0 B10R1.11 CCOC(=O)C1=CC=CN1 E22399 [0,0,0,0,0,0|2,0,0]=2 1 B10R1.11 CCOC(=O)C1=CC=NO1 E43160 [0,0,0,0,0,0|2,0,0]=2 2 B10R1.11 CCOC(=O)C1=CN=CN1 E22557 [0,0,0,0,0,0|3,0,0]=3 3 B10R1.11 CCOC(=O)C1=CN=CO1 E10769 [0,0,0,0,0,0|2,0,0]=2 4 B10R1.11 CCOC(=O)C1=CN=CS1 E9760 [0,0,0,0,0,0|2,1,0]=3 5 B10R1.11 CCOC(=O)C1=CN=NS1 E41038 [0,0,0,0,0,0|3,1,0]=4 6 B10R1.11 CCOC(=O)C1=CNC=C1 E46399 [0,0,0,0,0,0|3,0,0]=3 7 B10R1.11 CCOC(=O)C1=CNN=C1 E8068 [0,0,0,0,0,0|4,0,0]=4 8 B10R1.11 CCOC(=O)C1=COC=C1 E69380 [0,0,0,0,0,0|3,0,0]=3 9 B10R1.11 CCOC(=O)C1=COC=N1 E2170 [0,0,0,0,0,0|3,0,0]=3 10 B10R1.11 CCOC(=O)C1=CON=C1 E8088 [0,0,0,0,0,0|4,0,0]=4 11 B10R1.11 CCOC(=O)C1=CSC=C1 E46245 [0,0,0,0,0,0|3,0,0]=3 12 B10R1.11 CCOC(=O)C1=CSC=N1 E2134 [0,0,0,0,0,0|3,0,0]=3 13 B10R1.11 CCOC(=O)C1=NC=CN1 E23112 [0,0,0,0,0,0|3,0,0]=3 14 B10R1.11 CCOC(=O)C1=NC=CO1 E23077 [0,0,0,0,0,0|2,0,0]=2 15 B10R1.11 CCOC(=O)C1=NC=CS1 E43151 [0,0,0,0,0,0|2,1,0]=3 16 B10R1.11 CCOC(=O)C1=NN=CS1 T67360 [0,0,0,0,0,0|3,1,0]=4 17 B10R1.11 CCOC(=O)C1=NNC=C1 E0715 [0,0,0,0,0,0|3,0,0]=3 18 B10R1.11 CCOC(=O)C1=NOC=C1 E7434 [0,0,0,0,0,0|3,0,0]=3 19 B10R1.11 CCOC(=O)N1C=CN=C1 E43219 [0,0,0,0,0,0|4,0,0]=4 20 B10R1.11 N#CCC(=O)C1=CC=CO1 F68571 [0,0,0,0,0,0|1,0,1]=2 21 B10R1.11 N#CCC(=O)C1=CC=CS1 T12473 [0,0,0,0,0,0|1,1,1]=3 22 B10R1.11 N#CCC(=O)C1=CSC=C1 X12834 [0,0,0,0,0,0|3,0,1]=4 23 B9R1.11 CCC(=O)C1=NC=CS1 T43174 [1,0,0,0,0,0|1,1,0]=3 24 B9R1.11 COC(=O)C1=CC=CN1 M11015 [1,0,0,0,0,0|2,0,0]=3 25 B9R1.11 COC(=O)C1=CC=CO1 M39270 [1,0,0,0,0,0|1,0,0]=2 26 B9R1.11 COC(=O)C1=CC=CS1 M42941 [1,0,0,0,0,0|1,1,0]=3 27 B9R1.11 COC(=O)C1=CC=NN1 M12748 [1,0,0,0,0,0|3,0,0]=4 28 B9R1.11 COC(=O)C1=CN=CN1 M14078 [1,0,0,0,0,0|3,0,0]=4 29 B9R1.11 COC(=O)C1=CN=CN1 M41348 [1,0,0,0,0,0|3,0,0]=4 30 B9R1.11 COC(=O)C1=CN=CO1 M40997 [1,0,0,0,0,0|2,0,0]=3 31 B9R1.11 COC(=O)C1=CN=CS1 M2158 [1,0,0,0,0,0|2,1,0]=4 32 B9R1.11 COC(=O)C1=CNC=C1 M37783 [1,0,0,0,0,0|3,0,0]=4 33 B9R1.11 COC(=O)C1=CSC=C1 M12826 [1,0,0,0,0,0|3,0,0]=4 34 B9R1.11 COC(=O)C1=CSC=N1 M2932 [1,0,0,0,0,0|3,0,0]=4 35 B9R1.11 COC(=O)C1=NC=CN1 M11275 [1,0,0,0,0,0|3,0,0]=4 36 B9R1.11 COC(=O)C1=NC=CO1 M40998 [1,0,0,0,0,0|2,0,0]=3 37 B9R1.11 COC(=O)C1=NC=CS1 M40994 [1,0,0,0,0,0|2,1,0]=4 38 B9R1.11 NNC(=O)C1=CC=CO1 F66138 [1,0,0,0,0,0|2,0,0]=3 39 B9R1.11 O=C(CBr)C1=CC=CS1 B42721 [1,0,0,0,0,0|1,1,0]=3 40 B9R1.11 O=C(CBr)C1=NC=CS1 B40844 [1,0,0,0,0,0|2,1,0]=4 41 B9R1.12 CCCCC1=CSC=C1 B47048 [1,0,0,0,0,0|2,0,1]=4 42 B9R1.12 CCCCC1=NC=CN1 B43788 [1,0,0,0,0,0|2,0,1]=4 43 B9R1.12 CCOCC1=CC=CO1 E38338 [1,0,0,0,0,0|1,0,1]=3 44 B9R1.12 ICCCC1=CC=CS1 K46278 [1,0,0,0,0,0|1,1,1]=4 45 B9R1.12 O=CC=CC1=CC=CO1 F45509 [1,0,0,0,0,0|1,0,2]=4 46 B9R1.12 O=C\C=C\C1=CC=CO1 F45510 [1,0,0,0,0,0|1,0,2]=4 47 B9R1.12 OCCCC1=CC=CS1 T36724 [1,0,0,0,0,0|1,1,1]=4 48 B11R1.15 CCOC(=O)C1=CC(=O)NN1 E43249 [0,1,0,0,0,0|3,0,0]=4 49 B11R1.15 CCOC(=O)C1=CC(Br)=CN1 E23668 [0,1,0,0,0,0|2,0,0]=3 50 B11R1.15 CCOC(=O)C1=CC(Br)=CS1 E45906 [0,1,0,0,0,0|1,1,0]=3 51 B11R1.15 CCOC(=O)C1=CC(Br)=NO1 E42869 [0,1,0,0,0,0|2,0,0]=3 52 B11R1.15 CCOC(=O)C1=CC(C)=CN1 E69074 [0,1,0,0,0,0|2,0,0]=3 53 B11R1.15 CCOC(=O)C1=CC(C)=NN1 E23529 [0,1,0,0,0,0|3,0,0]=4 54 B11R1.15 CCOC(=O)C1=CC(C)=NO1 E46428 [0,1,0,0,0,0|2,0,0]=3 55 B11R1.15 CCOC(=O)C1=CC(N)=CN1 E43654 [0,1,0,0,0,0|2,0,0]=3 56 B11R1.15 CCOC(=O)C1=CC=C(Br)O1 E45937 [0,1,0,0,0,0|1,0,0]=2 57 B11R1.15 CCOC(=O)C1=CC=C(Br)S1 E45907 [0,1,0,0,0,0|1,1,0]=3 58 B11R1.15 CCOC(=O)C1=CC=C(C)N1 E13124 [0,1,0,0,0,0|2,0,0]=3 59 B11R1.15 CCOC(=O)C1=CC=C(C)S1 E46839 [0,1,0,0,0,0|1,1,0]=3 60 B11R1.15 CCOC(=O)C1=CC=C(Cl)S1 E45915 [0,1,0,0,0,0|1,1,0]=3 61 B11R1.15 CCOC(=O)C1=CN(C)C=N1 E12958 [0,1,0,0,0,0|3,0,0]=4 62 B11R1.15 CCOC(=O)C1=CN=C(Br)N1 E43032 [0,1,0,0,0,0|3,0,0]=4 63 B11R1.15 CCOC(=O)C1=CN=C(Br)O1 E32408 [0,1,0,0,0,0|2,0,0]=3 64 B11R1.15 CCOC(=O)C1=CN=C(Br)S1 E2650 [0,1,0,0,0,0|2,1,0]=4 65 B11R1.15 CCOC(=O)C1=CN=C(C)S1 E2885 [0,1,0,0,0,0|2,1,0]=4 66 B11R1.15 CCOC(=O)C1=CN=C(Cl)S1 E42860 [0,1,0,0,0,0|2,1,0]=4 67 B11R1.15 CCOC(=O)C1=CN=C(N)N1 E8858 [0,1,0,0,0,0|3,0,0]=4 68 B11R1.15 CCOC(=O)C1=CN=C(N)O1 E32364 [0,1,0,0,0,0|2,0,0]=3 69 B11R1.15 CCOC(=O)C1=CN=C(N)S1 E2652 [0,1,0,0,0,0|2,1,0]=4 70 B11R1.15 CCOC(=O)C1=CNC(C)=C1 E64019 [0,1,0,0,0,0|3,0,0]=4 71 B11R1.15 CCOC(=O)C1=COC(Br)=N1 E9339 [0,1,0,0,0,0|3,0,0]=4 72 B11R1.15 CCOC(=O)C1=COC(C)=N1 E9858 [0,1,0,0,0,0|3,0,0]=4 73 B11R1.15 CCOC(=O)C1=COC(Cl)=N1 E2065 [0,1,0,0,0,0|3,0,0]=4 74 B11R1.15 CCOC(=O)C1=COC(I)=N1 E42873 [0,1,0,0,0,0|3,0,0]=4 75 B11R1.15 CCOC(=O)C1=COC(N)=N1 E2076 [0,1,0,0,0,0|3,0,0]=4 76 B11R1.15 CCOC(=O)C1=CSC(=S)N1 E63132 [0,1,0,0,0,0|3,0,0]=4 77 B11R1.15 CCOC(=O)C1=CSC(Br)=C1 E45908 [0,1,0,0,0,0|3,0,0]=4 78 B11R1.15 CCOC(=O)C1=CSC(Br)=N1 E2133 [0,1,0,0,0,0|3,0,0]=4 79 B11R1.15 CCOC(=O)C1=CSC(C)=N1 E2046 [0,1,0,0,0,0|3,0,0]=4 80 B11R1.15 CCOC(=O)C1=CSC(Cl)=N1 M4857 [0,1,0,0,0,0|3,0,0]=4 81 B11R1.15 CCOC(=O)C1=CSC(F)=N1 E42865 [0,1,0,0,0,0|3,0,0]=4 82 B11R1.15 CCOC(=O)C1=CSC(N)=N1 E2339 [0,1,0,0,0,0|3,0,0]=4 83 B11R1.15 CCOC(=O)C1=NC(Br)=CN1 E26759 [0,1,0,0,0,0|3,0,0]=4 84 B11R1.15 CCOC(=O)C1=NC(Br)=CS1 E7894 [0,1,0,0,0,0|2,1,0]=4 85 B11R1.15 CCOC(=O)C1=NC(Br)=NO1 E37366 [0,1,0,0,0,0|3,0,0]=4 86 B11R1.15 CCOC(=O)C1=NC(C)=NO1 E43247 [0,1,0,0,0,0|3,0,0]=4 87 B11R1.15 CCOC(=O)C1=NN(C)C=C1 E43656 [0,1,0,0,0,0|3,0,0]=4 88 B11R1.15 CCOC(=O)C1=NN=C(Br)O1 E62442 [0,1,0,0,0,0|3,0,0]=4 89 B11R1.15 CCOC(=O)C1=NNC(Br)=C1 E37196 [0,1,0,0,0,0|3,0,0]=4 90 B11R1.15 CCOC(=O)C1=NNC(Cl)=C1 E19218 [0,1,0,0,0,0|3,0,0]=4 91 B11R1.15 CCOC(=O)C1=NNC(F)=C1 E29650 [0,1,0,0,0,0|3,0,0]=4 92 B11R1.15 CCOC(=O)C1=NNC(N)=C1 E9969 [0,1,0,0,0,0|3,0,0]=4 93 B11R1.15 CCOC(=O)C1=NNC(O)=C1 E25701 [0,1,0,0,0,0|3,0,0]=4 94 B11R1.15 CCOC(=O)C1=NOC(N)=C1 E61595 [0,1,0,0,0,0|3,0,0]=4 95 B11R1.29 CNCCC(=O)C1=CC=CS1 M49532 [0,1,0,0,0,0|0,1,0]=2 96 B11R1.29 CNCC[C@@H](O)C1=CC=CS1 M47068 [0,1,0,0,0,0|0,1,2]=4 97 B11R1.29 CNCC[C@H](O)C1=CC=CS1 M47069 [0,1,0,0,0,0|0,1,2]=4 98 B11R1.31 CON(C)C(=O)C1=CC=CN1 M43662 [0,1,0,0,0,0|3,0,0]=4 99 B11R1.199 CCOC(=O)C1=C(Br)N=CO1 E42868 [0,1,0,0,0,0|2,0,0]=3 100 B11R1.199 CCOC(=O)C1=C(Br)SC=C1 E45905 [0,1,0,0,0,0|3,0,0]=4 101 B11R1.199 CCOC(=O)C1=C(Br)SC=N1 E3201 [0,1,0,0,0,0|3,0,0]=4 102 B11R1.199 CCOC(=O)C1=C(C)C=CN1 E7945 [0,1,0,0,0,0|2,0,0]=3 103 B11R1.199 CCOC(=O)C1=C(C)N=CO1 E46426 [0,1,0,0,0,0|2,0,0]=3 104 B11R1.199 CCOC(=O)C1=C(C)NC=C1 E46928 [0,1,0,0,0,0|3,0,0]=4 105 B11R1.199 CCOC(=O)C1=C(C)NC=N1 E38567 [0,1,0,0,0,0|3,0,0]=4 106 B11R1.199 CCOC(=O)C1=C(C)OC=N1 E46427 [0,1,0,0,0,0|3,0,0]=4 107 B11R1.199 CCOC(=O)C1=C(C)SC=N1 M4176 [0,1,0,0,0,0|3,0,0]=4 108 B11R1.199 CCOC(=O)C1=C(Cl)SC=N1 E42861 [0,1,0,0,0,0|3,0,0]=4 109 B11R1.199 CCOC(=O)C1=C(F)C=CN1 E8047 [0,1,0,0,0,0|2,0,0]=3 110 B11R1.199 CCOC(=O)C1=C(N)C=CN1 A2113 [0,1,0,0,0,0|2,0,0]=3 111 B11R1.199 CCOC(=O)C1=C(N)C=CN1 E1446 [0,1,0,0,0,0|2,0,0]=3 112 B11R1.199 CCOC(=O)C1=C(N)N=CS1 E43236 [0,1,0,0,0,0|2,1,0]=4 113 B11R1.199 CCOC(=O)C1=C(N)NC=C1 E1851 [0,1,0,0,0,0|3,0,0]=4 114 B11R1.199 CCOC(=O)C1=C(N)NC=N1 E37693 [0,1,0,0,0,0|3,0,0]=4 115 B11R1.199 CCOC(=O)C1=C(N)SC=C1 E46417 [0,1,0,0,0,0|3,0,0]=4 116 B11R1.199 CCOC(=O)C1=C(N)SC=N1 E43237 [0,1,0,0,0,0|3,0,0]=4 117 B11R1.199 CCOC(=O)C1=CC=NN1C E43657 [0,1,0,0,0,0|3,0,0]=4 118 B11R1.199 CCOC(=O)C1=CN=CN1N E43362 [0,1,0,0,0,0|3,0,0]=4 119 B11R1.199 CCOC(=O)C1=CNC=C1C E46929 [0,1,0,0,0,0|3,0,0]=4 120 B11R1.199 CCOC(=O)C1=NC=CN1C E43661 [0,1,0,0,0,0|3,0,0]=4 121 B11R1.199 CCOC(=O)C1=NNC=C1Br E1964 [0,1,0,0,0,0|3,0,0]=4 122 B11R1.199 CCOC(=O)C1=NNC=C1C E43658 [0,1,0,0,0,0|3,0,0]=4 123 B11R1.199 CCOC(=O)C1=NNC=C1I E11634 [0,1,0,0,0,0|3,0,0]=4 124 B9R0.35 CCCC(=O)C(=O)OCC E43810 [0,0,1,0,0,0|1,0,2]=4 125 B11R2.106 O=C1CCCC2=C1C=CO2 D49075 [0,0,0,1,0,0|2,0,0]=3 126 B11R2.106 O=C1CCCC2=C1C=CS2 B13835 [0,0,0,1,0,0|2,0,0]=3 127 B11R2.106 O=C1CCCC2=C1C=NN2 T63887 [0,0,0,1,0,0|3,0,0]=4 128 B11R2.106 O=C1CCCC2=C1SC=N2 D45890 [0,0,0,1,0,0|1,1,0]=3 129 B11R2.106 O=C1CCCC2=NNC=C12 T60555 [0,0,0,1,0,0|3,0,0]=4 130 B11R2.106 O=C1CCCN2C=NC=C12 D23645 [0,0,0,1,0,0|2,0,0]=3 131 B11R2.106 O=C1CCCN2N=CC=C12 D45989 [0,0,0,1,0,0|2,0,0]=3 132 B11R2.106 O=C1COCC2=C1C=CN2 D14771 [0,0,0,1,0,0|3,0,0]=4 133 B11R2.106 O=C1NC=CC2=C1OC=C2 F4977 [0,0,0,1,0,0|1,0,2]=4 134 B11R2.106 O=C1NCCC2=C1C=CO2 F60340 [0,0,0,1,0,0|3,0,0]=4 135 B11R2.106 OC1=NCCC2=C1SC=C2 D61282 [0,0,0,1,0,0|1,1,1]=4 136 B11R1.16 CC=CC(=O)C1=CC=CC=C1 P68339 [0,0,0,0,0,1|1,0,2]=4 137 B11R1.16 CCCC(=O)C1=CN=CC=C1 P50020 [0,0,0,0,0,1|1,0,0]=2 138 B11R1.16 CCCC(=O)C1=NC=CC=C1 B50017 [0,0,0,0,0,1|1,0,0]=2 139 B11R1.16 CCC[C@@H](N)C1=CC=CC=C1 P54182 [0,0,0,0,0,1|2,0,1]=4 140 B11R1.16 CCC[C@H](N)C1=CC=NC=C1 P37698 [0,0,0,0,0,1|2,0,1]=4 141 B11R1.16 CCC[C@H](N)C1=CC=NC=C1 P52255 [0,0,0,0,0,1|2,0,1]=4 142 B11R1.16 CCOC(=N)C1=CC=NC=C1 E46648 [0,0,0,0,0,1|3,0,0]=4 143 B11R1.16 CCOC(=O)C1=CC=NC=C1 E69401 [0,0,0,0,0,1|2,0,0]=3 144 B11R1.16 CCOC(=O)C1=CN=CC=C1 E68695 [0,0,0,0,0,1|2,0,0]=3 145 B11R1.16 CCOC(=O)C1=CN=NC=C1 E23449 [0,0,0,0,0,1|3,0,0]=4 146 B11R1.16 CCOC(=O)C1=NC=CC=C1 E67964 [0,0,0,0,0,1|2,0,0]=3 147 B11R1.16 CCOC(=O)C1=NC=CC=N1 E46004 [0,0,0,0,0,1|2,0,0]=3 148 B11R1.16 CCOC(=O)C1=NC=CN=C1 E24926 [0,0,0,0,0,1|2,0,0]=3 149 B11R1.16 CCOC(=O)C1=NC=NC=C1 E46000 [0,0,0,0,0,1|2,0,0]=3 150 B11R1.16 CCOC(=O)[C@@H]1CCC=CO1 E25573 [0,0,0,0,0,1|1,0,2]=4 151 B11R1.16 CCO[P@@H](=O)C1=CC=CC=C1 E46942 [0,0,0,0,0,1|3,0,0]=4 152 B11R1.16 N#CCC(=O)C1=CC=CC=C1 X67635 [0,0,0,0,0,1|2,0,1]=4 153 B11R1.16 N#CCC(=O)C1=CC=NC=C1 X47870 [0,0,0,0,0,1|2,0,1]=4 154 B11R1.16 N#CCC(=O)C1=CN=CC=C1 X67552 [0,0,0,0,0,1|2,0,1]=4 155 B11R1.16 N#CCC(=O)C1=NC=CC=C1 X0968 [0,0,0,0,0,1|2,0,1]=4 156 B11R1.16 O=C(OCCl)C1=CC=CC=C1 C48587 [0,0,0,0,0,1|3,0,0]=4 157 B11R1.30 CCOC(=O)CC1=CC=CN1 E14510 [0,0,0,0,0,1|2,0,0]=3 158 B11R1.30 CCOC(=O)CC1=NC=CS1 E46416 [0,0,0,0,0,1|2,1,0]=4 159 B11R1.30 CCOC(=O)CC1=NNC=C1 E25544 [0,0,0,0,0,1|3,0,0]=4 160 B8R0.1 CCOC(=O)\C=C\C=O E69342 [1,0,1,0,0,0|1,0,1]=4 161 B8R1.7 CC(=O)C1=CC=CN1 P68619 [2,0,0,0,0,0|1,0,0]=3 162 B8R1.7 CC(=O)C1=CC=CS1 A69304 [2,0,0,0,0,0|0,1,0]=3 163 B8R1.7 CC(=O)C1=CC=NN1 P61226 [2,0,0,0,0,0|2,0,0]=4 164 B8R1.7 CC(=O)C1=CC=NO1 K40990 [2,0,0,0,0,0|1,0,0]=3 165 B8R1.7 CC(=O)C1=CNC=C1 A37548 [2,0,0,0,0,0|2,0,0]=4 166 B8R1.7 CC(=O)C1=CNC=N1 A41019 [2,0,0,0,0,0|2,0,0]=4 167 B8R1.7 CC(=O)C1=CSC=C1 A12828 [2,0,0,0,0,0|2,0,0]=4 168 B8R1.7 CC(=O)C1=CSC=N1 T41006 [2,0,0,0,0,0|2,0,0]=4 169 B8R1.7 CC(=O)C1=NC=CN1 K67604 [2,0,0,0,0,0|2,0,0]=4 170 B8R1.7 CC(=O)C1=NC=CS1 A22587 [2,0,0,0,0,0|1,1,0]=4 171 B8R1.7 CC(=O)C1=NOC=C1 K40989 [2,0,0,0,0,0|2,0,0]=4 172 B8R1.7 CC(C)C1=CC=CO1 P43710 [2,0,0,0,0,0|1,0,1]=4 173 B8R1.7 C[C@@H](O)C1=CC=CO1 F43302 [2,0,0,0,0,0|0,0,2]=4 174 B8R1.7 NC(=O)C1=NC=CO1 X26086 [2,0,0,0,0,0|2,0,0]=4 175 B8R1.7 O=C(Cl)C1=CC=CS1 T10056 [2,0,0,0,0,0|1,1,0]=4 176 B8R1.7 O=C(O)C1=CC=CN1 P24658 [2,0,0,0,0,0|2,0,0]=4 177 B8R1.7 O=C(O)C1=CC=CO1 F38499 [2,0,0,0,0,0|1,0,0]=3 178 B8R1.7 O=C(O)C1=CC=CS1 T69312 [2,0,0,0,0,0|1,1,0]=4 179 B8R1.7 O=C(O)C1=CC=NO1 K40064 [2,0,0,0,0,0|2,0,0]=4 180 B8R1.7 O=C(O)C1=CN=CO1 O9363 [2,0,0,0,0,0|2,0,0]=4 181 B8R1.7 O=C([O-])C1=CC=CS1 C2751 [2,0,0,0,0,0|1,1,0]=4 182 B8R1.7 O=C([O-])C1=CC=CS1 C41403 [2,0,0,0,0,0|1,1,0]=4 183 B8R1.7 O=C([O-])C1=NC=CO1 S40296 [2,0,0,0,0,0|2,0,0]=4 184 B8R1.8 CCCC1=CC=CS1 P43744 [2,0,0,0,0,0|0,1,0]=3 185 B8R1.8 CCCC1=NC=CN1 P68616 [2,0,0,0,0,0|2,0,0]=4 186 B8R1.8 CCCC1=NC=CS1 P43394 [2,0,0,0,0,0|1,1,0]=4 187 B8R1.8 CNCC1=CC=CS1 M43398 [2,0,0,0,0,0|1,1,0]=4 188 B8R1.8 NCCC1=CC=CS1 T12818 [2,0,0,0,0,0|1,1,0]=4 189 B8R1.8 OCCC1=CC=CS1 T12817 [2,0,0,0,0,0|1,1,0]=4 190 B10R1.14 CC[C@@H](N)C1=CC=C(C)O1 M49548 [1,1,0,0,0,0|1,0,1]=4 191 B10R1.14 COC(=O)C1=CC(Br)=CN1 M12023 [1,1,0,0,0,0|2,0,0]=4 192 B10R1.14 COC(=O)C1=CC(Br)=CO1 M42715 [1,1,0,0,0,0|1,0,0]=3 193 B10R1.14 COC(=O)C1=CC(Br)=CS1 M7697 [1,1,0,0,0,0|1,1,0]=4 194 B10R1.14 COC(=O)C1=CC(C)=NO1 M43162 [1,1,0,0,0,0|2,0,0]=4 195 B10R1.14 COC(=O)C1=CC(Cl)=CS1 M14084 [1,1,0,0,0,0|1,1,0]=4 196 B10R1.14 COC(=O)C1=CC(F)=CS1 M42707 [1,1,0,0,0,0|1,1,0]=4 197 B10R1.14 COC(=O)C1=CC(N)=CS1 M43154 [1,1,0,0,0,0|1,1,0]=4 198 B10R1.14 COC(=O)C1=CC(O)=NO1 M37717 [1,1,0,0,0,0|2,0,0]=4 199 B10R1.14 COC(=O)C1=CC=C(Br)N1 M9622 [1,1,0,0,0,0|2,0,0]=4 200 B10R1.14 COC(=O)C1=CC=C(Br)O1 M42716 [1,1,0,0,0,0|1,0,0]=3 201 B10R1.14 COC(=O)C1=CC=C(Br)S1 M7698 [1,1,0,0,0,0|1,1,0]=4 202 B10R1.14 COC(=O)C1=CC=C(C)N1 M46412 [1,1,0,0,0,0|2,0,0]=4 203 B10R1.14 COC(=O)C1=CC=C(C)O1 M46254 [1,1,0,0,0,0|1,0,0]=3 204 B10R1.14 COC(=O)C1=CC=C(Cl)S1 M66823 [1,1,0,0,0,0|1,1,0]=4 205 B10R1.14 COC(=O)C1=CC=C(I)S1 M42708 [1,1,0,0,0,0|1,1,0]=4 206 B10R1.14 COC(=O)C1=CC=C(N)O1 A11105 [1,1,0,0,0,0|1,0,0]=3 207 B10R1.14 COC(=O)C1=CC=C(N)S1 M9979 [1,1,0,0,0,0|1,1,0]=4 208 B10R1.14 COC(=O)C1=CN=C(Br)O1 B3574 [1,1,0,0,0,0|2,0,0]=4 209 B10R1.14 COC(=O)C1=CN=C(C)O1 M3277 [1,1,0,0,0,0|2,0,0]=4 210 B10R1.14 COC(=O)C1=CN=C(Cl)O1 M2777 [1,1,0,0,0,0|2,0,0]=4 211 B10R1.14 COC(=O)C1=CN=C(N)O1 M2776 [1,1,0,0,0,0|2,0,0]=4 212 B10R1.14 COC(=O)C1=NC=C(C)O1 M17998 [1,1,0,0,0,0|2,0,0]=4 213 B10R1.23 O=C(O)C(=O)C1=CC=CO1 F68890 [1,1,0,0,0,0|1,0,1]=4 214 B10R1.149 COC(=O)C1=C(Br)C=CN1 B12084 [1,1,0,0,0,0|2,0,0]=4 215 B10R1.149 COC(=O)C1=C(Br)C=CS1 M15715 [1,1,0,0,0,0|1,1,0]=4 216 B10R1.149 COC(=O)C1=C(Br)N=CO1 M63259 [1,1,0,0,0,0|2,0,0]=4 217 B10R1.149 COC(=O)C1=C(C)C=CN1 M11830 [1,1,0,0,0,0|2,0,0]=4 218 B10R1.149 COC(=O)C1=C(C)C=CO1 M46253 [1,1,0,0,0,0|1,0,0]=3 219 B10R1.149 COC(=O)C1=C(C)C=CS1 M46249 [1,1,0,0,0,0|1,1,0]=4 220 B10R1.149 COC(=O)C1=C(Cl)C=CN1 M8084 [1,1,0,0,0,0|2,0,0]=4 221 B10R1.149 COC(=O)C1=C(Cl)C=CS1 M12481 [1,1,0,0,0,0|1,1,0]=4 222 B10R1.149 COC(=O)C1=C(F)C=CS1 M42706 [1,1,0,0,0,0|1,1,0]=4 223 B10R1.149 COC(=O)C1=C(N)C=CO1 M14191 [1,1,0,0,0,0|1,0,0]=3 224 B10R1.149 COC(=O)C1=C(N)C=CO1 M29739 [1,1,0,0,0,0|1,0,0]=3 225 B10R1.149 COC(=O)C1=C(N)C=CS1 M22453 [1,1,0,0,0,0|1,1,0]=4 226 B10R1.149 COC(=O)C1=C(O)C=CN1 M38841 [1,1,0,0,0,0|2,0,0]=4 227 B10R1.149 COC(=O)C1=C(O)C=CS1 M42957 [1,1,0,0,0,0|1,1,0]=4 228 B10R1.149 COC(=O)C1=CC=CN1N M43225 [1,1,0,0,0,0|2,0,0]=4 229 B10R1.21 CCCCCC1=CC=CS1 P50457 [1,1,0,0,0,0|0,1,1]=4 230 B10R1.21 NCCSCC1=CC=CO1 A3034 [1,1,0,0,0,0|1,0,1]=4 231 B12R1.16 CC1=CC=C(C(=O)CCCl)C=C1 C68955 [0,1,0,0,0,1|2,0,0]=4 232 B12R1.16 CCCC(=O)C1=CC=C(F)C=C1 F52671 [0,1,0,0,0,1|1,0,0]=3 233 B12R1.16 CCCC(=O)C1=CC=C(O)C=C1 H52799 [0,1,0,0,0,1|1,0,0]=3 234 B12R1.16 CCCC(=O)C1=CN=C(Cl)C=C1 C49858 [0,1,0,0,0,1|1,0,0]=3 235 B12R1.16 CCOC(=O)C1=CC=C(C)C=C1 E69403 [0,1,0,0,0,1|2,0,0]=4 236 B12R1.16 CCOC(=O)C1=CC=C(Cl)C=C1 E68949 [0,1,0,0,0,1|2,0,0]=4 237 B12R1.16 CCOC(=O)C1=CC=C(F)C=C1 E69037 [0,1,0,0,0,1|2,0,0]=4 238 B12R1.16 CCOC(=O)C1=CC=C(I)C=C1 E39579 [0,1,0,0,0,1|2,0,0]=4 239 B12R1.16 CCOC(=O)C1=CN=C(Br)C=C1 E48903 [0,1,0,0,0,1|2,0,0]=4 240 B12R1.16 CCOC(=O)C1=CN=C(C)C=C1 E10450 [0,1,0,0,0,1|2,0,0]=4 241 B12R1.16 CCOC(=O)C1=CN=C(Cl)C=C1 E39503 [0,1,0,0,0,1|2,0,0]=4 242 B12R1.16 CCOC(=O)C1=CN=C(N)C=C1 E3775 [0,1,0,0,0,1|2,0,0]=4 243 B12R1.16 CCOC(=O)C1=CN=C(O)C=C1 E49308 [0,1,0,0,0,1|2,0,0]=4 244 B12R1.16 CCOC(=O)C1=NC=C(Br)C=C1 E38711 [0,1,0,0,0,1|2,0,0]=4 245 B12R1.16 CCOC(=O)C1=NC=C(Br)C=N1 E45640 [0,1,0,0,0,1|2,0,0]=4 246 B12R1.16 CCOC(=O)C1=NC=C(C)C=C1 E50035 [0,1,0,0,0,1|2,0,0]=4 247 B12R1.16 CCOC(=O)C1=NC=C(C)N=C1 E46680 [0,1,0,0,0,1|2,0,0]=4 248 B12R1.16 CCOC(=O)C1=NC=C(Cl)C=C1 E48935 [0,1,0,0,0,1|2,0,0]=4 249 B12R1.16 CCOC(=O)C1=NC=C(Cl)C=N1 E17739 [0,1,0,0,0,1|2,0,0]=4 250 B12R1.16 CCOC(=O)C1=NC=C(N)N=C1 E37999 [0,1,0,0,0,1|2,0,0]=4 251 B12R1.16 CCOC(=O)C1=NN=C(Cl)C=C1 E45662 [0,1,0,0,0,1|2,0,0]=4 252 B12R1.16 CCOC(=O)C1=NN=C(N)C=C1 E9092 [0,1,0,0,0,1|2,0,0]=4 253 B12R1.16 COCC(=O)C1=CC=C(O)C=C1 H49931 [0,1,0,0,0,1|2,0,0]=4 254 B12R1.16 O=C(CCCl)C1=CC=C(Br)C=C1 B51653 [0,1,0,0,0,1|2,0,0]=4 255 B12R1.16 O=C(CCCl)C1=CC=C(F)C=C1 C51659 [0,1,0,0,0,1|2,0,0]=4 256 B12R1.17 CCOC(=O)C1=CC(=O)C=CO1 E49117 [0,1,0,0,0,1|1,0,0]=3 257 B12R1.17 CCOC(=O)C1=CC(=O)N=CN1 E9424 [0,1,0,0,0,1|2,0,0]=4 258 B12R1.17 CCOC(=O)C1=CC(Br)=NC=C1 E48906 [0,1,0,0,0,1|2,0,0]=4 259 B12R1.17 CCOC(=O)C1=CC(C)=NC=C1 E62072 [0,1,0,0,0,1|2,0,0]=4 260 B12R1.17 CCOC(=O)C1=CC(Cl)=NC=C1 E48953 [0,1,0,0,0,1|2,0,0]=4 261 B12R1.17 CCOC(=O)C1=CC(Cl)=NC=N1 E7681 [0,1,0,0,0,1|2,0,0]=4 262 B12R1.17 CCOC(=O)C1=CC(N)=CC=C1 E64578 [0,1,0,0,0,1|2,0,0]=4 263 B12R1.17 CCOC(=O)C1=CC(N)=NC=C1 E46664 [0,1,0,0,0,1|2,0,0]=4 264 B12R1.17 CCOC(=O)C1=CC(O)=CC=C1 E39534 [0,1,0,0,0,1|2,0,0]=4 265 B12R1.17 CCOC(=O)C1=CC=CC(Br)=C1 E51874 [0,1,0,0,0,1|2,0,0]=4 266 B12R1.17 CCOC(=O)C1=CC=CC(Br)=N1 E48924 [0,1,0,0,0,1|2,0,0]=4 267 B12R1.17 CCOC(=O)C1=CC=CC(Cl)=C1 E51913 [0,1,0,0,0,1|2,0,0]=4 268 B12R1.17 CCOC(=O)C1=CC=CC(Cl)=N1 E48936 [0,1,0,0,0,1|2,0,0]=4 269 B12R1.17 CCOC(=O)C1=CC=CC(I)=C1 E39580 [0,1,0,0,0,1|2,0,0]=4 270 B12R1.17 CCOC(=O)C1=CC=NC(Br)=N1 E37478 [0,1,0,0,0,1|2,0,0]=4 271 B12R1.17 CCOC(=O)C1=CC=NC(Cl)=N1 E45660 [0,1,0,0,0,1|2,0,0]=4 272 B12R1.17 CCOC(=O)C1=CN=CC(C)=C1 E50034 [0,1,0,0,0,1|2,0,0]=4 273 B12R1.17 CCOC(=O)C1=CN=CC(Cl)=N1 E45658 [0,1,0,0,0,1|2,0,0]=4 274 B12R1.17 CCOC(=O)C1=CN=CC(O)=C1 E49307 [0,1,0,0,0,1|2,0,0]=4 275 B12R1.17 CCOC(=O)C1=NC(C)=CC=N1 E37556 [0,1,0,0,0,1|2,0,0]=4 276 B12R1.17 CCOC(=O)C1=NC(N)=CC=C1 E32237 [0,1,0,0,0,1|2,0,0]=4 277 B12R1.17 CCOC(=O)C1=NC(N)=CC=N1 E46348 [0,1,0,0,0,1|2,0,0]=4 278 B12R1.17 CCOC(=O)C1=NC(N)=NC=C1 E61742 [0,1,0,0,0,1|2,0,0]=4 279 B12R1.17 CCOC(=O)C1=NC=CC(Br)=C1 E48902 [0,1,0,0,0,1|2,0,0]=4 280 B12R1.17 CCOC(=O)C1=NC=CC(Cl)=C1 E48934 [0,1,0,0,0,1|2,0,0]=4 281 B12R1.17 CCOC(=O)C1=NC=CC(N)=C1 E15648 [0,1,0,0,0,1|2,0,0]=4 282 B12R1.30 CNCCC(=O)C1=CC=CC=C1 M54151 [0,1,0,0,0,1|1,0,0]=3 283 B12R1.30 NCCNC(=O)C1=CN=CC=C1 A64779 [0,1,0,0,0,1|2,0,0]=4 284 B12R1.30 O=C(NCCO)C1=NC=CC=C1 H46674 [0,1,0,0,0,1|2,0,0]=4 285 B12R1.107 CC(=O)CC(=O)C1=CC=CC=C1 P68692 [0,1,0,0,0,1|1,0,1]=4 286 B12R1.308 CCOC(=O)C1=C(Br)C=CC=C1 E3305 [0,1,0,0,0,1|2,0,0]=4 287 B12R1.308 CCOC(=O)C1=C(Br)C=CC=N1 E48901 [0,1,0,0,0,1|2,0,0]=4 288 B12R1.308 CCOC(=O)C1=C(C)N=CC=C1 E50033 [0,1,0,0,0,1|2,0,0]=4 289 B12R1.308 CCOC(=O)C1=C(Cl)C=NC=C1 E48937 [0,1,0,0,0,1|2,0,0]=4 290 B12R1.308 CCOC(=O)C1=C(F)C=CC=C1 E51932 [0,1,0,0,0,1|2,0,0]=4 291 B12R1.308 CCOC(=O)C1=C(I)C=CC=C1 E51956 [0,1,0,0,0,1|2,0,0]=4 292 B12R1.308 CCOC(=O)C1=C(N)C=NC=C1 E46678 [0,1,0,0,0,1|2,0,0]=4 293 B12R1.308 CCOC(=O)C1=C(N)N=CC=C1 E7576 [0,1,0,0,0,1|2,0,0]=4 294 B12R1.308 CCOC(=O)C1=CC=CN=C1Br E38351 [0,1,0,0,0,1|2,0,0]=4 295 B12R1.308 CCOC(=O)C1=CC=CN=C1Cl E39502 [0,1,0,0,0,1|2,0,0]=4 296 B12R1.308 CCOC(=O)C1=NC=CC=C1C E24419 [0,1,0,0,0,1|2,0,0]=4 297 B12R1.308 CCOC(=O)C1=NC=CC=C1N E46661 [0,1,0,0,0,1|2,0,0]=4 298 B12R1.308 CCOC(=O)C1=NC=CN=C1Cl E45657 [0,1,0,0,0,1|2,0,0]=4 299 B12R1.308 CCOC(=O)C1=NN=CC=C1C M14117 [0,1,0,0,0,1|2,0,0]=4 300 B12R1.308 O=C(CCCl)C1=C(F)C=CC=C1 C51658 [0,1,0,0,0,1|2,0,0]=4 301 B12R1.55 CCOC(=O)C(=O)C1=CC=CS1 E12820 [0,1,0,0,0,1|1,1,0]=4 302 B12R1.295 CO\N=C(/C(=O)O)C1=CC=CO1 A45459 [0,2,0,0,0,0|2,0,0]=4 303 B12R1.103 CC(C)NC(=O)C1=CC=C(Br)S1 B46800 [0,2,0,0,0,0|1,1,0]=4 304 B12R1.312 C=CC1=NC=C(C(=O)OCC)O1 E49331 [0,2,0,0,0,0|2,0,0]=4 305 B12R1.312 CCOC(=O)C1=CC(C=O)=CN1 E4113 [0,2,0,0,0,0|2,0,0]=4 306 B12R1.312 CCOC(=O)C1=CC=C(C=O)N1 E4112 [0,2,0,0,0,0|2,0,0]=4 307 B12R1.312 CCOC(=O)C1=CC=C(CCl)O1 E49412 [0,2,0,0,0,0|1,0,0]=3 308 B12R1.313 CCOC(=O)C1=C(C)N=C(Cl)O1 E46147 [0,2,0,0,0,0|2,0,0]=4 309 B12R1.313 CCOC(=O)C1=C(C)N=C(N)O1 E43677 [0,2,0,0,0,0|2,0,0]=4 310 B12R1.15 COC(=O)CC(=O)C1=CC=CO1 M49114 [0,2,0,0,0,0|0,0,1]=3 311 B12R1.54 CN(C)C=CC(=O)C1=CC=CO1 D50079 [0,2,0,0,0,0|0,0,2]=4 312 B12R1.54 CN(C)CCC(=O)C1=CC=CS1 D52186 [0,2,0,0,0,0|0,1,0]=3 313 B12R1.54 O=C(O)CCC(=O)C1=CC=CS1 T49110 [0,2,0,0,0,0|0,1,1]=4 314 B12R1.265 CC(C)(C)NC(=O)C1=CC=CO1 B50363 [0,2,0,0,0,0|1,0,0]=3 315 B12R1.316 CCOC(=O)C1=C(C#N)C=CN1 E48824 [0,2,0,0,0,0|2,0,0]=4 316 B12R1.316 CCOC(=O)C1=C(C=O)C=CN1 E38964 [0,2,0,0,0,0|2,0,0]=4 317 B10R1.10 NCCC1=CC=CC(O)=C1 A49522 [0,0,1,1,0,0|2,0,0]=4 318 B10R1.4 COCC1=C(O)C=CC=C1 M69473 [0,0,1,1,0,0|2,0,0]=4 319 B10R1.4 NCCC1=C(O)C=CC=C1 A46892 [0,0,1,1,0,0|2,0,0]=4 320 B10R2.32 O=C1CCC2=C1C=CS2 D45612 [1,0,0,1,0,0|2,0,0]=4 321 B10R2.32 O=C1CCC2=C1SC=C2 C67539 [1,0,0,1,0,0|0,1,0]=3 322 B10R2.7 C1=CC2=C(CCCC2)N1 I19039 [1,0,0,1,0,0|1,0,1]=4 323 B12R2.1081 O=C1CCCC2=C1C=CC=N2 D0654 [0,0,0,1,0,1|1,0,0]=3 324 B12R2.1081 O=C1CCCC2=C1C=CN=C2 D69568 [0,0,0,1,0,1|1,0,0]=3 325 B12R2.1081 O=C1CCCC2=C1C=NC=C2 D52235 [0,0,0,1,0,1|1,0,0]=3 326 B12R2.1081 O=C1CCCC2=CC=CN=C12 D51765 [0,0,0,1,0,1|1,0,0]=3 327 B12R2.1081 O=C1CCNC2=C1C=CC=C2 D39113 [0,0,0,1,0,1|2,0,0]=4 328 B12R2.1081 O=C1CCOC2=C1C=CC=C2 C67858 [0,0,0,1,0,1|2,0,0]=4 329 B12R2.1081 O=C1CCOC2=CC=CN=C12 P48464 [0,0,0,1,0,1|2,0,0]=4 330 B12R2.1081 O=C1COCC2=C1C=CC=C2 I4950 [0,0,0,1,0,1|2,0,0]=4 331 B12R2.1081 O=C1CSCC2=C1C=CC=C2 T62209 [0,0,0,1,0,1|2,0,0]=4 332 B12R2.1081 O=C1NCCC2=C1C=CC=C2 D37571 [0,0,0,1,0,1|2,0,0]=4 333 B12R2.1081 O=C1NCCC2=C1C=CC=N2 D48818 [0,0,0,1,0,1|2,0,0]=4 334 B12R2.1081 O=C1NCCC2=C1C=NC=C2 D13447 [0,0,0,1,0,1|2,0,0]=4 335 B12R2.1081 O=C1NCCC2=CC=CN=C12 D48817 [0,0,0,1,0,1|2,0,0]=4 336 B12R2.1081 O=C1OCCC2=C1C=CC=C2 C51549 [0,0,0,1,0,1|2,0,0]=4 337 B12R2.196 CN1C=CC2=C1CCCC2=O D5363 [0,1,0,1,0,0|2,0,0]=4 338 B12R2.202 NC1=NC2=C(CCCC2=O)S1 A32093 [0,1,0,1,0,0|2,0,0]=4 339 B12R2.202 NC1=NC2=C(S1)C(=O)CCC2 A21871 [0,1,0,1,0,0|1,1,0]=4 340 B12R2.202 O=C1CCCC2=C1SC(Br)=N2 B61210 [0,1,0,1,0,0|1,1,0]=4 341 B12R2.202 O=C1NCCC2=C1SC(Br)=C2 B9505 [0,1,0,1,0,0|1,1,0]=4 342 B12R2.221 C[C@H]1CNC(=O)C2=CC=CN21 M46658 [0,1,0,1,0,0|1,0,0]=3 343 B10R1.15 C=C(CC)C1=CC=CC=C1 B52673 [1,0,0,0,0,1|2,0,0]=4 344 B10R1.15 CCC(=O)C1=CN=CC=C1 P49262 [1,0,0,0,0,1|1,0,0]=3 345 B10R1.15 CCC(=O)C1=NC=CC=N1 P61892 [1,0,0,0,0,1|1,0,0]=3 346 B10R1.15 CCC(=O)C1=NC=CN=C1 P14589 [1,0,0,0,0,1|1,0,0]=3 347 B10R1.15 COC(=O)C1=CC=NC=C1 M64933 [1,0,0,0,0,1|2,0,0]=4 348 B10R1.15 COC(=O)C1=NC=CC=C1 M28469 [1,0,0,0,0,1|2,0,0]=4 349 B10R1.15 COC(=O)C1=NC=CC=N1 M3445 [1,0,0,0,0,1|2,0,0]=4 350 B10R1.15 COC(=O)C1=NC=CN=C1 M2717 [1,0,0,0,0,1|2,0,0]=4 351 B10R1.15 COC(=O)C1=NC=NC=C1 P0159 [1,0,0,0,0,1|2,0,0]=4 352 B10R1.15 COC(=O)C1=NN=CC=C1 M0217 [1,0,0,0,0,1|2,0,0]=4 353 B10R1.15 O=C(CBr)C1=CN=CC=C1 B68250 [1,0,0,0,0,1|2,0,0]=4 354 B10R1.15 O=C(CBr)C1=NC=CC=C1 B45477 [1,0,0,0,0,1|2,0,0]=4 355 B10R1.15 O=C(CBr)C1=NC=CC=N1 B20416 [1,0,0,0,0,1|2,0,0]=4 356 B10R1.15 O=C(CBr)C1=NC=CC=N1 B69489 [1,0,0,0,0,1|2,0,0]=4 357 B10R1.15 O=C(CBr)C1=NC=CN=C1 B42452 [1,0,0,0,0,1|2,0,0]=4 358 B10R1.15 O=C(CCl)C1=CN=CC=C1 C45489 [1,0,0,0,0,1|2,0,0]=4 359 B10R1.15 O=C(CO)C1=CC=CC=C1 H67472 [1,0,0,0,0,1|2,0,0]=4 360 B10R1.17 CCCCC1=CC=NC=C1 B50306 [1,0,0,0,0,1|1,0,1]=4 361 B10R1.17 CCCOC1=CC=CC=C1 P50263 [1,0,0,0,0,1|2,0,0]=4 362 B12R1.32 CCCC(=O)CC1=CC=CC=C1 P54754 [0,0,0,0,0,2|1,0,0]=3 363 B12R1.32 CCOC(=O)CC1=CC=NC=C1 E50031 [0,0,0,0,0,2|2,0,0]=4 364 B12R1.32 CCOC(=O)CC1=CN=CC=C1 E50053 [0,0,0,0,0,2|2,0,0]=4 365 B12R1.32 CCOC(=O)CC1=NC=CC=C1 E22770 [0,0,0,0,0,2|2,0,0]=4 366 B12R1.32 CCOC(=O)CC1=NC=CC=N1 E14448 [0,0,0,0,0,2|2,0,0]=4 367 B12R1.32 CCOC(=O)CC1=NN=CC=C1 E18257 [0,0,0,0,0,2|2,0,0]=4 368 B12R1.32 CCOC(=O)NC1=CC=NC=C1 E60949 [0,0,0,0,0,2|2,0,0]=4