0 B10R1.172 C#CC1=NC(OC)=CN=C1 CS-0528942 [0,0,0,0,0,0|3,0,1]=4 1 B10R1.172 C#CC1=NC=CC(OC)=C1 CS-0609735 [0,0,0,0,0,0|2,0,1]=3 2 B10R1.172 COC1=CC(CN)=NC=C1 CS-0483209 [0,0,0,0,0,0|3,0,0]=3 3 B10R1.172 COC1=CC=NC(CCl)=C1 CS-0029801 [0,0,0,0,0,0|3,0,0]=3 4 B10R1.172 COC1=CN=CC(C#N)=C1 CS-0082366 [0,0,0,0,0,0|3,0,0]=3 5 B10R1.172 CSC1=CC=CC(CO)=C1 CS-0225753 [0,0,0,0,0,0|2,1,0]=3 6 B10R1.172 NNC1=CC(CO)=CC=C1 CS-1184747 [0,0,0,0,0,0|4,0,0]=4 7 B9R1.2 CC1=CC=CC(CCl)=N1 CS-W021434 [1,0,0,0,0,0|3,0,0]=4 8 B9R1.2 CC1=CC=CC(CN)=N1 CS-0100448 [1,0,0,0,0,0|3,0,0]=4 9 B9R1.2 CC1=CC=NC(CN)=C1 CS-0046314 [1,0,0,0,0,0|3,0,0]=4 10 B9R1.2 CCC1=NC(C)=CN=C1 CS-0161293 [1,0,0,0,0,0|3,0,0]=4 11 B9R1.2 COC1=CC(Cl)=NN=C1 CS-W019766 [1,0,0,0,0,0|3,0,0]=4 12 B9R1.2 COC1=CN=CC(Cl)=N1 CS-W019039 [1,0,0,0,0,0|3,0,0]=4 13 B9R1.2 COC1=CN=CC(N)=N1 CS-W013517 [1,0,0,0,0,0|3,0,0]=4 14 B9R1.2 COC1=NC=CC(Br)=N1 CS-0019378 [1,0,0,0,0,0|3,0,0]=4 15 B9R1.2 COC1=NN=CC(N)=C1 CS-0458624 [1,0,0,0,0,0|3,0,0]=4 16 B11R1.9 COC1=CC(CO)=NC(Cl)=C1 CS-0379629 [0,1,0,0,0,0|3,0,0]=4 17 B11R1.9 COC1=CC(Cl)=CC(C#N)=C1 CS-0099387 [0,1,0,0,0,0|2,0,0]=3 18 B11R1.189 C#CC1=NC(COC)=CC=C1 CS-0864239 [0,1,0,0,0,0|2,0,1]=4 19 B11R1.189 COC1=CC=CC(CCN)=N1 CS-W000067 [0,1,0,0,0,0|2,0,0]=3 20 B11R1.189 COC1=CC=CC(CCO)=N1 CS-0265278 [0,1,0,0,0,0|2,0,0]=3 21 B11R1.189 COCC1=CC(CO)=CC=C1 CS-0233432 [0,1,0,0,0,0|2,0,0]=3 22 B11R1.266 COC1=CC=CC(C(C)N)=N1 CS-0161890 [0,1,0,0,0,0|2,0,0]=3 23 B11R1.266 COC1=CC=CC(C(C)N)=N1 CS-0200441 [0,1,0,0,0,0|2,0,0]=3 24 B11R1.266 COC1=CN=CC(C(C)=O)=C1 CS-0155105 [0,1,0,0,0,0|2,0,0]=3 25 B11R1.266 COC1=CN=CC(C(C)=O)=N1 CS-0645975 [0,1,0,0,0,0|3,0,0]=4 26 B11R1.267 CNC1=CC=CC(OC)=C1N CS-0618592 [0,1,0,0,0,0|1,0,0]=2 27 B11R1.267 COC1=C(F)C(CBr)=CC=C1 CS-0695449 [0,1,0,0,0,0|2,0,0]=3 28 B11R1.267 COC1=C(O)C(CN)=CC=C1 CS-0626402 [0,1,0,0,0,0|2,0,0]=3 29 B11R1.267 COC1=CC=CC(CO)=C1F CS-0194749 [0,1,0,0,0,0|2,0,0]=3 30 B11R1.280 C#CC1=CC(OC)=CC=C1N CS-1225841 [0,1,0,0,0,0|1,0,1]=3 31 B11R1.280 C#CC1=CC=C(N)C(CC)=C1 CS-0609640 [0,1,0,0,0,0|2,0,1]=4 32 B11R1.280 COC1=C(C)C=NC(C=O)=C1 CS-0244993 [0,1,0,0,0,0|3,0,0]=4 33 B11R1.280 COC1=C(N)C=CC(C#N)=N1 CS-0890268 [0,1,0,0,0,0|3,0,0]=4 34 B11R1.280 COC1=CC(C#N)=CC=C1I CS-0377852 [0,1,0,0,0,0|2,0,0]=3 35 B11R1.280 COC1=CC(C#N)=CN=C1N CS-0160592 [0,1,0,0,0,0|3,0,0]=4 36 B11R1.280 COC1=CC(C=O)=CC=C1N CS-0374694 [0,1,0,0,0,0|2,0,0]=3 37 B11R1.280 COC1=CC(OC)=C(N)N=C1 CS-0588840 [0,1,0,0,0,0|1,0,0]=2 38 B11R1.280 COC1=CC=C(C)C(CN)=C1 CS-0651836 [0,1,0,0,0,0|2,0,0]=3 39 B11R1.280 COC1=CC=C(F)C(C=O)=N1 CS-0533986 [0,1,0,0,0,0|3,0,0]=4 40 B11R1.280 COC1=CC=C(N)C(C#N)=N1 CS-0377864 [0,1,0,0,0,0|3,0,0]=4 41 B11R1.280 COC1=CC=C(N)C(OC)=C1 CS-0033846 [0,1,0,0,0,0|0,0,0]=1 42 B11R1.280 COC1=NC(C=O)=C(C)C=C1 CS-0692350 [0,1,0,0,0,0|3,0,0]=4 43 B11R1.280 COC1=NC(C=O)=CC=C1C CS-0888264 [0,1,0,0,0,0|3,0,0]=4 44 B11R1.280 COC1=NC=C(O)C(C=O)=C1 CS-0119822 [0,1,0,0,0,0|3,0,0]=4 45 B8R1.2 C=CC1=CC=CC=C1 CS-0199613 [2,0,0,0,0,0|1,0,1]=4 46 B8R1.2 CC[N+]1=CC=CC=C1 CS-W016831 [2,0,0,0,0,0|2,0,0]=4 47 B8R1.2 CNC1=CC=CC=C1 CS-0197126 [2,0,0,0,0,0|1,0,0]=3 48 B8R1.4 CC1=CC(Cl)=NC=C1 CS-W011139 [2,0,0,0,0,0|2,0,0]=4 49 B8R1.4 CC1=CC(S)=NC=C1 CS-0448706 [2,0,0,0,0,0|1,1,0]=4 50 B8R1.4 CC1=CC=CC(=O)N1 CS-W011283 [2,0,0,0,0,0|1,0,1]=4 51 B8R1.4 NC1=CC(F)=CC=C1 CS-0172950 [2,0,0,0,0,0|2,0,0]=4 52 B10R1.2 C#CC1=CC=CC(C)=C1O CS-0611530 [1,1,0,0,0,0|1,0,1]=4 53 B10R1.2 CC1=C(I)C(C=O)=CC=C1 CS-0850283 [1,1,0,0,0,0|2,0,0]=4 54 B10R1.2 COC1=C(Cl)C(N)=CC=C1 CS-B0017 [1,1,0,0,0,0|1,0,0]=3 55 B10R1.2 COC1=CN=CC(F)=C1Br CS-0368897 [1,1,0,0,0,0|2,0,0]=4 56 B10R1.2 COC1=CN=CC(F)=C1N CS-0373578 [1,1,0,0,0,0|2,0,0]=4 57 B10R1.2 COC1=NC=CC(Cl)=C1N CS-0371392 [1,1,0,0,0,0|2,0,0]=4 58 B10R1.2 COC1=NC=CC(F)=C1N CS-0163582 [1,1,0,0,0,0|2,0,0]=4 59 B10R1.2 COC1=NC=CC(I)=C1F CS-0636381 [1,1,0,0,0,0|2,0,0]=4 60 B10R1.2 CSC1=C(I)C(C)=CC=C1 CS-0615254 [1,1,0,0,0,0|0,1,0]=3 61 B10R1.2 CSC1=C(N)C(C)=CC=C1 CS-0234384 [1,1,0,0,0,0|0,1,0]=3 62 B10R1.2 NCC1=C(O)C(O)=CC=C1 CS-0626407 [1,1,0,0,0,0|2,0,0]=4 63 B10R1.8 COC1=CC(F)=CC(O)=C1 CS-W004009 [1,1,0,0,0,0|0,0,0]=2 64 B10R1.8 COC1=CC(N)=CC(C)=C1 CS-W009064 [1,1,0,0,0,0|0,0,0]=2 65 B10R1.8 COC1=CC(N)=NC(C)=C1 CS-0622921 [1,1,0,0,0,0|1,0,0]=3 66 B10R1.8 COC1=CC(O)=CC(C)=C1 CS-0181797 [1,1,0,0,0,0|0,0,0]=2 67 B10R1.8 COC1=CC(O)=CC(N)=C1 CS-0514531 [1,1,0,0,0,0|0,0,0]=2 68 B10R1.8 COC1=CC(O)=CC(O)=C1 CS-W016468 [1,1,0,0,0,0|0,0,0]=2 69 B10R1.8 O=CC1=CC(O)=CC(F)=C1 CS-0108744 [1,1,0,0,0,0|2,0,0]=4 70 B10R1.8 OCC1=CC(O)=CC(F)=C1 CS-0378966 [1,1,0,0,0,0|2,0,0]=4 71 B10R1.10 CCCC1=CC=CC(Br)=C1 CS-0060101 [1,1,0,0,0,0|2,0,0]=4 72 B10R1.10 COCC1=NC=CC(Br)=C1 CS-0541448 [1,1,0,0,0,0|2,0,0]=4 73 B10R1.10 OCCC1=CC(F)=CC=C1 CS-W021390 [1,1,0,0,0,0|2,0,0]=4 74 B10R1.30 CC1=CC(CN)=C(Cl)C=C1 CS-0280262 [1,1,0,0,0,0|2,0,0]=4 75 B10R1.30 CC1=CC=C(Br)C(CN)=C1 CS-0617681 [1,1,0,0,0,0|2,0,0]=4 76 B10R1.30 CC1=CC=C(O)C=C1C#N CS-0373284 [1,1,0,0,0,0|2,0,0]=4 77 B10R1.30 CCC1=CC(N)=CC=C1F CS-0567559 [1,1,0,0,0,0|2,0,0]=4 78 B10R1.30 CCC1=NC(C)=CC=C1O CS-0182823 [1,1,0,0,0,0|2,0,0]=4 79 B10R1.30 CNC1=C(N)C=CC(Br)=C1 CS-W005679 [1,1,0,0,0,0|2,0,0]=4 80 B10R1.30 CNC1=C(N)C=CC(F)=C1 CS-0216852 [1,1,0,0,0,0|2,0,0]=4 81 B10R1.30 CNC1=CC(O)=CC=C1C CS-0187035 [1,1,0,0,0,0|1,0,0]=3 82 B10R1.30 COC1=C(C)C=CC(I)=C1 CS-0153556 [1,1,0,0,0,0|1,0,0]=3 83 B10R1.30 COC1=C(Cl)C=CC(N)=C1 CS-W016214 [1,1,0,0,0,0|1,0,0]=3 84 B10R1.30 COC1=CC(Br)=CN=C1F CS-0059248 [1,1,0,0,0,0|2,0,0]=4 85 B10R1.30 COC1=CC(Cl)=NC=C1F CS-0149624 [1,1,0,0,0,0|2,0,0]=4 86 B10R1.30 COC1=CC(F)=CC=C1I CS-0130922 [1,1,0,0,0,0|1,0,0]=3 87 B10R1.30 COC1=CC(S)=CC=C1F CS-0568056 [1,1,0,0,0,0|0,1,0]=3 88 B10R1.30 COC1=NC(Cl)=CC=C1F CS-0468513 [1,1,0,0,0,0|2,0,0]=4 89 B10R1.30 COC1=NC(F)=CC=C1Br CS-0614411 [1,1,0,0,0,0|2,0,0]=4 90 B10R1.30 COC1=NC(I)=CC=C1N CS-0653300 [1,1,0,0,0,0|2,0,0]=4 91 B10R1.30 NCC1=CC(O)=CC=C1Cl CS-0626410 [1,1,0,0,0,0|2,0,0]=4 92 B10R1.30 NCC1=CC(O)=CC=C1F CS-0882393 [1,1,0,0,0,0|2,0,0]=4 93 B10R1.30 O=CC1=CC(O)=CC=C1Cl CS-W006109 [1,1,0,0,0,0|2,0,0]=4 94 B10R1.30 OCC1=CC(O)=CC=C1O CS-0378114 [1,1,0,0,0,0|2,0,0]=4 95 B10R1.113 CC(=O)C1=CC(Cl)=CC=C1 CS-W018028 [1,1,0,0,0,0|2,0,0]=4 96 B10R1.113 CC(C)C1=CC(N)=CC=C1 CS-W013347 [1,1,0,0,0,0|2,0,0]=4 97 B10R1.113 CC1=CC(C(C)C)=CN=C1 CS-0654870 [1,1,0,0,0,0|2,0,0]=4 98 B10R1.113 CC1=CC(C(C)N)=CC=N1 CS-0214618 [1,1,0,0,0,0|2,0,0]=4 99 B10R1.113 CC1=CC=CC([C@@H](C)O)=N1 CS-0237638 [1,1,0,0,0,0|2,0,0]=4 100 B10R1.113 CN(C)C1=CC=CC(N)=C1 CS-0151314 [1,1,0,0,0,0|2,0,0]=4 101 B10R1.113 C[C@@H](O)C1=CC(N)=CC=C1 CS-0371105 [1,1,0,0,0,0|2,0,0]=4 102 B10R1.113 C[C@H](N)C1=CC(N)=CC=C1 CS-0651755 [1,1,0,0,0,0|2,0,0]=4 103 B10R1.113 C[C@H](N)C1=CC(O)=CC=C1 CS-B0172 [1,1,0,0,0,0|1,0,0]=3 104 B10R1.176 C#CC1=CC=C(N)C(C)=C1 CS-0609510 [1,1,0,0,0,0|1,0,1]=4 105 B10R1.176 CC1=CC(C=O)=CC=C1I CS-0883888 [1,1,0,0,0,0|2,0,0]=4 106 B10R1.176 CC1=CC(CO)=CC=C1Cl CS-0194584 [1,1,0,0,0,0|2,0,0]=4 107 B10R1.176 CC1=CC(CO)=CC=C1I CS-0378772 [1,1,0,0,0,0|2,0,0]=4 108 B10R1.176 CNC1=NC(C)=C(Br)C=C1 CS-0380665 [1,1,0,0,0,0|2,0,0]=4 109 B10R1.176 COC1=CC(Cl)=C(C)C=C1 CS-0153550 [1,1,0,0,0,0|1,0,0]=3 110 B10R1.176 COC1=CC=C(Br)C(F)=N1 CS-0130462 [1,1,0,0,0,0|2,0,0]=4 111 B10R1.176 COC1=CC=C(Cl)C(=O)N1 CS-0310721 [1,1,0,0,0,0|1,0,1]=4 112 B10R1.176 COC1=CC=C(O)C(Br)=N1 CS-0626684 [1,1,0,0,0,0|2,0,0]=4 113 B10R1.176 COC1=CC=C(O)C(C)=C1 CS-W006115 [1,1,0,0,0,0|0,0,0]=2 114 B10R1.176 COC1=CC=C(O)C(N)=N1 CS-0884389 [1,1,0,0,0,0|2,0,0]=4 115 B10R1.176 COC1=CN=C(Br)C(C)=N1 CS-0097628 [1,1,0,0,0,0|2,0,0]=4 116 B10R1.176 COC1=CN=C(N)C(Br)=C1 CS-0184366 [1,1,0,0,0,0|2,0,0]=4 117 B10R1.176 COC1=NC=C(F)C(I)=C1 CS-0063932 [1,1,0,0,0,0|2,0,0]=4 118 B10R1.176 COC1=NC=C(I)C(Cl)=C1 CS-0530131 [1,1,0,0,0,0|2,0,0]=4 119 B10R1.176 COC1=NC=C(N)C(Cl)=C1 CS-0334624 [1,1,0,0,0,0|2,0,0]=4 120 B10R1.176 CSC1=CN=C(Cl)C(C)=C1 CS-0448636 [1,1,0,0,0,0|1,1,0]=4 121 B10R1.176 OCC1=CC=C(I)C(O)=C1 CS-W018963 [1,1,0,0,0,0|2,0,0]=4 122 B12R1.11 COC1=CC(C(F)F)=CC(Br)=C1 CS-0525363 [0,2,0,0,0,0|2,0,0]=4 123 B12R1.11 COC1=CC(F)=CC(C(C)N)=C1 CS-0527716 [0,2,0,0,0,0|1,0,0]=3 124 B12R1.11 COC1=CC(N)=CC(N(C)C)=C1 CS-0905173 [0,2,0,0,0,0|1,0,0]=3 125 B12R1.41 COC1=CC(N)=CC(CCO)=C1 CS-M0774 [0,2,0,0,0,0|1,0,0]=3 126 B12R1.58 COC1=CC(C=O)=CC(C#N)=C1 CS-0112016 [0,2,0,0,0,0|2,0,0]=4 127 B12R1.235 COC1=CC(Br)=CC(OC)=C1C CS-0755042 [0,2,0,0,0,0|0,0,0]=2 128 B12R1.235 COC1=CC(I)=CC(OC)=C1Br CS-0752897 [0,2,0,0,0,0|0,0,0]=2 129 B12R1.300 COC1=C(F)C(F)=CC(C#N)=C1 CS-0634422 [0,2,0,0,0,0|2,0,0]=4 130 B12R1.300 COC1=CC(OC)=C(Cl)C(N)=C1 CS-0138701 [0,2,0,0,0,0|0,0,0]=2 131 B12R1.270 COC1=CC=C(Br)C(CCO)=N1 CS-0240824 [0,2,0,0,0,0|2,0,0]=4 132 B12R1.279 COCC1=CC(B(O)O)=CC=C1 CS-0176150 [0,2,0,0,0,0|2,0,0]=4 133 B12R1.286 COC1=CC(CC#N)=CC=C1Br CS-0202569 [0,2,0,0,0,0|1,0,1]=4 134 B12R1.286 COC1=CC(CNN)=CC=C1C CS-0286970 [0,2,0,0,0,0|2,0,0]=4 135 B12R1.435 COC1=CC([C@H](N)CO)=CC=C1 CS-0162073 [0,2,0,0,0,0|1,0,0]=3 136 B12R1.56 COC1=C(F)C=CC([C@H](C)N)=C1 CS-0000362 [0,2,0,0,0,0|1,0,0]=3 137 B12R1.56 COC1=CC(C(F)F)=CC=C1Br CS-0525382 [0,2,0,0,0,0|2,0,0]=4 138 B12R1.436 COC1=CC(S(C)(=N)=O)=CC=C1 CS-0645612 [0,2,0,0,0,0|0,1,0]=3 139 B12R1.436 COC1=CC=CC(S(C)(=N)=O)=C1 CS-0529717 [0,2,0,0,0,0|0,1,0]=3 140 B12R1.440 COC1=C(Cl)C(C(C)=O)=CC=C1 CS-0616864 [0,2,0,0,0,0|1,0,0]=3 141 B12R1.440 COC1=CC=CC(B(O)O)=C1O CS-0174142 [0,2,0,0,0,0|2,0,0]=4 142 B12R1.440 COC1=CC=CC(C(=O)O)=C1Cl CS-W016878 [0,2,0,0,0,0|2,0,0]=4 143 B12R1.453 COC1=CC(C(N)=O)=C(Br)C=C1 CS-0302587 [0,2,0,0,0,0|2,0,0]=4 144 B12R1.453 COC1=CC=C(F)C([C@@H](C)N)=C1 CS-0494965 [0,2,0,0,0,0|1,0,0]=3 145 B12R1.654 COC1=C(O)C(C=O)=CC=C1O CS-0059753 [0,2,0,0,0,0|2,0,0]=4 146 B12R1.1879 CCC1=CC=CC(CC)=C1NN CS-0098461 [0,2,0,0,0,0|2,0,0]=4 147 B12R1.1879 COC1=CC=CC(OC)=C1CCl CS-0302423 [0,2,0,0,0,0|0,0,0]=2 148 B12R1.78 COC1=CC(OC)=NC=C1C=O CS-0656821 [0,2,0,0,0,0|1,0,0]=3 149 B12R1.78 COC1=CC=C(OC)C(C=O)=C1 CS-W007635 [0,2,0,0,0,0|2,0,0]=4 150 B12R2.44 COC1=CC2=C(C=C1)NCC2 CS-0019194 [0,1,0,1,0,0|1,0,0]=3 151 B12R2.44 NCC1=CC=C2CCOC2=C1 CS-0159664 [0,1,0,1,0,0|2,0,0]=4 152 B12R2.44 OCC1=CC2=C(C=C1)CCO2 CS-0060648 [0,1,0,1,0,0|2,0,0]=4 153 B12R2.315 COC1=CC=CC2=C1C=NS2 CS-0646163 [0,1,0,1,0,0|0,1,1]=4