=N)N ACI-02506 [0,0,0,0,0,0|4,0,0]=4 4 B10R1.61 CC1=NC=CN=C1C(=O)O ACI-02629 [0,0,0,0,0,0|4,0,0]=4 5 B10R1.61 CS(=O)C1=C(I)C=CC=C1 RH-10K-001 [0,0,0,0,0,0|2,0,0]=2 6 B10R1.61 N=C(N)C1=C(Br)C=CC=C1 ACI-NI-00396 [0,0,0,0,0,0|3,0,0]=3 7 B10R1.61 N=C(N)C1=C(F)C=CC=C1 ACI-NI-00227 [0,0,0,0,0,0|3,0,0]=3 8 B10R1.61 NC(=O)C1=C(Cl)C=CC=N1 ACI-05458 [0,0,0,0,0,0|3,0,0]=3 9 B10R1.61 NC(=O)C1=CC=CC=C1Br ACI-05397 [0,0,0,0,0,0|2,0,0]=2 10 B10R1.61 NC(=O)C1=CC=CN=C1Cl ACI-05357 [0,0,0,0,0,0|3,0,0]=3 11 B10R1.61 NC(=O)C1=CC=CN=C1F ACI-05446 [0,0,0,0,0,0|3,0,0]=3 12 B10R1.61 NC(=O)C1=CC=NC=C1F ACI-05445 [0,0,0,0,0,0|3,0,0]=3 13 B10R1.61 NC(=O)C1=NC=CC=C1F ACI-05448 [0,0,0,0,0,0|3,0,0]=3 14 B10R1.61 NC(=S)C1=C(Br)C=CC=C1 ACI-NI-00219 [0,0,0,0,0,0|2,1,0]=3 15 B10R1.61 NC(=S)C1=C(F)C=CC=C1 ACI-NI-00228 [0,0,0,0,0,0|2,1,0]=3 16 B10R1.61 NC1=C(C(=O)O)C=CN=C1 ACI-00348 [0,0,0,0,0,0|2,0,0]=2 17 B10R1.61 NC1=NC=CC=C1C(=O)O ACI-04973 [0,0,0,0,0,0|2,0,0]=2 18 B10R1.61 O=C(Cl)C1=CC=CC=C1Br ACI-01723 [0,0,0,0,0,0|2,0,0]=2 19 B10R1.61 O=C(Cl)C1=CC=CN=C1Cl ACI-NI-00466 [0,0,0,0,0,0|3,0,0]=3 20 B10R1.61 O=C(Cl)C1=CC=CN=C1F ACI-03845 [0,0,0,0,0,0|3,0,0]=3 21 B10R1.61 O=C(Cl)C1=CC=NC=C1F ACI-03843 [0,0,0,0,0,0|3,0,0]=3 22 B10R1.61 O=C(Cl)C1=NC=CC=C1Cl ACI-04861 [0,0,0,0,0,0|3,0,0]=3 23 B10R1.61 O=C(Cl)C1=NC=CC=C1F ACI-03849 [0,0,0,0,0,0|3,0,0]=3 24 B10R1.61 O=C(O)C1=C(Cl)C=CN=C1 ACI-00044 [0,0,0,0,0,0|3,0,0]=3 25 B10R1.61 O=C(O)C1=CC=CN=C1O ACI-01430 [0,0,0,0,0,0|3,0,0]=3 26 B10R1.61 O=[N+]([O-])C1=C(Cl)C=CN=C1 ACI-00997 [0,0,0,0,0,0|4,0,0]=4 27 B10R1.61 O=[N+]([O-])C1=CC=CN=C1S WS-04C-008 [0,0,0,0,0,0|4,0,0]=4 28 B9R1.6 N=C(N)C1=CC=CC=N1 ACI-NI-00265 [1,0,0,0,0,0|3,0,0]=4 29 B9R1.6 N=C(N)C1=CC=CN=C1 ACI-00003 [1,0,0,0,0,0|3,0,0]=4 30 B9R1.6 N=C(N)C1=CC=NC=C1 ACI-NI-00269 [1,0,0,0,0,0|3,0,0]=4 31 B9R1.6 NC(=S)C1=CC=CC=N1 ACI-NI-00266 [1,0,0,0,0,0|2,1,0]=4 32 B9R1.15 CNC1=CC=CC=C1O ACI-05339 [1,0,0,0,0,0|2,0,0]=3 33 B9R1.15 COC1=C(Br)C=NC=C1 ACI-06376 [1,0,0,0,0,0|3,0,0]=4 34 B9R1.15 COC1=C(Br)C=NC=C1 ACI-06377 [1,0,0,0,0,0|3,0,0]=4 35 B9R1.15 COC1=CC=CN=C1Br ACI-01447 [1,0,0,0,0,0|3,0,0]=4 36 B9R1.15 ClCC1=CC=CC=C1Br ACI-03860 [1,0,0,0,0,0|2,0,1]=4 37 B9R1.15 NCC1=CC=CC=C1O ACI-02209 [1,0,0,0,0,0|2,0,1]=4 38 B9R1.15 O=CC1=CC=CN=C1Br WS-02K-001 [1,0,0,0,0,0|2,0,0]=3 39 B9R1.15 O=CC1=CC=CN=C1Cl WS-02I-001 [1,0,0,0,0,0|2,0,0]=3 40 B11R1.53 CCC1=CC=CC=C1C(=O)Cl FD-10K-001 [0,1,0,0,0,0|2,0,0]=3 41 B11R1.53 CCC1=CC=CC=C1C(N)=O ACI-05454 [0,1,0,0,0,0|2,0,0]=3 42 B11R1.53 COC1=C(C(=N)N)C=CC=C1 ACI-NI-00256 [0,1,0,0,0,0|3,0,0]=4 43 B11R1.53 COC1=C(C(N)=S)C=CC=C1 ACI-NI-00257 [0,1,0,0,0,0|2,1,0]=4 44 B11R1.53 COC1=CC=CC=C1C(C)=O ACI-05712 [0,1,0,0,0,0|1,0,0]=2 45 B11R1.53 COC1=NC=CC=C1C(=O)O WS-05C-008 [0,1,0,0,0,0|3,0,0]=4 46 B11R1.53 CSC1=NC=CC=C1C(=O)O ACI-01817 [0,1,0,0,0,0|3,0,0]=4 47 B11R1.53 O=C(Cl)C1=CC=CC=C1CCl ACI-01786 [0,1,0,0,0,0|2,0,0]=3 48 B11R1.87 NS(=O)(=O)C1=CC=CC=C1Br ACI-04503 [0,1,0,0,0,0|3,0,0]=4 49 B11R1.87 NS(=O)(=O)C1=CC=CC=C1F ACI-04508 [0,1,0,0,0,0|3,0,0]=4 50 B11R1.87 NS(=O)(=O)C1=CC=CC=C1I ACI-04502 [0,1,0,0,0,0|3,0,0]=4 51 B11R1.87 O=S(=O)(Cl)C1=CC=CC=C1Br ACI-NI-00185 [0,1,0,0,0,0|3,0,0]=4 52 B11R1.87 O=S(=O)(Cl)C1=CC=CC=C1F ACI-NI-00276 [0,1,0,0,0,0|3,0,0]=4 53 B11R1.87 O=S(=O)(Cl)C1=CC=CC=C1I ACI-NI-00057 [0,1,0,0,0,0|3,0,0]=4 54 B11R1.156 CC1=C(C(=O)Cl)C(Cl)=NC=C1 WS-04B-006 [0,1,0,0,0,0|3,0,0]=4 55 B11R1.156 CC1=C(C(=O)O)C(Br)=NC=C1 WS-04F-001 [0,1,0,0,0,0|3,0,0]=4 56 B11R1.156 CC1=C(C(=O)O)C(Cl)=NC=C1 ACI-00846 [0,1,0,0,0,0|3,0,0]=4 57 B11R1.156 CC1=C(C(=O)O)C(O)=NC=C1 ACI-01234 [0,1,0,0,0,0|3,0,0]=4 58 B11R1.156 CC1=C(C(N)=O)C(Cl)=NC=C1 ACI-05383 [0,1,0,0,0,0|3,0,0]=4 59 B11R1.159 N=C(N)C1=C(Cl)C(Cl)=CC=C1 ACI-03947 [0,1,0,0,0,0|3,0,0]=4 60 B11R1.159 NC(=O)C1=C(Cl)C(Cl)=CC=C1 ACI-03957 [0,1,0,0,0,0|2,0,0]=3 61 B11R1.159 O=C(Cl)C1=C(Cl)C(Cl)=CC=C1 ACI-03968 [0,1,0,0,0,0|2,0,0]=3 62 B11R1.159 O=C(O)C1=CC=CC(I)=C1F ACI-06373 [0,1,0,0,0,0|2,0,0]=3 63 B11R1.166 CC(=O)C1=CN=C(N)N=C1C ACI-00090 [0,1,0,0,0,0|3,0,0]=4 64 B11R1.166 CC1=C(C(=N)N)C=CC(Br)=C1 ACI-03944 [0,1,0,0,0,0|3,0,0]=4 65 B11R1.166 CC1=C(C(=O)Cl)C=CC(Br)=C1 ACI-03965 [0,1,0,0,0,0|2,0,0]=3 66 B11R1.166 CC1=C(C(N)=O)C=CC(Br)=C1 ACI-03955 [0,1,0,0,0,0|2,0,0]=3 67 B11R1.166 CC1=C(N(C)C)C=CC(Br)=C1 ACI-06402 [0,1,0,0,0,0|3,0,0]=4 68 B11R1.166 CC1=CC=C(C(=O)Cl)C(Br)=C1 ACI-01767 [0,1,0,0,0,0|2,0,0]=3 69 B11R1.166 CC1=CC=C(C(N)=O)C(Br)=C1 ACI-05403 [0,1,0,0,0,0|2,0,0]=3 70 B11R1.166 CC1=CC=C(C(N)=O)C(Cl)=N1 ACI-05353 [0,1,0,0,0,0|3,0,0]=4 71 B11R1.166 CC1=CN=C(C(N)=O)C(N)=C1 WS-03K-001 [0,1,0,0,0,0|2,0,0]=3 72 B11R1.166 N=C(N)C1=C(F)C=C(Br)C=C1 ACI-03945 [0,1,0,0,0,0|3,0,0]=4 73 B11R1.166 N=C(N)C1=C(F)C=C(F)C=C1 ACI-00232 [0,1,0,0,0,0|3,0,0]=4 74 B11R1.166 NC(=O)C1=C(F)C=C(Br)C=C1 ACI-03956 [0,1,0,0,0,0|2,0,0]=3 75 B11R1.166 NC(=O)C1=CC=C(Br)C=C1Cl ACI-05399 [0,1,0,0,0,0|2,0,0]=3 76 B11R1.166 O=C(Cl)C1=C(F)C=C(Br)C=C1 ACI-03966 [0,1,0,0,0,0|2,0,0]=3 77 B11R1.166 O=C(Cl)C1=CC=C(Br)C=C1Cl ACI-01735 [0,1,0,0,0,0|2,0,0]=3 78 B11R1.166 O=C(O)C1=CC=C(O)N=C1Cl ACI-00424 [0,1,0,0,0,0|3,0,0]=4 79 B11R1.166 O=[N+]([O-])C1=C(Br)C=C(Cl)C=C1 ACI-02454 [0,1,0,0,0,0|3,0,0]=4 80 B11R1.167 N=C(N)C1=C(F)C=CC(Cl)=C1 ACI-03948 [0,1,0,0,0,0|3,0,0]=4 81 B11R1.167 NC(=O)C1=C(F)C=CC(Cl)=C1 ACI-03958 [0,1,0,0,0,0|2,0,0]=3 82 B11R1.167 NC(=O)C1=CC(Br)=CC=C1Cl ACI-05398 [0,1,0,0,0,0|2,0,0]=3 83 B11R1.167 NC(=O)C1=CC(Br)=CN=C1Cl ACI-05394 [0,1,0,0,0,0|3,0,0]=4 84 B11R1.167 NC(=O)C1=CC(Cl)=CN=C1Cl ACI-05358 [0,1,0,0,0,0|3,0,0]=4 85 B11R1.167 NC1=C(C(=O)O)C=C(Br)C=N1 ACI-00984 [0,1,0,0,0,0|2,0,0]=3 86 B11R1.167 NC1=C(C(=O)O)C=C(F)N=C1 ACI-06269 [0,1,0,0,0,0|2,0,0]=3 87 B11R1.167 NC1=CC=C(I)C=C1[N+](=O)[O-] ACI-01595 [0,1,0,0,0,0|2,0,0]=3 88 B11R1.167 NC1=CN=C(Cl)C=C1C(=O)O JM-04I-008 [0,1,0,0,0,0|2,0,0]=3 89 B11R1.167 NC1=NC=C(Br)C=C1C(=O)O WS-02D-005 [0,1,0,0,0,0|2,0,0]=3 90 B11R1.167 NC1=NC=C(I)C=C1C(=O)O WS-02E-004 [0,1,0,0,0,0|2,0,0]=3 91 B11R1.167 O=C(Cl)C1=C(F)C=CC(Cl)=C1 ACI-03970 [0,1,0,0,0,0|2,0,0]=3 92 B11R1.167 O=C(Cl)C1=CC(Br)=CC=C1Cl ACI-01732 [0,1,0,0,0,0|2,0,0]=3 93 B11R1.167 O=C(Cl)C1=CC(Br)=CN=C1Cl WS-02E-092 [0,1,0,0,0,0|3,0,0]=4 94 B11R1.167 O=C(Cl)C1=CC(Cl)=CN=C1Cl ACI-00222 [0,1,0,0,0,0|3,0,0]=4 95 B11R1.167 O=C(O)C1=CC(Br)=CN=C1Cl WS-02E-001 [0,1,0,0,0,0|3,0,0]=4 96 B11R1.167 O=C(O)C1=CC(Br)=CN=C1O ACI-00110 [0,1,0,0,0,0|3,0,0]=4 97 B11R1.167 O=C(O)C1=CC(Cl)=CN=C1Cl ACI-00301 [0,1,0,0,0,0|3,0,0]=4 98 B11R1.167 O=C(O)C1=CC(Cl)=CN=C1O WS-01E-001 [0,1,0,0,0,0|3,0,0]=4 99 B11R1.167 O=C(O)C1=CC(F)=CN=C1Cl ACI-00426 [0,1,0,0,0,0|3,0,0]=4 100 B11R1.167 O=[N+]([O-])C1=C(O)C=CC(O)=C1 ACI-06427a [0,1,0,0,0,0|3,0,0]=4 101 B11R1.222 CCC(=O)C1=CC=CC=C1Br ACI-04019 [0,1,0,0,0,0|1,0,0]=2 102 B11R1.222 CCC(=O)C1=CC=CC=C1Cl ACI-04018 [0,1,0,0,0,0|1,0,0]=2 103 B11R1.222 COC(=O)C1=C(Cl)C=CN=C1 ACI-NI-00119 [0,1,0,0,0,0|2,0,0]=3 104 B11R1.222 COC(=O)C1=C(N)C=NC=C1 SB-05G-001 [0,1,0,0,0,0|1,0,0]=2 105 B11R1.222 COC(=O)C1=CC=CN=C1Br ACI-01378 [0,1,0,0,0,0|2,0,0]=3 106 B11R1.222 COC(=O)C1=CC=CN=C1Cl ACI-01376 [0,1,0,0,0,0|2,0,0]=3 107 B11R1.222 COC(=O)C1=CC=CN=C1O JM-04F-050 [0,1,0,0,0,0|2,0,0]=3 108 B11R1.222 NNC(=O)C1=CC=CC=C1Br ACI-01722 [0,1,0,0,0,0|2,0,0]=3 109 B11R1.222 NNC(=O)C1=CC=CC=C1F ACI-01726 [0,1,0,0,0,0|2,0,0]=3 110 B11R2.1 BrC1=CSC2=C1C=CC=C2 ACI-00699 [0,0,0,1,0,0|2,0,1]=4 111 B11R2.1 CC1=COC2=C1C=CC=C2 ACI-01521 [0,0,0,1,0,0|2,0,0]=3 112 B11R2.1 CC1=CSC2=C1C=CC=C2 ACI-02476 [0,0,0,1,0,0|2,0,0]=3 113 B11R2.1 CN1CCC2=CC=CC=C21 JM-06J-001 [0,0,0,1,0,0|3,0,0]=4 114 B11R2.1 NC1=NNC2=C1C=CC=C2 ACI-NI-00387 [0,0,0,1,0,0|2,0,0]=3 115 B11R2.1 NC1=NNC2=NC=CC=C12 ACI-04391 [0,0,0,1,0,0|3,0,0]=4 116 B11R2.1 OC1=NOC2=C1C=CC=C2 ACI-00380 [0,0,0,1,0,0|2,0,1]=4 117 B9R1.41 CC1=C(C(=O)Cl)C=CO1 RH-11J-001 [0,0,0,0,1,0|3,0,0]=4 118 B9R1.41 CC1=C(C(N)=O)C=CO1 RH-11A-003 [0,0,0,0,1,0|3,0,0]=4 119 B9R1.41 CC1=C(C(N)=O)OC=C1 JM-11A-005 [0,0,0,0,1,0|3,0,0]=4 120 B9R1.41 O=C(O)C1=C(Br)C=CS1 ACI-00956 [0,0,0,0,1,0|3,0,0]=4 121 B11R1.86 CC(=O)CC1=C(C)C=CC=C1 ACI-05057 [0,0,0,0,0,1|1,0,0]=2 122 B11R1.86 CC1=CC=CC=C1CC(=O)Cl ACI-05798 [0,0,0,0,0,1|2,0,0]=3 123 B11R1.86 NC(=O)CC1=C(I)C=CC=C1 ACI-05460 [0,0,0,0,0,1|2,0,0]=3 124 B11R1.86 NC(=S)CC1=CC=CC=C1Br ACI-NI-00198 [0,0,0,0,0,1|2,1,0]=4 125 B11R1.86 NC(=S)NC1=CC=CC=C1Cl ACI-00828 [0,0,0,0,0,1|2,1,0]=4 126 B11R1.86 O=C(Cl)CC1=C(F)C=CC=C1 ACI-05793 [0,0,0,0,0,1|2,0,0]=3 127 B11R1.86 O=C(Cl)CC1=C(I)C=CC=C1 ACI-05161 [0,0,0,0,0,1|2,0,0]=3 128 B8R1.5 NC1=CC=CN=C1Cl ACI-00447 [2,0,0,0,0,0|2,0,0]=4 129 B10R1.13 CC(=O)C1=CC=C(Cl)N=C1 ACI-NI-00400 [1,1,0,0,0,0|1,0,0]=3 130 B10R1.13 CC1=CC=C(C(=N)N)C=C1 ACI-00494 [1,1,0,0,0,0|2,0,0]=4 131 B10R1.13 CC1=CC=C(C(N)=O)C=N1 ACI-NI-00764 [1,1,0,0,0,0|2,0,0]=4 132 B10R1.13 CC1=CN=C(C(=O)O)C=C1 RH-05J-001 [1,1,0,0,0,0|2,0,0]=4 133 B10R1.13 N=C(N)C1=CC=C(Br)C=C1 ACI-NI-00221 [1,1,0,0,0,0|2,0,0]=4 134 B10R1.13 N=C(N)C1=CC=C(Cl)C=C1 ACI-01689 [1,1,0,0,0,0|2,0,0]=4 135 B10R1.13 N=C(N)C1=CC=C(F)C=C1 ACI-NI-00230 [1,1,0,0,0,0|2,0,0]=4 136 B10R1.13 NC(=O)C1=CC=C(Cl)N=C1 ACI-05362 [1,1,0,0,0,0|2,0,0]=4 137 B10R1.13 NC(=O)C1=CC=C(F)C=C1 ACI-05410 [1,1,0,0,0,0|1,0,0]=3 138 B10R1.13 NC(=O)C1=CC=C(F)N=C1 ACI-05369 [1,1,0,0,0,0|2,0,0]=4 139 B10R1.13 NC(=O)C1=NC=C(Br)C=C1 ACI-05390 [1,1,0,0,0,0|2,0,0]=4 140 B10R1.13 NC(=O)C1=NC=C(F)C=C1 ACI-05447 [1,1,0,0,0,0|2,0,0]=4 141 B10R1.13 NC(=S)C1=CC=C(Br)C=C1 ACI-NI-00222 [1,1,0,0,0,0|1,1,0]=4 142 B10R1.13 NC(=S)C1=CC=C(F)C=C1 ACI-NI-00231 [1,1,0,0,0,0|1,1,0]=4 143 B10R1.13 O=C(Cl)C1=CC=C(Cl)N=C1 ACI-00319 [1,1,0,0,0,0|2,0,0]=4 144 B10R1.13 O=C(Cl)C1=CN=C(F)C=C1 ACI-00437 [1,1,0,0,0,0|2,0,0]=4 145 B10R1.13 O=C(Cl)C1=NC=C(Br)C=C1 ACI-01622 [1,1,0,0,0,0|2,0,0]=4 146 B10R1.13 O=C(Cl)C1=NC=C(F)C=C1 ACI-03847 [1,1,0,0,0,0|2,0,0]=4 147 B10R1.13 O=C(O)C1=CC=C(I)N=C1 ACI-05589 [1,1,0,0,0,0|2,0,0]=4 148 B10R1.13 O=C(O)C1=CN=C(F)C=C1 ACI-00439 [1,1,0,0,0,0|2,0,0]=4 149 B10R1.13 O=C(O)C1=NC=C(Br)C=C1 ACI-01682 [1,1,0,0,0,0|2,0,0]=4 150 B10R1.15 COC(=N)C1=CC=CC=C1 ACI-15283 [1,1,0,0,0,0|1,0,0]=3 151 B10R1.15 NNC(=O)C1=CC=CC=C1 ACI-01630 [1,1,0,0,0,0|1,0,0]=3 152 B10R1.15 N\C(=N/O)C1=CC=CC=C1 ACI-00072 [1,1,0,0,0,0|1,0,1]=4 153 B10R1.15 O=C(CBr)C1=CC=CN=C1 ACI-NI-00021 [1,1,0,0,0,0|1,0,0]=3 154 B10R1.15 O=C(CBr)C1=CC=NC=C1 ACI-NI-00022 [1,1,0,0,0,0|1,0,0]=3 155 B10R1.15 O=C(CBr)C1=NC=CC=C1 ACI-NI-00023 [1,1,0,0,0,0|1,0,0]=3 156 B10R1.15 O=C(NO)C1=CC=CC=C1 ACI-01576 [1,1,0,0,0,0|1,0,0]=3 157 B10R1.15 O\N=C(/Cl)C1=CC=CC=C1 RH-11K-001 [1,1,0,0,0,0|1,0,1]=4 158 B10R1.113 CC(=O)C1=CC=NC(N)=N1 ACI-05038 [1,1,0,0,0,0|2,0,0]=4 159 B10R1.113 CC(=O)C1=NC(Br)=CC=C1 WS-05F-004 [1,1,0,0,0,0|1,0,0]=3 160 B10R1.113 CC(=O)C1=NC=CC(Br)=C1 ACI-04001 [1,1,0,0,0,0|1,0,0]=3 161 B10R1.113 CC(=O)C1=NC=CC(Cl)=C1 ACI-00417 [1,1,0,0,0,0|1,0,0]=3 162 B10R1.113 N=C(N)C1=CC=CC(Br)=C1 ACI-NI-00224 [1,1,0,0,0,0|2,0,0]=4 163 B10R1.113 N=C(N)C1=CC=CC(Cl)=C1 ACI-NI-00236 [1,1,0,0,0,0|2,0,0]=4 164 B10R1.113 N=C(N)C1=CC=CC(F)=C1 ACI-NI-00233 [1,1,0,0,0,0|2,0,0]=4 165 B10R1.113 NC(=O)C1=CC(Br)=CN=C1 ACI-00462 [1,1,0,0,0,0|2,0,0]=4 166 B10R1.113 NC(=O)C1=CC(Cl)=NC=C1 ACI-05361 [1,1,0,0,0,0|2,0,0]=4 167 B10R1.113 NC(=O)C1=CC(F)=CC=C1 ACI-03952 [1,1,0,0,0,0|1,0,0]=3 168 B10R1.113 NC(=O)C1=CC(F)=NC=C1 ACI-05368 [1,1,0,0,0,0|2,0,0]=4 169 B10R1.113 NC(=O)C1=NC(F)=CC=C1 ACI-05444 [1,1,0,0,0,0|2,0,0]=4 170 B10R1.113 NC(=S)C1=CC=CC(Br)=C1 ACI-NI-00225 [1,1,0,0,0,0|1,1,0]=4 171 B10R1.113 NC(=S)C1=CC=CC(Cl)=C1 ACI-NI-00237 [1,1,0,0,0,0|1,1,0]=4 172 B10R1.113 NC(=S)C1=CC=CC(F)=C1 ACI-NI-00234 [1,1,0,0,0,0|1,1,0]=4 173 B10R1.113 NC1=NC(C(=O)O)=CC=C1 ACI-04969 [1,1,0,0,0,0|2,0,0]=4 174 B10R1.113 O=C(Cl)C1=CC(Cl)=NC=C1 ACI-00306 [1,1,0,0,0,0|2,0,0]=4 175 B10R1.113 O=C(Cl)C1=CC(F)=CC=C1 ACI-03964 [1,1,0,0,0,0|1,0,0]=3 176 B10R1.113 O=C(Cl)C1=CC(F)=CN=C1 ACI-05622 [1,1,0,0,0,0|2,0,0]=4 177 B10R1.113 O=C(Cl)C1=CC(F)=NC=C1 ACI-00434 [1,1,0,0,0,0|2,0,0]=4 178 B10R1.113 O=C(Cl)C1=NC(F)=CC=C1 ACI-03839 [1,1,0,0,0,0|2,0,0]=4 179 B10R1.113 O=C(O)C1=CC(Cl)=NC=C1 ACI-00312 [1,1,0,0,0,0|2,0,0]=4 180 B10R1.113 O=C(O)C1=CC(F)=NC=C1 ACI-00436 [1,1,0,0,0,0|2,0,0]=4 181 B10R1.113 O=C(O)C1=NC(F)=CC=C1 ACI-02728 [1,1,0,0,0,0|2,0,0]=4 182 B10R1.2 COC1=CC=CC(N)=C1N WS-05L-004 [1,1,0,0,0,0|1,0,0]=3 183 B10R1.20 C=CC1=NC=CC=C1C=O ACI-01425 [1,1,0,0,0,0|2,0,0]=4 184 B10R1.20 O=CC1=CC=CC=C1CBr ACI-05244 [1,1,0,0,0,0|1,0,0]=3 185 B10R1.30 COC1=CC(N)=CC=C1F ACI-05283 [1,1,0,0,0,0|2,0,0]=4 186 B10R1.30 O=CC1=CC(Br)=CN=C1Cl WS-02G-001 [1,1,0,0,0,0|2,0,0]=4 187 B10R1.30 O=CC1=CC(Cl)=CC=C1F ACI-00824 [1,1,0,0,0,0|1,0,0]=3 188 B10R1.30 O=CC1=CC(Cl)=CN=C1Cl ACI-00225 [1,1,0,0,0,0|2,0,0]=4 189 B10R1.149 COC(=O)C1=C(O)C=CS1 ACI-00880 [0,1,0,0,1,0|2,0,0]=4 190 B10R1.149 COC(=O)C1=CSC=C1N JL-11K-001 [0,1,0,0,1,0|1,0,0]=3 191 B10R1.149 COC(=O)C1=CSC=C1N JL-11K-003 [0,1,0,0,1,0|1,0,0]=3 192 B12R1.124 CC(C(=O)O)C1=CC=CC=C1O ACI-04385 [0,1,0,0,0,1|2,0,0]=4 193 B12R1.127 CC(=S)NC1=CC(Br)=CC=C1Br ACI-00884 [0,1,0,0,0,1|1,1,0]=4 194 B12R1.233 CC(=O)CC1=C(C)C=C(Cl)C=C1 ACI-05056 [0,1,0,0,0,1|1,0,0]=3 195 B12R1.233 O=C(Cl)CC1=C(F)C=C(F)C=C1 ACI-05792 [0,1,0,0,0,1|2,0,0]=4 196 B12R1.233 O=C(Cl)CC1=CC=C(Cl)C=C1Cl ACI-05796 [0,1,0,0,0,1|2,0,0]=4 197 B12R1.371 COC(=O)CC1=CC=CC=C1Br ACI-01581 [0,1,0,0,0,1|1,0,0]=3 198 B12R1.1009 CC(C)SC1=C(Cl)C=CC=C1N RH-05K-064 [0,1,0,0,0,1|1,0,1]=4 199 B12R1.1009 NC(=O)CC1=C(F)C=CC=C1Cl ACI-05457 [0,1,0,0,0,1|2,0,0]=4 200 B12R1.1009 O=C(Cl)CC1=C(Cl)C=CC=C1Cl ACI-05797 [0,1,0,0,0,1|2,0,0]=4 201 B12R1.1009 O=C(Cl)CC1=C(F)C=CC=C1Cl JL-11B-001 [0,1,0,0,0,1|2,0,0]=4 202 B12R1.57 NNC1=NC(Cl)=CC=C1C(=O)O SB-16B-001 [0,2,0,0,0,0|2,0,0]=4 203 B12R1.77 CCC(=O)C1=CC=CC=C1OC ACI-04020 [0,2,0,0,0,0|1,0,0]=3 204 B12R1.283 N#CCC1=CC=CC=C1C(=O)O ACI-02228 [0,2,0,0,0,0|1,0,1]=4 205 B12R1.195 CNS(=O)(=O)C1=CC=CC=C1Br ACI-06024 [0,2,0,0,0,0|2,0,0]=4 206 B12R1.195 CNS(=O)(=O)C1=CC=CC=C1F ACI-06030 [0,2,0,0,0,0|2,0,0]=4 207 B12R1.195 CNS(=O)(=O)C1=CC=CC=C1I ACI-06025 [0,2,0,0,0,0|2,0,0]=4 208 B12R1.894 O=C(O)C1=C(F)C(I)=CC=C1F ACI-04694 [0,2,0,0,0,0|2,0,0]=4 209 B12R1.1000 CC1=CC(F)=CC(C)=C1C(=O)Cl ACI-02131 [0,2,0,0,0,0|2,0,0]=4 210 B12R1.1000 CC1=CC(F)=CC(C)=C1C(N)=O ACI-05422 [0,2,0,0,0,0|2,0,0]=4 211 B12R1.1000 NC(=O)C1=C(F)C=C(Br)C=C1F ACI-05443 [0,2,0,0,0,0|2,0,0]=4 212 B12R1.1000 O=C(Cl)C1=C(F)C=C(Br)C=C1F JL-10B-002 [0,2,0,0,0,0|2,0,0]=4 213 B12R1.3441 COC(=O)C1=C(F)C=CC=C1O ACI-05666 [0,2,0,0,0,0|1,0,0]=3 214 B12R1.3441 COC(=O)C1=C(O)C=CC=C1O ACI-05667 [0,2,0,0,0,0|1,0,0]=3 215 B12R1.3441 O=C(CBr)C1=C(F)C=CC=C1F ACI-01719 [0,2,0,0,0,0|1,0,0]=3 216 B12R1.3441 O=C(NO)C1=C(F)C=CC=C1O ACI-05686 [0,2,0,0,0,0|2,0,0]=4 217 B12R1.3441 O=C(NO)C1=C(O)C=CC=C1O ACI-05687 [0,2,0,0,0,0|2,0,0]=4 218 B12R1.24 CC1=C(C(=O)NN)C=CC=C1I ACI-01768 [0,2,0,0,0,0|2,0,0]=4 219 B12R1.24 COC(=O)C1=C(O)C(N)=CC=C1 ACI-04221 [0,2,0,0,0,0|1,0,0]=3 220 B12R1.24 COC(=O)C1=CC=CC(Cl)=C1O ACI-05675 [0,2,0,0,0,0|1,0,0]=3 221 B12R1.24 COC(=O)C1=CC=CC(F)=C1O ACI-05676 [0,2,0,0,0,0|1,0,0]=3 222 B12R1.24 COC(=O)C1=CC=CC(O)=C1O ACI-05677 [0,2,0,0,0,0|1,0,0]=3 223 B12R1.24 NNC(=O)C1=C(F)C(F)=CC=C1 ACI-01758 [0,2,0,0,0,0|2,0,0]=4 224 B12R1.24 NNC(=O)C1=CC=CC(Cl)=C1Cl ACI-01763 [0,2,0,0,0,0|2,0,0]=4 225 B12R1.24 O=C(NO)C1=CC=CC(Cl)=C1O ACI-05695 [0,2,0,0,0,0|2,0,0]=4 226 B12R1.24 O=C(NO)C1=CC=CC(F)=C1O ACI-05696 [0,2,0,0,0,0|2,0,0]=4 227 B12R1.24 O=C(NO)C1=CC=CC(O)=C1O ACI-05697 [0,2,0,0,0,0|2,0,0]=4 228 B12R1.511 CC1=CC(C(=O)O)=C(Br)C(C)=C1 ACI-05601 [0,2,0,0,0,0|2,0,0]=4 229 B12R1.511 CC1=CC(I)=CC(C(=O)O)=C1N ACI-01860 [0,2,0,0,0,0|1,0,0]=3 230 B12R1.232 NC(=O)C1=C(F)C=C(F)C(F)=C1 ACI-03962 [0,2,0,0,0,0|2,0,0]=4 231 B12R1.232 NC1=C([N+](=O)[O-])C=C(F)C(Cl)=C1 ACI-00371 [0,2,0,0,0,0|2,0,0]=4 232 B12R1.232 O=C(Cl)C1=C(F)C=C(F)C(F)=C1 ACI-03973 [0,2,0,0,0,0|2,0,0]=4 233 B12R1.232 O=C(Cl)C1=CC(F)=C(Br)C=C1F ACI-06625 [0,2,0,0,0,0|2,0,0]=4 234 B12R1.232 O=C(O)C1=CC(F)=C(Br)C=C1F ACI-06624 [0,2,0,0,0,0|2,0,0]=4 235 B12R1.232 O=C(O)C1=CC(I)=C(F)C=C1F ACI-04695 [0,2,0,0,0,0|2,0,0]=4 236 B12R1.452 CSC1=CC=C(C(C)=O)C(Cl)=C1 ACI-01609 [0,2,0,0,0,0|1,0,0]=3 237 B12R1.1703 CC1=CC=C(C(=O)NN)C(Br)=C1 ACI-01765 [0,2,0,0,0,0|2,0,0]=4 238 B12R1.1703 CC1=CC=C(C(=O)NO)C(O)=C1 ACI-05693 [0,2,0,0,0,0|2,0,0]=4 239 B12R1.1703 COC(=O)C1=C(Br)C=C(F)C=C1 RH-15H-001 [0,2,0,0,0,0|1,0,0]=3 240 B12R1.1703 COC(=O)C1=C(Cl)C=C(Cl)C=N1 ACI-04831 [0,2,0,0,0,0|2,0,0]=4 241 B12R1.1703 COC(=O)C1=C(F)C=C(F)C=N1 ACI-04828 [0,2,0,0,0,0|2,0,0]=4 242 B12R1.1703 COC(=O)C1=C(O)C=C(Cl)C=C1 SB-12E-001 [0,2,0,0,0,0|1,0,0]=3 243 B12R1.1703 COC(=O)C1=CC=C(Br)C=C1F SB-05B-001 [0,2,0,0,0,0|1,0,0]=3 244 B12R1.1703 COC(=O)C1=CC=C(Br)C=C1O ACI-05682 [0,2,0,0,0,0|1,0,0]=3 245 B12R1.1703 COC(=O)C1=CC=C(C)C=C1O ACI-05673 [0,2,0,0,0,0|1,0,0]=3 246 B12R1.1703 COC(=O)C1=CC=C(C)N=C1Cl ACI-00873 [0,2,0,0,0,0|2,0,0]=4 247 B12R1.1703 COC(=O)C1=CC=C(F)C=C1O ACI-05670 [0,2,0,0,0,0|1,0,0]=3 248 B12R1.1703 COC(=O)C1=CC=C(F)N=C1F ACI-00472 [0,2,0,0,0,0|2,0,0]=4 249 B12R1.1703 COC(=O)C1=CC=C(O)C=C1O ACI-05671 [0,2,0,0,0,0|1,0,0]=3 250 B12R1.1703 NNC(=O)C1=C(F)C=C(F)C=C1 ACI-01740 [0,2,0,0,0,0|2,0,0]=4 251 B12R1.1703 NNC(=O)C1=CC=C(Br)C=C1Cl ACI-01733 [0,2,0,0,0,0|2,0,0]=4 252 B12R1.1703 O=C(NO)C1=C(O)C=C(Cl)C=C1 SB-12E-002 [0,2,0,0,0,0|2,0,0]=4 253 B12R1.1703 O=C(NO)C1=CC=C(Br)C=C1O ACI-05702 [0,2,0,0,0,0|2,0,0]=4 254 B12R1.1703 O=C(NO)C1=CC=C(F)C=C1O ACI-05690 [0,2,0,0,0,0|2,0,0]=4 255 B12R1.1703 O=C(NO)C1=CC=C(O)C=C1O ACI-05691 [0,2,0,0,0,0|2,0,0]=4 256 B12R1.354 CC1=CC=C(O)C(C(=O)NO)=C1 ACI-05701 [0,2,0,0,0,0|2,0,0]=4 257 B12R1.354 COC(=O)C1=C(C)C=CC(N)=C1 ACI-03786 [0,2,0,0,0,0|1,0,0]=3 258 B12R1.354 COC(=O)C1=CC(Br)=CN=C1C ACI-06404 [0,2,0,0,0,0|2,0,0]=4 259 B12R1.354 COC(=O)C1=CC(Br)=CN=C1Cl ACI-00874 [0,2,0,0,0,0|2,0,0]=4 260 B12R1.354 COC(=O)C1=CC(Br)=CN=C1O ACI-00875 [0,2,0,0,0,0|2,0,0]=4 261 B12R1.354 COC(=O)C1=CC(C)=CC=C1O ACI-05681 [0,2,0,0,0,0|1,0,0]=3 262 B12R1.354 COC(=O)C1=CC(Cl)=CC=C1O ACI-05678 [0,2,0,0,0,0|1,0,0]=3 263 B12R1.354 COC(=O)C1=CC(Cl)=CN=C1Cl ACI-01387 [0,2,0,0,0,0|2,0,0]=4 264 B12R1.354 COC(=O)C1=CC(I)=CC=C1O ACI-05680 [0,2,0,0,0,0|1,0,0]=3 265 B12R1.354 COC(=O)C1=CC(I)=CN=C1Cl ACI-01377 [0,2,0,0,0,0|2,0,0]=4 266 B12R1.354 COC(=O)C1=CC(I)=CN=C1O ACI-01006 [0,2,0,0,0,0|2,0,0]=4 267 B12R1.354 NNC(=O)C1=CC(Br)=CC=C1Cl ACI-01731 [0,2,0,0,0,0|2,0,0]=4 268 B12R1.354 NNC(=O)C1=CC(F)=CC=C1F ACI-01759 [0,2,0,0,0,0|2,0,0]=4 269 B12R1.354 O=C(NO)C1=CC(Cl)=CC=C1O ACI-05698 [0,2,0,0,0,0|2,0,0]=4 270 B12R1.354 O=C(NO)C1=CC(I)=CC=C1O ACI-05700 [0,2,0,0,0,0|2,0,0]=4 271 B12R1.308 CCOC(=O)C1=CC=CN=C1Cl ACI-01386 [0,2,0,0,0,0|2,0,0]=4 272 B12R1.308 CCOC(=O)C1=CC=CN=C1N ACI-04974 [0,2,0,0,0,0|1,0,0]=3 273 B12R1.308 N#CCC(=O)C1=CC=CC=C1Cl ACI-01607 [0,2,0,0,0,0|1,0,0]=3 274 B12R1.308 N#CCC(=O)C1=CC=CC=C1F ACI-01088 [0,2,0,0,0,0|1,0,0]=3 275 B12R1.308 O=C(N=C=S)C1=CC=CC=C1Cl ACI-01608 [0,2,0,0,0,0|1,0,1]=4 276 B12R1.308 O=CNC(=O)C1=CC=CC=C1O WS-02D-008 [0,2,0,0,0,0|1,0,1]=4 277 B10R1.66 CC(=O)\C=C\C1=CSC=C1 RH-05D-001 [0,0,1,1,0,0|2,0,0]=4 278 B10R1.31 CC(=O)C1=CNC(C=O)=C1 ACI-01337 [0,0,1,1,0,0|1,0,0]=3 279 B12R2.24 O=C1CNC2=CC=CC=C2O1 ACI-02216 [0,0,0,1,0,1|0,0,0]=2 280 B12R2.24 O=C1NC2=CC=CC=C2CO1 ACI-02206 [0,0,0,1,0,1|2,0,0]=4 281 B12R2.24 O=C1NCC2=CC=CC=C2O1 ACI-02210 [0,0,0,1,0,1|2,0,0]=4 282 B12R2.202 NC1=C2OC(=O)NC2=CC=C1 ACI-05945 [0,0,0,1,0,1|1,0,0]=3 283 B12R2.202 NC1=CC=CC2=C1NC(=O)N2 ACI-04839 [0,0,0,1,0,1|1,0,0]=3 284 B12R2.1081 S=C1NCCC2=CC=CC=C12 FD-10F-003 [0,1,0,1,0,0|1,1,0]=4 285 B12R2.2028 CC1CC(=O)C2=CC=CC=C21 JM-04K-002 [0,1,0,1,0,0|1,0,0]=3 286 B12R2.2403 CC1(C)CNC2=CC=CC=C21 ACI-02737 [0,1,0,1,0,0|1,0,1]=4 287 B12R2.612 NC1=NNC2=C1C=CC(Br)=C2 ACI-00934 [0,1,0,1,0,0|2,0,0]=4 288 B12R2.132 CC1=CSC2=CC=C(Br)C=C12 ACI-05326 [0,1,0,1,0,0|2,0,0]=4 289 B12R2.132 CC1=CSC2=CC=C(Cl)C=C12 JM-03G-003 [0,1,0,1,0,0|2,0,0]=4 290 B12R2.132 CC1=CSC2=CC=C(F)C=C12 JM-04J-011 [0,1,0,1,0,0|2,0,0]=4 291 B12R2.132 NC1=CC=C2CCC(=O)C2=C1 ACI-01589 [0,1,0,1,0,0|1,0,0]=3 292 B12R2.132 NC1=CC=C2COC(=O)C2=C1 RH-05C-010 [0,1,0,1,0,0|2,0,0]=4 293 B12R2.1 ClCC1=COC2=CC=CC=C12 ACI-05949 [0,1,0,1,0,0|2,0,0]=4 294 B12R2.1 N#CC1=CNC2=C1C=CC=C2 ACI-00379 [0,1,0,1,0,0|1,0,1]=4 295 B12R2.1 O=CC1=COC2=C1C=CC=C2 ACI-01517 [0,1,0,1,0,0|1,0,1]=4 296 B12R2.1 O=CC1=CSC2=C1C=CC=C2 ACI-00483 [0,1,0,1,0,0|1,0,1]=4 297 B12R2.1 OCC1=COC2=CC=CC=C12 ACI-05948 [0,1,0,1,0,0|2,0,0]=4 298 B12R2.18 CC1=C(Br)C2=C(C=CC=C2)S1 ACI-00954 [0,1,0,1,0,0|2,0,0]=4 299 B12R2.18 CC1CC2=C(C=CC=C2)C1=O JM-03H-001 [0,1,0,1,0,0|1,0,0]=3 300 B12R2.18 CN1C(=O)CC2=CC=CC=C21 RH-11F-002 [0,1,0,1,0,0|2,0,0]=4 301 B8R1.7 CC(=O)C1=CC=NN1 ACI-NI-00192 [1,0,0,0,1,0|2,0,0]=4 302 B8R1.7 NC(=O)C1=CC=CO1 ACI-02007 [1,0,0,0,1,0|2,0,0]=4 303 B8R1.7 NC(=O)C1=COC=C1 ACI-02522 [1,0,0,0,1,0|2,0,0]=4 304 B8R1.7 NC(=O)C1=CSC=C1 JM-03G-005 [1,0,0,0,1,0|2,0,0]=4 305 B8R1.7 O=C(Cl)C1=COC=C1 ACI-00295 [1,0,0,0,1,0|2,0,0]=4 306 B8R1.7 O=C(Cl)C1=CSC=C1 ACI-00297 [1,0,0,0,1,0|2,0,0]=4 307 B8R1.11 O=CC1=C(Br)C=CS1 ACI-00955 [1,0,0,0,1,0|2,0,0]=4 308 B8R1.11 O=CC1=C(Br)SC=C1 ACI-01273 [1,0,0,0,1,0|2,0,0]=4 309 B12R1.125 CC(=O)\C=C\C1=CC=CC=C1Cl ACI-00859 [0,0,0,0,0,2|1,0,0]=3 310 B12R1.125 CC1=CC=CC=C1\C=C\C(=O)O ACI-05912 [0,0,0,0,0,2|2,0,0]=4 311 B12R1.125 O=C(O)\C=C\C1=CC=CC=C1F ACI-05913 [0,0,0,0,0,2|2,0,0]=4