0 B10R1.11 CCCC(=O)C1=CC=CO1 2H17-1-20 [0,0,0,0,0,0|0,0,0]=0 1 B10R1.11 CCCC(=O)N1C=CN=C1 4H17-1-0K [0,0,0,0,0,0|3,0,0]=3 2 B10R1.11 CCNC(=O)C1=CSC=C1 8H48-1-0Q [0,0,0,0,0,0|3,0,0]=3 3 B10R1.11 CCOC(=N)C1=CC=CS1 8H66-5-2Z [0,0,0,0,0,0|2,1,0]=3 4 B10R1.11 CCOC(=O)C1=CC=CO1 2H23-1-35 [0,0,0,0,0,0|1,0,0]=1 5 B10R1.11 CCOC(=O)C1=CN=CS1 8H23-1-11 [0,0,0,0,0,0|2,1,0]=3 6 B10R1.11 CCOC(=O)C1=CNN=N1 4H23-1-GD [0,0,0,0,0,0|4,0,0]=4 7 B10R1.11 CCOC(=O)C1=COC=C1 2H23-1-11 [0,0,0,0,0,0|3,0,0]=3 8 B10R1.11 CCOC(=O)C1=CON=C1 4H58-1-E6 [0,0,0,0,0,0|4,0,0]=4 9 B10R1.11 CCOC(=O)C1=CSN=N1 8H23-1-32 [0,0,0,0,0,0|4,0,0]=4 10 B10R1.11 CCOC(=O)C1=NC=CO1 4H23-1-8C [0,0,0,0,0,0|2,0,0]=2 11 B10R1.11 CCOC(=O)C1=NC=CS1 8H23-1-0H [0,0,0,0,0,0|2,1,0]=3 12 B10R1.11 CCOC(=O)C1=NOC=N1 4H56-1-P2 [0,0,0,0,0,0|4,0,0]=4 13 B10R1.11 CCOC(=O)C1CC=CC1 2423-1-0D [0,0,0,0,0,0|2,0,2]=4 14 B10R1.11 CCOC(=O)N1C=CC=C1 4H56-1-07S [0,0,0,0,0,0|3,0,0]=3 15 B10R1.11 CCOC(=O)N1C=CN=C1 4H23-1-LP [0,0,0,0,0,0|4,0,0]=4 16 B10R1.11 N#CCC(=O)C1=CC=CN1 4H37-1-59 [0,0,0,0,0,0|2,0,1]=3 17 B10R1.11 N#CCC(=O)C1=CSC=C1 8H37-1-0B [0,0,0,0,0,0|3,0,1]=4 18 B9R1.11 CCC(=O)C1=CC=CN1 4H17-1-9P [1,0,0,0,0,0|1,0,0]=2 19 B9R1.11 CCC(=O)C1=CC=CS1 6H17-1-23 [1,0,0,0,0,0|0,1,0]=2 20 B9R1.11 CCC(=O)C1=NC=CS1 8H17-1-0G [1,0,0,0,0,0|1,1,0]=3 21 B9R1.11 CCC(N)C1=CC=CS1 7H33-5-08 [1,0,0,0,0,0|1,1,1]=4 22 B9R1.11 CNC(=O)C1=CC=CN1 4H48-1-06J [1,0,0,0,0,0|2,0,0]=3 23 B9R1.11 COC(=O)C1=CC=NS1 8H23-1-02 [1,0,0,0,0,0|2,1,0]=4 24 B9R1.11 COC(=O)C1=COC=C1 2H23-1-1C [1,0,0,0,0,0|3,0,0]=4 25 B9R1.11 COC(=O)C1=CSC=C1 6H23-1-0K [1,0,0,0,0,0|3,0,0]=4 26 B9R1.11 COC(=O)C1=NC=CS1 8H23-1-0J [1,0,0,0,0,0|2,1,0]=4 27 B9R1.11 COC(=O)N1C=CC=C1 4H51-1-83 [1,0,0,0,0,0|3,0,0]=4 28 B9R1.11 CSC(=O)C1=CSC=N1 8H66-1-28 [1,0,0,0,0,0|3,0,0]=4 29 B9R1.11 N#CC(=O)C1=CC=CS1 8H46-1-X0 [1,0,0,0,0,0|1,1,1]=4 30 B9R1.11 NNC(=O)C1=CC=CN1 4H39-1-36 [1,0,0,0,0,0|3,0,0]=4 31 B9R1.11 NNC(=O)C1=CC=CO1 4H39-1-22 [1,0,0,0,0,0|2,0,0]=3 32 B9R1.11 O=C(CBr)C1=CC=CO1 2H17-9-X0 [1,0,0,0,0,0|1,0,0]=2 33 B9R1.11 O=C(CCl)C1=CC=CS1 6H17-5-X1 [1,0,0,0,0,0|1,1,0]=3 34 B9R1.11 O=C(O[Cu])C1=CC=CS1 9629-1-00 [1,0,0,0,0,0|2,1,0]=4 35 B9R1.11 O=CC(=O)C1=CC=CS1 6H18-1-X0 [1,0,0,0,0,0|1,1,1]=4 36 B9R1.11 OC[C@@H](O)C1=CC=CO1 2H04-1-03 [1,0,0,0,0,0|1,0,2]=4 37 B9R1.12 BrCCCC1=CC=CS1 5H66-9-0K [1,0,0,0,0,0|1,1,1]=4 38 B9R1.12 CCCCC1=CC=CS1 5H66-1-23 [1,0,0,0,0,0|0,1,1]=3 39 B9R1.12 CCCCC1=NC=CN1 3H32-1-GY [1,0,0,0,0,0|2,0,1]=4 40 B9R1.12 CCCCN1C=CC=N1 3H32-1-NQ [1,0,0,0,0,0|2,0,1]=4 41 B9R1.12 CCNCC1=CC=CS1 7H31-1-0C [1,0,0,0,0,0|1,1,1]=4 42 B9R1.12 CCOCC1=CC=CO1 2H07-1-0D [1,0,0,0,0,0|1,0,1]=3 43 B9R1.12 CSSCC1=CC=CO1 6H66-1-1B [1,0,0,0,0,0|2,0,1]=4 44 B9R1.12 O=C\C=C\C1=CC=CO1 2H15-1-0U [1,0,0,0,0,0|1,0,2]=4 45 B9R1.12 OCCCC1=CC=CS1 6H21-1-0E [1,0,0,0,0,0|1,1,1]=4 46 B11R1.15 CCOC(=O)C1=CC(=O)CC1 2429-1-02 [0,1,0,0,0,0|2,0,1]=4 47 B11R1.15 CCOC(=O)C1=CC(Br)=NO1 4H23-9-0A [0,1,0,0,0,0|2,0,0]=3 48 B11R1.15 CCOC(=O)C1=CC(C)=CN1 4H58-1-XX [0,1,0,0,0,0|2,0,0]=3 49 B11R1.15 CCOC(=O)C1=CC(C)=CS1 6H66-1-60 [0,1,0,0,0,0|1,1,0]=3 50 B11R1.15 CCOC(=O)C1=CC(I)=CN1 4H23-H-10 [0,1,0,0,0,0|2,0,0]=3 51 B11R1.15 CCOC(=O)C1=CC=C(C)N1 4H23-1-76 [0,1,0,0,0,0|2,0,0]=3 52 B11R1.15 CCOC(=O)C1=CC=C(Cl)S1 6H23-5-0D [0,1,0,0,0,0|1,1,0]=3 53 B11R1.15 CCOC(=O)C1=CN(C)C=N1 4H23-1-DT [0,1,0,0,0,0|3,0,0]=4 54 B11R1.15 CCOC(=O)C1=CN=C(Br)O1 4H58-B-32 [0,1,0,0,0,0|2,0,0]=3 55 B11R1.15 CCOC(=O)C1=CN=C(C)S1 8H70-1-T9 [0,1,0,0,0,0|2,1,0]=4 56 B11R1.15 CCOC(=O)C1=CN=C(Cl)S1 8H23-5-0A [0,1,0,0,0,0|2,1,0]=4 57 B11R1.15 CCOC(=O)C1=CN=C(N)N1 4H58-1-7Q [0,1,0,0,0,0|3,0,0]=4 58 B11R1.15 CCOC(=O)C1=CN=C(N)S1 8H58-5-X3 [0,1,0,0,0,0|2,1,0]=4 59 B11R1.15 CCOC(=O)C1=CNC(=O)O1 4H56-1-0E [0,1,0,0,0,0|2,0,0]=3 60 B11R1.15 CCOC(=O)C1=COC(Br)=C1 2H23-9-12 [0,1,0,0,0,0|3,0,0]=4 61 B11R1.15 CCOC(=O)C1=NC(Br)=CS1 8H70-9-10 [0,1,0,0,0,0|2,1,0]=4 62 B11R1.15 CCOC(=O)C1=NC=C(C)S1 8H23-1-22 [0,1,0,0,0,0|2,1,0]=4 63 B11R1.15 CCOC(=O)C1=NN(C)C=C1 4H23-1-GR [0,1,0,0,0,0|3,0,0]=4 64 B11R1.15 CCOC(=O)C1=NN=C(C)O1 4H58-1-YM [0,1,0,0,0,0|3,0,0]=4 65 B11R1.29 CCCCC(=O)C1=CC=CO1 2H17-1-21 [0,1,0,0,0,0|0,0,0]=1 66 B11R1.29 CCCNC(=O)C1=CSC=C1 8H48-1-0X [0,1,0,0,0,0|2,0,0]=3 67 B11R1.29 CCCOC(=O)C1=CC=CO1 2H23-1-1M [0,1,0,0,0,0|0,0,0]=1 68 B11R1.29 CNCC[C@H](O)C1=CC=CS1 8H66-1-2E [0,1,0,0,0,0|0,1,2]=4 69 B11R1.31 N#CC(F)C(=O)C1=CC=CO1 4H37-3-0W [0,1,0,0,0,0|1,0,1]=3 70 B11R1.77 CC(C)NC(=O)C1=CSC=C1 8H48-1-0V [0,1,0,0,0,0|3,0,0]=4 71 B11R1.199 CCNC(=O)C1=CC=CN1C 4H48-1-06F [0,1,0,0,0,0|2,0,0]=3 72 B11R1.199 CCOC(=O)C1=C(Br)N=CO1 4H23-9-68 [0,1,0,0,0,0|2,0,0]=3 73 B11R1.199 CCOC(=O)C1=C(Br)N=CS1 8H70-9-11 [0,1,0,0,0,0|2,1,0]=4 74 B11R1.199 CCOC(=O)C1=C(Br)SC=C1 6H66-9-0D [0,1,0,0,0,0|3,0,0]=4 75 B11R1.199 CCOC(=O)C1=C(C)C=NN1 4H23-1-FC [0,1,0,0,0,0|3,0,0]=4 76 B11R1.199 CCOC(=O)C1=C(C)N=CS1 8H23-1-39 [0,1,0,0,0,0|2,1,0]=4 77 B11R1.199 CCOC(=O)C1=C(C)NC=C1 4H23-1-31 [0,1,0,0,0,0|3,0,0]=4 78 B11R1.199 CCOC(=O)C1=C(C)OC=C1 2F23-1-00 [0,1,0,0,0,0|3,0,0]=4 79 B11R1.199 CCOC(=O)C1=C(C)OC=N1 4H23-1-GU [0,1,0,0,0,0|3,0,0]=4 80 B11R1.199 CCOC(=O)C1=C(C)SC=C1 6H23-1-0N [0,1,0,0,0,0|3,0,0]=4 81 B11R1.199 CCOC(=O)C1=C(N)C=CN1 4H56-5-U0 [0,1,0,0,0,0|2,0,0]=3 82 B11R1.199 CCOC(=O)C1=C(N)NC=C1 4H56-1-KP [0,1,0,0,0,0|3,0,0]=4 83 B11R1.199 CCOC(=O)C1=C(N)SC=N1 8H70-1-0J [0,1,0,0,0,0|3,0,0]=4 84 B11R1.199 CCOC(=O)C1=CC=CN1N 4H39-5-0C [0,1,0,0,0,0|2,0,0]=3 85 B11R1.199 CCOC(=O)C1=CC=NN1C 4H23-1-F8 [0,1,0,0,0,0|3,0,0]=4 86 B11R1.199 CCOC(=O)C1=CN=CN1C 4H23-1-DZ [0,1,0,0,0,0|3,0,0]=4 87 B11R1.199 CCOC(=O)C1=NNC=C1I 4H23-H-06 [0,1,0,0,0,0|3,0,0]=4 88 B9R0.5 C\C=C\C=C\C(=O)OCC 2324-1-23 [0,0,1,0,0,0|2,0,0]=3 89 B9R0.35 CCCC(=O)C(=O)OCC 2129-1-1D [0,0,1,0,0,0|1,0,2]=4 90 B11R2.2 C1=CSC(C2=NCCC2)=C1 7H70-1-33 [0,0,0,1,0,0|1,1,0]=3 91 B11R2.106 O=C1CCCC2=C1C=CO2 2H17-1-0J [0,0,0,1,0,0|2,0,0]=3 92 B11R2.106 O=C1CCCC2=C1C=CS2 6H17-1-0B [0,0,0,1,0,0|2,0,0]=3 93 B11R2.106 O=C1CCCC2=C1SN=N2 8H17-1-01 [0,0,0,1,0,0|2,1,0]=4 94 B11R2.106 O=C1CCCC2=NNC=C12 4H17-1-AD [0,0,0,1,0,0|3,0,0]=4 95 B11R2.106 O=C1CCCC2=NON=C12 4H17-1-94 [0,0,0,1,0,0|3,0,0]=4 96 B11R2.106 O=C1CCCN2C=CC=C12 4H48-1-CU [0,0,0,1,0,0|1,0,0]=2 97 B11R2.106 O=C1COCC2=C1C=CN2 4H17-1-AK [0,0,0,1,0,0|3,0,0]=4 98 B11R2.106 O=C1NCCN2C=CC=C12 4H48-1-06Y [0,0,0,1,0,0|2,0,0]=3 99 B11R1.16 CCCC(=O)C1=CC=CC=C1 2617-1-Y7 [0,0,0,0,0,1|1,0,0]=2 100 B11R1.16 CCCC(=O)C1=CC=CC=N1 4H17-1-9H [0,0,0,0,0,1|1,0,0]=2 101 B11R1.16 CCCC(=O)C1=CC=CN=C1 4H17-1-7V [0,0,0,0,0,1|1,0,0]=2 102 B11R1.16 CCCC(N)C1=CC=CC=N1 3H30-1-HJ [0,0,0,0,0,1|2,0,1]=4 103 B11R1.16 CCCC(N)C1=CC=CN=C1 3H30-1-HK [0,0,0,0,0,1|2,0,1]=4 104 B11R1.16 CCCC(O)C1=CC=CC=C1 2602-1-0G [0,0,0,0,0,1|1,0,2]=4 105 B11R1.16 CCNC(=O)C1=CC=CN=C1 4H48-1-04W [0,0,0,0,0,1|2,0,0]=3 106 B11R1.16 CCOC(=N)C1=CC=CC=C1 4656-5-2E [0,0,0,0,0,1|3,0,0]=4 107 B11R1.16 CCOC(=N)C1=CC=CC=N1 4H56-1-26 [0,0,0,0,0,1|3,0,0]=4 108 B11R1.16 CCOC(=O)C1=CC=CC=C1 2623-1-2H [0,0,0,0,0,1|2,0,0]=3 109 B11R1.16 CCOC(=O)C1=CC=CN=C1 4H23-1-D7 [0,0,0,0,0,1|2,0,0]=3 110 B11R1.16 CCOC(=O)C1=CC=NC=N1 4H23-1-DM [0,0,0,0,0,1|2,0,0]=3 111 B11R1.16 CCOC(=O)C1=CC=NN=C1 4H23-1-CW [0,0,0,0,0,1|3,0,0]=4 112 B11R1.16 CCOC(=O)C1=CN=CN=C1 4H23-1-F3 [0,0,0,0,0,1|3,0,0]=4 113 B11R1.16 CCOC(=O)C1=NC=CC=N1 4H23-1-F0 [0,0,0,0,0,1|2,0,0]=3 114 B11R1.16 CCOC(=O)C1=NC=CN=N1 4H58-1-104 [0,0,0,0,0,1|3,0,0]=4 115 B11R1.16 CCOC(=O)C1CCC=CO1 2H23-1-61 [0,0,0,0,0,1|1,0,2]=4 116 B11R1.16 CNOC(=O)C1=CC=CC=C1 4656-5-2V [0,0,0,0,0,1|3,0,0]=4 117 B11R1.16 C\C=C\C(=O)C1=CC=CC=C1 2617-1-1B [0,0,0,0,0,1|1,0,2]=4 118 B11R1.16 N#CCC(=O)C1=CC=NC=C1 4H37-1-W8 [0,0,0,0,0,1|2,0,1]=4 119 B11R1.16 O=S(CCCl)C1=CC=CC=C1 6665-5-00 [0,0,0,0,0,1|3,0,0]=4 120 B11R1.30 CCOC(=O)CC1=CC=CS1 6H23-1-09 [0,0,0,0,0,1|1,1,0]=3 121 B11R1.30 CCOC(=O)CC1=CSC=C1 6H23-1-06 [0,0,0,0,0,1|3,0,0]=4 122 B11R1.30 CCOC(=O)CC1=CSC=N1 8H23-1-0N [0,0,0,0,0,1|3,0,0]=4 123 B11R1.30 CCOC(=O)CC1=NC=CS1 8H23-1-0Q [0,0,0,0,0,1|2,1,0]=4 124 B11R1.30 CCOC(=O)NC1=CC=CS1 8H56-1-0J [0,0,0,0,0,1|1,1,0]=3 125 B8R0.1 C=CCOC(=O)OCC 2328-1-00 [1,0,1,0,0,0|1,0,1]=4 126 B8R0.4 CCC\C=C\C=C\CO 2301-1-0B [1,0,1,0,0,0|0,0,1]=3 127 B8R0.6 C\C=C\C=C\C(=O)OC 2323-1-0M [1,0,1,0,0,0|2,0,0]=4 128 B8R1.7 CC(=O)C1=COC=C1 2H17-1-31 [2,0,0,0,0,0|2,0,0]=4 129 B8R1.7 CC(=O)C1=CSC=N1 8H17-1-0K [2,0,0,0,0,0|2,0,0]=4 130 B8R1.7 CC(=O)C1=NC=CS1 8H70-1-U9 [2,0,0,0,0,0|1,1,0]=4 131 B8R1.7 CC(=O)C1=NNC=C1 4H17-1-A9 [2,0,0,0,0,0|2,0,0]=4 132 B8R1.7 CC(=O)N1C=CC=N1 4H17-1-A6 [2,0,0,0,0,0|2,0,0]=4 133 B8R1.7 CC(O)C1=CC=CO1 2H02-1-01 [2,0,0,0,0,0|0,0,2]=4 134 B8R1.7 NC(=O)C1=CC=CO1 4H48-1-0T [2,0,0,0,0,0|1,0,0]=3 135 B8R1.7 NC(=S)C1=CC=CO1 8H67-1-21 [2,0,0,0,0,0|1,1,0]=4 136 B8R1.7 O=C([O-])C1=CC=CS1 6H22-1-05 [2,0,0,0,0,0|1,1,0]=4 137 B8R1.8 CCCC1=CC=CO1 2H10-1-14 [2,0,0,0,0,0|0,0,0]=2 138 B8R1.8 CCCC1=NC=CN1 3H32-1-KX [2,0,0,0,0,0|2,0,0]=4 139 B8R1.8 CCCC1=NC=CS1 7H70-1-27 [2,0,0,0,0,0|1,1,0]=4 140 B8R1.8 CCCN1C=CC=N1 3H32-1-HP [2,0,0,0,0,0|2,0,0]=4 141 B8R1.8 CNCC1=CC=CS1 7H31-1-0F [2,0,0,0,0,0|1,1,0]=4 142 B8R1.8 CNCC1=CN=CO1 4H31-1-62 [2,0,0,0,0,0|2,0,0]=4 143 B8R1.8 NCCC1=CC=CO1 4H30-1-9R [2,0,0,0,0,0|1,0,0]=3 144 B10R1.14 CC1=CC=C(C(=O)CCl)S1 6H17-5-0B [1,1,0,0,0,0|1,1,0]=4 145 B10R1.14 CC1=CC=C(C(=O)NN)O1 4H39-1-03 [1,1,0,0,0,0|2,0,0]=4 146 B10R1.14 CC[C@H](N)C1=CC=C(C)O1 4H30-1-S0 [1,1,0,0,0,0|1,0,1]=4 147 B10R1.14 COC(=O)C1=CC(Br)=NO1 4H23-9-Z0 [1,1,0,0,0,0|2,0,0]=4 148 B10R1.14 COC(=O)C1=CC(C)=NO1 4H23-1-F4 [1,1,0,0,0,0|2,0,0]=4 149 B10R1.14 COC(=O)C1=CC(F)=CN1 4H23-3-2U [1,1,0,0,0,0|2,0,0]=4 150 B10R1.14 COC(=O)C1=CC(F)=CS1 6H23-3-0D [1,1,0,0,0,0|1,1,0]=4 151 B10R1.14 COC(=O)C1=CC(I)=CN1 4H23-H-0C [1,1,0,0,0,0|2,0,0]=4 152 B10R1.14 COC(=O)C1=CC(O)=NO1 4H23-1-HJ [1,1,0,0,0,0|2,0,0]=4 153 B10R1.14 COC(=O)C1=CC=C(Br)N1 4H58-9-2W [1,1,0,0,0,0|2,0,0]=4 154 B10R1.14 COC(=O)C1=CC=C(C)O1 2H23-1-0Z [1,1,0,0,0,0|1,0,0]=3 155 B10R1.14 COC(=O)C1=CC=C(Cl)N1 4H56-5-99 [1,1,0,0,0,0|2,0,0]=4 156 B10R1.14 COC(=O)C1=CC=C(Cl)S1 6H23-5-0C [1,1,0,0,0,0|1,1,0]=4 157 B10R1.14 COC(=O)C1=CC=C(I)S1 6H66-H-02 [1,1,0,0,0,0|1,1,0]=4 158 B10R1.14 COC(=O)C1=CC=C(N)O1 4H58-1-6D [1,1,0,0,0,0|1,0,0]=3 159 B10R1.14 COC(=O)C1=CN=C(C)O1 4H23-1-CZ [1,1,0,0,0,0|2,0,0]=4 160 B10R1.14 COC(=O)C1=CN=C(Cl)O1 P311-A-28 [1,1,0,0,0,0|2,0,0]=4 161 B10R1.14 COC(=O)C1=CN=C(N)O1 4H58-1-U5 [1,1,0,0,0,0|2,0,0]=4 162 B10R1.14 COC(=O)C1=NC=C(C)O1 4H23-1-G2 [1,1,0,0,0,0|2,0,0]=4 163 B10R1.23 CN(C)C(=O)C1=CC=CN1 4H48-1-A0 [1,1,0,0,0,0|2,0,0]=4 164 B10R1.23 CN(O)C(=O)C1=CC=CO1 4H48-1-077 [1,1,0,0,0,0|1,0,0]=3 165 B10R1.23 O=C(C1=CC=CO1)C(O)O 2H20-1-41 [1,1,0,0,0,0|1,0,0]=3 166 B10R1.149 CN1C=CC=C1C(=O)CCl 4H17-5-3A [1,1,0,0,0,0|2,0,0]=4 167 B10R1.149 CNC(=O)C1=C(C)C=CS1 8H48-1-0Y [1,1,0,0,0,0|1,1,0]=4 168 B10R1.149 CNC(=O)C1=CC=CN1C 4H48-1-06H [1,1,0,0,0,0|2,0,0]=4 169 B10R1.149 COC(=O)C1=C(Br)C=CN1 4H23-9-15 [1,1,0,0,0,0|2,0,0]=4 170 B10R1.149 COC(=O)C1=C(Br)C=CS1 6H23-9-01 [1,1,0,0,0,0|1,1,0]=4 171 B10R1.149 COC(=O)C1=C(C)C=CS1 6H23-1-0H [1,1,0,0,0,0|1,1,0]=4 172 B10R1.149 COC(=O)C1=C(C)C=NO1 4H23-1-7Q [1,1,0,0,0,0|2,0,0]=4 173 B10R1.149 COC(=O)C1=C(Cl)C=CN1 4H58-5-A8 [1,1,0,0,0,0|2,0,0]=4 174 B10R1.149 COC(=O)C1=C(Cl)C=CS1 6H23-5-08 [1,1,0,0,0,0|1,1,0]=4 175 B10R1.149 COC(=O)C1=C(F)C=CS1 6H23-3-0C [1,1,0,0,0,0|1,1,0]=4 176 B10R1.149 COC(=O)C1=C(N)C=CO1 4H58-1-VV [1,1,0,0,0,0|1,0,0]=3 177 B10R1.149 COC(=O)C1=C(O)C=CN1 4H23-1-F2 [1,1,0,0,0,0|2,0,0]=4 178 B10R1.149 COC(=O)C1=CC=CN1N 4H58-1-ZV [1,1,0,0,0,0|2,0,0]=4 179 B10R1.149 O=C(CBr)C1=C(Br)C=CS1 6H17-9-0A [1,1,0,0,0,0|1,1,0]=4 180 B10R1.21 CCCCCC1=CC=CO1 2H10-1-16 [1,1,0,0,0,0|0,0,1]=3 181 B10R1.21 CCCCCC1=CC=CS1 5H66-1-14 [1,1,0,0,0,0|0,1,1]=4 182 B10R1.21 CCCNCC1=CC=CS1 7H31-1-0J [1,1,0,0,0,0|0,1,1]=4 183 B10R1.21 NCCSCC1=CC=CO1 8H66-1-3N [1,1,0,0,0,0|1,0,1]=4 184 B10R1.66 CC(=O)\C=C\C1=CC=CO1 2H17-1-24 [1,1,0,0,0,0|0,0,2]=4 185 B12R1.16 CCCC(=O)C1=CC=C(Cl)C=C1 2617-5-34 [0,1,0,0,0,1|1,0,0]=3 186 B12R1.16 CCNC(=O)C1=CC=C(Br)C=N1 4H48-9-W6 [0,1,0,0,0,1|2,0,0]=4 187 B12R1.16 CCNC(=O)C1=CC=C(F)C=C1 4648-3-2G [0,1,0,0,0,1|2,0,0]=4 188 B12R1.16 CCOC(=O)C1=CC=C(Br)N=C1 4H23-9-08 [0,1,0,0,0,1|2,0,0]=4 189 B12R1.16 CCOC(=O)C1=CC=C(C)C=C1 2723-1-34 [0,1,0,0,0,1|2,0,0]=4 190 B12R1.16 CCOC(=O)C1=CC=C(C)N=N1 4H23-1-DD [0,1,0,0,0,1|2,0,0]=4 191 B12R1.16 CCOC(=O)C1=CC=C(Cl)C=C1 2623-5-0R [0,1,0,0,0,1|2,0,0]=4 192 B12R1.16 CCOC(=O)C1=CC=C(Cl)C=N1 4H23-5-1Q [0,1,0,0,0,1|2,0,0]=4 193 B12R1.16 CCOC(=O)C1=CC=C(Cl)N=N1 4H23-5-5Q [0,1,0,0,0,1|2,0,0]=4 194 B12R1.16 CCOC(=O)C1=CC=C(F)C=N1 4H58-3-4U [0,1,0,0,0,1|2,0,0]=4 195 B12R1.16 CCOC(=O)C1=CC=C(N)N=N1 4H58-1-7T [0,1,0,0,0,1|2,0,0]=4 196 B12R1.16 CCOC(=O)C1=CC=C(O)C=N1 4H23-1-F5 [0,1,0,0,0,1|2,0,0]=4 197 B12R1.16 CCOC(=O)C1=CN=C(C)C=N1 4H23-1-DU [0,1,0,0,0,1|2,0,0]=4 198 B12R1.16 CCOC(=O)C1=CN=C(N)C=N1 4H58-1-7P [0,1,0,0,0,1|2,0,0]=4 199 B12R1.16 CCOC(=O)C1=NC=C(C)C=C1 4H23-1-BE [0,1,0,0,0,1|2,0,0]=4 200 B12R1.16 CCOC(=O)C1=NC=C(Cl)C=N1 4H58-5-3M [0,1,0,0,0,1|2,0,0]=4 201 B12R1.16 CCOC(=O)C1=NC=C(Cl)N=C1 4H23-5-4U [0,1,0,0,0,1|2,0,0]=4 202 B12R1.16 CCOC(=O)C1=NNC(=O)C=C1 4H56-1-07J [0,1,0,0,0,1|2,0,0]=4 203 B12R1.16 COCC(=O)C1=CC=C(O)C=C1 2620-1-0F [0,1,0,0,0,1|2,0,0]=4 204 B12R1.16 O=C(CCCl)C1=CC=C(Br)C=C1 2617-B-29 [0,1,0,0,0,1|2,0,0]=4 205 B12R1.16 O=C(CCCl)C1=CC=C(Cl)C=C1 2617-5-11 [0,1,0,0,0,1|2,0,0]=4 206 B12R1.16 O=C(CCCl)C1=CC=C(O)C=C1 2620-5-20 [0,1,0,0,0,1|2,0,0]=4 207 B12R1.16 O=C(CCO)C1=CC=C(O)C=C1 2620-1-0T [0,1,0,0,0,1|2,0,0]=4 208 B12R1.17 CCNC(=O)C1=CC=CC(Br)=C1 4648-9-28 [0,1,0,0,0,1|2,0,0]=4 209 B12R1.17 CCNC(=O)C1=CC=CC(F)=C1 4648-3-2E [0,1,0,0,0,1|2,0,0]=4 210 B12R1.17 CCNC(=O)C1=CC=CC(O)=C1 4648-1-3J [0,1,0,0,0,1|2,0,0]=4 211 B12R1.17 CCNC(=O)C1=NC=CC(Cl)=C1 4H48-5-H6 [0,1,0,0,0,1|2,0,0]=4 212 B12R1.17 CCOC(=O)C1=CC(Cl)=CC=N1 4H23-5-2H [0,1,0,0,0,1|2,0,0]=4 213 B12R1.17 CCOC(=O)C1=CC(Cl)=NC=N1 4H23-5-31 [0,1,0,0,0,1|2,0,0]=4 214 B12R1.17 CCOC(=O)C1=CC(N)=CC=N1 4H30-1-A4 [0,1,0,0,0,1|2,0,0]=4 215 B12R1.17 CCOC(=O)C1=CC=CC(Cl)=C1 2623-5-0W [0,1,0,0,0,1|2,0,0]=4 216 B12R1.17 CCOC(=O)C1=CC=CC(Cl)=N1 4H23-5-5T [0,1,0,0,0,1|2,0,0]=4 217 B12R1.17 CCOC(=O)C1=CC=CC(N)=C1 4658-1-X0 [0,1,0,0,0,1|2,0,0]=4 218 B12R1.17 CCOC(=O)C1=CC=CC(N)=N1 4H58-1-054 [0,1,0,0,0,1|2,0,0]=4 219 B12R1.17 CCOC(=O)C1=CC=NC(Cl)=N1 4H23-5-Y8 [0,1,0,0,0,1|2,0,0]=4 220 B12R1.17 CCOC(=O)C1=CN=CC(C)=C1 4H23-1-F7 [0,1,0,0,0,1|2,0,0]=4 221 B12R1.17 CCOC(=O)C1=CN=CC(Cl)=C1 4H23-5-4Y [0,1,0,0,0,1|2,0,0]=4 222 B12R1.17 CCOC(=O)C1=NC=CC(Br)=C1 4H56-9-33 [0,1,0,0,0,1|2,0,0]=4 223 B12R1.17 CCOC(=O)C1=NC=CC(O)=C1 4H56-1-FX [0,1,0,0,0,1|2,0,0]=4 224 B12R1.30 CCCCC(=O)C1=NC=CC=C1 4H17-1-9Z [0,1,0,0,0,1|1,0,0]=3 225 B12R1.30 CCSCC(=O)C1=CC=CC=C1 6666-1-14 [0,1,0,0,0,1|1,0,0]=3 226 B12R1.30 N#CCCC(=O)C1=CC=CC=C1 4637-1-0S [0,1,0,0,0,1|1,0,1]=4 227 B12R1.30 O=C(CCCCl)C1=CC=CC=C1 2617-5-Z5 [0,1,0,0,0,1|1,0,0]=3 228 B12R1.30 O=C(NCCCl)C1=CC=CC=C1 4648-5-2H [0,1,0,0,0,1|2,0,0]=4 229 B12R1.30 O=C(OCCBr)C1=CC=CC=C1 2623-9-0A [0,1,0,0,0,1|2,0,0]=4 230 B12R1.30 O=C(OCCCl)C1=CC=CC=C1 2623-5-0K [0,1,0,0,0,1|2,0,0]=4 231 B12R1.30 O=C(OCCO)C1=CC=CC=C1 2629-1-0R [0,1,0,0,0,1|2,0,0]=4 232 B12R1.107 CC(C)CC(=O)C1=CC=CC=C1 2617-1-1Z [0,1,0,0,0,1|1,0,0]=3 233 B12R1.107 CC(C)CC(=O)C1=NC=CC=C1 4H17-1-9T [0,1,0,0,0,1|1,0,0]=3 234 B12R1.107 C[S+](C)CC(=O)C1=CC=CC=C1 6666-3-06 [0,1,0,0,0,1|2,0,0]=4 235 B12R1.308 CCCC(=O)C1=CC=CC=C1F 2617-3-88 [0,1,0,0,0,1|1,0,0]=3 236 B12R1.308 CCCC(=O)C1=CC=CC=C1N 4656-1-2U [0,1,0,0,0,1|1,0,0]=3 237 B12R1.308 CCCC(=O)C1=NC=CC=C1C 4H17-1-8Z [0,1,0,0,0,1|1,0,0]=3 238 B12R1.308 CCNC(=O)C1=CC=CN=C1Cl 4H48-5-HM [0,1,0,0,0,1|2,0,0]=4 239 B12R1.308 CCOC(=O)C1=C(C)C=CC=C1 2723-1-1T [0,1,0,0,0,1|2,0,0]=4 240 B12R1.308 CCOC(=O)C1=C(O)C=CC=C1 2623-1-1V [0,1,0,0,0,1|2,0,0]=4 241 B12R1.308 CCOC(=O)C1=CC=CC=C1Cl 2623-5-14 [0,1,0,0,0,1|2,0,0]=4 242 B12R1.308 CCOC(=O)C1=CC=CC=C1I 2623-H-03 [0,1,0,0,0,1|2,0,0]=4 243 B12R1.308 CCOC(=O)C1=CC=CC=C1N 4658-1-29 [0,1,0,0,0,1|2,0,0]=4 244 B12R1.308 CCOC(=O)C1=CC=CN=C1F 4H23-3-2S [0,1,0,0,0,1|2,0,0]=4 245 B12R1.308 CCOC(=O)C1=CC=NC=C1Cl 4H23-5-5G [0,1,0,0,0,1|2,0,0]=4 246 B12R1.308 CCOC(=O)C1=CC=NC=C1N 4H58-5-00 [0,1,0,0,0,1|2,0,0]=4 247 B12R1.308 CCOC(=O)C1=CC=NC=C1O 4H56-1-W7 [0,1,0,0,0,1|2,0,0]=4 248 B12R1.308 CCOC(=O)C1=CN=CC=C1Cl 4H23-5-04 [0,1,0,0,0,1|2,0,0]=4 249 B12R1.308 CCOC(=O)C1=CN=CC=C1O 4H23-1-KE [0,1,0,0,0,1|2,0,0]=4 250 B12R1.308 CCOC(=O)C1=NC=CC=C1Br 4H58-9-4D [0,1,0,0,0,1|2,0,0]=4 251 B12R1.308 CCOC(=O)C1=NC=CC=C1C 4H23-1-DX [0,1,0,0,0,1|2,0,0]=4 252 B12R1.308 CCOC(=O)C1=NC=CC=C1Cl 4H23-5-2Y [0,1,0,0,0,1|2,0,0]=4 253 B12R1.308 CCOC(=O)C1=NC=CC=C1N 4H56-1-GA [0,1,0,0,0,1|2,0,0]=4 254 B12R1.308 CCOC(=O)C1=NC=CC=C1O 4H23-1-FR [0,1,0,0,0,1|2,0,0]=4 255 B12R1.308 CCOC(=O)C1=NC=CN=C1Cl 4H58-5-2R [0,1,0,0,0,1|2,0,0]=4 256 B12R1.55 CCOC(=O)C(=O)C1=CC=CS1 6H29-1-07 [0,1,0,0,0,1|1,1,0]=4 257 B12R1.33 CON(C)C(=O)C1=CC=C(Br)O1 4H48-9-2H [0,2,0,0,0,0|2,0,0]=4 258 B12R1.103 CC(C)OC(=O)C1=CC(I)=CN1 4H23-H-11 [0,2,0,0,0,0|2,0,0]=4 259 B12R1.312 CCOC(=O)C1=CC(C=O)=CN1 4H23-1-DF [0,2,0,0,0,0|2,0,0]=4 260 B12R1.312 CCOC(=O)C1=CC=C(CCl)O1 2H23-5-X1 [0,2,0,0,0,0|1,0,0]=3 261 B12R1.313 CCOC(=O)C1=C(C)C=C(C)N1 4H23-1-88 [0,2,0,0,0,0|2,0,0]=4 262 B12R1.313 CCOC(=O)C1=C(C)N=C(N)O1 4H58-1-6B [0,2,0,0,0,0|2,0,0]=4 263 B12R1.313 CCOC(=O)C1=C(N)C=C(C)N1 4H58-1-HQ [0,2,0,0,0,0|2,0,0]=4 264 B12R1.313 CCOC(=O)C1=CC(Br)=CN1C 4H23-9-0D [0,2,0,0,0,0|2,0,0]=4 265 B12R1.314 CCOC(=O)C1=CC(C)=C(C)N1 4H23-1-KJ [0,2,0,0,0,0|2,0,0]=4 266 B12R1.1579 CCOC(=O)C1=C(C)C(C)=CN1 4H23-1-X0 [0,2,0,0,0,0|2,0,0]=4 267 B12R1.15 COC(=O)CC(=O)C1=CC=CO1 2H29-1-0G [0,2,0,0,0,0|0,0,1]=3 268 B12R1.35 CCCCCC(=O)C1=CC=CO1 2H17-1-19 [0,2,0,0,0,0|0,0,0]=2 269 B12R1.54 CC(=O)CCC(=O)C1=COC=C1 2H18-1-02 [0,2,0,0,0,0|2,0,0]=4 270 B12R1.54 CN(C)CCC(=O)C1=CC=CS1 8H32-5-01 [0,2,0,0,0,0|0,1,0]=3 271 B12R1.54 CN(C)CCC(=O)C1=CC=CS1 8H56-9-06 [0,2,0,0,0,0|0,1,0]=3 272 B12R1.54 O=C(O)CCC(=O)C1=CC=CS1 6H29-1-00 [0,2,0,0,0,0|0,1,1]=4 273 B12R1.265 CC(C)(C)NC(=O)C1=CC=CN1 4H48-1-06D [0,2,0,0,0,0|2,0,0]=4 274 B12R1.265 CC(C)(C)OC(=O)C1=CC=CS1 6H23-1-0D [0,2,0,0,0,0|1,1,0]=4 275 B10R1.10 CCCC1=CC=CC(N)=C1 3730-1-74 [0,0,1,1,0,0|2,0,0]=4 276 B10R1.10 CCCC1=CC=CC(N)=N1 3H30-1-TP [0,0,1,1,0,0|2,0,0]=4 277 B10R1.10 CCNC1=CC=CC(O)=C1 4631-1-17 [0,0,1,1,0,0|2,0,0]=4 278 B10R1.10 CCOC1=CC=CC(O)=C1 2607-1-1Q [0,0,1,1,0,0|2,0,0]=4 279 B10R1.10 CNCC1=CC=CC(O)=C1 4631-1-0K [0,0,1,1,0,0|2,0,0]=4 280 B10R1.4 CCCC1=CC=CC=C1N 3730-1-X4 [0,0,1,1,0,0|2,0,0]=4 281 B10R1.4 CCCC1=CC=CC=C1O 2701-1-29 [0,0,1,1,0,0|1,0,0]=3 282 B10R1.4 CCNC1=CC=CC=C1O 4H56-1-0NA [0,0,1,1,0,0|2,0,0]=4 283 B10R1.4 CCOC1=NC=CC=C1O 4H56-1-W6 [0,0,1,1,0,0|2,0,0]=4 284 B10R1.4 COCC1=CC=CC=C1O 2607-1-32 [0,0,1,1,0,0|2,0,0]=4 285 B10R1.4 OCCC1=CC=CC=C1O 2604-1-0G [0,0,1,1,0,0|2,0,0]=4 286 B10R2.32 O=C1CCC2=C1SC=C2 6H17-1-0D [1,0,0,1,0,0|0,1,0]=3 287 B10R2.7 C1=CC2=C(CCCC2)N1 3H31-1-4W [1,0,0,1,0,0|1,0,1]=4 288 B10R2.7 C1=CC2=C(CCCC2)S1 5H66-1-05 [1,0,0,1,0,0|0,1,1]=4 289 B12R2.2 C1=CC=C(C2=NCCC2)C=C1 3H31-1-AK [0,0,0,1,0,1|2,0,0]=4 290 B12R2.2 C1=CN=CC(C2=NCCC2)=C1 3H32-1-8H [0,0,0,1,0,1|2,0,0]=4 291 B12R2.1081 O=C1CCCC2=C1C=CC=N2 4H17-1-Y9 [0,0,0,1,0,1|1,0,0]=3 292 B12R2.1081 O=C1CCNC2=CC=CC=C12 4H17-5-3J [0,0,0,1,0,1|2,0,0]=4 293 B12R2.1081 O=C1CCOC2=CC=CN=C12 4H17-1-7S [0,0,0,1,0,1|2,0,0]=4 294 B12R2.1081 O=C1COCC2=CC=CC=C12 2H10-1-48 [0,0,0,1,0,1|2,0,0]=4 295 B12R2.1081 O=C1NCCC2=CC=CN=C12 4H48-1-05G [0,0,0,1,0,1|2,0,0]=4 296 B12R2.1081 O=C1OCCC2=C1C=NC=C2 4H56-1-HB [0,0,0,1,0,1|2,0,0]=4 297 B12R2.2028 CC1CC(=O)C2=CC=CC=C21 2617-1-Y0 [0,0,0,1,0,1|1,0,0]=3 298 B12R2.2028 O=C1CC(Br)C2=CC=CC=C12 2617-9-X0 [0,0,0,1,0,1|2,0,0]=4 299 B12R2.2075 O=C(C1=CC=CC=C1)C2CC2 2617-1-1Y [0,0,0,1,0,1|1,0,0]=3 300 B12R2.2075 O=C(C1=CC=CC=N1)C2CC2 4H17-1-8M [0,0,0,1,0,1|1,0,0]=3 301 B12R2.2075 O=C(C1=CC=CN=C1)C2CC2 4H17-1-8N [0,0,0,1,0,1|1,0,0]=3 302 B12R2.6 CC1=CC=C(C2CCCN2)O1 4H31-1-1T [0,1,0,1,0,0|1,0,1]=4 303 B12R2.202 CC1=CC2=C(CCCC2=O)N1 4H17-1-8G [0,1,0,1,0,0|2,0,0]=4 304 B12R2.202 NC1=NC2=C(S1)C(=O)CCC2 8H30-1-02 [0,1,0,1,0,0|1,1,0]=4 305 B12R2.202 O=C1CC2=C(CCCC2=O)N1 4H48-1-TJ [0,1,0,1,0,0|2,0,0]=4 306 B12R2.221 CC1CNC(=O)C2=CC=CN21 4H48-1-JR [0,1,0,1,0,0|1,0,0]=3 307 B12R2.2074 O=C(NC1CC1)C2=CC=CN2 4H48-1-06E [0,1,0,1,0,0|1,0,0]=3 308 B12R2.2074 O=C(NC1CC1)C2=CSC=C2 8H48-1-0W [0,1,0,1,0,0|2,0,0]=4 309 B10R1.15 CCC(=O)C1=CC=CC=N1 4H17-1-7Z [1,0,0,0,0,1|1,0,0]=3 310 B10R1.15 CCC(=O)C1=CC=CN=C1 4H17-1-9K [1,0,0,0,0,1|1,0,0]=3 311 B10R1.15 COC(=O)C1=CC=CC=C1 2623-1-X3 [1,0,0,0,0,1|2,0,0]=4 312 B10R1.15 COC(=O)C1=CC=CC=N1 4H21-1-AH [1,0,0,0,0,1|2,0,0]=4 313 B10R1.15 COC(=O)C1=CC=CN=C1 4H23-1-HD [1,0,0,0,0,1|2,0,0]=4 314 B10R1.15 COC(=O)C1=CN=CC=N1 4H23-1-56 [1,0,0,0,0,1|2,0,0]=4 315 B10R1.15 NCC(=O)C1=CC=CC=C1 4656-1-92 [1,0,0,0,0,1|2,0,0]=4 316 B10R1.15 NCC(=O)C1=CC=CC=C1 4656-5-Q0 [1,0,0,0,0,1|2,0,0]=4 317 B10R1.15 O=C(CBr)C1=CC=NC=N1 4H17-9-03 [1,0,0,0,0,1|2,0,0]=4 318 B10R1.15 O=C(CCl)C1=CC=CC=C1 2617-5-Z2 [1,0,0,0,0,1|2,0,0]=4 319 B10R1.15 O=C(CCl)C1=CC=CN=C1 4433-5-00 [1,0,0,0,0,1|2,0,0]=4 320 B10R1.15 O=C(CO)C1=CC=CC=C1 2620-1-0H [1,0,0,0,0,1|2,0,0]=4 321 B10R1.17 CCCCC1=CC=CN=C1 3H32-1-JE [1,0,0,0,0,1|1,0,1]=4 322 B10R1.17 CCCNC1=CC=CC=C1 3631-1-0M [1,0,0,0,0,1|2,0,0]=4 323 B10R1.17 CCCOC1=CC=CC=C1 2607-1-1S [1,0,0,0,0,1|2,0,0]=4 324 B12R1.32 CCCC(=O)CC1=CC=CC=C1 2617-1-0X [0,0,0,0,0,2|1,0,0]=3 325 B12R1.32 CCCC(=O)OC1=CC=CC=C1 2623-1-16 [0,0,0,0,0,2|1,0,0]=3 326 B12R1.32 CCOC(=O)CC1=CC=CC=N1 4H23-1-4K [0,0,0,0,0,2|2,0,0]=4 327 B12R1.32 CCOC(=O)CC1=CC=CN=C1 4H23-1-M0 [0,0,0,0,0,2|2,0,0]=4 328 B12R1.32 CCOC(=O)CC1=CC=NC=C1 4H23-1-G6 [0,0,0,0,0,2|2,0,0]=4 329 B12R1.32 CCOC(=O)CC1=NC=CC=N1 4H58-1-UA [0,0,0,0,0,2|2,0,0]=4 330 B12R1.32 CCOC(=O)CC1=NC=CN=C1 4H23-1-KR [0,0,0,0,0,2|2,0,0]=4 331 B12R1.32 O=C(CCCl)NC1=CC=CC=C1 4648-5-2W [0,0,0,0,0,2|2,0,0]=4 332 B12R1.32 O=C(CCCl)OC1=CC=CC=C1 2623-5-1M [0,0,0,0,0,2|2,0,0]=4