0 B9R1.11 C/C(=N/O)/C1=CC=CO1 S602906 [0,0,0,0,0,0|4,0,0]=4 1 B9R1.11 C/C(=N\N)/C1=CC=CS1 L164542 [0,0,0,0,0,0|4,0,0]=4 2 B9R1.11 C/C(=N\O)/C1=CC=CN1 L166960 [0,0,0,0,0,0|3,0,0]=3 3 B9R1.11 CCC(=O)C1=CC=CN1 CDS000726 [0,0,0,0,0,0|0,0,0]=0 4 B9R1.11 CCC(=O)C1=CC=CO1 CDS001525 [0,0,0,0,0,0|1,0,0]=1 5 B9R1.11 CCC(=O)C1=CCCC1 T246662 [0,0,0,0,0,0|1,0,2]=3 6 B9R1.11 CCC(N)C1=CC=CS1 T326984 [0,0,0,0,0,0|2,0,1]=3 7 B9R1.11 CCC(N)C1=NC=CS1 CBR00629 [0,0,0,0,0,0|2,0,2]=4 8 B9R1.11 CNC(C)C1=CC=CS1 CBR01263 [0,0,0,0,0,0|3,0,1]=4 9 B9R1.11 COC(=O)C1=NNC=C1 CDS009495 [0,0,0,0,0,0|2,0,1]=3 10 B8R1.7 CC(=O)C1=CNC=C1 CDS015198 [1,0,0,0,0,0|2,0,0]=3 11 B8R1.7 CC(=O)C1=NC=CN1 CBR02095 [1,0,0,0,0,0|1,0,0]=2 12 B8R1.7 CC(N)C1=CC=CS1 BOG00116 [1,0,0,0,0,0|2,0,1]=4 13 B8R1.7 CC(N)C1=CC=CS1 CDS002035 [1,0,0,0,0,0|2,0,1]=4 14 B8R1.7 N=C(N)C1=CC=CO1 CBR00909 [1,0,0,0,0,0|3,0,0]=4 15 B8R1.7 NC(=O)C1=CC=CN1 CDS004399 [1,0,0,0,0,0|1,0,0]=2 16 B8R1.7 NC(=O)C1=CN=CS1 CDS020516 [1,0,0,0,0,0|3,0,0]=4 17 B8R1.7 NC(=O)C1=CSC=N1 CDS006757 [1,0,0,0,0,0|2,0,1]=4 18 B8R1.7 NC(=S)C1=CC=CN1 BOG00082 [1,0,0,0,0,0|1,1,0]=3 19 B8R1.7 NC(=S)C1=CC=CO1 BOG00126 [1,0,0,0,0,0|2,1,0]=4 20 B8R1.7 NC(=S)C1=CC=CS1 CDS014286 [1,0,0,0,0,0|2,1,0]=4 21 B8R1.7 O=C(O)C1=CC=CO1 S927228 [1,0,0,0,0,0|2,0,0]=3 22 B8R1.7 O=C(O)C1=CC=NN1 CDS005690 [1,0,0,0,0,0|2,0,0]=3 23 B8R1.7 O=C(O)C1=CC=NS1 CDS010046 [1,0,0,0,0,0|3,0,0]=4 24 B8R1.7 O=C(O)C1=CN=CS1 CDS007958 [1,0,0,0,0,0|3,0,0]=4 25 B8R1.7 O=C(O)C1=CN=NN1 CDS001736 [1,0,0,0,0,0|3,0,0]=4 26 B8R1.7 O=C(O)C1=NC=CN1 CDS019334 [1,0,0,0,0,0|2,0,0]=3 27 B8R1.8 CCCN1C=CC=C1 PH010280 [1,0,0,0,0,0|2,0,1]=4 28 B8R1.8 CNCC1=CC=CS1 CDS004831 [1,0,0,0,0,0|2,0,1]=4 29 B8R1.8 CNCC1=CC=CS1 PH012021 [1,0,0,0,0,0|2,0,1]=4 30 B8R1.8 CNCC1=NC=CN1 CBR00689 [1,0,0,0,0,0|2,0,1]=4 31 B8R1.8 NCCC1=CC=CO1 CBR02448 [1,0,0,0,0,0|2,0,1]=4 32 B8R1.8 ON=CC1=CC=CS1 S551848 [1,0,0,0,0,0|3,0,0]=4 33 B10R1.11 CCCC(=O)C1=CC=CO1 S593230 [0,1,0,0,0,0|1,0,0]=2 34 B10R1.11 CCCC(=O)C1=CC=CS1 S410160 [0,1,0,0,0,0|1,0,0]=2 35 B10R1.11 CCCC(N)C1=CC=CS1 CBR00906 [0,1,0,0,0,0|2,0,1]=4 36 B10R1.11 CCOC(=O)C1=CC=CN1 CDS000975 [0,1,0,0,0,0|0,0,0]=1 37 B10R1.11 CCOC(=O)C1=CCCC1 S942871 [0,1,0,0,0,0|1,0,2]=4 38 B10R1.11 CCOC(=O)C1=CNC=N1 CVT00042 [0,1,0,0,0,0|1,0,1]=3 39 B10R1.11 CNC[C@@H](O)C1=CC=CO1 PH008825 [0,1,0,0,0,0|1,0,2]=4 40 B10R1.14 CCC(=O)C1=CC=C(S1)Br CBR01166 [0,1,0,0,0,0|1,0,0]=2 41 B10R1.14 CCC(=O)C1=CC=C(S1)C CBR00320 [0,1,0,0,0,0|1,0,0]=2 42 B10R1.14 CNC(=O)C1=NC(=NN1)Br CBR01587 [0,1,0,0,0,0|3,0,0]=4 43 B10R1.14 CNC(=O)C1=NNC(=C1)N CBR01592 [0,1,0,0,0,0|2,0,1]=4 44 B10R1.14 COC(=O)C1=CC(=CS1)Br CDS005911 [0,1,0,0,0,0|2,0,0]=3 45 B10R1.14 COC(=O)C1=CC=C(O1)Br S810541 [0,1,0,0,0,0|2,0,0]=3 46 B10R1.14 COC(=O)C1=CN=C(S1)Cl SYX00302 [0,1,0,0,0,0|3,0,0]=4 47 B10R1.14 COC(=O)C1=CN=C(S1)N PH011707 [0,1,0,0,0,0|3,0,0]=4 48 B10R1.14 COC(=O)C1=COC(=N1)Cl SYX00378 [0,1,0,0,0,0|2,0,1]=4 49 B10R1.14 COC(=O)C1=COC(=N1)N SYX00318 [0,1,0,0,0,0|2,0,1]=4 50 B10R1.14 COC(=O)C1=CSC(=N1)C SYX00285 [0,1,0,0,0,0|2,0,1]=4 51 B10R1.14 COC(=O)C1=CSC(=N1)Cl SYX00303 [0,1,0,0,0,0|2,0,1]=4 52 B10R1.14 COC(=O)C1=NC(=CS1)Br PHB00113 [0,1,0,0,0,0|2,0,1]=4 53 B10R1.14 COC(=O)C1=NOC(=C1)C EME00018 [0,1,0,0,0,0|2,0,1]=4 54 B10R1.14 O=C(CBr)C1=CC=C(S1)Cl CDS003755 [0,1,0,0,0,0|2,0,0]=3 55 B10R1.23 CN(C)C(=O)C1=CC=CO1 PH008437 [0,1,0,0,0,0|2,0,0]=3 56 B10R1.149 CCC(=O)C1=CC=NN1C CBR01985 [0,1,0,0,0,0|1,0,0]=2 57 B10R1.149 CCC(=O)C1=NC=NN1C CBR01363 [0,1,0,0,0,0|2,0,0]=3 58 B10R1.149 CCC(N)C1=CC=NN1C CBR00298 [0,1,0,0,0,0|2,0,1]=4 59 B10R1.149 CN1C=CC=C1/C(=N/O)/N CBR01624 [0,1,0,0,0,0|3,0,0]=4 60 B10R1.149 CN1C=CC=C1C(=O)NN CDS015065 [0,1,0,0,0,0|2,0,0]=3 61 B10R1.149 COC(=O)C1=C(SC=N1)Br SYX00326 [0,1,0,0,0,0|2,0,1]=4 62 B10R1.149 COC(=O)C1=C(SC=N1)C SYX00155 [0,1,0,0,0,0|2,0,1]=4 63 B10R1.149 COC(=O)C1=COC=C1C T208701 [0,1,0,0,0,0|3,0,0]=4 64 B10R1.149 COC(=O)C1=NNC=C1C S940550 [0,1,0,0,0,0|2,0,1]=4 65 B10R1.149 O=C(CBr)C1=C(C=CS1)Cl CDS014953 [0,1,0,0,0,0|2,0,0]=3 66 B10R2.32 O=C1CCC2N1C=CC2 PH015928 [0,0,0,1,0,0|2,0,1]=4 67 B10R1.15 C1(C=CCC=C1)C(=O)OC T175234 [0,0,0,0,0,1|2,0,1]=4 68 B10R1.15 C=C(OC)C1=CC=CC=C1 PH000315 [0,0,0,0,0,1|3,0,0]=4 69 B10R1.15 CCB(N)C1=CC=CC=C1 S320773 [0,0,0,0,0,1|3,0,0]=4 70 B10R1.15 CCC(=O)C1=NC=CC=C1 CDS007501 [0,0,0,0,0,1|0,0,1]=2 71 B10R1.15 CCC(N)C1=CC=CC=N1 CBR00661 [0,0,0,0,0,1|1,0,2]=4 72 B10R1.15 CCC(N)C1=CC=CN=C1 CBR00143 [0,0,0,0,0,1|1,0,2]=4 73 B10R1.15 CCC(N)C1=CC=NC=C1 CBR01655 [0,0,0,0,0,1|2,0,1]=4 74 B10R1.15 CCN(C)C1=CC=CC=C1 R750956 [0,0,0,0,0,1|3,0,0]=4 75 B10R1.15 CCN(N)C1=CC=CC=C1 PH010945 [0,0,0,0,0,1|3,0,0]=4 76 B10R1.15 CSC(=N)C1=CC=CC=N1 BOG00223 [0,0,0,0,0,1|2,0,1]=4 77 B10R1.15 CSC(=N)C1=CC=NC=C1 BOG00224 [0,0,0,0,0,1|3,0,0]=4 78 B10R1.15 CSC(=O)C1=CC=CC=C1 S918059 [0,0,0,0,0,1|2,0,0]=3 79 B10R1.15 NCC(=O)C1=CC=NC=C1 PH019007 [0,0,0,0,0,1|2,0,0]=3 80 B10R1.15 NNC(=O)C1=CC=CC=C1 S463663 [0,0,0,0,0,1|3,0,0]=4 81 B10R1.15 NNC(=O)C1=CC=CC=N1 CDS000511 [0,0,0,0,0,1|2,0,1]=4 82 B10R1.15 O=C(CBr)C1=NC=CC=C1 CDS017722 [0,0,0,0,0,1|1,0,1]=3 83 B10R1.15 O=C(N[O-])C1=CC=CC=C1 S453080 [0,0,0,0,0,1|3,0,0]=4 84 B10R1.27 CCC(=O)NC1=NC=CS1 PH008993 [0,0,0,0,0,1|1,0,1]=3 85 B10R1.27 COC(=O)NC1=NC=CS1 T324566 [0,0,0,0,0,1|2,0,1]=4 86 B10R1.27 O=C(CCl)NC1=NC=CS1 PH009983 [0,0,0,0,0,1|2,0,1]=4 87 B7R1.1 CSC1=CC=CS1 R436550 [2,0,0,0,0,0|2,0,0]=4 88 B7R1.1 O=CC1=CC=NN1 CDS003145 [2,0,0,0,0,0|1,0,0]=3 89 B7R1.1 O=CC1=NNC=C1 CDS009918 [2,0,0,0,0,0|1,0,1]=4 90 B7R1.1 O=CC1=NOC=C1 CDS009683 [2,0,0,0,0,0|1,0,1]=4 91 B7R1.1 OCC1=CC=CN1 CDS009556 [2,0,0,0,0,0|1,0,0]=3 92 B7R1.1 SCC1=CC=CS1 CDS000069 [2,0,0,0,0,0|2,0,0]=4 93 B9R0.46 C/C=C/C/C=C/C(=O)OC S765929 [0,1,1,0,0,0|2,0,0]=4 94 B9R1.35 CC(=O)C1=CC=C(S1)C S552038 [1,1,0,0,0,0|1,0,0]=3 95 B9R1.35 CC(=O)C1=CN=C(O1)N CBR01750 [1,1,0,0,0,0|2,0,0]=4 96 B9R1.35 CC(=O)C1=CNC(=N1)C PH000026 [1,1,0,0,0,0|1,0,1]=4 97 B9R1.35 CC(=O)C1=CSC(=C1)Cl PHB00060 [1,1,0,0,0,0|2,0,0]=4 98 B9R1.35 CC1=CC=C(O1)C(=O)[O-] R127981 [1,1,0,0,0,0|2,0,0]=4 99 B9R1.35 CC1=CNC(=N1)C(=O)O CBR02470 [1,1,0,0,0,0|2,0,0]=4 100 B9R1.35 NC(=O)C1=CC=C(S1)Br CBR00204 [1,1,0,0,0,0|2,0,0]=4 101 B9R1.35 NC1=CSC(=C1)C(=O)O CDS010170 [1,1,0,0,0,0|2,0,0]=4 102 B9R1.35 O=C(Cl)C1=CC(=CS1)Br CDS013861 [1,1,0,0,0,0|2,0,0]=4 103 B9R1.35 O=C(O)C1=CC=C(O1)Cl CDS012743 [1,1,0,0,0,0|2,0,0]=4 104 B9R1.35 O=C1NC=C(N1)C(=O)O CBR00002 [1,1,0,0,0,0|2,0,0]=4 105 B9R1.41 CC(=O)C1=CNC=C1C L164399 [1,1,0,0,0,0|2,0,0]=4 106 B9R1.41 CC1=C(NC=C1)C(=O)O T325260 [1,1,0,0,0,0|1,0,0]=3 107 B9R1.41 CC1=C(NC=N1)C(=O)O CDS007137 [1,1,0,0,0,0|2,0,0]=4 108 B9R1.41 CN1C=CC=C1C(=O)Cl PH016725 [1,1,0,0,0,0|1,0,0]=3 109 B9R1.41 CN1C=CN=C1C(=O)Cl PH018704 [1,1,0,0,0,0|2,0,0]=4 110 B9R1.41 CN1C=CN=C1C(=O)[O-] CDS003312 [1,1,0,0,0,0|2,0,0]=4 111 B9R1.41 NC(=O)C1=C(C=NN1)N CBR00702 [1,1,0,0,0,0|2,0,0]=4 112 B9R1.41 O=C(Cl)C1=C(C=CS1)Br PH010582 [1,1,0,0,0,0|2,0,0]=4 113 B9R1.41 O=C(Cl)C1=C(C=CS1)Cl CDS013694 [1,1,0,0,0,0|2,0,0]=4 114 B9R1.41 O=C(O)C1=C(C=CN1)Cl T266515 [1,1,0,0,0,0|1,0,0]=3 115 B9R1.41 O=C(O)C1=C(C=CO1)Br CDS020682 [1,1,0,0,0,0|2,0,0]=4 116 B9R1.7 CCCC1=CC=C(O1)C L159743 [1,1,0,0,0,0|1,0,1]=4 117 B9R1.7 CCCC1=NC=C(N1)Br CBR01481 [1,1,0,0,0,0|1,0,1]=4 118 B9R1.7 CCOC1=CC(=NN1)C CBR00897 [1,1,0,0,0,0|2,0,0]=4 119 B9R1.12 C(=O)/C=C/C1=CC=CN1 L166448 [1,1,0,0,0,0|0,0,2]=4 120 B9R1.12 CCCCC1=CC=CO1 CDS001204 [1,1,0,0,0,0|1,0,1]=4 121 B9R1.12 CCCCC1=CC=CS1 CDS001487 [1,1,0,0,0,0|1,0,1]=4 122 B9R1.12 NCCCC1=CC=CO1 CBR00236 [1,1,0,0,0,0|1,0,1]=4 123 B9R1.13 CC(O)CC1=CC=CS1 S365017 [1,1,0,0,0,0|1,0,1]=4 124 B9R1.33 CN1C=CC=C1CCN CBR01483 [1,1,0,0,0,0|1,0,1]=4 125 B9R1.33 N(C)CC1=CC=CN1C T316350 [1,1,0,0,0,0|1,0,1]=4 126 B11R1.12 CC/C(=N/O)/C1=CC=CC=C1 S799947 [0,1,0,0,0,1|1,0,1]=4 127 B11R1.12 CC/C(=N\O)/C1=CC=CC=C1 PH011544 [0,1,0,0,0,1|1,0,1]=4 128 B11R1.16 C=CCC(=O)C1=CC=CC=C1 T216402 [0,1,0,0,0,1|1,0,1]=4 129 B11R1.16 CCCS(=O)C1=CC=CC=C1 S799858 [0,1,0,0,0,1|2,0,0]=4 130 B11R1.16 CCNC(=O)C1=CC=CC=C1 S681059 [0,1,0,0,0,1|1,0,0]=3 131 B11R1.16 CCNC(=O)C1=CN=CC=C1 S435422 [0,1,0,0,0,1|0,0,1]=3 132 B11R1.16 CSCC(=O)C1=CC=CC=C1 S834017 [0,1,0,0,0,1|1,0,0]=3 133 B11R1.16 O=C(NCO)C1=CC=CC=C1 S403466 [0,1,0,0,0,1|2,0,0]=4 134 B11R1.16 O=C(SCO)C1=CC=CC=C1 PH006830 [0,1,0,0,0,1|2,0,0]=4 135 B11R1.22 CC1=CC=C(C=N1)C(=O)CCl PH019170 [0,1,0,0,0,1|1,0,1]=4 136 B11R1.22 CCC(=O)C1=CC=C(C=C1)N PH006875 [0,1,0,0,0,1|1,0,0]=3 137 B11R1.22 CNC(=O)C1=CC=C(C=C1)Br CDS003953 [0,1,0,0,0,1|2,0,0]=4 138 B11R1.22 CNC(=O)C1=CC=C(C=C1)C R580023 [0,1,0,0,0,1|2,0,0]=4 139 B11R1.22 CNC(=O)C1=CC=C(C=C1)F PH011769 [0,1,0,0,0,1|2,0,0]=4 140 B11R1.22 CNC(=O)C1=CC=C(C=C1)N CDS005578 [0,1,0,0,0,1|2,0,0]=4 141 B11R1.22 CNC(=O)C1=CC=C(C=N1)Br CDS007754 [0,1,0,0,0,1|1,0,1]=4 142 B11R1.22 CNC(=O)C1=CNC(=O)C=C1 EME00410 [0,1,0,0,0,1|1,0,0]=3 143 B11R1.22 COC(=O)C1=CC=C(C=N1)Br CDS003613 [0,1,0,0,0,1|1,0,1]=4 144 B11R1.22 COC(=O)C1=CC=C(C=N1)O CDS005288 [0,1,0,0,0,1|1,0,1]=4 145 B11R1.22 COC(=O)C1=CC=C(N=C1)Br CDS004061 [0,1,0,0,0,1|1,0,1]=4 146 B11R1.22 COC(=O)C1=CC=[N+](C=C1)[O-] S311014 [0,1,0,0,0,1|2,0,0]=4 147 B11R1.22 COC(=O)C1=NC=C(C=N1)C PHB00068 [0,1,0,0,0,1|1,0,1]=4 148 B11R1.22 NCC(=O)C1=CC=C(C=C1)Cl S138916 [0,1,0,0,0,1|2,0,0]=4 149 B11R1.22 NCC(=O)C1=CC=C(C=C1)F CDS003453 [0,1,0,0,0,1|2,0,0]=4 150 B11R1.22 O=C(CBr)C1=CC=C(C=C1)O CDS013566 [0,1,0,0,0,1|2,0,0]=4 151 B11R1.22 O=C(CCl)C1=CC=C(C=C1)Br S852406 [0,1,0,0,0,1|2,0,0]=4 152 B11R1.22 O=C(CCl)C1=CC=C(C=C1)O S313750 [0,1,0,0,0,1|2,0,0]=4 153 B11R1.23 CCC(=O)C1=CC=CC(=C1)C PH014761 [0,1,0,0,0,1|1,0,0]=3 154 B11R1.23 CCC(=O)C1=CC=CC(=C1)N PH011160 [0,1,0,0,0,1|1,0,0]=3 155 B11R1.23 CCC(=O)C1=CC=CC(=C1)O PH010905 [0,1,0,0,0,1|1,0,0]=3 156 B11R1.23 CNC(=O)C1=CC(=CC=C1)N CDS003178 [0,1,0,0,0,1|2,0,0]=4 157 B11R1.23 CNC(=O)C1=CC(=CC=C1)O EME00408 [0,1,0,0,0,1|2,0,0]=4 158 B11R1.23 CNC(=O)C1=CC(=CC=N1)Cl CDS004290 [0,1,0,0,0,1|1,0,1]=4 159 B11R1.23 CNC(=O)C1=CC(=NC=C1)Cl CBR00287 [0,1,0,0,0,1|2,0,0]=4 160 B11R1.23 CNC(=O)C1=CC=CC(=C1)C PH007559 [0,1,0,0,0,1|2,0,0]=4 161 B11R1.23 CNC(=O)C1=CC=CC(=C1)Cl PH011022 [0,1,0,0,0,1|2,0,0]=4 162 B11R1.23 COC(=O)C1=CC(=CC=N1)Br CDS014039 [0,1,0,0,0,1|1,0,1]=4 163 B11R1.23 COC(=O)C1=CC(=CC=N1)N CDS021624 [0,1,0,0,0,1|1,0,1]=4 164 B11R1.23 COC(=O)C1=CC(=NC=C1)I ADE000319 [0,1,0,0,0,1|2,0,0]=4 165 B11R1.23 COC(=O)C1=CC=CC(=C1)F CDS020886 [0,1,0,0,0,1|2,0,0]=4 166 B11R1.23 COC(=O)C1=CC=CC(=N1)N CDS005987 [0,1,0,0,0,1|1,0,1]=4 167 B11R1.23 COC(=O)C1=CN=CC(=C1)C PH016250 [0,1,0,0,0,1|1,0,1]=4 168 B11R1.23 COC(=O)C1=CN=CC(=C1)F CDS020854 [0,1,0,0,0,1|1,0,1]=4 169 B11R1.23 COC(=O)C1=C[N+](=CC=C1)C S385360 [0,1,0,0,0,1|1,0,1]=4 170 B11R1.23 COC(=O)C1=NC(=CC=C1)I ADE000338 [0,1,0,0,0,1|1,0,1]=4 171 B11R1.23 COC(=O)C1=NC=CC(=C1)Cl ADE000255 [0,1,0,0,0,1|1,0,1]=4 172 B11R1.23 COC(=O)C1=NC=CC(=C1)Cl ADE000348 [0,1,0,0,0,1|1,0,1]=4 173 B11R1.36 CC(C)C(=O)C1=CC=CN=C1 PH000523 [0,1,0,0,0,1|0,0,1]=3 174 B11R1.36 CN(C)C(=O)C1=CN=CC=C1 CDS000360 [0,1,0,0,0,1|1,0,1]=4 175 B11R1.222 CNC(=O)C1=C(C=CC=C1)N PH000108 [0,1,0,0,0,1|2,0,0]=4 176 B11R1.222 CNC(=O)C1=CC=CC=C1C PH005184 [0,1,0,0,0,1|2,0,0]=4 177 B11R1.222 CNC(=O)C1=CC=CC=C1S S662097 [0,1,0,0,0,1|2,0,0]=4 178 B11R1.222 CNC(=O)C1=CC=CN=C1Cl VBP00050 [0,1,0,0,0,1|1,0,1]=4 179 B11R1.222 COC(=O)C1=C(C=NC=C1)O KOB0086 [0,1,0,0,0,1|2,0,0]=4 180 B11R1.222 COC(=O)C1=CC=NC=C1N ANV00027 [0,1,0,0,0,1|2,0,0]=4 181 B11R1.222 COC(=O)C1=CN=CC=C1N PHB00050 [0,1,0,0,0,1|1,0,1]=4 182 B11R1.222 COC(=O)C1=NC=CC=C1O CDS005462 [0,1,0,0,0,1|1,0,1]=4 183 B11R1.30 CCCC(=O)NC1=NC=CS1 PH008987 [0,1,0,0,0,1|1,0,1]=4 184 B11R1.30 CCOC(=O)CN1C=CC=N1 S945447 [0,1,0,0,0,1|1,0,1]=4 185 B11R1.30 O=C(CCCl)NC1=NC=CS1 PH000394 [0,1,0,0,0,1|1,0,1]=4 186 B11R1.35 CC(C)C(=O)NC1=NC=CS1 PH008459 [0,1,0,0,0,1|1,0,1]=4 187 B11R1.15 CC1=CC=C(S1)C(=O)CC#N CDS023214 [0,2,0,0,0,0|1,0,1]=4 188 B11R1.15 CCOC(=O)C1=CC=C(O1)Br S811386 [0,2,0,0,0,0|1,0,0]=3 189 B11R1.15 CCOC(=O)C1=CN=C(S1)C SYX00356 [0,2,0,0,0,0|2,0,0]=4 190 B11R1.15 CCOC(=O)C1=COC(=N1)Br CDS008103 [0,2,0,0,0,0|1,0,1]=4 191 B11R1.15 CCOC(=O)C1=CSC(=N1)Cl JRD0389 [0,2,0,0,0,0|1,0,1]=4 192 B11R1.29 N#CCCC(=O)C1=CC=CS1 S935255 [0,2,0,0,0,0|1,0,0]=3 193 B11R1.29 N#CSCC(=O)C1=CC=CS1 R701769 [0,2,0,0,0,0|1,0,1]=4 194 B11R1.29 NCCNC(=O)C1=CC=CO1 R733512 [0,2,0,0,0,0|1,0,0]=3 195 B11R1.77 CC(=O)CC(=O)C1=CC=CS1 TMT00516 [0,2,0,0,0,0|1,0,0]=3 196 B11R1.199 CCCC(=O)C1=C(C=CS1)C S593311 [0,2,0,0,0,0|1,0,0]=3 197 B11R1.199 CCOC(=O)C1=C(SC=C1)N JRD0693 [0,2,0,0,0,0|2,0,0]=4 198 B11R1.199 COCC(=O)C1=CC=NN1C CBR01333 [0,2,0,0,0,0|1,0,0]=3 199 B11R1.199 N1C=CC(=C1C)C(=O)OCC S941077 [0,2,0,0,0,0|2,0,0]=4 200 B11R1.225 COC(=O)C1=CC(=CN1C)Br ANV00082 [0,2,0,0,0,0|1,0,0]=3 201 B11R1.225 COC(=O)C1=CC(=CN1C)N ANV00044 [0,2,0,0,0,0|1,0,0]=3 202 B11R1.225 COC(=O)C1=CC(=O)NN1C PH014316 [0,2,0,0,0,0|2,0,0]=4 203 B11R1.865 COC(=O)C1=C(C(=NN1)C)Br JRD0210 [0,2,0,0,0,0|2,0,0]=4 204 B11R1.865 COC(=O)C1=CC=C(N1C)N CDS021001 [0,2,0,0,0,0|1,0,0]=3 205 B11R1.865 COC(=O)C1=CN=C(N1C)S PH003647 [0,2,0,0,0,0|2,0,0]=4 206 B11R1.59 COC(=O)C1=C(C=CO1)OC T266485 [0,2,0,0,0,0|2,0,0]=4 207 B9R1.15 CC[N+]1=CC=CC=C1N S142549 [0,0,1,1,0,0|2,0,0]=4 208 B9R1.15 COC1=CC=CC=C1N CDS000192 [0,0,1,1,0,0|2,0,0]=4 209 B9R1.15 COC1=NC=CC=C1N CDS002836 [0,0,1,1,0,0|2,0,0]=4 210 B9R1.2 CCC1=CC(=NC=C1)N CDS001263 [0,0,1,1,0,0|2,0,0]=4 211 B9R1.2 CCC1=CC=CC(=C1)Br CDS013673 [0,0,1,1,0,0|2,0,0]=4 212 B9R1.2 CCC1=NC(=CC=C1)C S580031 [0,0,1,1,0,0|2,0,0]=4 213 B9R1.2 CNC1=CC(=CC=C1)N S604097 [0,0,1,1,0,0|2,0,0]=4 214 B9R1.2 COC1=CC=CC(=C1)N CDS000467 [0,0,1,1,0,0|2,0,0]=4 215 B9R1.2 COC1=CC=CC(=N1)N ADE000359 [0,0,1,1,0,0|2,0,0]=4 216 B9R1.21 N1C(=CC=C1CC)C=O CBR01642 [0,0,1,1,0,0|2,0,0]=4 217 B9R1.50 O=C1C=CC=CC=CC1 T179078 [0,0,1,1,0,0|1,0,1]=4 218 B9R2.3 C1=NNC2=C1CCC2 CBR01038 [1,0,0,1,0,0|1,0,1]=4 219 B11R2.1 O=C1NCC2=C1C=CC=C2 CDS020611 [0,0,0,1,0,1|2,0,0]=4 220 B11R2.2 C1=COC(=C1)C2=NCCN2 T316245 [0,1,0,1,0,0|2,0,0]=4 221 B11R2.106 CC1NCCN2C1=CC=C2 CBR01041 [0,1,0,1,0,0|1,0,1]=4 222 B11R2.106 CC1NCCN2C1=CC=C2 CDS012737 [0,1,0,1,0,0|1,0,1]=4 223 B11R2.106 O=C1NC=CN2C1=CC=C2 SYX00423 [0,1,0,1,0,0|0,0,2]=4 224 B11R2.106 O=C1NCCC2=C1C=CN2 PH003760 [0,1,0,1,0,0|2,0,0]=4 225 B9R1.6 O=C(Cl)C1=CC=CN=C1 TMT00021 [1,0,0,0,0,1|1,0,1]=4 226 B9R1.6 O=C(Cl)C1=NC=CC=C1 CDS000333 [1,0,0,0,0,1|1,0,1]=4 227 B9R1.6 O=C(O)C1=CC=CC=N1 S172049 [1,0,0,0,0,1|1,0,1]=4 228 B9R1.6 O=C(O)C1=CC=CC=N1 S488666 [1,0,0,0,0,1|1,0,1]=4 229 B9R1.6 O=C([O-])C1=CC=CC=C1 S518174 [1,0,0,0,0,1|2,0,0]=4 230 B9R1.8 C/C=C/C1=CC=CC=N1 PH007383 [1,0,0,0,0,1|0,0,2]=4 231 B9R1.8 CCCC1=CC=NC=C1 S573086 [1,0,0,0,0,1|1,0,1]=4 232 B9R1.8 CCOC1=CC=CC=N1 S442267 [1,0,0,0,0,1|1,0,1]=4 233 B11R1.40 CCC(=O)OC1=CC=CC=C1 CDS000560 [0,0,0,0,0,2|1,0,0]=3 234 B11R1.40 COC(=O)CC1=CC=NC=C1 PH014598 [0,0,0,0,0,2|2,0,0]=4 235 B11R1.40 COC(=O)CC1=CN=CC=C1 S363855 [0,0,0,0,0,2|1,0,1]=4 236 B11R1.40 COC(=O)NC1=CC=CC=C1 S717290 [0,0,0,0,0,2|2,0,0]=4 237 B11R1.40 COC(=O)NC1=CN=CC=C1 R427268 [0,0,0,0,0,2|1,0,1]=4 238 B11R1.40 NCC(=O)NC1=CC=CC=C1 TMT00170 [0,0,0,0,0,2|2,0,0]=4 239 B11R1.40 O=C(CBr)NC1=CC=CC=C1 CDS009932 [0,0,0,0,0,2|2,0,0]=4 240 B11R1.25 CCC(=O)/C=C/C1=CC=CN1 L167339 [0,0,0,0,0,2|0,0,0]=2 241 B11R1.25 COC(=O)/C=C/C1=CC=CS1 PH011225 [0,0,0,0,0,2|2,0,0]=4 242 B11R1.25 COC(=O)CCC1=CC=CN1 CDS005344 [0,0,0,0,0,2|1,0,0]=3 243 B11R1.25 O=C(CCl)NCC1=CC=CO1 R468177 [0,0,0,0,0,2|2,0,0]=4 244 B11R1.25 O=C(CCl)NCC1=CC=CS1 PH003716 [0,0,0,0,0,2|2,0,0]=4 245 B11R1.25 O=C(CCl)OCC1=CC=CO1 S836451 [0,0,0,0,0,2|2,0,0]=4