0 B9R1.35 C=C(C)C1=CC=C(Cl)S1 CS-0771684 [0,0,0,0,0,0|2,0,0]=2 1 B9R1.35 CC(=O)C1=CC(C)=CS1 CS-0186262 [0,0,0,0,0,0|2,0,0]=2 2 B9R1.35 CC(=O)C1=CC(C)=NO1 CS-0005606 [0,0,0,0,0,0|3,0,0]=3 3 B9R1.35 CC(=O)C1=CC=C(Br)N1 CS-0532787 [0,0,0,0,0,0|2,0,0]=2 4 B9R1.35 CC(=O)C1=CN(C)C=C1 CS-0204236 [0,0,0,0,0,0|2,0,0]=2 5 B9R1.35 CC(=O)C1=CNC(C)=C1 CS-0131727 [0,0,0,0,0,0|2,0,0]=2 6 B9R1.35 CC(=O)N1C=C(I)C=N1 CS-0067226 [0,0,0,0,0,0|4,0,0]=4 7 B9R1.35 CC(N)C1=CC=C(Cl)S1 CS-0022298 [0,0,0,0,0,0|2,0,1]=3 8 B9R1.35 CC1=CC=C(B(O)O)O1 CS-W001234 [0,0,0,0,0,0|2,1,1]=4 9 B9R1.35 CC1=CC=C(C(=N)N)O1 CS-0259647 [0,0,0,0,0,0|2,1,0]=3 10 B9R1.35 CC1=CC=C(C(=N)N)S1 CS-1166046 [0,0,0,0,0,0|2,0,0]=2 11 B9R1.35 CC1=CC=C(C(C)N)S1 CS-0251216 [0,0,0,0,0,0|1,0,1]=2 12 B9R1.35 CC1=CC=C(C(C)O)S1 CS-0225255 [0,0,0,0,0,0|0,0,2]=2 13 B9R1.35 CC1=CC=C(C(C)S)S1 CS-0259190 [0,0,0,0,0,0|0,1,1]=2 14 B9R1.35 CC1=CC=C(C(N)=O)S1 CS-0453814 [0,0,0,0,0,0|1,0,0]=1 15 B9R1.35 CC1=CC=C(S(=O)O)S1 CS-1034738 [0,0,0,0,0,0|2,0,0]=2 16 B9R1.35 CC1=CN=C(C(=O)[O-])O1 CS-0048703 [0,0,0,0,0,0|2,1,0]=3 17 B9R1.35 CC1=CSC(C(C)N)=N1 CS-0217373 [0,0,0,0,0,0|3,0,1]=4 18 B9R1.35 CC1=CSC(C(C)N)=N1 CS-0713751 [0,0,0,0,0,0|3,0,1]=4 19 B9R1.35 CC1=CSC(C(C)O)=N1 CS-0234501 [0,0,0,0,0,0|2,0,2]=4 20 B9R1.35 CC1=CSC(N(C)C)=N1 CS-0239183 [0,0,0,0,0,0|4,0,0]=4 21 B9R1.35 CC1=NC(C(=N)N)=CS1 CS-0315086 [0,0,0,0,0,0|4,0,0]=4 22 B9R1.35 CC1=NC(C(C)C)=CS1 CS-0057980 [0,0,0,0,0,0|3,0,1]=4 23 B9R1.35 CC1=NC(C(C)N)=CS1 CS-0005455 [0,0,0,0,0,0|3,0,1]=4 24 B9R1.35 CC1=NC(C(N)=O)=CN1 CS-0245843 [0,0,0,0,0,0|3,0,0]=3 25 B9R1.35 CC1=NC(C(N)=O)=CO1 CS-0036398 [0,0,0,0,0,0|3,0,0]=3 26 B9R1.35 CC1=NC(C(N)=O)=CS1 CS-0062460 [0,0,0,0,0,0|3,0,0]=3 27 B9R1.35 CC1=NC(C(N)=S)=CN1 CS-0329078 [0,0,0,0,0,0|3,1,0]=4 28 B9R1.35 CC1=NC=C(C(=N)N)S1 CS-0969090 [0,0,0,0,0,0|3,0,0]=3 29 B9R1.35 CC1=NC=C(C(N)=O)O1 CS-0673355 [0,0,0,0,0,0|2,1,0]=3 30 B9R1.35 CC1=NN(C(C)C)C=C1 CS-0274494 [0,0,0,0,0,0|3,0,1]=4 31 B9R1.35 CC1=NN([N+](=O)[O-])C=C1 CS-0359900 [0,0,0,0,0,0|4,0,0]=4 32 B9R1.35 CC1=NNC(C(N)=O)=N1 CS-0223738 [0,0,0,0,0,0|4,0,0]=4 33 B9R1.35 CC1=NOC(C(=O)[O-])=N1 CS-0214721 [0,0,0,0,0,0|4,0,0]=4 34 B9R1.35 CN1C=NC(C(N)=O)=C1 CS-0018916 [0,0,0,0,0,0|4,0,0]=4 35 B9R1.35 NC(=O)C1=COC(Br)=N1 CS-0679279 [0,0,0,0,0,0|4,0,0]=4 36 B9R1.35 NC(=O)C1=COC(Cl)=N1 CS-0149965 [0,0,0,0,0,0|4,0,0]=4 37 B9R1.35 NC(=S)C1=CC=C(Br)S1 CS-0250226 [0,0,0,0,0,0|2,1,0]=3 38 B9R1.35 NC(=S)C1=CC=C(Cl)S1 CS-0250727 [0,0,0,0,0,0|2,1,0]=3 39 B9R1.35 NC1=CNC(C(=O)O)=N1 CS-0157306 [0,0,0,0,0,0|4,0,0]=4 40 B9R1.35 NC1=NC(C(=O)O)=CS1 CS-0314330 [0,0,0,0,0,0|4,0,0]=4 41 B9R1.35 NC1=NN=C(C(=O)O)S1 CS-0112653 [0,0,0,0,0,0|4,0,0]=4 42 B9R1.35 O=C(O)C1=CN=C(S)N1 CS-0309010 [0,0,0,0,0,0|4,0,0]=4 43 B9R1.35 O=C(O)C1=NC(Cl)=CN1 CS-0489434 [0,0,0,0,0,0|4,0,0]=4 44 B9R1.35 O=C(O)C1=NC=C(Br)N1 CS-0642243 [0,0,0,0,0,0|4,0,0]=4 45 B9R1.35 O=[N+]([O-])C1=CC=C(Br)O1 CS-0312815 [0,0,0,0,0,0|3,1,0]=4 46 B9R1.35 O=[N+]([O-])C1=CC=C(I)S1 CS-0245431 [0,0,0,0,0,0|3,0,0]=3 47 B8R1.1 C=CC1=CC=C(C)O1 CS-0223422 [1,0,0,0,0,0|0,1,1]=3 48 B8R1.1 CC1=CN=C(C=O)S1 CS-W003454 [1,0,0,0,0,0|1,0,0]=2 49 B8R1.1 CC1=NC=C(CN)S1 CS-0097678 [1,0,0,0,0,0|2,0,1]=4 50 B8R1.1 CC1=NC=C(CN)S1 CS-0113081 [1,0,0,0,0,0|2,0,1]=4 51 B8R1.1 CC1=NOC(C=O)=C1 CS-0085332 [1,0,0,0,0,0|3,0,0]=4 52 B8R1.1 CCC1=CC=C(C)O1 CS-0333891 [1,0,0,0,0,0|0,1,1]=3 53 B8R1.1 CCC1=CC=C(C)S1 CS-0152517 [1,0,0,0,0,0|0,0,1]=2 54 B8R1.1 CCC1=CC=C(S)S1 CS-0216332 [1,0,0,0,0,0|1,0,1]=3 55 B8R1.1 CCC1=CN=C(Br)S1 CS-0308788 [1,0,0,0,0,0|2,0,1]=4 56 B8R1.1 CNC1=NC(C)=CS1 CS-0138030 [1,0,0,0,0,0|3,0,0]=4 57 B8R1.1 CNC1=NC=C(C)S1 CS-0282156 [1,0,0,0,0,0|2,0,0]=3 58 B8R1.1 CNC1=NN(C)C=C1 CS-0643924 [1,0,0,0,0,0|3,0,0]=4 59 B8R1.1 COC1=CC=C(Br)S1 CS-0239688 [1,0,0,0,0,0|2,0,0]=3 60 B8R1.1 COC1=CN=C(N)S1 CS-0132056 [1,0,0,0,0,0|3,0,0]=4 61 B8R1.1 COC1=NC=C(Br)S1 CS-W001573 [1,0,0,0,0,0|3,0,0]=4 62 B8R1.1 CSC1=CC(C)=CS1 CS-0196399 [1,0,0,0,0,0|3,0,0]=4 63 B8R1.1 CSC1=CNC(=N)S1 CS-0150103 [1,0,0,0,0,0|3,0,0]=4 64 B8R1.1 CSC1=NN=C(C)S1 CS-0161397 [1,0,0,0,0,0|3,0,0]=4 65 B8R1.1 N#CC1=CC=C(I)S1 CS-0112255 [1,0,0,0,0,0|2,0,1]=4 66 B8R1.1 N=C1NC=C(C=O)S1 CS-0043839 [1,0,0,0,0,0|2,0,0]=3 67 B8R1.1 NC1=NC(C=O)=CS1 CS-0054972 [1,0,0,0,0,0|3,0,0]=4 68 B8R1.1 O=CC1=CC(Cl)=CO1 CS-0453722 [1,0,0,0,0,0|3,0,0]=4 69 B8R1.1 O=CC1=CC=C(I)S1 CS-0214606 [1,0,0,0,0,0|1,0,0]=2 70 B8R1.1 O=CC1=CSC(Cl)=C1 CS-W006694 [1,0,0,0,0,0|3,0,0]=4 71 B8R1.1 OCC1=CC=C(F)S1 CS-B1086 [1,0,0,0,0,0|1,0,2]=4 72 B8R1.7 C=C(C)C1=CC=CO1 CS-0468109 [1,0,0,0,0,0|1,1,0]=3 73 B8R1.7 C=C(C)C1=CC=CS1 CS-0323699 [1,0,0,0,0,0|1,0,0]=2 74 B8R1.7 CC(=O)C1=CCCC1 CS-0272100 [1,0,0,0,0,0|1,0,2]=4 75 B8R1.7 CC(=O)N1C=CC=N1 CS-0171650 [1,0,0,0,0,0|2,0,0]=3 76 B8R1.7 CC(=O)N1C=NC=N1 CS-0447429 [1,0,0,0,0,0|3,0,0]=4 77 B8R1.7 CC(C)C1=CN=CS1 CS-0259471 [1,0,0,0,0,0|2,0,1]=4 78 B8R1.7 CC(C)C1=NC=CS1 CS-0447438 [1,0,0,0,0,0|2,0,1]=4 79 B8R1.7 CC(N)C1=CC=CO1 CS-0030195 [1,0,0,0,0,0|1,1,1]=4 80 B8R1.7 CC(N)C1=NC=CS1 CS-0678777 [1,0,0,0,0,0|2,0,1]=4 81 B8R1.7 CC(O)C1=CC=CS1 CS-0464858 [1,0,0,0,0,0|0,0,2]=3 82 B8R1.7 C[C@@H](N)C1=NC=CS1 CS-0212361 [1,0,0,0,0,0|2,0,1]=4 83 B8R1.7 C[C@@H](O)C1=CC=CO1 CS-0158192 [1,0,0,0,0,0|0,1,2]=4 84 B8R1.7 C[C@H](N)C1=CC=CO1 CS-0962538 [1,0,0,0,0,0|1,1,1]=4 85 B8R1.7 C[C@H](N)C1=NC=CS1 CS-0162117 [1,0,0,0,0,0|2,0,1]=4 86 B8R1.7 C[C@H](O)C1=CC=CO1 CS-0260782 [1,0,0,0,0,0|0,1,2]=4 87 B8R1.7 N=C(N)C1=CC=CO1 CS-0216688 [1,0,0,0,0,0|2,1,0]=4 88 B8R1.7 N=C(N)C1=CC=CS1 CS-0122224 [1,0,0,0,0,0|2,0,0]=3 89 B8R1.7 NC(=O)C1=CC=NO1 CS-0461079 [1,0,0,0,0,0|2,1,0]=4 90 B8R1.7 NC(=O)C1=CN=CO1 CS-0340744 [1,0,0,0,0,0|2,1,0]=4 91 B8R1.7 NC(=O)C1=CN=CS1 CS-0259104 [1,0,0,0,0,0|2,0,0]=3 92 B8R1.7 NC(=O)C1=CSC=C1 CS-W011147 [1,0,0,0,0,0|3,0,0]=4 93 B8R1.7 NC(=O)C1=NC=CO1 CS-0039003 [1,0,0,0,0,0|2,1,0]=4 94 B8R1.7 NC(=O)C1=NN=CS1 CS-0577131 [1,0,0,0,0,0|3,0,0]=4 95 B8R1.7 NC(=O)C1=NSC=C1 CS-0660602 [1,0,0,0,0,0|3,0,0]=4 96 B8R1.7 NC(=S)C1=CC=CN1 CS-0262958 [1,0,0,0,0,0|2,1,0]=4 97 B8R1.7 NC(=S)C1=CC=CO1 CS-W011146 [1,0,0,0,0,0|1,2,0]=4 98 B8R1.7 NC(=S)C1=CN=CS1 CS-0217681 [1,0,0,0,0,0|2,1,0]=4 99 B8R1.7 NC(=S)C1=NC=CS1 CS-0224151 [1,0,0,0,0,0|2,1,0]=4 100 B8R1.7 O=C(O)C1=NC=CO1 CS-W021738 [1,0,0,0,0,0|2,1,0]=4 101 B8R1.7 O=N(=O)C1=CC=CO1 CS-W016615 [1,0,0,0,0,0|2,1,0]=4 102 B8R1.7 O=S([O-])C1=CC=CS1 CS-0664385 [1,0,0,0,0,0|2,0,0]=3 103 B8R1.7 O=[N+]([O-])C1=NC=CS1 CS-0654685 [1,0,0,0,0,0|3,0,0]=4 104 B10R1.14 CC1=CC=C(C(=O)CCl)S1 CS-0213026 [0,1,0,0,0,0|0,0,0]=1 105 B10R1.14 CC1=CC=C(C(=O)NN)S1 CS-0216702 [0,1,0,0,0,0|1,0,0]=2 106 B10R1.14 CC1=CC=C(C(C)C#N)O1 CS-0256946 [0,1,0,0,0,0|1,1,1]=4 107 B10R1.14 CC1=CC=C(C(O)CN)O1 CS-0262896 [0,1,0,0,0,0|0,1,2]=4 108 B10R1.14 CCC(=O)C1=CC=C(C)S1 CS-0213315 [0,1,0,0,0,0|0,0,0]=1 109 B10R1.14 CCC(=O)C1=CC=C(Cl)S1 CS-0217523 [0,1,0,0,0,0|1,0,0]=2 110 B10R1.14 CCC(=O)C1=CN(C)N=C1 CS-0058331 [0,1,0,0,0,0|3,0,0]=4 111 B10R1.14 CC[C@@H](N)C1=CC=C(C)O1 CS-0030817 [0,1,0,0,0,0|1,1,1]=4 112 B10R1.14 CC[C@H](N)C1=CC=C(C)O1 CS-0162121 [0,1,0,0,0,0|1,1,1]=4 113 B10R1.14 CN1C=C(C(=O)CCl)C=N1 CS-0262902 [0,1,0,0,0,0|3,0,0]=4 114 B10R1.14 CN1C=CC(C(=O)CCl)=C1 CS-0307987 [0,1,0,0,0,0|2,0,0]=3 115 B10R1.14 CN1C=CC(C(=O)NN)=N1 CS-0206897 [0,1,0,0,0,0|3,0,0]=4 116 B10R1.14 CNC(=O)C1=CC=C(Br)O1 CS-0301299 [0,1,0,0,0,0|1,1,0]=3 117 B10R1.14 CNC(=O)C1=CN=C(C)S1 CS-0651844 [0,1,0,0,0,0|1,0,0]=2 118 B10R1.14 CNC(=O)C1=CSC(N)=N1 CS-0070940 [0,1,0,0,0,0|3,0,0]=4 119 B10R1.14 CNC(=O)C1=NNC(C)=C1 CS-0314811 [0,1,0,0,0,0|3,0,0]=4 120 B10R1.14 CNC(=O)C1=NOC(C)=C1 CS-0160410 [0,1,0,0,0,0|3,0,0]=4 121 B10R1.14 COC(=O)C1=CC(C)=CN1 CS-0152853 [0,1,0,0,0,0|2,0,0]=3 122 B10R1.14 COC(=O)C1=CC(C)=CS1 CS-0195901 [0,1,0,0,0,0|2,0,0]=3 123 B10R1.14 COC(=O)C1=CC(N)=CN1 CS-0215980 [0,1,0,0,0,0|3,0,0]=4 124 B10R1.14 COC(=O)C1=CC=C(Cl)N1 CS-0448683 [0,1,0,0,0,0|2,0,0]=3 125 B10R1.14 COC(=O)C1=CC=C(N)N1 CS-0187513 [0,1,0,0,0,0|2,0,0]=3 126 B10R1.14 COC(=O)C1=CN=C(C)O1 CS-0044019 [0,1,0,0,0,0|1,1,0]=3 127 B10R1.14 COC(=O)C1=CN=C(Cl)O1 CS-0043879 [0,1,0,0,0,0|2,1,0]=4 128 B10R1.14 COC(=O)C1=CN=C(I)S1 CS-0572619 [0,1,0,0,0,0|2,0,0]=3 129 B10R1.14 COC(=O)C1=CN=C(N)O1 CS-0130344 [0,1,0,0,0,0|2,1,0]=4 130 B10R1.14 COC(=O)C1=CSC(=O)N1 CS-0966874 [0,1,0,0,0,0|3,0,0]=4 131 B10R1.14 COC(=O)C1=NC=C(C)O1 CS-0048972 [0,1,0,0,0,0|1,1,0]=3 132 B10R1.14 COC(=O)C1=NN=C(Br)S1 CS-0910129 [0,1,0,0,0,0|3,0,0]=4 133 B10R1.14 NNC(=O)C1=CC=C(Br)S1 CS-W014745 [0,1,0,0,0,0|2,0,0]=3 134 B10R1.14 NNC(=O)C1=CC=C(Cl)S1 CS-0072594 [0,1,0,0,0,0|2,0,0]=3 135 B10R1.14 N\C(=N/O)C1=CC=C(Br)S1 CS-0261075 [0,1,0,0,0,0|2,0,1]=4 136 B10R1.14 O=C(CBr)C1=CC=C(Br)S1 CS-0218792 [0,1,0,0,0,0|1,0,0]=2 137 B10R1.31 CCC1=CC(C(=O)O)=CS1 CS-0152525 [0,1,0,0,0,0|3,0,0]=4 138 B10R1.31 CCC1=CC=C(B(O)O)S1 CS-0174929 [0,1,0,0,0,0|2,0,1]=4 139 B10R1.31 CCC1=CC=C(C(=O)O)N1 CS-0089412 [0,1,0,0,0,0|2,0,0]=3 140 B10R1.31 CCC1=CC=C(C(=O)O)O1 CS-0247276 [0,1,0,0,0,0|1,1,0]=3 141 B10R1.31 CCC1=CC=C(C(C)=O)O1 CS-0230261 [0,1,0,0,0,0|0,1,0]=2 142 B10R1.31 CCC1=CC=C(C(C)=O)S1 CS-0233207 [0,1,0,0,0,0|0,0,0]=1 143 B10R1.31 CCC1=NC(C(=O)O)=CS1 CS-0106566 [0,1,0,0,0,0|3,0,0]=4 144 B10R1.31 CCC1=NC=C(C(=O)O)S1 CS-0251736 [0,1,0,0,0,0|2,0,0]=3 145 B10R1.31 CCN1C=C(C(C)=O)C=N1 CS-0251836 [0,1,0,0,0,0|3,0,0]=4 146 B10R1.31 CCN1C=CC(C(N)=O)=N1 CS-0240674 [0,1,0,0,0,0|3,0,0]=4 147 B10R1.31 COC1=CC=C(C(=O)O)O1 CS-0243026 [0,1,0,0,0,0|1,1,0]=3 148 B10R1.31 CSC1=CC(C(=O)O)=CO1 CS-0869928 [0,1,0,0,0,0|3,0,0]=4 149 B10R1.31 N#CC1=CC=C(C(=O)O)S1 CS-0205393 [0,1,0,0,0,0|1,0,1]=3 150 B10R1.31 NCC1=CC=C(C(=O)O)O1 CS-0157318 [0,1,0,0,0,0|1,1,0]=3 151 B10R1.31 NCC1=CC=C([N+](=O)[O-])S1 CS-0446025 [0,1,0,0,0,0|2,0,0]=3 152 B10R1.31 O=C(O)C1=CC(CO)=CS1 CS-0188137 [0,1,0,0,0,0|3,0,0]=4 153 B10R1.31 O=C(O)C1=NN(CO)C=C1 CS-0217754 [0,1,0,0,0,0|3,0,0]=4 154 B10R1.31 O=[N+]([O-])C1=CC=C(CBr)S1 CS-0696054 [0,1,0,0,0,0|2,0,0]=3 155 B10R1.55 CC1=CC=C(S(=O)(=O)Cl)S1 CS-0071879 [0,1,0,0,0,0|2,0,0]=3 156 B10R1.55 CS(=O)(=O)C1=CC=C(Br)S1 CS-0053915 [0,1,0,0,0,0|2,0,0]=3 157 B10R1.55 O=S(=O)(F)C1=CC=C(Br)S1 CS-0697357 [0,1,0,0,0,0|3,0,0]=4 158 B10R1.58 CC(=O)C1=CC(Br)=C(Br)S1 CS-0033741 [0,1,0,0,0,0|1,0,0]=2 159 B10R1.58 CC(=O)C1=NC(C)=C(C)S1 CS-0279638 [0,1,0,0,0,0|1,0,0]=2 160 B10R1.58 CC1=C(Br)C=C(B(O)O)S1 CS-0108818 [0,1,0,0,0,0|2,0,1]=4 161 B10R1.58 CC1=C(Br)NC(C(=O)O)=N1 CS-0187121 [0,1,0,0,0,0|3,0,0]=4 162 B10R1.58 CC1=C(C)NC(C(=O)O)=C1 CS-W000758 [0,1,0,0,0,0|2,0,0]=3 163 B10R1.58 CC1=C(C)SC(C(C)C)=N1 CS-0331847 [0,1,0,0,0,0|2,0,1]=4 164 B10R1.58 CC1=C(Cl)SC(C(=O)O)=C1 CS-0179653 [0,1,0,0,0,0|2,0,0]=3 165 B10R1.58 CC1=CC(C(N)=O)=NN1C CS-0153135 [0,1,0,0,0,0|3,0,0]=4 166 B10R1.58 CN1N=C(C(=O)O)C=C1N CS-0050691 [0,1,0,0,0,0|3,0,0]=4 167 B10R1.58 NC(=O)C1=CC(Cl)=C(Cl)N1 CS-0060158 [0,1,0,0,0,0|3,0,0]=4 168 B10R1.58 NC1=C(Br)SC(C(=O)O)=C1 CS-0042021 [0,1,0,0,0,0|2,0,0]=3 169 B10R1.58 O=C(O)C1=CC(Br)=C(Br)N1 CS-0451417 [0,1,0,0,0,0|3,0,0]=4 170 B10R1.58 O=C(O)C1=CC(F)=C(Br)S1 CS-0521530 [0,1,0,0,0,0|2,0,0]=3 171 B10R1.58 O=C(O)C1=NC(Br)=C(Br)S1 CS-0566583 [0,1,0,0,0,0|3,0,0]=4 172 B10R1.59 CC(=O)C1=C(C)N=C(C)O1 CS-0212469 [0,1,0,0,0,0|1,1,0]=3 173 B10R1.59 CC(=O)C1=C(C)OC(C)=C1 CS-0063357 [0,1,0,0,0,0|2,0,0]=3 174 B10R1.59 CC(=O)C1=C(C)SC(C)=N1 CS-0307911 [0,1,0,0,0,0|2,0,0]=3 175 B10R1.59 CC1=CC(C(=O)O)=C(Br)S1 CS-0308082 [0,1,0,0,0,0|3,0,0]=4 176 B10R1.59 CC1=CC(C)=C(C(=O)O)S1 CS-0246262 [0,1,0,0,0,0|1,0,0]=2 177 B10R1.59 CC1=NC(C(=O)O)=C(C)S1 CS-0205681 [0,1,0,0,0,0|3,0,0]=4 178 B10R1.59 CC1=NC(C(=O)O)=C(N)S1 CS-0160730 [0,1,0,0,0,0|3,0,0]=4 179 B10R1.59 CC1=NC(C)=C(C(C)O)S1 CS-0251772 [0,1,0,0,0,0|1,0,2]=4 180 B10R1.59 CN1C=C(N)C(C(=O)O)=N1 CS-0308488 [0,1,0,0,0,0|3,0,0]=4 181 B10R1.59 CN1C=C(N)C(C(N)=O)=N1 CS-0099639 [0,1,0,0,0,0|3,0,0]=4 182 B10R1.59 O=C(O)C1=C(Cl)C=C(Cl)S1 CS-0094208 [0,1,0,0,0,0|2,0,0]=3 183 B10R1.194 CC(=O)C1=C(Br)C(Br)=CS1 CS-0245009 [0,1,0,0,0,0|3,0,0]=4 184 B10R1.194 CC(=O)C1=C(N)N(C)N=C1 CS-0264861 [0,1,0,0,0,0|3,0,0]=4 185 B10R1.194 CC1=C(C)C(C(=O)O)=CS1 CS-0036851 [0,1,0,0,0,0|3,0,0]=4 186 B10R1.194 CC1=C(N)C(C(=O)O)=CS1 CS-0197360 [0,1,0,0,0,0|3,0,0]=4 187 B10R1.194 CC1=CC=C(C(=O)O)N1C CS-0117682 [0,1,0,0,0,0|2,0,0]=3 188 B10R1.194 CC1=CC=C(C(N)=S)N1C CS-0240965 [0,1,0,0,0,0|2,1,0]=4 189 B10R1.194 CC1=CNC(C(=O)O)=C1C CS-0051604 [0,1,0,0,0,0|3,0,0]=4 190 B10R1.194 CC1=CSC(C(=O)O)=C1Cl CS-0309337 [0,1,0,0,0,0|3,0,0]=4 191 B10R1.194 CC1=CSC(C(=O)O)=C1I CS-0673236 [0,1,0,0,0,0|3,0,0]=4 192 B10R1.194 CC1=CSC(C(=O)[O-])=C1I CS-0282182 [0,1,0,0,0,0|3,0,0]=4 193 B10R1.194 CC1=NC=C(C(=O)O)N1C CS-0094384 [0,1,0,0,0,0|3,0,0]=4 194 B8R0.9 C\C=C(C)\C=C\C(=O)O CS-0368559 [0,0,1,0,0,0|2,0,1]=4 195 B8R0.23 C=C(NC(C)=O)C(=O)O CS-W011122 [0,0,1,0,0,0|3,0,0]=4 196 B10R1.13 CC(=O)C1=CNC(=O)C=N1 CS-0044031 [0,0,0,0,0,1|3,0,0]=4 197 B10R1.13 CC(=O)C1=NC=C(C)C=C1 CS-0714517 [0,0,0,0,0,1|1,0,0]=2 198 B10R1.13 CC(=O)C1=NC=C(F)C=N1 CS-0054640 [0,0,0,0,0,1|3,0,0]=4 199 B10R1.13 CC(=O)C1CC=C(C)CC1 CS-0033709 [0,0,0,0,0,1|1,0,2]=4 200 B10R1.13 CC1=CC=C([C@@H](C)N)C=C1 CS-0122808 [0,0,0,0,0,1|2,0,1]=4 201 B10R1.13 CC1=CN=C(C(=O)O)C=C1 CS-0212774 [0,0,0,0,0,1|2,0,0]=3 202 B10R1.13 CC1=CN=C(C(C)N)C=C1 CS-0196546 [0,0,0,0,0,1|2,0,1]=4 203 B10R1.13 CC1=NC=C(C(N)=O)N=C1 CS-0152780 [0,0,0,0,0,1|3,0,0]=4 204 B10R1.13 CC1=NC=C(C(N)=S)C=C1 CS-0309132 [0,0,0,0,0,1|2,1,0]=4 205 B10R1.13 CC1=NN=C(C(=N)N)C=C1 CS-0152723 [0,0,0,0,0,1|3,0,0]=4 206 B10R1.13 CC1=NN=C(C(=O)O)C=C1 CS-W003657 [0,0,0,0,0,1|2,0,0]=3 207 B10R1.13 CS(=O)C1=CC=C(F)C=C1 CS-0046847 [0,0,0,0,0,1|3,0,0]=4 208 B10R1.13 Cc1ccc(C(C)C)cc1 CS-0082014 [0,0,0,0,0,1|2,0,1]=4 209 B10R1.13 NC(=O)C1=CC=C(O)C=C1 CS-0251993 [0,0,0,0,0,1|3,0,0]=4 210 B10R1.13 NC(=O)C1=NC=C(O)C=C1 CS-0050458 [0,0,0,0,0,1|3,0,0]=4 211 B10R1.13 NC(=O)C1=NNC(=O)C=C1 CS-0071707 [0,0,0,0,0,1|3,0,0]=4 212 B10R1.13 NC1=CC=C(C(=O)O)C=C1 CS-0698412 [0,0,0,0,0,1|3,0,0]=4 213 B10R1.13 NC1=CN=C(C(=O)O)C=C1 CS-0210626 [0,0,0,0,0,1|3,0,0]=4 214 B10R1.13 O=C(F)C1=CC=C(Br)C=C1 CS-0436823 [0,0,0,0,0,1|3,0,0]=4 215 B10R1.13 O=C(F)C1=CC=C(Cl)C=C1 CS-0865466 [0,0,0,0,0,1|3,0,0]=4 216 B10R1.13 O=C(F)C1=CC=C(I)C=C1 CS-0866006 [0,0,0,0,0,1|3,0,0]=4 217 B10R1.13 O=C(O)C1=CN=C(S)C=C1 CS-1205396 [0,0,0,0,0,1|3,0,0]=4 218 B10R1.13 O=C(O)C1=CNC(=S)C=C1 CS-0128653 [0,0,0,0,0,1|3,0,0]=4 219 B10R1.13 O=C(O)C1=NC=C(O)C=C1 CS-0442163 [0,0,0,0,0,1|3,0,0]=4 220 B10R1.13 O=C([O-])C1=CC=C(Br)C=C1 CS-0539239 [0,0,0,0,0,1|3,0,0]=4 221 B10R1.54 CC(=O)CC1=NC(C)=NO1 CS-0713416 [0,0,0,0,0,1|3,0,0]=4 222 B10R1.54 CC(=O)NC1=NC=C(C)S1 CS-0209959 [0,0,0,0,0,1|1,0,0]=2 223 B10R1.54 CC(=O)NC1=NOC(C)=C1 CS-0721009 [0,0,0,0,0,1|3,0,0]=4 224 B10R1.54 CC(=O)NC1=NOC(C)=N1 CS-0667943 [0,0,0,0,0,1|3,0,0]=4 225 B10R1.54 CC1=CC=C(CC(=O)O)S1 CS-0251394 [0,0,0,0,0,1|1,0,0]=2 226 B10R1.54 CC1=CSC(CC(=O)O)=N1 CS-0669030 [0,0,0,0,0,1|3,0,0]=4 227 B10R1.54 CC1=CSC(CC(N)=O)=N1 CS-0074167 [0,0,0,0,0,1|3,0,0]=4 228 B10R1.54 CC1=NC(CC(=O)O)=CS1 CS-0037814 [0,0,0,0,0,1|3,0,0]=4 229 B10R1.54 CC1=NC(CC(N)=O)=CS1 CS-0205231 [0,0,0,0,0,1|3,0,0]=4 230 B10R1.54 CN1C=CC(CC(=O)O)=N1 CS-0037801 [0,0,0,0,0,1|3,0,0]=4 231 B10R1.54 CN1C=CC(CC(=O)O)=N1 CS-0074875 [0,0,0,0,0,1|3,0,0]=4 232 B10R1.113 C=C(C)C1=CC(Br)=CC=C1 CS-0217182 [0,0,0,0,0,1|3,0,0]=4 233 B10R1.113 C=C(C)C1=CC(Cl)=CC=C1 CS-0512381 [0,0,0,0,0,1|3,0,0]=4 234 B10R1.113 CC(=O)C1=CC(Cl)=NC=N1 CS-0449839 [0,0,0,0,0,1|3,0,0]=4 235 B10R1.113 CC(=O)C1=CC(O)=CN=C1 CS-0188470 [0,0,0,0,0,1|2,0,0]=3 236 B10R1.113 CC(=O)C1=NC(C)=NC=C1 CS-0163212 [0,0,0,0,0,1|1,0,0]=2 237 B10R1.113 CC1=CC(C(=N)N)=CC=C1 CS-0122222 [0,0,0,0,0,1|3,0,0]=4 238 B10R1.113 CC1=CC(C(=N)N)=CC=C1 CS-0209832 [0,0,0,0,0,1|3,0,0]=4 239 B10R1.113 CC1=CC(C(=N)N)=NC=C1 CS-0038257 [0,0,0,0,0,1|3,0,0]=4 240 B10R1.113 CC1=CC(C(=O)O)=NC=C1 CS-W005037 [0,0,0,0,0,1|2,0,0]=3 241 B10R1.113 CC1=CC(C(C)Br)=CC=C1 CS-0258302 [0,0,0,0,0,1|2,0,1]=4 242 B10R1.113 CC1=CC(C(C)C)=CC=C1 CS-0331846 [0,0,0,0,0,1|2,0,1]=4 243 B10R1.113 CC1=CC(C(C)N)=CC=C1 CS-0456283 [0,0,0,0,0,1|2,0,1]=4 244 B10R1.113 CC1=CC(C(C)N)=NC=C1 CS-0005381 [0,0,0,0,0,1|2,0,1]=4 245 B10R1.113 CC1=CC(C(N)=O)=CN=C1 CS-0037467 [0,0,0,0,0,1|2,0,0]=3 246 B10R1.113 CC1=CC(C(N)=S)=CC=C1 CS-0153121 [0,0,0,0,0,1|2,1,0]=4 247 B10R1.113 CC1=CC(S(=O)O)=NC=C1 CS-0959317 [0,0,0,0,0,1|3,0,0]=4 248 B10R1.113 CC1=CC(S(C)=O)=CC=C1 CS-0250511 [0,0,0,0,0,1|2,0,0]=3 249 B10R1.113 CC1=CC([C@@H](C)O)=NC=C1 CS-0163636 [0,0,0,0,0,1|1,0,2]=4 250 B10R1.113 CC1=CC([N+](=O)[O-])=NC=C1 CS-0153153 [0,0,0,0,0,1|3,0,0]=4 251 B10R1.113 CC1=CC=CC([C@H](C)N)=C1 CS-0000339 [0,0,0,0,0,1|2,0,1]=4 252 B10R1.113 CC1=CN=CC(C(N)=O)=N1 CS-0160574 [0,0,0,0,0,1|2,0,0]=3 253 B10R1.113 CC1=NC(C(N)=O)=CC=C1 CS-0669006 [0,0,0,0,0,1|2,0,0]=3 254 B10R1.113 CC1=NC(N(C)C)=NC=C1 CS-0977334 [0,0,0,0,0,1|3,0,0]=4 255 B10R1.113 CC1=NC=CC(C(N)=O)=N1 CS-0759339 [0,0,0,0,0,1|2,0,0]=3 256 B10R1.113 CS(=O)C1=CC(Br)=CC=C1 CS-0209611 [0,0,0,0,0,1|3,0,0]=4 257 B10R1.113 CS(=O)C1=CC(N)=CC=C1 CS-0972245 [0,0,0,0,0,1|3,0,0]=4 258 B10R1.113 CS(=O)C1=CC=CC(N)=C1 CS-0250512 [0,0,0,0,0,1|3,0,0]=4 259 B10R1.113 NC(=O)C1=CC(Cl)=CN=C1 CS-0450454 [0,0,0,0,0,1|3,0,0]=4 260 B10R1.113 NC(=O)C1=CC(F)=CN=C1 CS-0036700 [0,0,0,0,0,1|3,0,0]=4 261 B10R1.113 NC(=O)C1=CC(O)=CN=C1 CS-0062251 [0,0,0,0,0,1|3,0,0]=4 262 B10R1.113 NC(=O)C1=CC=CC(=O)N1 CS-0070490 [0,0,0,0,0,1|3,0,0]=4 263 B10R1.113 NC(=O)C1=NC(N)=CC=C1 CS-0217596 [0,0,0,0,0,1|3,0,0]=4 264 B10R1.113 NC(=O)C1=NC(N)=NC=C1 CS-0045614 [0,0,0,0,0,1|3,0,0]=4 265 B10R1.113 NC(=O)C1=NC=CC(F)=C1 CS-0207680 [0,0,0,0,0,1|3,0,0]=4 266 B10R1.113 NC1=CC(C(=O)O)=NC=C1 CS-0212759 [0,0,0,0,0,1|3,0,0]=4 267 B10R1.113 NC1=CC=CC(C(=O)O)=C1 CS-0074486 [0,0,0,0,0,1|3,0,0]=4 268 B10R1.113 NC1=CC=CC(C(=O)[O-])=C1 CS-0362624 [0,0,0,0,0,1|3,0,0]=4 269 B10R1.113 O=C(O)C1=NC(I)=CC=C1 CS-0327002 [0,0,0,0,0,1|3,0,0]=4 270 B10R1.113 O=C([O-])C1=CC(Cl)=CC=C1 CS-0362625 [0,0,0,0,0,1|3,0,0]=4 271 B10R1.113 O=C1C=CNC(C(=O)O)=C1 CS-0099526 [0,0,0,0,0,1|3,0,0]=4 272 B10R1.113 O=C1C=NC=C(C(=O)O)N1 CS-0005515 [0,0,0,0,0,1|3,0,0]=4 273 B10R1.113 O=C1C=NC=C(C(=O)[O-])N1 CS-M0894 [0,0,0,0,0,1|3,0,0]=4 274 B7R0.4 C\C=C/C=C/C(=O)O CS-0747017 [1,0,1,0,0,0|1,0,0]=3 275 B7R0.6 C=C(C)COC(C)=O CS-0187450 [1,0,1,0,0,0|2,0,0]=4 276 B7R1.1 CCC1=NC=CS1 CS-0205022 [2,0,0,0,0,0|1,0,1]=4 277 B7R1.2 CC1=CN=C(I)S1 CS-0211503 [2,0,0,0,0,0|2,0,0]=4 278 B7R1.2 CC1=CSC(=O)N1 CS-0308346 [2,0,0,0,0,0|2,0,0]=4 279 B7R1.2 CC1=NN=C(C)S1 CS-W011244 [2,0,0,0,0,0|2,0,0]=4 280 B7R1.2 CC1=NNC(=O)S1 CS-0152718 [2,0,0,0,0,0|2,0,0]=4 281 B7R1.2 O=C1C=CC(=O)C1 CS-0204257 [2,0,0,0,0,0|2,0,0]=4 282 B7R1.2 O=C1C=CC(=O)O1 CS-0504295 [2,0,0,0,0,0|1,1,0]=4 283 B9R1.7 BrCCC1=CC=C(Br)S1 CS-0511648 [1,1,0,0,0,0|1,0,1]=4 284 B9R1.7 CC1=CC=C(CC#N)S1 CS-0239536 [1,1,0,0,0,0|0,0,2]=4 285 B9R1.7 CC1=CC=C(CCN)O1 CS-0163785 [1,1,0,0,0,0|0,1,1]=4 286 B9R1.7 CC1=CC=C(CCN)S1 CS-0309172 [1,1,0,0,0,0|0,0,1]=3 287 B9R1.7 CC1=CC=C(CCO)O1 CS-0186430 [1,1,0,0,0,0|0,1,1]=4 288 B9R1.7 CC1=NC=C(CCO)S1 CS-0224909 [1,1,0,0,0,0|1,0,1]=4 289 B9R1.7 CNCC1=CC=C(Br)S1 CS-0224242 [1,1,0,0,0,0|1,0,1]=4 290 B9R1.7 CNCC1=CC=C(C)S1 CS-0257583 [1,1,0,0,0,0|0,0,1]=3 291 B9R1.7 CNCC1=CC=C(C)S1 CS-0672531 [1,1,0,0,0,0|0,0,1]=3 292 B9R1.7 CNCC1=CC=C(Cl)S1 CS-0223920 [1,1,0,0,0,0|1,0,1]=4 293 B9R1.7 O\N=C\C1=CC=C(Br)S1 CS-0195336 [1,1,0,0,0,0|1,0,1]=4 294 B9R1.21 C#CC1=CC=C(CC)S1 CS-0698117 [1,1,0,0,0,0|0,0,2]=4 295 B9R1.21 CCC1=CC=C(C=O)O1 CS-0204240 [1,1,0,0,0,0|0,1,0]=3 296 B9R1.21 CCC1=NC=C(C=O)N1 CS-0152484 [1,1,0,0,0,0|2,0,0]=4 297 B9R1.21 CCN1C=CC(C=O)=C1 CS-0217985 [1,1,0,0,0,0|2,0,0]=4 298 B9R1.21 CSC1=CC=C(C#N)S1 CS-0448311 [1,1,0,0,0,0|1,0,1]=4 299 B9R1.21 CSC1=CC=C(C=O)S1 CS-W013281 [1,1,0,0,0,0|0,0,0]=2 300 B9R1.21 N#CC1=CC=C(CN)S1 CS-0312197 [1,1,0,0,0,0|1,0,1]=4 301 B9R1.21 O=CC1=CC=C(C=O)N1 CS-0119391 [1,1,0,0,0,0|1,0,1]=4 302 B9R1.21 O=CC1=CC=C(CCl)O1 CS-0695712 [1,1,0,0,0,0|0,1,0]=3 303 B9R1.21 O=CC1=CC=C(CO)N1 CS-0157346 [1,1,0,0,0,0|1,0,0]=3 304 B9R1.22 CC1=C(C=O)SC(Br)=C1 CS-0451922 [1,1,0,0,0,0|1,0,0]=3 305 B9R1.22 CC1=NC(C)=C(C=O)O1 CS-0172064 [1,1,0,0,0,0|1,1,0]=4 306 B9R1.22 CC1=NC(C=O)=C(C)O1 CS-0461906 [1,1,0,0,0,0|2,0,0]=4 307 B9R1.22 O=CC1=C(Br)C=C(Br)S1 CS-0191296 [1,1,0,0,0,0|1,0,0]=3 308 B9R1.23 CC1=C(Br)C=C(CO)S1 CS-0190745 [1,1,0,0,0,0|0,0,2]=4 309 B9R1.23 CC1=C(Br)SC(C=O)=C1 CS-0054647 [1,1,0,0,0,0|1,0,0]=3 310 B9R1.23 CC1=C(C)SC(C=O)=C1 CS-0229935 [1,1,0,0,0,0|0,0,0]=2 311 B9R1.23 O=CC1=CC(Br)=C(Br)O1 CS-0195335 [1,1,0,0,0,0|1,1,0]=4 312 B9R1.23 O=CC1=CC(Cl)=C(Cl)N1 CS-0437331 [1,1,0,0,0,0|2,0,0]=4 313 B9R1.132 CC1=CNC(C=O)=C1C CS-0051605 [1,1,0,0,0,0|2,0,0]=4 314 B9R1.11 CCC(=O)C1=NC=CS1 CS-0152648 [1,1,0,0,0,0|1,0,0]=3 315 B9R1.11 CCC(O)C1=CC=CS1 CS-0225482 [1,1,0,0,0,0|0,0,2]=4 316 B9R1.11 CNC(=O)C1=CC=CN1 CS-0507864 [1,1,0,0,0,0|1,0,0]=3 317 B9R1.11 CNC(=O)C1=CC=CS1 CS-0127299 [1,1,0,0,0,0|0,0,0]=2 318 B9R1.11 CNC(=O)C1=NNC=C1 CS-0199212 [1,1,0,0,0,0|2,0,0]=4 319 B9R1.11 CNC(C)C1=CC=CS1 CS-0249309 [1,1,0,0,0,0|1,0,1]=4 320 B9R1.11 COC(=O)C1=COC=N1 CS-W000502 [1,1,0,0,0,0|2,0,0]=4 321 B9R1.11 COC(=O)N1C=CC=C1 CS-0204294 [1,1,0,0,0,0|2,0,0]=4 322 B9R1.11 CSC(=O)C1=CC=CO1 CS-0150113 [1,1,0,0,0,0|0,1,0]=3 323 B9R1.11 N=C(NO)C1=CC=CS1 CS-W018292 [1,1,0,0,0,0|1,0,1]=4 324 B9R1.11 NCC(O)C1=CC=CS1 CS-0260755 [1,1,0,0,0,0|0,0,2]=4 325 B9R1.11 NNC(=O)C1=CN=CS1 CS-0209017 [1,1,0,0,0,0|2,0,0]=4 326 B9R1.11 O=C(CBr)C1=CC=CN1 CS-0188425 [1,1,0,0,0,0|1,0,0]=3 327 B9R1.11 O=C(CCl)C1=CC=CS1 CS-0239288 [1,1,0,0,0,0|0,0,0]=2 328 B9R1.11 O=CC(=O)C1=CC=CO1 CS-0187927 [1,1,0,0,0,0|0,1,1]=4 329 B9R1.11 [NH3+]CC(=O)C1=CC=CS1 CS-0127472 [1,1,0,0,0,0|0,0,0]=2 330 B9R1.19 CC(C)(C)C1=CC=CS1 CS-0066781 [1,1,0,0,0,0|1,0,1]=4 331 B9R1.19 CC(C)(N)C1=CC=CS1 CS-0455968 [1,1,0,0,0,0|1,0,1]=4 332 B9R1.19 C[Si](C)([O-])C1=CC=CS1 CS-0460519 [1,1,0,0,0,0|0,1,1]=4 333 B9R1.19 O=S(=O)(O)C1=CC=CS1 CS-0096224 [1,1,0,0,0,0|2,0,0]=4 334 B9R1.41 CC(=O)C1=C(Br)N=CS1 CS-0161907 [1,1,0,0,0,0|1,0,0]=3 335 B9R1.41 CC(=O)C1=C(Br)SC=C1 CS-0498797 [1,1,0,0,0,0|2,0,0]=4 336 B9R1.41 CC(=O)C1=C(C)SC=N1 CS-0196717 [1,1,0,0,0,0|2,0,0]=4 337 B9R1.41 CC(=O)C1=C(N)C=CS1 CS-W016437 [1,1,0,0,0,0|0,0,0]=2 338 B9R1.41 CC(=O)C1=CC=NN1C CS-W021193 [1,1,0,0,0,0|2,0,0]=4 339 B9R1.41 CC1=C(C(C)O)SC=C1 CS-0236914 [1,1,0,0,0,0|0,0,2]=4 340 B9R1.41 CC1=C(C(N)=O)NC=C1 CS-0896517 [1,1,0,0,0,0|2,0,0]=4 341 B9R1.41 CC1=C(C(N)=O)SC=C1 CS-W018301 [1,1,0,0,0,0|1,0,0]=3 342 B9R1.41 CC1=C(C(N)=S)SC=C1 CS-0246080 [1,1,0,0,0,0|1,1,0]=4 343 B9R1.41 NC(=O)C1=C(Br)C=CS1 CS-0089827 [1,1,0,0,0,0|1,0,0]=3 344 B9R1.41 NC(=O)C1=CC=CN1N CS-0052646 [1,1,0,0,0,0|2,0,0]=4 345 B9R1.41 NC(=S)C1=C(Br)C=CS1 CS-0247376 [1,1,0,0,0,0|1,1,0]=4 346 B9R1.41 NC1=C(C(=O)O)SC=C1 CS-0059259 [1,1,0,0,0,0|1,0,0]=3 347 B9R1.41 O=C(O)C1=C(O)C=CS1 CS-0096798 [1,1,0,0,0,0|1,0,0]=3 348 B9R1.41 O=S(O)C1=C(Br)C=CS1 CS-0950875 [1,1,0,0,0,0|2,0,0]=4 349 B11R1.3 CC(=O)C1=CC=C(CO)C=C1 CS-0155093 [0,1,0,0,0,1|1,0,0]=3 350 B11R1.3 CCC1=CN=C(C(=O)O)C=C1 CS-0000172 [0,1,0,0,0,1|2,0,0]=4 351 B11R1.3 CCC1=NC=C(C(C)=O)C=N1 CS-0161954 [0,1,0,0,0,1|2,0,0]=4 352 B11R1.3 COC1=CN=C(C(=O)O)C=C1 CS-0183765 [0,1,0,0,0,1|2,0,0]=4 353 B11R1.3 COC1=CN=C(C(=O)O)C=C1 CS-W004666 [0,1,0,0,0,1|2,0,0]=4 354 B11R1.3 COC1=NC=C(C(C)=O)C=N1 CS-0186228 [0,1,0,0,0,1|2,0,0]=4 355 B11R1.3 CSC1=NC=C(C(=O)O)C=C1 CS-0195664 [0,1,0,0,0,1|2,0,0]=4 356 B11R1.3 C\N=C1\C=CC(C(=O)O)=CN1 CS-0216517 [0,1,0,0,0,1|2,0,0]=4 357 B11R1.3 C\N=C1\C=CC(C(N)=O)=CN1 CS-0151236 [0,1,0,0,0,1|2,0,0]=4 358 B11R1.3 NC(=O)C1=CC=C(CO)C=C1 CS-0162592 [0,1,0,0,0,1|2,0,0]=4 359 B11R1.3 NCC1=CC=C(C(N)=O)C=C1 CS-0047067 [0,1,0,0,0,1|2,0,0]=4 360 B11R1.3 O=C(O)C1=CN=C(CO)C=C1 CS-W006873 [0,1,0,0,0,1|2,0,0]=4 361 B11R1.21 CC(=O)C1=CC(Br)=C(F)N=C1 CS-0699151 [0,1,0,0,0,1|2,0,0]=4 362 B11R1.21 CC(=O)C1=CC(C)=C(N)N=C1 CS-0161894 [0,1,0,0,0,1|2,0,0]=4 363 B11R1.21 CC(=O)C1=CC(I)=C(N)C=C1 CS-0462920 [0,1,0,0,0,1|2,0,0]=4 364 B11R1.21 CC(=O)C1=CC(O)=C(C)C=C1 CS-0209159 [0,1,0,0,0,1|1,0,0]=3 365 B11R1.21 CC(=O)C1=CC=C(O)C(N)=C1 CS-0308660 [0,1,0,0,0,1|2,0,0]=4 366 B11R1.21 CC1=C(F)C=C(C(N)=O)C=C1 CS-0256498 [0,1,0,0,0,1|2,0,0]=4 367 B11R1.21 CC1=CC(C(=O)O)=CN=C1C CS-0451336 [0,1,0,0,0,1|2,0,0]=4 368 B11R1.21 CC1=NC=C(C(N)=O)SC1C CS-0161543 [0,1,0,0,0,1|2,0,0]=4 369 B11R1.22 CC1=CC=C(C(=O)C#N)C=C1 CS-0324363 [0,1,0,0,0,1|1,0,1]=4 370 B11R1.22 CC1=CC=C(C(=O)CN)C=C1 CS-0127144 [0,1,0,0,0,1|1,0,0]=3 371 B11R1.22 CC1=CC=C(C(=O)NO)C=C1 CS-0517428 [0,1,0,0,0,1|2,0,0]=4 372 B11R1.22 CNC(=O)C1=CC=C(N)N=C1 CS-0237005 [0,1,0,0,0,1|2,0,0]=4 373 B11R1.22 CNC(=O)C1=CN=C(Br)C=C1 CS-0212255 [0,1,0,0,0,1|2,0,0]=4 374 B11R1.22 CNC(=O)C1=NC=C(Cl)C=C1 CS-0159751 [0,1,0,0,0,1|2,0,0]=4 375 B11R1.22 COC(=O)C1=CC=[N+](C)C=C1 CS-0237320 [0,1,0,0,0,1|2,0,0]=4 376 B11R1.22 COC(=O)C1=CNC(=O)C=C1 CS-0216791 [0,1,0,0,0,1|2,0,0]=4 377 B11R1.22 NCC(=O)C1=CC=C(Cl)C=C1 CS-0100867 [0,1,0,0,0,1|2,0,0]=4 378 B11R1.22 O=C(CBr)C1=NC=C(Cl)C=C1 CS-0462439 [0,1,0,0,0,1|2,0,0]=4 379 B11R1.22 O=C(CCl)C1=CC=C(I)C=C1 CS-0223315 [0,1,0,0,0,1|2,0,0]=4 380 B11R1.22 O=C(CCl)C1=CN=C(Cl)C=C1 CS-0186597 [0,1,0,0,0,1|2,0,0]=4 381 B11R1.22 O=C(CO)C1=CC=C(Cl)C=C1 CS-0308670 [0,1,0,0,0,1|2,0,0]=4 382 B11R1.166 CC(=O)C1=C(Br)N=C(Br)C=C1 CS-0661023 [0,1,0,0,0,1|2,0,0]=4 383 B11R1.166 CC(=O)C1=C(C)N=C(C)C=N1 CS-W018142 [0,1,0,0,0,1|2,0,0]=4 384 B11R1.166 CC(=O)C1=C(Cl)N=C(C)C=N1 CS-0757718 [0,1,0,0,0,1|2,0,0]=4 385 B11R1.166 CC(=O)C1=C(F)C=C(C)C=C1 CS-0206451 [0,1,0,0,0,1|1,0,0]=3 386 B11R1.166 CC(=O)C1=C(F)C=C(F)C=N1 CS-W000451 [0,1,0,0,0,1|2,0,0]=4 387 B11R1.166 CC(=O)C1=C(N)C=C(Cl)C=C1 CS-0043785 [0,1,0,0,0,1|2,0,0]=4 388 B11R1.166 CC(=O)C1=CC=C(N)C=C1C CS-0308418 [0,1,0,0,0,1|2,0,0]=4 389 B11R1.166 CC(=O)C1=CN=C(C)N=C1C CS-0263237 [0,1,0,0,0,1|2,0,0]=4 390 B11R1.166 CC(=O)C1=NC=C(Br)C=C1C CS-0432681 [0,1,0,0,0,1|2,0,0]=4 391 B11R1.166 CC(=O)C1=NC=C(Br)C=C1Cl CS-0432694 [0,1,0,0,0,1|2,0,0]=4 392 B11R1.166 CC1=CC(=O)C(C(=O)O)=CN1 CS-0783832 [0,1,0,0,0,1|2,0,0]=4 393 B11R1.166 CC1=CN=C(C(=O)O)C(N)=C1 CS-0477638 [0,1,0,0,0,1|2,0,0]=4 394 B11R1.166 CC1=NC(Br)=C(C(=O)O)C=C1 CS-0308389 [0,1,0,0,0,1|2,0,0]=4 395 B11R1.166 CC1=NC(Cl)=C(C(N)=O)C=C1 CS-0308231 [0,1,0,0,0,1|2,0,0]=4 396 B11R1.166 CC1=NC=C(C(=O)O)C(N)=C1 CS-W022077 [0,1,0,0,0,1|2,0,0]=4 397 B11R1.39 CC1=CSC(NC(=O)CCl)=N1 CS-0072087 [0,1,0,0,0,1|2,0,0]=4 398 B11R1.39 CC1=CSC(NC(=O)CCl)=N1 CS-0246151 [0,1,0,0,0,1|2,0,0]=4 399 B11R1.39 CCC(=O)NC1=NC(C)=CS1 CS-0256894 [0,1,0,0,0,1|2,0,0]=4 400 B11R1.39 CNC(=O)CC1=CN=C(N)S1 CS-0335160 [0,1,0,0,0,1|2,0,0]=4 401 B11R1.39 COC(=O)CC1=CC=C(Br)S1 CS-0434795 [0,1,0,0,0,1|1,0,0]=3 402 B11R1.39 COC(=O)CC1=CC=C(Cl)S1 CS-0203176 [0,1,0,0,0,1|1,0,0]=3 403 B11R1.39 COC(=O)CC1=CN=C(Cl)S1 CS-0187455 [0,1,0,0,0,1|2,0,0]=4 404 B11R1.39 COC(=O)CC1=CN=C(N)S1 CS-0049216 [0,1,0,0,0,1|2,0,0]=4 405 B11R1.39 COC(=O)CC1=NC(C)=CS1 CS-0308977 [0,1,0,0,0,1|2,0,0]=4 406 B11R1.39 O=C(CCl)NC1=NC=C(Br)S1 CS-0218769 [0,1,0,0,0,1|2,0,0]=4 407 B11R1.43 CC(=O)NC1=CC=C(C=O)S1 CS-0204585 [0,1,0,0,0,1|0,0,1]=3 408 B11R1.43 CC(=O)NC1=NC(CO)=CS1 CS-0277429 [0,1,0,0,0,1|2,0,0]=4 409 B11R1.80 CC(=O)NC1=CC(C)=C(C)S1 CS-0236945 [0,1,0,0,0,1|0,0,0]=2 410 B11R1.314 CC1=CC=C(C(=O)C(C)C)S1 CS-0713849 [0,1,0,0,0,1|1,0,1]=4 411 B11R1.314 CC1=CC=C(C(C)C(=O)O)O1 CS-0262854 [0,1,0,0,0,1|1,1,0]=4 412 B11R1.314 O=C(O)C(=O)C1=CC=C(Br)S1 CS-0242334 [0,1,0,0,0,1|2,0,0]=4 413 B11R1.314 O=C(O)C(=O)C1=CC=C(Cl)S1 CS-0236985 [0,1,0,0,0,1|2,0,0]=4 414 B11R1.23 CC1=CC(C(=O)C#N)=CC=C1 CS-0317493 [0,1,0,0,0,1|1,0,1]=4 415 B11R1.23 CC1=CC=CC(C(=O)NN)=N1 CS-0238288 [0,1,0,0,0,1|2,0,0]=4 416 B11R1.23 CCC(=O)C1=CC(C)=CN=C1 CS-0535416 [0,1,0,0,0,1|1,0,0]=3 417 B11R1.23 CNC(=O)C1=CC(Br)=NC=C1 CS-0212385 [0,1,0,0,0,1|2,0,0]=4 418 B11R1.23 CNC(=O)C1=CC=CC(Cl)=C1 CS-0784853 [0,1,0,0,0,1|2,0,0]=4 419 B11R1.23 CNC(=O)C1=NC(Br)=CC=C1 CS-0212668 [0,1,0,0,0,1|2,0,0]=4 420 B11R1.23 COC(=O)C1=CC(N)=CN=C1 CS-0309368 [0,1,0,0,0,1|2,0,0]=4 421 B11R1.23 COC(=O)C1=CC=C[N+](C)=C1 CS-0468915 [0,1,0,0,0,1|2,0,0]=4 422 B11R1.23 COC(=O)C1=NC(C)=CC=N1 CS-0049026 [0,1,0,0,0,1|1,0,0]=3 423 B11R1.23 COC(=O)C1=NC=CC(Cl)=C1 CS-W015242 [0,1,0,0,0,1|2,0,0]=4 424 B11R1.23 COC(=O)C1=NC=CC(O)=C1 CS-0208315 [0,1,0,0,0,1|2,0,0]=4 425 B11R1.23 NCC(=O)C1=CC=CC(Br)=C1 CS-0037552 [0,1,0,0,0,1|2,0,0]=4 426 B11R1.23 NCC(=O)C1=CC=CC(F)=C1 CS-0434956 [0,1,0,0,0,1|2,0,0]=4 427 B11R1.23 O=C(CBr)C1=CC(Cl)=NC=C1 CS-0317617 [0,1,0,0,0,1|2,0,0]=4 428 B11R1.23 O=C(CBr)C1=CC(I)=CC=C1 CS-0454236 [0,1,0,0,0,1|2,0,0]=4 429 B11R1.23 O=C(CCl)C1=CC(F)=CC=C1 CS-0197269 [0,1,0,0,0,1|2,0,0]=4 430 B11R1.23 O=C(CCl)C1=CC=CC(Cl)=C1 CS-0005773 [0,1,0,0,0,1|2,0,0]=4 431 B11R1.74 CC(=O)C1=CC(F)=CC(C)=C1 CS-0460990 [0,1,0,0,0,1|1,0,0]=3 432 B11R1.74 CC(=O)C1=CC(O)=CC(Br)=C1 CS-0884624 [0,1,0,0,0,1|2,0,0]=4 433 B11R1.74 CC(=O)C1=NC(Br)=CC(Br)=C1 CS-0551134 [0,1,0,0,0,1|2,0,0]=4 434 B11R1.74 CC(=O)C1=NC(Br)=CC(Cl)=C1 CS-0699150 [0,1,0,0,0,1|2,0,0]=4 435 B11R1.74 CC1=CC(C(=O)O)=CC(C)=N1 CS-0246077 [0,1,0,0,0,1|2,0,0]=4 436 B11R1.74 CC1=CC(C(N)=O)=CC(Br)=C1 CS-0683572 [0,1,0,0,0,1|2,0,0]=4 437 B11R1.74 CC1=CC(C(N)=O)=CC(F)=C1 CS-0322999 [0,1,0,0,0,1|2,0,0]=4 438 B11R1.74 CC1=CC(C)=CC(C(N)=O)=C1 CS-0709330 [0,1,0,0,0,1|2,0,0]=4 439 B11R1.74 CC1=CC(Cl)=CC(C(=O)O)=N1 CS-0005503 [0,1,0,0,0,1|2,0,0]=4 440 B11R1.155 CC1=CC(S(C)(=O)=O)=CC=C1 CS-0339732 [0,1,0,0,0,1|2,0,0]=4 441 B11R1.155 CC1=NC(S(C)(=O)=O)=NC=C1 CS-0129383 [0,1,0,0,0,1|2,0,0]=4 442 B11R1.159 CC(=O)C1=C(C)C(Cl)=CC=C1 CS-0222575 [0,1,0,0,0,1|2,0,0]=4 443 B11R1.159 CC(=O)C1=C(C)C(O)=CC=C1 CS-0153512 [0,1,0,0,0,1|2,0,0]=4 444 B11R1.159 CC(=O)C1=C(N)C(Cl)=NC=C1 CS-0072637 [0,1,0,0,0,1|2,0,0]=4 445 B11R1.159 CC(=O)C1=CC=CC(F)=C1N CS-0850935 [0,1,0,0,0,1|2,0,0]=4 446 B11R1.159 CC(=O)C1=CC=CC(O)=C1F CS-0375927 [0,1,0,0,0,1|2,0,0]=4 447 B11R1.159 CC(=O)C1=CC=CN(C)C1=O CS-0976965 [0,1,0,0,0,1|2,0,0]=4 448 B11R1.159 CC1=C(C)C(C(=O)O)=CC=N1 CS-0163287 [0,1,0,0,0,1|2,0,0]=4 449 B11R1.167 CC(=O)C1=C(C)C=CC(N)=C1 CS-0224396 [0,1,0,0,0,1|2,0,0]=4 450 B11R1.167 CC(=O)C1=C(C)N=CC(Br)=C1 CS-0153531 [0,1,0,0,0,1|2,0,0]=4 451 B11R1.167 CC(=O)C1=C(C)N=CC(C)=N1 CS-0152834 [0,1,0,0,0,1|1,0,0]=3 452 B11R1.167 CC(=O)C1=C(Cl)N=CC(C)=N1 CS-0757723 [0,1,0,0,0,1|1,0,0]=3 453 B11R1.167 CC(=O)C1=C(F)C=CC(N)=C1 CS-0209963 [0,1,0,0,0,1|2,0,0]=4 454 B11R1.167 CC(=O)C1=C(F)C=NC(Br)=C1 CS-0143692 [0,1,0,0,0,1|2,0,0]=4 455 B11R1.167 CC(=O)C1=C(N)C=CC(Cl)=N1 CS-0662143 [0,1,0,0,0,1|2,0,0]=4 456 B11R1.167 CC(=O)C1=CC(Br)=CN=C1N CS-0309976 [0,1,0,0,0,1|2,0,0]=4 457 B11R1.167 CC(=O)C1=NC(Br)=CC=C1Br CS-0959913 [0,1,0,0,0,1|2,0,0]=4 458 B11R1.167 CC1=CC(C(=O)O)=C(N)C=N1 CS-0050683 [0,1,0,0,0,1|2,0,0]=4 459 B11R1.167 CC1=CC(C(=O)O)=C(O)C=N1 CS-0450450 [0,1,0,0,0,1|2,0,0]=4 460 B11R1.167 CC1=CC(C(N)=O)=C(Cl)N=C1 CS-0331479 [0,1,0,0,0,1|2,0,0]=4 461 B11R1.167 CC1=CC(C(N)=O)=C(N)N=C1 CS-0153122 [0,1,0,0,0,1|2,0,0]=4 462 B11R1.167 CC1=CC=C(C)C(C(=O)O)=N1 CS-0097913 [0,1,0,0,0,1|2,0,0]=4 463 B11R1.167 CC1=CN=C(F)C(C(=O)O)=C1 CS-0127894 [0,1,0,0,0,1|2,0,0]=4 464 B11R1.167 CC1=NC=C(Cl)C(C(=O)O)=N1 CS-0050533 [0,1,0,0,0,1|2,0,0]=4 465 B11R1.266 CC(=O)C1=CC=CC(CCl)=C1 CS-0452306 [0,1,0,0,0,1|1,0,0]=3 466 B11R1.266 CCC1=CC=CC(C(=O)O)=N1 CS-W022495 [0,1,0,0,0,1|2,0,0]=4 467 B11R1.266 CNC1=CC=CC(C(=O)O)=C1 CS-W007248 [0,1,0,0,0,1|2,0,0]=4 468 B11R1.266 CNC1=CC=CC(C(C)=O)=C1 CS-W007301 [0,1,0,0,0,1|1,0,0]=3 469 B11R1.266 CNC1=CN=CC(C(=O)O)=C1 CS-0070382 [0,1,0,0,0,1|2,0,0]=4 470 B11R1.266 COC1=CC(C(=O)O)=NC=C1 CS-0692437 [0,1,0,0,0,1|2,0,0]=4 471 B11R1.266 COC1=CC(C(N)=O)=CC=N1 CS-0082381 [0,1,0,0,0,1|2,0,0]=4 472 B11R1.266 COC1=CC=CC(C(N)=O)=N1 CS-0150320 [0,1,0,0,0,1|2,0,0]=4 473 B11R1.266 COC1=NC(C(C)=O)=NC=C1 CS-0105729 [0,1,0,0,0,1|1,0,0]=3 474 B11R1.266 CSC1=CC=CC(C(=O)O)=N1 CS-0195482 [0,1,0,0,0,1|2,0,0]=4 475 B11R1.266 C\N=C1\C=C(C(=O)O)C=CN1 CS-0300497 [0,1,0,0,0,1|2,0,0]=4 476 B11R1.266 NC(=O)C1=CC(CCl)=CC=C1 CS-0695385 [0,1,0,0,0,1|2,0,0]=4 477 B11R1.266 NC(=O)C1=CC(CO)=CC=C1 CS-0696311 [0,1,0,0,0,1|2,0,0]=4 478 B11R1.266 NCC1=CC(C(N)=O)=CC=C1 CS-0108743 [0,1,0,0,0,1|2,0,0]=4 479 B11R1.266 NCC1=CC(C(N)=O)=CC=C1 CS-0251850 [0,1,0,0,0,1|2,0,0]=4 480 B11R1.6 CNS(=O)(=O)C1=CC=C(Br)S1 CS-0251491 [0,2,0,0,0,0|2,0,0]=4 481 B11R1.6 CNS(=O)(=O)C1=CC=C(Cl)S1 CS-0252572 [0,2,0,0,0,0|2,0,0]=4 482 B11R1.15 CCCC(=O)C1=CC=C(C)S1 CS-0672219 [0,2,0,0,0,0|0,0,0]=2 483 B11R1.15 CCOC(=O)C1=CC=C(Br)N1 CS-0019300 [0,2,0,0,0,0|2,0,0]=4 484 B11R1.15 CCOC(=O)C1=CC=C(C)O1 CS-0215605 [0,2,0,0,0,0|0,1,0]=3 485 B11R1.15 CCOC(=O)C1=CC=C(C)S1 CS-0667785 [0,2,0,0,0,0|0,0,0]=2 486 B11R1.15 CCOC(=O)C1=CC=C(N)N1 CS-0455392 [0,2,0,0,0,0|2,0,0]=4 487 B11R1.15 CCOC(=O)C1=CNC(=O)S1 CS-0936394 [0,2,0,0,0,0|2,0,0]=4 488 B11R1.15 N#CCC(=O)C1=CC=C(Br)O1 CS-0248565 [0,2,0,0,0,0|1,1,0]=4 489 B11R1.15 N#CCC(=O)C1=CC=C(Br)S1 CS-0699221 [0,2,0,0,0,0|1,0,0]=3 490 B11R1.44 CCC1=CC=C(C(=O)CCl)S1 CS-0233238 [0,2,0,0,0,0|0,0,0]=2 491 B11R1.44 CCC1=CC=C(C(=O)NN)S1 CS-0213379 [0,2,0,0,0,0|1,0,0]=3 492 B11R1.44 CCC1=CC=C(C(=O)OC)O1 CS-0120818 [0,2,0,0,0,0|0,1,0]=3 493 B11R1.44 CCN1C=CC(C(=O)OC)=N1 CS-0237033 [0,2,0,0,0,0|2,0,0]=4 494 B11R1.44 CNC(=O)C1=CC=C(CN)O1 CS-0742460 [0,2,0,0,0,0|0,1,0]=3 495 B11R1.44 CNC(=O)C1=CC=C(CO)O1 CS-0366990 [0,2,0,0,0,0|0,1,0]=3 496 B11R1.44 COC(=O)C1=CC=C(CBr)S1 CS-0696003 [0,2,0,0,0,0|0,0,0]=2 497 B11R1.44 COC(=O)C1=CC=C(CN)N1 CS-0150804 [0,2,0,0,0,0|1,0,0]=3 498 B11R1.44 COC(=O)C1=NN(CO)C=C1 CS-0239332 [0,2,0,0,0,0|2,0,0]=4 499 B11R1.225 CC1=CC(=O)N(C(=O)CCl)O1 CS-0733829 [0,2,0,0,0,0|1,1,0]=4 500 B11R1.225 CC1=CC(C(=O)CBr)=C(C)S1 CS-0257510 [0,2,0,0,0,0|2,0,0]=4 501 B11R1.225 CC1=NC(C)=C(C(=O)NN)S1 CS-0680353 [0,2,0,0,0,0|2,0,0]=4 502 B11R1.225 CCC(=O)C1=C(C)SC(C)=C1 CS-0713481 [0,2,0,0,0,0|2,0,0]=4 503 B11R1.225 CN1C=C(Cl)C(C(=O)CBr)=N1 CS-0161337 [0,2,0,0,0,0|2,0,0]=4 504 B11R1.225 COC(=O)C1=C(Br)SC(C)=N1 CS-0187516 [0,2,0,0,0,0|2,0,0]=4 505 B11R1.225 COC(=O)C1=C(C)C=C(Br)O1 CS-0038467 [0,2,0,0,0,0|1,1,0]=4 506 B11R1.225 COC(=O)C1=C(C)C=C(Br)S1 CS-0112894 [0,2,0,0,0,0|1,0,0]=3 507 B11R1.225 COC(=O)C1=C(C)NC(C)=C1 CS-0038238 [0,2,0,0,0,0|2,0,0]=4 508 B11R1.225 COC(=O)C1=C(Cl)N=C(Cl)S1 CS-0727569 [0,2,0,0,0,0|2,0,0]=4 509 B11R1.225 COC(=O)C1=C(N)C=C(C)N1 CS-0217227 [0,2,0,0,0,0|1,0,0]=3 510 B11R1.225 COC(=O)C1=C(O)C=C(C)S1 CS-0071892 [0,2,0,0,0,0|0,0,0]=2 511 B11R1.225 COC(=O)C1=C(O)C=C(Cl)S1 CS-1055247 [0,2,0,0,0,0|1,0,0]=3 512 B11R1.225 COC(=O)C1=CN(C)C=C1C CS-0648392 [0,2,0,0,0,0|2,0,0]=4 513 B11R1.225 COC(=O)C1=NN(C)C=C1C CS-0242401 [0,2,0,0,0,0|2,0,0]=4 514 B11R1.225 COC(=O)C1=NN(C)C=C1N CS-0256757 [0,2,0,0,0,0|2,0,0]=4 515 B11R1.226 COC(=O)C1=CC(Br)=C(C)N1 CS-0436360 [0,2,0,0,0,0|1,0,0]=3 516 B11R1.226 COC(=O)C1=CC(Br)=C(Cl)O1 CS-0313969 [0,2,0,0,0,0|1,1,0]=4 517 B11R1.865 COC(=O)C1=C(I)C(C)=CS1 CS-0236303 [0,2,0,0,0,0|2,0,0]=4 518 B11R1.865 COC(=O)C1=CC=C(C)N1C CS-0331190 [0,2,0,0,0,0|1,0,0]=3 519 B11R1.45 CCC1=CC=C(S(=O)(=O)Cl)S1 CS-0071828 [0,2,0,0,0,0|2,0,0]=4 520 B11R1.45 NCC1=CC=C(S(N)(=O)=O)S1 CS-W020197 [0,2,0,0,0,0|2,0,0]=4 521 B11R1.48 CC1=C(CO)C=C(C(=O)O)O1 CS-0134543 [0,2,0,0,0,0|1,1,0]=4 522 B11R1.48 CCC1=C(Br)C=C(C(=O)O)S1 CS-0145837 [0,2,0,0,0,0|1,0,0]=3 523 B11R1.48 CCC1=C(C)C=C(C(=O)O)S1 CS-0452343 [0,2,0,0,0,0|1,0,0]=3 524 B11R1.50 CCC1=NC(C)=C(C(=O)O)S1 CS-0252547 [0,2,0,0,0,0|2,0,0]=4 525 B11R1.50 CCC1=NC(C)=C(C(C)=O)S1 CS-0217625 [0,2,0,0,0,0|1,0,0]=3 526 B11R1.50 CSC1=NC(N)=C(C(C)=O)S1 CS-0235442 [0,2,0,0,0,0|1,0,0]=3 527 B11R1.50 CSC1=NC(N)=C(C(N)=O)S1 CS-0021976 [0,2,0,0,0,0|2,0,0]=4 528 B11R1.124 CCOC1=NC=C(C(=O)O)S1 CS-0249250 [0,2,0,0,0,0|2,0,0]=4 529 B11R1.124 COCC1=CC=C(C(=O)O)S1 CS-0196011 [0,2,0,0,0,0|1,0,0]=3 530 B11R1.124 CSCC1=CC=C(C(=O)O)O1 CS-0230123 [0,2,0,0,0,0|1,1,0]=4 531 B11R1.124 O=C(O)C1=CC=C(CCO)S1 CS-0360554 [0,2,0,0,0,0|1,0,0]=3 532 B11R1.175 CC(=O)C1=CC=C(C(=O)O)O1 CS-0214621 [0,2,0,0,0,0|0,1,1]=4 533 B11R1.175 CC(N)C1=NC=C(C(=O)O)S1 CS-0445502 [0,2,0,0,0,0|2,0,0]=4 534 B11R1.175 NC(=O)C1=CC=C(C(=O)O)S1 CS-0216802 [0,2,0,0,0,0|1,0,1]=4 535 B11R1.646 CC1=CC(Br)=C(S(=O)(=O)Cl)S1 CS-0217833 [0,2,0,0,0,0|2,0,0]=4 536 B11R1.672 CC1=C(C(=O)O)SC(Cl)=C1Cl CS-0153625 [0,2,0,0,0,0|2,0,0]=4 537 B11R1.672 O=C(O)C1=C(Br)C(Br)=C(Br)S1 CS-0532114 [0,2,0,0,0,0|2,0,0]=4 538 B11R1.672 O=C(O)C1=C(Cl)C(Cl)=C(Cl)S1 CS-0157950 [0,2,0,0,0,0|2,0,0]=4 539 B9R1.69 CC1=CC(Br)=C(S)C=C1 CS-0280338 [0,0,1,1,0,0|1,0,1]=4 540 B9R1.69 CC1=CC(Br)=CC=C1S CS-0214904 [0,0,1,1,0,0|2,0,0]=4 541 B9R1.69 CC1=CC(Cl)=CC=C1S CS-0280607 [0,0,1,1,0,0|2,0,0]=4 542 B9R1.69 CC1=CC(F)=C(S)C=C1 CS-0237454 [0,0,1,1,0,0|1,0,1]=4 543 B9R1.69 CC1=CC=C(Cl)C(C)=C1 CS-0040120 [0,0,1,1,0,0|2,0,0]=4 544 B9R1.33 CSSC1=C(C)OC=C1 CS-0454577 [0,0,1,1,0,0|1,0,1]=4 545 B11R2.60 CN1C=CC2=C1CCC2=O CS-0052472 [0,1,0,1,0,0|2,0,0]=4 546 B9R1.2 C=CC1=CC(C)=CN=C1 CS-0056743 [1,0,0,0,0,1|1,0,1]=4 547 B9R1.2 C=CC1=NC=CC(C)=C1 CS-0196764 [1,0,0,0,0,1|1,0,1]=4 548 B9R1.2 CC1=NC=CC(C=O)=N1 CS-W008742 [1,0,0,0,0,1|1,0,0]=3 549 B9R1.2 CCC1=CC=CC(C)=C1 CS-W013572 [1,0,0,0,0,1|1,0,1]=4 550 B9R1.2 CCC1=CC=CC(C)=N1 CS-0217858 [1,0,0,0,0,1|1,0,1]=4 551 B9R1.2 CNC1=CC=CC(C)=N1 CS-0152813 [1,0,0,0,0,1|2,0,0]=4 552 B9R1.2 CNC1=CN=CC(C)=N1 CS-0038230 [1,0,0,0,0,1|2,0,0]=4 553 B9R1.2 CNC1=NC(C)=NC=C1 CS-0045972 [1,0,0,0,0,1|2,0,0]=4 554 B9R1.2 CNC1=NC=CC(C)=N1 CS-0653180 [1,0,0,0,0,1|2,0,0]=4 555 B9R1.2 COC1=NC(C)=CN=C1 CS-0311527 [1,0,0,0,0,1|2,0,0]=4 556 B9R1.2 COC1=NC=CC(C)=N1 CS-0152798 [1,0,0,0,0,1|2,0,0]=4 557 B9R1.2 CSC1=CC(C)=CC=C1 CS-0695315 [1,0,0,0,0,1|2,0,0]=4 558 B9R1.2 NC1=CC=CC(C=O)=C1 CS-0043924 [1,0,0,0,0,1|2,0,0]=4 559 B9R1.2 O=CC1=CC(I)=CN=C1 CS-0192448 [1,0,0,0,0,1|2,0,0]=4 560 B9R1.2 O=CC1=NC(Cl)=CN=C1 CS-W006097 [1,0,0,0,0,1|2,0,0]=4 561 B9R1.13 CC(=O)CC1=CC=CO1 CS-0071306 [1,0,0,0,0,1|0,1,0]=3 562 B9R1.13 CC(=O)CC1=CC=CS1 CS-0037233 [1,0,0,0,0,1|0,0,0]=2 563 B9R1.13 CC(=O)CC1=CSC=C1 CS-0258395 [1,0,0,0,0,1|2,0,0]=4 564 B9R1.13 CC(=O)CN1C=CC=N1 CS-0250525 [1,0,0,0,0,1|2,0,0]=4 565 B9R1.13 CC(=O)NC1=CC=CS1 CS-0075152 [1,0,0,0,0,1|0,0,0]=2 566 B9R1.13 N=C(N)CC1=CC=CS1 CS-0252617 [1,0,0,0,0,1|2,0,0]=4 567 B9R1.13 O=C(O)CC1=CC=CN1 CS-0343301 [1,0,0,0,0,1|2,0,0]=4 568 B9R1.13 O=C(O)CC1=CC=CO1 CS-W005298 [1,0,0,0,0,1|1,1,0]=4 569 B11R1.20 CC(=O)NC1=CNC(=O)C=C1 CS-0187547 [0,0,0,0,0,2|2,0,0]=4 570 B11R1.20 CC(=O)NC1=NC=C(C)N=C1 CS-0667324 [0,0,0,0,0,2|2,0,0]=4 571 B11R1.20 CC(=O)NC1=NC=C(F)C=C1 CS-0084786 [0,0,0,0,0,2|2,0,0]=4 572 B11R1.20 CC(=O)NC1=NC=C(O)C=C1 CS-0153958 [0,0,0,0,0,2|2,0,0]=4 573 B11R1.20 CC(=O)OC1=CC=C(Br)N=C1 CS-0240814 [0,0,0,0,0,2|2,0,0]=4 574 B11R1.20 CC(=O)SC1=CC=C(Br)C=C1 CS-1007799 [0,0,0,0,0,2|2,0,0]=4 575 B11R1.75 CC1=CC=C(\C=C\C(=O)O)O1 CS-0867530 [0,0,0,0,0,2|1,1,0]=4 576 B11R1.157 CC(=O)NC1=CC(F)=CN=C1 CS-0779721 [0,0,0,0,0,2|2,0,0]=4 577 B11R1.157 CC(=O)NC1=CC=CC(Cl)=C1 CS-0277313 [0,0,0,0,0,2|2,0,0]=4 578 B11R1.157 CC(=O)NC1=NC=CC(N)=C1 CS-0153956 [0,0,0,0,0,2|2,0,0]=4 579 B11R1.157 CC(=O)OC1=CC=CC(Cl)=C1 CS-0111923 [0,0,0,0,0,2|2,0,0]=4 580 B11R1.157 CC1=CC(CC(=O)O)=CN=C1 CS-0052258 [0,0,0,0,0,2|2,0,0]=4 581 B11R1.157 CC1=CN=CC(CC(=O)O)=C1 CS-0163159 [0,0,0,0,0,2|2,0,0]=4 582 B11R1.157 CC1=NC(CC(=O)[O-])=CC=C1 CS-0187632 [0,0,0,0,0,2|2,0,0]=4