0 B11R1.24 BrCCCC1=CC=CC(Br)=C1 C77758 [0,0,0,0,0,0|2,1,0]=3 1 B11R1.24 BrCCOC1=CC=CC(Br)=C1 98063 [0,0,0,0,0,0|3,1,0]=4 2 B11R1.24 CC1=CC(CCCN)=NC=C1 W10140 [0,0,0,0,0,0|4,0,0]=4 3 B11R1.24 CC1=CC=CC(CCC=O)=C1 C10532 [0,0,0,0,0,0|3,0,0]=3 4 B11R1.24 CCCC[N+]1=CC(C)=CC=C1 C93515 [0,0,0,0,0,0|3,0,0]=3 5 B11R1.24 CCNCC1=CC(Br)=CN=C1 F19801 [0,0,0,0,0,0|3,1,0]=4 6 B11R1.24 CCOCC1=CC=CC(Br)=C1 F17773 [0,0,0,0,0,0|2,1,0]=3 7 B11R1.24 CNCCC1=CC=CC(Br)=C1 C78466 [0,0,0,0,0,0|0,1,0]=1 8 B11R1.24 COCCC1=CC(N)=NC=C1 AT18204 [0,0,0,0,0,0|3,0,0]=3 9 B11R1.24 ClC1=CC=CC(CCCBr)=C1 C78574 [0,0,0,0,0,0|2,1,0]=3 10 B11R1.24 N#CCCC1=CC=CC(F)=C1 97618 [0,0,0,0,0,0|2,0,0]=2 11 B11R1.24 N#CCOC1=CC(O)=CC=C1 C77746 [0,0,0,0,0,0|4,0,0]=4 12 B11R1.24 NC1=CC(CCCO)=NC=C1 AC5942 [0,0,0,0,0,0|4,0,0]=4 13 B11R1.24 NC1=CC=CC(OCCO)=C1 C78268 [0,0,0,0,0,0|4,0,0]=4 14 B11R1.24 NCCCC1=CC=CC(F)=C1 97619 [0,0,0,0,0,0|2,0,0]=2 15 B11R1.24 NCCCC1=CC=CC(N)=C1 C78147 [0,0,0,0,0,0|3,0,0]=3 16 B11R1.24 NCCCC1=CC=CC(O)=C1 C78310 [0,0,0,0,0,0|3,0,0]=3 17 B11R1.24 O=CCCC1=CC(O)=CC=C1 F19734 [0,0,0,0,0,0|3,0,0]=3 18 B11R1.24 O=CNCC1=CC=CC(F)=C1 Y10034 [0,0,0,0,0,0|3,0,0]=3 19 B11R1.24 O=C\C=C\C1=CC=CC(F)=C1 FD10704 [0,0,0,0,0,0|2,0,2]=4 20 B11R1.24 [C-]#[N+]CCC1=CC=CC(F)=C1 50335 [0,0,0,0,0,0|0,0,2]=2 21 B10R1.10 CC1=CC=CC(CC=O)=C1 74805 [1,0,0,0,0,0|2,0,1]=4 22 B10R1.10 CC1=CC=CC(CCBr)=N1 AC6969 [1,0,0,0,0,0|3,0,0]=4 23 B10R1.10 CC1=CC=CC(CCN)=N1 P19093 [1,0,0,0,0,0|2,0,0]=3 24 B10R1.10 CC1=NC=CC(CNN)=C1 F52070 [1,0,0,0,0,0|3,0,0]=4 25 B10R1.10 CC1=NC=CC(CNN)=C1 F52466 [1,0,0,0,0,0|3,0,0]=4 26 B10R1.10 CCCC1=CC=CC(F)=C1 36946 [1,0,0,0,0,0|0,0,0]=1 27 B10R1.10 CCNC1=CC=CC(Cl)=C1 L10102 [1,0,0,0,0,0|1,1,0]=3 28 B10R1.10 CCNC1=CC=CC(O)=C1 F16135 [1,0,0,0,0,0|2,0,0]=3 29 B10R1.10 CCOC1=CC=CC(S)=C1 T73015 [1,0,0,0,0,0|2,0,0]=3 30 B10R1.10 CCSC1=CC(N)=CC=C1 AT20857 [1,0,0,0,0,0|2,0,0]=3 31 B10R1.10 CNCC1=CC(Cl)=NC=C1 AT26616 [1,0,0,0,0,0|1,1,0]=3 32 B10R1.10 CNCC1=NC(C)=CC=C1 D87644 [1,0,0,0,0,0|2,0,0]=3 33 B10R1.10 CNCC1=NC=CC(Cl)=C1 CS1254 [1,0,0,0,0,0|1,1,0]=3 34 B10R1.10 COCC1=CC(N)=CC=C1 30379 [1,0,0,0,0,0|2,0,0]=3 35 B10R1.10 CSCC1=CC(N)=CC=C1 AT15211 [1,0,0,0,0,0|2,0,0]=3 36 B10R1.10 NCCC1=CC=CC(I)=C1 C78608 [1,0,0,0,0,0|0,1,0]=2 37 B10R1.10 NNCC1=CC(Br)=CN=C1 P11105 [1,0,0,0,0,0|2,1,0]=4 38 B10R1.10 NNCC1=CC=CC(Cl)=C1 P15270 [1,0,0,0,0,0|1,1,0]=3 39 B10R1.10 NNCC1=CC=CC(O)=C1 D87672 [1,0,0,0,0,0|2,0,0]=3 40 B10R1.10 N\N=C\C1=CC=CC(O)=C1 F15561 [1,0,0,0,0,0|2,0,1]=4 41 B10R1.10 O=CCC1=CC=CC(Cl)=C1 W16823 [1,0,0,0,0,0|1,1,1]=4 42 B10R1.17 CCCCC1=CC=CN=N1 O10974 [1,0,0,0,0,0|3,0,0]=4 43 B10R1.17 CNCCC1=CC=CN=C1 C73747 [1,0,0,0,0,0|1,0,0]=2 44 B10R1.17 CNCCC1=CC=NC=C1 AR1715 [1,0,0,0,0,0|1,0,0]=2 45 B10R1.17 CNNCC1=NC=CC=C1 30190 [1,0,0,0,0,0|2,0,0]=3 46 B10R1.17 FCCNC1=CC=CC=C1 D77931 [1,0,0,0,0,0|3,0,0]=4 47 B10R1.17 NNCCC1=CC=CC=C1 AC4670 [1,0,0,0,0,0|1,0,0]=2 48 B10R1.17 NOCCC1=CC=CC=C1 C10179 [1,0,0,0,0,0|2,0,0]=3 49 B10R1.17 O=CCCC1=NC=CC=C1 P20552 [1,0,0,0,0,0|3,0,0]=4 50 B10R1.17 O=CCOC1=CC=CC=C1 C15303 [1,0,0,0,0,0|3,0,0]=4 51 B10R1.17 OCCCC1=CN=CC=C1 AC5531 [1,0,0,0,0,0|3,0,0]=4 52 B10R1.17 SCCCC1=CN=CC=C1 F18019 [1,0,0,0,0,0|3,0,0]=4 53 B10R1.17 SCCCC1=NC=CC=C1 F18728 [1,0,0,0,0,0|3,0,0]=4 54 B12R1.17 C=CC[C@H](N)C1=CC=CC(Br)=C1 74253 [0,1,0,0,0,0|1,1,1]=4 55 B12R1.17 CCCC(=O)C1=CC(C)=CC=C1 N13969 [0,1,0,0,0,0|2,0,1]=4 56 B12R1.17 CCCC(=O)C1=CC(F)=CN=C1 N14269 [0,1,0,0,0,0|2,0,1]=4 57 B12R1.17 CCCC(=O)C1=CC=CC(Cl)=C1 N13955 [0,1,0,0,0,0|1,1,1]=4 58 B12R1.17 CCCC(=O)C1=CC=CC(F)=C1 N13952 [0,1,0,0,0,0|1,0,1]=3 59 B12R1.17 CCOC(=N)C1=CC=CC(F)=C1 91789 [0,1,0,0,0,0|2,0,1]=4 60 B12R1.17 CCOC(=N)C1=CC=CC(F)=C1 D87710 [0,1,0,0,0,0|2,0,1]=4 61 B12R1.17 CN(CCBr)C1=CC(F)=CC=C1 72470 [0,1,0,0,0,0|3,0,0]=4 62 B12R1.17 COC[C@H](N)C1=CC=CC(Cl)=C1 N13031 [0,1,0,0,0,0|1,1,0]=3 63 B12R1.17 COC[C@H](N)C1=CC=CC(F)=C1 D81287 [0,1,0,0,0,0|1,0,0]=2 64 B12R1.17 N#CC[C@H](O)C1=CC=CC(O)=C1 D85736 [0,1,0,0,0,0|3,0,0]=4 65 B12R1.17 N[C@@H](CCO)C1=CC=CC(Cl)=C1 57810 [0,1,0,0,0,0|2,1,0]=4 66 B12R1.17 N[C@@H](CCO)C1=CC=CC(O)=C1 62481 [0,1,0,0,0,0|3,0,0]=4 67 B12R1.25 CCCOC1=C(C)C(N)=CC=C1 F17950 [0,1,0,0,0,0|3,0,0]=4 68 B12R1.28 BrCCCCC1=CC=CC(Br)=C1 AT22149 [0,1,0,0,0,0|1,1,0]=3 69 B12R1.28 BrCCCOC1=CC=CC(Br)=C1 97812 [0,1,0,0,0,0|2,1,0]=4 70 B12R1.28 CCCCCC1=CC=CC(=O)O1 T70705 [0,1,0,0,0,0|3,0,0]=4 71 B12R1.28 CCCNCC1=CC(C)=CC=C1 C77940 [0,1,0,0,0,0|2,0,0]=3 72 B12R1.28 CCCNCC1=CC=CC(Br)=C1 C78566 [0,1,0,0,0,0|1,1,0]=3 73 B12R1.28 CCCNCC1=CC=CC(Cl)=C1 C78191 [0,1,0,0,0,0|1,1,0]=3 74 B12R1.28 CCCNCC1=CC=CC(F)=C1 C78563 [0,1,0,0,0,0|1,0,0]=2 75 B12R1.28 COCCNC1=NC=CC(N)=C1 F19660 [0,1,0,0,0,0|3,0,0]=4 76 B12R1.28 ClC1=CC=CC(OCCCBr)=C1 97802 [0,1,0,0,0,0|2,1,0]=4 77 B12R1.28 N#CCCOC1=CC=CC(Br)=C1 F13495 [0,1,0,0,0,0|2,1,0]=4 78 B12R1.28 NC1=CC=CC(OCCCO)=C1 C77805 [0,1,0,0,0,0|3,0,0]=4 79 B12R1.28 OCCCCC1=CC=CC(Br)=C1 AT22147 [0,1,0,0,0,0|1,1,0]=3 80 B12R1.50 CC1=CC=CC(C[C@H](N)CO)=C1 C78461 [0,1,0,0,0,0|3,0,0]=4 81 B12R1.50 CCC(=O)CC1=CC=CC(Br)=C1 N14158 [0,1,0,0,0,0|1,1,1]=4 82 B12R1.50 CCC(=O)CC1=CC=CC(F)=C1 N14137 [0,1,0,0,0,0|1,0,1]=3 83 B12R1.50 CC[C@H](N)CC1=CC(C)=CC=C1 N14536 [0,1,0,0,0,0|2,0,0]=3 84 B12R1.50 CC[C@H](N)CC1=CC=CC(Br)=C1 N14532 [0,1,0,0,0,0|1,1,0]=3 85 B12R1.50 CC[C@H](N)CC1=CC=CC(Cl)=C1 N14527 [0,1,0,0,0,0|1,1,0]=3 86 B12R1.50 CC[C@H](N)CC1=CC=CC(F)=C1 N14524 [0,1,0,0,0,0|1,0,0]=2 87 B12R1.50 CNC(=O)CC1=CC(N)=CC=C1 N10567 [0,1,0,0,0,0|1,0,1]=3 88 B12R1.50 CNC(=O)NC1=NC=CC(F)=C1 96549 [0,1,0,0,0,0|2,0,1]=4 89 B12R1.50 CN[C@@H](C)CC1=CC=CC(F)=C1 N12793 [0,1,0,0,0,0|0,0,0]=1 90 B12R1.50 N[C@H](CO)CC1=CC=CC(Br)=C1 C78100 [0,1,0,0,0,0|2,1,0]=4 91 B12R1.50 N[C@H](CO)CC1=CC=CC(Br)=C1 C78242 [0,1,0,0,0,0|2,1,0]=4 92 B12R1.50 N[C@H](CO)CC1=CC=CC(Cl)=C1 Y11238 [0,1,0,0,0,0|2,1,0]=4 93 B12R1.50 N[C@H](CO)CC1=CC=CC(F)=C1 N11307 [0,1,0,0,0,0|2,0,0]=3 94 B12R1.100 C#CCOC1=CC(F)=CC(F)=C1 C78232 [0,1,0,0,0,0|2,0,1]=4 95 B12R1.100 CC1=CC(C)=CC(CCCN)=C1 C77897 [0,1,0,0,0,0|3,0,0]=4 96 B12R1.100 COCOC1=CC(F)=CC(F)=C1 AC6738 [0,1,0,0,0,0|2,0,0]=3 97 B12R1.100 FC1=CC(F)=CC(CCCBr)=C1 C78521 [0,1,0,0,0,0|2,0,0]=3 98 B12R1.100 NCCCC1=CC(F)=CC(F)=C1 C77734 [0,1,0,0,0,0|2,0,0]=3 99 B12R1.100 OCCCC1=CC(F)=CC(F)=C1 C77733 [0,1,0,0,0,0|2,0,0]=3 100 B12R1.100 OCCOC1=CC(Br)=CC(F)=C1 N11578 [0,1,0,0,0,0|3,0,0]=4 101 B12R1.226 CC(C)NCC1=CC=CC(Br)=C1 C77759 [0,1,0,0,0,0|2,1,0]=4 102 B12R1.226 CC(C)NCC1=CC=CC(Cl)=C1 C78565 [0,1,0,0,0,0|2,1,0]=4 103 B12R1.226 CC(C)NCC1=CC=CC(F)=C1 C78564 [0,1,0,0,0,0|2,0,0]=3 104 B12R1.226 CC(C)OCC1=CC(N)=CC=C1 F20261 [0,1,0,0,0,0|3,0,0]=4 105 B12R1.226 CC1=CC=CC(CNC(C)C)=C1 C78583 [0,1,0,0,0,0|3,0,0]=4 106 B12R1.226 CC1=CC=CC(OC[C@H](C)N)=C1 F50497 [0,1,0,0,0,0|3,0,0]=4 107 B12R1.226 NC(=O)CCC1=CC=CC(Br)=C1 F20007 [0,1,0,0,0,0|2,1,0]=4 108 B12R1.226 NC(=O)CCC1=CC=CC(Cl)=C1 D87293 [0,1,0,0,0,0|2,1,0]=4 109 B12R1.374 CCOCC1=C(Br)C=CC(F)=C1 N10175 [0,1,0,0,0,0|2,0,0]=3 110 B12R1.374 CCOCC1=C(F)C=CC(Br)=C1 N10200 [0,1,0,0,0,0|2,1,0]=4 111 B12R1.374 FC1=CC(CCCBr)=C(F)C=C1 C77741 [0,1,0,0,0,0|2,0,0]=3 112 B12R1.374 OCCCC1=C(F)C=CC(F)=C1 C78523 [0,1,0,0,0,0|2,0,0]=3 113 B12R1.382 C#CCCC1=CC=CC(C#N)=C1 D85889 [0,1,0,0,0,0|2,0,1]=4 114 B12R1.382 CCNCC1=CC=CC(OC)=C1 F16322 [0,1,0,0,0,0|3,0,0]=4 115 B12R1.382 COC1=CC=CC(CCC=O)=C1 AC6075 [0,1,0,0,0,0|3,0,0]=4 116 B12R1.385 CC1=C(C)C=C(CCCN)C=C1 C77896 [0,1,0,0,0,0|3,0,0]=4 117 B12R1.385 CCCCC1=CC(N)=C(N)C=C1 F18184 [0,1,0,0,0,0|2,0,0]=3 118 B12R1.385 CNCCC1=CC(Cl)=C(Cl)C=C1 C78278 [0,1,0,0,0,0|0,1,0]=2 119 B12R1.385 FC1=C(F)C=C(CCCBr)C=C1 C77742 [0,1,0,0,0,0|2,0,0]=3 120 B12R1.385 NCCCC1=CC(Cl)=C(Cl)C=C1 C78454 [0,1,0,0,0,0|2,1,0]=4 121 B12R1.385 NCCCC1=CC(F)=C(F)C=C1 C78171 [0,1,0,0,0,0|2,0,0]=3 122 B12R1.385 OCCCC1=CC(F)=C(F)C=C1 C78127 [0,1,0,0,0,0|2,0,0]=3 123 B12R2.24 BrC1=NC2=C(C=C1)CNCC2 C13599 [0,0,0,1,0,0|1,1,0]=3 124 B12R2.24 CC1=CC2=C(C=C1)CNCC2 C15799 [0,0,0,1,0,0|1,0,0]=2 125 B12R2.24 ClC1=CC2=C(C=C1)CCCC2 Y10725 [0,0,0,1,0,0|1,1,0]=3 126 B12R2.24 ClC1=CC2=C(C=C1)COCC2 N14606 [0,0,0,1,0,0|1,1,0]=3 127 B12R2.24 FC1=CC2=C(C=C1)CCNC2 76409 [0,0,0,1,0,0|2,0,0]=3 128 B12R2.24 FC1=CC2=C(C=C1)COCC2 N14605 [0,0,0,1,0,0|1,0,0]=2 129 B12R2.80 NC1CC1C2=CC=CC(Cl)=C2 D86978 [0,0,0,1,0,0|2,1,0]=4 130 B12R2.80 N[C@H]1C[C@@H]1C2=CC=CC(Cl)=C2 AC1027 [0,0,0,1,0,0|2,1,0]=4 131 B12R2.80 N[C@H]1C[C@@H]1C2=CC=CC(F)=C2 E72638 [0,0,0,1,0,0|2,0,0]=3 132 B12R2.203 CN1C=CC2=CC=CC(N)=C21 N13008 [0,0,0,1,0,0|1,0,2]=4 133 B12R2.203 CN1C=NC2=CC=CC(Cl)=C21 91614 [0,0,0,1,0,0|1,1,1]=4 134 B12R2.203 N[C@H]1CCC2=CC=CC(F)=C21 Y12096 [0,0,0,1,0,0|2,0,0]=3 135 B12R2.612 CC1=CC2=C(C=C1)[C@@H](N)CC2 N10840 [0,0,0,1,0,0|3,0,0]=4 136 B12R2.612 CN1C=CC2=C1C=CC(F)=C2 98405 [0,0,0,1,0,0|0,0,2]=3 137 B12R2.612 ClC1=CC2=C(C=C1)[C@@H](Br)CC2 AT21847 [0,0,0,1,0,0|2,1,0]=4 138 B12R2.612 Cl[C@H]1CCC2=C1C=CC(Br)=C2 O11349 [0,0,0,1,0,0|2,1,0]=4 139 B12R2.612 N[C@H]1CCC2=C1C=CC(F)=C2 69968 [0,0,0,1,0,0|2,0,0]=3 140 B12R2.612 N[C@H]1CCC2=C1C=CC(F)=C2 F16940 [0,0,0,1,0,0|2,0,0]=3 141 B12R2.612 N[C@H]1CCC2=C1C=CC(F)=C2 Y11252 [0,0,0,1,0,0|2,0,0]=3 142 B12R2.612 O=C1CCC2=C1C=CC(S)=C2 79915 [0,0,0,1,0,0|3,0,0]=4 143 B12R2.1081 CC1=C2CNCCC2=NC=N1 C16784 [0,0,0,1,0,0|3,0,0]=4 144 B12R2.1081 CC1=C2CNCCC2=NC=N1 SC2281 [0,0,0,1,0,0|3,0,0]=4 145 B12R2.1081 CC1=CC=CC2=C1CCOC2 N14603 [0,0,0,1,0,0|3,0,0]=4 146 B12R2.1081 ClC1=C2CCCNC2=CC=C1 N14207 [0,0,0,1,0,0|2,1,0]=4 147 B12R2.1081 ClC1=C2CCNCC2=CC=C1 24212 [0,0,0,1,0,0|2,1,0]=4 148 B12R2.1081 ClC1=C2CCOCC2=CC=C1 N14602 [0,0,0,1,0,0|2,1,0]=4 149 B12R2.1081 ClC1=NC=NC2=C1CNCC2 82104 [0,0,0,1,0,0|2,1,0]=4 150 B12R2.1081 FC1=C2CCOCC2=CC=C1 N14601 [0,0,0,1,0,0|2,0,0]=3 151 B12R2.1081 FC1=C2NCCOC2=CC=C1 90425 [0,0,0,1,0,0|3,0,0]=4 152 B12R2.1081 NC1=C2CCCCC2=CN=C1 F13768 [0,0,0,1,0,0|3,0,0]=4 153 B12R2.1081 NC1=C2CNCCC2=CC=C1 C10171 [0,0,0,1,0,0|1,0,0]=2 154 B12R2.1081 OC1=C2CCNCC2=CC=C1 20736 [0,0,0,1,0,0|3,0,0]=4 155 B12R2.1081 OC1=C2CNCCC2=CC=C1 AT24057 [0,0,0,1,0,0|1,0,0]=2 156 B12R2.1081 OC1=C2CNCCC2=CC=C1 C15586 [0,0,0,1,0,0|1,0,0]=2 157 B12R2.1081 OC1=C2OCCCC2=CC=C1 76490 [0,0,0,1,0,0|3,0,0]=4 158 B12R2.1081 OC1=NC=CC2=C1CNCC2 F53632 [0,0,0,1,0,0|2,0,0]=3 159 B12R2.2313 CC1=CC(C2CNC2)=NC=C1 90168 [0,0,0,1,0,0|2,0,0]=3 160 B12R2.2313 CC1=CC=CC(C2CNC2)=C1 AT15442 [0,0,0,1,0,0|1,0,0]=2 161 B12R2.2313 CC1=CC=CC(C2CNC2)=N1 90170 [0,0,0,1,0,0|2,0,0]=3 162 B12R2.2313 CC1=CC=NC(C2CNC2)=N1 90177 [0,0,0,1,0,0|3,0,0]=4 163 B12R2.2313 NC1=CC(C2CCC2)=NC=C1 F52581 [0,0,0,1,0,0|3,0,0]=4 164 B12R2.2313 OC1=CC(C2CCC2)=CC=C1 97837 [0,0,0,1,0,0|2,0,0]=3 165 B10R1.29 CNCCN1C=CN=C1C D75971 [0,0,0,0,1,0|3,0,0]=4 166 B9R1.2 CNC1=NC=CC(N)=C1 F12690 [2,0,0,0,0,0|2,0,0]=4 167 B9R1.2 FC1=CC(CCl)=CN=C1 O10881 [2,0,0,0,0,0|2,0,0]=4 168 B9R1.2 NCC1=CC(=O)NC=C1 37540 [2,0,0,0,0,0|2,0,0]=4 169 B9R1.2 NCC1=CC(Br)=CN=C1 F19818 [2,0,0,0,0,0|1,1,0]=4 170 B9R1.2 NCC1=CC(F)=NC=C1 W18404 [2,0,0,0,0,0|1,0,0]=3 171 B9R1.2 NCC1=CC(N)=NC=C1 AC6477 [2,0,0,0,0,0|2,0,0]=4 172 B9R1.2 NCC1=CC=CC(Cl)=N1 C72946 [2,0,0,0,0,0|1,1,0]=4 173 B9R1.2 NCC1=CC=CC(I)=C1 CK2420 [2,0,0,0,0,0|0,1,0]=3 174 B9R1.2 NCC1=CC=CC(O)=N1 F10425 [2,0,0,0,0,0|2,0,0]=4 175 B9R1.2 NCC1=NC=CC(Br)=C1 26892 [2,0,0,0,0,0|1,1,0]=4 176 B9R1.2 NCC1=NC=CC(F)=C1 C71953 [2,0,0,0,0,0|1,0,0]=3 177 B9R1.2 NCC1=NC=CC(N)=C1 77886 [2,0,0,0,0,0|2,0,0]=4 178 B9R1.2 [2H]CC1=CC=CC(F)=C1 D99661 [2,0,0,0,0,0|1,0,0]=3 179 B9R1.8 BrCCC1=CN=CC=C1 C77647 [2,0,0,0,0,0|2,0,0]=4 180 B9R1.8 CCCC1=CC=CN=C1 O11051 [2,0,0,0,0,0|1,0,0]=3 181 B9R1.8 CCC[N+]1=CC=CC=C1 T72121 [2,0,0,0,0,0|1,0,0]=3 182 B9R1.8 CNCC1=CN=CN=C1 38577 [2,0,0,0,0,0|2,0,0]=4 183 B9R1.8 CNCC1=NC=CC=N1 27199 [2,0,0,0,0,0|2,0,0]=4 184 B9R1.8 CNCC1=NC=CC=N1 72796 [2,0,0,0,0,0|2,0,0]=4 185 B9R1.8 CNCC1=NC=NC=C1 C14477 [2,0,0,0,0,0|2,0,0]=4 186 B9R1.8 CNNC1=CC=CC=C1 C77159 [2,0,0,0,0,0|1,0,0]=3 187 B9R1.8 FCCC1=CC=CC=C1 75534 [2,0,0,0,0,0|1,0,0]=3 188 B9R1.8 NCCC1=CC=CC=C1 T71816 [2,0,0,0,0,0|0,0,0]=2 189 B9R1.8 NCCC1=CC=CC=C1 T72591 [2,0,0,0,0,0|0,0,0]=2 190 B9R1.8 NCCC1=NC=CC=N1 83201 [2,0,0,0,0,0|2,0,0]=4 191 B9R1.8 NCCC1=NC=CC=N1 P10852 [2,0,0,0,0,0|2,0,0]=4 192 B9R1.8 NCCC1=NC=CN=C1 AT22557 [2,0,0,0,0,0|2,0,0]=4 193 B9R1.8 NCCC1=NC=NC=C1 P10950 [2,0,0,0,0,0|2,0,0]=4 194 B9R1.8 NNCC1=NC=CC=C1 P10521 [2,0,0,0,0,0|2,0,0]=4 195 B9R1.8 OCCC1=CC=NC=C1 T72404 [2,0,0,0,0,0|2,0,0]=4 196 B9R1.8 SCCC1=NC=CC=C1 F18309 [2,0,0,0,0,0|2,0,0]=4 197 B11R1.13 CCOC1=C(C)C(N)=CC=C1 F18648 [1,1,0,0,0,0|2,0,0]=4 198 B11R1.13 ClC1=CC=CC(CCBr)=C1Cl C78633 [1,1,0,0,0,0|1,1,0]=4 199 B11R1.13 N#CCC1=CC=CC(F)=C1Cl 94661 [1,1,0,0,0,0|0,0,2]=4 200 B11R1.13 O=CCC1=CC=CC(F)=C1F 22736 [1,1,0,0,0,0|1,0,1]=4 201 B11R1.23 C=C[C@H](N)C1=CC=CC(F)=C1 N15235 [1,1,0,0,0,0|0,0,2]=4 202 B11R1.23 C=C[C@H](N)C1=CC=CC(F)=C1 N15236 [1,1,0,0,0,0|0,0,2]=4 203 B11R1.23 CC1=CC=CC([C@@H](N)CN)=C1 N13429 [1,1,0,0,0,0|1,0,0]=3 204 B11R1.23 CC1=CC=CC([C@@H](N)CN)=C1 N13430 [1,1,0,0,0,0|1,0,0]=3 205 B11R1.23 CC1=CC=CC([C@@H](N)CN)=C1 N13431 [1,1,0,0,0,0|1,0,0]=3 206 B11R1.23 CC1=CC=CC([C@@H](N)CN)=C1 N13452 [1,1,0,0,0,0|1,0,0]=3 207 B11R1.23 CC1=CC=CC([C@@H](N)CN)=C1 N13453 [1,1,0,0,0,0|1,0,0]=3 208 B11R1.23 CC1=CC=CC([C@@H](N)CN)=C1 N13454 [1,1,0,0,0,0|1,0,0]=3 209 B11R1.23 CC1=CC=CC([C@@H](O)CN)=C1 C78286 [1,1,0,0,0,0|1,0,0]=3 210 B11R1.23 CCC(=O)C1=CC(N)=CC=C1 34175 [1,1,0,0,0,0|1,0,1]=4 211 B11R1.23 CC[C@H](O)C1=CC(C)=CC=C1 N14416 [1,1,0,0,0,0|1,0,0]=3 212 B11R1.23 CC[C@H](O)C1=CC=CC(Br)=C1 N12527 [1,1,0,0,0,0|0,1,0]=3 213 B11R1.23 CC[C@H](O)C1=CC=CC(Cl)=C1 N12311 [1,1,0,0,0,0|0,1,0]=3 214 B11R1.23 CN[C@@H](C)C1=CC=CC(F)=C1 N12243 [1,1,0,0,0,0|0,0,0]=2 215 B11R1.23 NCC(=O)C1=CC(O)=CC=C1 C77908 [1,1,0,0,0,0|1,0,1]=4 216 B11R1.23 NC[C@H](N)C1=CC=CC(Br)=C1 N13420 [1,1,0,0,0,0|0,1,0]=3 217 B11R1.23 NC[C@H](N)C1=CC=CC(Br)=C1 N13421 [1,1,0,0,0,0|0,1,0]=3 218 B11R1.23 NC[C@H](N)C1=CC=CC(Br)=C1 N13422 [1,1,0,0,0,0|0,1,0]=3 219 B11R1.23 NC[C@H](N)C1=CC=CC(Br)=C1 N13443 [1,1,0,0,0,0|0,1,0]=3 220 B11R1.23 NC[C@H](N)C1=CC=CC(Br)=C1 N13445 [1,1,0,0,0,0|0,1,0]=3 221 B11R1.23 NC[C@H](N)C1=CC=CC(Cl)=C1 N13411 [1,1,0,0,0,0|0,1,0]=3 222 B11R1.23 NC[C@H](N)C1=CC=CC(Cl)=C1 N13412 [1,1,0,0,0,0|0,1,0]=3 223 B11R1.23 NC[C@H](N)C1=CC=CC(Cl)=C1 N13413 [1,1,0,0,0,0|0,1,0]=3 224 B11R1.23 NC[C@H](N)C1=CC=CC(Cl)=C1 N13435 [1,1,0,0,0,0|0,1,0]=3 225 B11R1.23 NC[C@H](N)C1=CC=CC(Cl)=C1 N13436 [1,1,0,0,0,0|0,1,0]=3 226 B11R1.23 NC[C@H](N)C1=CC=CC(Cl)=C1 N13437 [1,1,0,0,0,0|0,1,0]=3 227 B11R1.23 NC[C@H](N)C1=CC=CC(F)=C1 N13396 [1,1,0,0,0,0|0,0,0]=2 228 B11R1.23 NC[C@H](N)C1=CC=CC(F)=C1 N13397 [1,1,0,0,0,0|0,0,0]=2 229 B11R1.23 NC[C@H](N)C1=CC=CC(F)=C1 N13398 [1,1,0,0,0,0|0,0,0]=2 230 B11R1.23 NC[C@H](N)C1=CC=CC(F)=C1 N13399 [1,1,0,0,0,0|0,0,0]=2 231 B11R1.23 NC[C@H](N)C1=CC=CC(F)=C1 N13404 [1,1,0,0,0,0|0,0,0]=2 232 B11R1.23 NC[C@H](N)C1=CC=CC(F)=C1 N13405 [1,1,0,0,0,0|0,0,0]=2 233 B11R1.23 NC[C@H](O)C1=CC=CC(Br)=C1 58439 [1,1,0,0,0,0|0,1,0]=3 234 B11R1.23 NC[C@H](O)C1=CC=CC(Br)=C1 71528 [1,1,0,0,0,0|0,1,0]=3 235 B11R1.23 NC[C@H](O)C1=CC=CC(Br)=C1 92116 [1,1,0,0,0,0|0,1,0]=3 236 B11R1.23 NC[C@H](O)C1=CC=CC(Cl)=C1 58428 [1,1,0,0,0,0|0,1,0]=3 237 B11R1.23 NC[C@H](O)C1=CC=CC(Cl)=C1 C78287 [1,1,0,0,0,0|0,1,0]=3 238 B11R1.23 NC[C@H](O)C1=CC=CC(Cl)=C1 D77208 [1,1,0,0,0,0|0,1,0]=3 239 B11R1.23 N[C@@H](CF)C1=CC=CC(Br)=C1 N14613 [1,1,0,0,0,0|1,1,0]=4 240 B11R1.23 N[C@@H](CO)C1=CC(F)=CN=C1 N14406 [1,1,0,0,0,0|2,0,0]=4 241 B11R1.23 N[C@@H](CO)C1=CC(F)=CN=C1 N14407 [1,1,0,0,0,0|2,0,0]=4 242 B11R1.23 N[C@@H](CO)C1=CC=CC(F)=C1 N12818 [1,1,0,0,0,0|1,0,0]=3 243 B11R1.23 O=C(CO)C1=CC=CC(F)=C1 AC5675 [1,1,0,0,0,0|1,0,1]=4 244 B11R1.23 O[C@@H](CCl)C1=CC=CC(Br)=C1 58437 [1,1,0,0,0,0|1,1,0]=4 245 B11R1.23 O[C@@H](CCl)C1=CC=CC(Cl)=C1 58424 [1,1,0,0,0,0|1,1,0]=4 246 B11R1.23 O[C@@H](CCl)C1=CC=CC(Cl)=C1 C72678 [1,1,0,0,0,0|1,1,0]=4 247 B11R1.34 C=CCC1=CC(Br)=CC(F)=C1 C76836 [1,1,0,0,0,0|0,0,2]=4 248 B11R1.34 CCOC1=CC(Br)=CC(Br)=C1 N11666 [1,1,0,0,0,0|1,1,0]=4 249 B11R1.34 CCOC1=CC(F)=NC(F)=C1 C16442 [1,1,0,0,0,0|2,0,0]=4 250 B11R1.34 COCC1=CC(Br)=CC(Br)=C1 AT26748 [1,1,0,0,0,0|1,1,0]=4 251 B11R1.34 COCC1=CC(Br)=CC(F)=C1 94138 [1,1,0,0,0,0|1,0,0]=3 252 B11R1.34 COCC1=CC(F)=CC(F)=C1 AT26699 [1,1,0,0,0,0|1,0,0]=3 253 B11R1.34 ClC1=CC(Cl)=CC(CCBr)=C1 C78597 [1,1,0,0,0,0|1,1,0]=4 254 B11R1.34 NCCC1=CC(Cl)=CC(Cl)=C1 F12494 [1,1,0,0,0,0|0,1,0]=3 255 B11R1.34 NOCC1=CC(Cl)=CC(Cl)=C1 D74083 [1,1,0,0,0,0|1,1,0]=4 256 B11R1.34 OCCC1=CC(Br)=CC(Br)=C1 AT19150 [1,1,0,0,0,0|1,1,0]=4 257 B11R1.34 OCCC1=CC(O)=CC(O)=C1 AT19148 [1,1,0,0,0,0|2,0,0]=4 258 B11R1.157 CC(=O)CC1=CC(C)=CC=C1 N12785 [1,1,0,0,0,0|1,0,1]=4 259 B11R1.157 CC(C)CC1=CC=CC(N)=C1 O11024 [1,1,0,0,0,0|1,0,0]=3 260 B11R1.157 CC(C)NC1=CC=CC(Br)=C1 C77831 [1,1,0,0,0,0|1,1,0]=4 261 B11R1.157 CC(C)NC1=CC=CC(Cl)=C1 C78133 [1,1,0,0,0,0|1,1,0]=4 262 B11R1.157 CC1=CC=CC(C[C@H](C)N)=C1 N11054 [1,1,0,0,0,0|1,0,0]=3 263 B11R1.157 C[C@H](N)CC1=CC=CC(Br)=C1 E72139 [1,1,0,0,0,0|0,1,0]=3 264 B11R1.157 C[C@H](N)CC1=CC=CC(Cl)=C1 83690 [1,1,0,0,0,0|0,1,0]=3 265 B11R1.157 C[C@H](N)CC1=CC=CC(Cl)=C1 N11066 [1,1,0,0,0,0|0,1,0]=3 266 B11R1.157 C[C@H](N)CC1=CC=CC(F)=C1 N10878 [1,1,0,0,0,0|0,0,0]=2 267 B11R1.157 C[S@](=O)CC1=CC(N)=CC=C1 AT15220 [1,1,0,0,0,0|2,0,0]=4 268 B11R1.157 N=C(N)NC1=CC=CC(F)=C1 C16183 [1,1,0,0,0,0|1,0,1]=4 269 B11R1.157 OB(O)CC1=CC=CC(F)=C1 D79888 [1,1,0,0,0,0|2,0,0]=4 270 B11R1.182 CC1=C(CCN)C=C(Cl)C=C1 AT13431 [1,1,0,0,0,0|0,1,0]=3 271 B11R1.182 CCCC1=C(Br)C=CC(O)=C1 57995 [1,1,0,0,0,0|1,0,0]=3 272 B11R1.182 CCCN1C=C(N)C=CC1=O AT19282 [1,1,0,0,0,0|2,0,0]=4 273 B11R1.182 CCOC1=C(F)C=CC(Br)=C1 H11056 [1,1,0,0,0,0|1,1,0]=4 274 B11R1.182 CNCC1=C(Cl)C=CC(Cl)=C1 76693 [1,1,0,0,0,0|0,1,0]=3 275 B11R1.182 CNCC1=C(F)C=CC(Br)=C1 36267 [1,1,0,0,0,0|0,1,0]=3 276 B11R1.182 COCC1=C(Br)C=CC(F)=C1 N11817 [1,1,0,0,0,0|1,0,0]=3 277 B11R1.182 ClC1=CC(CCBr)=C(Cl)C=C1 C78205 [1,1,0,0,0,0|1,1,0]=4 278 B11R1.182 NCCC1=C(Br)C=CC(Cl)=C1 AT11063 [1,1,0,0,0,0|0,1,0]=3 279 B11R1.182 NCCC1=C(F)C=CC(Br)=C1 N12525 [1,1,0,0,0,0|0,1,0]=3 280 B11R1.182 NCCC1=C(F)C=CC(F)=C1 AT21560 [1,1,0,0,0,0|0,0,0]=2 281 B11R1.182 NCCN1C=C(Br)C=CC1=O AT19269 [1,1,0,0,0,0|1,1,0]=4 282 B11R1.182 NNCC1=C(Br)C=CC(Cl)=C1 AC5350 [1,1,0,0,0,0|1,1,0]=4 283 B11R1.182 NNCC1=C(Cl)C=CC(F)=C1 AC5377 [1,1,0,0,0,0|1,0,0]=3 284 B11R1.182 NNCC1=C(F)C=CC(Br)=C1 AC5379 [1,1,0,0,0,0|1,1,0]=4 285 B11R1.189 CCCC1=CC=CC(OC)=C1 AC9509 [1,1,0,0,0,0|1,0,0]=3 286 B11R1.189 CCOC1=CC(CN)=CC=C1 N12140 [1,1,0,0,0,0|2,0,0]=4 287 B11R1.189 CCSC1=CC(C#N)=CC=C1 AT20900 [1,1,0,0,0,0|2,0,0]=4 288 B11R1.189 COC1=NC=CC(CCN)=C1 AT18209 [1,1,0,0,0,0|2,0,0]=4 289 B11R1.189 COCC1=CC(C#N)=CC=C1 O10889 [1,1,0,0,0,0|2,0,0]=4 290 B11R1.189 COCC1=CC=CC(OC)=C1 N11528 [1,1,0,0,0,0|2,0,0]=4 291 B11R1.189 N#CC1=CC(CCN)=CC=C1 72737 [1,1,0,0,0,0|1,0,0]=3 292 B11R1.192 CCCC1=CC(Br)=C(Cl)C=C1 F31327 [1,1,0,0,0,0|0,1,0]=3 293 B11R1.192 CCOC1=CC(F)=C(O)C=C1 94989 [1,1,0,0,0,0|1,0,0]=3 294 B11R1.192 CCOC1=CC(N)=C(N)C=C1 34477 [1,1,0,0,0,0|2,0,0]=4 295 B11R1.192 CCSC1=CC(Cl)=C(Br)C=C1 89705 [1,1,0,0,0,0|1,1,0]=4 296 B11R1.192 CNCC1=CC(F)=C(F)C=C1 N12835 [1,1,0,0,0,0|0,0,0]=2 297 B11R1.192 ClC1=C(Cl)C=C(CCBr)C=C1 C78192 [1,1,0,0,0,0|1,1,0]=4 298 B11R1.192 FC1=C(Br)C=CC(CCBr)=C1 AC8493 [1,1,0,0,0,0|1,0,0]=3 299 B11R1.192 N#CCC1=CC(F)=C(O)C=C1 F13577 [1,1,0,0,0,0|0,0,2]=4 300 B11R1.192 NNCC1=CC(Br)=C(F)C=C1 E71963 [1,1,0,0,0,0|1,1,0]=4 301 B11R1.192 NNCC1=CC(Cl)=C(Cl)C=C1 AC5360 [1,1,0,0,0,0|1,1,0]=4 302 B11R1.192 NNCC1=CC(F)=C(F)C=C1 AC5348 [1,1,0,0,0,0|1,0,0]=3 303 B11R1.1 CC1=CC=C(CCCN)C=C1 C78299 [1,1,0,0,0,0|2,0,0]=4 304 B11R1.1 CNCCC1=CC=C(Br)C=C1 C78422 [1,1,0,0,0,0|0,0,0]=2 305 B11R1.1 CNCCC1=CC=C(C)C=C1 C78074 [1,1,0,0,0,0|0,0,0]=2 306 B11R1.1 CNCCC1=NC=C(Br)C=N1 AT18381 [1,1,0,0,0,0|2,0,0]=4 307 B11R1.1 COCCC1=CC=C(Br)C=C1 28244 [1,1,0,0,0,0|1,0,0]=3 308 B11R1.1 COCCC1=CC=C(N)C=C1 F11764 [1,1,0,0,0,0|1,0,0]=3 309 B11R1.1 CONCC1=CC=C(Br)C=C1 N11596 [1,1,0,0,0,0|2,0,0]=4 310 B11R1.1 ClC1=CC=C(CCCBr)C=C1 S11935 [1,1,0,0,0,0|2,0,0]=4 311 B11R1.1 N#CCCC1=CC=C(O)C=C1 C15091 [1,1,0,0,0,0|2,0,0]=4 312 B11R1.1 NCCCC1=CC=C(N)C=C1 C78351 [1,1,0,0,0,0|2,0,0]=4 313 B11R1.16 C#CC[C@H](O)C1=CC=CC=C1 W15219 [1,1,0,0,0,0|1,0,1]=4 314 B11R1.16 CCC[C@H](N)C1=CC=CC=C1 N12265 [1,1,0,0,0,0|1,0,0]=3 315 B11R1.16 CNC[C@H](C)C1=CC=CC=C1 C11240 [1,1,0,0,0,0|0,0,0]=2 316 B11R1.16 CNC[C@H](O)C1=CC=CC=C1 C11214 [1,1,0,0,0,0|0,0,0]=2 317 B11R1.16 COC[C@H](N)C1=CC=CC=C1 AC6537 [1,1,0,0,0,0|1,0,0]=3 318 B11R1.16 NCC[C@H](N)C1=CC=CC=C1 N14729 [1,1,0,0,0,0|2,0,0]=4 319 B11R1.16 NCC[C@H](N)C1=CC=CC=C1 N14730 [1,1,0,0,0,0|2,0,0]=4 320 B11R1.16 OCC[C@H](O)C1=CC=CC=C1 C80043 [1,1,0,0,0,0|2,0,0]=4 321 B11R1.17 BrCCCC1=C(Br)C=CC=C1 C77748 [1,1,0,0,0,0|2,0,0]=4 322 B11R1.17 CCCOC1=C(N)C=CC=C1 AC7746 [1,1,0,0,0,0|2,0,0]=4 323 B11R1.17 CCNCC1=C(Cl)C=CC=C1 C16114 [1,1,0,0,0,0|2,0,0]=4 324 B11R1.17 CNCCC1=C(C)C=CC=C1 C78447 [1,1,0,0,0,0|0,0,0]=2 325 B11R1.17 CNCCC1=C(Cl)C=CC=C1 C78279 [1,1,0,0,0,0|0,0,0]=2 326 B11R1.17 ClC1=C(CCCBr)C=CC=C1 C78298 [1,1,0,0,0,0|2,0,0]=4 327 B11R1.17 NCCCC1=C(Cl)C=CC=C1 C78000 [1,1,0,0,0,0|2,0,0]=4 328 B11R1.17 NCCCC1=C(F)C=CC=C1 F20045 [1,1,0,0,0,0|2,0,0]=4 329 B11R1.28 CCCCNC1=CC=NC=C1 F21501 [1,1,0,0,0,0|2,0,0]=4 330 B11R1.28 CCNCCC1=CC=CC=C1 AC5622 [1,1,0,0,0,0|0,0,0]=2 331 B11R1.28 NNCCOC1=CC=CC=C1 AC4849 [1,1,0,0,0,0|1,0,0]=3 332 B11R1.28 NOCCOC1=CC=CC=C1 AT21707 [1,1,0,0,0,0|2,0,0]=4 333 B11R1.28 OCCCCC1=CC=NC=C1 31475 [1,1,0,0,0,0|2,0,0]=4 334 B11R1.40 CC[C@H](N)CC1=CC=CC=C1 74053 [1,1,0,0,0,0|1,0,0]=3 335 B11R1.40 CNC(=S)NC1=CC=CC=C1 T72207 [1,1,0,0,0,0|1,0,1]=4 336 B11R1.40 C[C@H](C=O)CC1=CC=CC=C1 F16111 [1,1,0,0,0,0|2,0,0]=4 337 B11R1.40 NC[C@@H](N)CC1=CC=CC=C1 N14383 [1,1,0,0,0,0|2,0,0]=4 338 B11R1.40 NC[C@@H](N)CC1=CC=CC=C1 N14384 [1,1,0,0,0,0|2,0,0]=4 339 B11R1.40 NC[C@@H](N)CC1=CC=CC=C1 N14385 [1,1,0,0,0,0|2,0,0]=4 340 B11R1.40 N[C@H](CO)CC1=CC=CC=C1 C78372 [1,1,0,0,0,0|2,0,0]=4 341 B11R1.91 CC(=O)CCC1=CC=NC=C1 AT24518 [1,1,0,0,0,0|2,0,0]=4 342 B11R1.91 C[C@H](N)COC1=CC=CC=C1 N12753 [1,1,0,0,0,0|2,0,0]=4 343 B11R1.91 C[C@H](N)COC1=CC=CC=C1 N12763 [1,1,0,0,0,0|2,0,0]=4 344 B11R1.91 C[C@H](N)CSC1=CC=CC=C1 AT26670 [1,1,0,0,0,0|2,0,0]=4 345 B13R1.12 CC1=C(F)C=CC=C1[C@@H](N)CC#N N15006 [0,2,0,0,0,0|2,0,0]=4 346 B13R1.12 CC1=C(F)C=CC=C1[C@@H](N)CC#N N15007 [0,2,0,0,0,0|2,0,0]=4 347 B13R1.12 CC1=C(F)C=CC=C1[C@@H](N)CC#N N15008 [0,2,0,0,0,0|2,0,0]=4 348 B13R1.12 CCCC(=O)C1=CC=CC(F)=C1F N14014 [0,2,0,0,0,0|1,0,1]=4 349 B13R1.12 CCC[C@H](N)C1=C(C)C(C)=CC=C1 N11289 [0,2,0,0,0,0|2,0,0]=4 350 B13R1.12 CCC[C@H](N)C1=CC=CC(F)=C1F N11378 [0,2,0,0,0,0|1,0,0]=3 351 B13R1.12 N#CC[C@H](N)C1=CC=CC(F)=C1Br N15003 [0,2,0,0,0,0|2,0,0]=4 352 B13R1.12 N#CC[C@H](N)C1=CC=CC(F)=C1Br N15004 [0,2,0,0,0,0|2,0,0]=4 353 B13R1.12 N#CC[C@H](N)C1=CC=CC(F)=C1Br N15005 [0,2,0,0,0,0|2,0,0]=4 354 B13R1.12 N#CC[C@H](N)C1=CC=CC(F)=C1Cl N15000 [0,2,0,0,0,0|2,0,0]=4 355 B13R1.12 N#CC[C@H](N)C1=CC=CC(F)=C1Cl N15001 [0,2,0,0,0,0|2,0,0]=4 356 B13R1.12 N#CC[C@H](N)C1=CC=CC(F)=C1Cl N15002 [0,2,0,0,0,0|2,0,0]=4 357 B13R1.18 CCCCC(=O)C1=CC(C)=CC=C1 N13970 [0,2,0,0,0,0|2,0,0]=4 358 B13R1.18 CCCCC(=O)C1=CC=CC(Br)=C1 N13964 [0,2,0,0,0,0|1,1,0]=4 359 B13R1.18 CCCCC(=O)C1=CC=CC(Cl)=C1 N13956 [0,2,0,0,0,0|1,1,0]=4 360 B13R1.18 COCC[C@H](N)C1=CC(C)=CC=C1 N13830 [0,2,0,0,0,0|2,0,0]=4 361 B13R1.18 COCC[C@H](N)C1=CC=CC(Cl)=C1 N13827 [0,2,0,0,0,0|1,1,0]=4 362 B13R1.18 COCC[C@H](N)C1=CC=CC(F)=C1 N13796 [0,2,0,0,0,0|1,0,0]=3 363 B13R1.22 COC(=O)[C@H](N)C1=CC=CC(F)=C1 CL9515 [0,2,0,0,0,0|1,0,1]=4 364 B13R1.22 COC(=O)[C@H](N)C1=CC=CC(F)=C1 N12512 [0,2,0,0,0,0|1,0,1]=4 365 B13R1.147 CC(C)C[C@H](N)C1=CC=CC(Br)=C1 N14471 [0,2,0,0,0,0|1,1,0]=4 366 B13R1.147 CC(C)C[C@H](N)C1=CC=CC(Cl)=C1 N14468 [0,2,0,0,0,0|1,1,0]=4 367 B13R1.147 CC(C)C[C@H](N)C1=CC=CC(Cl)=C1 N14469 [0,2,0,0,0,0|1,1,0]=4 368 B13R1.147 CC(C)C[C@H](N)C1=CC=CC(F)=C1 N14465 [0,2,0,0,0,0|1,0,0]=3 369 B13R1.147 CC1=CC=CC([C@@H](N)CC(C)C)=C1 N14475 [0,2,0,0,0,0|2,0,0]=4 370 B13R1.446 CC1=C([C@@H](N)CCO)C=C(F)C=C1 Y11744 [0,2,0,0,0,0|2,0,0]=4 371 B13R1.446 CC1=C([C@@H](N)CCO)C=C(F)C=C1 Y13266 [0,2,0,0,0,0|2,0,0]=4 372 B13R1.446 CC1=C([C@@H](N)CCO)C=C(F)C=C1 Y13289 [0,2,0,0,0,0|2,0,0]=4 373 B13R1.446 CCCC(=O)C1=C(F)C=CC(F)=C1 N14030 [0,2,0,0,0,0|1,0,1]=4 374 B13R1.446 CCC[C@H](N)C1=C(F)C=CC(F)=C1 N11166 [0,2,0,0,0,0|1,0,0]=3 375 B13R1.446 COC[C@H](N)C1=C(C)C=CC(C)=C1 Y12175 [0,2,0,0,0,0|2,0,0]=4 376 B13R1.446 COC[C@H](N)C1=C(Cl)C=CC(Br)=C1 Y12853 [0,2,0,0,0,0|1,1,0]=4 377 B13R1.446 COC[C@H](N)C1=C(Cl)C=CC(Br)=C1 Y12901 [0,2,0,0,0,0|1,1,0]=4 378 B13R1.446 COC[C@H](N)C1=C(Cl)C=CC(Br)=C1 Y12924 [0,2,0,0,0,0|1,1,0]=4 379 B13R1.446 N#CC[C@H](N)C1=C(F)C=CC(F)=C1 N14972 [0,2,0,0,0,0|2,0,0]=4 380 B13R1.446 N#CC[C@H](N)C1=C(F)C=CC(F)=C1 N14973 [0,2,0,0,0,0|2,0,0]=4 381 B13R1.446 N#CC[C@H](N)C1=C(F)C=CC(F)=C1 N14974 [0,2,0,0,0,0|2,0,0]=4 382 B13R1.446 N[C@@H](CCO)C1=C(Br)C=CC(F)=C1 Y12236 [0,2,0,0,0,0|2,0,0]=4 383 B13R1.446 N[C@@H](CCO)C1=C(Br)C=CC(F)=C1 Y13022 [0,2,0,0,0,0|2,0,0]=4 384 B13R1.446 N[C@@H](CCO)C1=C(Cl)C=CC(F)=C1 Y12238 [0,2,0,0,0,0|2,0,0]=4 385 B13R1.446 N[C@@H](CCO)C1=C(Cl)C=CC(F)=C1 Y12239 [0,2,0,0,0,0|2,0,0]=4 386 B13R1.446 N[C@@H](CCO)C1=C(Cl)C=CC(F)=C1 Y12940 [0,2,0,0,0,0|2,0,0]=4 387 B13R1.450 CC1=CC(F)=CC([C@@H](N)CC#N)=C1 N15039 [0,2,0,0,0,0|2,0,0]=4 388 B13R1.450 CC1=CC(F)=CC([C@@H](N)CC#N)=C1 N15040 [0,2,0,0,0,0|2,0,0]=4 389 B13R1.450 CC1=CC(F)=CC([C@@H](N)CC#N)=C1 N15041 [0,2,0,0,0,0|2,0,0]=4 390 B13R1.450 CCCC(=O)C1=CC(C)=CC(F)=C1 N14071 [0,2,0,0,0,0|1,0,1]=4 391 B13R1.450 CCCC(=O)C1=CC(Cl)=CC(F)=C1 N14066 [0,2,0,0,0,0|1,0,1]=4 392 B13R1.450 CCCC(=O)C1=CC(F)=CC(F)=C1 N14062 [0,2,0,0,0,0|1,0,1]=4 393 B13R1.450 CCC[C@H](N)C1=CC(C)=CC(F)=C1 N11369 [0,2,0,0,0,0|1,0,0]=3 394 B13R1.450 CCC[C@H](N)C1=CC(Cl)=CC(Cl)=C1 N11380 [0,2,0,0,0,0|1,1,0]=4 395 B13R1.450 CCC[C@H](N)C1=CC(F)=CC(F)=C1 N11286 [0,2,0,0,0,0|1,0,0]=3 396 B13R1.450 N#CC[C@H](N)C1=CC(Br)=CC(F)=C1 N15036 [0,2,0,0,0,0|2,0,0]=4 397 B13R1.450 N#CC[C@H](N)C1=CC(Br)=CC(F)=C1 N15037 [0,2,0,0,0,0|2,0,0]=4 398 B13R1.450 N#CC[C@H](N)C1=CC(Br)=CC(F)=C1 N15038 [0,2,0,0,0,0|2,0,0]=4 399 B13R1.450 N#CC[C@H](N)C1=CC(Cl)=CC(F)=C1 N15033 [0,2,0,0,0,0|2,0,0]=4 400 B13R1.450 N#CC[C@H](N)C1=CC(Cl)=CC(F)=C1 N15034 [0,2,0,0,0,0|2,0,0]=4 401 B13R1.450 N#CC[C@H](N)C1=CC(Cl)=CC(F)=C1 N15035 [0,2,0,0,0,0|2,0,0]=4 402 B13R1.450 N#CC[C@H](N)C1=CC(F)=CC(F)=C1 N15030 [0,2,0,0,0,0|2,0,0]=4 403 B13R1.450 N#CC[C@H](N)C1=CC(F)=CC(F)=C1 N15031 [0,2,0,0,0,0|2,0,0]=4 404 B13R1.450 N#CC[C@H](N)C1=CC(F)=CC(F)=C1 N15032 [0,2,0,0,0,0|2,0,0]=4 405 B13R1.460 COC[C@H](N)C1=CC=CC(OC)=C1 N12800 [0,2,0,0,0,0|2,0,0]=4 406 B13R1.466 CC1=C(F)C=C([C@@H](N)CC#N)C=C1 N15018 [0,2,0,0,0,0|2,0,0]=4 407 B13R1.466 CC1=C(F)C=C([C@@H](N)CC#N)C=C1 N15019 [0,2,0,0,0,0|2,0,0]=4 408 B13R1.466 CC1=C(F)C=C([C@@H](N)CC#N)C=C1 N15020 [0,2,0,0,0,0|2,0,0]=4 409 B13R1.466 CCCC(=O)C1=CC(F)=C(C)C=C1 N14055 [0,2,0,0,0,0|1,0,1]=4 410 B13R1.466 CCCC(=O)C1=CC(F)=C(Cl)C=C1 N14047 [0,2,0,0,0,0|1,0,1]=4 411 B13R1.466 CCCC(=O)C1=CC(F)=C(F)C=C1 N14044 [0,2,0,0,0,0|1,0,1]=4 412 B13R1.466 CCC[C@H](N)C1=CC(C)=C(C)C=C1 N11171 [0,2,0,0,0,0|2,0,0]=4 413 B13R1.466 CCC[C@H](N)C1=CC(C)=C(F)C=C1 N11204 [0,2,0,0,0,0|2,0,0]=4 414 B13R1.466 CCC[C@H](N)C1=CC(F)=C(F)C=C1 N11161 [0,2,0,0,0,0|1,0,0]=3 415 B13R1.466 CNC[C@H](O)C1=CC(O)=C(O)C=C1 D95540 [0,2,0,0,0,0|1,0,0]=3 416 B13R1.466 COC[C@H](N)C1=CC(F)=C(F)C=C1 N13033 [0,2,0,0,0,0|1,0,0]=3 417 B13R1.466 N#CC[C@H](N)C1=CC(F)=C(Br)C=C1 N15015 [0,2,0,0,0,0|2,0,0]=4 418 B13R1.466 N#CC[C@H](N)C1=CC(F)=C(Br)C=C1 N15016 [0,2,0,0,0,0|2,0,0]=4 419 B13R1.466 N#CC[C@H](N)C1=CC(F)=C(Br)C=C1 N15017 [0,2,0,0,0,0|2,0,0]=4 420 B13R1.466 N#CC[C@H](N)C1=CC(F)=C(Cl)C=C1 N15012 [0,2,0,0,0,0|2,0,0]=4 421 B13R1.466 N#CC[C@H](N)C1=CC(F)=C(Cl)C=C1 N15013 [0,2,0,0,0,0|2,0,0]=4 422 B13R1.466 N#CC[C@H](N)C1=CC(F)=C(Cl)C=C1 N15014 [0,2,0,0,0,0|2,0,0]=4 423 B13R1.466 N#CC[C@H](N)C1=CC(F)=C(F)C=C1 N15009 [0,2,0,0,0,0|2,0,0]=4 424 B13R1.466 N#CC[C@H](N)C1=CC(F)=C(F)C=C1 N15010 [0,2,0,0,0,0|2,0,0]=4 425 B13R1.466 N#CC[C@H](N)C1=CC(F)=C(F)C=C1 N15011 [0,2,0,0,0,0|2,0,0]=4 426 B13R1.40 COC(=O)CC1=CC=CC(F)=C1O 92707 [0,2,0,0,0,0|1,0,1]=4 427 B13R1.150 CC1=C(F)C=CC=C1CCC(=O)O F52892 [0,2,0,0,0,0|2,0,0]=4 428 B13R1.6 BrCCCCOC1=CC=CC(Br)=C1 97813 [0,2,0,0,0,0|1,1,0]=4 429 B13R1.6 CCCCNCC1=CC(C)=CC=C1 C78344 [0,2,0,0,0,0|2,0,0]=4 430 B13R1.6 CCCCNCC1=CC=CC(Br)=C1 C78341 [0,2,0,0,0,0|1,1,0]=4 431 B13R1.6 CCCCNCC1=CC=CC(Cl)=C1 C77945 [0,2,0,0,0,0|1,1,0]=4 432 B13R1.6 CCCCNCC1=CC=CC(F)=C1 C78338 [0,2,0,0,0,0|1,0,0]=3 433 B13R1.6 CCOCCOC1=CC=CC(Br)=C1 N11546 [0,2,0,0,0,0|1,1,0]=4 434 B13R1.6 COCCCOC1=CC(N)=CC=C1 F13498 [0,2,0,0,0,0|2,0,0]=4 435 B13R1.6 ClC1=CC=CC(OCCCCBr)=C1 97803 [0,2,0,0,0,0|1,1,0]=4 436 B13R1.20 CCCC(=O)CC1=CC(C)=CC=C1 N14167 [0,2,0,0,0,0|2,0,0]=4 437 B13R1.20 CCCC(=O)CC1=CC=CC(Br)=C1 N14159 [0,2,0,0,0,0|1,1,0]=4 438 B13R1.20 CCCC(=O)CC1=CC=CC(Cl)=C1 N14151 [0,2,0,0,0,0|1,1,0]=4 439 B13R1.20 CCCC(=O)CC1=CC=CC(F)=C1 N14138 [0,2,0,0,0,0|1,0,0]=3 440 B13R1.20 CCC[C@H](N)CC1=CC(C)=CC=C1 N14537 [0,2,0,0,0,0|2,0,0]=4 441 B13R1.20 CCC[C@H](N)CC1=CC=CC(Br)=C1 N14533 [0,2,0,0,0,0|1,1,0]=4 442 B13R1.20 CCC[C@H](N)CC1=CC=CC(Cl)=C1 N14528 [0,2,0,0,0,0|1,1,0]=4 443 B13R1.20 CCC[C@H](N)CC1=CC=CC(F)=C1 N14525 [0,2,0,0,0,0|1,0,0]=3 444 B13R1.20 N#CCC(=O)CC1=CC=CC(F)=C1 93636 [0,2,0,0,0,0|2,0,0]=4 445 B13R1.55 CCCCOC1=CC(F)=CC(F)=C1 75697 [0,2,0,0,0,0|1,0,0]=3 446 B13R1.149 NC(=O)NCCC1=CC(O)=CC=C1 E72610 [0,2,0,0,0,0|1,0,1]=4 447 B13R1.666 CCCCOC1=CC=CC(C=O)=C1 S11902 [0,2,0,0,0,0|2,0,0]=4 448 B13R1.666 CCCNCC1=CC=CC(OC)=C1 C78449 [0,2,0,0,0,0|2,0,0]=4 449 B13R1.666 CNCCCC1=CC=CC(OC)=C1 C77751 [0,2,0,0,0,0|1,0,0]=3 450 B13R1.669 CNCCCC1=CC(F)=C(F)C=C1 C78235 [0,2,0,0,0,0|0,0,0]=2 451 B13R1.81 CC[C@H](N)CC1=CC=CC(OC)=C1 N14539 [0,2,0,0,0,0|2,0,0]=4 452 B13R1.148 CC(C)C(=O)CC1=CC=CC(F)=C1 N14140 [0,2,0,0,0,0|1,0,1]=4 453 B13R1.148 CC(C)[C@@H](N)CC1=CC=CC(Br)=C1 N14534 [0,2,0,0,0,0|1,1,0]=4 454 B13R1.148 CC(C)[C@@H](N)CC1=CC=CC(Cl)=C1 N14530 [0,2,0,0,0,0|1,1,0]=4 455 B13R1.148 CC(C)[C@@H](N)CC1=CC=CC(F)=C1 N14523 [0,2,0,0,0,0|1,0,0]=3 456 B13R1.148 O=C(O)[C@@H](O)CC1=CC=CC(F)=C1 AC5720 [0,2,0,0,0,0|2,0,0]=4 457 B13R1.2872 CCC(=O)CC1=C(F)C=CC(F)=C1 N14565 [0,2,0,0,0,0|1,0,1]=4 458 B13R1.2879 COC(=O)CC1=CC(F)=C(Br)C=C1 93739 [0,2,0,0,0,0|1,0,1]=4 459 B13R1.2879 N[C@H](CO)CC1=CC(F)=C(F)C=C1 C78060 [0,2,0,0,0,0|2,0,0]=4 460 B13R1.136 CCCCC1=CC(F)=C(O)C(F)=C1 36958 [0,2,0,0,0,0|1,0,0]=3 461 B13R1.3420 O=C(O)CCC1=CC(Br)=CC(F)=C1 F52879 [0,2,0,0,0,0|2,0,0]=4 462 B13R1.3420 O=C(O)CCC1=CC(Cl)=CC(F)=C1 F52875 [0,2,0,0,0,0|2,0,0]=4 463 B13R1.511 CC(=O)CCC1=CC(Cl)=C(Cl)C=C1 W12660 [0,2,0,0,0,0|1,1,0]=4 464 B13R1.511 O=C(O)CCC1=CC(F)=C(O)C=C1 F52917 [0,2,0,0,0,0|2,0,0]=4 465 B13R1.838 CC(C)(C)NCC1=CC=CC(F)=C1 C78591 [0,2,0,0,0,0|2,0,0]=4 466 B13R1.893 CC(C)OCC1=C(Br)C=CC(F)=C1 N10212 [0,2,0,0,0,0|2,0,0]=4 467 B13R1.893 CC1=C(CCC(=O)O)C=C(F)C=C1 F52899 [0,2,0,0,0,0|2,0,0]=4 468 B13R1.893 O=C(O)CCC1=C(F)C=CC(F)=C1 F52863 [0,2,0,0,0,0|2,0,0]=4 469 B13R1.568 CNCCC1=CC=CC(C(=O)O)=C1 CS3246 [0,2,0,0,0,0|1,0,0]=3 470 B13R1.568 CNCCC1=CC=CC(C(=O)O)=C1 CS3249 [0,2,0,0,0,0|1,0,0]=3 471 B11R1.81 CNCC1=C(Cl)C=C(F)C=C1 76695 [0,0,1,1,0,0|1,0,1]=4 472 B11R1.81 CNCC1=C(F)C=C(F)C=C1 36787 [0,0,1,1,0,0|1,0,1]=4 473 B11R1.605 CNCC1=C(F)C=CC=C1F 36785 [0,0,1,1,0,0|1,0,1]=4 474 B11R2.35 CC1=CC(C2CC2)=NC=C1 AC9117 [1,0,0,1,0,0|2,0,0]=4 475 B11R2.35 CC1=CC=CC(C2CC2)=C1 AC9451 [1,0,0,1,0,0|1,0,0]=3 476 B11R2.35 CC1=CC=CC(C2CC2)=N1 AC9039 [1,0,0,1,0,0|2,0,0]=4 477 B11R2.35 ClC1=CC(C2CC2)=CC=C1 97830 [1,0,0,1,0,0|0,1,0]=3 478 B11R2.35 NC1=CC(C2CC2)=CN=C1 S11509 [1,0,0,1,0,0|2,0,0]=4 479 B11R2.35 NC1=CC(C2CC2)=NC=C1 F52584 [1,0,0,1,0,0|2,0,0]=4 480 B11R2.35 NC1=NC(C2CC2)=CC=C1 AT24911 [1,0,0,1,0,0|2,0,0]=4 481 B11R2.35 OC1=CC(C2CC2)=CC=C1 97835 [1,0,0,1,0,0|1,0,0]=3 482 B11R2.35 OC1=CC(C2CC2)=NC=C1 55360 [1,0,0,1,0,0|2,0,0]=4 483 B11R2.36 CC1=CC2=C(C=C1)CNC2 71833 [1,0,0,1,0,0|1,0,0]=3 484 B11R2.36 CC1=CC2=C(C=C1)CNC2 W10108 [1,0,0,1,0,0|1,0,0]=3 485 B11R2.36 CC1=NC=C2CNCC2=C1 F17653 [1,0,0,1,0,0|2,0,0]=4 486 B11R2.36 CC1=NC=C2CNCC2=C1 S11542 [1,0,0,1,0,0|2,0,0]=4 487 B11R2.36 ClC1=CN=C2CNCC2=C1 F19783 [1,0,0,1,0,0|1,1,0]=4 488 B11R2.36 FC1=CC2=C(C=C1)CC=C2 N14223 [1,0,0,1,0,0|0,0,2]=4 489 B11R2.36 FC1=CC2=C(C=C1)CCC2 36515 [1,0,0,1,0,0|0,0,0]=2 490 B11R2.36 IC1=CC2=C(C=C1)CCC2 C12643 [1,0,0,1,0,0|0,1,0]=3 491 B11R2.36 IC1=CC2=C(C=C1)CNC2 32000 [1,0,0,1,0,0|0,1,0]=3 492 B11R2.36 NC1=CC2=C(C=C1)CNC2 SC4171 [1,0,0,1,0,0|1,0,0]=3 493 B11R2.36 NC1=CC2=C(C=C1)OCC2 88994 [1,0,0,1,0,0|2,0,0]=4 494 B11R2.36 NC1=CN=C2CCCC2=C1 F30816 [1,0,0,1,0,0|2,0,0]=4 495 B11R2.36 OC1=CN=C2CCCC2=C1 F30817 [1,0,0,1,0,0|2,0,0]=4 496 B11R2.36 OC1=NC2=C(C=C1)CCC2 20278 [1,0,0,1,0,0|2,0,0]=4 497 B11R2.106 BrC1=C2CCCC2=NC=C1 F53407 [1,0,0,1,0,0|1,1,0]=4 498 B11R2.106 BrC1=C2CCOC2=CC=C1 F12556 [1,0,0,1,0,0|1,1,0]=4 499 B11R2.106 BrC1=NC=CC2=C1CNC2 D97047 [1,0,0,1,0,0|1,1,0]=4 500 B11R2.106 CC1=CC=CC2=C1CNC2 W10109 [1,0,0,1,0,0|1,0,0]=3 501 B11R2.106 ClC1=C2CCCC2=CC=C1 N13077 [1,0,0,1,0,0|0,1,0]=3 502 B11R2.106 ClC1=C2CNCC2=CC=C1 FD13081 [1,0,0,1,0,0|0,1,0]=3 503 B11R2.106 ClC1=C2CNCC2=NC=C1 S11449 [1,0,0,1,0,0|1,1,0]=4 504 B11R2.106 ClC1=C2OCCC2=CC=C1 F53809 [1,0,0,1,0,0|1,1,0]=4 505 B11R2.106 FC1=C2NCCC2=CC=C1 C73504 [1,0,0,1,0,0|0,0,0]=2 506 B11R2.106 IC1=C2CCOC2=CC=C1 E72245 [1,0,0,1,0,0|1,1,0]=4 507 B11R2.1 C[C@H]1CNC2=C1C=CC=C2 W18948 [1,0,0,1,0,0|2,0,0]=4 508 B11R2.1 N[C@H]1CCC2=C1C=CC=C2 41003 [1,0,0,1,0,0|2,0,0]=4 509 B11R2.4 N[C@H]1C[C@@H]1C2=CC=CC=C2 C14923 [1,0,0,1,0,0|2,0,0]=4 510 B11R2.20 C1=CN=C2CNCCC2=C1 P10652 [1,0,0,1,0,0|1,0,0]=3 511 B11R2.20 C1=NC=C2CCNCC2=N1 P19161 [1,0,0,1,0,0|2,0,0]=4 512 B11R2.239 C1=CC(C2CNC2)=NC=N1 74669 [1,0,0,1,0,0|2,0,0]=4 513 B11R2.239 C1=CC=C(C2CCC2)C=C1 F52090 [1,0,0,1,0,0|1,0,0]=3 514 B11R2.239 C1=CC=C([C@@H]2CCN2)C=C1 A50749 [1,0,0,1,0,0|2,0,0]=4 515 B11R2.239 C1=CN=C(C2CNC2)C=C1 F31095 [1,0,0,1,0,0|1,0,0]=3 516 B11R2.988 NC[C@H]1CC2=C1C=CC=C2 AT20374 [1,0,0,1,0,0|2,0,0]=4 517 B11R2.988 OC[C@H]1CC2=C1C=CC=C2 67862 [1,0,0,1,0,0|2,0,0]=4 518 B11R2.10 NC1=CC2=C(CCNC2)S1 F18457 [0,0,0,1,1,0|2,0,0]=4 519 B13R2.13 CC1=CC=CC([C@H]2CCNC2)=C1 N11129 [0,1,0,1,0,0|1,0,0]=3 520 B13R2.13 ClC1=CC([C@H]2CCNC2)=CC=C1 65735 [0,1,0,1,0,0|0,1,0]=3 521 B13R2.13 ClC1=CC([C@H]2CCNC2)=CC=C1 65737 [0,1,0,1,0,0|0,1,0]=3 522 B13R2.13 ClC1=CC([C@H]2CCNC2)=CC=C1 65767 [0,1,0,1,0,0|0,1,0]=3 523 B13R2.13 ClC1=CC([C@H]2CCNC2)=CC=C1 N10839 [0,1,0,1,0,0|0,1,0]=3 524 B13R2.13 FC1=CC([C@H]2CCNC2)=CC=C1 65739 [0,1,0,1,0,0|0,0,0]=2 525 B13R2.13 FC1=CC([C@H]2CCNC2)=CC=C1 65741 [0,1,0,1,0,0|0,0,0]=2 526 B13R2.13 FC1=CC([C@H]2CCNC2)=CC=C1 N11081 [0,1,0,1,0,0|0,0,0]=2 527 B13R2.13 FC1=CN=CC([C@H]2CCNC2)=C1 C93388 [0,1,0,1,0,0|1,0,0]=3 528 B13R2.13 NC1=CC=CC([C@@H]2CCCN2)=C1 N14348 [0,1,0,1,0,0|2,0,0]=4 529 B13R2.13 OC1=CC([C@@H]2CCCN2)=CC=C1 I11612 [0,1,0,1,0,0|2,0,0]=4 530 B13R2.151 O=C1CC(C2=CC=CC(F)=C2)C1 91864 [0,1,0,1,0,0|1,0,0]=3 531 B13R2.151 O[C@H]1C[C@H](C2=CC=CC(Br)=C2)C1 91840 [0,1,0,1,0,0|1,1,0]=4 532 B13R2.151 O[C@H]1C[C@H](C2=CC=CC(F)=C2)C1 91841 [0,1,0,1,0,0|1,0,0]=3 533 B13R2.162 N[C@H]1CCCC2=C1C=C(F)C=C2 N11009 [0,1,0,1,0,0|1,0,0]=3 534 B13R2.162 N[C@H]1CCCC2=C1C=C(F)C=C2 N11074 [0,1,0,1,0,0|1,0,0]=3 535 B13R2.162 N[C@H]1CCCC2=C1C=C(F)C=C2 N13129 [0,1,0,1,0,0|1,0,0]=3 536 B13R2.162 N[C@H]1CSCC2=C1C=C(Br)C=C2 SC2421 [0,1,0,1,0,0|1,1,0]=4 537 B13R2.162 O=C1CCC2=CC=CC(F)=C2C1 Y10670 [0,1,0,1,0,0|1,0,0]=3 538 B13R2.162 OC1=CC2=C(C=C1)CNC[C@@H]2O C16747 [0,1,0,1,0,0|1,0,0]=3 539 B13R2.162 O[C@H]1CCCC2=C1C=C(Cl)C=C2 N13025 [0,1,0,1,0,0|1,1,0]=4 540 B13R2.162 O[C@H]1CCCC2=C1C=C(F)C=C2 N14444 [0,1,0,1,0,0|1,0,0]=3 541 B13R2.162 O[C@H]1CCOC2=C1C=C(F)C=C2 N14455 [0,1,0,1,0,0|2,0,0]=4 542 B13R2.342 N[C@H]1CCCC2=C(Br)C=CC=C21 F16889 [0,1,0,1,0,0|1,1,0]=4 543 B13R2.342 N[C@H]1CCCC2=C(Cl)C=CC=C21 I10729 [0,1,0,1,0,0|1,1,0]=4 544 B13R2.342 N[C@H]1CCCC2=C(O)C=CC=C21 N12814 [0,1,0,1,0,0|2,0,0]=4 545 B13R2.342 N[C@H]1CCOC2=C(F)C=CC=C21 N13139 [0,1,0,1,0,0|2,0,0]=4 546 B13R2.342 O[C@H]1CCCC2=C(Cl)C=CC=C21 N14445 [0,1,0,1,0,0|1,1,0]=4 547 B13R2.342 O[C@H]1CCCC2=C(F)C=CC=C21 E72763 [0,1,0,1,0,0|1,0,0]=3 548 B13R2.342 O[C@H]1CCOC2=C(F)C=CC=C21 N14453 [0,1,0,1,0,0|2,0,0]=4 549 B13R2.3018 CC1=CC=CC(C2(N)COC2)=C1 59772 [0,1,0,1,0,0|2,0,0]=4 550 B13R2.3018 NC1(C2=CC=CC(Cl)=C2)CNC1 59781 [0,1,0,1,0,0|0,1,0]=3 551 B13R2.3018 NC1(C2=CC=CC(F)=C2)CCC1 28206 [0,1,0,1,0,0|1,0,0]=3 552 B13R2.3018 NC1(C2=CC=CC(F)=C2)CCC1 69061 [0,1,0,1,0,0|1,0,0]=3 553 B13R2.3018 OC1(C2=CC=CC(Br)=C2)CNC1 AT12573 [0,1,0,1,0,0|0,1,0]=3 554 B13R2.5187 CN1N=C(I)C2=C1C=CC(F)=C2 78658 [0,1,0,1,0,0|1,0,1]=4 555 B13R2.32 FC1=C(Cl)C=CC2=C1CCNC2 84514 [0,1,0,1,0,0|0,1,0]=3 556 B13R2.32 FC1=C(F)C2=C(C=C1)CNCC2 AT19623 [0,1,0,1,0,0|0,0,0]=2 557 B13R2.32 FC1=C(F)C2=C(C=C1)CNCC2 AT19624 [0,1,0,1,0,0|0,0,0]=2 558 B13R2.4820 BrC1=C2NCCCCC2=CC=C1 AT10609 [0,1,0,1,0,0|1,1,0]=4 559 B13R2.5180 CC1=C(F)C=CC2=C1CCC2=O F52766 [0,1,0,1,0,0|2,0,0]=4 560 B13R2.5180 N[C@H]1CCC2=C1C=CC(F)=C2Br 94559 [0,1,0,1,0,0|2,0,0]=4 561 B13R2.5180 N[C@H]1CCC2=C1C=CC(F)=C2Br N13074 [0,1,0,1,0,0|2,0,0]=4 562 B13R2.5180 N[C@H]1CCC2=C1C=CC(F)=C2Cl N11355 [0,1,0,1,0,0|2,0,0]=4 563 B13R2.5180 O[C@H]1CCC2=C1C=CC(F)=C2F N14438 [0,1,0,1,0,0|2,0,0]=4 564 B13R2.3729 BrC1=CC2=C(C=C1)CCCNC2 D85465 [0,1,0,1,0,0|1,1,0]=4 565 B13R2.3729 BrC1=CC2=C(C=C1)CCCOC2 F52895 [0,1,0,1,0,0|1,1,0]=4 566 B13R2.3729 BrC1=CC2=C(C=C1)CNCCO2 AT22674 [0,1,0,1,0,0|0,1,0]=3 567 B13R2.3729 BrC1=CC2=C(C=C1)COCCO2 F53181 [0,1,0,1,0,0|1,1,0]=4 568 B13R2.3729 BrC1=CC2=C(C=C1)NCCCC2 AT10607 [0,1,0,1,0,0|1,1,0]=4 569 B13R2.3729 ClC1=NC2=C(C=C1)CCNCC2 P11147 [0,1,0,1,0,0|1,1,0]=4 570 B13R2.3729 FC1=CC2=C(C=C1)CCCNC2 51232 [0,1,0,1,0,0|1,0,0]=3 571 B13R2.3729 FC1=CC2=C(C=C1)NCCCO2 AT14831 [0,1,0,1,0,0|2,0,0]=4 572 B13R2.3729 FC1=CC2=C(C=C1)OCCNC2 AT16102 [0,1,0,1,0,0|2,0,0]=4 573 B13R2.3729 NC1=CC2=C(C=C1)CCCCN2 32131 [0,1,0,1,0,0|2,0,0]=4 574 B13R2.3729 OC1=CC2=C(C=C1)CCCNC2 C90439 [0,1,0,1,0,0|2,0,0]=4 575 B13R2.3729 OC1=CC2=C(C=C1)CCNCC2 85919 [0,1,0,1,0,0|1,0,0]=3 576 B13R2.3729 OC1=CC2=C(C=C1)CCNCC2 P20370 [0,1,0,1,0,0|1,0,0]=3 577 B13R2.4818 CN1CCCC2=CC=CC(O)=C21 P11599 [0,1,0,1,0,0|1,0,0]=3 578 B13R2.4818 CN1CCOC2=C1C(N)=CC=C2 AT20455 [0,1,0,1,0,0|1,0,0]=3 579 B13R2.4818 N[C@H]1CCOC2=CC=CC(F)=C21 D81550 [0,1,0,1,0,0|2,0,0]=4 580 B13R2.5179 C[C@@H]1NCCC2=C1C=CC(F)=C2 AT19619 [0,1,0,1,0,0|0,0,0]=2 581 B13R2.5179 C[C@@H]1NCCC2=C1C=CC(F)=C2 AT19620 [0,1,0,1,0,0|0,0,0]=2 582 B13R2.5179 NC1=CC2=C(C=C1)C(=O)NCC2 CS1458 [0,1,0,1,0,0|1,0,1]=4 583 B13R2.5179 NC1=CC2=C(C=C1)[C@@H](O)CCC2 S11524 [0,1,0,1,0,0|2,0,0]=4 584 B13R2.5179 N[C@H]1CCCC2=C1C=CC(F)=C2 N12720 [0,1,0,1,0,0|1,0,0]=3 585 B13R2.5179 N[C@H]1CCCC2=C1C=CC(I)=C2 W15956 [0,1,0,1,0,0|1,1,0]=4 586 B13R2.5179 N[C@H]1CCCC2=C1C=CC(O)=C2 N13166 [0,1,0,1,0,0|2,0,0]=4 587 B13R2.5179 N[C@H]1CCOC2=C1C=CC(F)=C2 I11337 [0,1,0,1,0,0|2,0,0]=4 588 B13R2.5179 N[C@H]1CCOC2=C1C=CC(F)=C2 N13088 [0,1,0,1,0,0|2,0,0]=4 589 B13R2.5179 O=C1CCNC2=C1C=CC(F)=C2 N12843 [0,1,0,1,0,0|2,0,0]=4 590 B13R2.5179 O[C@H]1CCCC2=C1C=CC(Cl)=C2 N14446 [0,1,0,1,0,0|1,1,0]=4 591 B13R2.5179 O[C@H]1CCOC2=C1C=CC(F)=C2 N14454 [0,1,0,1,0,0|2,0,0]=4 592 B13R2.5331 FC1=CC(OC[C@H]2CO2)=CC=C1 28186 [0,1,0,1,0,0|1,0,0]=3 593 B13R2.155 C[C@H]1CC2=C(C=CC(F)=C2)CN1 AT19622 [0,1,0,1,0,0|0,0,0]=2 594 B13R2.155 C[C@H]1CC2=C(C=CC(N)=C2)CN1 F13589 [0,1,0,1,0,0|1,0,0]=3 595 B13R2.155 NC1=CC2=C(C=C1)CC[C@H](O)C2 94668 [0,1,0,1,0,0|2,0,0]=4 596 B13R2.155 O[C@H]1CCC2=C(C=C(Br)C=C2)C1 94667 [0,1,0,1,0,0|1,1,0]=4 597 B13R2.4856 C[C@H]1CC2=CC=CC(F)=C2C1=O N14228 [0,1,0,1,0,0|2,0,0]=4 598 B13R2.5190 CN1C(N)=NC2=C1C=CC(F)=C2 AC3040 [0,1,0,1,0,0|1,0,1]=4 599 B13R2.140 ClC1=CC(C2CNC2)=CC(Cl)=N1 91953 [0,1,0,1,0,0|1,1,0]=4 600 B13R2.328 CC1=CC(F)=CC2=C1CNCC2 AT19621 [0,1,0,1,0,0|0,0,0]=2 601 B13R2.328 CC1=CC(O)=CC2=C1CNCC2 E71293 [0,1,0,1,0,0|1,0,0]=3 602 B13R2.328 FC1=C2CNCCC2=CC(Br)=C1 90660 [0,1,0,1,0,0|0,0,0]=2 603 B13R2.328 FC1=CC(F)=C2CNCCC2=C1 AT19600 [0,1,0,1,0,0|0,0,0]=2 604 B13R2.328 FC1=CC(F)=C2NCCCC2=C1 N12715 [0,1,0,1,0,0|2,0,0]=4 605 B13R2.11642 CC1=C2C(=O)CCC2=CC(F)=C1 F52771 [0,1,0,1,0,0|2,0,0]=4 606 B13R2.11642 CC1=CC(F)=C2C(=O)CCC2=C1 C14522 [0,1,0,1,0,0|2,0,0]=4 607 B13R2.11642 N[C@H]1CCC2=CC(Br)=CC(F)=C21 67307 [0,1,0,1,0,0|2,0,0]=4 608 B13R2.11642 N[C@H]1CCC2=CC(F)=CC(F)=C21 N10998 [0,1,0,1,0,0|2,0,0]=4 609 B13R2.11642 O[C@H]1CCC2=CC(F)=CC(F)=C21 N14441 [0,1,0,1,0,0|2,0,0]=4 610 B13R2.3108 CC1(C)CNC2=C1C=CC(F)=C2 85439 [0,1,0,1,0,0|2,0,0]=4 611 B13R2.3683 CN1CCC2=C(C=CC(Br)=C2)C1 98419 [0,1,0,1,0,0|0,1,0]=3 612 B13R2.3683 C[C@H]1CCC2=C(C=CC(F)=C2)N1 51483 [0,1,0,1,0,0|1,0,0]=3 613 B13R2.3683 C[C@H]1CCC2=C(C=CC(F)=C2)N1 51485 [0,1,0,1,0,0|1,0,0]=3 614 B13R2.175 NC1=C(NC2CC2)C=C(F)C=C1 AT23052 [0,1,0,1,0,0|2,0,0]=4 615 B13R2.371 ClC1=C2CNCCC2=C(Br)C=C1 33428 [0,1,0,1,0,0|0,1,0]=3 616 B13R2.371 NC1=C2NCCCC2=C(F)C=C1 81007 [0,1,0,1,0,0|2,0,0]=4 617 B13R2.5151 N[C@H]1CCC2=C(Br)C=CC(F)=C21 94568 [0,1,0,1,0,0|2,0,0]=4 618 B13R2.5151 O[C@H]1CCC2=C(F)C=CC(F)=C21 N13001 [0,1,0,1,0,0|2,0,0]=4 619 B13R2.57 COC1=CC2=C(C=C1)COCC2 N14608 [0,1,0,1,0,0|2,0,0]=4 620 B13R2.57 O=CC1=CC2=C(C=C1)COCC2 94695 [0,1,0,1,0,0|2,0,0]=4 621 B13R2.57 OCC1=CC2=C(C=C1)CNCC2 W14964 [0,1,0,1,0,0|1,0,0]=3 622 B13R2.1613 N#CC1=C2CNCCC2=CC=C1 P11020 [0,1,0,1,0,0|1,0,0]=3 623 B13R2.369 FC1=C(F)C=C2NCCCC2=C1 53384 [0,1,0,1,0,0|2,0,0]=4 624 B13R2.369 NC1=C(F)C=C2NCCCC2=C1 F13947 [0,1,0,1,0,0|2,0,0]=4 625 B13R2.521 FC1=C(Br)C=CC(SC2CC2)=C1 89759 [0,1,0,1,0,0|2,0,0]=4 626 B13R2.522 NC1CC1C2=CC(F)=C(F)C=C2 W15098 [0,1,0,1,0,0|2,0,0]=4 627 B13R2.522 N[C@H]1C[C@H]1C2=CC(F)=C(F)C=C2 F19424 [0,1,0,1,0,0|2,0,0]=4 628 B13R2.3790 CN1C=CC2=C1C(F)=C(Br)C=C2 89411 [0,1,0,1,0,0|0,0,2]=4 629 B13R2.3790 N[C@H]1CCC2=C1C(F)=C(Br)C=C2 94562 [0,1,0,1,0,0|2,0,0]=4 630 B13R2.3790 O=C1CCC2=C1C(F)=C(Br)C=C2 94563 [0,1,0,1,0,0|2,0,0]=4 631 B13R2.3790 O=C1CCC2=C1C(F)=C(F)C=C2 C16578 [0,1,0,1,0,0|2,0,0]=4 632 B13R2.3790 O[C@H]1CCC2=C1C(F)=C(Br)C=C2 94564 [0,1,0,1,0,0|2,0,0]=4 633 B13R2.11634 CC1=C(F)C=C2CCC(=O)C2=C1 F52770 [0,1,0,1,0,0|2,0,0]=4 634 B13R2.11634 CC1=C(F)C=C2CC[C@H](N)C2=C1 N11184 [0,1,0,1,0,0|2,0,0]=4 635 B13R2.11634 N[C@H]1CCC2=CC(F)=C(Br)C=C21 94566 [0,1,0,1,0,0|2,0,0]=4 636 B13R2.11634 N[C@H]1CCC2=CC(F)=C(Br)C=C21 N11346 [0,1,0,1,0,0|2,0,0]=4 637 B13R2.11634 N[C@H]1CCC2=CC(F)=C(Br)C=C21 N11352 [0,1,0,1,0,0|2,0,0]=4 638 B13R2.11634 N[C@H]1CCC2=CC(F)=C(Cl)C=C21 N11356 [0,1,0,1,0,0|2,0,0]=4 639 B13R2.11634 N[C@H]1CCC2=CC(F)=C(Cl)C=C21 Y12524 [0,1,0,1,0,0|2,0,0]=4 640 B13R2.11634 N[C@H]1CCC2=CC(F)=C(Cl)C=C21 Y12525 [0,1,0,1,0,0|2,0,0]=4 641 B13R2.11634 N[C@H]1CCC2=CC(F)=C(F)C=C21 N10993 [0,1,0,1,0,0|2,0,0]=4 642 B13R2.11634 O[C@H]1CCC2=CC(F)=C(Br)C=C21 94565 [0,1,0,1,0,0|2,0,0]=4 643 B13R2.11634 O[C@H]1CCC2=CC(F)=C(F)C=C21 N14439 [0,1,0,1,0,0|2,0,0]=4 644 B9R1.7 CC1=CC=C(CCN)S1 31616 [1,0,0,0,1,0|2,0,0]=4 645 B9R1.7 CC1=CSC(CCN)=C1 96997 [1,0,0,0,1,0|2,0,0]=4 646 B9R1.7 CNCC1=CC=C(C)S1 75578 [1,0,0,0,1,0|2,0,0]=4 647 B9R1.7 CNCC1=CNC(Br)=C1 F13038 [1,0,0,0,1,0|1,1,0]=4 648 B9R1.12 CNCCC1=CC=CS1 AT16732 [1,0,0,0,1,0|1,0,0]=3 649 B9R1.12 CNCCC1=CN=CN1 D86292 [1,0,0,0,1,0|2,0,0]=4