0 B11R1.16 BrCCC(Br)c1ccccc1 Amb23456167 [0,0,0,0,0,0|3,0,1]=4 1 B11R1.16 C#CCC(=O)c1ccccc1 Amb27794052 [0,0,0,0,0,0|1,0,2]=3 2 B11R1.16 C#CCC(=O)c1cccnc1 Amb26066447 [0,0,0,0,0,0|2,0,2]=4 3 B11R1.16 C#COC(=O)c1ccccc1 Amb25084221 [0,0,0,0,0,0|0,0,2]=2 4 B11R1.16 C=C(CCBr)c1ccccc1 Amb27646402 [0,0,0,0,0,0|3,0,0]=3 5 B11R1.16 C=C(CCC)c1ccccc1 Amb24669524 [0,0,0,0,0,0|2,0,0]=2 6 B11R1.16 C=C(CCCl)c1ccccc1 Amb28120007 [0,0,0,0,0,0|3,0,0]=3 7 B11R1.16 C=C(CCN)c1ccccc1 Amb32953172 [0,0,0,0,0,0|3,0,0]=3 8 B11R1.16 C=C(CCN)c1ccccn1 Amb33360278 [0,0,0,0,0,0|4,0,0]=4 9 B11R1.16 C=C(CCN)c1cccnc1 Amb33360412 [0,0,0,0,0,0|4,0,0]=4 10 B11R1.16 C=C(CCN)c1ccncc1 Amb33380624 [0,0,0,0,0,0|4,0,0]=4 11 B11R1.16 C=C(CNN)c1ccccc1 Amb27956116 [0,0,0,0,0,0|4,0,0]=4 12 B11R1.16 C=C(COC)c1ccccc1 Amb28188323 [0,0,0,0,0,0|3,0,0]=3 13 B11R1.16 C=C(N=[N+]=[N-])c1ccccc1 Amb27863728 [0,0,0,0,0,0|4,0,0]=4 14 B11R1.16 C=C(NC=O)c1ccccc1 Amb28046518 [0,0,0,0,0,0|3,0,1]=4 15 B11R1.16 C=C(OCC)c1cccnn1 Amb27789484 [0,0,0,0,0,0|3,0,0]=3 16 B11R1.16 C=C(OCC)c1ncccn1 Amb24533755 [0,0,0,0,0,0|3,0,0]=3 17 B11R1.16 C=CCC(=O)c1ccccc1 Amb17334260 [0,0,0,0,0,0|1,0,2]=3 18 B11R1.16 C=CCC(=O)c1ccccn1 Amb17334265 [0,0,0,0,0,0|2,0,2]=4 19 B11R1.16 C=CCC(=O)c1cccnc1 Amb17334267 [0,0,0,0,0,0|2,0,2]=4 20 B11R1.16 C=CCC(=O)c1ccncc1 Amb17334269 [0,0,0,0,0,0|2,0,2]=4 21 B11R1.16 C=CCS(=O)c1ccccc1 Amb17933936 [0,0,0,0,0,0|2,0,2]=4 22 B11R1.16 C=CNC(=O)c1ccncc1 Amb27170598 [0,0,0,0,0,0|2,0,2]=4 23 B11R1.16 C=COC(=O)c1ccccc1 Amb10807409 [0,0,0,0,0,0|0,0,2]=2 24 B11R1.16 C=COC(C)c1ccccc1 Amb22522122 [0,0,0,0,0,0|1,0,3]=4 25 B11R1.16 C=C\C=C(\N)c1ccccc1 Amb26578846 [0,0,0,0,0,0|2,0,2]=4 26 B11R1.16 C=NNC(=O)c1ccncc1 Amb4034434 [0,0,0,0,0,0|3,0,1]=4 27 B11R1.16 CC#CC(=O)c1ccccc1 Amb17593622 [0,0,0,0,0,0|1,0,1]=2 28 B11R1.16 CC#CC(Cl)c1ccccc1 Amb28365466 [0,0,0,0,0,0|2,0,2]=4 29 B11R1.16 CC#C[C@H](O)c1ccccc1 Amb27981913 [0,0,0,0,0,0|1,0,3]=4 30 B11R1.16 CC(CCBr)c1ccccc1 Amb857802 [0,0,0,0,0,0|3,0,1]=4 31 B11R1.16 CC(CCCl)c1ccccc1 Amb17232691 [0,0,0,0,0,0|3,0,1]=4 32 B11R1.16 CC(CCN)c1ccccc1 Amb17991256 [0,0,0,0,0,0|3,0,1]=4 33 B11R1.16 CC(CCN)c1ccccc1 Amb5739006 [0,0,0,0,0,0|3,0,1]=4 34 B11R1.16 CC(CCO)c1ccccc1 Amb3938966 [0,0,0,0,0,0|3,0,1]=4 35 B11R1.16 CC(CCS)c1ccccc1 Amb25866017 [0,0,0,0,0,0|3,0,1]=4 36 B11R1.16 CC(NCO)c1ccccc1 Amb27403352 [0,0,0,0,0,0|3,0,1]=4 37 B11R1.16 CC(OC=O)c1ccccc1 Amb22735162 [0,0,0,0,0,0|2,0,2]=4 38 B11R1.16 CC(OCCl)c1ccccc1 Amb27852517 [0,0,0,0,0,0|2,0,1]=3 39 B11R1.16 CCCC(=O)c1ccccc1 Amb4605997 [0,0,0,0,0,0|1,0,0]=1 40 B11R1.16 CCCC(=O)c1ccccn1 Amb6301471 [0,0,0,0,0,0|2,0,0]=2 41 B11R1.16 CCCC(=O)c1cccnc1 Amb17232054 [0,0,0,0,0,0|2,0,0]=2 42 B11R1.16 CCCC(=O)c1cccnn1 Amb28285831 [0,0,0,0,0,0|3,0,0]=3 43 B11R1.16 CCCC(=O)c1ccncc1 Amb22235246 [0,0,0,0,0,0|2,0,0]=2 44 B11R1.16 CCCC(=O)c1ccncn1 Amb26417226 [0,0,0,0,0,0|3,0,0]=3 45 B11R1.16 CCCC(=O)c1cncnc1 Amb18182735 [0,0,0,0,0,0|3,0,0]=3 46 B11R1.16 CCCC(=O)c1ncccn1 Amb18179375 [0,0,0,0,0,0|3,0,0]=3 47 B11R1.16 CCCC(Br)c1ccccc1 Amb8835450 [0,0,0,0,0,0|2,0,1]=3 48 B11R1.16 CCCC(Br)c1ccccn1 Amb25675709 [0,0,0,0,0,0|3,0,1]=4 49 B11R1.16 CCCC(C)c1ccccc1 Amb4017935 [0,0,0,0,0,0|2,0,1]=3 50 B11R1.16 CCCC(Cl)c1ccccc1 Amb7766848 [0,0,0,0,0,0|2,0,1]=3 51 B11R1.16 CCCC(N)c1ccccc1 Amb8503301 [0,0,0,0,0,0|2,0,1]=3 52 B11R1.16 CCCC(N)c1ccccc1 Amb9729508 [0,0,0,0,0,0|2,0,1]=3 53 B11R1.16 CCCC(N)c1ccccn1 Amb18984959 [0,0,0,0,0,0|3,0,1]=4 54 B11R1.16 CCCC(N)c1cccnc1 Amb18984960 [0,0,0,0,0,0|3,0,1]=4 55 B11R1.16 CCCC(N)c1ccncc1 Amb18984961 [0,0,0,0,0,0|3,0,1]=4 56 B11R1.16 CCCC(N)c1ccncc1 Amb30982091 [0,0,0,0,0,0|3,0,1]=4 57 B11R1.16 CCCC(O)c1ccccc1 Amb9748221 [0,0,0,0,0,0|1,0,2]=3 58 B11R1.16 CCCC(O)c1ccccn1 Amb18179397 [0,0,0,0,0,0|2,0,2]=4 59 B11R1.16 CCCC(O)c1cccnc1 Amb17232090 [0,0,0,0,0,0|2,0,2]=4 60 B11R1.16 CCCC(S)c1ccccc1 Amb9208055 [0,0,0,0,0,0|1,1,1]=3 61 B11R1.16 CCCN(C)c1ccccc1 Amb27176635 [0,0,0,0,0,0|3,0,0]=3 62 B11R1.16 CCCN(C)c1ccncc1 Amb27176636 [0,0,0,0,0,0|4,0,0]=4 63 B11R1.16 CCCS(=O)c1ccccc1 Amb4013577 [0,0,0,0,0,0|2,0,0]=2 64 B11R1.16 CCC[C@@H](N)c1ccccc1 Amb16233791 [0,0,0,0,0,0|2,0,1]=3 65 B11R1.16 CCC[C@@H](N)c1ccccc1 Amb22388605 [0,0,0,0,0,0|2,0,1]=3 66 B11R1.16 CCC[C@@H](O)c1cccnc1 Amb28069903 [0,0,0,0,0,0|2,0,2]=4 67 B11R1.16 CCC[C@H](N)c1ccccc1 Amb20241164 [0,0,0,0,0,0|2,0,1]=3 68 B11R1.16 CCC[C@H](N)c1ccccc1 Amb23385315 [0,0,0,0,0,0|2,0,1]=3 69 B11R1.16 CCC[C@H](O)c1ccccc1 Amb22338698 [0,0,0,0,0,0|1,0,2]=3 70 B11R1.16 CCNC(=N)c1ccccn1 Amb27213074 [0,0,0,0,0,0|3,0,0]=3 71 B11R1.16 CCNC(=N)c1cnccn1 Amb24477665 [0,0,0,0,0,0|4,0,0]=4 72 B11R1.16 CCNC(=N)c1cncnc1 Amb28345966 [0,0,0,0,0,0|4,0,0]=4 73 B11R1.16 CCNC(=O)c1ccccc1 Amb6871002 [0,0,0,0,0,0|1,0,0]=1 74 B11R1.16 CCNC(=O)c1ccccn1 Amb8439146 [0,0,0,0,0,0|2,0,0]=2 75 B11R1.16 CCNC(=O)c1ccnnc1 Amb27823464 [0,0,0,0,0,0|3,0,0]=3 76 B11R1.16 CCNC(=S)c1ccccc1 Amb27848073 [0,0,0,0,0,0|1,1,0]=2 77 B11R1.16 CCNC(C)c1ccccc1 Amb1771733 [0,0,0,0,0,0|2,0,1]=3 78 B11R1.16 CCNC(C)c1ccccc1 Amb6537886 [0,0,0,0,0,0|2,0,1]=3 79 B11R1.16 CCNC(C)c1cccnc1 Amb9726977 [0,0,0,0,0,0|3,0,1]=4 80 B11R1.16 CCNC(C)c1ccncc1 Amb33548282 [0,0,0,0,0,0|3,0,1]=4 81 B11R1.16 CCNC(C)c1ccncc1 Amb6272006 [0,0,0,0,0,0|3,0,1]=4 82 B11R1.16 CCNS(=O)c1ccccc1 Amb27261568 [0,0,0,0,0,0|2,0,0]=2 83 B11R1.16 CCN[C@@H](C)c1ccccc1 Amb27175162 [0,0,0,0,0,0|2,0,1]=3 84 B11R1.16 CCN[C@H](C)c1ccccn1 Amb28249175 [0,0,0,0,0,0|3,0,1]=4 85 B11R1.16 CCOC(=N)c1ccccc1 Amb17666955 [0,0,0,0,0,0|1,0,0]=1 86 B11R1.16 CCOC(=N)c1ccccc1 Amb33527262 [0,0,0,0,0,0|1,0,0]=1 87 B11R1.16 CCOC(=N)c1cccnc1 Amb18179379 [0,0,0,0,0,0|2,0,0]=2 88 B11R1.16 CCOC(=N)c1ccncc1 Amb18179378 [0,0,0,0,0,0|2,0,0]=2 89 B11R1.16 CCOC(=N)c1cnccn1 Amb29847909 [0,0,0,0,0,0|3,0,0]=3 90 B11R1.16 CCOC(=N)c1cncnc1 Amb27246849 [0,0,0,0,0,0|3,0,0]=3 91 B11R1.16 CCOC(=O)C1=CC=CCC1 Amb32644787 [0,0,0,0,0,0|0,0,2]=2 92 B11R1.16 CCOC(=O)C1=CCCCC1 Amb24612358 [0,0,0,0,0,0|0,0,4]=4 93 B11R1.16 CCOC(=O)C1=CCCCN1 Amb24061335 [0,0,0,0,0,0|1,0,3]=4 94 B11R1.16 CCOC(=O)C1=CCCCO1 Amb25711566 [0,0,0,0,0,0|1,0,3]=4 95 B11R1.16 CCOC(=O)C1=CCCNC1 Amb24117865 [0,0,0,0,0,0|1,0,3]=4 96 B11R1.16 CCOC(=O)C1=CCCNC1 Amb25726082 [0,0,0,0,0,0|1,0,3]=4 97 B11R1.16 CCOC(=O)C1=CCCOC1 Amb24178914 [0,0,0,0,0,0|1,0,3]=4 98 B11R1.16 CCOC(=O)C1=CNCCS1 Amb27878378 [0,0,0,0,0,0|2,0,2]=4 99 B11R1.16 CCOC(=O)C1=CSCCN1 Amb28119907 [0,0,0,0,0,0|2,0,2]=4 100 B11R1.16 CCOC(=O)C1C=CCCC1 Amb26317877 [0,0,0,0,0,0|0,0,4]=4 101 B11R1.16 CCOC(=O)C1C=CCNC1 Amb35751603 [0,0,0,0,0,0|1,0,3]=4 102 B11R1.16 CCOC(=O)C1C=CCNC1 Amb35751861 [0,0,0,0,0,0|1,0,3]=4 103 B11R1.16 CCOC(=O)C1CC=CCC1 Amb16230893 [0,0,0,0,0,0|0,0,4]=4 104 B11R1.16 CCOC(=O)C1CC=CCN1 Amb27591609 [0,0,0,0,0,0|1,0,3]=4 105 B11R1.16 CCOC(=O)C1CCC=CO1 Amb23439138 [0,0,0,0,0,0|1,0,3]=4 106 B11R1.16 CCOC(=O)N1C=CCCC1 Amb24667994 [0,0,0,0,0,0|1,0,3]=4 107 B11R1.16 CCOC(=O)N1CC=CCC1 Amb27864892 [0,0,0,0,0,0|1,0,3]=4 108 B11R1.16 CCOC(=O)[C@H]1CC=CCO1 Amb27449816 [0,0,0,0,0,0|1,0,3]=4 109 B11R1.16 CCOC(=O)c1ccccc1 Amb4302705 [0,0,0,0,0,0|0,0,0]=0 110 B11R1.16 CCOC(=O)c1ccccn1 Amb3940414 [0,0,0,0,0,0|1,0,0]=1 111 B11R1.16 CCOC(=O)c1cccnc1 Amb3940120 [0,0,0,0,0,0|1,0,0]=1 112 B11R1.16 CCOC(=O)c1ccncc1 Amb1210124 [0,0,0,0,0,0|1,0,0]=1 113 B11R1.16 CCOC(=O)c1ccncc1 Amb33140921 [0,0,0,0,0,0|1,0,0]=1 114 B11R1.16 CCOC(=O)c1ccncn1 Amb8383933 [0,0,0,0,0,0|2,0,0]=2 115 B11R1.16 CCOC(=O)c1ccnnc1 Amb8383938 [0,0,0,0,0,0|2,0,0]=2 116 B11R1.16 CCOC(=O)c1cnccn1 Amb8428068 [0,0,0,0,0,0|2,0,0]=2 117 B11R1.16 CCOC(=O)c1cncnc1 Amb8439525 [0,0,0,0,0,0|2,0,0]=2 118 B11R1.16 CCOC(=O)c1ncccn1 Amb19930079 [0,0,0,0,0,0|2,0,0]=2 119 B11R1.16 CCOC(=O)c1nccnn1 Amb10604457 [0,0,0,0,0,0|3,0,0]=3 120 B11R1.16 CCOC(=[NH2+])c1ccccc1 Amb5720188 [0,0,0,0,0,0|1,0,0]=1 121 B11R1.16 CCOC(C)c1ccccc1 Amb17940188 [0,0,0,0,0,0|1,0,1]=2 122 B11R1.16 CCOC(O)c1ccccc1 Amb27399654 [0,0,0,0,0,0|0,0,2]=2 123 B11R1.16 CCOC(O)c1ccncc1 Amb28321304 [0,0,0,0,0,0|1,0,2]=3 124 B11R1.16 CCON(C)c1ccccc1 Amb27234596 [0,0,0,0,0,0|2,0,0]=2 125 B11R1.16 CCO[PH](=O)c1ccccc1 Amb10601587 [0,0,0,0,0,0|1,0,0]=1 126 B11R1.16 CCSC(=O)c1ccccc1 Amb27828652 [0,0,0,0,0,0|0,1,0]=1 127 B11R1.16 CCSC(C)c1ccccc1 Amb28145240 [0,0,0,0,0,0|1,1,1]=3 128 B11R1.16 CC\C=C(/C)c1ccccc1 Amb25151168 [0,0,0,0,0,0|2,0,0]=2 129 B11R1.16 CC\C=C(\C)c1ccccc1 Amb27445109 [0,0,0,0,0,0|2,0,0]=2 130 B11R1.16 CC\N=C(/N)c1cccnc1 Amb21970333 [0,0,0,0,0,0|3,0,0]=3 131 B11R1.16 CC\[S+]=C(/N)c1ccccc1 Amb27236829 [0,0,0,0,0,0|1,1,0]=2 132 B11R1.16 CN(CCBr)c1ccccc1 Amb24477466 [0,0,0,0,0,0|4,0,0]=4 133 B11R1.16 CN(CCCl)c1ccccc1 Amb17334788 [0,0,0,0,0,0|4,0,0]=4 134 B11R1.16 CN(CCI)c1ccccc1 Amb28138218 [0,0,0,0,0,0|4,0,0]=4 135 B11R1.16 CN(CCN)c1ccccc1 Amb13949227 [0,0,0,0,0,0|4,0,0]=4 136 B11R1.16 CN(CCN)c1ccccc1 Amb2371516 [0,0,0,0,0,0|4,0,0]=4 137 B11R1.16 CN(CCN)c1ccccc1 Amb59983 [0,0,0,0,0,0|4,0,0]=4 138 B11R1.16 CN(CCO)c1ccccc1 Amb2720819 [0,0,0,0,0,0|4,0,0]=4 139 B11R1.16 CN(CCS)c1ccccc1 Amb13881732 [0,0,0,0,0,0|4,0,0]=4 140 B11R1.16 CNCC(=O)c1ccccc1 Amb577810 [0,0,0,0,0,0|2,0,0]=2 141 B11R1.16 CNCC(=O)c1ccccn1 Amb31094252 [0,0,0,0,0,0|3,0,0]=3 142 B11R1.16 CNCC(=O)c1cccnc1 Amb27146952 [0,0,0,0,0,0|3,0,0]=3 143 B11R1.16 CNCC(=O)c1ccncc1 Amb31094250 [0,0,0,0,0,0|3,0,0]=3 144 B11R1.16 CNCC(=O)c1ccncn1 Amb33269066 [0,0,0,0,0,0|4,0,0]=4 145 B11R1.16 CNCC(=O)c1cnccn1 Amb21862013 [0,0,0,0,0,0|4,0,0]=4 146 B11R1.16 CNCC(=O)c1cncnc1 Amb26505058 [0,0,0,0,0,0|4,0,0]=4 147 B11R1.16 CNCC(=O)c1ncccn1 Amb18201675 [0,0,0,0,0,0|4,0,0]=4 148 B11R1.16 CNCC(C)c1ccccc1 Amb17619365 [0,0,0,0,0,0|3,0,1]=4 149 B11R1.16 CNCC(C)c1ccccc1 Amb6355911 [0,0,0,0,0,0|3,0,1]=4 150 B11R1.16 CNCC(F)c1ccccc1 Amb24710254 [0,0,0,0,0,0|3,0,1]=4 151 B11R1.16 CNCC(N)c1ccccc1 Amb18290185 [0,0,0,0,0,0|3,0,1]=4 152 B11R1.16 CNCC(O)c1ccccc1 Amb32405137 [0,0,0,0,0,0|2,0,2]=4 153 B11R1.16 CNCC(O)c1ccccc1 Amb3939362 [0,0,0,0,0,0|2,0,2]=4 154 B11R1.16 CNC[C@@H](C)c1ccccc1 Amb27253876 [0,0,0,0,0,0|3,0,1]=4 155 B11R1.16 CNNC(=N)c1cccnc1 Amb25690466 [0,0,0,0,0,0|4,0,0]=4 156 B11R1.16 CNNC(=O)c1ccncc1 Amb28434923 [0,0,0,0,0,0|3,0,0]=3 157 B11R1.16 CNNC(=O)c1ncccn1 Amb22749170 [0,0,0,0,0,0|4,0,0]=4 158 B11R1.16 CNOC(=O)c1ccccc1 Amb25240574 [0,0,0,0,0,0|1,0,0]=1 159 B11R1.16 CN\C=C(\C)c1ccccc1 Amb27468700 [0,0,0,0,0,0|3,0,0]=3 160 B11R1.16 CN\N=C(/N)c1ccccc1 Amb20623020 [0,0,0,0,0,0|3,0,0]=3 161 B11R1.16 CN\N=C(\C)c1ccncc1 Amb25129259 [0,0,0,0,0,0|4,0,0]=4 162 B11R1.16 COCC(=O)c1ccccc1 Amb4605981 [0,0,0,0,0,0|2,0,0]=2 163 B11R1.16 COCC(=O)c1ccccn1 Amb10607921 [0,0,0,0,0,0|3,0,0]=3 164 B11R1.16 COCC(=O)c1cnccn1 Amb27973329 [0,0,0,0,0,0|4,0,0]=4 165 B11R1.16 COCC(=O)c1ncccn1 Amb27883002 [0,0,0,0,0,0|4,0,0]=4 166 B11R1.16 COCC(Br)c1ccccc1 Amb27797279 [0,0,0,0,0,0|3,0,1]=4 167 B11R1.16 COCC(N)c1ccccc1 Amb1134749 [0,0,0,0,0,0|3,0,1]=4 168 B11R1.16 COCC(N)c1ccccc1 Amb13952604 [0,0,0,0,0,0|3,0,1]=4 169 B11R1.16 COCC(O)c1ccccc1 Amb18791504 [0,0,0,0,0,0|2,0,2]=4 170 B11R1.16 COCC(S)c1ccccc1 Amb25698414 [0,0,0,0,0,0|2,1,1]=4 171 B11R1.16 COC[C@@H](N)c1ccccc1 Amb17061641 [0,0,0,0,0,0|3,0,1]=4 172 B11R1.16 COC[C@H](N)c1ccccc1 Amb22737495 [0,0,0,0,0,0|3,0,1]=4 173 B11R1.16 COC[C@H](O)c1ccccc1 Amb27410269 [0,0,0,0,0,0|2,0,2]=4 174 B11R1.16 CONC(=O)c1ccccc1 Amb16969913 [0,0,0,0,0,0|2,0,0]=2 175 B11R1.16 CONC(=O)c1cncnc1 Amb28314753 [0,0,0,0,0,0|4,0,0]=4 176 B11R1.16 CONC(C)c1ccccc1 Amb22896960 [0,0,0,0,0,0|3,0,1]=4 177 B11R1.16 CO\N=C(/N)c1ccccc1 Amb18224270 [0,0,0,0,0,0|3,0,0]=3 178 B11R1.16 CO\N=C(/N)c1ccccn1 Amb18224284 [0,0,0,0,0,0|4,0,0]=4 179 B11R1.16 CO\N=C(/N)c1cccnc1 Amb18224285 [0,0,0,0,0,0|4,0,0]=4 180 B11R1.16 CO\N=C(/N)c1ccncc1 Amb18224286 [0,0,0,0,0,0|4,0,0]=4 181 B11R1.16 CP(CCCl)c1ccccc1 Amb28239778 [0,0,0,0,0,0|4,0,0]=4 182 B11R1.16 CSCC(=O)c1ccccc1 Amb4034487 [0,0,0,0,0,0|2,0,0]=2 183 B11R1.16 CSCC(=O)c1cncnc1 Amb18182678 [0,0,0,0,0,0|4,0,0]=4 184 B11R1.16 CSCC(Cl)c1ccccc1 Amb27272993 [0,0,0,0,0,0|3,0,1]=4 185 B11R1.16 CSCC(N)c1ccccc1 Amb18300065 [0,0,0,0,0,0|3,0,1]=4 186 B11R1.16 CSCC(O)c1ccccc1 Amb18793198 [0,0,0,0,0,0|2,0,2]=4 187 B11R1.16 CSC[C@H](N)c1ccccc1 Amb28397956 [0,0,0,0,0,0|3,0,1]=4 188 B11R1.16 CSC[C@H](O)c1ccccc1 Amb28077783 [0,0,0,0,0,0|2,0,2]=4 189 B11R1.16 CS\N=C(\N)c1ccccc1 Amb28365468 [0,0,0,0,0,0|3,0,0]=3 190 B11R1.16 C[C@@H](CCN)c1ccccc1 Amb28285355 [0,0,0,0,0,0|3,0,1]=4 191 B11R1.16 C[C@H](CCO)c1ccccc1 Amb24371178 [0,0,0,0,0,0|3,0,1]=4 192 B11R1.16 C\C(=C/C#N)c1ccccc1 Amb32941900 [0,0,0,0,0,0|3,0,1]=4 193 B11R1.16 C\C(=C/C=O)c1ccccc1 Amb17593660 [0,0,0,0,0,0|3,0,1]=4 194 B11R1.16 C\C(=C/CBr)c1ccccc1 Amb28384582 [0,0,0,0,0,0|3,0,0]=3 195 B11R1.16 C\C(=C/CN)c1ccccc1 Amb23555622 [0,0,0,0,0,0|3,0,0]=3 196 B11R1.16 C\C(=C/CN)c1ccccn1 Amb31099542 [0,0,0,0,0,0|4,0,0]=4 197 B11R1.16 C\C(=C/CN)c1cccnc1 Amb31099543 [0,0,0,0,0,0|4,0,0]=4 198 B11R1.16 C\C(=C/CN)c1ccncc1 Amb31099544 [0,0,0,0,0,0|4,0,0]=4 199 B11R1.16 C\C(=C/CO)c1ccccc1 Amb8392366 [0,0,0,0,0,0|3,0,0]=3 200 B11R1.16 C\C(=C/CO)c1ccccn1 Amb24373086 [0,0,0,0,0,0|4,0,0]=4 201 B11R1.16 C\C(=C\CN)c1cccnc1 Amb27765028 [0,0,0,0,0,0|4,0,0]=4 202 B11R1.16 C\C(=C\CO)c1cccnc1 Amb27191760 [0,0,0,0,0,0|4,0,0]=4 203 B11R1.16 C\C=C\C(=O)c1ccccc1 Amb10574126 [0,0,0,0,0,0|1,0,1]=2 204 B11R1.16 C\C=C\C(=O)c1cccnc1 Amb25712944 [0,0,0,0,0,0|2,0,1]=3 205 B11R1.16 C\C=C\C(=O)c1cncnc1 Amb27406203 [0,0,0,0,0,0|3,0,1]=4 206 B11R1.16 C\C=C\C(O)c1ccccc1 Amb25887104 [0,0,0,0,0,0|1,0,3]=4 207 B11R1.16 C\C=C\[C@H](N)c1ccccc1 Amb27163147 [0,0,0,0,0,0|2,0,2]=4 208 B11R1.16 ClCCC(Br)c1ccccc1 Amb21856734 [0,0,0,0,0,0|3,0,1]=4 209 B11R1.16 ClCCC(Cl)c1ccccc1 Amb17872667 [0,0,0,0,0,0|3,0,1]=4 210 B11R1.16 N#CCC(=O)c1ccccc1 Amb1644485 [0,0,0,0,0,0|2,0,1]=3 211 B11R1.16 N#CCC(=O)c1ccccn1 Amb2608726 [0,0,0,0,0,0|3,0,1]=4 212 B11R1.16 N#CCC(=O)c1cccnc1 Amb22899257 [0,0,0,0,0,0|3,0,1]=4 213 B11R1.16 N#CCC(=O)c1cccnc1 Amb33528624 [0,0,0,0,0,0|3,0,1]=4 214 B11R1.16 N#CCC(=O)c1ccncc1 Amb8832803 [0,0,0,0,0,0|3,0,1]=4 215 B11R1.16 N#CCS(=O)c1ccccc1 Amb22505329 [0,0,0,0,0,0|3,0,1]=4 216 B11R1.16 N#CNC(=N)c1ccccc1 Amb20527583 [0,0,0,0,0,0|3,0,1]=4 217 B11R1.16 N#CNC(=O)c1ccccc1 Amb4007087 [0,0,0,0,0,0|2,0,1]=3 218 B11R1.16 N#CNC(=O)c1ccccn1 Amb28067311 [0,0,0,0,0,0|3,0,1]=4 219 B11R1.16 N#C\C=C(/Br)c1ccccc1 Amb17595559 [0,0,0,0,0,0|3,0,1]=4 220 B11R1.16 N#C\C=C(/Cl)c1ccccc1 Amb1107219 [0,0,0,0,0,0|3,0,1]=4 221 B11R1.16 N#C\C=C(/N)c1ccccc1 Amb2609675 [0,0,0,0,0,0|3,0,1]=4 222 B11R1.16 N#C\C=C(\Br)c1ccccc1 Amb27492883 [0,0,0,0,0,0|3,0,1]=4 223 B11R1.16 N#C\C=C(\Cl)c1ccccc1 Amb27601178 [0,0,0,0,0,0|3,0,1]=4 224 B11R1.16 N#C\C=C(\N)c1ccccc1 Amb25891462 [0,0,0,0,0,0|3,0,1]=4 225 B11R1.16 N#C\N=C(/N)c1ccccc1 Amb1146072 [0,0,0,0,0,0|3,0,1]=4 226 B11R1.16 N#C\N=C(\N)c1ccccc1 Amb4437466 [0,0,0,0,0,0|3,0,1]=4 227 B11R1.16 N=C=NC(=O)c1ccccc1 Amb28127436 [0,0,0,0,0,0|2,0,1]=3 228 B11R1.16 N=CNC(=O)c1ccccc1 Amb27961481 [0,0,0,0,0,0|2,0,1]=3 229 B11R1.16 NC(CCCl)c1ccccc1 Amb27247405 [0,0,0,0,0,0|3,0,1]=4 230 B11R1.16 NC(CCO)c1ccccc1 Amb1993953 [0,0,0,0,0,0|3,0,1]=4 231 B11R1.16 NCCC(=O)c1ccccc1 Amb2613669 [0,0,0,0,0,0|2,0,0]=2 232 B11R1.16 NCCC(=O)c1ccccn1 Amb18121375 [0,0,0,0,0,0|3,0,0]=3 233 B11R1.16 NCCC(=O)c1cccnc1 Amb18121496 [0,0,0,0,0,0|3,0,0]=3 234 B11R1.16 NCCC(=O)c1ccncc1 Amb18639595 [0,0,0,0,0,0|3,0,0]=3 235 B11R1.16 NCCC(=O)c1ccncn1 Amb33269069 [0,0,0,0,0,0|4,0,0]=4 236 B11R1.16 NCCC(=O)c1cnccn1 Amb26603088 [0,0,0,0,0,0|4,0,0]=4 237 B11R1.16 NCCC(=O)c1cncnc1 Amb24761230 [0,0,0,0,0,0|4,0,0]=4 238 B11R1.16 NCCC(=O)c1ncccn1 Amb33270701 [0,0,0,0,0,0|4,0,0]=4 239 B11R1.16 NCCC(Br)c1ccccc1 Amb27643497 [0,0,0,0,0,0|3,0,1]=4 240 B11R1.16 NCCC(F)c1ccccc1 Amb27760515 [0,0,0,0,0,0|3,0,1]=4 241 B11R1.16 NCCC(N)c1ccccc1 Amb18972395 [0,0,0,0,0,0|3,0,1]=4 242 B11R1.16 NCCC(O)c1ccccc1 Amb21984527 [0,0,0,0,0,0|2,0,2]=4 243 B11R1.16 NCCC(O)c1ccccc1 Amb9782359 [0,0,0,0,0,0|2,0,2]=4 244 B11R1.16 NCCS(=O)c1ccccc1 Amb18974516 [0,0,0,0,0,0|3,0,0]=3 245 B11R1.16 NCCS(=O)c1ccccc1 Amb19349568 [0,0,0,0,0,0|3,0,0]=3 246 B11R1.16 NCC[C@@H](O)c1ccccc1 Amb22225304 [0,0,0,0,0,0|2,0,2]=4 247 B11R1.16 NCC[C@H](O)c1ccccc1 Amb22226644 [0,0,0,0,0,0|2,0,2]=4 248 B11R1.16 NNCC(=O)c1cccnc1 Amb28342492 [0,0,0,0,0,0|4,0,0]=4 249 B11R1.16 NOCC(=O)c1ccccc1 Amb29848094 [0,0,0,0,0,0|3,0,0]=3 250 B11R1.16 N[C@@H](CCO)c1ccccc1 Amb8384290 [0,0,0,0,0,0|3,0,1]=4 251 B11R1.16 N[C@H](CCO)c1ccccc1 Amb22265524 [0,0,0,0,0,0|3,0,1]=4 252 B11R1.16 N[C@H](CCO)c1ccccc1 Amb8397180 [0,0,0,0,0,0|3,0,1]=4 253 B11R1.16 N\N=C\C(=O)c1ccccc1 Amb9824983 [0,0,0,0,0,0|3,0,0]=3 254 B11R1.16 O=C(C=C=S)c1ccccc1 Amb27227059 [0,0,0,0,0,0|2,0,1]=3 255 B11R1.16 O=C(CCBr)c1ccccc1 Amb4066411 [0,0,0,0,0,0|2,0,0]=2 256 B11R1.16 O=C(CCCl)c1ccccc1 Amb3940266 [0,0,0,0,0,0|2,0,0]=2 257 B11R1.16 O=C(CCCl)c1ccncc1 Amb24117884 [0,0,0,0,0,0|3,0,0]=3 258 B11R1.16 O=C(CCO)c1ccccc1 Amb16231606 [0,0,0,0,0,0|2,0,0]=2 259 B11R1.16 O=C(CCO)c1ccccn1 Amb26484243 [0,0,0,0,0,0|3,0,0]=3 260 B11R1.16 O=C(CCO)c1cccnc1 Amb26017511 [0,0,0,0,0,0|3,0,0]=3 261 B11R1.16 O=C(CCO)c1ccncc1 Amb24544067 [0,0,0,0,0,0|3,0,0]=3 262 B11R1.16 O=C(CCS)c1ccccc1 Amb17400214 [0,0,0,0,0,0|2,0,0]=2 263 B11R1.16 O=C(N=C=S)c1ccccc1 Amb2092776 [0,0,0,0,0,0|2,0,1]=3 264 B11R1.16 O=C(N=C=S)c1ccccn1 Amb9375600 [0,0,0,0,0,0|3,0,1]=4 265 B11R1.16 O=C(N=C=S)c1ccncc1 Amb9375599 [0,0,0,0,0,0|3,0,1]=4 266 B11R1.16 O=C(NC#P)c1ccccc1 Amb28245816 [0,0,0,0,0,0|2,0,1]=3 267 B11R1.16 O=C(NCCl)c1ccccc1 Amb7761622 [0,0,0,0,0,0|2,0,0]=2 268 B11R1.16 O=C(NCCl)c1cccnc1 Amb27974129 [0,0,0,0,0,0|3,0,0]=3 269 B11R1.16 O=C(NCO)c1ccccc1 Amb1200467 [0,0,0,0,0,0|2,0,0]=2 270 B11R1.16 O=C(NCO)c1cccnc1 Amb6358137 [0,0,0,0,0,0|3,0,0]=3 271 B11R1.16 O=C(NNO)c1ccccn1 Amb25043959 [0,0,0,0,0,0|4,0,0]=4 272 B11R1.16 O=C(NO[K])c1ccccc1 Amb33457787 [0,0,0,0,0,0|3,0,0]=3 273 B11R1.16 O=C(OCCl)c1ccccc1 Amb19958719 [0,0,0,0,0,0|1,0,0]=1 274 B11R1.16 O=C(OCCl)c1cccnc1 Amb28343065 [0,0,0,0,0,0|2,0,0]=2 275 B11R1.16 O=C(OCF)c1ccccc1 Amb27485928 [0,0,0,0,0,0|1,0,0]=1 276 B11R1.16 O=C(OCI)c1ccccc1 Amb25148286 [0,0,0,0,0,0|1,0,0]=1 277 B11R1.16 O=C(OCO)c1ccccc1 Amb25115920 [0,0,0,0,0,0|1,0,0]=1 278 B11R1.16 O=C(SCCl)c1ccccc1 Amb28458380 [0,0,0,0,0,0|1,1,0]=2 279 B11R1.16 O=C(\C=C/[O-])c1ccccc1 Amb17843402 [0,0,0,0,0,0|2,0,1]=3 280 B11R1.16 O=C(\C=C/[O-])c1ccccc1 Amb2385893 [0,0,0,0,0,0|2,0,1]=3 281 B11R1.16 O=C(\C=C\Cl)c1ccccc1 Amb17594153 [0,0,0,0,0,0|2,0,1]=3 282 B11R1.16 O=C(\C=C\Cl)c1ccccn1 Amb35645311 [0,0,0,0,0,0|3,0,1]=4 283 B11R1.16 O=C(\C=C\Cl)c1cccnc1 Amb35645317 [0,0,0,0,0,0|3,0,1]=4 284 B11R1.16 O=C(\C=C\Cl)c1ccncc1 Amb35645314 [0,0,0,0,0,0|3,0,1]=4 285 B11R1.16 O=C(\C=C\[O-])c1ccccc1 Amb22360915 [0,0,0,0,0,0|2,0,1]=3 286 B11R1.16 O=C(\C=N\O)c1ccccc1 Amb2781112 [0,0,0,0,0,0|3,0,0]=3 287 B11R1.16 O=C(\N=C\S)c1ccccc1 Amb24485844 [0,0,0,0,0,0|2,0,1]=3 288 B11R1.16 O=C=NC(=O)c1ccccc1 Amb3940094 [0,0,0,0,0,0|2,0,1]=3 289 B11R1.16 O=C=NC(=O)c1ccccn1 Amb26647466 [0,0,0,0,0,0|3,0,1]=4 290 B11R1.16 O=C=NC(=O)c1cccnc1 Amb17232035 [0,0,0,0,0,0|3,0,1]=4 291 B11R1.16 O=C=NC(=O)c1ccncc1 Amb27473383 [0,0,0,0,0,0|3,0,1]=4 292 B11R1.16 O=CCC(=O)c1ccccc1 Amb8394158 [0,0,0,0,0,0|2,0,1]=3 293 B11R1.16 O=CCC(=O)c1ccccn1 Amb9204927 [0,0,0,0,0,0|3,0,1]=4 294 B11R1.16 O=CCC(=O)c1cccnc1 Amb9204929 [0,0,0,0,0,0|3,0,1]=4 295 B11R1.16 O=CCC(=O)c1ccncc1 Amb9204939 [0,0,0,0,0,0|3,0,1]=4 296 B11R1.16 O=CNC(=O)c1ccccn1 Amb27831529 [0,0,0,0,0,0|3,0,1]=4 297 B11R1.16 O=COC(=O)c1ccccc1 Amb27421012 [0,0,0,0,0,0|1,0,1]=2 298 B11R1.16 O=C[CH-]C(=O)c1ccccc1 Amb24121236 [0,0,0,0,0,0|2,0,1]=3 299 B11R1.16 O=C[CH-]C(=O)c1cccnc1 Amb27816419 [0,0,0,0,0,0|3,0,1]=4 300 B11R1.16 O=C\C=C(/Cl)c1ccccc1 Amb17232626 [0,0,0,0,0,0|3,0,1]=4 301 B11R1.16 O=S(CCCl)c1ccccc1 Amb9158149 [0,0,0,0,0,0|3,0,0]=3 302 B11R1.16 O=S(CCO)c1ccccc1 Amb27411411 [0,0,0,0,0,0|3,0,0]=3 303 B11R1.16 OC(CCBr)c1ccccc1 Amb26365753 [0,0,0,0,0,0|2,0,2]=4 304 B11R1.16 OC(CCCl)c1ccccc1 Amb17611064 [0,0,0,0,0,0|2,0,2]=4 305 B11R1.16 OCCC(Cl)c1ccccc1 Amb27823326 [0,0,0,0,0,0|3,0,1]=4 306 B11R1.16 OCCC(F)c1ccccc1 Amb28460703 [0,0,0,0,0,0|3,0,1]=4 307 B11R1.16 OCCC(O)c1ccccc1 Amb17777842 [0,0,0,0,0,0|2,0,2]=4 308 B11R1.16 OCC[C@@H](O)c1ccccc1 Amb8516760 [0,0,0,0,0,0|2,0,2]=4 309 B11R1.16 OCOB(O)c1ccccc1 Amb33512956 [0,0,0,0,0,0|2,0,1]=3 310 B11R1.16 OC\C=C(\Br)c1ccccc1 Amb28284946 [0,0,0,0,0,0|3,0,0]=3 311 B11R1.16 O[C@@H](CCCl)c1ccccc1 Amb17611058 [0,0,0,0,0,0|2,0,2]=4 312 B11R1.16 O[C@H](CCBr)c1ccccc1 Amb27437857 [0,0,0,0,0,0|2,0,2]=4 313 B11R1.16 O[C@H](CCCl)c1ccccc1 Amb2779830 [0,0,0,0,0,0|2,0,2]=4 314 B11R1.16 O[C@H](CCI)c1ccccc1 Amb27603615 [0,0,0,0,0,0|2,0,2]=4 315 B11R1.16 [N-]=[N+]=CC(=O)c1ccccc1 Amb16233231 [0,0,0,0,0,0|3,0,0]=3 316 B11R1.16 [N-]=[N+]=CC(=O)c1ccccn1 Amb24618462 [0,0,0,0,0,0|4,0,0]=4 317 B11R1.16 [N-]=[N+]=CC(=O)c1cccnc1 Amb26961792 [0,0,0,0,0,0|4,0,0]=4 318 B11R1.16 [N-]=[N+]=CC(=O)c1ccncc1 Amb25922938 [0,0,0,0,0,0|4,0,0]=4 319 B11R1.16 [N-]=[N+]=NC(=O)c1ccccc1 Amb8938214 [0,0,0,0,0,0|3,0,0]=3 320 B11R1.16 [N-]=[N+]=NC(=O)c1cccnc1 Amb8938225 [0,0,0,0,0,0|4,0,0]=4 321 B11R1.16 [N-]=[N+]=NC(=O)c1ccncc1 Amb10574948 [0,0,0,0,0,0|4,0,0]=4 322 B10R1.15 BP(CO)c1ccccc1 Amb27652937 [1,0,0,0,0,0|3,0,0]=4 323 B10R1.15 B[PH](CO)c1ccccc1 Amb27826578 [1,0,0,0,0,0|3,0,0]=4 324 B10R1.15 BrCC(Br)c1ccccc1 Amb8394124 [1,0,0,0,0,0|2,0,1]=4 325 B10R1.15 Br\C=C(\Br)c1ccccc1 Amb8394126 [1,0,0,0,0,0|2,0,1]=4 326 B10R1.15 C#CC(=O)c1ccccc1 Amb1088846 [1,0,0,0,0,0|0,0,2]=3 327 B10R1.15 C#CC(=O)c1ccccn1 Amb28120737 [1,0,0,0,0,0|1,0,2]=4 328 B10R1.15 C#CC(=O)c1cccnc1 Amb27272672 [1,0,0,0,0,0|1,0,2]=4 329 B10R1.15 C#CC(=O)c1ccncc1 Amb27235537 [1,0,0,0,0,0|1,0,2]=4 330 B10R1.15 C=C(C#N)c1ccccc1 Amb17231856 [1,0,0,0,0,0|2,0,1]=4 331 B10R1.15 C=C(C=O)c1ccccc1 Amb16233227 [1,0,0,0,0,0|2,0,1]=4 332 B10R1.15 C=C(CBr)c1ccccc1 Amb8391739 [1,0,0,0,0,0|2,0,0]=3 333 B10R1.15 C=C(CBr)c1ccccn1 Amb33387999 [1,0,0,0,0,0|3,0,0]=4 334 B10R1.15 C=C(CBr)c1cccnc1 Amb33451443 [1,0,0,0,0,0|3,0,0]=4 335 B10R1.15 C=C(CBr)c1ccncc1 Amb24759413 [1,0,0,0,0,0|3,0,0]=4 336 B10R1.15 C=C(CC)c1ccccn1 Amb24467663 [1,0,0,0,0,0|2,0,0]=3 337 B10R1.15 C=C(CCl)c1ccccc1 Amb26968652 [1,0,0,0,0,0|2,0,0]=3 338 B10R1.15 C=C(CCl)c1ccccn1 Amb26577778 [1,0,0,0,0,0|3,0,0]=4 339 B10R1.15 C=C(CCl)c1cccnc1 Amb33052569 [1,0,0,0,0,0|3,0,0]=4 340 B10R1.15 C=C(CCl)c1ccncc1 Amb33052726 [1,0,0,0,0,0|3,0,0]=4 341 B10R1.15 C=C(CN)c1ccccc1 Amb10609068 [1,0,0,0,0,0|2,0,0]=3 342 B10R1.15 C=C(CN)c1ccccc1 Amb9421165 [1,0,0,0,0,0|2,0,0]=3 343 B10R1.15 C=C(CN)c1ccccn1 Amb27767907 [1,0,0,0,0,0|3,0,0]=4 344 B10R1.15 C=C(CN)c1cccnc1 Amb33360054 [1,0,0,0,0,0|3,0,0]=4 345 B10R1.15 C=C(CN)c1ccncc1 Amb33380645 [1,0,0,0,0,0|3,0,0]=4 346 B10R1.15 C=C(CO)c1ccccc1 Amb27839071 [1,0,0,0,0,0|2,0,0]=3 347 B10R1.15 C=C(CO)c1ccncc1 Amb25887623 [1,0,0,0,0,0|3,0,0]=4 348 B10R1.15 C=C(NC)c1ccccc1 Amb27975699 [1,0,0,0,0,0|2,0,0]=3 349 B10R1.15 C=C(OC)c1ccccn1 Amb28141881 [1,0,0,0,0,0|2,0,0]=3 350 B10R1.15 C=CC(=C)c1ccccc1 Amb26348162 [1,0,0,0,0,0|1,0,2]=4 351 B10R1.15 C=CC(=O)c1ccccc1 Amb33542643 [1,0,0,0,0,0|0,0,2]=3 352 B10R1.15 C=CC(=O)c1ccccn1 Amb28399382 [1,0,0,0,0,0|1,0,2]=4 353 B10R1.15 C=CC(=O)c1cccnc1 Amb25776729 [1,0,0,0,0,0|1,0,2]=4 354 B10R1.15 C=CC(=O)c1ccncc1 Amb24482055 [1,0,0,0,0,0|1,0,2]=4 355 B10R1.15 C=CS(=O)c1ccccc1 Amb15692858 [1,0,0,0,0,0|1,0,2]=4 356 B10R1.15 CC(CBr)c1ccccc1 Amb3940569 [1,0,0,0,0,0|2,0,1]=4 357 B10R1.15 CC(CCl)c1ccccc1 Amb17232147 [1,0,0,0,0,0|2,0,1]=4 358 B10R1.15 CC(CI)c1ccccc1 Amb26629255 [1,0,0,0,0,0|2,0,1]=4 359 B10R1.15 CC(CN)c1ccccc1 Amb19958781 [1,0,0,0,0,0|2,0,1]=4 360 B10R1.15 CC(CN)c1ccccc1 Amb5717369 [1,0,0,0,0,0|2,0,1]=4 361 B10R1.15 CC(CO)c1ccccc1 Amb2720837 [1,0,0,0,0,0|2,0,1]=4 362 B10R1.15 CC(CS)c1ccccc1 Amb28349926 [1,0,0,0,0,0|2,0,1]=4 363 B10R1.15 CC(ON)c1ccccc1 Amb17089185 [1,0,0,0,0,0|2,0,1]=4 364 B10R1.15 CC(ON)c1ccccc1 Amb22491086 [1,0,0,0,0,0|2,0,1]=4 365 B10R1.15 CCC(=N)c1ccccn1 Amb28182447 [1,0,0,0,0,0|2,0,0]=3 366 B10R1.15 CCC(=O)c1ccccc1 Amb4037285 [1,0,0,0,0,0|0,0,0]=1 367 B10R1.15 CCC(=O)c1ccccn1 Amb6301470 [1,0,0,0,0,0|1,0,0]=2 368 B10R1.15 CCC(=O)c1cccnc1 Amb8386799 [1,0,0,0,0,0|1,0,0]=2 369 B10R1.15 CCC(=O)c1ccncc1 Amb10576400 [1,0,0,0,0,0|1,0,0]=2 370 B10R1.15 CCC(=O)c1ccncn1 Amb25737542 [1,0,0,0,0,0|2,0,0]=3 371 B10R1.15 CCC(=O)c1cnccn1 Amb22235242 [1,0,0,0,0,0|2,0,0]=3 372 B10R1.15 CCC(=O)c1cncnc1 Amb24082134 [1,0,0,0,0,0|2,0,0]=3 373 B10R1.15 CCC(=O)c1cnncn1 Amb18203073 [1,0,0,0,0,0|3,0,0]=4 374 B10R1.15 CCC(=O)c1ncccn1 Amb22236265 [1,0,0,0,0,0|2,0,0]=3 375 B10R1.15 CCC(Br)c1ccccc1 Amb9210652 [1,0,0,0,0,0|1,0,1]=3 376 B10R1.15 CCC(Br)c1ccccn1 Amb27647660 [1,0,0,0,0,0|2,0,1]=4 377 B10R1.15 CCC(Br)c1cccnc1 Amb24556035 [1,0,0,0,0,0|2,0,1]=4 378 B10R1.15 CCC(Br)c1ccncc1 Amb27463363 [1,0,0,0,0,0|2,0,1]=4 379 B10R1.15 CCC(C)c1ccccc1 Amb9702788 [1,0,0,0,0,0|1,0,1]=3 380 B10R1.15 CCC(C)c1ccccn1 Amb28145932 [1,0,0,0,0,0|2,0,1]=4 381 B10R1.15 CCC(C)c1ccncc1 Amb26842817 [1,0,0,0,0,0|2,0,1]=4 382 B10R1.15 CCC(Cl)c1ccccc1 Amb7766794 [1,0,0,0,0,0|1,0,1]=3 383 B10R1.15 CCC(N)c1ccccc1 Amb19959910 [1,0,0,0,0,0|1,0,1]=3 384 B10R1.15 CCC(N)c1ccccc1 Amb9703596 [1,0,0,0,0,0|1,0,1]=3 385 B10R1.15 CCC(N)c1ccccn1 Amb10607917 [1,0,0,0,0,0|2,0,1]=4 386 B10R1.15 CCC(N)c1ccccn1 Amb22587075 [1,0,0,0,0,0|2,0,1]=4 387 B10R1.15 CCC(N)c1cccnc1 Amb10607957 [1,0,0,0,0,0|2,0,1]=4 388 B10R1.15 CCC(N)c1cccnc1 Amb30588534 [1,0,0,0,0,0|2,0,1]=4 389 B10R1.15 CCC(N)c1ccncc1 Amb8009606 [1,0,0,0,0,0|2,0,1]=4 390 B10R1.15 CCC(O)c1ccccc1 Amb6705776 [1,0,0,0,0,0|0,0,2]=3 391 B10R1.15 CCC(O)c1ccccn1 Amb26851902 [1,0,0,0,0,0|1,0,2]=4 392 B10R1.15 CCC(O)c1cccnc1 Amb17231904 [1,0,0,0,0,0|1,0,2]=4 393 B10R1.15 CCC(O)c1ccncc1 Amb16233288 [1,0,0,0,0,0|1,0,2]=4 394 B10R1.15 CCC(S)c1ccccc1 Amb9208017 [1,0,0,0,0,0|0,1,1]=3 395 B10R1.15 CCN(C)c1ccccn1 Amb26564265 [1,0,0,0,0,0|3,0,0]=4 396 B10R1.15 CCN(N)c1ccccc1 Amb836839 [1,0,0,0,0,0|2,0,0]=3 397 B10R1.15 CCN(N)c1ccccn1 Amb18643189 [1,0,0,0,0,0|3,0,0]=4 398 B10R1.15 CCP(Cl)c1ccccc1 Amb27765906 [1,0,0,0,0,0|2,0,0]=3 399 B10R1.15 CCS(=O)c1ccccc1 Amb22500370 [1,0,0,0,0,0|1,0,0]=2 400 B10R1.15 CCS(=O)c1ccccn1 Amb28049400 [1,0,0,0,0,0|2,0,0]=3 401 B10R1.15 CC[C@@H](Br)c1ccccc1 Amb27761826 [1,0,0,0,0,0|1,0,1]=3 402 B10R1.15 CC[C@@H](N)c1ccccc1 Amb22265426 [1,0,0,0,0,0|1,0,1]=3 403 B10R1.15 CC[C@@H](N)c1ccccc1 Amb8383789 [1,0,0,0,0,0|1,0,1]=3 404 B10R1.15 CC[C@@H](N)c1ccccn1 Amb25797820 [1,0,0,0,0,0|2,0,1]=4 405 B10R1.15 CC[C@@H](N)c1ccccn1 Amb30869540 [1,0,0,0,0,0|2,0,1]=4 406 B10R1.15 CC[C@@H](N)c1ccncc1 Amb30647447 [1,0,0,0,0,0|2,0,1]=4 407 B10R1.15 CC[C@@H](O)c1ccccc1 Amb8517168 [1,0,0,0,0,0|0,0,2]=3 408 B10R1.15 CC[C@@H](O)c1ccccn1 Amb25717055 [1,0,0,0,0,0|1,0,2]=4 409 B10R1.15 CC[C@@H](O)c1cccnc1 Amb27161307 [1,0,0,0,0,0|1,0,2]=4 410 B10R1.15 CC[C@H](Br)c1ccccc1 Amb27659277 [1,0,0,0,0,0|1,0,1]=3 411 B10R1.15 CC[C@H](C)c1ccccc1 Amb28326096 [1,0,0,0,0,0|1,0,1]=3 412 B10R1.15 CC[C@H](C)c1ccccn1 Amb27407415 [1,0,0,0,0,0|2,0,1]=4 413 B10R1.15 CC[C@H](N)c1ccccc1 Amb22265559 [1,0,0,0,0,0|1,0,1]=3 414 B10R1.15 CC[C@H](N)c1ccccc1 Amb8628779 [1,0,0,0,0,0|1,0,1]=3 415 B10R1.15 CC[C@H](N)c1ccccn1 Amb26961005 [1,0,0,0,0,0|2,0,1]=4 416 B10R1.15 CC[C@H](N)c1ccccn1 Amb33802008 [1,0,0,0,0,0|2,0,1]=4 417 B10R1.15 CC[C@H](N)c1ccccn1 Amb33872493 [1,0,0,0,0,0|2,0,1]=4 418 B10R1.15 CC[C@H](N)c1cccnc1 Amb30647446 [1,0,0,0,0,0|2,0,1]=4 419 B10R1.15 CC[C@H](N)c1ccncc1 Amb27404537 [1,0,0,0,0,0|2,0,1]=4 420 B10R1.15 CC[C@H](N)c1ccncc1 Amb30647448 [1,0,0,0,0,0|2,0,1]=4 421 B10R1.15 CC[C@H](O)c1ccccc1 Amb8517167 [1,0,0,0,0,0|0,0,2]=3 422 B10R1.15 CC[C@H](O)c1ccccn1 Amb25910593 [1,0,0,0,0,0|1,0,2]=4 423 B10R1.15 CC[C@H](O)c1cccnc1 Amb24432697 [1,0,0,0,0,0|1,0,2]=4 424 B10R1.15 CC[C@H](O)c1ccncc1 Amb27861997 [1,0,0,0,0,0|1,0,2]=4 425 B10R1.15 CNC(=N)c1ccccc1 Amb23447117 [1,0,0,0,0,0|2,0,0]=3 426 B10R1.15 CNC(=N)c1ccccc1 Amb28775800 [1,0,0,0,0,0|2,0,0]=3 427 B10R1.15 CNC(=N)c1cccnc1 Amb32667420 [1,0,0,0,0,0|3,0,0]=4 428 B10R1.15 CNC(=O)C1=CC=CNC1 Amb27252063 [1,0,0,0,0,0|2,0,1]=4 429 B10R1.15 CNC(=O)c1ccccc1 Amb2591685 [1,0,0,0,0,0|1,0,0]=2 430 B10R1.15 CNC(=O)c1ccccn1 Amb6892873 [1,0,0,0,0,0|2,0,0]=3 431 B10R1.15 CNC(=O)c1cccnc1 Amb3886560 [1,0,0,0,0,0|2,0,0]=3 432 B10R1.15 CNC(=O)c1ccncc1 Amb26328844 [1,0,0,0,0,0|2,0,0]=3 433 B10R1.15 CNC(=O)c1ccncn1 Amb27589630 [1,0,0,0,0,0|3,0,0]=4 434 B10R1.15 CNC(=O)c1ncccn1 Amb25985661 [1,0,0,0,0,0|3,0,0]=4 435 B10R1.15 CNC(=S)c1ccccc1 Amb10552988 [1,0,0,0,0,0|1,1,0]=3 436 B10R1.15 CNC(=S)c1cccnc1 Amb27877638 [1,0,0,0,0,0|2,1,0]=4 437 B10R1.15 CNC(C)c1ccccc1 Amb6382953 [1,0,0,0,0,0|2,0,1]=4 438 B10R1.15 CNC(C)c1ccccc1 Amb9745717 [1,0,0,0,0,0|2,0,1]=4 439 B10R1.15 CNN(C)c1ccccc1 Amb27398128 [1,0,0,0,0,0|3,0,0]=4 440 B10R1.15 CN[C@@H](C)c1ccccc1 Amb17740009 [1,0,0,0,0,0|2,0,1]=4 441 B10R1.15 CN[C@H](C)c1ccccc1 Amb10844610 [1,0,0,0,0,0|2,0,1]=4 442 B10R1.15 COC(=N)c1ccccc1 Amb4009954 [1,0,0,0,0,0|1,0,0]=2 443 B10R1.15 COC(=N)c1ccccc1 Amb6366188 [1,0,0,0,0,0|1,0,0]=2 444 B10R1.15 COC(=N)c1cccnn1 Amb27618556 [1,0,0,0,0,0|3,0,0]=4 445 B10R1.15 COC(=N)c1cnccn1 Amb10071951 [1,0,0,0,0,0|3,0,0]=4 446 B10R1.15 COC(=O)C1=CC=CNC1 Amb28042598 [1,0,0,0,0,0|1,0,1]=3 447 B10R1.15 COC(=O)N1C=CC=CC1 Amb2697197 [1,0,0,0,0,0|1,0,1]=3 448 B10R1.15 COC(=O)c1ccccc1 Amb4302710 [1,0,0,0,0,0|0,0,0]=1 449 B10R1.15 COC(=O)c1ccccn1 Amb2721020 [1,0,0,0,0,0|1,0,0]=2 450 B10R1.15 COC(=O)c1cccnc1 Amb1212078 [1,0,0,0,0,0|1,0,0]=2 451 B10R1.15 COC(=O)c1cccnc1 Amb22741138 [1,0,0,0,0,0|1,0,0]=2 452 B10R1.15 COC(=O)c1cccnn1 Amb21960450 [1,0,0,0,0,0|2,0,0]=3 453 B10R1.15 COC(=O)c1ccncc1 Amb6608958 [1,0,0,0,0,0|1,0,0]=2 454 B10R1.15 COC(=O)c1ccncn1 Amb7101502 [1,0,0,0,0,0|2,0,0]=3 455 B10R1.15 COC(=O)c1ccnnc1 Amb17935713 [1,0,0,0,0,0|2,0,0]=3 456 B10R1.15 COC(=O)c1cnccn1 Amb2455964 [1,0,0,0,0,0|2,0,0]=3 457 B10R1.15 COC(=O)c1cnccn1 Amb33620824 [1,0,0,0,0,0|2,0,0]=3 458 B10R1.15 COC(=O)c1cncnc1 Amb5492761 [1,0,0,0,0,0|2,0,0]=3 459 B10R1.15 COC(=O)c1ncccn1 Amb7101492 [1,0,0,0,0,0|2,0,0]=3 460 B10R1.15 COC(=O)c1nccnn1 Amb25327432 [1,0,0,0,0,0|3,0,0]=4 461 B10R1.15 COC(=S)c1ccccc1 Amb10569749 [1,0,0,0,0,0|0,1,0]=2 462 B10R1.15 COC(C)c1ccccc1 Amb23568513 [1,0,0,0,0,0|1,0,1]=3 463 B10R1.15 CON(C)c1ccccn1 Amb27804447 [1,0,0,0,0,0|3,0,0]=4 464 B10R1.15 COS(=O)c1ccccc1 Amb2689327 [1,0,0,0,0,0|1,0,0]=2 465 B10R1.15 CP(CO)c1ccccc1 Amb27410449 [1,0,0,0,0,0|3,0,0]=4 466 B10R1.15 CSC(=N)c1ccccc1 Amb22488568 [1,0,0,0,0,0|1,1,0]=3 467 B10R1.15 CSC(=O)c1ccccn1 Amb1487227 [1,0,0,0,0,0|1,1,0]=3 468 B10R1.15 CSC(=S)c1ccccc1 Amb24395059 [1,0,0,0,0,0|0,2,0]=3 469 B10R1.15 C[C@@H](CN)c1ccccc1 Amb33623692 [1,0,0,0,0,0|2,0,1]=4 470 B10R1.15 C[C@@H](CN)c1ccccc1 Amb4036825 [1,0,0,0,0,0|2,0,1]=4 471 B10R1.15 C[C@@H](CO)c1ccccc1 Amb3939247 [1,0,0,0,0,0|2,0,1]=4 472 B10R1.15 C[C@@H](ON)c1ccccc1 Amb25850037 [1,0,0,0,0,0|2,0,1]=4 473 B10R1.15 C[C@@H](ON)c1ccccc1 Amb32665789 [1,0,0,0,0,0|2,0,1]=4 474 B10R1.15 C[C@H](CN)c1ccccc1 Amb10070369 [1,0,0,0,0,0|2,0,1]=4 475 B10R1.15 C[C@H](CO)c1ccccc1 Amb3939248 [1,0,0,0,0,0|2,0,1]=4 476 B10R1.15 C[C@H](ON)c1ccccc1 Amb32665788 [1,0,0,0,0,0|2,0,1]=4 477 B10R1.15 C[C@H](ON)c1ccccc1 Amb32666539 [1,0,0,0,0,0|2,0,1]=4 478 B10R1.15 C\C(=C/Br)c1ccccc1 Amb25066105 [1,0,0,0,0,0|2,0,1]=4 479 B10R1.15 C\C(=C/Cl)c1ccccc1 Amb30621745 [1,0,0,0,0,0|2,0,1]=4 480 B10R1.15 C\C(=C\Br)c1ccccc1 Amb4035454 [1,0,0,0,0,0|2,0,1]=4 481 B10R1.15 C\C(=C\Cl)c1ccccc1 Amb26652006 [1,0,0,0,0,0|2,0,1]=4 482 B10R1.15 C\C(=N/N)c1ccccc1 Amb4016930 [1,0,0,0,0,0|3,0,0]=4 483 B10R1.15 C\C(=N/O)c1ccccc1 Amb2387477 [1,0,0,0,0,0|3,0,0]=4 484 B10R1.15 C\C(=N\O)c1ccccc1 Amb3428046 [1,0,0,0,0,0|3,0,0]=4 485 B10R1.15 C\C=C(/C)c1ccccc1 Amb29628341 [1,0,0,0,0,0|1,0,1]=3 486 B10R1.15 C\C=C(/C)c1ccncc1 Amb24103190 [1,0,0,0,0,0|2,0,1]=4 487 B10R1.15 C\C=C(/F)c1ccccc1 Amb25881627 [1,0,0,0,0,0|1,0,1]=3 488 B10R1.15 C\C=C(/N)c1ccccc1 Amb27787637 [1,0,0,0,0,0|1,0,1]=3 489 B10R1.15 C\C=C(\C)c1ccccc1 Amb26360165 [1,0,0,0,0,0|1,0,1]=3 490 B10R1.15 C\C=C(\C)c1cccnc1 Amb27260271 [1,0,0,0,0,0|2,0,1]=4 491 B10R1.15 C\N=C(/N)c1cccnc1 Amb21970335 [1,0,0,0,0,0|3,0,0]=4 492 B10R1.15 C\N=C(\C)c1ccccn1 Amb24433259 [1,0,0,0,0,0|3,0,0]=4 493 B10R1.15 C\N=C(\N)c1cccnc1 Amb28555473 [1,0,0,0,0,0|3,0,0]=4 494 B10R1.15 ClCC(Cl)c1ccccc1 Amb2720893 [1,0,0,0,0,0|2,0,1]=4 495 B10R1.15 Cl\C=C(\Cl)c1ccccc1 Amb25849275 [1,0,0,0,0,0|2,0,1]=4 496 B10R1.15 FC(CBr)c1ccccc1 Amb20075900 [1,0,0,0,0,0|2,0,1]=4 497 B10R1.15 FC(CCl)c1ccccc1 Amb27596575 [1,0,0,0,0,0|2,0,1]=4 498 B10R1.15 N#CC(=O)c1ccccc1 Amb6893027 [1,0,0,0,0,0|1,0,1]=3 499 B10R1.15 N=C(NN)c1ccccc1 Amb22234855 [1,0,0,0,0,0|3,0,0]=4 500 B10R1.15 N=CC(=O)c1ccccc1 Amb27783553 [1,0,0,0,0,0|1,0,1]=3 501 B10R1.15 NC(CCl)c1ccccc1 Amb27602197 [1,0,0,0,0,0|2,0,1]=4 502 B10R1.15 NC(CF)c1ccccc1 Amb2372575 [1,0,0,0,0,0|2,0,1]=4 503 B10R1.15 NC(CF)c1ccccc1 Amb33362248 [1,0,0,0,0,0|2,0,1]=4 504 B10R1.15 NC(CO)c1ccccc1 Amb8513829 [1,0,0,0,0,0|2,0,1]=4 505 B10R1.15 NCC(=O)c1ccccc1 Amb1073498 [1,0,0,0,0,0|1,0,0]=2 506 B10R1.15 NCC(=O)c1ccccc1 Amb33531112 [1,0,0,0,0,0|1,0,0]=2 507 B10R1.15 NCC(=O)c1ccccn1 Amb10601921 [1,0,0,0,0,0|2,0,0]=3 508 B10R1.15 NCC(=O)c1ccccn1 Amb18832469 [1,0,0,0,0,0|2,0,0]=3 509 B10R1.15 NCC(=O)c1cccnc1 Amb17607867 [1,0,0,0,0,0|2,0,0]=3 510 B10R1.15 NCC(=O)c1cccnc1 Amb22277079 [1,0,0,0,0,0|2,0,0]=3 511 B10R1.15 NCC(=O)c1cccnc1 Amb22754018 [1,0,0,0,0,0|2,0,0]=3 512 B10R1.15 NCC(=O)c1ccncc1 Amb18832471 [1,0,0,0,0,0|2,0,0]=3 513 B10R1.15 NCC(=O)c1ccncc1 Amb22002046 [1,0,0,0,0,0|2,0,0]=3 514 B10R1.15 NCC(=O)c1ccncn1 Amb18832380 [1,0,0,0,0,0|3,0,0]=4 515 B10R1.15 NCC(=O)c1cnccn1 Amb21862012 [1,0,0,0,0,0|3,0,0]=4 516 B10R1.15 NCC(=O)c1cnccn1 Amb33038182 [1,0,0,0,0,0|3,0,0]=4 517 B10R1.15 NCC(=O)c1cncnc1 Amb18832378 [1,0,0,0,0,0|3,0,0]=4 518 B10R1.15 NCC(=O)c1ncccn1 Amb24105961 [1,0,0,0,0,0|3,0,0]=4 519 B10R1.15 NCC(Cl)c1ccccc1 Amb27984951 [1,0,0,0,0,0|2,0,1]=4 520 B10R1.15 NCC(F)c1ccccc1 Amb23454844 [1,0,0,0,0,0|2,0,1]=4 521 B10R1.15 NCC(F)c1ccccc1 Amb33249671 [1,0,0,0,0,0|2,0,1]=4 522 B10R1.15 NCC(N)c1ccccc1 Amb21857142 [1,0,0,0,0,0|2,0,1]=4 523 B10R1.15 NCC(N)c1ccccc1 Amb33473621 [1,0,0,0,0,0|2,0,1]=4 524 B10R1.15 NCC(N)c1ccccc1 Amb9380661 [1,0,0,0,0,0|2,0,1]=4 525 B10R1.15 NCC(O)c1ccccc1 Amb33542602 [1,0,0,0,0,0|1,0,2]=4 526 B10R1.15 NCC(O)c1ccccc1 Amb33544420 [1,0,0,0,0,0|1,0,2]=4 527 B10R1.15 NC[C@@H](F)c1ccccc1 Amb25279947 [1,0,0,0,0,0|2,0,1]=4 528 B10R1.15 NC[C@@H](F)c1ccccc1 Amb32661014 [1,0,0,0,0,0|2,0,1]=4 529 B10R1.15 NC[C@@H](O)c1ccccc1 Amb24107154 [1,0,0,0,0,0|1,0,2]=4 530 B10R1.15 NC[C@@H](O)c1ccccc1 Amb8630286 [1,0,0,0,0,0|1,0,2]=4 531 B10R1.15 NC[C@H](O)c1ccccc1 Amb10070626 [1,0,0,0,0,0|1,0,2]=4 532 B10R1.15 NC[C@H](O)c1ccccc1 Amb8631408 [1,0,0,0,0,0|1,0,2]=4 533 B10R1.15 NC[PH](=O)c1ccccc1 Amb28119772 [1,0,0,0,0,0|2,0,0]=3 534 B10R1.15 NNC(=O)c1ccccc1 Amb1208583 [1,0,0,0,0,0|2,0,0]=3 535 B10R1.15 NNC(=O)c1ccccn1 Amb1208395 [1,0,0,0,0,0|3,0,0]=4 536 B10R1.15 NNC(=O)c1cccnc1 Amb1786962 [1,0,0,0,0,0|3,0,0]=4 537 B10R1.15 NNC(=O)c1ccncc1 Amb6335257 [1,0,0,0,0,0|3,0,0]=4 538 B10R1.15 NNC(=S)c1ccccc1 Amb23513674 [1,0,0,0,0,0|2,1,0]=4 539 B10R1.15 NNS(=O)c1ccccc1 Amb27428863 [1,0,0,0,0,0|3,0,0]=4 540 B10R1.15 N[C@@H](CBr)c1ccccc1 Amb27876239 [1,0,0,0,0,0|2,0,1]=4 541 B10R1.15 N[C@@H](CF)c1ccccc1 Amb22887019 [1,0,0,0,0,0|2,0,1]=4 542 B10R1.15 N[C@@H](CF)c1ccccc1 Amb22887020 [1,0,0,0,0,0|2,0,1]=4 543 B10R1.15 N[C@@H](CO)c1ccccc1 Amb3939344 [1,0,0,0,0,0|2,0,1]=4 544 B10R1.15 N[C@H](CCl)c1ccccc1 Amb27214165 [1,0,0,0,0,0|2,0,1]=4 545 B10R1.15 N[C@H](CF)c1ccccc1 Amb27768745 [1,0,0,0,0,0|2,0,1]=4 546 B10R1.15 N[C@H](CF)c1ccccc1 Amb33482690 [1,0,0,0,0,0|2,0,1]=4 547 B10R1.15 N[C@H](CO)c1ccccc1 Amb2720557 [1,0,0,0,0,0|2,0,1]=4 548 B10R1.15 N\C(=N/O)c1ccccc1 Amb1149046 [1,0,0,0,0,0|3,0,0]=4 549 B10R1.15 N\C(=N/O)c1ccccc1 Amb6298734 [1,0,0,0,0,0|3,0,0]=4 550 B10R1.15 N\C(=N\O)c1ccccc1 Amb2226909 [1,0,0,0,0,0|3,0,0]=4 551 B10R1.15 N\N=C(/Cl)c1ccccc1 Amb27951117 [1,0,0,0,0,0|3,0,0]=4 552 B10R1.15 N\N=C(/N)c1ccccc1 Amb20407822 [1,0,0,0,0,0|3,0,0]=4 553 B10R1.15 N\N=C(\Cl)c1ccccc1 Amb27210015 [1,0,0,0,0,0|3,0,0]=4 554 B10R1.15 O=C(CBr)c1ccccc1 Amb33533065 [1,0,0,0,0,0|1,0,0]=2 555 B10R1.15 O=C(CBr)c1ccccn1 Amb1980867 [1,0,0,0,0,0|2,0,0]=3 556 B10R1.15 O=C(CBr)c1ccccn1 Amb2684941 [1,0,0,0,0,0|2,0,0]=3 557 B10R1.15 O=C(CBr)c1cccnc1 Amb1981330 [1,0,0,0,0,0|2,0,0]=3 558 B10R1.15 O=C(CBr)c1cccnc1 Amb2684942 [1,0,0,0,0,0|2,0,0]=3 559 B10R1.15 O=C(CBr)c1ccncc1 Amb1981329 [1,0,0,0,0,0|2,0,0]=3 560 B10R1.15 O=C(CBr)c1ccncc1 Amb2684943 [1,0,0,0,0,0|2,0,0]=3 561 B10R1.15 O=C(CBr)c1ccncn1 Amb22304669 [1,0,0,0,0,0|3,0,0]=4 562 B10R1.15 O=C(CBr)c1ccncn1 Amb22490403 [1,0,0,0,0,0|3,0,0]=4 563 B10R1.15 O=C(CBr)c1cnccn1 Amb16233325 [1,0,0,0,0,0|3,0,0]=4 564 B10R1.15 O=C(CBr)c1cnccn1 Amb22235528 [1,0,0,0,0,0|3,0,0]=4 565 B10R1.15 O=C(CBr)c1cncnc1 Amb21964583 [1,0,0,0,0,0|3,0,0]=4 566 B10R1.15 O=C(CBr)c1cncnc1 Amb22276010 [1,0,0,0,0,0|3,0,0]=4 567 B10R1.15 O=C(CBr)c1ncccn1 Amb22304716 [1,0,0,0,0,0|3,0,0]=4 568 B10R1.15 O=C(CBr)c1ncccn1 Amb22491896 [1,0,0,0,0,0|3,0,0]=4 569 B10R1.15 O=C(CCl)c1ccccc1 Amb3940253 [1,0,0,0,0,0|1,0,0]=2 570 B10R1.15 O=C(CCl)c1ccccn1 Amb33329358 [1,0,0,0,0,0|2,0,0]=3 571 B10R1.15 O=C(CCl)c1ccccn1 Amb33545115 [1,0,0,0,0,0|2,0,0]=3 572 B10R1.15 O=C(CCl)c1cccnc1 Amb22371841 [1,0,0,0,0,0|2,0,0]=3 573 B10R1.15 O=C(CCl)c1cccnc1 Amb7172585 [1,0,0,0,0,0|2,0,0]=3 574 B10R1.15 O=C(CCl)c1ccncc1 Amb22371842 [1,0,0,0,0,0|2,0,0]=3 575 B10R1.15 O=C(CCl)c1ccncc1 Amb3319289 [1,0,0,0,0,0|2,0,0]=3 576 B10R1.15 O=C(CCl)c1ccncn1 Amb28456565 [1,0,0,0,0,0|3,0,0]=4 577 B10R1.15 O=C(CCl)c1cnccn1 Amb24104161 [1,0,0,0,0,0|3,0,0]=4 578 B10R1.15 O=C(CCl)c1cncnc1 Amb25281438 [1,0,0,0,0,0|3,0,0]=4 579 B10R1.15 O=C(CCl)c1cncnc1 Amb33330976 [1,0,0,0,0,0|3,0,0]=4 580 B10R1.15 O=C(CCl)c1ncccn1 Amb22753079 [1,0,0,0,0,0|3,0,0]=4 581 B10R1.15 O=C(CF)c1ccccc1 Amb10603600 [1,0,0,0,0,0|1,0,0]=2 582 B10R1.15 O=C(CI)c1ccccc1 Amb23579972 [1,0,0,0,0,0|1,0,0]=2 583 B10R1.15 O=C(CO)c1ccccc1 Amb3940718 [1,0,0,0,0,0|1,0,0]=2 584 B10R1.15 O=C(CO)c1ccccn1 Amb18063640 [1,0,0,0,0,0|2,0,0]=3 585 B10R1.15 O=C(CO)c1cccnc1 Amb18063681 [1,0,0,0,0,0|2,0,0]=3 586 B10R1.15 O=C(CO)c1ccncc1 Amb18063686 [1,0,0,0,0,0|2,0,0]=3 587 B10R1.15 O=C(CS)c1ccccc1 Amb16192503 [1,0,0,0,0,0|1,0,0]=2 588 B10R1.15 O=C(C[K])c1ccncn1 Amb28287563 [1,0,0,0,0,0|3,0,0]=4 589 B10R1.15 O=C(NCl)c1cccnc1 Amb26039027 [1,0,0,0,0,0|3,0,0]=4 590 B10R1.15 O=C(NI)c1ccccc1 Amb27787732 [1,0,0,0,0,0|2,0,0]=3 591 B10R1.15 O=C(NO)c1ccccc1 Amb1645521 [1,0,0,0,0,0|2,0,0]=3 592 B10R1.15 O=C(NO)c1ccccn1 Amb6268699 [1,0,0,0,0,0|3,0,0]=4 593 B10R1.15 O=C(NO)c1cccnc1 Amb33532633 [1,0,0,0,0,0|3,0,0]=4 594 B10R1.15 O=C(NO)c1ccncc1 Amb6270440 [1,0,0,0,0,0|3,0,0]=4 595 B10R1.15 O=C(N[O-])c1ccccc1 Amb18800075 [1,0,0,0,0,0|2,0,0]=3 596 B10R1.15 O=C(N[O-])c1ccccc1 Amb4035742 [1,0,0,0,0,0|2,0,0]=3 597 B10R1.15 O=C(OCl)c1cnccn1 Amb27776207 [1,0,0,0,0,0|3,0,0]=4 598 B10R1.15 O=C(OO)c1cccnc1 Amb24094187 [1,0,0,0,0,0|2,0,0]=3 599 B10R1.15 O=C(OO)c1ccncc1 Amb24066209 [1,0,0,0,0,0|2,0,0]=3 600 B10R1.15 O=C(O[K])c1cccnc1 Amb3150242 [1,0,0,0,0,0|2,0,0]=3 601 B10R1.15 O=CC(=O)c1ccccc1 Amb4338217 [1,0,0,0,0,0|1,0,1]=3 602 B10R1.15 O=CC(=O)c1ccccc1 Amb8513585 [1,0,0,0,0,0|1,0,1]=3 603 B10R1.15 O=CC(=O)c1ccccn1 Amb25066902 [1,0,0,0,0,0|2,0,1]=4 604 B10R1.15 O=S(CF)c1ccccc1 Amb22723398 [1,0,0,0,0,0|2,0,0]=3 605 B10R1.15 O=S(CO)c1ccccc1 Amb27617047 [1,0,0,0,0,0|2,0,0]=3 606 B10R1.15 O=S(O[Na])c1ccccc1 Amb6365754 [1,0,0,0,0,0|2,0,0]=3 607 B10R1.15 OC(CBr)c1ccccc1 Amb17206105 [1,0,0,0,0,0|1,0,2]=4 608 B10R1.15 OC(CCl)c1ccccc1 Amb9826903 [1,0,0,0,0,0|1,0,2]=4 609 B10R1.15 OC(CF)c1ccccc1 Amb22731897 [1,0,0,0,0,0|1,0,2]=4 610 B10R1.15 OC(CI)c1ccccc1 Amb28073875 [1,0,0,0,0,0|1,0,2]=4 611 B10R1.15 OC(CS)c1ccccc1 Amb10608997 [1,0,0,0,0,0|1,0,2]=4 612 B10R1.15 OCC(Br)c1ccccc1 Amb27971765 [1,0,0,0,0,0|2,0,1]=4 613 B10R1.15 OCC(Cl)c1ccccc1 Amb27165767 [1,0,0,0,0,0|2,0,1]=4 614 B10R1.15 OCC(F)c1ccccc1 Amb24105399 [1,0,0,0,0,0|2,0,1]=4 615 B10R1.15 OCC(O)c1ccccc1 Amb4350706 [1,0,0,0,0,0|1,0,2]=4 616 B10R1.15 OCC(S)c1ccccc1 Amb25333535 [1,0,0,0,0,0|1,1,1]=4 617 B10R1.15 OC[C@@H](O)c1ccccc1 Amb8514912 [1,0,0,0,0,0|1,0,2]=4 618 B10R1.15 OC[C@H](Br)c1ccccc1 Amb27798351 [1,0,0,0,0,0|2,0,1]=4 619 B10R1.15 OC[C@H](Cl)c1ccccc1 Amb27659257 [1,0,0,0,0,0|2,0,1]=4 620 B10R1.15 OC[C@H](O)c1ccccc1 Amb8389336 [1,0,0,0,0,0|1,0,2]=4 621 B10R1.15 OC[C@H](S)c1ccccc1 Amb28207325 [1,0,0,0,0,0|1,1,1]=4 622 B10R1.15 O[C@@H](CBr)c1ccccc1 Amb19929326 [1,0,0,0,0,0|1,0,2]=4 623 B10R1.15 O[C@@H](CCl)c1ccccc1 Amb16231709 [1,0,0,0,0,0|1,0,2]=4 624 B10R1.15 O[C@@H](CF)c1ccccc1 Amb24389146 [1,0,0,0,0,0|1,0,2]=4 625 B10R1.15 O[C@@H](CS)c1ccccc1 Amb27604413 [1,0,0,0,0,0|1,0,2]=4 626 B10R1.15 O[C@H](CBr)c1ccccc1 Amb19929329 [1,0,0,0,0,0|1,0,2]=4 627 B10R1.15 O[C@H](CCl)c1ccccc1 Amb8394082 [1,0,0,0,0,0|1,0,2]=4 628 B10R1.15 O[C@H](CF)c1ccccc1 Amb24437736 [1,0,0,0,0,0|1,0,2]=4 629 B10R1.15 O[C@H](CS)c1ccccc1 Amb27494941 [1,0,0,0,0,0|1,0,2]=4 630 B10R1.15 O\N=C(/Cl)c1ccccc1 Amb32411906 [1,0,0,0,0,0|3,0,0]=4 631 B10R1.15 O\N=C(\Cl)c1ccccc1 Amb2684308 [1,0,0,0,0,0|3,0,0]=4 632 B10R1.15 O\N=C(\O)c1ccccc1 Amb17843421 [1,0,0,0,0,0|2,0,1]=4 633 B10R1.15 S=C(CBr)c1ccccc1 Amb27755078 [1,0,0,0,0,0|1,1,0]=3 634 B10R1.15 [NH3+]CC(=O)c1ccccc1 Amb9787668 [1,0,0,0,0,0|1,0,0]=2 635 B10R1.17 BrCC#Cc1ccccc1 Amb26032687 [1,0,0,0,0,0|2,0,1]=4 636 B10R1.17 BrCCCc1ccccc1 Amb2721516 [1,0,0,0,0,0|2,0,1]=4 637 B10R1.17 BrCCOc1ccccc1 Amb1152333 [1,0,0,0,0,0|3,0,0]=4 638 B10R1.17 BrCCSc1ccccc1 Amb6255409 [1,0,0,0,0,0|3,0,0]=4 639 B10R1.17 BrCOCc1ccccc1 Amb27410470 [1,0,0,0,0,0|1,0,1]=3 640 B10R1.17 BrC\C=C\c1ccccc1 Amb8513086 [1,0,0,0,0,0|2,0,0]=3 641 B10R1.17 BrC\C=C\c1ccccn1 Amb28365946 [1,0,0,0,0,0|3,0,0]=4 642 B10R1.17 C#C\C=C\c1ccccc1 Amb33082101 [1,0,0,0,0,0|1,0,2]=4 643 B10R1.17 C=COCc1ccccc1 Amb17940722 [1,0,0,0,0,0|0,0,3]=4 644 B10R1.17 C=C\C=C\c1ccccc1 Amb17938988 [1,0,0,0,0,0|1,0,2]=4 645 B10R1.17 CC=C=Cc1ccccc1 Amb27435633 [1,0,0,0,0,0|1,0,1]=3 646 B10R1.17 CCCC[n+]1ccccc1 Amb8393211 [1,0,0,0,0,0|2,0,1]=4 647 B10R1.17 CCCC[n+]1ccccc1 Amb8516223 [1,0,0,0,0,0|2,0,1]=4 648 B10R1.17 CCCC[n+]1ccccc1 Amb8516227 [1,0,0,0,0,0|2,0,1]=4 649 B10R1.17 CCCC[n+]1ccccc1 Amb8516263 [1,0,0,0,0,0|2,0,1]=4 650 B10R1.17 CCCCc1ccccc1 Amb6608912 [1,0,0,0,0,0|1,0,1]=3 651 B10R1.17 CCCCc1ccccn1 Amb8395993 [1,0,0,0,0,0|2,0,1]=4 652 B10R1.17 CCCCc1cccnc1 Amb4037068 [1,0,0,0,0,0|2,0,1]=4 653 B10R1.17 CCCCc1ccncc1 Amb10555008 [1,0,0,0,0,0|2,0,1]=4 654 B10R1.17 CCCNc1ccccc1 Amb534130 [1,0,0,0,0,0|2,0,0]=3 655 B10R1.17 CCCNc1cccnc1 Amb6686632 [1,0,0,0,0,0|3,0,0]=4 656 B10R1.17 CCCNc1ccncc1 Amb6614447 [1,0,0,0,0,0|3,0,0]=4 657 B10R1.17 CCCOc1ccccc1 Amb2842271 [1,0,0,0,0,0|2,0,0]=3 658 B10R1.17 CCCSc1ccccc1 Amb4014460 [1,0,0,0,0,0|2,0,0]=3 659 B10R1.17 CCCSc1ccccn1 Amb24733306 [1,0,0,0,0,0|3,0,0]=4 660 B10R1.17 CCCSc1ccncc1 Amb28126322 [1,0,0,0,0,0|3,0,0]=4 661 B10R1.17 CCNCc1ccccc1 Amb3699539 [1,0,0,0,0,0|1,0,1]=3 662 B10R1.17 CCNCc1ccccn1 Amb2592098 [1,0,0,0,0,0|2,0,1]=4 663 B10R1.17 CCNCc1cccnc1 Amb21972163 [1,0,0,0,0,0|2,0,1]=4 664 B10R1.17 CCNCc1cccnc1 Amb837759 [1,0,0,0,0,0|2,0,1]=4 665 B10R1.17 CCNCc1ccncc1 Amb1214646 [1,0,0,0,0,0|2,0,1]=4 666 B10R1.17 CCOCc1ccccc1 Amb9787555 [1,0,0,0,0,0|0,0,1]=2 667 B10R1.17 CCOCc1ccccn1 Amb27267027 [1,0,0,0,0,0|1,0,1]=3 668 B10R1.17 CCOCc1ccncc1 Amb27255285 [1,0,0,0,0,0|1,0,1]=3 669 B10R1.17 CCONc1ncccn1 Amb27262264 [1,0,0,0,0,0|3,0,0]=4 670 B10R1.17 CCOSc1ccccc1 Amb28049338 [1,0,0,0,0,0|1,0,0]=2 671 B10R1.17 CCSCc1ccccc1 Amb9787636 [1,0,0,0,0,0|0,1,1]=3 672 B10R1.17 CCSCc1ccccn1 Amb28124640 [1,0,0,0,0,0|1,1,1]=4 673 B10R1.17 CCSCc1cccnc1 Amb26909883 [1,0,0,0,0,0|1,1,1]=4 674 B10R1.17 CCSSc1ccccc1 Amb28057163 [1,0,0,0,0,0|1,1,0]=3 675 B10R1.17 CC\C=C/c1cccnc1 Amb24602371 [1,0,0,0,0,0|2,0,0]=3 676 B10R1.17 CC\C=C\c1ccccc1 Amb17673826 [1,0,0,0,0,0|1,0,0]=2 677 B10R1.17 CC\C=C\c1cccnc1 Amb28076152 [1,0,0,0,0,0|2,0,0]=3 678 B10R1.17 CC\C=N/c1cccnc1 Amb28250076 [1,0,0,0,0,0|3,0,0]=4 679 B10R1.17 CC\N=C\c1ccccc1 Amb10558476 [1,0,0,0,0,0|1,0,0]=2 680 B10R1.17 CC\N=C\c1cccnc1 Amb26548619 [1,0,0,0,0,0|2,0,0]=3 681 B10R1.17 CN=C=Cc1ccccc1 Amb27423885 [1,0,0,0,0,0|2,0,0]=3 682 B10R1.17 CNC#Cc1ccccc1 Amb28422275 [1,0,0,0,0,0|2,0,1]=4 683 B10R1.17 CNCCc1ccccc1 Amb1132990 [1,0,0,0,0,0|2,0,1]=4 684 B10R1.17 CNCCc1ccccc1 Amb33545919 [1,0,0,0,0,0|2,0,1]=4 685 B10R1.17 CNNCc1ccccc1 Amb26859422 [1,0,0,0,0,0|2,0,1]=4 686 B10R1.17 CNNCc1ccccc1 Amb33328543 [1,0,0,0,0,0|2,0,1]=4 687 B10R1.17 CNOCc1ccccc1 Amb22059601 [1,0,0,0,0,0|1,0,1]=3 688 B10R1.17 CNOCc1ccccc1 Amb32412803 [1,0,0,0,0,0|1,0,1]=3 689 B10R1.17 CN\N=C\c1ccccc1 Amb17867553 [1,0,0,0,0,0|2,0,0]=3 690 B10R1.17 CN\N=C\c1cccnc1 Amb28049739 [1,0,0,0,0,0|3,0,0]=4 691 B10R1.17 CN\N=N\c1ccccc1 Amb25720206 [1,0,0,0,0,0|3,0,0]=4 692 B10R1.17 COCCc1ccccc1 Amb4020014 [1,0,0,0,0,0|2,0,1]=4 693 B10R1.17 COCOc1ccccc1 Amb2608594 [1,0,0,0,0,0|3,0,0]=4 694 B10R1.17 CONCc1ccccc1 Amb26432339 [1,0,0,0,0,0|2,0,1]=4 695 B10R1.17 CO\C=C/c1ccncc1 Amb24103279 [1,0,0,0,0,0|3,0,0]=4 696 B10R1.17 CO\C=C\c1ccccc1 Amb22002452 [1,0,0,0,0,0|2,0,0]=3 697 B10R1.17 CO\C=N\c1ccccc1 Amb6297410 [1,0,0,0,0,0|3,0,0]=4 698 B10R1.17 CO\N=C\c1ccccn1 Amb24719324 [1,0,0,0,0,0|3,0,0]=4 699 B10R1.17 CO\N=C\c1cccnc1 Amb26847062 [1,0,0,0,0,0|3,0,0]=4 700 B10R1.17 CO\N=C\c1ccncc1 Amb25173617 [1,0,0,0,0,0|3,0,0]=4 701 B10R1.17 CSCCc1ccccc1 Amb26586093 [1,0,0,0,0,0|2,0,1]=4 702 B10R1.17 CSCNc1ccccc1 Amb25992690 [1,0,0,0,0,0|3,0,0]=4 703 B10R1.17 CSCOc1ccccc1 Amb22231357 [1,0,0,0,0,0|3,0,0]=4 704 B10R1.17 CS\C=C\c1ccccc1 Amb27654244 [1,0,0,0,0,0|2,0,0]=3 705 B10R1.17 C\C=C\Cc1ccccc1 Amb4035140 [1,0,0,0,0,0|1,0,2]=4 706 B10R1.17 C\C=C\Sc1ccccc1 Amb24665698 [1,0,0,0,0,0|2,0,1]=4 707 B10R1.17 C\C=N\Nc1ccccc1 Amb27788878 [1,0,0,0,0,0|2,0,1]=4 708 B10R1.17 C\N=N\C=C1/C=CC=CN1 Amb27468590 [1,0,0,0,0,0|3,0,0]=4 709 B10R1.17 ClCC#Cc1ccccc1 Amb17772264 [1,0,0,0,0,0|2,0,1]=4 710 B10R1.17 ClCCCc1ccccc1 Amb3941487 [1,0,0,0,0,0|2,0,1]=4 711 B10R1.17 ClCCNc1ccccc1 Amb17334388 [1,0,0,0,0,0|3,0,0]=4 712 B10R1.17 ClCCOc1ccccc1 Amb3940573 [1,0,0,0,0,0|3,0,0]=4 713 B10R1.17 ClCCSc1ccccc1 Amb2685910 [1,0,0,0,0,0|3,0,0]=4 714 B10R1.17 ClCOCc1ccccc1 Amb2684626 [1,0,0,0,0,0|1,0,1]=3 715 B10R1.17 ClCOCc1ccccn1 Amb27834619 [1,0,0,0,0,0|2,0,1]=4 716 B10R1.17 ClCSCc1ccccc1 Amb16231183 [1,0,0,0,0,0|1,1,1]=4 717 B10R1.17 ClCSSc1ccccc1 Amb27865461 [1,0,0,0,0,0|2,1,0]=4 718 B10R1.17 ClC\C=C\c1ccccc1 Amb6608898 [1,0,0,0,0,0|2,0,0]=3 719 B10R1.17 ClC\C=C\c1cccnc1 Amb26369517 [1,0,0,0,0,0|3,0,0]=4 720 B10R1.17 ClC\C=C\c1ccncc1 Amb27392424 [1,0,0,0,0,0|3,0,0]=4 721 B10R1.17 FCC#Cc1ccccc1 Amb24586400 [1,0,0,0,0,0|2,0,1]=4 722 B10R1.17 FCCNc1ccccc1 Amb26349791 [1,0,0,0,0,0|3,0,0]=4 723 B10R1.17 FC\C=C\c1ccccc1 Amb27449580 [1,0,0,0,0,0|2,0,0]=3 724 B10R1.17 ICC#Cc1ccccc1 Amb27262163 [1,0,0,0,0,0|2,0,1]=4 725 B10R1.17 ICCCc1ccccc1 Amb10605506 [1,0,0,0,0,0|2,0,1]=4 726 B10R1.17 ICCOc1ccccc1 Amb10608588 [1,0,0,0,0,0|3,0,0]=4 727 B10R1.17 ICCSc1ccccc1 Amb27458209 [1,0,0,0,0,0|3,0,0]=4 728 B10R1.17 ICOCc1ccccc1 Amb28348666 [1,0,0,0,0,0|1,0,1]=3 729 B10R1.17 N#C\C=C\c1ccccc1 Amb1678044 [1,0,0,0,0,0|2,0,1]=4 730 B10R1.17 NCC#Cc1ccccc1 Amb1239477 [1,0,0,0,0,0|2,0,1]=4 731 B10R1.17 NCC#Cc1ccccc1 Amb2371766 [1,0,0,0,0,0|2,0,1]=4 732 B10R1.17 NCCCc1ccccc1 Amb844788 [1,0,0,0,0,0|2,0,1]=4 733 B10R1.17 NCCNc1ccccc1 Amb23412206 [1,0,0,0,0,0|3,0,0]=4 734 B10R1.17 NCCNc1ccccc1 Amb2720312 [1,0,0,0,0,0|3,0,0]=4 735 B10R1.17 NCCOc1ccccc1 Amb1214559 [1,0,0,0,0,0|3,0,0]=4 736 B10R1.17 NCCOc1ccccc1 Amb2099529 [1,0,0,0,0,0|3,0,0]=4 737 B10R1.17 NCCSc1ccccc1 Amb6374305 [1,0,0,0,0,0|3,0,0]=4 738 B10R1.17 NCCSc1ccccc1 Amb6827055 [1,0,0,0,0,0|3,0,0]=4 739 B10R1.17 NC\C=C/c1ccccc1 Amb24746209 [1,0,0,0,0,0|2,0,0]=3 740 B10R1.17 NC\C=C/c1ccccc1 Amb6383106 [1,0,0,0,0,0|2,0,0]=3 741 B10R1.17 NC\C=C\c1ccccc1 Amb16187112 [1,0,0,0,0,0|2,0,0]=3 742 B10R1.17 NC\C=C\c1ccccc1 Amb4019220 [1,0,0,0,0,0|2,0,0]=3 743 B10R1.17 NC\C=C\c1ccccn1 Amb18063261 [1,0,0,0,0,0|3,0,0]=4 744 B10R1.17 NC\C=C\c1cccnc1 Amb18063302 [1,0,0,0,0,0|3,0,0]=4 745 B10R1.17 NC\C=C\c1cccnc1 Amb31148908 [1,0,0,0,0,0|3,0,0]=4 746 B10R1.17 NC\C=C\c1ccncc1 Amb18062333 [1,0,0,0,0,0|3,0,0]=4 747 B10R1.17 O=COCc1ccccc1 Amb4605893 [1,0,0,0,0,0|1,0,2]=4 748 B10R1.17 O=C\C=C/c1ccccc1 Amb20246989 [1,0,0,0,0,0|2,0,1]=4 749 B10R1.17 O=C\C=C\c1ccccc1 Amb2792758 [1,0,0,0,0,0|2,0,1]=4 750 B10R1.17 OCC#Cc1ccccc1 Amb534712 [1,0,0,0,0,0|2,0,1]=4 751 B10R1.17 OCCCc1ccccc1 Amb3939054 [1,0,0,0,0,0|2,0,1]=4 752 B10R1.17 OCCNc1ccccc1 Amb3940335 [1,0,0,0,0,0|3,0,0]=4 753 B10R1.17 OCCOc1ccccc1 Amb2209344 [1,0,0,0,0,0|3,0,0]=4 754 B10R1.17 OCOCc1ccccc1 Amb25727798 [1,0,0,0,0,0|1,0,1]=3 755 B10R1.17 OCSCc1ccccc1 Amb27839241 [1,0,0,0,0,0|1,1,1]=4 756 B10R1.17 OC\C=C/c1ccccn1 Amb26391968 [1,0,0,0,0,0|3,0,0]=4 757 B10R1.17 OC\C=C/c1ccncc1 Amb27617653 [1,0,0,0,0,0|3,0,0]=4 758 B10R1.17 OC\C=C\c1ccccc1 Amb7809230 [1,0,0,0,0,0|2,0,0]=3 759 B10R1.17 OC\C=C\c1ccccn1 Amb22749315 [1,0,0,0,0,0|3,0,0]=4 760 B10R1.17 OC\C=C\c1cccnc1 Amb17619713 [1,0,0,0,0,0|3,0,0]=4 761 B10R1.17 OC\C=C\c1ccncc1 Amb22749186 [1,0,0,0,0,0|3,0,0]=4 762 B10R1.17 SCC#Cc1ccccc1 Amb27454293 [1,0,0,0,0,0|2,0,1]=4 763 B10R1.17 SCCCc1ccccc1 Amb6255807 [1,0,0,0,0,0|2,0,1]=4 764 B10R1.17 SCCOc1ccccc1 Amb2794986 [1,0,0,0,0,0|3,0,0]=4 765 B10R1.17 SCCSc1ccccc1 Amb13881734 [1,0,0,0,0,0|3,0,0]=4 766 B10R1.17 SC\C=C\c1ccccc1 Amb6255720 [1,0,0,0,0,0|2,0,0]=3 767 B10R1.17 [SiH3]CCCc1ccccc1 Amb22347053 [1,0,0,0,0,0|1,1,1]=4 768 B12R1.3 C#C\C(=C\CO)c1ccccc1 Amb27829961 [0,1,0,0,0,0|3,0,0]=4 769 B12R1.3 C=C\C(=C/CCl)c1ccccc1 Amb27865659 [0,1,0,0,0,0|3,0,0]=4 770 B12R1.3 CC=C=C(CO)c1ccccc1 Amb27978491 [0,1,0,0,0,0|1,0,2]=4 771 B12R1.3 CCCC(C#N)c1ccccc1 Amb2720802 [0,1,0,0,0,0|2,0,1]=4 772 B12R1.3 CCCC(C=O)c1ccccc1 Amb17594046 [0,1,0,0,0,0|1,0,1]=3 773 B12R1.3 CCCC(CBr)c1ccccc1 Amb17247626 [0,1,0,0,0,0|2,0,1]=4 774 B12R1.3 CCCC(CC)c1ccccc1 Amb9787575 [0,1,0,0,0,0|2,0,1]=4 775 B12R1.3 CCCC(CCl)c1ccccc1 Amb17233968 [0,1,0,0,0,0|2,0,1]=4 776 B12R1.3 CCCC(CN)c1ccccc1 Amb8950183 [0,1,0,0,0,0|2,0,1]=4 777 B12R1.3 CCCC(CO)c1ccccc1 Amb17232487 [0,1,0,0,0,0|1,0,2]=4 778 B12R1.3 CCCN(C#N)c1ccccc1 Amb27434318 [0,1,0,0,0,0|3,0,0]=4 779 B12R1.3 CCC\C(=N\N)c1ccccc1 Amb27649935 [0,1,0,0,0,0|2,0,0]=3 780 B12R1.3 CCC\C(=N\N)c1ccccn1 Amb28201662 [0,1,0,0,0,0|3,0,0]=4 781 B12R1.3 CCC\C(=N\O)c1ccccc1 Amb27979178 [0,1,0,0,0,0|1,0,1]=3 782 B12R1.3 CCNC(C#N)c1ccccc1 Amb22736556 [0,1,0,0,0,0|2,0,1]=4 783 B12R1.3 CCNC(C#N)c1ccccc1 Amb7761469 [0,1,0,0,0,0|2,0,1]=4 784 B12R1.3 CCNC(CC)c1ccccc1 Amb9721097 [0,1,0,0,0,0|2,0,1]=4 785 B12R1.3 CCNC(CO)c1ccccc1 Amb6739961 [0,1,0,0,0,0|1,0,2]=4 786 B12R1.3 CCN[C@@H](CO)c1ccccc1 Amb22745949 [0,1,0,0,0,0|1,0,2]=4 787 B12R1.3 CCN\C(=N\C)c1ccccc1 Amb26858373 [0,1,0,0,0,0|2,0,0]=3 788 B12R1.3 CCN\C(=N\Cl)c1ccccc1 Amb28252173 [0,1,0,0,0,0|2,0,0]=3 789 B12R1.3 CCN\C(=N\N)c1ccccn1 Amb18788296 [0,1,0,0,0,0|3,0,0]=4 790 B12R1.3 CCN\C(=N\O)c1ccccc1 Amb27866255 [0,1,0,0,0,0|1,0,1]=3 791 B12R1.3 CCN\C(=N\O)c1ccccn1 Amb27614621 [0,1,0,0,0,0|2,0,1]=4 792 B12R1.3 CCOC(C#N)c1ccccc1 Amb27828457 [0,1,0,0,0,0|1,0,1]=3 793 B12R1.3 CCOC(CBr)c1ccccc1 Amb33348513 [0,1,0,0,0,0|1,0,1]=3 794 B12R1.3 CCOC(CI)c1ccccc1 Amb33349128 [0,1,0,0,0,0|1,0,1]=3 795 B12R1.3 CCOC(CN)c1ccccc1 Amb17605997 [0,1,0,0,0,0|1,0,1]=3 796 B12R1.3 CCOC(CN)c1ccccc1 Amb33447126 [0,1,0,0,0,0|1,0,1]=3 797 B12R1.3 CCO\C(=C/Cl)c1ccccc1 Amb28365649 [0,1,0,0,0,0|1,0,0]=2 798 B12R1.3 CCO\C(=C\Cl)c1ccccc1 Amb28052050 [0,1,0,0,0,0|1,0,0]=2 799 B12R1.3 CC\C(=N\NC)c1ccccc1 Amb27757106 [0,1,0,0,0,0|3,0,0]=4 800 B12R1.3 CC\C=C(/C#N)c1ccccc1 Amb17232217 [0,1,0,0,0,0|2,0,0]=3 801 B12R1.3 CC\C=C(\C#N)c1ccccn1 Amb28241134 [0,1,0,0,0,0|3,0,0]=4 802 B12R1.3 CC\C=C(\C=O)c1ccccc1 Amb10807890 [0,1,0,0,0,0|1,0,0]=2 803 B12R1.3 CN\C(=N\OC)c1ccccc1 Amb24519522 [0,1,0,0,0,0|3,0,0]=4 804 B12R1.3 CN\C=C(\C#N)c1ccccc1 Amb27211595 [0,1,0,0,0,0|3,0,0]=4 805 B12R1.3 COC\C(=N\O)c1ccccc1 Amb27770752 [0,1,0,0,0,0|2,0,1]=4 806 B12R1.3 CO\C=C(/C=O)c1ccccc1 Amb18126326 [0,1,0,0,0,0|2,0,0]=3 807 B12R1.3 CO\N=C(/C=O)c1ccccc1 Amb10572536 [0,1,0,0,0,0|2,0,0]=3 808 B12R1.3 CO\N=C(\C=O)c1ccccc1 Amb27440030 [0,1,0,0,0,0|2,0,0]=3 809 B12R1.3 CSC\C(=N\N)c1ccccc1 Amb28316277 [0,1,0,0,0,0|3,0,0]=4 810 B12R1.3 CS\C=C(\CO)c1ccccc1 Amb27831038 [0,1,0,0,0,0|2,0,1]=4 811 B12R1.3 N#C\C(=C\CO)c1ccccc1 Amb27197973 [0,1,0,0,0,0|3,0,0]=4 812 B12R1.3 NC\C(=C\CBr)c1ccccc1 Amb28294157 [0,1,0,0,0,0|3,0,0]=4 813 B12R1.3 NC\C(=C\CCl)c1ccccc1 Amb27658977 [0,1,0,0,0,0|3,0,0]=4 814 B12R1.3 O=C\C(=C/NO)c1ccccc1 Amb17777667 [0,1,0,0,0,0|3,0,0]=4 815 B12R1.3 [C-]#[N+]\C(=C\NC)c1ccccc1 Amb26078141 [0,1,0,0,0,0|3,0,0]=4 816 B12R1.16 C#CCC(=O)c1ccc(Cl)cc1 Amb18809130 [0,1,0,0,0,0|1,0,2]=4 817 B12R1.16 C#CCC(=O)c1ccc(I)cc1 Amb27392668 [0,1,0,0,0,0|1,0,2]=4 818 B12R1.16 C=C(CCC)c1ccc(C)cc1 Amb27639357 [0,1,0,0,0,0|2,0,0]=3 819 B12R1.16 C=C(CCN)c1ccc(Br)cc1 Amb33451499 [0,1,0,0,0,0|3,0,0]=4 820 B12R1.16 C=C(CCN)c1ccc(C)cc1 Amb33318535 [0,1,0,0,0,0|3,0,0]=4 821 B12R1.16 C=C(CCN)c1ccc(Cl)cc1 Amb33052824 [0,1,0,0,0,0|3,0,0]=4 822 B12R1.16 C=C(CCN)c1ccc(F)cc1 Amb33375942 [0,1,0,0,0,0|3,0,0]=4 823 B12R1.16 C=C(CCN)c1ccc(O)cc1 Amb33268370 [0,1,0,0,0,0|3,0,0]=4 824 B12R1.16 C=C(CCO)c1ccc(Cl)cc1 Amb25760753 [0,1,0,0,0,0|3,0,0]=4 825 B12R1.16 C=C(CCO)c1ccc(F)cc1 Amb27471973 [0,1,0,0,0,0|3,0,0]=4 826 B12R1.16 C=C(OCC)c1ccc(Br)nn1 Amb33135786 [0,1,0,0,0,0|3,0,0]=4 827 B12R1.16 C=C(OCC)c1ccc(Cl)nn1 Amb26961882 [0,1,0,0,0,0|3,0,0]=4 828 B12R1.16 C=C(OCC)c1ccc(N)cc1 Amb33136036 [0,1,0,0,0,0|1,0,0]=2 829 B12R1.16 C=C(OCC)c1ccc(N)cn1 Amb33136186 [0,1,0,0,0,0|2,0,0]=3 830 B12R1.16 C=C(OCC)c1ccc(N)nc1 Amb33135834 [0,1,0,0,0,0|2,0,0]=3 831 B12R1.16 C=C(OCC)c1ccc(N)nn1 Amb33135938 [0,1,0,0,0,0|3,0,0]=4 832 B12R1.16 C=C(OCC)c1ccc(O)cc1 Amb33135802 [0,1,0,0,0,0|1,0,0]=2 833 B12R1.16 C=C(OCC)c1ccc(O)cn1 Amb33136318 [0,1,0,0,0,0|2,0,0]=3 834 B12R1.16 C=C(OCC)c1cnc(Br)cn1 Amb24675425 [0,1,0,0,0,0|3,0,0]=4 835 B12R1.16 C=C(OCC)c1cnc(Cl)cn1 Amb26391240 [0,1,0,0,0,0|3,0,0]=4 836 B12R1.16 C=C(OCC)c1cnc(F)nc1 Amb33135760 [0,1,0,0,0,0|3,0,0]=4 837 B12R1.16 C=C(OCC)c1cnc(N)cn1 Amb33135836 [0,1,0,0,0,0|3,0,0]=4 838 B12R1.16 C=C(OCC)c1cnc(N)nc1 Amb33136340 [0,1,0,0,0,0|3,0,0]=4 839 B12R1.16 C=CCC(=O)c1ccc(Br)cc1 Amb17343203 [0,1,0,0,0,0|1,0,2]=4 840 B12R1.16 C=CCC(=O)c1ccc(C)cc1 Amb10563159 [0,1,0,0,0,0|1,0,2]=4 841 B12R1.16 C=CCC(=O)c1ccc(Cl)cc1 Amb17335459 [0,1,0,0,0,0|1,0,2]=4 842 B12R1.16 C=CCC(=O)c1ccc(F)cc1 Amb17334601 [0,1,0,0,0,0|1,0,2]=4 843 B12R1.16 C=CCC(=O)c1ccc(I)cc1 Amb27171953 [0,1,0,0,0,0|1,0,2]=4 844 B12R1.16 C=CCC(=O)c1ccc(O)cc1 Amb17334557 [0,1,0,0,0,0|1,0,2]=4 845 B12R1.16 C=COC(=O)c1ccc(O)cc1 Amb18645955 [0,1,0,0,0,0|0,0,2]=3 846 B12R1.16 CC#CC(=O)c1ccc(Cl)cc1 Amb27176169 [0,1,0,0,0,0|1,0,1]=3 847 B12R1.16 CCCC(=O)c1ccc(Br)cc1 Amb2567820 [0,1,0,0,0,0|1,0,0]=2 848 B12R1.16 CCCC(=O)c1ccc(Br)cn1 Amb28125218 [0,1,0,0,0,0|2,0,0]=3 849 B12R1.16 CCCC(=O)c1ccc(C)cc1 Amb3940678 [0,1,0,0,0,0|1,0,0]=2 850 B12R1.16 CCCC(=O)c1ccc(Cl)cc1 Amb1679791 [0,1,0,0,0,0|1,0,0]=2 851 B12R1.16 CCCC(=O)c1ccc(Cl)cn1 Amb27800726 [0,1,0,0,0,0|2,0,0]=3 852 B12R1.16 CCCC(=O)c1ccc(Cl)nc1 Amb20242050 [0,1,0,0,0,0|2,0,0]=3 853 B12R1.16 CCCC(=O)c1ccc(F)cc1 Amb4020581 [0,1,0,0,0,0|1,0,0]=2 854 B12R1.16 CCCC(=O)c1ccc(F)cn1 Amb28041902 [0,1,0,0,0,0|2,0,0]=3 855 B12R1.16 CCCC(=O)c1ccc(I)cc1 Amb4013959 [0,1,0,0,0,0|1,0,0]=2 856 B12R1.16 CCCC(=O)c1ccc(N)cc1 Amb2684368 [0,1,0,0,0,0|1,0,0]=2 857 B12R1.16 CCCC(=O)c1ccc(O)cc1 Amb1033062 [0,1,0,0,0,0|1,0,0]=2 858 B12R1.16 CCCC(=O)c1cnc(C)cn1 Amb28127038 [0,1,0,0,0,0|3,0,0]=4 859 B12R1.16 CCCC(=O)c1ncc(Br)cn1 Amb28252168 [0,1,0,0,0,0|3,0,0]=4 860 B12R1.16 CCCC(Br)c1ccc(Br)cc1 Amb27976372 [0,1,0,0,0,0|2,0,1]=4 861 B12R1.16 CCCC(C)c1ccc(O)cc1 Amb17594074 [0,1,0,0,0,0|2,0,1]=4 862 B12R1.16 CCCC(Cl)c1ccc(C)cc1 Amb17139051 [0,1,0,0,0,0|2,0,1]=4 863 B12R1.16 CCCC(Cl)c1ccc(Cl)cc1 Amb17139906 [0,1,0,0,0,0|2,0,1]=4 864 B12R1.16 CCCC(Cl)c1ccc(F)cc1 Amb17139162 [0,1,0,0,0,0|2,0,1]=4 865 B12R1.16 CCCC(N)c1ccc(Br)cc1 Amb6255527 [0,1,0,0,0,0|2,0,1]=4 866 B12R1.16 CCCC(N)c1ccc(C)cc1 Amb6256136 [0,1,0,0,0,0|2,0,1]=4 867 B12R1.16 CCCC(N)c1ccc(Cl)cc1 Amb20626143 [0,1,0,0,0,0|2,0,1]=4 868 B12R1.16 CCCC(N)c1ccc(Cl)cc1 Amb9717984 [0,1,0,0,0,0|2,0,1]=4 869 B12R1.16 CCCC(N)c1ccc(F)cc1 Amb9717477 [0,1,0,0,0,0|2,0,1]=4 870 B12R1.16 CCCC(N)c1ccc(N)cc1 Amb27476459 [0,1,0,0,0,0|2,0,1]=4 871 B12R1.16 CCCC(N)c1ccc(O)cc1 Amb18939625 [0,1,0,0,0,0|2,0,1]=4 872 B12R1.16 CCCC(N)c1ccc(S)cc1 Amb27214632 [0,1,0,0,0,0|2,0,1]=4 873 B12R1.16 CCCC(O)c1ccc(Br)cc1 Amb4011737 [0,1,0,0,0,0|1,0,2]=4 874 B12R1.16 CCCC(O)c1ccc(C)cc1 Amb4035735 [0,1,0,0,0,0|1,0,2]=4 875 B12R1.16 CCCC(O)c1ccc(Cl)cc1 Amb4035851 [0,1,0,0,0,0|1,0,2]=4 876 B12R1.16 CCCC(O)c1ccc(F)cc1 Amb4036341 [0,1,0,0,0,0|1,0,2]=4 877 B12R1.16 CCCC(O)c1ccc(O)cc1 Amb27226065 [0,1,0,0,0,0|1,0,2]=4 878 B12R1.16 CCCC(S)c1ccc(Cl)cc1 Amb32788871 [0,1,0,0,0,0|1,1,1]=4 879 B12R1.16 CCCN(C)c1ccc(Cl)cc1 Amb27804750 [0,1,0,0,0,0|3,0,0]=4 880 B12R1.16 CCCN(C)c1ccc(F)cc1 Amb27653560 [0,1,0,0,0,0|3,0,0]=4 881 B12R1.16 CCCN(C)c1ccc(O)cc1 Amb28064673 [0,1,0,0,0,0|3,0,0]=4 882 B12R1.16 CCCS(=O)c1ccc(N)cc1 Amb18977331 [0,1,0,0,0,0|2,0,0]=3 883 B12R1.16 CCC[C@@H](N)c1ccc(C)cc1 Amb27259101 [0,1,0,0,0,0|2,0,1]=4 884 B12R1.16 CCC[C@@H](N)c1ccc(F)cc1 Amb22298535 [0,1,0,0,0,0|2,0,1]=4 885 B12R1.16 CCC[C@@H](O)c1ccc(Cl)cc1 Amb27834099 [0,1,0,0,0,0|1,0,2]=4 886 B12R1.16 CCC[C@H](N)c1ccc(Br)cc1 Amb27871377 [0,1,0,0,0,0|2,0,1]=4 887 B12R1.16 CCC[C@H](N)c1ccc(F)cc1 Amb22298578 [0,1,0,0,0,0|2,0,1]=4 888 B12R1.16 CCC[C@H](N)c1ccc(F)cc1 Amb24700451 [0,1,0,0,0,0|2,0,1]=4 889 B12R1.16 CCC[C@H](N)c1ccc(O)cc1 Amb27461355 [0,1,0,0,0,0|2,0,1]=4 890 B12R1.16 CCC[C@H](O)c1ccc(Br)cc1 Amb27752379 [0,1,0,0,0,0|1,0,2]=4 891 B12R1.16 CCNC(=N)c1ccc(Br)cc1 Amb8480354 [0,1,0,0,0,0|2,0,0]=3 892 B12R1.16 CCNC(=N)c1ccc(C)cc1 Amb28066438 [0,1,0,0,0,0|2,0,0]=3 893 B12R1.16 CCNC(=N)c1ccc(F)cc1 Amb27598915 [0,1,0,0,0,0|2,0,0]=3 894 B12R1.16 CCNC(=N)c1ccc(F)cn1 Amb27748586 [0,1,0,0,0,0|3,0,0]=4 895 B12R1.16 CCNC(=N)c1ccc(N)cc1 Amb27461687 [0,1,0,0,0,0|2,0,0]=3 896 B12R1.16 CCNC(=N)c1ccc(O)nc1 Amb35675416 [0,1,0,0,0,0|3,0,0]=4 897 B12R1.16 CCNC(=O)c1cc[n+]([O-])cc1 Amb27804732 [0,1,0,0,0,0|2,0,0]=3 898 B12R1.16 CCNC(=O)c1ccc(Br)cc1 Amb6264373 [0,1,0,0,0,0|1,0,0]=2 899 B12R1.16 CCNC(=O)c1ccc(Br)cn1 Amb10068170 [0,1,0,0,0,0|2,0,0]=3 900 B12R1.16 CCNC(=O)c1ccc(Br)nc1 Amb19959846 [0,1,0,0,0,0|2,0,0]=3 901 B12R1.16 CCNC(=O)c1ccc(C)cn1 Amb27833325 [0,1,0,0,0,0|2,0,0]=3 902 B12R1.16 CCNC(=O)c1ccc(Cl)cn1 Amb27401922 [0,1,0,0,0,0|2,0,0]=3 903 B12R1.16 CCNC(=O)c1ccc(Cl)nc1 Amb6245899 [0,1,0,0,0,0|2,0,0]=3 904 B12R1.16 CCNC(=O)c1ccc(Cl)nn1 Amb19058323 [0,1,0,0,0,0|3,0,0]=4 905 B12R1.16 CCNC(=O)c1ccc(F)cc1 Amb17775265 [0,1,0,0,0,0|1,0,0]=2 906 B12R1.16 CCNC(=O)c1ccc(F)nc1 Amb27954389 [0,1,0,0,0,0|2,0,0]=3 907 B12R1.16 CCNC(=O)c1ccc(I)cc1 Amb6436078 [0,1,0,0,0,0|1,0,0]=2 908 B12R1.16 CCNC(=O)c1ccc(N)cc1 Amb6369720 [0,1,0,0,0,0|1,0,0]=2 909 B12R1.16 CCNC(=O)c1ccc(N)cn1 Amb27268152 [0,1,0,0,0,0|2,0,0]=3 910 B12R1.16 CCNC(=O)c1ccc(N)nc1 Amb18284692 [0,1,0,0,0,0|2,0,0]=3 911 B12R1.16 CCNC(=O)c1ccc(O)cc1 Amb6671675 [0,1,0,0,0,0|1,0,0]=2 912 B12R1.16 CCNC(=O)c1ccc(S)nn1 Amb28186411 [0,1,0,0,0,0|3,0,0]=4 913 B12R1.16 CCNC(=O)c1cnc(C)cn1 Amb27199218 [0,1,0,0,0,0|3,0,0]=4 914 B12R1.16 CCNC(=O)c1cnc(Cl)cn1 Amb26436637 [0,1,0,0,0,0|3,0,0]=4 915 B12R1.16 CCNC(=O)c1ncc(Br)cn1 Amb26067041 [0,1,0,0,0,0|3,0,0]=4 916 B12R1.16 CCNC(C)c1ccc(Br)cc1 Amb1095032 [0,1,0,0,0,0|2,0,1]=4 917 B12R1.16 CCNC(C)c1ccc(Br)cc1 Amb5716086 [0,1,0,0,0,0|2,0,1]=4 918 B12R1.16 CCNC(C)c1ccc(F)cc1 Amb10188230 [0,1,0,0,0,0|2,0,1]=4 919 B12R1.16 CCNC(C)c1ccc(F)cc1 Amb9728805 [0,1,0,0,0,0|2,0,1]=4 920 B12R1.16 CCNC(C)c1ccc(O)cc1 Amb6268123 [0,1,0,0,0,0|2,0,1]=4 921 B12R1.16 CCNC(C)c1ccc(S)cc1 Amb27591497 [0,1,0,0,0,0|2,0,1]=4 922 B12R1.16 CCNS(=O)c1ccc(N)cc1 Amb18863098 [0,1,0,0,0,0|2,0,0]=3 923 B12R1.16 CCN[C@@H](C)c1ccc(Br)cc1 Amb28349963 [0,1,0,0,0,0|2,0,1]=4 924 B12R1.16 CCN[C@@H](C)c1ccc(F)cc1 Amb27955045 [0,1,0,0,0,0|2,0,1]=4 925 B12R1.16 CCOC(=N)C1=CNC(=O)C=C1 Amb35593409 [0,1,0,0,0,0|2,0,0]=3 926 B12R1.16 CCOC(=N)c1cc[n+]([O-])cc1 Amb24654829 [0,1,0,0,0,0|2,0,0]=3 927 B12R1.16 CCOC(=N)c1ccc(Br)cc1 Amb20673144 [0,1,0,0,0,0|1,0,0]=2 928 B12R1.16 CCOC(=N)c1ccc(Br)cn1 Amb27266062 [0,1,0,0,0,0|2,0,0]=3 929 B12R1.16 CCOC(=N)c1ccc(C)cc1 Amb20673131 [0,1,0,0,0,0|1,0,0]=2 930 B12R1.16 CCOC(=N)c1ccc(Cl)cc1 Amb20673139 [0,1,0,0,0,0|1,0,0]=2 931 B12R1.16 CCOC(=N)c1ccc(Cl)nc1 Amb28046865 [0,1,0,0,0,0|2,0,0]=3 932 B12R1.16 CCOC(=N)c1ccc(F)cc1 Amb10072702 [0,1,0,0,0,0|1,0,0]=2 933 B12R1.16 CCOC(=N)c1ccc(O)cc1 Amb18798395 [0,1,0,0,0,0|1,0,0]=2 934 B12R1.16 CCOC(=N)c1ccc(O)cc1 Amb9786531 [0,1,0,0,0,0|1,0,0]=2 935 B12R1.16 CCOC(=N)c1cnc(C)cn1 Amb35638006 [0,1,0,0,0,0|3,0,0]=4 936 B12R1.16 CCOC(=N)c1ncc(C)cn1 Amb27770280 [0,1,0,0,0,0|3,0,0]=4 937 B12R1.16 CCOC(=O)C1=CNC(=O)C=C1 Amb20240866 [0,1,0,0,0,0|1,0,0]=2 938 B12R1.16 CCOC(=O)C1=CNC(=O)N=C1 Amb22015202 [0,1,0,0,0,0|2,0,0]=3 939 B12R1.16 CCOC(=O)C1=CNC(=O)NC1 Amb8467870 [0,1,0,0,0,0|2,0,1]=4 940 B12R1.16 CCOC(=O)C1=CNC(=O)SC1 Amb27751282 [0,1,0,0,0,0|2,0,1]=4 941 B12R1.16 CCOC(=O)C1=CNC(=S)C=C1 Amb19373085 [0,1,0,0,0,0|1,0,0]=2 942 B12R1.16 CCOC(=O)C1=CNC(=S)N=C1 Amb22490832 [0,1,0,0,0,0|2,0,0]=3 943 B12R1.16 CCOC(=O)C1=COC(=O)C=C1 Amb28292886 [0,1,0,0,0,0|1,0,0]=2 944 B12R1.16 CCOC(=O)C1=NNC(=O)C=C1 Amb18003087 [0,1,0,0,0,0|2,0,0]=3 945 B12R1.16 CCOC(=O)C1C=CC(=O)CC1 Amb24117007 [0,1,0,0,0,0|0,0,3]=4 946 B12R1.16 CCOC(=O)N1C=CC(=O)CC1 Amb25340967 [0,1,0,0,0,0|1,0,2]=4 947 B12R1.16 CCOC(=O)c1cc[n+](C)cc1 Amb22263420 [0,1,0,0,0,0|1,0,0]=2 948 B12R1.16 CCOC(=O)c1cc[n+]([O-])cc1 Amb21961771 [0,1,0,0,0,0|1,0,0]=2 949 B12R1.16 CCOC(=O)c1ccc(Br)cc1 Amb3939194 [0,1,0,0,0,0|0,0,0]=1 950 B12R1.16 CCOC(=O)c1ccc(Br)cn1 Amb8395930 [0,1,0,0,0,0|1,0,0]=2 951 B12R1.16 CCOC(=O)c1ccc(Br)nc1 Amb8947701 [0,1,0,0,0,0|1,0,0]=2 952 B12R1.16 CCOC(=O)c1ccc(Br)nn1 Amb27148653 [0,1,0,0,0,0|2,0,0]=3 953 B12R1.16 CCOC(=O)c1ccc(C)cc1 Amb2725523 [0,1,0,0,0,0|0,0,0]=1 954 B12R1.16 CCOC(=O)c1ccc(C)cn1 Amb19958117 [0,1,0,0,0,0|1,0,0]=2 955 B12R1.16 CCOC(=O)c1ccc(C)nc1 Amb9273960 [0,1,0,0,0,0|1,0,0]=2 956 B12R1.16 CCOC(=O)c1ccc(C)nn1 Amb17798485 [0,1,0,0,0,0|2,0,0]=3 957 B12R1.16 CCOC(=O)c1ccc(Cl)cc1 Amb2793041 [0,1,0,0,0,0|0,0,0]=1 958 B12R1.16 CCOC(=O)c1ccc(Cl)cn1 Amb6384304 [0,1,0,0,0,0|1,0,0]=2 959 B12R1.16 CCOC(=O)c1ccc(Cl)nc1 Amb2726033 [0,1,0,0,0,0|1,0,0]=2 960 B12R1.16 CCOC(=O)c1ccc(Cl)nn1 Amb5794288 [0,1,0,0,0,0|2,0,0]=3 961 B12R1.16 CCOC(=O)c1ccc(F)cc1 Amb2687854 [0,1,0,0,0,0|0,0,0]=1 962 B12R1.16 CCOC(=O)c1ccc(F)cn1 Amb19930070 [0,1,0,0,0,0|1,0,0]=2 963 B12R1.16 CCOC(=O)c1ccc(I)cc1 Amb2687872 [0,1,0,0,0,0|0,0,0]=1 964 B12R1.16 CCOC(=O)c1ccc(I)cn1 Amb23412377 [0,1,0,0,0,0|1,0,0]=2 965 B12R1.16 CCOC(=O)c1ccc(I)nc1 Amb26542066 [0,1,0,0,0,0|1,0,0]=2 966 B12R1.16 CCOC(=O)c1ccc(N)cc1 Amb1196078 [0,1,0,0,0,0|0,0,0]=1 967 B12R1.16 CCOC(=O)c1ccc(N)cc1 Amb6383639 [0,1,0,0,0,0|0,0,0]=1 968 B12R1.16 CCOC(=O)c1ccc(N)cn1 Amb18646487 [0,1,0,0,0,0|1,0,0]=2 969 B12R1.16 CCOC(=O)c1ccc(N)cn1 Amb32665760 [0,1,0,0,0,0|1,0,0]=2 970 B12R1.16 CCOC(=O)c1ccc(N)nc1 Amb8385708 [0,1,0,0,0,0|1,0,0]=2 971 B12R1.16 CCOC(=O)c1ccc(N)nn1 Amb17739970 [0,1,0,0,0,0|2,0,0]=3 972 B12R1.16 CCOC(=O)c1ccc(O)cc1 Amb6355859 [0,1,0,0,0,0|0,0,0]=1 973 B12R1.16 CCOC(=O)c1ccc(O)cn1 Amb22490288 [0,1,0,0,0,0|1,0,0]=2 974 B12R1.16 CCOC(=O)c1ccc(O)nc1 Amb8397235 [0,1,0,0,0,0|1,0,0]=2 975 B12R1.16 CCOC(=O)c1ccc(O)nn1 Amb10879437 [0,1,0,0,0,0|2,0,0]=3 976 B12R1.16 CCOC(=O)c1ccc(S)cc1 Amb25263975 [0,1,0,0,0,0|0,0,0]=1 977 B12R1.16 CCOC(=O)c1ccc(S)nn1 Amb10879438 [0,1,0,0,0,0|2,0,0]=3 978 B12R1.16 CCOC(=O)c1cnc(Br)cn1 Amb19957595 [0,1,0,0,0,0|2,0,0]=3 979 B12R1.16 CCOC(=O)c1cnc(Br)nc1 Amb24432526 [0,1,0,0,0,0|2,0,0]=3 980 B12R1.16 CCOC(=O)c1cnc(C)cn1 Amb18801006 [0,1,0,0,0,0|2,0,0]=3 981 B12R1.16 CCOC(=O)c1cnc(C)nc1 Amb8397256 [0,1,0,0,0,0|2,0,0]=3 982 B12R1.16 CCOC(=O)c1cnc(C)nn1 Amb27868834 [0,1,0,0,0,0|3,0,0]=4 983 B12R1.16 CCOC(=O)c1cnc(Cl)cn1 Amb21964837 [0,1,0,0,0,0|2,0,0]=3 984 B12R1.16 CCOC(=O)c1cnc(Cl)nc1 Amb17621544 [0,1,0,0,0,0|2,0,0]=3 985 B12R1.16 CCOC(=O)c1cnc(F)nc1 Amb27192374 [0,1,0,0,0,0|2,0,0]=3 986 B12R1.16 CCOC(=O)c1cnc(N)cn1 Amb16232001 [0,1,0,0,0,0|2,0,0]=3 987 B12R1.16 CCOC(=O)c1cnc(N)nc1 Amb2697547 [0,1,0,0,0,0|2,0,0]=3 988 B12R1.16 CCOC(=O)c1cnc(O)cn1 Amb21964496 [0,1,0,0,0,0|2,0,0]=3 989 B12R1.16 CCOC(=O)c1ncc(Br)cn1 Amb17935844 [0,1,0,0,0,0|2,0,0]=3 990 B12R1.16 CCOC(=O)c1ncc(C)cn1 Amb22490769 [0,1,0,0,0,0|2,0,0]=3 991 B12R1.16 CCOC(=O)c1ncc(Cl)cn1 Amb23439140 [0,1,0,0,0,0|2,0,0]=3 992 B12R1.16 CCOC(=O)c1ncc(F)cn1 Amb24485438 [0,1,0,0,0,0|2,0,0]=3 993 B12R1.16 CCOC(=O)c1ncc(N)cn1 Amb23412488 [0,1,0,0,0,0|2,0,0]=3 994 B12R1.16 CCOC(=O)c1ncc(O)cn1 Amb22499473 [0,1,0,0,0,0|2,0,0]=3 995 B12R1.16 CCOC(C)c1ccc(I)cc1 Amb33512232 [0,1,0,0,0,0|1,0,1]=3 996 B12R1.16 CCON(C)c1ccc(Br)cn1 Amb27626819 [0,1,0,0,0,0|3,0,0]=4 997 B12R1.16 CCON(C)c1ccc(N)cc1 Amb27789813 [0,1,0,0,0,0|2,0,0]=3 998 B12R1.16 CCON(C)c1ccc(N)cn1 Amb27788092 [0,1,0,0,0,0|3,0,0]=4 999 B12R1.16 CCOS(=O)c1ccc(Cl)cc1 Amb25114237 [0,1,0,0,0,0|1,0,0]=2 1000 B12R1.16 CCO[PH](=O)c1ccc(F)cc1 Amb28318191 [0,1,0,0,0,0|1,0,0]=2 1001 B12R1.16 CCSC(C)c1ccc(F)cc1 Amb28206909 [0,1,0,0,0,0|1,1,1]=4 1002 B12R1.16 CC\C=C(\Cl)c1ccc(F)cc1 Amb27800091 [0,1,0,0,0,0|2,0,0]=3 1003 B12R1.16 CNCC(=O)c1ccc(Br)cc1 Amb17248090 [0,1,0,0,0,0|2,0,0]=3 1004 B12R1.16 CNCC(=O)c1ccc(Br)cn1 Amb33477130 [0,1,0,0,0,0|3,0,0]=4 1005 B12R1.16 CNCC(=O)c1ccc(Br)nc1 Amb33387717 [0,1,0,0,0,0|3,0,0]=4 1006 B12R1.16 CNCC(=O)c1ccc(C)cc1 Amb17232427 [0,1,0,0,0,0|2,0,0]=3 1007 B12R1.16 CNCC(=O)c1ccc(C)cn1 Amb33199156 [0,1,0,0,0,0|3,0,0]=4 1008 B12R1.16 CNCC(=O)c1ccc(C)nc1 Amb25154107 [0,1,0,0,0,0|3,0,0]=4 1009 B12R1.16 CNCC(=O)c1ccc(Cl)cc1 Amb2777315 [0,1,0,0,0,0|2,0,0]=3 1010 B12R1.16 CNCC(=O)c1ccc(Cl)nc1 Amb33261546 [0,1,0,0,0,0|3,0,0]=4 1011 B12R1.16 CNCC(=O)c1ccc(F)cc1 Amb17232631 [0,1,0,0,0,0|2,0,0]=3 1012 B12R1.16 CNCC(=O)c1ccc(F)cc1 Amb24121219 [0,1,0,0,0,0|2,0,0]=3 1013 B12R1.16 CNCC(=O)c1ccc(F)cn1 Amb28199191 [0,1,0,0,0,0|3,0,0]=4 1014 B12R1.16 CNCC(=O)c1ccc(F)nc1 Amb33225302 [0,1,0,0,0,0|3,0,0]=4 1015 B12R1.16 CNCC(=O)c1ccc(N)cc1 Amb18550919 [0,1,0,0,0,0|2,0,0]=3 1016 B12R1.16 CNCC(=O)c1ccc(O)cc1 Amb1075808 [0,1,0,0,0,0|2,0,0]=3 1017 B12R1.16 CNCC(=O)c1ccc(O)cc1 Amb6859390 [0,1,0,0,0,0|2,0,0]=3 1018 B12R1.16 CN\C=C(\C)c1ccc(Cl)cc1 Amb27814193 [0,1,0,0,0,0|3,0,0]=4 1019 B12R1.16 CN\N=C(\C)c1ccc(F)cc1 Amb27802349 [0,1,0,0,0,0|3,0,0]=4 1020 B12R1.16 COCC(=O)c1ccc(Br)cc1 Amb9665975 [0,1,0,0,0,0|2,0,0]=3 1021 B12R1.16 COCC(=O)c1ccc(Br)cn1 Amb27426653 [0,1,0,0,0,0|3,0,0]=4 1022 B12R1.16 COCC(=O)c1ccc(C)cn1 Amb28068268 [0,1,0,0,0,0|3,0,0]=4 1023 B12R1.16 COCC(=O)c1ccc(Cl)cc1 Amb9666006 [0,1,0,0,0,0|2,0,0]=3 1024 B12R1.16 COCC(=O)c1ccc(F)cc1 Amb9666007 [0,1,0,0,0,0|2,0,0]=3 1025 B12R1.16 COCC(=O)c1ccc(N)cc1 Amb17202004 [0,1,0,0,0,0|2,0,0]=3 1026 B12R1.16 COCC(=O)c1ccc(O)cc1 Amb17616985 [0,1,0,0,0,0|2,0,0]=3 1027 B12R1.16 CONC(=O)c1cc[n+]([O-])cc1 Amb28256662 [0,1,0,0,0,0|3,0,0]=4 1028 B12R1.16 CONC(=O)c1ccc(Br)cn1 Amb28325399 [0,1,0,0,0,0|3,0,0]=4 1029 B12R1.16 CONC(=O)c1ccc(C)cc1 Amb16980459 [0,1,0,0,0,0|2,0,0]=3 1030 B12R1.16 CONC(=O)c1ccc(F)cn1 Amb27406267 [0,1,0,0,0,0|3,0,0]=4 1031 B12R1.16 CONC(=O)c1ccc(O)cc1 Amb25124655 [0,1,0,0,0,0|2,0,0]=3 1032 B12R1.16 CO\N=C(/C)c1ccc(Cl)cc1 Amb33868175 [0,1,0,0,0,0|3,0,0]=4 1033 B12R1.16 CO\N=C(/C)c1ccc(F)cc1 Amb32661033 [0,1,0,0,0,0|3,0,0]=4 1034 B12R1.16 CO\N=C(/N)c1ccc(Br)cc1 Amb18227753 [0,1,0,0,0,0|3,0,0]=4 1035 B12R1.16 CO\N=C(/N)c1ccc(C)cc1 Amb18862602 [0,1,0,0,0,0|3,0,0]=4 1036 B12R1.16 CO\N=C(/N)c1ccc(Cl)cc1 Amb18863111 [0,1,0,0,0,0|3,0,0]=4 1037 B12R1.16 CO\N=C(/N)c1ccc(F)cc1 Amb18862745 [0,1,0,0,0,0|3,0,0]=4 1038 B12R1.16 CO\N=C(\C)c1ccc(F)cc1 Amb27164505 [0,1,0,0,0,0|3,0,0]=4 1039 B12R1.16 CO\N=C(\C)c1ccc(I)cc1 Amb27178833 [0,1,0,0,0,0|3,0,0]=4 1040 B12R1.16 CSCC(=O)c1ccc(Br)cc1 Amb24638487 [0,1,0,0,0,0|2,0,0]=3 1041 B12R1.16 CSCC(=O)c1ccc(C)cc1 Amb18796320 [0,1,0,0,0,0|2,0,0]=3 1042 B12R1.16 CSCC(=O)c1ccc(C)nc1 Amb27441620 [0,1,0,0,0,0|3,0,0]=4 1043 B12R1.16 CSCC(=O)c1ccc(Cl)cc1 Amb18320090 [0,1,0,0,0,0|2,0,0]=3 1044 B12R1.16 CSCC(=O)c1ccc(F)cc1 Amb19057445 [0,1,0,0,0,0|2,0,0]=3 1045 B12R1.16 CSCC(=O)c1ccc(I)cc1 Amb25826398 [0,1,0,0,0,0|2,0,0]=3 1046 B12R1.16 CSCC(=O)c1ccc(O)cc1 Amb18181564 [0,1,0,0,0,0|2,0,0]=3 1047 B12R1.16 C\C(=C/CN)c1ccc(Br)cc1 Amb31098021 [0,1,0,0,0,0|3,0,0]=4 1048 B12R1.16 C\C(=C/CN)c1ccc(C)cc1 Amb31099547 [0,1,0,0,0,0|3,0,0]=4 1049 B12R1.16 C\C(=C/CN)c1ccc(Cl)cc1 Amb31096965 [0,1,0,0,0,0|3,0,0]=4 1050 B12R1.16 C\C(=C/CN)c1ccc(F)cc1 Amb31099551 [0,1,0,0,0,0|3,0,0]=4 1051 B12R1.16 C\C(=C/CO)c1ccc(Cl)cc1 Amb27815981 [0,1,0,0,0,0|3,0,0]=4 1052 B12R1.16 C\C(=C\CN)c1ccc(F)cc1 Amb24662850 [0,1,0,0,0,0|3,0,0]=4 1053 B12R1.16 Cc1ccc(C(=O)C=C=O)cc1 Amb28141131 [0,1,0,0,0,0|2,0,1]=4 1054 B12R1.16 Cc1ccc(C(=O)C=[N+]=[N-])cc1 Amb26961733 [0,1,0,0,0,0|3,0,0]=4 1055 B12R1.16 Cc1ccc(C(=O)CC#N)cc1 Amb1981339 [0,1,0,0,0,0|2,0,1]=4 1056 B12R1.16 Cc1ccc(C(=O)CC=O)cc1 Amb9204941 [0,1,0,0,0,0|2,0,1]=4 1057 B12R1.16 Cc1ccc(C(=O)CCBr)cc1 Amb4066426 [0,1,0,0,0,0|2,0,0]=3 1058 B12R1.16 Cc1ccc(C(=O)CCCl)cc1 Amb4464622 [0,1,0,0,0,0|2,0,0]=3 1059 B12R1.16 Cc1ccc(C(=O)CCN)cc1 Amb17194471 [0,1,0,0,0,0|2,0,0]=3 1060 B12R1.16 Cc1ccc(C(=O)CCN)cn1 Amb24560240 [0,1,0,0,0,0|3,0,0]=4 1061 B12R1.16 Cc1ccc(C(=O)CCN)nc1 Amb33199160 [0,1,0,0,0,0|3,0,0]=4 1062 B12R1.16 Cc1ccc(C(=O)CCO)cc1 Amb18563614 [0,1,0,0,0,0|2,0,0]=3 1063 B12R1.16 Cc1ccc(C(=O)CCO)cn1 Amb28324319 [0,1,0,0,0,0|3,0,0]=4 1064 B12R1.16 Cc1ccc(C(=O)CCS)cc1 Amb17400836 [0,1,0,0,0,0|2,0,0]=3 1065 B12R1.16 Cc1ccc(C(=O)N=C=O)cc1 Amb6252633 [0,1,0,0,0,0|2,0,1]=4 1066 B12R1.16 Cc1ccc(C(=O)N=C=S)cc1 Amb2689338 [0,1,0,0,0,0|2,0,1]=4 1067 B12R1.16 Cc1ccc(C(=O)NCCl)cc1 Amb7807821 [0,1,0,0,0,0|2,0,0]=3 1068 B12R1.16 Cc1ccc(C(=O)NCO)cc1 Amb2793597 [0,1,0,0,0,0|2,0,0]=3 1069 B12R1.16 Cc1ccc(C(=O)[CH-]C=O)cc1 Amb28076867 [0,1,0,0,0,0|2,0,1]=4 1070 B12R1.16 Cc1ccc(C(=O)\C=C\Cl)cc1 Amb25774994 [0,1,0,0,0,0|2,0,1]=4 1071 B12R1.16 Cc1ccc(C(=O)\C=C\[O-])cc1 Amb474680 [0,1,0,0,0,0|2,0,1]=4 1072 B12R1.16 Cc1ccc(C(=O)\C=N\O)cc1 Amb2609882 [0,1,0,0,0,0|3,0,0]=4 1073 B12R1.16 N#CCC(=O)c1ccc(Br)cc1 Amb6372715 [0,1,0,0,0,0|2,0,1]=4 1074 B12R1.16 N#CCC(=O)c1ccc(Cl)cc1 Amb1648832 [0,1,0,0,0,0|2,0,1]=4 1075 B12R1.16 N#CCC(=O)c1ccc(F)cc1 Amb1661968 [0,1,0,0,0,0|2,0,1]=4 1076 B12R1.16 N#CCC(=O)c1ccc(I)cc1 Amb33531460 [0,1,0,0,0,0|2,0,1]=4 1077 B12R1.16 N#CCC(=O)c1ccc(N)cc1 Amb4382151 [0,1,0,0,0,0|2,0,1]=4 1078 B12R1.16 N#CCC(=O)c1ccc(O)cc1 Amb10071606 [0,1,0,0,0,0|2,0,1]=4 1079 B12R1.16 N#N=CC(=O)c1ccc(Br)cc1 Amb9827070 [0,1,0,0,0,0|3,0,0]=4 1080 B12R1.16 N#N=CC(=O)c1ccc(Cl)cc1 Amb9827157 [0,1,0,0,0,0|3,0,0]=4 1081 B12R1.16 NCCC(=O)c1ccc(Br)cc1 Amb17195655 [0,1,0,0,0,0|2,0,0]=3 1082 B12R1.16 NCCC(=O)c1ccc(Br)cn1 Amb33477124 [0,1,0,0,0,0|3,0,0]=4 1083 B12R1.16 NCCC(=O)c1ccc(Br)nc1 Amb33387706 [0,1,0,0,0,0|3,0,0]=4 1084 B12R1.16 NCCC(=O)c1ccc(Cl)cc1 Amb17194559 [0,1,0,0,0,0|2,0,0]=3 1085 B12R1.16 NCCC(=O)c1ccc(Cl)nc1 Amb33261495 [0,1,0,0,0,0|3,0,0]=4 1086 B12R1.16 NCCC(=O)c1ccc(F)cc1 Amb17108934 [0,1,0,0,0,0|2,0,0]=3 1087 B12R1.16 NCCC(=O)c1ccc(F)cn1 Amb33316677 [0,1,0,0,0,0|3,0,0]=4 1088 B12R1.16 NCCC(=O)c1ccc(F)nc1 Amb33426568 [0,1,0,0,0,0|3,0,0]=4 1089 B12R1.16 NCCC(=O)c1ccc(O)cc1 Amb27266111 [0,1,0,0,0,0|2,0,0]=3 1090 B12R1.16 NCCS(=O)c1ccc(Br)cc1 Amb18290919 [0,1,0,0,0,0|3,0,0]=4 1091 B12R1.16 NCCS(=O)c1ccc(I)cc1 Amb25315872 [0,1,0,0,0,0|3,0,0]=4 1092 B12R1.16 NC\C=C(\Cl)c1ccc(F)cc1 Amb27201340 [0,1,0,0,0,0|3,0,0]=4 1093 B12R1.16 NOCC(=O)c1ccc(F)cc1 Amb27398410 [0,1,0,0,0,0|3,0,0]=4 1094 B12R1.16 N\C=C\C(=O)c1ccc(Cl)cc1 Amb27614726 [0,1,0,0,0,0|2,0,1]=4 1095 B12R1.16 N\N=C\C(=O)c1ccc(Br)cc1 Amb9824987 [0,1,0,0,0,0|3,0,0]=4 1096 B12R1.16 N\N=C\C(=O)c1ccc(Cl)cc1 Amb9824986 [0,1,0,0,0,0|3,0,0]=4 1097 B12R1.16 Nc1ccc(C(=O)CCCl)cc1 Amb17202006 [0,1,0,0,0,0|2,0,0]=3 1098 B12R1.16 Nc1ccc(C(=O)N=C=S)cc1 Amb27174264 [0,1,0,0,0,0|2,0,1]=4 1099 B12R1.16 O=C(CCBr)c1ccc(Br)cc1 Amb17437866 [0,1,0,0,0,0|2,0,0]=3 1100 B12R1.16 O=C(CCBr)c1ccc(Cl)cc1 Amb4034399 [0,1,0,0,0,0|2,0,0]=3 1101 B12R1.16 O=C(CCBr)c1ccc(F)cc1 Amb17437867 [0,1,0,0,0,0|2,0,0]=3 1102 B12R1.16 O=C(CCBr)c1ccc(I)cc1 Amb27619702 [0,1,0,0,0,0|2,0,0]=3 1103 B12R1.16 O=C(CCBr)c1ccc(O)cc1 Amb26352653 [0,1,0,0,0,0|2,0,0]=3 1104 B12R1.16 O=C(CCCl)c1ccc(Br)cc1 Amb6298829 [0,1,0,0,0,0|2,0,0]=3 1105 B12R1.16 O=C(CCCl)c1ccc(Cl)cc1 Amb2724275 [0,1,0,0,0,0|2,0,0]=3 1106 B12R1.16 O=C(CCCl)c1ccc(F)cc1 Amb1233062 [0,1,0,0,0,0|2,0,0]=3 1107 B12R1.16 O=C(CCCl)c1ccc(O)cc1 Amb18552996 [0,1,0,0,0,0|2,0,0]=3 1108 B12R1.16 O=C(CCCl)c1ccc(S)cc1 Amb27259811 [0,1,0,0,0,0|2,0,0]=3 1109 B12R1.16 O=C(CCO)c1ccc(Br)cc1 Amb18069914 [0,1,0,0,0,0|2,0,0]=3 1110 B12R1.16 O=C(CCO)c1ccc(Cl)cc1 Amb18564305 [0,1,0,0,0,0|2,0,0]=3 1111 B12R1.16 O=C(CCO)c1ccc(F)cc1 Amb1111123 [0,1,0,0,0,0|2,0,0]=3 1112 B12R1.16 O=C(CCO)c1ccc(O)cc1 Amb8399058 [0,1,0,0,0,0|2,0,0]=3 1113 B12R1.16 O=C(CCS)c1ccc(Br)cc1 Amb17411234 [0,1,0,0,0,0|2,0,0]=3 1114 B12R1.16 O=C(CCS)c1ccc(Cl)cc1 Amb17402391 [0,1,0,0,0,0|2,0,0]=3 1115 B12R1.16 O=C(CCS)c1ccc(F)cc1 Amb17401021 [0,1,0,0,0,0|2,0,0]=3 1116 B12R1.16 O=C(N=C=S)c1ccc(Br)cc1 Amb33531641 [0,1,0,0,0,0|2,0,1]=4 1117 B12R1.16 O=C(N=C=S)c1ccc(Cl)cc1 Amb1649095 [0,1,0,0,0,0|2,0,1]=4 1118 B12R1.16 O=C(N=C=S)c1ccc(F)cc1 Amb9249959 [0,1,0,0,0,0|2,0,1]=4 1119 B12R1.16 O=C(NCCl)c1ccc(F)cc1 Amb7807822 [0,1,0,0,0,0|2,0,0]=3 1120 B12R1.16 O=C(NCO)c1ccc(Cl)cc1 Amb2793594 [0,1,0,0,0,0|2,0,0]=3 1121 B12R1.16 O=C(NCO)c1ccc(F)cc1 Amb2793598 [0,1,0,0,0,0|2,0,0]=3 1122 B12R1.16 O=C(OCCl)c1ccc(Cl)nc1 Amb27848650 [0,1,0,0,0,0|2,0,0]=3 1123 B12R1.16 O=C(OCCl)c1ccc(F)cc1 Amb28385633 [0,1,0,0,0,0|1,0,0]=2 1124 B12R1.16 O=C(\C=C/[O-])c1ccc(Cl)cc1 Amb24121228 [0,1,0,0,0,0|2,0,1]=4 1125 B12R1.16 O=C(\C=C\Cl)c1ccc(Br)cc1 Amb33832699 [0,1,0,0,0,0|2,0,1]=4 1126 B12R1.16 O=C(\C=C\Cl)c1ccc(Cl)cc1 Amb33832700 [0,1,0,0,0,0|2,0,1]=4 1127 B12R1.16 O=C(\C=C\Cl)c1ccc(F)cc1 Amb27409141 [0,1,0,0,0,0|2,0,1]=4 1128 B12R1.16 O=C(\C=C\Cl)c1ccc(I)cc1 Amb35609460 [0,1,0,0,0,0|2,0,1]=4 1129 B12R1.16 O=C(\C=C\Cl)c1ccc(O)cc1 Amb35645312 [0,1,0,0,0,0|2,0,1]=4 1130 B12R1.16 O=C(\C=C\[O-])c1ccc(Br)cc1 Amb27639750 [0,1,0,0,0,0|2,0,1]=4 1131 B12R1.16 O=C(\C=C\[O-])c1ccc(Cl)cc1 Amb24109294 [0,1,0,0,0,0|2,0,1]=4 1132 B12R1.16 O=C(\C=C\[O-])c1ccc(Cl)cc1 Amb30584833 [0,1,0,0,0,0|2,0,1]=4 1133 B12R1.16 O=C(\C=C\[O-])c1ccc(F)cc1 Amb416271 [0,1,0,0,0,0|2,0,1]=4 1134 B12R1.16 O=C(\C=N/O)c1ccc(O)cc1 Amb27263002 [0,1,0,0,0,0|3,0,0]=4 1135 B12R1.16 O=C(\C=N\O)c1ccc(Br)cc1 Amb27875418 [0,1,0,0,0,0|3,0,0]=4 1136 B12R1.16 O=C(\C=N\O)c1ccc(Cl)cc1 Amb2434431 [0,1,0,0,0,0|3,0,0]=4 1137 B12R1.16 O=C(\C=N\O)c1ccc(F)cc1 Amb4479325 [0,1,0,0,0,0|3,0,0]=4 1138 B12R1.16 O=C(\C=N\O)c1ccc(O)cc1 Amb25113482 [0,1,0,0,0,0|3,0,0]=4 1139 B12R1.16 O=C=NC(=O)c1ccc(Br)cc1 Amb17247242 [0,1,0,0,0,0|2,0,1]=4 1140 B12R1.16 O=C=NC(=O)c1ccc(Cl)cc1 Amb6252632 [0,1,0,0,0,0|2,0,1]=4 1141 B12R1.16 O=C=NC(=O)c1ccc(F)cc1 Amb6252631 [0,1,0,0,0,0|2,0,1]=4 1142 B12R1.16 O=C=NC(=O)c1ccc(O)cc1 Amb26874443 [0,1,0,0,0,0|2,0,1]=4 1143 B12R1.16 O=CCC(=O)c1ccc(Br)cc1 Amb9204942 [0,1,0,0,0,0|2,0,1]=4 1144 B12R1.16 O=CCC(=O)c1ccc(Cl)cc1 Amb5717711 [0,1,0,0,0,0|2,0,1]=4 1145 B12R1.16 O=CCC(=O)c1ccc(F)cc1 Amb9204897 [0,1,0,0,0,0|2,0,1]=4 1146 B12R1.16 O=CCC(=O)c1ccc(I)cc1 Amb24748951 [0,1,0,0,0,0|2,0,1]=4 1147 B12R1.16 O=CCC(=O)c1ccc(O)cc1 Amb27168149 [0,1,0,0,0,0|2,0,1]=4 1148 B12R1.16 O=CNC(=O)c1ccc(Br)cc1 Amb28251420 [0,1,0,0,0,0|2,0,1]=4 1149 B12R1.16 O=CNC(=O)c1ccc(Cl)cc1 Amb27849669 [0,1,0,0,0,0|2,0,1]=4 1150 B12R1.16 O=S(CCCl)c1ccc(Br)cc1 Amb9677472 [0,1,0,0,0,0|3,0,0]=4 1151 B12R1.16 O=S(CCCl)c1ccc(Cl)cc1 Amb9677437 [0,1,0,0,0,0|3,0,0]=4 1152 B12R1.16 O=S(CCF)c1ccc(F)cc1 Amb27407396 [0,1,0,0,0,0|3,0,0]=4 1153 B12R1.16 O=S(CCO)c1ccc(Cl)cc1 Amb25969463 [0,1,0,0,0,0|3,0,0]=4 1154 B12R1.16 [N-]=[N+]=CC(=O)c1ccc(F)cc1 Amb26514940 [0,1,0,0,0,0|3,0,0]=4 1155 B12R1.16 [N-]=[N+]=NC(=O)c1ccc(Cl)cc1 Amb8439580 [0,1,0,0,0,0|3,0,0]=4 1156 B12R1.16 [N-]=[N+]=NC(=O)c1ccc(I)cc1 Amb8938240 [0,1,0,0,0,0|3,0,0]=4 1157 B12R1.16 [N-]=[N+]=NC(=O)c1ccc(N)cc1 Amb27759354 [0,1,0,0,0,0|3,0,0]=4 1158 B12R1.17 C#CCC(=O)c1cccc(C)c1 Amb18799927 [0,1,0,0,0,0|1,0,2]=4 1159 B12R1.17 C=C(CCN)c1cccc(Br)c1 Amb33451466 [0,1,0,0,0,0|3,0,0]=4 1160 B12R1.17 C=C(CCN)c1cccc(C)c1 Amb33380570 [0,1,0,0,0,0|3,0,0]=4 1161 B12R1.17 C=C(CCN)c1cccc(Cl)c1 Amb33223582 [0,1,0,0,0,0|3,0,0]=4 1162 B12R1.17 C=C(CCN)c1cccc(F)c1 Amb33203777 [0,1,0,0,0,0|3,0,0]=4 1163 B12R1.17 C=C(CCN)c1cccc(O)c1 Amb33310864 [0,1,0,0,0,0|3,0,0]=4 1164 B12R1.17 C=C(OCC)c1cc(Br)ncn1 Amb33135995 [0,1,0,0,0,0|3,0,0]=4 1165 B12R1.17 C=C(OCC)c1cc(Cl)ccn1 Amb33135761 [0,1,0,0,0,0|2,0,0]=3 1166 B12R1.17 C=C(OCC)c1cc(Cl)ncn1 Amb25217353 [0,1,0,0,0,0|3,0,0]=4 1167 B12R1.17 C=C(OCC)c1cc(F)ccn1 Amb33136134 [0,1,0,0,0,0|2,0,0]=3 1168 B12R1.17 C=C(OCC)c1cc(N)ccn1 Amb33136252 [0,1,0,0,0,0|2,0,0]=3 1169 B12R1.17 C=C(OCC)c1cc(N)ncn1 Amb27875960 [0,1,0,0,0,0|3,0,0]=4 1170 B12R1.17 C=C(OCC)c1cccc(Br)n1 Amb33135765 [0,1,0,0,0,0|2,0,0]=3 1171 B12R1.17 C=C(OCC)c1cccc(Cl)n1 Amb33135989 [0,1,0,0,0,0|2,0,0]=3 1172 B12R1.17 C=C(OCC)c1cccc(F)n1 Amb33136246 [0,1,0,0,0,0|2,0,0]=3 1173 B12R1.17 C=C(OCC)c1cccc(N)c1 Amb33135830 [0,1,0,0,0,0|1,0,0]=2 1174 B12R1.17 C=C(OCC)c1cccc(N)n1 Amb33135831 [0,1,0,0,0,0|2,0,0]=3 1175 B12R1.17 C=C(OCC)c1cccc(O)c1 Amb33136254 [0,1,0,0,0,0|1,0,0]=2 1176 B12R1.17 C=C(OCC)c1ccnc(Cl)n1 Amb25194927 [0,1,0,0,0,0|3,0,0]=4 1177 B12R1.17 C=C(OCC)c1ccnc(N)c1 Amb33135835 [0,1,0,0,0,0|2,0,0]=3 1178 B12R1.17 C=C(OCC)c1ccnc(N)n1 Amb33135838 [0,1,0,0,0,0|3,0,0]=4 1179 B12R1.17 C=C(OCC)c1cncc(Cl)n1 Amb33072423 [0,1,0,0,0,0|3,0,0]=4 1180 B12R1.17 C=C(OCC)c1cncc(N)c1 Amb33136213 [0,1,0,0,0,0|2,0,0]=3 1181 B12R1.17 C=C(OCC)c1cncc(O)c1 Amb33136057 [0,1,0,0,0,0|2,0,0]=3 1182 B12R1.17 C=C(OCC)c1nccc(N)n1 Amb33135973 [0,1,0,0,0,0|3,0,0]=4 1183 B12R1.17 C=C=CC(=O)c1cccc(Cl)c1 Amb27164588 [0,1,0,0,0,0|1,0,2]=4 1184 B12R1.17 C=CCC(=O)c1cccc(Br)c1 Amb17343201 [0,1,0,0,0,0|1,0,2]=4 1185 B12R1.17 C=CCC(=O)c1cccc(C)c1 Amb17334498 [0,1,0,0,0,0|1,0,2]=4 1186 B12R1.17 C=CCC(=O)c1cccc(Cl)c1 Amb17335457 [0,1,0,0,0,0|1,0,2]=4 1187 B12R1.17 C=CCC(=O)c1cccc(F)c1 Amb18788273 [0,1,0,0,0,0|1,0,2]=4 1188 B12R1.17 C=CCC(=O)c1cccc(I)c1 Amb27601489 [0,1,0,0,0,0|1,0,2]=4 1189 B12R1.17 C=CCC(=O)c1cccc(O)c1 Amb17334559 [0,1,0,0,0,0|1,0,2]=4 1190 B12R1.17 CCCC(=O)c1cc(C)ccn1 Amb27949023 [0,1,0,0,0,0|2,0,0]=3 1191 B12R1.17 CCCC(=O)c1cc(Cl)ccn1 Amb27453613 [0,1,0,0,0,0|2,0,0]=3 1192 B12R1.17 CCCC(=O)c1cccc(Br)c1 Amb17193987 [0,1,0,0,0,0|1,0,0]=2 1193 B12R1.17 CCCC(=O)c1cccc(C)c1 Amb3940677 [0,1,0,0,0,0|1,0,0]=2 1194 B12R1.17 CCCC(=O)c1cccc(Cl)c1 Amb17198744 [0,1,0,0,0,0|1,0,0]=2 1195 B12R1.17 CCCC(=O)c1cccc(F)c1 Amb17232581 [0,1,0,0,0,0|1,0,0]=2 1196 B12R1.17 CCCC(=O)c1cccc(N)c1 Amb33548311 [0,1,0,0,0,0|1,0,0]=2 1197 B12R1.17 CCCC(=O)c1ccnc(C)n1 Amb27606119 [0,1,0,0,0,0|3,0,0]=4 1198 B12R1.17 CCCC(=O)c1ccnc(Cl)c1 Amb6301674 [0,1,0,0,0,0|2,0,0]=3 1199 B12R1.17 CCCC(C)c1cccc(O)c1 Amb27229592 [0,1,0,0,0,0|2,0,1]=4 1200 B12R1.17 CCCC(Cl)c1cccc(Br)c1 Amb29880680 [0,1,0,0,0,0|2,0,1]=4 1201 B12R1.17 CCCC(Cl)c1cccc(Cl)c1 Amb27656221 [0,1,0,0,0,0|2,0,1]=4 1202 B12R1.17 CCCC(N)c1cccc(Br)c1 Amb28240805 [0,1,0,0,0,0|2,0,1]=4 1203 B12R1.17 CCCC(N)c1cccc(C)c1 Amb17232449 [0,1,0,0,0,0|2,0,1]=4 1204 B12R1.17 CCCC(N)c1cccc(C)c1 Amb32662396 [0,1,0,0,0,0|2,0,1]=4 1205 B12R1.17 CCCC(N)c1cccc(Cl)c1 Amb17234050 [0,1,0,0,0,0|2,0,1]=4 1206 B12R1.17 CCCC(N)c1cccc(F)c1 Amb17232649 [0,1,0,0,0,0|2,0,1]=4 1207 B12R1.17 CCCC(N)c1cccc(F)c1 Amb30982493 [0,1,0,0,0,0|2,0,1]=4 1208 B12R1.17 CCCC(N)c1cccc(I)c1 Amb27209580 [0,1,0,0,0,0|2,0,1]=4 1209 B12R1.17 CCCC(N)c1cccc(N)c1 Amb25891904 [0,1,0,0,0,0|2,0,1]=4 1210 B12R1.17 CCCC(O)c1cccc(Br)c1 Amb17248424 [0,1,0,0,0,0|1,0,2]=4 1211 B12R1.17 CCCC(O)c1cccc(C)c1 Amb17232484 [0,1,0,0,0,0|1,0,2]=4 1212 B12R1.17 CCCC(O)c1cccc(Cl)c1 Amb17234155 [0,1,0,0,0,0|1,0,2]=4 1213 B12R1.17 CCCC(O)c1cccc(F)c1 Amb17232673 [0,1,0,0,0,0|1,0,2]=4 1214 B12R1.17 CCCS(=O)c1cccc(N)c1 Amb27258884 [0,1,0,0,0,0|2,0,0]=3 1215 B12R1.17 CCC[C@@H](N)c1cccc(I)c1 Amb27814307 [0,1,0,0,0,0|2,0,1]=4 1216 B12R1.17 CCC[C@@H](O)c1cccc(Br)c1 Amb27176217 [0,1,0,0,0,0|1,0,2]=4 1217 B12R1.17 CCC[C@@H](O)c1cccc(F)c1 Amb28138837 [0,1,0,0,0,0|1,0,2]=4 1218 B12R1.17 CCC[C@H](N)c1cccc(C)c1 Amb28313719 [0,1,0,0,0,0|2,0,1]=4 1219 B12R1.17 CCC[C@H](N)c1cccc(Cl)c1 Amb28346844 [0,1,0,0,0,0|2,0,1]=4 1220 B12R1.17 CCC[C@H](N)c1cccc(F)c1 Amb27626030 [0,1,0,0,0,0|2,0,1]=4 1221 B12R1.17 CCC[C@H](N)c1cccc(N)c1 Amb28255487 [0,1,0,0,0,0|2,0,1]=4 1222 B12R1.17 CCC[C@H](O)c1cccc(Cl)c1 Amb27826760 [0,1,0,0,0,0|1,0,2]=4 1223 B12R1.17 CCNC(=N)c1cccc(Br)c1 Amb27662544 [0,1,0,0,0,0|2,0,0]=3 1224 B12R1.17 CCNC(=N)c1cccc(C)c1 Amb28365624 [0,1,0,0,0,0|2,0,0]=3 1225 B12R1.17 CCNC(=N)c1cccc(F)c1 Amb28345132 [0,1,0,0,0,0|2,0,0]=3 1226 B12R1.17 CCNC(=O)C1=CC(=O)NC=C1 Amb26024473 [0,1,0,0,0,0|2,0,0]=3 1227 B12R1.17 CCNC(=O)C1=CC=NC(=O)N1 Amb32419039 [0,1,0,0,0,0|3,0,0]=4 1228 B12R1.17 CCNC(=O)c1c[n+]([O-])ccn1 Amb27645271 [0,1,0,0,0,0|3,0,0]=4 1229 B12R1.17 CCNC(=O)c1cc(C)ccn1 Amb28240139 [0,1,0,0,0,0|2,0,0]=3 1230 B12R1.17 CCNC(=O)c1cc(C)ncn1 Amb27456278 [0,1,0,0,0,0|3,0,0]=4 1231 B12R1.17 CCNC(=O)c1cc(Cl)ccn1 Amb8323132 [0,1,0,0,0,0|2,0,0]=3 1232 B12R1.17 CCNC(=O)c1cc(F)ccn1 Amb27231485 [0,1,0,0,0,0|2,0,0]=3 1233 B12R1.17 CCNC(=O)c1cc(S)ccn1 Amb9378846 [0,1,0,0,0,0|2,0,0]=3 1234 B12R1.17 CCNC(=O)c1ccc[n+]([O-])c1 Amb27775357 [0,1,0,0,0,0|2,0,0]=3 1235 B12R1.17 CCNC(=O)c1cccc(Br)c1 Amb3367312 [0,1,0,0,0,0|1,0,0]=2 1236 B12R1.17 CCNC(=O)c1cccc(C)c1 Amb3361463 [0,1,0,0,0,0|1,0,0]=2 1237 B12R1.17 CCNC(=O)c1cccc(Cl)c1 Amb3357855 [0,1,0,0,0,0|1,0,0]=2 1238 B12R1.17 CCNC(=O)c1cccc(Cl)n1 Amb19075151 [0,1,0,0,0,0|2,0,0]=3 1239 B12R1.17 CCNC(=O)c1cccc(F)c1 Amb3373688 [0,1,0,0,0,0|1,0,0]=2 1240 B12R1.17 CCNC(=O)c1cccc(I)c1 Amb3888523 [0,1,0,0,0,0|1,0,0]=2 1241 B12R1.17 CCNC(=O)c1cccc(N)c1 Amb2193629 [0,1,0,0,0,0|1,0,0]=2 1242 B12R1.17 CCNC(=O)c1cccc(O)c1 Amb6671664 [0,1,0,0,0,0|1,0,0]=2 1243 B12R1.17 CCNC(=O)c1cccc(S)c1 Amb27784878 [0,1,0,0,0,0|1,0,0]=2 1244 B12R1.17 CCNC(=O)c1ccnc(Br)c1 Amb19959849 [0,1,0,0,0,0|2,0,0]=3 1245 B12R1.17 CCNC(=O)c1ccnc(C)c1 Amb27808423 [0,1,0,0,0,0|2,0,0]=3 1246 B12R1.17 CCNC(=O)c1ccnc(C)n1 Amb27853426 [0,1,0,0,0,0|3,0,0]=4 1247 B12R1.17 CCNC(=O)c1ccnc(Cl)c1 Amb6667939 [0,1,0,0,0,0|2,0,0]=3 1248 B12R1.17 CCNC(=O)c1ccnc(Cl)n1 Amb27662786 [0,1,0,0,0,0|3,0,0]=4 1249 B12R1.17 CCNC(=O)c1cncc(Br)c1 Amb7067215 [0,1,0,0,0,0|2,0,0]=3 1250 B12R1.17 CCNC(=O)c1cncc(I)c1 Amb27449092 [0,1,0,0,0,0|2,0,0]=3 1251 B12R1.17 CCNC(=O)c1cncc(N)c1 Amb23452696 [0,1,0,0,0,0|2,0,0]=3 1252 B12R1.17 CCNC(C)c1cccc(Br)c1 Amb6258594 [0,1,0,0,0,0|2,0,1]=4 1253 B12R1.17 CCNC(C)c1cccc(Cl)c1 Amb6258034 [0,1,0,0,0,0|2,0,1]=4 1254 B12R1.17 CCNC(C)c1cccc(F)c1 Amb6269871 [0,1,0,0,0,0|2,0,1]=4 1255 B12R1.17 CCNC(C)c1cccc(O)c1 Amb6266939 [0,1,0,0,0,0|2,0,1]=4 1256 B12R1.17 CCNC(C)c1cccc(O)c1 Amb7969803 [0,1,0,0,0,0|2,0,1]=4 1257 B12R1.17 CCN[C@H](C)c1cccc(F)c1 Amb27263944 [0,1,0,0,0,0|2,0,1]=4 1258 B12R1.17 CCN[C@H](C)c1cccc(O)c1 Amb28206952 [0,1,0,0,0,0|2,0,1]=4 1259 B12R1.17 CCOC(=N)c1cccc(Br)c1 Amb20673168 [0,1,0,0,0,0|1,0,0]=2 1260 B12R1.17 CCOC(=N)c1cccc(C)c1 Amb20673130 [0,1,0,0,0,0|1,0,0]=2 1261 B12R1.17 CCOC(=N)c1cccc(Cl)c1 Amb20673138 [0,1,0,0,0,0|1,0,0]=2 1262 B12R1.17 CCOC(=N)c1cccc(Cl)n1 Amb25843265 [0,1,0,0,0,0|2,0,0]=3 1263 B12R1.17 CCOC(=N)c1cccc(F)c1 Amb18792899 [0,1,0,0,0,0|1,0,0]=2 1264 B12R1.17 CCOC(=N)c1cccc(F)c1 Amb20673134 [0,1,0,0,0,0|1,0,0]=2 1265 B12R1.17 CCOC(=N)c1cccc(I)c1 Amb27230237 [0,1,0,0,0,0|1,0,0]=2 1266 B12R1.17 CCOC(=N)c1ccnc(C)n1 Amb27403791 [0,1,0,0,0,0|3,0,0]=4 1267 B12R1.17 CCOC(=N)c1ccnc(Cl)c1 Amb26589940 [0,1,0,0,0,0|2,0,0]=3 1268 B12R1.17 CCOC(=N)c1cncc(Cl)c1 Amb25977016 [0,1,0,0,0,0|2,0,0]=3 1269 B12R1.17 CCOC(=O)C1=CC(=O)C=CO1 Amb21864798 [0,1,0,0,0,0|1,0,0]=2 1270 B12R1.17 CCOC(=O)C1=CC(=O)CCC1 Amb27659241 [0,1,0,0,0,0|0,0,3]=4 1271 B12R1.17 CCOC(=O)C1=CC(=O)N=CN1 Amb22436856 [0,1,0,0,0,0|2,0,0]=3 1272 B12R1.17 CCOC(=O)C1=CC(=O)NC=C1 Amb22499695 [0,1,0,0,0,0|1,0,0]=2 1273 B12R1.17 CCOC(=O)C1=CC(=O)NN=C1 Amb22235582 [0,1,0,0,0,0|2,0,0]=3 1274 B12R1.17 CCOC(=O)C1=CC(=S)NC=C1 Amb25971726 [0,1,0,0,0,0|1,0,0]=2 1275 B12R1.17 CCOC(=O)C1=CN(C)C=CC1 Amb27840645 [0,1,0,0,0,0|1,0,1]=3 1276 B12R1.17 CCOC(=O)C1=NC(=O)CN=C1 Amb22388356 [0,1,0,0,0,0|2,0,1]=4 1277 B12R1.17 CCOC(=O)C1CC=CC(=O)C1 Amb27177764 [0,1,0,0,0,0|0,0,3]=4 1278 B12R1.17 CCOC(=O)N1CC=CC(=O)C1 Amb26338314 [0,1,0,0,0,0|1,0,2]=4 1279 B12R1.17 CCOC(=O)c1cc(Br)ccn1 Amb10603764 [0,1,0,0,0,0|1,0,0]=2 1280 B12R1.17 CCOC(=O)c1cc(Br)ncn1 Amb27813553 [0,1,0,0,0,0|2,0,0]=3 1281 B12R1.17 CCOC(=O)c1cc(Cl)ccn1 Amb8396779 [0,1,0,0,0,0|1,0,0]=2 1282 B12R1.17 CCOC(=O)c1cc(Cl)ncn1 Amb22001535 [0,1,0,0,0,0|2,0,0]=3 1283 B12R1.17 CCOC(=O)c1cc(F)ccn1 Amb23412382 [0,1,0,0,0,0|1,0,0]=2 1284 B12R1.17 CCOC(=O)c1cc(F)ncn1 Amb27441981 [0,1,0,0,0,0|2,0,0]=3 1285 B12R1.17 CCOC(=O)c1cc(N)ccn1 Amb19516035 [0,1,0,0,0,0|1,0,0]=2 1286 B12R1.17 CCOC(=O)c1cc(N)ncn1 Amb24415295 [0,1,0,0,0,0|2,0,0]=3 1287 B12R1.17 CCOC(=O)c1cc(O)ccn1 Amb22741288 [0,1,0,0,0,0|1,0,0]=2 1288 B12R1.17 CCOC(=O)c1cc(S)ccn1 Amb27491629 [0,1,0,0,0,0|1,0,0]=2 1289 B12R1.17 CCOC(=O)c1ccc[n+](C)c1 Amb22369764 [0,1,0,0,0,0|1,0,0]=2 1290 B12R1.17 CCOC(=O)c1ccc[n+]([O-])c1 Amb24109386 [0,1,0,0,0,0|1,0,0]=2 1291 B12R1.17 CCOC(=O)c1cccc(Br)c1 Amb3939177 [0,1,0,0,0,0|0,0,0]=1 1292 B12R1.17 CCOC(=O)c1cccc(Br)n1 Amb2687790 [0,1,0,0,0,0|1,0,0]=2 1293 B12R1.17 CCOC(=O)c1cccc(C)c1 Amb6357586 [0,1,0,0,0,0|0,0,0]=1 1294 B12R1.17 CCOC(=O)c1cccc(Cl)c1 Amb6365956 [0,1,0,0,0,0|0,0,0]=1 1295 B12R1.17 CCOC(=O)c1cccc(Cl)n1 Amb19515866 [0,1,0,0,0,0|1,0,0]=2 1296 B12R1.17 CCOC(=O)c1cccc(F)c1 Amb6357127 [0,1,0,0,0,0|0,0,0]=1 1297 B12R1.17 CCOC(=O)c1cccc(F)n1 Amb23412379 [0,1,0,0,0,0|1,0,0]=2 1298 B12R1.17 CCOC(=O)c1cccc(I)c1 Amb8514836 [0,1,0,0,0,0|0,0,0]=1 1299 B12R1.17 CCOC(=O)c1cccc(N)c1 Amb3940548 [0,1,0,0,0,0|0,0,0]=1 1300 B12R1.17 CCOC(=O)c1cccc(N)c1 Amb6357392 [0,1,0,0,0,0|0,0,0]=1 1301 B12R1.17 CCOC(=O)c1cccc(N)n1 Amb8439355 [0,1,0,0,0,0|1,0,0]=2 1302 B12R1.17 CCOC(=O)c1cccc(O)c1 Amb1800779 [0,1,0,0,0,0|0,0,0]=1 1303 B12R1.17 CCOC(=O)c1cccc(O)n1 Amb1094026 [0,1,0,0,0,0|1,0,0]=2 1304 B12R1.17 CCOC(=O)c1cccc(S)c1 Amb26585185 [0,1,0,0,0,0|0,0,0]=1 1305 B12R1.17 CCOC(=O)c1ccnc(Br)c1 Amb10600785 [0,1,0,0,0,0|1,0,0]=2 1306 B12R1.17 CCOC(=O)c1ccnc(Br)n1 Amb22499758 [0,1,0,0,0,0|2,0,0]=3 1307 B12R1.17 CCOC(=O)c1ccnc(C)c1 Amb19944347 [0,1,0,0,0,0|1,0,0]=2 1308 B12R1.17 CCOC(=O)c1ccnc(C)c1 Amb21856459 [0,1,0,0,0,0|1,0,0]=2 1309 B12R1.17 CCOC(=O)c1ccnc(C)n1 Amb21962511 [0,1,0,0,0,0|2,0,0]=3 1310 B12R1.17 CCOC(=O)c1ccnc(Cl)c1 Amb6301684 [0,1,0,0,0,0|1,0,0]=2 1311 B12R1.17 CCOC(=O)c1ccnc(Cl)n1 Amb19895063 [0,1,0,0,0,0|2,0,0]=3 1312 B12R1.17 CCOC(=O)c1ccnc(F)c1 Amb25034597 [0,1,0,0,0,0|1,0,0]=2 1313 B12R1.17 CCOC(=O)c1ccnc(F)n1 Amb26608414 [0,1,0,0,0,0|2,0,0]=3 1314 B12R1.17 CCOC(=O)c1ccnc(N)c1 Amb2697293 [0,1,0,0,0,0|1,0,0]=2 1315 B12R1.17 CCOC(=O)c1ccnc(N)n1 Amb22275935 [0,1,0,0,0,0|2,0,0]=3 1316 B12R1.17 CCOC(=O)c1ccnc(O)n1 Amb21961011 [0,1,0,0,0,0|2,0,0]=3 1317 B12R1.17 CCOC(=O)c1cncc(Br)c1 Amb1085854 [0,1,0,0,0,0|1,0,0]=2 1318 B12R1.17 CCOC(=O)c1cncc(Br)n1 Amb25688725 [0,1,0,0,0,0|2,0,0]=3 1319 B12R1.17 CCOC(=O)c1cncc(C)c1 Amb8388682 [0,1,0,0,0,0|1,0,0]=2 1320 B12R1.17 CCOC(=O)c1cncc(C)n1 Amb22276838 [0,1,0,0,0,0|2,0,0]=3 1321 B12R1.17 CCOC(=O)c1cncc(Cl)n1 Amb21964836 [0,1,0,0,0,0|2,0,0]=3 1322 B12R1.17 CCOC(=O)c1cncc(I)c1 Amb28252258 [0,1,0,0,0,0|1,0,0]=2 1323 B12R1.17 CCOC(=O)c1cncc(N)c1 Amb578720 [0,1,0,0,0,0|1,0,0]=2 1324 B12R1.17 CCOC(=O)c1cncc(N)n1 Amb18646708 [0,1,0,0,0,0|2,0,0]=3 1325 B12R1.17 CCOC(=O)c1cncc(O)c1 Amb17912115 [0,1,0,0,0,0|1,0,0]=2 1326 B12R1.17 CCOC(=O)c1cncc(O)c1 Amb575994 [0,1,0,0,0,0|1,0,0]=2 1327 B12R1.17 CCOC(=O)c1cncc(O)n1 Amb24649755 [0,1,0,0,0,0|2,0,0]=3 1328 B12R1.17 CCOC(=O)c1cnnc(C)c1 Amb27826054 [0,1,0,0,0,0|2,0,0]=3 1329 B12R1.17 CCOC(=O)c1cnnc(Cl)c1 Amb22499174 [0,1,0,0,0,0|2,0,0]=3 1330 B12R1.17 CCOC(=O)c1cnnc(N)c1 Amb26530704 [0,1,0,0,0,0|2,0,0]=3 1331 B12R1.17 CCOC(=O)c1cnnc(N)n1 Amb27837171 [0,1,0,0,0,0|3,0,0]=4 1332 B12R1.17 CCOC(=O)c1nccc(Cl)n1 Amb25744684 [0,1,0,0,0,0|2,0,0]=3 1333 B12R1.17 CCOC(=O)c1nccc(F)n1 Amb25973419 [0,1,0,0,0,0|2,0,0]=3 1334 B12R1.17 CCOC(=O)c1nccc(I)n1 Amb25159690 [0,1,0,0,0,0|2,0,0]=3 1335 B12R1.17 CCOC(=O)c1nccc(N)n1 Amb16233845 [0,1,0,0,0,0|2,0,0]=3 1336 B12R1.17 CCOC(C)c1cccc(N)c1 Amb18973987 [0,1,0,0,0,0|1,0,1]=3 1337 B12R1.17 CCO[PH](=O)c1cccc(F)c1 Amb27602658 [0,1,0,0,0,0|1,0,0]=2 1338 B12R1.17 CCSC(C)c1cccc(F)c1 Amb27790121 [0,1,0,0,0,0|1,1,1]=4 1339 B12R1.17 CNCC(=O)c1cc(C)ccn1 Amb33318413 [0,1,0,0,0,0|3,0,0]=4 1340 B12R1.17 CNCC(=O)c1cc(Cl)ccn1 Amb24653655 [0,1,0,0,0,0|3,0,0]=4 1341 B12R1.17 CNCC(=O)c1cc(F)ccn1 Amb33415289 [0,1,0,0,0,0|3,0,0]=4 1342 B12R1.17 CNCC(=O)c1cccc(Br)c1 Amb17315041 [0,1,0,0,0,0|2,0,0]=3 1343 B12R1.17 CNCC(=O)c1cccc(Br)n1 Amb33432804 [0,1,0,0,0,0|3,0,0]=4 1344 B12R1.17 CNCC(=O)c1cccc(C)c1 Amb18862586 [0,1,0,0,0,0|2,0,0]=3 1345 B12R1.17 CNCC(=O)c1cccc(C)n1 Amb33200738 [0,1,0,0,0,0|3,0,0]=4 1346 B12R1.17 CNCC(=O)c1cccc(Cl)c1 Amb18863066 [0,1,0,0,0,0|2,0,0]=3 1347 B12R1.17 CNCC(=O)c1cccc(Cl)n1 Amb33223284 [0,1,0,0,0,0|3,0,0]=4 1348 B12R1.17 CNCC(=O)c1cccc(F)c1 Amb18862706 [0,1,0,0,0,0|2,0,0]=3 1349 B12R1.17 CNCC(=O)c1cccc(N)c1 Amb18051532 [0,1,0,0,0,0|2,0,0]=3 1350 B12R1.17 CNCC(=O)c1cccc(O)c1 Amb16231895 [0,1,0,0,0,0|2,0,0]=3 1351 B12R1.17 CNCC(=O)c1cccc(O)c1 Amb17619313 [0,1,0,0,0,0|2,0,0]=3 1352 B12R1.17 CNCC(=O)c1cccc(O)c1 Amb18646278 [0,1,0,0,0,0|2,0,0]=3 1353 B12R1.17 CNCC(=O)c1ccnc(C)c1 Amb33268226 [0,1,0,0,0,0|3,0,0]=4 1354 B12R1.17 CNCC(=O)c1cncc(Br)c1 Amb33389078 [0,1,0,0,0,0|3,0,0]=4 1355 B12R1.17 CNCC(=O)c1cncc(C)c1 Amb25041572 [0,1,0,0,0,0|3,0,0]=4 1356 B12R1.17 CNCC(=O)c1cncc(F)c1 Amb28313591 [0,1,0,0,0,0|3,0,0]=4 1357 B12R1.17 CNNC(=O)c1cccc(Cl)n1 Amb27465586 [0,1,0,0,0,0|3,0,0]=4 1358 B12R1.17 CN\N=C(\C)c1cccc(F)c1 Amb28065760 [0,1,0,0,0,0|3,0,0]=4 1359 B12R1.17 COCC(=O)c1cccc(C)c1 Amb9665971 [0,1,0,0,0,0|2,0,0]=3 1360 B12R1.17 COCC(=O)c1cccc(C)n1 Amb27761882 [0,1,0,0,0,0|3,0,0]=4 1361 B12R1.17 COCC(=O)c1cccc(Cl)c1 Amb9665994 [0,1,0,0,0,0|2,0,0]=3 1362 B12R1.17 COCC(=O)c1cccc(N)n1 Amb27467749 [0,1,0,0,0,0|3,0,0]=4 1363 B12R1.17 COCC(=O)c1cncc(Br)c1 Amb27466920 [0,1,0,0,0,0|3,0,0]=4 1364 B12R1.17 COCC(=O)c1cncc(C)c1 Amb28059105 [0,1,0,0,0,0|3,0,0]=4 1365 B12R1.17 COCC(=O)c1cncc(Cl)c1 Amb28396696 [0,1,0,0,0,0|3,0,0]=4 1366 B12R1.17 CONC(=O)c1cccc(C)c1 Amb16980458 [0,1,0,0,0,0|2,0,0]=3 1367 B12R1.17 CONC(=O)c1cccc(C)n1 Amb27402982 [0,1,0,0,0,0|3,0,0]=4 1368 B12R1.17 CONC(=O)c1cccc(Cl)c1 Amb16969942 [0,1,0,0,0,0|2,0,0]=3 1369 B12R1.17 CONC(=O)c1cccc(Cl)n1 Amb28383672 [0,1,0,0,0,0|3,0,0]=4 1370 B12R1.17 CONC(=O)c1cccc(I)c1 Amb8283933 [0,1,0,0,0,0|2,0,0]=3 1371 B12R1.17 CONC(=O)c1cccc(N)c1 Amb27658442 [0,1,0,0,0,0|2,0,0]=3 1372 B12R1.17 CONC(=O)c1cncc(Br)c1 Amb16072976 [0,1,0,0,0,0|3,0,0]=4 1373 B12R1.17 CONC(=O)c1cncc(C)c1 Amb28140140 [0,1,0,0,0,0|3,0,0]=4 1374 B12R1.17 CO\N=C(/N)c1cccc(Br)c1 Amb18227752 [0,1,0,0,0,0|3,0,0]=4 1375 B12R1.17 CO\N=C(/N)c1cccc(C)c1 Amb845157 [0,1,0,0,0,0|3,0,0]=4 1376 B12R1.17 CO\N=C(/N)c1cccc(Cl)c1 Amb18863110 [0,1,0,0,0,0|3,0,0]=4 1377 B12R1.17 CO\N=C(/N)c1cccc(F)c1 Amb18862746 [0,1,0,0,0,0|3,0,0]=4 1378 B12R1.17 CO\N=C(\C)c1cccc(Br)c1 Amb27190646 [0,1,0,0,0,0|3,0,0]=4 1379 B12R1.17 CO\N=C(\C)c1cccc(Cl)c1 Amb27804711 [0,1,0,0,0,0|3,0,0]=4 1380 B12R1.17 CO\N=C(\C)c1cccc(F)c1 Amb27833435 [0,1,0,0,0,0|3,0,0]=4 1381 B12R1.17 CO\N=C(\C)c1cccc(N)c1 Amb28044905 [0,1,0,0,0,0|3,0,0]=4 1382 B12R1.17 CO\N=C(\C)c1cccc(O)c1 Amb27178904 [0,1,0,0,0,0|3,0,0]=4 1383 B12R1.17 CSCC(=O)c1cccc(Br)c1 Amb25149784 [0,1,0,0,0,0|2,0,0]=3 1384 B12R1.17 CSCC(=O)c1cccc(C)c1 Amb18796323 [0,1,0,0,0,0|2,0,0]=3 1385 B12R1.17 CSCC(=O)c1cccc(Cl)c1 Amb18320097 [0,1,0,0,0,0|2,0,0]=3 1386 B12R1.17 CSCC(=O)c1cccc(F)c1 Amb19057446 [0,1,0,0,0,0|2,0,0]=3 1387 B12R1.17 CSCC(=O)c1cccc(I)c1 Amb27866073 [0,1,0,0,0,0|2,0,0]=3 1388 B12R1.17 CSCC(=O)c1cncc(C)c1 Amb28348120 [0,1,0,0,0,0|3,0,0]=4 1389 B12R1.17 C\C(=C/CN)c1cccc(Br)c1 Amb31098023 [0,1,0,0,0,0|3,0,0]=4 1390 B12R1.17 C\C(=C/CN)c1cccc(C)c1 Amb31099549 [0,1,0,0,0,0|3,0,0]=4 1391 B12R1.17 C\C(=C/CN)c1cccc(F)c1 Amb31099553 [0,1,0,0,0,0|3,0,0]=4 1392 B12R1.17 C\C(=C/CO)c1cccc(Br)c1 Amb27248580 [0,1,0,0,0,0|3,0,0]=4 1393 B12R1.17 C\C(=C/CO)c1cccc(Cl)c1 Amb27628731 [0,1,0,0,0,0|3,0,0]=4 1394 B12R1.17 C\C(=C\CCl)c1cccc(Cl)c1 Amb27428002 [0,1,0,0,0,0|3,0,0]=4 1395 B12R1.17 C\C=C\C(=O)c1cccc(Cl)c1 Amb27243983 [0,1,0,0,0,0|1,0,1]=3 1396 B12R1.17 Cc1cc(C(=O)CCN)ccn1 Amb33268545 [0,1,0,0,0,0|3,0,0]=4 1397 B12R1.17 Cc1cccc(C(=O)C=[N+]=[N-])c1 Amb25761996 [0,1,0,0,0,0|3,0,0]=4 1398 B12R1.17 Cc1cccc(C(=O)CC#N)c1 Amb1648833 [0,1,0,0,0,0|2,0,1]=4 1399 B12R1.17 Cc1cccc(C(=O)CC=O)c1 Amb18788116 [0,1,0,0,0,0|2,0,1]=4 1400 B12R1.17 Cc1cccc(C(=O)CCBr)c1 Amb26841200 [0,1,0,0,0,0|2,0,0]=3 1401 B12R1.17 Cc1cccc(C(=O)CCN)c1 Amb24700399 [0,1,0,0,0,0|2,0,0]=3 1402 B12R1.17 Cc1cccc(C(=O)CCN)n1 Amb33200747 [0,1,0,0,0,0|3,0,0]=4 1403 B12R1.17 Cc1cccc(C(=O)CCO)c1 Amb25735228 [0,1,0,0,0,0|2,0,0]=3 1404 B12R1.17 Cc1cccc(C(=O)N=C=O)c1 Amb6252639 [0,1,0,0,0,0|2,0,1]=4 1405 B12R1.17 Cc1cccc(C(=O)N=C=S)c1 Amb2689337 [0,1,0,0,0,0|2,0,1]=4 1406 B12R1.17 Cc1cccc(C(=O)N=[N+]=[N-])c1 Amb8938198 [0,1,0,0,0,0|3,0,0]=4 1407 B12R1.17 Cc1cccc(C(=O)NC#N)c1 Amb27616988 [0,1,0,0,0,0|2,0,1]=4 1408 B12R1.17 Cc1cccc(C(=O)NCO)c1 Amb27616730 [0,1,0,0,0,0|2,0,0]=3 1409 B12R1.17 Cc1cccc(C(=O)OCCl)c1 Amb28119804 [0,1,0,0,0,0|1,0,0]=2 1410 B12R1.17 Cc1cccc(C(=O)\C=C\[O-])c1 Amb28077592 [0,1,0,0,0,0|2,0,1]=4 1411 B12R1.17 Cc1cccc(C(=O)\C=N\O)c1 Amb26975599 [0,1,0,0,0,0|3,0,0]=4 1412 B12R1.17 Cc1cccc(S(=O)CCN)c1 Amb18974528 [0,1,0,0,0,0|3,0,0]=4 1413 B12R1.17 Cc1ccnc(C(=O)CCN)c1 Amb33318418 [0,1,0,0,0,0|3,0,0]=4 1414 B12R1.17 Cc1cncc(C(=O)CCN)c1 Amb24460200 [0,1,0,0,0,0|3,0,0]=4 1415 B12R1.17 N#CCC(=O)c1cccc(Br)c1 Amb3938913 [0,1,0,0,0,0|2,0,1]=4 1416 B12R1.17 N#CCC(=O)c1cccc(Cl)c1 Amb1676838 [0,1,0,0,0,0|2,0,1]=4 1417 B12R1.17 N#CCC(=O)c1cccc(F)c1 Amb2688031 [0,1,0,0,0,0|2,0,1]=4 1418 B12R1.17 N#CCC(=O)c1cccc(I)c1 Amb7786151 [0,1,0,0,0,0|2,0,1]=4 1419 B12R1.17 N#CCC(=O)c1cccc(O)c1 Amb10071608 [0,1,0,0,0,0|2,0,1]=4 1420 B12R1.17 N#CNC(=O)c1cccc(Br)c1 Amb27489244 [0,1,0,0,0,0|2,0,1]=4 1421 B12R1.17 N#CNC(=O)c1cccc(I)c1 Amb27950822 [0,1,0,0,0,0|2,0,1]=4 1422 B12R1.17 N#CNC(=O)c1cccc(O)c1 Amb27656887 [0,1,0,0,0,0|2,0,1]=4 1423 B12R1.17 NCCC(=O)c1cc(F)ccn1 Amb33415295 [0,1,0,0,0,0|3,0,0]=4 1424 B12R1.17 NCCC(=O)c1cccc(Br)c1 Amb18121501 [0,1,0,0,0,0|2,0,0]=3 1425 B12R1.17 NCCC(=O)c1cccc(Br)n1 Amb33432799 [0,1,0,0,0,0|3,0,0]=4 1426 B12R1.17 NCCC(=O)c1cccc(Cl)c1 Amb26318502 [0,1,0,0,0,0|2,0,0]=3 1427 B12R1.17 NCCC(=O)c1cccc(Cl)n1 Amb33223046 [0,1,0,0,0,0|3,0,0]=4 1428 B12R1.17 NCCC(=O)c1cccc(F)c1 Amb27416316 [0,1,0,0,0,0|2,0,0]=3 1429 B12R1.17 NCCC(=O)c1cccc(O)c1 Amb27479943 [0,1,0,0,0,0|2,0,0]=3 1430 B12R1.17 NCCC(=O)c1cncc(Br)c1 Amb33389080 [0,1,0,0,0,0|3,0,0]=4 1431 B12R1.17 NCCC(=O)c1cncc(F)c1 Amb25809288 [0,1,0,0,0,0|3,0,0]=4 1432 B12R1.17 N\C=C\C(=O)c1cccc(Cl)c1 Amb27190737 [0,1,0,0,0,0|2,0,1]=4 1433 B12R1.17 Nc1cccc(C(=O)CCCl)c1 Amb27665899 [0,1,0,0,0,0|2,0,0]=3 1434 B12R1.17 Nc1cccc(C(=O)N=C=S)c1 Amb28118409 [0,1,0,0,0,0|2,0,1]=4 1435 B12R1.17 Nc1cccc(S(=O)CCO)c1 Amb27197309 [0,1,0,0,0,0|3,0,0]=4 1436 B12R1.17 O=C(CCBr)c1cccc(Br)c1 Amb17437897 [0,1,0,0,0,0|2,0,0]=3 1437 B12R1.17 O=C(CCBr)c1cccc(F)c1 Amb25669661 [0,1,0,0,0,0|2,0,0]=3 1438 B12R1.17 O=C(CCBr)c1cccc(I)c1 Amb26398515 [0,1,0,0,0,0|2,0,0]=3 1439 B12R1.17 O=C(CCBr)c1cccc(O)c1 Amb28187113 [0,1,0,0,0,0|2,0,0]=3 1440 B12R1.17 O=C(CCCl)c1cccc(Br)c1 Amb17351482 [0,1,0,0,0,0|2,0,0]=3 1441 B12R1.17 O=C(CCCl)c1cccc(Cl)c1 Amb25742498 [0,1,0,0,0,0|2,0,0]=3 1442 B12R1.17 O=C(CCCl)c1cccc(I)c1 Amb27488590 [0,1,0,0,0,0|2,0,0]=3 1443 B12R1.17 O=C(CCCl)c1cccc(O)c1 Amb26549170 [0,1,0,0,0,0|2,0,0]=3 1444 B12R1.17 O=C(CCI)c1cccc(Cl)c1 Amb27621668 [0,1,0,0,0,0|2,0,0]=3 1445 B12R1.17 O=C(CCO)c1cccc(Br)c1 Amb26883865 [0,1,0,0,0,0|2,0,0]=3 1446 B12R1.17 O=C(CCO)c1cccc(F)c1 Amb27163257 [0,1,0,0,0,0|2,0,0]=3 1447 B12R1.17 O=C(N=C=S)c1cccc(Cl)c1 Amb2685767 [0,1,0,0,0,0|2,0,1]=4 1448 B12R1.17 O=C(N=C=S)c1cccc(O)c1 Amb28243846 [0,1,0,0,0,0|2,0,1]=4 1449 B12R1.17 O=C(OCCl)c1cccc(F)c1 Amb27389148 [0,1,0,0,0,0|1,0,0]=2 1450 B12R1.17 O=C(\C=C/[O-])c1cccc(Br)c1 Amb24121221 [0,1,0,0,0,0|2,0,1]=4 1451 B12R1.17 O=C(\C=C\Br)c1cccc(O)c1 Amb33135431 [0,1,0,0,0,0|2,0,1]=4 1452 B12R1.17 O=C(\C=C\Cl)c1cccc(Br)c1 Amb35609465 [0,1,0,0,0,0|2,0,1]=4 1453 B12R1.17 O=C(\C=C\Cl)c1cccc(Cl)c1 Amb35609457 [0,1,0,0,0,0|2,0,1]=4 1454 B12R1.17 O=C(\C=C\Cl)c1cccc(F)c1 Amb35585506 [0,1,0,0,0,0|2,0,1]=4 1455 B12R1.17 O=C(\C=C\Cl)c1cccc(I)c1 Amb35609472 [0,1,0,0,0,0|2,0,1]=4 1456 B12R1.17 O=C(\C=C\Cl)c1cccc(O)c1 Amb35645315 [0,1,0,0,0,0|2,0,1]=4 1457 B12R1.17 O=C(\C=N/O)c1cccc(O)c1 Amb28070820 [0,1,0,0,0,0|3,0,0]=4 1458 B12R1.17 O=C(\C=N\O)c1cccc(O)c1 Amb25706998 [0,1,0,0,0,0|3,0,0]=4 1459 B12R1.17 O=C=NC(=O)c1cccc(Br)c1 Amb17247241 [0,1,0,0,0,0|2,0,1]=4 1460 B12R1.17 O=C=NC(=O)c1cccc(Cl)c1 Amb6252638 [0,1,0,0,0,0|2,0,1]=4 1461 B12R1.17 O=C=NC(=O)c1cccc(F)c1 Amb6252637 [0,1,0,0,0,0|2,0,1]=4 1462 B12R1.17 O=CCC(=O)c1cccc(Br)c1 Amb9204925 [0,1,0,0,0,0|2,0,1]=4 1463 B12R1.17 O=CCC(=O)c1cccc(Cl)c1 Amb7766342 [0,1,0,0,0,0|2,0,1]=4 1464 B12R1.17 O=CCC(=O)c1cccc(F)c1 Amb9204905 [0,1,0,0,0,0|2,0,1]=4 1465 B12R1.17 [N-]=[N+]=CC(=O)c1cccc(Br)c1 Amb26883796 [0,1,0,0,0,0|3,0,0]=4 1466 B12R1.17 [N-]=[N+]=CC(=O)c1cccc(F)c1 Amb25320625 [0,1,0,0,0,0|3,0,0]=4 1467 B12R1.17 [N-]=[N+]=NC(=O)c1cccc(Br)c1 Amb8439581 [0,1,0,0,0,0|3,0,0]=4 1468 B12R1.17 [N-]=[N+]=NC(=O)c1cccc(Cl)c1 Amb8938220 [0,1,0,0,0,0|3,0,0]=4 1469 B12R1.17 [N-]=[N+]=NC(=O)c1cccc(F)c1 Amb8938203 [0,1,0,0,0,0|3,0,0]=4 1470 B12R1.17 [N-]=[N+]=NC(=O)c1cccc(I)c1 Amb8938239 [0,1,0,0,0,0|3,0,0]=4 1471 B12R1.17 [N-]=[N+]=NC(=O)c1cccc(N)c1 Amb28146851 [0,1,0,0,0,0|3,0,0]=4 1472 B12R1.17 [N-]=[N+]=NC(=O)c1cccc(O)c1 Amb27873257 [0,1,0,0,0,0|3,0,0]=4 1473 B12R1.30 C#CCCC(=O)c1ccccc1 Amb8869629 [0,1,0,0,0,0|1,0,1]=3 1474 B12R1.30 C#CCCC(=O)c1ccccn1 Amb27475769 [0,1,0,0,0,0|2,0,1]=4 1475 B12R1.30 C#CCNC(=O)c1ccccc1 Amb4406905 [0,1,0,0,0,0|1,0,1]=3 1476 B12R1.30 C#CCNC(=O)c1ccccn1 Amb8330929 [0,1,0,0,0,0|2,0,1]=4 1477 B12R1.30 C#CCOC(=O)c1ccccn1 Amb28344514 [0,1,0,0,0,0|1,0,1]=3 1478 B12R1.30 C#CCOC(=O)c1cccnc1 Amb2780586 [0,1,0,0,0,0|1,0,1]=3 1479 B12R1.30 C#CCOC(=O)c1ccncc1 Amb27809226 [0,1,0,0,0,0|1,0,1]=3 1480 B12R1.30 C#CCOC(=O)c1ccncn1 Amb8438940 [0,1,0,0,0,0|2,0,1]=4 1481 B12R1.30 C#CCOC(=O)c1cnccn1 Amb28193567 [0,1,0,0,0,0|2,0,1]=4 1482 B12R1.30 C#CCOC(=O)c1ncccn1 Amb28281442 [0,1,0,0,0,0|2,0,1]=4 1483 B12R1.30 C#CC\N=C(\N)c1ccccc1 Amb25784600 [0,1,0,0,0,0|2,0,1]=4 1484 B12R1.30 C#C\C=C\C(=O)c1ccccc1 Amb8389984 [0,1,0,0,0,0|1,0,2]=4 1485 B12R1.30 C=C=CCC(=O)c1ccccc1 Amb27177995 [0,1,0,0,0,0|1,0,2]=4 1486 B12R1.30 C=CC#CC(=O)c1ccccc1 Amb27802550 [0,1,0,0,0,0|1,0,2]=4 1487 B12R1.30 C=CCCC(=O)c1ccccc1 Amb9031540 [0,1,0,0,0,0|1,0,1]=3 1488 B12R1.30 C=CCNC(=N)c1ccccc1 Amb26517100 [0,1,0,0,0,0|2,0,1]=4 1489 B12R1.30 C=CCNC(=O)c1ccccc1 Amb3098985 [0,1,0,0,0,0|1,0,1]=3 1490 B12R1.30 C=CCNC(=O)c1ccccn1 Amb26950124 [0,1,0,0,0,0|2,0,1]=4 1491 B12R1.30 C=CCNC(=O)c1cccnc1 Amb17794173 [0,1,0,0,0,0|2,0,1]=4 1492 B12R1.30 C=CCNC(=S)c1ccccc1 Amb27482551 [0,1,0,0,0,0|1,1,1]=4 1493 B12R1.30 C=CCOC(=O)c1ccccc1 Amb4034453 [0,1,0,0,0,0|0,0,1]=2 1494 B12R1.30 C=CCOC(=O)c1cccnc1 Amb2780585 [0,1,0,0,0,0|1,0,1]=3 1495 B12R1.30 C=CCOC(=O)c1ccncc1 Amb22730922 [0,1,0,0,0,0|1,0,1]=3 1496 B12R1.30 C=C\C=C\C(=O)c1ccccc1 Amb27267134 [0,1,0,0,0,0|1,0,2]=4 1497 B12R1.30 CC#COC(=O)c1ccccc1 Amb27777575 [0,1,0,0,0,0|0,0,1]=2 1498 B12R1.30 CC(CCCBr)c1ccccc1 Amb33082370 [0,1,0,0,0,0|2,0,1]=4 1499 B12R1.30 CC(CCCN)c1ccccc1 Amb18563593 [0,1,0,0,0,0|2,0,1]=4 1500 B12R1.30 CC(CCCO)c1ccccc1 Amb33213887 [0,1,0,0,0,0|2,0,1]=4 1501 B12R1.30 CC(CCCS)c1ccccc1 Amb33082130 [0,1,0,0,0,0|2,0,1]=4 1502 B12R1.30 CC(NCCCl)c1ccccc1 Amb17335659 [0,1,0,0,0,0|2,0,1]=4 1503 B12R1.30 CC(NCCN)c1ccccc1 Amb17091024 [0,1,0,0,0,0|2,0,1]=4 1504 B12R1.30 CC(NCCO)c1ccccc1 Amb2092663 [0,1,0,0,0,0|2,0,1]=4 1505 B12R1.30 CC(OCCN)c1ccccc1 Amb6248427 [0,1,0,0,0,0|1,0,1]=3 1506 B12R1.30 CC(OCCO)c1ccccc1 Amb24103429 [0,1,0,0,0,0|1,0,1]=3 1507 B12R1.30 CC(SCCN)c1ccccc1 Amb17500453 [0,1,0,0,0,0|1,1,1]=4 1508 B12R1.30 CC=C=CC(=O)c1ccccc1 Amb28144211 [0,1,0,0,0,0|1,0,1]=3 1509 B12R1.30 CCCCC(=O)c1ccccc1 Amb4605998 [0,1,0,0,0,0|1,0,0]=2 1510 B12R1.30 CCCCC(=O)c1ccccn1 Amb6301472 [0,1,0,0,0,0|2,0,0]=3 1511 B12R1.30 CCCCC(=O)c1cccnc1 Amb10607964 [0,1,0,0,0,0|2,0,0]=3 1512 B12R1.30 CCCCC(=O)c1ccncc1 Amb10573758 [0,1,0,0,0,0|2,0,0]=3 1513 B12R1.30 CCCCC(=O)c1cnccn1 Amb18798311 [0,1,0,0,0,0|3,0,0]=4 1514 B12R1.30 CCCCC(N)c1ccccc1 Amb9717704 [0,1,0,0,0,0|2,0,1]=4 1515 B12R1.30 CCCCC(O)c1ccccc1 Amb4034459 [0,1,0,0,0,0|1,0,2]=4 1516 B12R1.30 CCCCC(S)c1ccccc1 Amb32788793 [0,1,0,0,0,0|1,1,1]=4 1517 B12R1.30 CCCCN(N)c1ccccc1 Amb17226670 [0,1,0,0,0,0|3,0,0]=4 1518 B12R1.30 CCCC[C@@H](N)c1ccccc1 Amb28555742 [0,1,0,0,0,0|2,0,1]=4 1519 B12R1.30 CCCC[C@@H](N)c1ccccc1 Amb33276169 [0,1,0,0,0,0|2,0,1]=4 1520 B12R1.30 CCCC[C@@H](O)c1ccccc1 Amb30627576 [0,1,0,0,0,0|1,0,2]=4 1521 B12R1.30 CCCC[C@H](N)c1ccccc1 Amb28555741 [0,1,0,0,0,0|2,0,1]=4 1522 B12R1.30 CCCC[C@H](N)c1ccccc1 Amb33276167 [0,1,0,0,0,0|2,0,1]=4 1523 B12R1.30 CCCC[C@H](O)c1ccccc1 Amb28555740 [0,1,0,0,0,0|1,0,2]=4 1524 B12R1.30 CCCNC(=N)c1ccccc1 Amb23447119 [0,1,0,0,0,0|2,0,0]=3 1525 B12R1.30 CCCNC(=O)c1ccccn1 Amb8330947 [0,1,0,0,0,0|2,0,0]=3 1526 B12R1.30 CCCNC(=O)c1cccnc1 Amb3357738 [0,1,0,0,0,0|2,0,0]=3 1527 B12R1.30 CCCNC(=O)c1ccncn1 Amb27857474 [0,1,0,0,0,0|3,0,0]=4 1528 B12R1.30 CCCNC(=O)c1cnccn1 Amb8331906 [0,1,0,0,0,0|3,0,0]=4 1529 B12R1.30 CCCNC(=O)c1ncccn1 Amb28369202 [0,1,0,0,0,0|3,0,0]=4 1530 B12R1.30 CCCNC(=S)c1ccccn1 Amb27983603 [0,1,0,0,0,0|2,1,0]=4 1531 B12R1.30 CCCNC(C)c1ccccc1 Amb6335367 [0,1,0,0,0,0|2,0,1]=4 1532 B12R1.30 CCCNC(C)c1ccccc1 Amb9726952 [0,1,0,0,0,0|2,0,1]=4 1533 B12R1.30 CCCOC(=O)c1ccccc1 Amb6357116 [0,1,0,0,0,0|0,0,0]=1 1534 B12R1.30 CCCOC(=O)c1cccnc1 Amb1958081 [0,1,0,0,0,0|1,0,0]=2 1535 B12R1.30 CCCOC(=O)c1cnccn1 Amb18801005 [0,1,0,0,0,0|2,0,0]=3 1536 B12R1.30 CCC\C=C(\N)c1ccccc1 Amb27965051 [0,1,0,0,0,0|2,0,0]=3 1537 B12R1.30 CCC\C=C(\N)c1ccncc1 Amb28385666 [0,1,0,0,0,0|3,0,0]=4 1538 B12R1.30 CCC\N=C(/C)c1ccccc1 Amb17779516 [0,1,0,0,0,0|2,0,0]=3 1539 B12R1.30 CCC\N=C(/N)c1cccnc1 Amb21970337 [0,1,0,0,0,0|3,0,0]=4 1540 B12R1.30 CCNCC(C)c1ccccc1 Amb6729198 [0,1,0,0,0,0|2,0,1]=4 1541 B12R1.30 CCNCC(N)c1ccccc1 Amb19009737 [0,1,0,0,0,0|2,0,1]=4 1542 B12R1.30 CCNCC(O)c1ccccc1 Amb9247502 [0,1,0,0,0,0|1,0,2]=4 1543 B12R1.30 CCNNC(=N)c1cccnc1 Amb28326265 [0,1,0,0,0,0|3,0,0]=4 1544 B12R1.30 CCN\C=C(/N)c1ccccc1 Amb27668811 [0,1,0,0,0,0|2,0,0]=3 1545 B12R1.30 CCOCC(=O)c1ccccc1 Amb9666077 [0,1,0,0,0,0|0,0,0]=1 1546 B12R1.30 CCOCC(=O)c1ccccn1 Amb6301484 [0,1,0,0,0,0|1,0,0]=2 1547 B12R1.30 CCOCC(N)c1ccccc1 Amb1125200 [0,1,0,0,0,0|1,0,1]=3 1548 B12R1.30 CCOC[C@@H](N)c1ccccc1 Amb17061646 [0,1,0,0,0,0|1,0,1]=3 1549 B12R1.30 CCOC[C@H](N)c1ccccc1 Amb35747248 [0,1,0,0,0,0|1,0,1]=3 1550 B12R1.30 CCOC[C@H](N)c1ccccc1 Amb35747836 [0,1,0,0,0,0|1,0,1]=3 1551 B12R1.30 CCONC(=O)c1ccccc1 Amb10572541 [0,1,0,0,0,0|0,0,0]=1 1552 B12R1.30 CCONC(=O)c1cccnc1 Amb27221999 [0,1,0,0,0,0|1,0,0]=2 1553 B12R1.30 CCONC(=O)c1ccncc1 Amb27769987 [0,1,0,0,0,0|1,0,0]=2 1554 B12R1.30 CCONC(=O)c1cnccn1 Amb27483740 [0,1,0,0,0,0|2,0,0]=3 1555 B12R1.30 CCO\N=C(/N)c1ccccc1 Amb18862600 [0,1,0,0,0,0|1,0,0]=2 1556 B12R1.30 CCO\N=C(/N)c1ccccn1 Amb18862624 [0,1,0,0,0,0|2,0,0]=3 1557 B12R1.30 CCO\N=C(/N)c1cccnc1 Amb18862625 [0,1,0,0,0,0|2,0,0]=3 1558 B12R1.30 CCO\N=C(/N)c1ccncc1 Amb18862626 [0,1,0,0,0,0|2,0,0]=3 1559 B12R1.30 CCSCC(=O)c1ccccc1 Amb2778943 [0,1,0,0,0,0|0,1,0]=2 1560 B12R1.30 CC\C=C\C(N)c1ccccc1 Amb27790820 [0,1,0,0,0,0|2,0,1]=4 1561 B12R1.30 CC\C=C\C(O)c1ccccc1 Amb22546781 [0,1,0,0,0,0|1,0,2]=4 1562 B12R1.30 CC\C=C\[C@@H](O)c1ccccc1 Amb27598606 [0,1,0,0,0,0|1,0,2]=4 1563 B12R1.30 CC\C=N\[C@H](C)c1ccccc1 Amb27852444 [0,1,0,0,0,0|2,0,1]=4 1564 B12R1.30 CN(CCCBr)c1ccccc1 Amb32664174 [0,1,0,0,0,0|3,0,0]=4 1565 B12R1.30 CN(CCCBr)c1ccccc1 Amb32664423 [0,1,0,0,0,0|3,0,0]=4 1566 B12R1.30 CN(CCCCl)c1ccccc1 Amb17335669 [0,1,0,0,0,0|3,0,0]=4 1567 B12R1.30 CN(CCCN)c1ccccc1 Amb2786601 [0,1,0,0,0,0|3,0,0]=4 1568 B12R1.30 CN(CCCO)c1ccccc1 Amb9246590 [0,1,0,0,0,0|3,0,0]=4 1569 B12R1.30 CNCCC(=O)c1ccccc1 Amb11032366 [0,1,0,0,0,0|1,0,0]=2 1570 B12R1.30 CNCCC(=O)c1ccccc1 Amb8390832 [0,1,0,0,0,0|1,0,0]=2 1571 B12R1.30 CNCCC(C)c1ccccc1 Amb5739286 [0,1,0,0,0,0|2,0,1]=4 1572 B12R1.30 CNCCC(Cl)c1ccccc1 Amb8629327 [0,1,0,0,0,0|2,0,1]=4 1573 B12R1.30 CNCCC(O)c1ccccc1 Amb3939363 [0,1,0,0,0,0|1,0,2]=4 1574 B12R1.30 CNCCN(C)c1ccccc1 Amb6715077 [0,1,0,0,0,0|3,0,0]=4 1575 B12R1.30 CNCNC(=O)c1ccccc1 Amb27402677 [0,1,0,0,0,0|1,0,0]=2 1576 B12R1.30 CNC\C=C(/C)c1ccccc1 Amb23555664 [0,1,0,0,0,0|2,0,0]=3 1577 B12R1.30 CNC\C=C(/C)c1ccccn1 Amb31161604 [0,1,0,0,0,0|3,0,0]=4 1578 B12R1.30 CNC\C=C(/C)c1cccnc1 Amb31161605 [0,1,0,0,0,0|3,0,0]=4 1579 B12R1.30 CNC\C=C(/C)c1ccncc1 Amb31161606 [0,1,0,0,0,0|3,0,0]=4 1580 B12R1.30 CNC\C=C(\C)c1ccccc1 Amb27963918 [0,1,0,0,0,0|2,0,0]=3 1581 B12R1.30 CN\C=C/C(=O)c1ccccc1 Amb2386631 [0,1,0,0,0,0|1,0,1]=3 1582 B12R1.30 CN\C=C\C(=S)c1ccccc1 Amb27462236 [0,1,0,0,0,0|1,1,1]=4 1583 B12R1.30 COCCC(=O)c1ccccc1 Amb33538573 [0,1,0,0,0,0|1,0,0]=2 1584 B12R1.30 COCCC(Cl)c1ccccc1 Amb32686938 [0,1,0,0,0,0|2,0,1]=4 1585 B12R1.30 COCCC(N)c1ccccc1 Amb34912740 [0,1,0,0,0,0|2,0,1]=4 1586 B12R1.30 COCCC(O)c1ccccc1 Amb18788453 [0,1,0,0,0,0|1,0,2]=4 1587 B12R1.30 COCC[C@@H](N)c1ccccc1 Amb33620965 [0,1,0,0,0,0|2,0,1]=4 1588 B12R1.30 COCC[C@@H](N)c1ccccc1 Amb33738637 [0,1,0,0,0,0|2,0,1]=4 1589 B12R1.30 COCNC(=O)c1ccncc1 Amb28239521 [0,1,0,0,0,0|2,0,0]=3 1590 B12R1.30 CSCCC(=O)c1ccccc1 Amb32683163 [0,1,0,0,0,0|1,0,0]=2 1591 B12R1.30 CSCNC(=O)c1ccccc1 Amb28208358 [0,1,0,0,0,0|1,0,0]=2 1592 B12R1.30 CS\C=C\C(=O)c1ccccc1 Amb27973048 [0,1,0,0,0,0|1,0,1]=3 1593 B12R1.30 C[C@@H](NCCCl)c1ccccc1 Amb30621967 [0,1,0,0,0,0|2,0,1]=4 1594 B12R1.30 C[C@@H](NCCO)c1ccccc1 Amb2721786 [0,1,0,0,0,0|2,0,1]=4 1595 B12R1.30 C[C@H](NCCO)c1ccccc1 Amb2698698 [0,1,0,0,0,0|2,0,1]=4 1596 B12R1.30 C[NH2+]CCC(O)c1ccccc1 Amb33513043 [0,1,0,0,0,0|1,0,2]=4 1597 B12R1.30 C\C(=C/CCBr)c1ccccc1 Amb17246875 [0,1,0,0,0,0|2,0,0]=3 1598 B12R1.30 C\C(=C/CCCl)c1ccccc1 Amb17233775 [0,1,0,0,0,0|2,0,0]=3 1599 B12R1.30 C\C(=C/CCN)c1ccccc1 Amb17232384 [0,1,0,0,0,0|2,0,0]=3 1600 B12R1.30 C\C(=C/CCN)c1ccccn1 Amb31161607 [0,1,0,0,0,0|3,0,0]=4 1601 B12R1.30 C\C(=C/CCN)c1cccnc1 Amb31161608 [0,1,0,0,0,0|3,0,0]=4 1602 B12R1.30 C\C(=C/CCN)c1ccncc1 Amb31161609 [0,1,0,0,0,0|3,0,0]=4 1603 B12R1.30 C\C(=C/CCO)c1ccccc1 Amb28421884 [0,1,0,0,0,0|2,0,0]=3 1604 B12R1.30 C\C(=C\CC=O)c1ccccc1 Amb24757521 [0,1,0,0,0,0|2,0,1]=4 1605 B12R1.30 C\C(=C\CCCl)c1cccnc1 Amb27627718 [0,1,0,0,0,0|3,0,0]=4 1606 B12R1.30 C\C(=C\CCN)c1ccccc1 Amb27453270 [0,1,0,0,0,0|2,0,0]=3 1607 B12R1.30 C\C(=C\CCN)c1cccnc1 Amb27470574 [0,1,0,0,0,0|3,0,0]=4 1608 B12R1.30 C\C(=C\CCO)c1ccccc1 Amb27840638 [0,1,0,0,0,0|2,0,0]=3 1609 B12R1.30 C\C(=C\CNN)c1ccccc1 Amb28429635 [0,1,0,0,0,0|3,0,0]=4 1610 B12R1.30 C\C(=N/OCCl)c1ccccc1 Amb27974241 [0,1,0,0,0,0|2,0,0]=3 1611 B12R1.30 C\C=C\CS(=O)c1ccccc1 Amb28365911 [0,1,0,0,0,0|2,0,1]=4 1612 B12R1.30 C\C=C\NC(=O)c1ccccc1 Amb27800283 [0,1,0,0,0,0|1,0,1]=3 1613 B12R1.30 C\C=N/NC(=O)c1ccccc1 Amb24072878 [0,1,0,0,0,0|1,0,1]=3 1614 B12R1.30 C\C=N\N=C(/N)c1ccccc1 Amb27476220 [0,1,0,0,0,0|2,0,1]=4 1615 B12R1.30 C\C=N\NC(=O)c1ccccc1 Amb4431611 [0,1,0,0,0,0|1,0,1]=3 1616 B12R1.30 C\C=N\NC(=O)c1cccnc1 Amb3106727 [0,1,0,0,0,0|2,0,1]=4 1617 B12R1.30 N#CCCC(=O)c1ccccc1 Amb1672449 [0,1,0,0,0,0|1,0,1]=3 1618 B12R1.30 N#CCCC(=O)c1ccccn1 Amb9472150 [0,1,0,0,0,0|2,0,1]=4 1619 B12R1.30 N#CCCC(=O)c1cccnc1 Amb455618 [0,1,0,0,0,0|2,0,1]=4 1620 B12R1.30 N#CCCC(=O)c1ccncc1 Amb9472177 [0,1,0,0,0,0|2,0,1]=4 1621 B12R1.30 N#CCNC(=O)c1ccccc1 Amb6346069 [0,1,0,0,0,0|1,0,1]=3 1622 B12R1.30 N#CCNC(=O)c1ccccn1 Amb18180001 [0,1,0,0,0,0|2,0,1]=4 1623 B12R1.30 N#CCNC(=O)c1ccncc1 Amb18180002 [0,1,0,0,0,0|2,0,1]=4 1624 B12R1.30 N#CCOC(=O)c1ccccc1 Amb8384344 [0,1,0,0,0,0|0,0,1]=2 1625 B12R1.30 N#CCOC(=O)c1ccccn1 Amb22751030 [0,1,0,0,0,0|1,0,1]=3 1626 B12R1.30 N#CCOC(=O)c1ccncc1 Amb27406543 [0,1,0,0,0,0|1,0,1]=3 1627 B12R1.30 N#CCOC(=O)c1ccnnc1 Amb27979927 [0,1,0,0,0,0|2,0,1]=4 1628 B12R1.30 N#CCOC(=O)c1cnccn1 Amb28256372 [0,1,0,0,0,0|2,0,1]=4 1629 B12R1.30 N#CCSC(=S)c1ccccc1 Amb26375487 [0,1,0,0,0,0|0,2,1]=4 1630 B12R1.30 N#CSCC(=O)c1ccccc1 Amb2616276 [0,1,0,0,0,0|1,1,1]=4 1631 B12R1.30 N#C\N=N\C(=O)c1ccccc1 Amb28247241 [0,1,0,0,0,0|2,0,1]=4 1632 B12R1.30 N=C(NCCO)c1ccccc1 Amb26974089 [0,1,0,0,0,0|2,0,0]=3 1633 B12R1.30 N=CNNC(=O)c1ccccc1 Amb27179869 [0,1,0,0,0,0|2,0,1]=4 1634 B12R1.30 NC(CCCO)c1ccccc1 Amb9783958 [0,1,0,0,0,0|2,0,1]=4 1635 B12R1.30 NCCCC(=O)c1ccccc1 Amb18623671 [0,1,0,0,0,0|1,0,0]=2 1636 B12R1.30 NCCCC(=O)c1cccnn1 Amb18828327 [0,1,0,0,0,0|3,0,0]=4 1637 B12R1.30 NCCCC(O)c1ccccc1 Amb17079154 [0,1,0,0,0,0|1,0,2]=4 1638 B12R1.30 NCCCC(O)c1ccccc1 Amb21984517 [0,1,0,0,0,0|1,0,2]=4 1639 B12R1.30 NCCNC(=O)c1ccccc1 Amb302802 [0,1,0,0,0,0|1,0,0]=2 1640 B12R1.30 NCCNC(=O)c1ccccc1 Amb6662646 [0,1,0,0,0,0|1,0,0]=2 1641 B12R1.30 NCCNC(=O)c1ccccn1 Amb1124326 [0,1,0,0,0,0|2,0,0]=3 1642 B12R1.30 NCCNC(=O)c1ccccn1 Amb21953271 [0,1,0,0,0,0|2,0,0]=3 1643 B12R1.30 NCCNC(=O)c1cccnc1 Amb21953968 [0,1,0,0,0,0|2,0,0]=3 1644 B12R1.30 NCCNC(=O)c1cccnc1 Amb32410116 [0,1,0,0,0,0|2,0,0]=3 1645 B12R1.30 NCCNC(=O)c1cccnc1 Amb33543179 [0,1,0,0,0,0|2,0,0]=3 1646 B12R1.30 NCCNC(=O)c1ccncc1 Amb1136215 [0,1,0,0,0,0|2,0,0]=3 1647 B12R1.30 NCCNC(=O)c1ccncc1 Amb21955218 [0,1,0,0,0,0|2,0,0]=3 1648 B12R1.30 NCCNC(=O)c1ccncc1 Amb8468630 [0,1,0,0,0,0|2,0,0]=3 1649 B12R1.30 NCCNC(=O)c1cnccn1 Amb1129684 [0,1,0,0,0,0|3,0,0]=4 1650 B12R1.30 NCCNC(=O)c1cnccn1 Amb32674720 [0,1,0,0,0,0|3,0,0]=4 1651 B12R1.30 NCCOC(=O)c1ccccc1 Amb10807731 [0,1,0,0,0,0|0,0,0]=1 1652 B12R1.30 NCCSC(=O)c1ccccc1 Amb3987898 [0,1,0,0,0,0|0,1,0]=2 1653 B12R1.30 N[C@@H](CCCO)c1ccccc1 Amb23440411 [0,1,0,0,0,0|2,0,1]=4 1654 B12R1.30 N\C=N\OC(=O)c1cccnc1 Amb27407037 [0,1,0,0,0,0|2,0,1]=4 1655 B12R1.30 O=C(C#CCCl)c1ccccc1 Amb28121125 [0,1,0,0,0,0|1,0,1]=3 1656 B12R1.30 O=C(C#CCO)c1ccccc1 Amb22495841 [0,1,0,0,0,0|1,0,1]=3 1657 B12R1.30 O=C(CCCBr)c1ccccc1 Amb17247624 [0,1,0,0,0,0|1,0,0]=2 1658 B12R1.30 O=C(CCCCl)c1ccccc1 Amb1229841 [0,1,0,0,0,0|1,0,0]=2 1659 B12R1.30 O=C(CCCO)c1ccccc1 Amb17334609 [0,1,0,0,0,0|1,0,0]=2 1660 B12R1.30 O=C(NCCBr)c1ccccn1 Amb8826105 [0,1,0,0,0,0|2,0,0]=3 1661 B12R1.30 O=C(NCCBr)c1ccnnc1 Amb28322461 [0,1,0,0,0,0|3,0,0]=4 1662 B12R1.30 O=C(NCCBr)c1cncnc1 Amb27250184 [0,1,0,0,0,0|3,0,0]=4 1663 B12R1.30 O=C(NCCCl)c1ccccc1 Amb2414312 [0,1,0,0,0,0|1,0,0]=2 1664 B12R1.30 O=C(NCCCl)c1ccccn1 Amb19045651 [0,1,0,0,0,0|2,0,0]=3 1665 B12R1.30 O=C(NCCCl)c1cccnc1 Amb17103236 [0,1,0,0,0,0|2,0,0]=3 1666 B12R1.30 O=C(NCCCl)c1ccnnc1 Amb27249157 [0,1,0,0,0,0|3,0,0]=4 1667 B12R1.30 O=C(NCCCl)c1cnccn1 Amb35678476 [0,1,0,0,0,0|3,0,0]=4 1668 B12R1.30 O=C(NCCF)c1cncnc1 Amb28281409 [0,1,0,0,0,0|3,0,0]=4 1669 B12R1.30 O=C(NCCI)c1ccccc1 Amb22753771 [0,1,0,0,0,0|1,0,0]=2 1670 B12R1.30 O=C(NCCI)c1cccnc1 Amb27462874 [0,1,0,0,0,0|2,0,0]=3 1671 B12R1.30 O=C(NCCI)c1cnccn1 Amb35678477 [0,1,0,0,0,0|3,0,0]=4 1672 B12R1.30 O=C(NCCO)c1ccccc1 Amb4318140 [0,1,0,0,0,0|1,0,0]=2 1673 B12R1.30 O=C(NCCO)c1ccccn1 Amb1951218 [0,1,0,0,0,0|2,0,0]=3 1674 B12R1.30 O=C(NCCO)c1cccnc1 Amb4061596 [0,1,0,0,0,0|2,0,0]=3 1675 B12R1.30 O=C(NCCO)c1ccncc1 Amb3939184 [0,1,0,0,0,0|2,0,0]=3 1676 B12R1.30 O=C(NCCO)c1cnccn1 Amb9242298 [0,1,0,0,0,0|3,0,0]=4 1677 B12R1.30 O=C(NCCS)c1ccccc1 Amb26616512 [0,1,0,0,0,0|1,0,0]=2 1678 B12R1.30 O=C(NCCS)c1cccnc1 Amb27224848 [0,1,0,0,0,0|2,0,0]=3 1679 B12R1.30 O=C(OCCCl)c1ccccc1 Amb385414 [0,1,0,0,0,0|0,0,0]=1 1680 B12R1.30 O=C(OCCO)c1ccccc1 Amb1110468 [0,1,0,0,0,0|0,0,0]=1 1681 B12R1.30 O=C(O\C=C\Cl)c1ccccc1 Amb26397046 [0,1,0,0,0,0|0,0,2]=3 1682 B12R1.30 O=C(O\N=C/Cl)c1ccccc1 Amb27858713 [0,1,0,0,0,0|1,0,1]=3 1683 B12R1.30 O=C(\C=C\CCl)c1ccccc1 Amb27983598 [0,1,0,0,0,0|1,0,1]=3 1684 B12R1.30 O=C(\C=C\O[Na])c1ccccc1 Amb2370899 [0,1,0,0,0,0|2,0,1]=4 1685 B12R1.30 O=CCCC(=O)c1cccnc1 Amb17618984 [0,1,0,0,0,0|2,0,1]=4 1686 B12R1.30 O=CCNC(=O)c1ccccc1 Amb17102065 [0,1,0,0,0,0|1,0,1]=3 1687 B12R1.30 O=CCNC(=O)c1cccnc1 Amb17102107 [0,1,0,0,0,0|2,0,1]=4 1688 B12R1.30 O=CNCC(=O)c1ccccc1 Amb20075907 [0,1,0,0,0,0|2,0,1]=4 1689 B12R1.30 O=CNNC(=O)c1ccccc1 Amb27406610 [0,1,0,0,0,0|2,0,1]=4 1690 B12R1.30 OC(CCCCl)c1ccccc1 Amb17194564 [0,1,0,0,0,0|1,0,2]=4 1691 B12R1.30 OCCCC(O)c1ccccc1 Amb17334675 [0,1,0,0,0,0|1,0,2]=4 1692 B12R1.30 OCC\C=C(\O)c1ccncc1 Amb27766556 [0,1,0,0,0,0|2,0,1]=4 1693 B12R1.30 S=C(NCCCl)c1ccccc1 Amb28118876 [0,1,0,0,0,0|1,1,0]=3 1694 B12R1.30 [N-]=[N+]=NCC(=O)c1ccccc1 Amb18114574 [0,1,0,0,0,0|3,0,0]=4 1695 B12R1.34 C#CC(C)C(=O)c1ccccc1 Amb27861418 [0,1,0,0,0,0|1,0,2]=4 1696 B12R1.34 C=C(C(=O)CC)c1ccccc1 Amb27177863 [0,1,0,0,0,0|2,0,0]=3 1697 B12R1.34 C=C(C(=O)CO)c1ccccc1 Amb27175970 [0,1,0,0,0,0|3,0,0]=4 1698 B12R1.34 C=C(C(=O)OC)c1ccccc1 Amb8392364 [0,1,0,0,0,0|3,0,0]=4 1699 B12R1.34 C=C(CC)[C@H](O)c1ccccc1 Amb28460718 [0,1,0,0,0,0|1,0,2]=4 1700 B12R1.34 C=C(CO)C(=C)c1ccccc1 Amb27432138 [0,1,0,0,0,0|3,0,0]=4 1701 B12R1.34 C=C(OC)C(=O)c1ccccc1 Amb17594034 [0,1,0,0,0,0|2,0,0]=3 1702 B12R1.34 C=C(c1ccccc1)C(O)CC Amb27431432 [0,1,0,0,0,0|2,0,0]=3 1703 B12R1.34 C=CC(C)C(=O)c1ccccc1 Amb27749794 [0,1,0,0,0,0|1,0,2]=4 1704 B12R1.34 C=CC(Cl)C(=O)c1ccccc1 Amb27841407 [0,1,0,0,0,0|1,0,2]=4 1705 B12R1.34 CC(C#N)C(=O)c1ccccc1 Amb33529617 [0,1,0,0,0,0|2,0,1]=4 1706 B12R1.34 CC(C=O)C(=O)c1ccccc1 Amb18645647 [0,1,0,0,0,0|2,0,1]=4 1707 B12R1.34 CC(CCl)C(=O)c1ccccc1 Amb4006275 [0,1,0,0,0,0|2,0,0]=3 1708 B12R1.34 CC(CO)C(=O)c1ccccc1 Amb8392341 [0,1,0,0,0,0|2,0,0]=3 1709 B12R1.34 CCC(=N)C(=O)c1ccccc1 Amb27590280 [0,1,0,0,0,0|1,0,0]=2 1710 B12R1.34 CCC(=O)C(=O)c1ccccc1 Amb17400106 [0,1,0,0,0,0|1,0,0]=2 1711 B12R1.34 CCC(=O)C(=O)c1ccccn1 Amb25762144 [0,1,0,0,0,0|2,0,0]=3 1712 B12R1.34 CCC(=O)C(=O)c1cccnc1 Amb27436887 [0,1,0,0,0,0|2,0,0]=3 1713 B12R1.34 CCC(=O)C(=O)c1ccncc1 Amb25245097 [0,1,0,0,0,0|2,0,0]=3 1714 B12R1.34 CCC(=O)C(Br)c1ccccc1 Amb17596238 [0,1,0,0,0,0|2,0,1]=4 1715 B12R1.34 CCC(=O)C(C)c1ccccc1 Amb3940841 [0,1,0,0,0,0|2,0,1]=4 1716 B12R1.34 CCC(=O)C(Cl)c1ccccc1 Amb27477956 [0,1,0,0,0,0|2,0,1]=4 1717 B12R1.34 CCC(=O)C(F)c1ccccc1 Amb27668940 [0,1,0,0,0,0|2,0,1]=4 1718 B12R1.34 CCC(=O)C(N)c1ccccc1 Amb27244834 [0,1,0,0,0,0|2,0,1]=4 1719 B12R1.34 CCC(=O)C(O)c1ccccc1 Amb28201072 [0,1,0,0,0,0|1,0,2]=4 1720 B12R1.34 CCC(=O)N(C)c1ccccc1 Amb2611725 [0,1,0,0,0,0|3,0,0]=4 1721 B12R1.34 CCC(=O)N(N)c1ccccc1 Amb33191340 [0,1,0,0,0,0|3,0,0]=4 1722 B12R1.34 CCC(Br)C(=O)c1ccccc1 Amb6673863 [0,1,0,0,0,0|1,0,0]=2 1723 B12R1.34 CCC(Br)C(=O)c1ccccn1 Amb19959526 [0,1,0,0,0,0|2,0,0]=3 1724 B12R1.34 CCC(C)C(=O)c1ccccc1 Amb8850439 [0,1,0,0,0,0|1,0,0]=2 1725 B12R1.34 CCC(C)C(=O)c1ccccn1 Amb24649735 [0,1,0,0,0,0|2,0,0]=3 1726 B12R1.34 CCC(C)C(N)c1ccccc1 Amb30628584 [0,1,0,0,0,0|2,0,1]=4 1727 B12R1.34 CCC(C)[C@H](N)c1ccccc1 Amb27430422 [0,1,0,0,0,0|2,0,1]=4 1728 B12R1.34 CCC(Cl)C(=O)c1ccccc1 Amb19074252 [0,1,0,0,0,0|1,0,0]=2 1729 B12R1.34 CCC(F)C(=O)c1ccccc1 Amb26600904 [0,1,0,0,0,0|1,0,0]=2 1730 B12R1.34 CCC(N)C(=O)c1ccccc1 Amb17138555 [0,1,0,0,0,0|1,0,0]=2 1731 B12R1.34 CCC(N)C(=O)c1ccccc1 Amb22549075 [0,1,0,0,0,0|1,0,0]=2 1732 B12R1.34 CCC(N)C(=O)c1cncnc1 Amb27881483 [0,1,0,0,0,0|3,0,0]=4 1733 B12R1.34 CCC(N)C(C)c1ccccc1 Amb18829127 [0,1,0,0,0,0|2,0,1]=4 1734 B12R1.34 CCC(N)C(C)c1ccccc1 Amb20623710 [0,1,0,0,0,0|2,0,1]=4 1735 B12R1.34 CCC(N)C(O)c1ccccc1 Amb19373101 [0,1,0,0,0,0|1,0,2]=4 1736 B12R1.34 CCC(N)C(O)c1ccccc1 Amb9428998 [0,1,0,0,0,0|1,0,2]=4 1737 B12R1.34 CCC(O)C(=O)c1ccccc1 Amb18800792 [0,1,0,0,0,0|1,0,0]=2 1738 B12R1.34 CCC(O)C(=O)c1cnccn1 Amb27770902 [0,1,0,0,0,0|3,0,0]=4 1739 B12R1.34 CCC(O)C(=O)c1cncnc1 Amb27648522 [0,1,0,0,0,0|3,0,0]=4 1740 B12R1.34 CCC(O)C(O)c1ccccc1 Amb27163573 [0,1,0,0,0,0|1,0,2]=4 1741 B12R1.34 CCC(O)[C@H](C)c1ccccc1 Amb27981671 [0,1,0,0,0,0|2,0,1]=4 1742 B12R1.34 CCN(C)C(=N)c1ccccc1 Amb28253999 [0,1,0,0,0,0|2,0,0]=3 1743 B12R1.34 CCN(C)C(=O)c1ccccn1 Amb28078652 [0,1,0,0,0,0|2,0,0]=3 1744 B12R1.34 CCN(C)C(=O)c1cccnc1 Amb27604273 [0,1,0,0,0,0|2,0,0]=3 1745 B12R1.34 CCN(C)C(=O)c1ccncn1 Amb27187804 [0,1,0,0,0,0|3,0,0]=4 1746 B12R1.34 CCN(C)C(=O)c1cnccn1 Amb28065031 [0,1,0,0,0,0|3,0,0]=4 1747 B12R1.34 CCN(N)C(=O)c1ccccc1 Amb33191317 [0,1,0,0,0,0|1,0,0]=2 1748 B12R1.34 CCS(=O)C(C)c1ccccc1 Amb28063578 [0,1,0,0,0,0|1,1,1]=4 1749 B12R1.34 CC[C@@H](C)[C@H](O)c1ccccc1 Amb28321457 [0,1,0,0,0,0|1,0,2]=4 1750 B12R1.34 CC[C@@H](N)C(=O)c1cccnc1 Amb35596792 [0,1,0,0,0,0|2,0,0]=3 1751 B12R1.34 CC[C@@H](N)C(=O)c1cnccn1 Amb35596793 [0,1,0,0,0,0|3,0,0]=4 1752 B12R1.34 CC[C@@H](N)C(=O)c1cncnc1 Amb35596794 [0,1,0,0,0,0|3,0,0]=4 1753 B12R1.34 CC[C@@H](N)C(C)c1ccccc1 Amb29867804 [0,1,0,0,0,0|2,0,1]=4 1754 B12R1.34 CC[C@@H](N)C(O)c1ccccc1 Amb35602701 [0,1,0,0,0,0|1,0,2]=4 1755 B12R1.34 CC[C@@H](N)[C@@H](O)c1ccccc1 Amb27760494 [0,1,0,0,0,0|1,0,2]=4 1756 B12R1.34 CC[C@@H](O)C(C)c1ccccc1 Amb29852038 [0,1,0,0,0,0|2,0,1]=4 1757 B12R1.34 CC[C@@H](O)[C@@H](C)c1ccccc1 Amb27766563 [0,1,0,0,0,0|2,0,1]=4 1758 B12R1.34 CC[C@@H](O)[C@@H](O)c1ccccc1 Amb28293390 [0,1,0,0,0,0|1,0,2]=4 1759 B12R1.34 CC[C@@H](O)[C@H](O)c1ccccc1 Amb27835137 [0,1,0,0,0,0|1,0,2]=4 1760 B12R1.34 CC[C@H](N)C(=O)c1cccnc1 Amb30038296 [0,1,0,0,0,0|2,0,0]=3 1761 B12R1.34 CC[C@H](N)C(=O)c1cnccn1 Amb30038518 [0,1,0,0,0,0|3,0,0]=4 1762 B12R1.34 CC[C@H](N)C(=O)c1cncnc1 Amb30038768 [0,1,0,0,0,0|3,0,0]=4 1763 B12R1.34 CC[C@H](N)C(C)c1ccccc1 Amb29867785 [0,1,0,0,0,0|2,0,1]=4 1764 B12R1.34 CC[C@H](N)C(O)c1ccccc1 Amb35601261 [0,1,0,0,0,0|1,0,2]=4 1765 B12R1.34 CC[C@H](N)[C@H](O)c1ccccc1 Amb28121117 [0,1,0,0,0,0|1,0,2]=4 1766 B12R1.34 CC[C@H](O)C(C)c1ccccc1 Amb29852039 [0,1,0,0,0,0|2,0,1]=4 1767 B12R1.34 CC[C@H](O)[C@H](N)c1ccccc1 Amb28292456 [0,1,0,0,0,0|2,0,1]=4 1768 B12R1.34 CC[C@H](O)[C@H](O)c1ccccc1 Amb27835888 [0,1,0,0,0,0|1,0,2]=4 1769 B12R1.34 CNC(=O)C(=O)c1ccccc1 Amb17334577 [0,1,0,0,0,0|2,0,0]=3 1770 B12R1.34 CNC(C)C(=O)c1ccccc1 Amb8384820 [0,1,0,0,0,0|2,0,0]=3 1771 B12R1.34 CNC(C)C(=O)c1ccccn1 Amb27172409 [0,1,0,0,0,0|3,0,0]=4 1772 B12R1.34 CNC(C)C(=O)c1cccnc1 Amb26392364 [0,1,0,0,0,0|3,0,0]=4 1773 B12R1.34 CNC(C)C(=O)c1ccncc1 Amb25381151 [0,1,0,0,0,0|3,0,0]=4 1774 B12R1.34 CN[C@@H](C)C(=O)c1cccnc1 Amb35659710 [0,1,0,0,0,0|3,0,0]=4 1775 B12R1.34 CN[C@H](C)C(=O)c1ccccc1 Amb28129791 [0,1,0,0,0,0|2,0,0]=3 1776 B12R1.34 COC(=O)C(=O)c1ccccc1 Amb6296065 [0,1,0,0,0,0|2,0,0]=3 1777 B12R1.34 CON(C)C(=O)c1ccccc1 Amb4037088 [0,1,0,0,0,0|2,0,0]=3 1778 B12R1.34 CON(C)C(=O)c1ccccn1 Amb20673724 [0,1,0,0,0,0|3,0,0]=4 1779 B12R1.34 CON(C)C(=O)c1cccnc1 Amb20673749 [0,1,0,0,0,0|3,0,0]=4 1780 B12R1.34 CON(C)C(=O)c1ccncc1 Amb10571540 [0,1,0,0,0,0|3,0,0]=4 1781 B12R1.34 CON(C)S(=O)c1ccccc1 Amb28383906 [0,1,0,0,0,0|3,0,0]=4 1782 B12R1.34 CSC(C)C(=O)c1ccccc1 Amb18796322 [0,1,0,0,0,0|2,0,0]=3 1783 B12R1.34 CSC(O)C(=O)c1ccccc1 Amb17594697 [0,1,0,0,0,0|2,0,0]=3 1784 B12R1.34 C[C@@H](CO)C(=O)c1ccccc1 Amb27599400 [0,1,0,0,0,0|2,0,0]=3 1785 B12R1.34 C\C(=C/Cl)C(=O)c1ccccc1 Amb28290358 [0,1,0,0,0,0|2,0,1]=4 1786 B12R1.34 C\C(=C/O)C(=O)c1ccccc1 Amb28386635 [0,1,0,0,0,0|2,0,1]=4 1787 B12R1.34 C\C(=C\F)C(=O)c1ccccc1 Amb27854298 [0,1,0,0,0,0|2,0,1]=4 1788 B12R1.34 C\C(=C\N)C(=O)c1ccccc1 Amb2386654 [0,1,0,0,0,0|2,0,1]=4 1789 B12R1.34 C\C(=N/O)C(=O)c1ccccc1 Amb2720251 [0,1,0,0,0,0|3,0,0]=4 1790 B12R1.34 C\C(=N\N)C(=O)c1ccccc1 Amb24745786 [0,1,0,0,0,0|3,0,0]=4 1791 B12R1.34 C\C=C(/F)C(=O)c1ccccc1 Amb27176127 [0,1,0,0,0,0|1,0,1]=3 1792 B12R1.34 C\C=C(\Br)C(=O)c1ccccc1 Amb27776890 [0,1,0,0,0,0|1,0,1]=3 1793 B12R1.34 C\C=C(\C)C(=O)c1ccccc1 Amb25730208 [0,1,0,0,0,0|1,0,1]=3 1794 B12R1.34 N#CC(=O)C(=O)c1ccccc1 Amb27433531 [0,1,0,0,0,0|2,0,1]=4 1795 B12R1.34 N#CC(Cl)C(=O)c1ccccc1 Amb25807933 [0,1,0,0,0,0|2,0,1]=4 1796 B12R1.34 N#CC(F)C(=O)c1ccccc1 Amb17621808 [0,1,0,0,0,0|2,0,1]=4 1797 B12R1.34 N#CC(N)C(=O)c1ccccc1 Amb28385419 [0,1,0,0,0,0|2,0,1]=4 1798 B12R1.34 NC(=S=O)C(=O)c1ccccc1 Amb27483110 [0,1,0,0,0,0|3,0,0]=4 1799 B12R1.34 O=C(CBr)C(=O)c1ccccc1 Amb17406921 [0,1,0,0,0,0|2,0,0]=3 1800 B12R1.34 O=C(CO)C(=O)c1ccccc1 Amb27178026 [0,1,0,0,0,0|2,0,0]=3 1801 B12R1.34 O=C(\C(Cl)=C/Cl)c1ccccc1 Amb26558724 [0,1,0,0,0,0|2,0,1]=4 1802 B12R1.34 O=C(\C(Cl)=C\Cl)c1ccccc1 Amb27402575 [0,1,0,0,0,0|2,0,1]=4 1803 B12R1.34 O=C(c1ccccc1)C(Br)CCl Amb17351480 [0,1,0,0,0,0|2,0,0]=3 1804 B12R1.34 O=C(c1ccccc1)C(Cl)CCl Amb17337895 [0,1,0,0,0,0|2,0,0]=3 1805 B12R1.34 O=C(c1ccccc1)C(F)CCl Amb28396582 [0,1,0,0,0,0|2,0,0]=3 1806 B12R1.34 O=C(c1ccccc1)C(O)CO Amb27175820 [0,1,0,0,0,0|2,0,0]=3 1807 B12R1.34 O=C(c1ccccc1)[C@H](O)CO Amb27227037 [0,1,0,0,0,0|2,0,0]=3 1808 B12R1.34 O=CC(Cl)C(=O)c1ccccc1 Amb28364135 [0,1,0,0,0,0|2,0,1]=4 1809 B12R1.34 O=CC(F)C(=O)c1ccccc1 Amb26485248 [0,1,0,0,0,0|2,0,1]=4 1810 B12R1.34 OC\C(F)=C(\F)c1ccccc1 Amb27426618 [0,1,0,0,0,0|3,0,0]=4 1811 B12R1.39 CCCC(C)(C)c1ccccc1 Amb27231101 [0,1,0,0,0,0|2,0,1]=4 1812 B12R1.39 CCCC(C)(N)c1ccccc1 Amb9676775 [0,1,0,0,0,0|2,0,1]=4 1813 B12R1.39 CCCC(C)(O)c1ccccc1 Amb4019246 [0,1,0,0,0,0|1,0,2]=4 1814 B12R1.39 CCCS(=O)(=O)c1ccccc1 Amb24485446 [0,1,0,0,0,0|2,0,0]=3 1815 B12R1.39 CCNS(=O)(=O)c1ccccc1 Amb3357686 [0,1,0,0,0,0|2,0,0]=3 1816 B12R1.39 CCNS(=O)(=O)c1ccccn1 Amb25892232 [0,1,0,0,0,0|3,0,0]=4 1817 B12R1.39 CCNS(=O)(=O)c1cccnc1 Amb8886217 [0,1,0,0,0,0|3,0,0]=4 1818 B12R1.39 CCOP(=O)(F)c1ccccc1 Amb10839099 [0,1,0,0,0,0|1,0,0]=2 1819 B12R1.39 CCOP(C)(=O)c1ccccc1 Amb24487373 [0,1,0,0,0,0|1,0,0]=2 1820 B12R1.39 CCOP(O)(=S)c1ccccc1 Amb8392130 [0,1,0,0,0,0|1,0,1]=3 1821 B12R1.39 CCOS(=O)(=O)c1ccccc1 Amb4017809 [0,1,0,0,0,0|1,0,0]=2 1822 B12R1.39 CCO[Si](C)(C)c1ccccc1 Amb19894004 [0,1,0,0,0,0|1,1,0]=3 1823 B12R1.39 CCSC(C)(C)c1ccccc1 Amb28349658 [0,1,0,0,0,0|1,1,1]=4 1824 B12R1.39 CNCP(=O)(O)c1ccccc1 Amb27778480 [0,1,0,0,0,0|3,0,0]=4 1825 B12R1.39 COCS(=O)(=O)c1ccccc1 Amb24324970 [0,1,0,0,0,0|3,0,0]=4 1826 B12R1.39 CONS(=O)(=O)c1ccccc1 Amb16969978 [0,1,0,0,0,0|3,0,0]=4 1827 B12R1.39 CSCS(=O)(=O)c1ccccc1 Amb9786504 [0,1,0,0,0,0|3,0,0]=4 1828 B12R1.39 C\C=C\S(=O)(=O)c1ccccc1 Amb24484200 [0,1,0,0,0,0|2,0,1]=4 1829 B12R1.39 N=S(=O)(CCO)c1ccccc1 Amb27433169 [0,1,0,0,0,0|3,0,0]=4 1830 B12R1.39 NCCP(=O)(O)c1ccccc1 Amb28343056 [0,1,0,0,0,0|3,0,0]=4 1831 B12R1.39 NCCS(=O)(=O)c1ccccc1 Amb5716090 [0,1,0,0,0,0|3,0,0]=4 1832 B12R1.39 NCCS(=O)(=O)c1ccccc1 Amb5742909 [0,1,0,0,0,0|3,0,0]=4 1833 B12R1.39 NCNS(=O)(=O)c1ccccc1 Amb27442498 [0,1,0,0,0,0|3,0,0]=4 1834 B12R1.39 O=S(=O)(CCBr)c1ccccc1 Amb17106167 [0,1,0,0,0,0|3,0,0]=4 1835 B12R1.39 O=S(=O)(CCCl)c1ccccc1 Amb1034876 [0,1,0,0,0,0|3,0,0]=4 1836 B12R1.107 C=C(C)CC(=O)c1ccccc1 Amb18563490 [0,1,0,0,0,0|1,0,1]=3 1837 B12R1.107 C=C(C)CC(=O)c1ccccn1 Amb18563515 [0,1,0,0,0,0|2,0,1]=4 1838 B12R1.107 C=C(C)CC(=O)c1cccnc1 Amb18563516 [0,1,0,0,0,0|2,0,1]=4 1839 B12R1.107 C=C(C)CC(=O)c1ccncc1 Amb18563517 [0,1,0,0,0,0|2,0,1]=4 1840 B12R1.107 C=C(C)OC(=O)c1ccccn1 Amb24643969 [0,1,0,0,0,0|1,0,1]=3 1841 B12R1.107 C=C(CC(C)=O)c1ccccc1 Amb27802448 [0,1,0,0,0,0|2,0,1]=4 1842 B12R1.107 C=C(CC(C)O)c1ccccc1 Amb27486292 [0,1,0,0,0,0|2,0,0]=3 1843 B12R1.107 C=C(NC(C)=O)c1ccccc1 Amb8394362 [0,1,0,0,0,0|2,0,1]=4 1844 B12R1.107 CC(=N)CC(=O)c1ccccc1 Amb4354188 [0,1,0,0,0,0|1,0,1]=3 1845 B12R1.107 CC(=O)CC(=O)c1ccccc1 Amb534154 [0,1,0,0,0,0|1,0,1]=3 1846 B12R1.107 CC(=O)CC(=O)c1ccccn1 Amb9204928 [0,1,0,0,0,0|2,0,1]=4 1847 B12R1.107 CC(=O)CC(=O)c1cccnc1 Amb33528506 [0,1,0,0,0,0|2,0,1]=4 1848 B12R1.107 CC(=O)CC(=O)c1ccncc1 Amb9204940 [0,1,0,0,0,0|2,0,1]=4 1849 B12R1.107 CC(=O)OC(C)c1ccccc1 Amb4037062 [0,1,0,0,0,0|1,0,2]=4 1850 B12R1.107 CC(=O)\C=C(\S)c1ccccc1 Amb27428395 [0,1,0,0,0,0|1,1,1]=4 1851 B12R1.107 CC(=O)\N=C(\N)c1ccccc1 Amb25150972 [0,1,0,0,0,0|2,0,1]=4 1852 B12R1.107 CC(Br)CC(Br)c1ccccc1 Amb27267411 [0,1,0,0,0,0|2,0,1]=4 1853 B12R1.107 CC(Br)CC(C)c1ccccc1 Amb25273655 [0,1,0,0,0,0|2,0,1]=4 1854 B12R1.107 CC(C)=CC(=O)c1ccccc1 Amb10874044 [0,1,0,0,0,0|1,0,1]=3 1855 B12R1.107 CC(C)CC(=O)c1ccccc1 Amb4017884 [0,1,0,0,0,0|1,0,0]=2 1856 B12R1.107 CC(C)CC(=O)c1ccccn1 Amb6301495 [0,1,0,0,0,0|2,0,0]=3 1857 B12R1.107 CC(C)CC(=O)c1cccnc1 Amb10607962 [0,1,0,0,0,0|2,0,0]=3 1858 B12R1.107 CC(C)CC(=O)c1ccncc1 Amb17334579 [0,1,0,0,0,0|2,0,0]=3 1859 B12R1.107 CC(C)CC(=O)c1ccnnc1 Amb28453539 [0,1,0,0,0,0|3,0,0]=4 1860 B12R1.107 CC(C)CC(=O)c1ncccn1 Amb18792555 [0,1,0,0,0,0|3,0,0]=4 1861 B12R1.107 CC(C)CC(N)c1ccccc1 Amb6892355 [0,1,0,0,0,0|2,0,1]=4 1862 B12R1.107 CC(C)CC(N)c1ccccc1 Amb9703509 [0,1,0,0,0,0|2,0,1]=4 1863 B12R1.107 CC(C)CC(O)c1ccccc1 Amb1110402 [0,1,0,0,0,0|1,0,2]=4 1864 B12R1.107 CC(C)CC(S)c1ccccc1 Amb7784758 [0,1,0,0,0,0|1,1,1]=4 1865 B12R1.107 CC(C)CN(C)c1ccccc1 Amb17232437 [0,1,0,0,0,0|3,0,0]=4 1866 B12R1.107 CC(C)C[C@@H](N)c1ccccc1 Amb22288660 [0,1,0,0,0,0|2,0,1]=4 1867 B12R1.107 CC(C)C[C@@H](N)c1ccccc1 Amb27175567 [0,1,0,0,0,0|2,0,1]=4 1868 B12R1.107 CC(C)C[C@H](N)c1ccccc1 Amb22288705 [0,1,0,0,0,0|2,0,1]=4 1869 B12R1.107 CC(C)C[C@H](N)c1ccccc1 Amb27249677 [0,1,0,0,0,0|2,0,1]=4 1870 B12R1.107 CC(C)NC(=N)c1ccccc1 Amb27985757 [0,1,0,0,0,0|2,0,0]=3 1871 B12R1.107 CC(C)NC(=O)c1cnccn1 Amb3363514 [0,1,0,0,0,0|3,0,0]=4 1872 B12R1.107 CC(C)NC(=S)c1ccccc1 Amb28119091 [0,1,0,0,0,0|1,1,0]=3 1873 B12R1.107 CC(C)NC(=S)c1cccnc1 Amb22641097 [0,1,0,0,0,0|2,1,0]=4 1874 B12R1.107 CC(C)NC(C)c1ccccc1 Amb9739299 [0,1,0,0,0,0|2,0,1]=4 1875 B12R1.107 CC(C)N[C@@H](C)c1ccccc1 Amb22747560 [0,1,0,0,0,0|2,0,1]=4 1876 B12R1.107 CC(C)N[C@@H](C)c1ccccc1 Amb27251954 [0,1,0,0,0,0|2,0,1]=4 1877 B12R1.107 CC(C)OC(=N)c1ccncc1 Amb25751672 [0,1,0,0,0,0|2,0,0]=3 1878 B12R1.107 CC(C)OC(=N)c1cnccn1 Amb29848000 [0,1,0,0,0,0|3,0,0]=4 1879 B12R1.107 CC(C)OC(=O)c1ccccc1 Amb15740252 [0,1,0,0,0,0|0,0,0]=1 1880 B12R1.107 CC(C)OC(=O)c1ccccn1 Amb17509339 [0,1,0,0,0,0|1,0,0]=2 1881 B12R1.107 CC(C)OC(=O)c1cccnc1 Amb1959307 [0,1,0,0,0,0|1,0,0]=2 1882 B12R1.107 CC(C)OC(=O)c1ccncn1 Amb25271292 [0,1,0,0,0,0|2,0,0]=3 1883 B12R1.107 CC(C)OC(=O)c1cnccn1 Amb28063238 [0,1,0,0,0,0|2,0,0]=3 1884 B12R1.107 CC(C)OC(=O)c1ncccn1 Amb27208059 [0,1,0,0,0,0|2,0,0]=3 1885 B12R1.107 CC(C)\N=C(/Cl)c1ccccc1 Amb33595358 [0,1,0,0,0,0|2,0,0]=3 1886 B12R1.107 CC(C)\N=C(/N)c1cccnc1 Amb21970338 [0,1,0,0,0,0|3,0,0]=4 1887 B12R1.107 CC(C)\N=C(\Cl)c1ccccc1 Amb2371275 [0,1,0,0,0,0|2,0,0]=3 1888 B12R1.107 CC(C[C@@H](C)N)c1ccccc1 Amb33081852 [0,1,0,0,0,0|2,0,1]=4 1889 B12R1.107 CC(C[C@@H](C)O)c1ccccc1 Amb28207302 [0,1,0,0,0,0|2,0,1]=4 1890 B12R1.107 CC(C[C@H](C)N)c1ccccc1 Amb33081854 [0,1,0,0,0,0|2,0,1]=4 1891 B12R1.107 CC(C[C@H](C)O)c1ccccc1 Amb33081855 [0,1,0,0,0,0|2,0,1]=4 1892 B12R1.107 CC(Cl)CC(=O)c1ccccc1 Amb28042789 [0,1,0,0,0,0|1,0,0]=2 1893 B12R1.107 CC(Cl)CC(C)c1ccccc1 Amb27175543 [0,1,0,0,0,0|2,0,1]=4 1894 B12R1.107 CC(Cl)CC(Cl)c1ccccc1 Amb28068688 [0,1,0,0,0,0|2,0,1]=4 1895 B12R1.107 CC(Cl)CC(O)c1ccccc1 Amb27865488 [0,1,0,0,0,0|1,0,2]=4 1896 B12R1.107 CC(Cl)OC(=O)c1ccccc1 Amb10603969 [0,1,0,0,0,0|0,0,0]=1 1897 B12R1.107 CC(N)CC(=O)c1ccccc1 Amb20668879 [0,1,0,0,0,0|1,0,0]=2 1898 B12R1.107 CC(N)CC(=O)c1ccccc1 Amb22059727 [0,1,0,0,0,0|1,0,0]=2 1899 B12R1.107 CC(N)CC(=O)c1ccccn1 Amb27623071 [0,1,0,0,0,0|2,0,0]=3 1900 B12R1.107 CC(N)CC(C)c1ccccc1 Amb27831891 [0,1,0,0,0,0|2,0,1]=4 1901 B12R1.107 CC(N)CC(O)c1ccccc1 Amb18646365 [0,1,0,0,0,0|1,0,2]=4 1902 B12R1.107 CC(N)CN(C)c1ccccc1 Amb10610213 [0,1,0,0,0,0|3,0,0]=4 1903 B12R1.107 CC(N)CN(C)c1ccccc1 Amb1137929 [0,1,0,0,0,0|3,0,0]=4 1904 B12R1.107 CC(N)CS(=O)c1ccccc1 Amb27165944 [0,1,0,0,0,0|2,0,0]=3 1905 B12R1.107 CC(N)NC(=O)c1ccccc1 Amb27792210 [0,1,0,0,0,0|1,0,0]=2 1906 B12R1.107 CC(O)CC(=O)c1ccccc1 Amb27177964 [0,1,0,0,0,0|1,0,0]=2 1907 B12R1.107 CC(O)CC(C)c1ccccc1 Amb27651998 [0,1,0,0,0,0|2,0,1]=4 1908 B12R1.107 CC(O)CC(F)c1ccccc1 Amb27588281 [0,1,0,0,0,0|2,0,1]=4 1909 B12R1.107 CC(O)CC(O)c1ccccc1 Amb1110547 [0,1,0,0,0,0|1,0,2]=4 1910 B12R1.107 CC(O)CN(C)c1ccccc1 Amb17138595 [0,1,0,0,0,0|3,0,0]=4 1911 B12R1.107 CC(O)CP(C)c1ccccc1 Amb27615506 [0,1,0,0,0,0|3,0,0]=4 1912 B12R1.107 CC(O)C[C@@H](O)c1ccccc1 Amb27748936 [0,1,0,0,0,0|1,0,2]=4 1913 B12R1.107 CC(O)NC(=S)c1ccccc1 Amb27623264 [0,1,0,0,0,0|1,1,0]=3 1914 B12R1.107 CC(O)OC(=O)c1cccnc1 Amb28345306 [0,1,0,0,0,0|1,0,0]=2 1915 B12R1.107 CC(O)OC(C)c1ccccc1 Amb28455545 [0,1,0,0,0,0|1,0,1]=3 1916 B12R1.107 CC(O)\C=C(\Cl)c1ccccc1 Amb27451951 [0,1,0,0,0,0|2,0,0]=3 1917 B12R1.107 CN(C)CC(=O)c1ccccc1 Amb22264767 [0,1,0,0,0,0|2,0,0]=3 1918 B12R1.107 CN(C)CC(=O)c1ccccc1 Amb9217331 [0,1,0,0,0,0|2,0,0]=3 1919 B12R1.107 CN(C)NC(=O)c1ccccc1 Amb10574824 [0,1,0,0,0,0|2,0,0]=3 1920 B12R1.107 CN(C)NC(=O)c1ccccn1 Amb28400620 [0,1,0,0,0,0|3,0,0]=4 1921 B12R1.107 CN(C)NC(=O)c1cccnc1 Amb26017998 [0,1,0,0,0,0|3,0,0]=4 1922 B12R1.107 CN(C)\C=C(/O)c1ccccc1 Amb24068870 [0,1,0,0,0,0|2,0,1]=4 1923 B12R1.107 CS(=O)CC(=O)c1ccccn1 Amb27862924 [0,1,0,0,0,0|3,0,0]=4 1924 B12R1.107 C[C@@H](Cl)C[C@@H](Cl)c1ccccc1 Amb28202622 [0,1,0,0,0,0|2,0,1]=4 1925 B12R1.107 C[C@@H](Cl)OC(=O)c1ccccc1 Amb27858875 [0,1,0,0,0,0|0,0,0]=1 1926 B12R1.107 C[C@@H](N)C[C@@H](O)c1ccccc1 Amb27592173 [0,1,0,0,0,0|1,0,2]=4 1927 B12R1.107 C[C@@H](O)C[C@@H](C)c1ccccc1 Amb27457680 [0,1,0,0,0,0|2,0,1]=4 1928 B12R1.107 C[C@@H](O)C[C@@H](S)c1ccccc1 Amb27218944 [0,1,0,0,0,0|1,1,1]=4 1929 B12R1.107 C[C@H](N)CN(C)c1ccccc1 Amb5782045 [0,1,0,0,0,0|3,0,0]=4 1930 B12R1.107 C[C@H](N)C[C@H](O)c1ccccc1 Amb27217333 [0,1,0,0,0,0|1,0,2]=4 1931 B12R1.107 C[C@H](O)CC(=O)c1ccccc1 Amb27178049 [0,1,0,0,0,0|1,0,0]=2 1932 B12R1.107 C[C@H](O)CN(C)c1ccccc1 Amb27615291 [0,1,0,0,0,0|3,0,0]=4 1933 B12R1.107 C[C@H](O)C[C@H](N)c1ccccc1 Amb27646110 [0,1,0,0,0,0|2,0,1]=4 1934 B12R1.107 C[S+](C)CC(=O)c1ccccc1 Amb10838263 [0,1,0,0,0,0|2,0,0]=3 1935 B12R1.107 C[S+](C)CC(=O)c1ccccc1 Amb4036338 [0,1,0,0,0,0|2,0,0]=3 1936 B12R1.107 C\C(=C\C(C)C)c1ccccc1 Amb4018527 [0,1,0,0,0,0|2,0,0]=3 1937 B12R1.107 C\C(=C\[C@H](C)O)c1ccccc1 Amb27650888 [0,1,0,0,0,0|2,0,0]=3 1938 B12R1.107 C\C(=N/C(C)C)c1ccccc1 Amb24053029 [0,1,0,0,0,0|2,0,0]=3 1939 B12R1.107 C\C(=N\N(C)C)c1ccccc1 Amb22347640 [0,1,0,0,0,0|3,0,0]=4 1940 B12R1.107 C\C(=N\S(C)=O)c1ccccc1 Amb35681678 [0,1,0,0,0,0|3,0,0]=4 1941 B12R1.107 C\C(N)=C/C(=O)c1ccccc1 Amb27666841 [0,1,0,0,0,0|1,0,1]=3 1942 B12R1.107 C\C(N)=C/C(=O)c1ccccn1 Amb10242646 [0,1,0,0,0,0|2,0,1]=4 1943 B12R1.107 C\C(N)=C\C(=O)c1ccccc1 Amb2386640 [0,1,0,0,0,0|1,0,1]=3 1944 B12R1.107 C\C(N)=C\C(=O)c1cccnc1 Amb28052006 [0,1,0,0,0,0|2,0,1]=4 1945 B12R1.107 C\C(N)=C\C(=O)c1ccncc1 Amb26338235 [0,1,0,0,0,0|2,0,1]=4 1946 B12R1.107 C\C(N)=C\S(=O)c1ccccc1 Amb26974071 [0,1,0,0,0,0|2,0,1]=4 1947 B12R1.107 N=C(N)CC(=O)c1ccccc1 Amb26371399 [0,1,0,0,0,0|2,0,1]=4 1948 B12R1.107 N=C(N)NC(=O)c1ccccc1 Amb25703047 [0,1,0,0,0,0|2,0,1]=4 1949 B12R1.107 N=C(N)SC(=O)c1ccccc1 Amb21955775 [0,1,0,0,0,0|1,1,1]=4 1950 B12R1.107 N=C(N)SC(=O)c1ccccc1 Amb9901863 [0,1,0,0,0,0|1,1,1]=4 1951 B12R1.107 NC(=O)CC(=O)c1ccccc1 Amb2734576 [0,1,0,0,0,0|2,0,1]=4 1952 B12R1.107 NC(=O)NC(=O)c1ccccc1 Amb3989198 [0,1,0,0,0,0|2,0,1]=4 1953 B12R1.107 NC(=S)CC(=O)c1ccccc1 Amb26430207 [0,1,0,0,0,0|2,0,1]=4 1954 B12R1.107 NC(=S)NC(=O)c1ccccc1 Amb2684614 [0,1,0,0,0,0|2,0,1]=4 1955 B12R1.107 NC(N)=CC(=O)c1ccccc1 Amb25108111 [0,1,0,0,0,0|2,0,1]=4 1956 B12R1.107 O=C(C=C(Cl)Cl)c1ccccc1 Amb27753874 [0,1,0,0,0,0|2,0,1]=4 1957 B12R1.107 O=C(CC(F)Cl)c1ccccc1 Amb27637711 [0,1,0,0,0,0|2,0,0]=3 1958 B12R1.107 O=C(C[N+](=O)[O-])c1ccccc1 Amb3687238 [0,1,0,0,0,0|3,0,0]=4 1959 B12R1.107 O=C(O[N+](=O)[O-])c1cccnc1 Amb27491612 [0,1,0,0,0,0|3,0,0]=4 1960 B12R1.308 C=C(CCN)c1ccccc1Br Amb33388000 [0,1,0,0,0,0|3,0,0]=4 1961 B12R1.308 C=C(CCN)c1ccccc1C Amb33362533 [0,1,0,0,0,0|3,0,0]=4 1962 B12R1.308 C=C(CCN)c1ccccc1Cl Amb33052606 [0,1,0,0,0,0|3,0,0]=4 1963 B12R1.308 C=C(CCN)c1ccccc1F Amb33361195 [0,1,0,0,0,0|3,0,0]=4 1964 B12R1.308 C=C(CCN)c1ccccc1O Amb33195783 [0,1,0,0,0,0|3,0,0]=4 1965 B12R1.308 C=C(CCO)c1ccccc1F Amb27980568 [0,1,0,0,0,0|3,0,0]=4 1966 B12R1.308 C=C(OCC)c1ccccc1N Amb33136058 [0,1,0,0,0,0|1,0,0]=2 1967 B12R1.308 C=C(OCC)c1ccccc1O Amb33136251 [0,1,0,0,0,0|1,0,0]=2 1968 B12R1.308 C=C(OCC)c1cccnc1N Amb33136323 [0,1,0,0,0,0|2,0,0]=3 1969 B12R1.308 C=C(OCC)c1ccncc1N Amb33135833 [0,1,0,0,0,0|2,0,0]=3 1970 B12R1.308 C=C(OCC)c1cnccc1C Amb19958591 [0,1,0,0,0,0|2,0,0]=3 1971 B12R1.308 C=C(OCC)c1cnccc1N Amb33136013 [0,1,0,0,0,0|2,0,0]=3 1972 B12R1.308 C=C(OCC)c1cncnc1Br Amb33136230 [0,1,0,0,0,0|3,0,0]=4 1973 B12R1.308 C=C(OCC)c1cncnc1Cl Amb33136175 [0,1,0,0,0,0|3,0,0]=4 1974 B12R1.308 C=C(OCC)c1ncccc1N Amb33135937 [0,1,0,0,0,0|2,0,0]=3 1975 B12R1.308 C=C(OCC)c1ncccc1O Amb33136066 [0,1,0,0,0,0|2,0,0]=3 1976 B12R1.308 C=C(OCC)c1nccnc1Cl Amb24579132 [0,1,0,0,0,0|3,0,0]=4 1977 B12R1.308 C=C(OCC)c1ncncc1Cl Amb33136328 [0,1,0,0,0,0|3,0,0]=4 1978 B12R1.308 C=C=CC(=O)c1ccccc1F Amb26475428 [0,1,0,0,0,0|1,0,2]=4 1979 B12R1.308 C=CCC(=O)c1ccccc1C Amb17334496 [0,1,0,0,0,0|1,0,2]=4 1980 B12R1.308 C=CCC(=O)c1ccccc1Cl Amb17335455 [0,1,0,0,0,0|1,0,2]=4 1981 B12R1.308 C=CCC(=O)c1ccccc1F Amb17334599 [0,1,0,0,0,0|1,0,2]=4 1982 B12R1.308 C=CCC(=O)c1ccccc1N Amb28145692 [0,1,0,0,0,0|1,0,2]=4 1983 B12R1.308 C=COC(=O)c1ccccc1O Amb4020572 [0,1,0,0,0,0|0,0,2]=3 1984 B12R1.308 CC#CC(=O)c1ccccc1Cl Amb27642088 [0,1,0,0,0,0|1,0,1]=3 1985 B12R1.308 CC#CC(=O)c1ccccc1N Amb27790775 [0,1,0,0,0,0|1,0,1]=3 1986 B12R1.308 CC#CC(=O)c1ccccc1O Amb27177683 [0,1,0,0,0,0|1,0,1]=3 1987 B12R1.308 CCCC(=O)c1ccccc1Br Amb17343723 [0,1,0,0,0,0|1,0,0]=2 1988 B12R1.308 CCCC(=O)c1ccccc1C Amb17198733 [0,1,0,0,0,0|1,0,0]=2 1989 B12R1.308 CCCC(=O)c1ccccc1Cl Amb17198743 [0,1,0,0,0,0|1,0,0]=2 1990 B12R1.308 CCCC(=O)c1ccccc1F Amb17198734 [0,1,0,0,0,0|1,0,0]=2 1991 B12R1.308 CCCC(=O)c1ccccc1N Amb18645869 [0,1,0,0,0,0|1,0,0]=2 1992 B12R1.308 CCCC(=O)c1ccccc1O Amb8629040 [0,1,0,0,0,0|1,0,0]=2 1993 B12R1.308 CCCC(=O)c1cccnc1Br Amb27841846 [0,1,0,0,0,0|2,0,0]=3 1994 B12R1.308 CCCC(=O)c1cncnc1C Amb27473689 [0,1,0,0,0,0|3,0,0]=4 1995 B12R1.308 CCCC(=O)c1ncccc1C Amb18798195 [0,1,0,0,0,0|2,0,0]=3 1996 B12R1.308 CCCC(=O)c1ncccc1Cl Amb26883709 [0,1,0,0,0,0|2,0,0]=3 1997 B12R1.308 CCCC(=O)c1ncccc1F Amb28059158 [0,1,0,0,0,0|2,0,0]=3 1998 B12R1.308 CCCC(=O)c1ncccc1N Amb27472806 [0,1,0,0,0,0|2,0,0]=3 1999 B12R1.308 CCCC(=O)c1ncncc1Br Amb27649497 [0,1,0,0,0,0|3,0,0]=4 2000 B12R1.308 CCCC(C)c1ccccc1C Amb27244850 [0,1,0,0,0,0|2,0,1]=4 2001 B12R1.308 CCCC(C)c1ccccc1O Amb3939443 [0,1,0,0,0,0|2,0,1]=4 2002 B12R1.308 CCCC(Cl)c1ccccc1Cl Amb27808095 [0,1,0,0,0,0|2,0,1]=4 2003 B12R1.308 CCCC(N)c1ccccc1Br Amb27815075 [0,1,0,0,0,0|2,0,1]=4 2004 B12R1.308 CCCC(N)c1ccccc1C Amb17232446 [0,1,0,0,0,0|2,0,1]=4 2005 B12R1.308 CCCC(N)c1ccccc1C Amb32662363 [0,1,0,0,0,0|2,0,1]=4 2006 B12R1.308 CCCC(N)c1ccccc1Cl Amb17234047 [0,1,0,0,0,0|2,0,1]=4 2007 B12R1.308 CCCC(N)c1ccccc1F Amb17232645 [0,1,0,0,0,0|2,0,1]=4 2008 B12R1.308 CCCC(N)c1ccccc1F Amb30982461 [0,1,0,0,0,0|2,0,1]=4 2009 B12R1.308 CCCC(O)c1ccccc1C Amb17232483 [0,1,0,0,0,0|1,0,2]=4 2010 B12R1.308 CCCC(O)c1ccccc1Cl Amb17234154 [0,1,0,0,0,0|1,0,2]=4 2011 B12R1.308 CCCC(O)c1ccccc1F Amb17232666 [0,1,0,0,0,0|1,0,2]=4 2012 B12R1.308 CCCN(C)c1ccccc1N Amb8898676 [0,1,0,0,0,0|3,0,0]=4 2013 B12R1.308 CCC[C@@H](N)c1ccccc1C Amb27391198 [0,1,0,0,0,0|2,0,1]=4 2014 B12R1.308 CCC[C@@H](N)c1ccccc1Cl Amb27196196 [0,1,0,0,0,0|2,0,1]=4 2015 B12R1.308 CCC[C@@H](O)c1ccccc1F Amb28064219 [0,1,0,0,0,0|1,0,2]=4 2016 B12R1.308 CCC[C@H](N)c1ccccc1C Amb26841003 [0,1,0,0,0,0|2,0,1]=4 2017 B12R1.308 CCC[C@H](N)c1ccccc1F Amb27830664 [0,1,0,0,0,0|2,0,1]=4 2018 B12R1.308 CCC[C@H](N)c1ccccc1I Amb28401584 [0,1,0,0,0,0|2,0,1]=4 2019 B12R1.308 CCC[C@H](N)c1ccccc1O Amb28072846 [0,1,0,0,0,0|2,0,1]=4 2020 B12R1.308 CCC[C@H](N)c1ccccc1S Amb27816971 [0,1,0,0,0,0|2,0,1]=4 2021 B12R1.308 CCC[C@H](O)c1ccccc1Br Amb27661408 [0,1,0,0,0,0|1,0,2]=4 2022 B12R1.308 CCC[C@H](O)c1ccccc1Cl Amb28381799 [0,1,0,0,0,0|1,0,2]=4 2023 B12R1.308 CCNC(=N)c1ccccc1Br Amb27590883 [0,1,0,0,0,0|2,0,0]=3 2024 B12R1.308 CCNC(=N)c1ccccc1C Amb28365623 [0,1,0,0,0,0|2,0,0]=3 2025 B12R1.308 CCNC(=N)c1cccnc1O Amb35675423 [0,1,0,0,0,0|3,0,0]=4 2026 B12R1.308 CCNC(=N)c1ccncc1C Amb28118370 [0,1,0,0,0,0|3,0,0]=4 2027 B12R1.308 CCNC(=O)C1=C(C)OC=CS1 Amb28341053 [0,1,0,0,0,0|3,0,0]=4 2028 B12R1.308 CCNC(=O)C1=CC=CNC1=O Amb24462761 [0,1,0,0,0,0|2,0,0]=3 2029 B12R1.308 CCNC(=O)C1=CNC=NC1=O Amb27660731 [0,1,0,0,0,0|3,0,0]=4 2030 B12R1.308 CCNC(=O)c1cccc[n+]1[O-] Amb27853098 [0,1,0,0,0,0|2,0,0]=3 2031 B12R1.308 CCNC(=O)c1ccccc1Br Amb3373826 [0,1,0,0,0,0|1,0,0]=2 2032 B12R1.308 CCNC(=O)c1ccccc1I Amb3709919 [0,1,0,0,0,0|1,0,0]=2 2033 B12R1.308 CCNC(=O)c1ccccc1N Amb1120573 [0,1,0,0,0,0|1,0,0]=2 2034 B12R1.308 CCNC(=O)c1ccccc1O Amb2137048 [0,1,0,0,0,0|1,0,0]=2 2035 B12R1.308 CCNC(=O)c1cccnc1Cl Amb2222505 [0,1,0,0,0,0|2,0,0]=3 2036 B12R1.308 CCNC(=O)c1cccnc1N Amb18958809 [0,1,0,0,0,0|2,0,0]=3 2037 B12R1.308 CCNC(=O)c1ccncc1I Amb28293912 [0,1,0,0,0,0|2,0,0]=3 2038 B12R1.308 CCNC(=O)c1ccncc1N Amb23571475 [0,1,0,0,0,0|2,0,0]=3 2039 B12R1.308 CCNC(=O)c1cnccc1Cl Amb27258886 [0,1,0,0,0,0|2,0,0]=3 2040 B12R1.308 CCNC(=O)c1cnccc1N Amb27770634 [0,1,0,0,0,0|2,0,0]=3 2041 B12R1.308 CCNC(=O)c1ncccc1Br Amb27490561 [0,1,0,0,0,0|2,0,0]=3 2042 B12R1.308 CCNC(=O)c1ncccc1C Amb27262245 [0,1,0,0,0,0|2,0,0]=3 2043 B12R1.308 CCNC(=O)c1ncncc1Cl Amb28064744 [0,1,0,0,0,0|3,0,0]=4 2044 B12R1.308 CCNC(=S)c1ccccc1S Amb26869428 [0,1,0,0,0,0|1,1,0]=3 2045 B12R1.308 CCNC(=S)c1cccnc1Cl Amb27828130 [0,1,0,0,0,0|2,1,0]=4 2046 B12R1.308 CCNC(C)c1ccccc1I Amb28288975 [0,1,0,0,0,0|2,0,1]=4 2047 B12R1.308 CCN[C@H](C)c1ccccc1Br Amb27615416 [0,1,0,0,0,0|2,0,1]=4 2048 B12R1.308 CCN[C@H](C)c1ccccc1C Amb28350570 [0,1,0,0,0,0|2,0,1]=4 2049 B12R1.308 CCN[C@H](C)c1ccccc1Cl Amb27637568 [0,1,0,0,0,0|2,0,1]=4 2050 B12R1.308 CCOC(=N)C1=CC=CNC1=O Amb22261521 [0,1,0,0,0,0|2,0,0]=3 2051 B12R1.308 CCOC(=N)c1ccccc1C Amb18792487 [0,1,0,0,0,0|1,0,0]=2 2052 B12R1.308 CCOC(=N)c1ccccc1F Amb20673133 [0,1,0,0,0,0|1,0,0]=2 2053 B12R1.308 CCOC(=N)c1ccccc1F Amb25867109 [0,1,0,0,0,0|1,0,0]=2 2054 B12R1.308 CCOC(=N)c1ccccc1I Amb27845578 [0,1,0,0,0,0|1,0,0]=2 2055 B12R1.308 CCOC(=N)c1ccccc1O Amb25891346 [0,1,0,0,0,0|1,0,0]=2 2056 B12R1.308 CCOC(=N)c1cccnc1Cl Amb27252034 [0,1,0,0,0,0|2,0,0]=3 2057 B12R1.308 CCOC(=N)c1ccncc1Br Amb28319003 [0,1,0,0,0,0|2,0,0]=3 2058 B12R1.308 CCOC(=N)c1ccncc1C Amb27177821 [0,1,0,0,0,0|2,0,0]=3 2059 B12R1.308 CCOC(=N)c1cnccc1Br Amb28140246 [0,1,0,0,0,0|2,0,0]=3 2060 B12R1.308 CCOC(=N)c1ncccc1Br Amb27873541 [0,1,0,0,0,0|2,0,0]=3 2061 B12R1.308 CCOC(=N)c1ncccc1Cl Amb27175306 [0,1,0,0,0,0|2,0,0]=3 2062 B12R1.308 CCOC(=N)c1ncccc1O Amb24351097 [0,1,0,0,0,0|2,0,0]=3 2063 B12R1.308 CCOC(=N)c1nccnc1C Amb35601030 [0,1,0,0,0,0|3,0,0]=4 2064 B12R1.308 CCOC(=O)C1=CC=CNC1=O Amb22751705 [0,1,0,0,0,0|1,0,0]=2 2065 B12R1.308 CCOC(=O)C1=CCCCC1=O Amb17594202 [0,1,0,0,0,0|0,0,3]=4 2066 B12R1.308 CCOC(=O)C1=CN=CNC1=O Amb19115311 [0,1,0,0,0,0|2,0,0]=3 2067 B12R1.308 CCOC(=O)C1=CNC=CC1=O Amb22522165 [0,1,0,0,0,0|1,0,0]=2 2068 B12R1.308 CCOC(=O)C1=COC=CC1=O Amb25066453 [0,1,0,0,0,0|1,0,0]=2 2069 B12R1.308 CCOC(=O)N1CC=COC1=O Amb26448885 [0,1,0,0,0,0|2,0,1]=4 2070 B12R1.308 CCOC(=O)N1CCC=CC1=O Amb22500511 [0,1,0,0,0,0|1,0,2]=4 2071 B12R1.308 CCOC(=O)c1cccc[n+]1[O-] Amb21961772 [0,1,0,0,0,0|1,0,0]=2 2072 B12R1.308 CCOC(=O)c1ccccc1Br Amb2687785 [0,1,0,0,0,0|0,0,0]=1 2073 B12R1.308 CCOC(=O)c1ccccc1C Amb3940128 [0,1,0,0,0,0|0,0,0]=1 2074 B12R1.308 CCOC(=O)c1ccccc1Cl Amb3939008 [0,1,0,0,0,0|0,0,0]=1 2075 B12R1.308 CCOC(=O)c1ccccc1F Amb6357502 [0,1,0,0,0,0|0,0,0]=1 2076 B12R1.308 CCOC(=O)c1ccccc1I Amb8384588 [0,1,0,0,0,0|0,0,0]=1 2077 B12R1.308 CCOC(=O)c1ccccc1N Amb1229845 [0,1,0,0,0,0|0,0,0]=1 2078 B12R1.308 CCOC(=O)c1ccccc1O Amb3940304 [0,1,0,0,0,0|0,0,0]=1 2079 B12R1.308 CCOC(=O)c1cccnc1Br Amb3632334 [0,1,0,0,0,0|1,0,0]=2 2080 B12R1.308 CCOC(=O)c1cccnc1C Amb3940119 [0,1,0,0,0,0|1,0,0]=2 2081 B12R1.308 CCOC(=O)c1cccnc1Cl Amb2725680 [0,1,0,0,0,0|1,0,0]=2 2082 B12R1.308 CCOC(=O)c1cccnc1F Amb22233852 [0,1,0,0,0,0|1,0,0]=2 2083 B12R1.308 CCOC(=O)c1cccnc1I Amb27459759 [0,1,0,0,0,0|1,0,0]=2 2084 B12R1.308 CCOC(=O)c1cccnc1N Amb2608573 [0,1,0,0,0,0|1,0,0]=2 2085 B12R1.308 CCOC(=O)c1cccnc1S Amb1130764 [0,1,0,0,0,0|1,0,0]=2 2086 B12R1.308 CCOC(=O)c1ccncc1Br Amb10606115 [0,1,0,0,0,0|1,0,0]=2 2087 B12R1.308 CCOC(=O)c1ccncc1Cl Amb22730548 [0,1,0,0,0,0|1,0,0]=2 2088 B12R1.308 CCOC(=O)c1ccncc1F Amb13887029 [0,1,0,0,0,0|1,0,0]=2 2089 B12R1.308 CCOC(=O)c1ccncc1I Amb24350555 [0,1,0,0,0,0|1,0,0]=2 2090 B12R1.308 CCOC(=O)c1ccncc1N Amb2697350 [0,1,0,0,0,0|1,0,0]=2 2091 B12R1.308 CCOC(=O)c1ccncc1N Amb8388414 [0,1,0,0,0,0|1,0,0]=2 2092 B12R1.308 CCOC(=O)c1ccncc1O Amb8630472 [0,1,0,0,0,0|1,0,0]=2 2093 B12R1.308 CCOC(=O)c1ccnnc1C Amb22002136 [0,1,0,0,0,0|2,0,0]=3 2094 B12R1.308 CCOC(=O)c1ccnnc1Cl Amb17935804 [0,1,0,0,0,0|2,0,0]=3 2095 B12R1.308 CCOC(=O)c1ccnnc1N Amb22499550 [0,1,0,0,0,0|2,0,0]=3 2096 B12R1.308 CCOC(=O)c1ccnnc1O Amb17935805 [0,1,0,0,0,0|2,0,0]=3 2097 B12R1.308 CCOC(=O)c1cnccc1Br Amb16233313 [0,1,0,0,0,0|1,0,0]=2 2098 B12R1.308 CCOC(=O)c1cnccc1C Amb17843888 [0,1,0,0,0,0|1,0,0]=2 2099 B12R1.308 CCOC(=O)c1cnccc1C Amb22295938 [0,1,0,0,0,0|1,0,0]=2 2100 B12R1.308 CCOC(=O)c1cnccc1Cl Amb10602708 [0,1,0,0,0,0|1,0,0]=2 2101 B12R1.308 CCOC(=O)c1cnccc1Cl Amb16230840 [0,1,0,0,0,0|1,0,0]=2 2102 B12R1.308 CCOC(=O)c1cnccc1N Amb20620300 [0,1,0,0,0,0|1,0,0]=2 2103 B12R1.308 CCOC(=O)c1cncnc1Br Amb25311643 [0,1,0,0,0,0|2,0,0]=3 2104 B12R1.308 CCOC(=O)c1cncnc1C Amb10605132 [0,1,0,0,0,0|2,0,0]=3 2105 B12R1.308 CCOC(=O)c1cncnc1Cl Amb17935875 [0,1,0,0,0,0|2,0,0]=3 2106 B12R1.308 CCOC(=O)c1cncnc1N Amb4022619 [0,1,0,0,0,0|2,0,0]=3 2107 B12R1.308 CCOC(=O)c1cncnc1O Amb2699781 [0,1,0,0,0,0|2,0,0]=3 2108 B12R1.308 CCOC(=O)c1cnncc1C Amb22284840 [0,1,0,0,0,0|2,0,0]=3 2109 B12R1.308 CCOC(=O)c1ncccc1Br Amb22233846 [0,1,0,0,0,0|1,0,0]=2 2110 B12R1.308 CCOC(=O)c1ncccc1C Amb18798397 [0,1,0,0,0,0|1,0,0]=2 2111 B12R1.308 CCOC(=O)c1ncccc1Cl Amb10975716 [0,1,0,0,0,0|1,0,0]=2 2112 B12R1.308 CCOC(=O)c1ncccc1F Amb19895590 [0,1,0,0,0,0|1,0,0]=2 2113 B12R1.308 CCOC(=O)c1ncccc1I Amb22752609 [0,1,0,0,0,0|1,0,0]=2 2114 B12R1.308 CCOC(=O)c1ncccc1N Amb5720179 [0,1,0,0,0,0|1,0,0]=2 2115 B12R1.308 CCOC(=O)c1ncccc1O Amb22263028 [0,1,0,0,0,0|1,0,0]=2 2116 B12R1.308 CCOC(=O)c1ncccc1O Amb33624926 [0,1,0,0,0,0|1,0,0]=2 2117 B12R1.308 CCOC(=O)c1nccnc1Br Amb23400030 [0,1,0,0,0,0|2,0,0]=3 2118 B12R1.308 CCOC(=O)c1nccnc1Cl Amb21858220 [0,1,0,0,0,0|2,0,0]=3 2119 B12R1.308 CCOC(=O)c1nccnc1N Amb18646711 [0,1,0,0,0,0|2,0,0]=3 2120 B12R1.308 CCOC(=O)c1ncncc1Br Amb22304687 [0,1,0,0,0,0|2,0,0]=3 2121 B12R1.308 CCOC(=O)c1ncncc1C Amb24099654 [0,1,0,0,0,0|2,0,0]=3 2122 B12R1.308 CCOC(=O)c1ncncc1I Amb32992334 [0,1,0,0,0,0|2,0,0]=3 2123 B12R1.308 CCOC(=O)c1ncncc1N Amb18646707 [0,1,0,0,0,0|2,0,0]=3 2124 B12R1.308 CCOC(=O)c1ncnnc1Cl Amb27175739 [0,1,0,0,0,0|3,0,0]=4 2125 B12R1.308 CCOC(=O)c1nnccc1C Amb24062287 [0,1,0,0,0,0|2,0,0]=3 2126 B12R1.308 CCOC(=O)c1nnccc1O Amb27485053 [0,1,0,0,0,0|2,0,0]=3 2127 B12R1.308 CCOC(=S)c1ccccc1O Amb22230695 [0,1,0,0,0,0|0,1,0]=2 2128 B12R1.308 CCON(C)c1ccncc1Br Amb27216437 [0,1,0,0,0,0|3,0,0]=4 2129 B12R1.308 CCSC(=O)c1ccccc1O Amb20242722 [0,1,0,0,0,0|0,1,0]=2 2130 B12R1.308 CCSC(C)c1ccccc1Cl Amb28127831 [0,1,0,0,0,0|1,1,1]=4 2131 B12R1.308 CCSC(C)c1ccccc1F Amb28185640 [0,1,0,0,0,0|1,1,1]=4 2132 B12R1.308 CNCC(=O)c1ccccc1Br Amb18160384 [0,1,0,0,0,0|2,0,0]=3 2133 B12R1.308 CNCC(=O)c1ccccc1C Amb18862585 [0,1,0,0,0,0|2,0,0]=3 2134 B12R1.308 CNCC(=O)c1ccccc1Cl Amb18863065 [0,1,0,0,0,0|2,0,0]=3 2135 B12R1.308 CNCC(=O)c1ccccc1Cl Amb32679864 [0,1,0,0,0,0|2,0,0]=3 2136 B12R1.308 CNCC(=O)c1ccccc1F Amb18862705 [0,1,0,0,0,0|2,0,0]=3 2137 B12R1.308 CNCC(=O)c1ccccc1O Amb26392452 [0,1,0,0,0,0|2,0,0]=3 2138 B12R1.308 CNCC(=O)c1cccnc1Br Amb33387442 [0,1,0,0,0,0|3,0,0]=4 2139 B12R1.308 CNCC(=O)c1cccnc1C Amb32880138 [0,1,0,0,0,0|3,0,0]=4 2140 B12R1.308 CNCC(=O)c1cccnc1Cl Amb33256936 [0,1,0,0,0,0|3,0,0]=4 2141 B12R1.308 CNCC(=O)c1cccnc1F Amb33378328 [0,1,0,0,0,0|3,0,0]=4 2142 B12R1.308 CNCC(=O)c1ccncc1Br Amb33388473 [0,1,0,0,0,0|3,0,0]=4 2143 B12R1.308 CNCC(=O)c1ccncc1C Amb33414506 [0,1,0,0,0,0|3,0,0]=4 2144 B12R1.308 CNCC(=O)c1ccncc1Cl Amb33413520 [0,1,0,0,0,0|3,0,0]=4 2145 B12R1.308 CNCC(=O)c1ccncc1F Amb25076936 [0,1,0,0,0,0|3,0,0]=4 2146 B12R1.308 CNCC(=O)c1cnccc1C Amb26503018 [0,1,0,0,0,0|3,0,0]=4 2147 B12R1.308 CNCC(=O)c1cnccc1N Amb27196154 [0,1,0,0,0,0|3,0,0]=4 2148 B12R1.308 CNCC(=O)c1ncccc1Br Amb33335735 [0,1,0,0,0,0|3,0,0]=4 2149 B12R1.308 CNCC(=O)c1ncccc1C Amb33429064 [0,1,0,0,0,0|3,0,0]=4 2150 B12R1.308 CNCC(=O)c1ncccc1F Amb28435430 [0,1,0,0,0,0|3,0,0]=4 2151 B12R1.308 CNNC(=O)c1ccccc1N Amb18646316 [0,1,0,0,0,0|2,0,0]=3 2152 B12R1.308 CNNC(=O)c1ccccc1O Amb25910765 [0,1,0,0,0,0|2,0,0]=3 2153 B12R1.308 CNOC(=O)c1ccccc1O Amb28381144 [0,1,0,0,0,0|1,0,0]=2 2154 B12R1.308 COCC(=O)c1cccnc1C Amb28250388 [0,1,0,0,0,0|3,0,0]=4 2155 B12R1.308 COCC(=O)c1ccncc1C Amb27656417 [0,1,0,0,0,0|3,0,0]=4 2156 B12R1.308 COCC(=O)c1ccncc1F Amb28133312 [0,1,0,0,0,0|3,0,0]=4 2157 B12R1.308 COCC(=O)c1cnccc1C Amb27948887 [0,1,0,0,0,0|3,0,0]=4 2158 B12R1.308 COCC(=O)c1cnccc1N Amb27590055 [0,1,0,0,0,0|3,0,0]=4 2159 B12R1.308 COCC(=O)c1ncccc1F Amb27411210 [0,1,0,0,0,0|3,0,0]=4 2160 B12R1.308 CONC(=O)c1ccccc1C Amb16969914 [0,1,0,0,0,0|2,0,0]=3 2161 B12R1.308 CONC(=O)c1ccccc1Cl Amb16980468 [0,1,0,0,0,0|2,0,0]=3 2162 B12R1.308 CONC(=O)c1ccccc1N Amb28119695 [0,1,0,0,0,0|2,0,0]=3 2163 B12R1.308 CONC(=O)c1ccccc1O Amb27668743 [0,1,0,0,0,0|2,0,0]=3 2164 B12R1.308 CONC(=O)c1cccnc1I Amb27178778 [0,1,0,0,0,0|3,0,0]=4 2165 B12R1.308 CONC(=O)c1cccnc1N Amb35671696 [0,1,0,0,0,0|3,0,0]=4 2166 B12R1.308 CONC(=O)c1ccncc1O Amb27475613 [0,1,0,0,0,0|3,0,0]=4 2167 B12R1.308 CONC(=O)c1cnccc1C Amb27220047 [0,1,0,0,0,0|3,0,0]=4 2168 B12R1.308 CONC(=O)c1cnccc1Cl Amb27394518 [0,1,0,0,0,0|3,0,0]=4 2169 B12R1.308 CONC(=O)c1ncccc1Br Amb27878227 [0,1,0,0,0,0|3,0,0]=4 2170 B12R1.308 CONC(=O)c1ncccc1C Amb27455702 [0,1,0,0,0,0|3,0,0]=4 2171 B12R1.308 CONC(=O)c1ncccc1Cl Amb28317532 [0,1,0,0,0,0|3,0,0]=4 2172 B12R1.308 CONC(=O)c1ncccc1O Amb27807844 [0,1,0,0,0,0|3,0,0]=4 2173 B12R1.308 CO\N=C(/C)c1ccccc1F Amb32660955 [0,1,0,0,0,0|3,0,0]=4 2174 B12R1.308 CO\N=C(/C)c1ccccc1O Amb27854963 [0,1,0,0,0,0|3,0,0]=4 2175 B12R1.308 CO\N=C(/N)c1ccccc1Br Amb18227754 [0,1,0,0,0,0|3,0,0]=4 2176 B12R1.308 CO\N=C(/N)c1ccccc1C Amb18862601 [0,1,0,0,0,0|3,0,0]=4 2177 B12R1.308 CO\N=C(/N)c1ccccc1Cl Amb18863109 [0,1,0,0,0,0|3,0,0]=4 2178 B12R1.308 CO\N=C(/N)c1ccccc1F Amb18862744 [0,1,0,0,0,0|3,0,0]=4 2179 B12R1.308 CO\N=C(\C)c1ccccc1Br Amb27207597 [0,1,0,0,0,0|3,0,0]=4 2180 B12R1.308 CO\N=C(\C)c1ccccc1C Amb27448740 [0,1,0,0,0,0|3,0,0]=4 2181 B12R1.308 CSCC(=O)c1ccccc1Br Amb27389140 [0,1,0,0,0,0|2,0,0]=3 2182 B12R1.308 CSCC(=O)c1ccccc1C Amb18796321 [0,1,0,0,0,0|2,0,0]=3 2183 B12R1.308 CSCC(=O)c1ccccc1Cl Amb18320104 [0,1,0,0,0,0|2,0,0]=3 2184 B12R1.308 CSCC(=O)c1ccccc1F Amb19057447 [0,1,0,0,0,0|2,0,0]=3 2185 B12R1.308 C\C(=C/CCl)c1ccccc1Cl Amb28343242 [0,1,0,0,0,0|3,0,0]=4 2186 B12R1.308 C\C(=C/CN)c1ccccc1Br Amb31098022 [0,1,0,0,0,0|3,0,0]=4 2187 B12R1.308 C\C(=C/CN)c1ccccc1C Amb31099548 [0,1,0,0,0,0|3,0,0]=4 2188 B12R1.308 C\C(=C/CN)c1ccccc1F Amb31099552 [0,1,0,0,0,0|3,0,0]=4 2189 B12R1.308 C\C(=C/CO)c1ccccc1Cl Amb27416537 [0,1,0,0,0,0|3,0,0]=4 2190 B12R1.308 C\C(=C/CO)c1ccccc1O Amb27749760 [0,1,0,0,0,0|3,0,0]=4 2191 B12R1.308 C\C(=C\CCl)c1ccccc1Cl Amb28318469 [0,1,0,0,0,0|3,0,0]=4 2192 B12R1.308 C\C=C\C(=O)c1ccccc1Cl Amb25816329 [0,1,0,0,0,0|1,0,1]=3 2193 B12R1.308 C\C=C\C(=O)c1cccnc1N Amb27825890 [0,1,0,0,0,0|2,0,1]=4 2194 B12R1.308 C\C=C\C(=O)c1cnccc1N Amb27870353 [0,1,0,0,0,0|2,0,1]=4 2195 B12R1.308 Cc1ccccc1C(=O)C=[N+]=[N-] Amb24644060 [0,1,0,0,0,0|3,0,0]=4 2196 B12R1.308 Cc1ccccc1C(=O)CC#N Amb397814 [0,1,0,0,0,0|2,0,1]=4 2197 B12R1.308 Cc1ccccc1C(=O)CC=O Amb7766349 [0,1,0,0,0,0|2,0,1]=4 2198 B12R1.308 Cc1ccccc1C(=O)CCBr Amb28119109 [0,1,0,0,0,0|2,0,0]=3 2199 B12R1.308 Cc1ccccc1C(=O)CCN Amb25062867 [0,1,0,0,0,0|2,0,0]=3 2200 B12R1.308 Cc1ccccc1C(=O)CCO Amb26555785 [0,1,0,0,0,0|2,0,0]=3 2201 B12R1.308 Cc1ccccc1C(=O)N=C=O Amb17232351 [0,1,0,0,0,0|2,0,1]=4 2202 B12R1.308 Cc1ccccc1C(=O)N=C=S Amb2689336 [0,1,0,0,0,0|2,0,1]=4 2203 B12R1.308 Cc1ccccc1C(=O)OCCl Amb27852560 [0,1,0,0,0,0|1,0,0]=2 2204 B12R1.308 Cc1ccccc1C(=O)\C=C\[O-] Amb27624352 [0,1,0,0,0,0|2,0,1]=4 2205 B12R1.308 Cc1cccnc1C(=O)CCN Amb33429067 [0,1,0,0,0,0|3,0,0]=4 2206 B12R1.308 Cc1ccncc1C(=O)CCN Amb24524737 [0,1,0,0,0,0|3,0,0]=4 2207 B12R1.308 Cc1cnccc1C(=O)CCN Amb33415544 [0,1,0,0,0,0|3,0,0]=4 2208 B12R1.308 Cc1ncccc1C(=O)CCN Amb32881378 [0,1,0,0,0,0|3,0,0]=4 2209 B12R1.308 N#CCC(=O)c1ccccc1Br Amb3941065 [0,1,0,0,0,0|2,0,1]=4 2210 B12R1.308 N#CCC(=O)c1ccccc1Cl Amb6365722 [0,1,0,0,0,0|2,0,1]=4 2211 B12R1.308 N#CCC(=O)c1ccccc1F Amb440283 [0,1,0,0,0,0|2,0,1]=4 2212 B12R1.308 N#CCC(=O)c1ccccc1I Amb6264353 [0,1,0,0,0,0|2,0,1]=4 2213 B12R1.308 N#CCC(=O)c1ccccc1N Amb9824190 [0,1,0,0,0,0|2,0,1]=4 2214 B12R1.308 N#CCC(=O)c1ccccc1O Amb10071607 [0,1,0,0,0,0|2,0,1]=4 2215 B12R1.308 N#CNC(=O)c1ccccc1Cl Amb26937226 [0,1,0,0,0,0|2,0,1]=4 2216 B12R1.308 N#CNC(=O)c1ccccc1N Amb27848178 [0,1,0,0,0,0|2,0,1]=4 2217 B12R1.308 NCCC(=O)c1ccccc1Br Amb33389465 [0,1,0,0,0,0|2,0,0]=3 2218 B12R1.308 NCCC(=O)c1ccccc1Cl Amb25709180 [0,1,0,0,0,0|2,0,0]=3 2219 B12R1.308 NCCC(=O)c1ccccc1Cl Amb32674762 [0,1,0,0,0,0|2,0,0]=3 2220 B12R1.308 NCCC(=O)c1ccccc1F Amb27881481 [0,1,0,0,0,0|2,0,0]=3 2221 B12R1.308 NCCC(=O)c1ccccc1N Amb21855941 [0,1,0,0,0,0|2,0,0]=3 2222 B12R1.308 NCCC(=O)c1ccccc1N Amb28555772 [0,1,0,0,0,0|2,0,0]=3 2223 B12R1.308 NCCC(=O)c1ccccc1N Amb32652605 [0,1,0,0,0,0|2,0,0]=3 2224 B12R1.308 NCCC(=O)c1ccccc1O Amb24346596 [0,1,0,0,0,0|2,0,0]=3 2225 B12R1.308 NCCC(=O)c1cccnc1Br Amb33387430 [0,1,0,0,0,0|3,0,0]=4 2226 B12R1.308 NCCC(=O)c1cccnc1Cl Amb33256920 [0,1,0,0,0,0|3,0,0]=4 2227 B12R1.308 NCCC(=O)c1cccnc1F Amb33378333 [0,1,0,0,0,0|3,0,0]=4 2228 B12R1.308 NCCC(=O)c1ccncc1Br Amb33388472 [0,1,0,0,0,0|3,0,0]=4 2229 B12R1.308 NCCC(=O)c1ccncc1Cl Amb33413510 [0,1,0,0,0,0|3,0,0]=4 2230 B12R1.308 NCCC(=O)c1ccncc1F Amb24550937 [0,1,0,0,0,0|3,0,0]=4 2231 B12R1.308 NCCC(=O)c1ncccc1Br Amb33335725 [0,1,0,0,0,0|3,0,0]=4 2232 B12R1.308 NCCC(=O)c1ncccc1F Amb33419506 [0,1,0,0,0,0|3,0,0]=4 2233 B12R1.308 NCCS(=O)c1ccccc1F Amb18974522 [0,1,0,0,0,0|3,0,0]=4 2234 B12R1.308 NCCS(=O)c1ccccc1F Amb19373859 [0,1,0,0,0,0|3,0,0]=4 2235 B12R1.308 NCCS(=O)c1ccccc1O Amb27208586 [0,1,0,0,0,0|3,0,0]=4 2236 B12R1.308 NCOC(=O)c1ccccc1O Amb28343097 [0,1,0,0,0,0|1,0,0]=2 2237 B12R1.308 O=C(CCBr)c1ccccc1Br Amb24695292 [0,1,0,0,0,0|2,0,0]=3 2238 B12R1.308 O=C(CCBr)c1ccccc1I Amb24696334 [0,1,0,0,0,0|2,0,0]=3 2239 B12R1.308 O=C(CCBr)c1ccccc1O Amb28322327 [0,1,0,0,0,0|2,0,0]=3 2240 B12R1.308 O=C(CCCl)c1ccccc1Cl Amb22229247 [0,1,0,0,0,0|2,0,0]=3 2241 B12R1.308 O=C(CCCl)c1ccccc1F Amb6301804 [0,1,0,0,0,0|2,0,0]=3 2242 B12R1.308 O=C(CCCl)c1ccccc1I Amb25796603 [0,1,0,0,0,0|2,0,0]=3 2243 B12R1.308 O=C(CCCl)c1ccccc1O Amb27470727 [0,1,0,0,0,0|2,0,0]=3 2244 B12R1.308 O=C(CCF)c1ccccc1Br Amb16231892 [0,1,0,0,0,0|2,0,0]=3 2245 B12R1.308 O=C(CCO)c1ccccc1Cl Amb27653159 [0,1,0,0,0,0|2,0,0]=3 2246 B12R1.308 O=C(CCO)c1ccccc1F Amb25159895 [0,1,0,0,0,0|2,0,0]=3 2247 B12R1.308 O=C(CCO)c1ccccc1O Amb27234354 [0,1,0,0,0,0|2,0,0]=3 2248 B12R1.308 O=C(N=C=S)c1ccccc1Cl Amb2685766 [0,1,0,0,0,0|2,0,1]=4 2249 B12R1.308 O=C(N=C=S)c1ccccc1F Amb9249958 [0,1,0,0,0,0|2,0,1]=4 2250 B12R1.308 O=C(NCCl)c1ccccc1Cl Amb7807833 [0,1,0,0,0,0|2,0,0]=3 2251 B12R1.308 O=C(NCCl)c1ccccc1F Amb7807832 [0,1,0,0,0,0|2,0,0]=3 2252 B12R1.308 O=C(NCO)c1ccccc1F Amb2793599 [0,1,0,0,0,0|2,0,0]=3 2253 B12R1.308 O=C(NCO)c1ccccc1O Amb6358947 [0,1,0,0,0,0|2,0,0]=3 2254 B12R1.308 O=C(\C=C\Cl)c1ccccc1Br Amb35645308 [0,1,0,0,0,0|2,0,1]=4 2255 B12R1.308 O=C(\C=C\Cl)c1ccccc1Cl Amb35645309 [0,1,0,0,0,0|2,0,1]=4 2256 B12R1.308 O=C(\C=C\Cl)c1ccccc1I Amb35609469 [0,1,0,0,0,0|2,0,1]=4 2257 B12R1.308 O=C(\C=C\Cl)c1ccccc1O Amb35645316 [0,1,0,0,0,0|2,0,1]=4 2258 B12R1.308 O=C(\C=C\[O-])c1ccccc1Cl Amb27258626 [0,1,0,0,0,0|2,0,1]=4 2259 B12R1.308 O=C(\C=C\[O-])c1ccccc1F Amb27265418 [0,1,0,0,0,0|2,0,1]=4 2260 B12R1.308 O=C=NC(=O)c1ccccc1Br Amb17247240 [0,1,0,0,0,0|2,0,1]=4 2261 B12R1.308 O=C=NC(=O)c1ccccc1Cl Amb17233863 [0,1,0,0,0,0|2,0,1]=4 2262 B12R1.308 O=C=NC(=O)c1ccccc1F Amb17232511 [0,1,0,0,0,0|2,0,1]=4 2263 B12R1.308 O=C=NC(=O)c1ccccc1I Amb27871128 [0,1,0,0,0,0|2,0,1]=4 2264 B12R1.308 O=CCC(=O)c1ccccc1Br Amb9204919 [0,1,0,0,0,0|2,0,1]=4 2265 B12R1.308 O=CCC(=O)c1ccccc1Cl Amb7766339 [0,1,0,0,0,0|2,0,1]=4 2266 B12R1.308 O=CCC(=O)c1ccccc1F Amb9204907 [0,1,0,0,0,0|2,0,1]=4 2267 B12R1.308 O=CCC(=O)c1ccccc1O Amb18645953 [0,1,0,0,0,0|2,0,1]=4 2268 B12R1.308 O=CNC(=O)c1ccccc1O Amb17621622 [0,1,0,0,0,0|2,0,1]=4 2269 B12R1.308 [N-]=[N+]=CC(=O)c1ccccc1F Amb24497496 [0,1,0,0,0,0|3,0,0]=4 2270 B12R1.308 [N-]=[N+]=NC(=O)c1ccccc1N Amb27841613 [0,1,0,0,0,0|3,0,0]=4 2271 B12R1.308 [N-]=[N+]=NC(=O)c1ccccc1O Amb26045094 [0,1,0,0,0,0|3,0,0]=4 2272 B10R0.1 CCOC(=O)\C=C\C=C\CO Amb8394083 [0,0,1,0,0,0|1,0,1]=3 2273 B10R0.1 C\C=C\C=C\NC(=O)OCC Amb27204766 [0,0,1,0,0,0|1,0,1]=3 2274 B10R0.19 C=CCNC(=O)C(=O)OCC Amb10879992 [0,0,1,0,0,0|2,0,1]=4 2275 B10R0.33 CCOC(=O)\C(=C/O)NC=O Amb22055322 [0,0,1,0,0,0|3,0,0]=4 2276 B10R0.33 CCOC(=O)\C(=C\N)NC=O Amb27799111 [0,0,1,0,0,0|3,0,0]=4 2277 B10R0.33 CCOC(=O)\C(=C\O)NC=O Amb27620710 [0,0,1,0,0,0|3,0,0]=4 2278 B10R0.33 C\C=C(/NC=O)C(=O)OCC Amb28322910 [0,0,1,0,0,0|2,0,1]=4 2279 B12R2.2 C1=C(c2ccccc2)CCC1 Amb4317492 [0,0,0,1,0,0|2,0,0]=3 2280 B12R2.2 C1=C(c2ccccc2)CNC1 Amb22059494 [0,0,0,1,0,0|3,0,0]=4 2281 B12R2.2 C1=C(c2ccccc2)CNC1 Amb30584704 [0,0,0,1,0,0|3,0,0]=4 2282 B12R2.2 C1=C(c2ccccc2)NCC1 Amb17938860 [0,0,0,1,0,0|2,0,0]=3 2283 B12R2.2 c1cc(C2=NCCC2)ccn1 Amb10605642 [0,0,0,1,0,0|3,0,0]=4 2284 B12R2.2 c1cc(C2=NCCN2)ccn1 Amb7968845 [0,0,0,1,0,0|3,0,0]=4 2285 B12R2.2 c1cc(C2NCCO2)ccn1 Amb17334300 [0,0,0,1,0,0|2,0,1]=4 2286 B12R2.2 c1cc(C2OCCO2)ccn1 Amb17334309 [0,0,0,1,0,0|1,0,2]=4 2287 B12R2.2 c1ccc(-c2ccco2)cc1 Amb8390025 [0,0,0,1,0,0|1,0,2]=4 2288 B12R2.2 c1ccc(-c2ccno2)cc1 Amb2191136 [0,0,0,1,0,0|2,0,1]=4 2289 B12R2.2 c1ccc(-c2cnco2)cc1 Amb2725800 [0,0,0,1,0,0|2,0,1]=4 2290 B12R2.2 c1ccc(-c2ncco2)cc1 Amb5494173 [0,0,0,1,0,0|1,0,2]=4 2291 B12R2.2 c1ccc(-c2ncno2)cc1 Amb10552927 [0,0,0,1,0,0|2,0,1]=4 2292 B12R2.2 c1ccc(-c2nnco2)cc1 Amb669572 [0,0,0,1,0,0|2,0,1]=4 2293 B12R2.2 c1ccc(B2OCCO2)nc1 Amb22490930 [0,0,0,1,0,0|2,0,1]=4 2294 B12R2.2 c1ccc(C2=NCCC2)cc1 Amb1106418 [0,0,0,1,0,0|2,0,0]=3 2295 B12R2.2 c1ccc(C2=NCCC2)nc1 Amb10606648 [0,0,0,1,0,0|3,0,0]=4 2296 B12R2.2 c1ccc(C2=NCCN2)cc1 Amb3940399 [0,0,0,1,0,0|2,0,0]=3 2297 B12R2.2 c1ccc(C2=NCCN2)nc1 Amb17836205 [0,0,0,1,0,0|3,0,0]=4 2298 B12R2.2 c1ccc(C2=NCCO2)cc1 Amb18063911 [0,0,0,1,0,0|1,0,0]=2 2299 B12R2.2 c1ccc(C2=NCCO2)nc1 Amb24100586 [0,0,0,1,0,0|2,0,0]=3 2300 B12R2.2 c1ccc(C2=NNCC2)cc1 Amb25354740 [0,0,0,1,0,0|3,0,0]=4 2301 B12R2.2 c1ccc(C2=NOCN2)cc1 Amb28120203 [0,0,0,1,0,0|3,0,0]=4 2302 B12R2.2 c1ccc(C2CCCC2)cc1 Amb9787161 [0,0,0,1,0,0|2,0,1]=4 2303 B12R2.2 c1ccc(C2CCCN2)cc1 Amb10808365 [0,0,0,1,0,0|2,0,1]=4 2304 B12R2.2 c1ccc(C2CCCN2)cc1 Amb9702996 [0,0,0,1,0,0|2,0,1]=4 2305 B12R2.2 c1ccc(C2CCCO2)cc1 Amb17334283 [0,0,0,1,0,0|1,0,1]=3 2306 B12R2.2 c1ccc(C2CCC[NH2+]2)cc1 Amb33512932 [0,0,0,1,0,0|2,0,1]=4 2307 B12R2.2 c1ccc(C2CNCO2)cc1 Amb18065307 [0,0,0,1,0,0|2,0,1]=4 2308 B12R2.2 c1ccc(C2NCCO2)cc1 Amb17334284 [0,0,0,1,0,0|1,0,1]=3 2309 B12R2.2 c1ccc(C2NCCO2)nc1 Amb17334298 [0,0,0,1,0,0|2,0,1]=4 2310 B12R2.2 c1ccc(C2NCCP2)cc1 Amb27606514 [0,0,0,1,0,0|2,0,1]=4 2311 B12R2.2 c1ccc(C2NCCS2)cc1 Amb3466213 [0,0,0,1,0,0|1,1,1]=4 2312 B12R2.2 c1ccc(C2OCCO2)cc1 Amb9786741 [0,0,0,1,0,0|0,0,2]=3 2313 B12R2.2 c1ccc(C2OCCO2)nc1 Amb17334307 [0,0,0,1,0,0|1,0,2]=4 2314 B12R2.2 c1ccc(C2SCCS2)cc1 Amb23401446 [0,0,0,1,0,0|0,2,1]=4 2315 B12R2.2 c1ccc(N2CCCC2)cc1 Amb8391946 [0,0,0,1,0,0|3,0,0]=4 2316 B12R2.2 c1ccc([C@@H]2CCCN2)cc1 Amb20241933 [0,0,0,1,0,0|2,0,1]=4 2317 B12R2.2 c1ccc([C@@H]2CCCN2)cc1 Amb8397178 [0,0,0,1,0,0|2,0,1]=4 2318 B12R2.2 c1ccc([C@H]2CCCN2)cc1 Amb20241932 [0,0,0,1,0,0|2,0,1]=4 2319 B12R2.2 c1ccc([C@H]2CCCN2)cc1 Amb8397179 [0,0,0,1,0,0|2,0,1]=4 2320 B12R2.2 c1cncc(C2=NCCC2)c1 Amb561332 [0,0,0,1,0,0|3,0,0]=4 2321 B12R2.2 c1cncc(C2=NCCN2)c1 Amb6751796 [0,0,0,1,0,0|3,0,0]=4 2322 B12R2.2 c1cncc(C2=NCCO2)c1 Amb10813641 [0,0,0,1,0,0|2,0,0]=3 2323 B12R2.2 c1cncc(C2NCCO2)c1 Amb17334299 [0,0,0,1,0,0|2,0,1]=4 2324 B12R2.2 c1cncc(C2OCCO2)c1 Amb17334308 [0,0,0,1,0,0|1,0,2]=4 2325 B12R2.27 CC[C@@H]1O[C@H]1c2ccccc2 Amb27768002 [0,0,0,1,0,0|1,0,2]=4 2326 B12R2.27 OCC1=C(c2ccccc2)N1 Amb28197190 [0,0,0,1,0,0|3,0,0]=4 2327 B12R2.27 OCC1N=C1c2ccccc2 Amb26560371 [0,0,0,1,0,0|3,0,0]=4 2328 B12R2.116 CC1(c2ccccc2)CCN1 Amb27263594 [0,0,0,1,0,0|2,0,1]=4 2329 B12R2.116 CC1(c2ccccc2)CCO1 Amb22497354 [0,0,0,1,0,0|1,0,1]=3 2330 B12R2.116 CC1(c2ccccn2)CCO1 Amb32642016 [0,0,0,1,0,0|2,0,1]=4 2331 B12R2.116 CC1(c2cccnc2)CCO1 Amb32642010 [0,0,0,1,0,0|2,0,1]=4 2332 B12R2.116 CC1(c2ccncc2)CCO1 Amb32642022 [0,0,0,1,0,0|2,0,1]=4 2333 B12R2.116 NC1(c2ccccc2)CCC1 Amb2371533 [0,0,0,1,0,0|2,0,1]=4 2334 B12R2.116 NC1(c2ccccc2)CCC1 Amb453192 [0,0,0,1,0,0|2,0,1]=4 2335 B12R2.116 OC1(c2ccccc2)CCC1 Amb33544160 [0,0,0,1,0,0|1,0,2]=4 2336 B12R2.235 CC1(c2ccccc2)OC1Cl Amb27776758 [0,0,0,1,0,0|2,0,1]=4 2337 B12R2.235 CC1OC1(O)c2ccccc2 Amb26510326 [0,0,0,1,0,0|0,0,2]=3 2338 B12R2.235 C[C@@]1(c2ccccc2)O[C@@H]1Cl Amb27195805 [0,0,0,1,0,0|2,0,1]=4 2339 B12R2.931 CCNC1Cc2ccccc21 Amb27840306 [0,0,0,1,0,0|2,0,1]=4 2340 B12R2.931 NCCC1=Cc2ccccc21 Amb27866978 [0,0,0,1,0,0|3,0,0]=4 2341 B12R2.931 OCCC1=Cc2ccccc21 Amb24414369 [0,0,0,1,0,0|3,0,0]=4 2342 B12R2.1081 BrC1=CCOc2ccccc21 Amb28385954 [0,0,0,1,0,0|3,0,0]=4 2343 B12R2.1081 BrC1CCCc2ccccc21 Amb8384413 [0,0,0,1,0,0|2,0,1]=4 2344 B12R2.1081 BrC1NCCc2ccccc21 Amb27176472 [0,0,0,1,0,0|2,0,1]=4 2345 B12R2.1081 BrC1OCCc2ccccc21 Amb23441457 [0,0,0,1,0,0|1,0,1]=3 2346 B12R2.1081 C=C1CCCc2ccccc21 Amb25736652 [0,0,0,1,0,0|2,0,0]=3 2347 B12R2.1081 C=C1CCCc2cccnc21 Amb33164017 [0,0,0,1,0,0|3,0,0]=4 2348 B12R2.1081 C=C1CCNc2ccccc21 Amb27596012 [0,0,0,1,0,0|3,0,0]=4 2349 B12R2.1081 C=C1CCOc2ccccc21 Amb26360090 [0,0,0,1,0,0|3,0,0]=4 2350 B12R2.1081 CC1=CCCc2ccccc21 Amb2439915 [0,0,0,1,0,0|2,0,0]=3 2351 B12R2.1081 CC1=CCOc2ccccc21 Amb25694360 [0,0,0,1,0,0|3,0,0]=4 2352 B12R2.1081 CC1=NCCc2ccccc21 Amb17940779 [0,0,0,1,0,0|2,0,0]=3 2353 B12R2.1081 CC1=NCCc2ccccc21 Amb33446974 [0,0,0,1,0,0|2,0,0]=3 2354 B12R2.1081 CC1=NCCc2ccccc21 Amb8517423 [0,0,0,1,0,0|2,0,0]=3 2355 B12R2.1081 CC1=NCCc2ncccc21 Amb22751775 [0,0,0,1,0,0|3,0,0]=4 2356 B12R2.1081 CC1CCCc2ccccc21 Amb22730060 [0,0,0,1,0,0|2,0,1]=4 2357 B12R2.1081 CC1NCCc2ccccc21 Amb19514854 [0,0,0,1,0,0|2,0,1]=4 2358 B12R2.1081 CC1NCCc2ccccc21 Amb5735598 [0,0,0,1,0,0|2,0,1]=4 2359 B12R2.1081 CC1OCNc2ccccc21 Amb28118766 [0,0,0,1,0,0|2,0,1]=4 2360 B12R2.1081 CN1CCCc2ccccc21 Amb15692645 [0,0,0,1,0,0|3,0,0]=4 2361 B12R2.1081 C[C@@H]1NCCc2ccccc21 Amb22751772 [0,0,0,1,0,0|2,0,1]=4 2362 B12R2.1081 C[C@H]1NCCc2ccccc21 Amb28186683 [0,0,0,1,0,0|2,0,1]=4 2363 B12R2.1081 ClC1=CCOc2ccccc21 Amb27194523 [0,0,0,1,0,0|3,0,0]=4 2364 B12R2.1081 ClC1CCCc2ccccc21 Amb9204490 [0,0,0,1,0,0|2,0,1]=4 2365 B12R2.1081 FC1=CCCc2ccccc21 Amb27482090 [0,0,0,1,0,0|2,0,0]=3 2366 B12R2.1081 IC1CCCc2ccccc21 Amb33714900 [0,0,0,1,0,0|2,0,1]=4 2367 B12R2.1081 NC1CCCc2ccccc21 Amb24273096 [0,0,0,1,0,0|2,0,1]=4 2368 B12R2.1081 NC1CCCc2ccccc21 Amb5716841 [0,0,0,1,0,0|2,0,1]=4 2369 B12R2.1081 NC1CCCc2ccccc21 Amb6334842 [0,0,0,1,0,0|2,0,1]=4 2370 B12R2.1081 NN1CCCc2ccccc21 Amb33172813 [0,0,0,1,0,0|3,0,0]=4 2371 B12R2.1081 NN1CCCc2ccccc21 Amb836811 [0,0,0,1,0,0|3,0,0]=4 2372 B12R2.1081 N[C@@H]1CCCc2ccccc21 Amb10844952 [0,0,0,1,0,0|2,0,1]=4 2373 B12R2.1081 N[C@H]1CCCc2ccccc21 Amb19929634 [0,0,0,1,0,0|2,0,1]=4 2374 B12R2.1081 N[C@H]1CCCc2ccccc21 Amb8383429 [0,0,0,1,0,0|2,0,1]=4 2375 B12R2.1081 O=C1C=CCc2ccccc21 Amb2388336 [0,0,0,1,0,0|1,0,1]=3 2376 B12R2.1081 O=C1C=CNc2ccccc21 Amb18369085 [0,0,0,1,0,0|2,0,1]=4 2377 B12R2.1081 O=C1C=COc2ccccc21 Amb19894749 [0,0,0,1,0,0|2,0,1]=4 2378 B12R2.1081 O=C1C=CSc2ccccc21 Amb22347337 [0,0,0,1,0,0|2,0,1]=4 2379 B12R2.1081 O=C1C=NNc2ccccc21 Amb18528334 [0,0,0,1,0,0|3,0,0]=4 2380 B12R2.1081 O=C1CC=Nc2ccccc21 Amb24062843 [0,0,0,1,0,0|2,0,1]=4 2381 B12R2.1081 O=C1CCC[n+]2ccccc21 Amb16191924 [0,0,0,1,0,0|2,0,0]=3 2382 B12R2.1081 O=C1CCC[n+]2ccccc21 Amb2613491 [0,0,0,1,0,0|2,0,0]=3 2383 B12R2.1081 O=C1CCCc2ccccc21 Amb534638 [0,0,0,1,0,0|1,0,0]=2 2384 B12R2.1081 O=C1CCCc2cccnc21 Amb8393834 [0,0,0,1,0,0|2,0,0]=3 2385 B12R2.1081 O=C1CCCc2ccncc21 Amb19888360 [0,0,0,1,0,0|2,0,0]=3 2386 B12R2.1081 O=C1CCCc2ccncc21 Amb22727966 [0,0,0,1,0,0|2,0,0]=3 2387 B12R2.1081 O=C1CCCc2cnccc21 Amb10603887 [0,0,0,1,0,0|2,0,0]=3 2388 B12R2.1081 O=C1CCCc2cnccc21 Amb20621086 [0,0,0,1,0,0|2,0,0]=3 2389 B12R2.1081 O=C1CCCc2ncccc21 Amb19515604 [0,0,0,1,0,0|2,0,0]=3 2390 B12R2.1081 O=C1CCCc2ncccc21 Amb2695282 [0,0,0,1,0,0|2,0,0]=3 2391 B12R2.1081 O=C1CCCc2nccnc21 Amb25152857 [0,0,0,1,0,0|3,0,0]=4 2392 B12R2.1081 O=C1CCCc2ncncc21 Amb21965046 [0,0,0,1,0,0|3,0,0]=4 2393 B12R2.1081 O=C1CCNc2ccccc21 Amb2699611 [0,0,0,1,0,0|2,0,0]=3 2394 B12R2.1081 O=C1CCNc2ccccc21 Amb33542509 [0,0,0,1,0,0|2,0,0]=3 2395 B12R2.1081 O=C1CCNc2cccnc21 Amb27954552 [0,0,0,1,0,0|3,0,0]=4 2396 B12R2.1081 O=C1CCNc2ncccc21 Amb16233465 [0,0,0,1,0,0|3,0,0]=4 2397 B12R2.1081 O=C1CCNc2ncccc21 Amb33532494 [0,0,0,1,0,0|3,0,0]=4 2398 B12R2.1081 O=C1CCOc2ccccc21 Amb1153759 [0,0,0,1,0,0|2,0,0]=3 2399 B12R2.1081 O=C1CCOc2cccnc21 Amb33544080 [0,0,0,1,0,0|3,0,0]=4 2400 B12R2.1081 O=C1CCOc2cnccc21 Amb33742663 [0,0,0,1,0,0|3,0,0]=4 2401 B12R2.1081 O=C1CCOc2ncccc21 Amb24061183 [0,0,0,1,0,0|3,0,0]=4 2402 B12R2.1081 O=C1CCSc2ccccc21 Amb1151631 [0,0,0,1,0,0|2,0,0]=3 2403 B12R2.1081 O=C1CCSc2ncccc21 Amb27267960 [0,0,0,1,0,0|3,0,0]=4 2404 B12R2.1081 O=C1CNCc2ccccc21 Amb22494722 [0,0,0,1,0,0|2,0,0]=3 2405 B12R2.1081 O=C1CNCc2ccccc21 Amb9783330 [0,0,0,1,0,0|2,0,0]=3 2406 B12R2.1081 O=C1CNCc2ncccc21 Amb18202251 [0,0,0,1,0,0|3,0,0]=4 2407 B12R2.1081 O=C1CNNc2ccccc21 Amb22057606 [0,0,0,1,0,0|3,0,0]=4 2408 B12R2.1081 O=C1CNNc2ccccc21 Amb22494235 [0,0,0,1,0,0|3,0,0]=4 2409 B12R2.1081 O=C1COCc2ccccc21 Amb10067824 [0,0,0,1,0,0|2,0,0]=3 2410 B12R2.1081 O=C1COCc2cccnc21 Amb27964992 [0,0,0,1,0,0|3,0,0]=4 2411 B12R2.1081 O=C1COCc2ncccc21 Amb25152848 [0,0,0,1,0,0|3,0,0]=4 2412 B12R2.1081 O=C1CSCc2ccccc21 Amb2733969 [0,0,0,1,0,0|2,0,0]=3 2413 B12R2.1081 O=C1CSCc2cnccc21 Amb27974060 [0,0,0,1,0,0|3,0,0]=4 2414 B12R2.1081 O=C1N=NNc2ccccc21 Amb19653630 [0,0,0,1,0,0|3,0,0]=4 2415 B12R2.1081 O=C1NC=Cc2ccccc21 Amb18364338 [0,0,0,1,0,0|1,0,2]=4 2416 B12R2.1081 O=C1NC=Nc2ccccc21 Amb18012662 [0,0,0,1,0,0|2,0,1]=4 2417 B12R2.1081 O=C1NCCc2ccccc21 Amb2502473 [0,0,0,1,0,0|1,0,0]=2 2418 B12R2.1081 O=C1NCCc2cccnc21 Amb22234340 [0,0,0,1,0,0|2,0,0]=3 2419 B12R2.1081 O=C1NCCc2ccncc21 Amb18202262 [0,0,0,1,0,0|2,0,0]=3 2420 B12R2.1081 O=C1NCCc2ccncc21 Amb35750745 [0,0,0,1,0,0|2,0,0]=3 2421 B12R2.1081 O=C1NCCc2ncccc21 Amb22002362 [0,0,0,1,0,0|2,0,0]=3 2422 B12R2.1081 O=C1NCCc2ncncc21 Amb28068894 [0,0,0,1,0,0|3,0,0]=4 2423 B12R2.1081 O=C1NCNc2ccncc21 Amb24419756 [0,0,0,1,0,0|3,0,0]=4 2424 B12R2.1081 O=C1NCSc2ccccc21 Amb27646438 [0,0,0,1,0,0|2,0,0]=3 2425 B12R2.1081 O=C1NN=Cc2ccccc21 Amb19338634 [0,0,0,1,0,0|2,0,1]=4 2426 B12R2.1081 O=C1NN=Nc2ccccc21 Amb17933278 [0,0,0,1,0,0|3,0,0]=4 2427 B12R2.1081 O=C1NNCc2ccccc21 Amb27215032 [0,0,0,1,0,0|2,0,0]=3 2428 B12R2.1081 O=C1NNCc2ccccc21 Amb33482996 [0,0,0,1,0,0|2,0,0]=3 2429 B12R2.1081 O=C1NNCc2ncccc21 Amb27823289 [0,0,0,1,0,0|3,0,0]=4 2430 B12R2.1081 O=C1NOCc2ccccc21 Amb26878656 [0,0,0,1,0,0|2,0,0]=3 2431 B12R2.1081 O=C1OC=Cc2ccccc21 Amb25189261 [0,0,0,1,0,0|0,0,2]=3 2432 B12R2.1081 O=C1OC=Cc2cccnc21 Amb19323216 [0,0,0,1,0,0|1,0,2]=4 2433 B12R2.1081 O=C1OC=Nc2ccccc21 Amb26019177 [0,0,0,1,0,0|1,0,1]=3 2434 B12R2.1081 O=C1OCCc2ccccc21 Amb16232507 [0,0,0,1,0,0|0,0,0]=1 2435 B12R2.1081 O=C1OCCc2ccncc21 Amb22372215 [0,0,0,1,0,0|1,0,0]=2 2436 B12R2.1081 O=C1OCCc2cnccc21 Amb27879707 [0,0,0,1,0,0|1,0,0]=2 2437 B12R2.1081 O=C1ON=Cc2ccccc21 Amb27628760 [0,0,0,1,0,0|1,0,1]=3 2438 B12R2.1081 O=C1SCCc2ccccc21 Amb24484481 [0,0,0,1,0,0|0,1,0]=2 2439 B12R2.1081 O=S1CCNc2ccccc21 Amb1106281 [0,0,0,1,0,0|3,0,0]=4 2440 B12R2.1081 O=S1CCOc2ccccc21 Amb33189180 [0,0,0,1,0,0|3,0,0]=4 2441 B12R2.1081 OB1OCCc2ccccc21 Amb10070693 [0,0,0,1,0,0|1,0,1]=3 2442 B12R2.1081 OC1=COCc2ccccc21 Amb10603427 [0,0,0,1,0,0|2,0,1]=4 2443 B12R2.1081 OC1CCCc2ccccc21 Amb9702810 [0,0,0,1,0,0|1,0,2]=4 2444 B12R2.1081 OC1OCCc2ccccc21 Amb27860258 [0,0,0,1,0,0|0,0,2]=3 2445 B12R2.1081 O[C@@H]1CCCc2ccccc21 Amb22337827 [0,0,0,1,0,0|1,0,2]=4 2446 B12R2.1081 O[C@H]1CCCc2ccccc21 Amb22336192 [0,0,0,1,0,0|1,0,2]=4 2447 B12R2.1081 S=C1NCCc2ccccc21 Amb2725056 [0,0,0,1,0,0|1,1,0]=3 2448 B12R2.1081 SC1CCCc2ccccc21 Amb9208036 [0,0,0,1,0,0|1,1,1]=4 2449 B12R2.1081 [NH3+]C1CCCc2ccccc21 Amb24113843 [0,0,0,1,0,0|2,0,1]=4 2450 B12R2.2028 C=C1NC(=O)c2ccccc21 Amb27487451 [0,0,0,1,0,0|1,0,2]=4 2451 B12R2.2028 C=C1OC(=O)c2ccccc21 Amb22229358 [0,0,0,1,0,0|0,0,2]=3 2452 B12R2.2028 CC1=CC(=O)c2ccccc21 Amb9783432 [0,0,0,1,0,0|1,0,1]=3 2453 B12R2.2028 CC1=CC(O)c2ccccc21 Amb17778893 [0,0,0,1,0,0|3,0,0]=4 2454 B12R2.2028 CC1C=C(Cl)c2ccccc21 Amb17778911 [0,0,0,1,0,0|2,0,0]=3 2455 B12R2.2028 CC1CC(=O)c2ccccc21 Amb9747864 [0,0,0,1,0,0|1,0,0]=2 2456 B12R2.2028 CC1CC(Cl)c2ccccc21 Amb27413208 [0,0,0,1,0,0|2,0,1]=4 2457 B12R2.2028 CC1CC(N)c2ccccc21 Amb19373084 [0,0,0,1,0,0|2,0,1]=4 2458 B12R2.2028 CC1CC(N)c2ccccc21 Amb6705561 [0,0,0,1,0,0|2,0,1]=4 2459 B12R2.2028 CC1CC(S)c2ccccc21 Amb24465175 [0,0,0,1,0,0|1,1,1]=4 2460 B12R2.2028 CC1CN(C)c2ccccc21 Amb5718018 [0,0,0,1,0,0|3,0,0]=4 2461 B12R2.2028 CC1NC(=O)c2ccccc21 Amb24104648 [0,0,0,1,0,0|1,0,0]=2 2462 B12R2.2028 CC1NC(=S)c2ccccc21 Amb27962483 [0,0,0,1,0,0|1,1,0]=3 2463 B12R2.2028 CC1NC(C)c2ccccc21 Amb20622620 [0,0,0,1,0,0|2,0,1]=4 2464 B12R2.2028 CC1NN(C)c2ccccc21 Amb27222813 [0,0,0,1,0,0|3,0,0]=4 2465 B12R2.2028 CC1OB(O)c2ccccc21 Amb25893330 [0,0,0,1,0,0|1,0,1]=3 2466 B12R2.2028 CC1OC(=O)c2cccnc21 Amb26847130 [0,0,0,1,0,0|1,0,0]=2 2467 B12R2.2028 CN1NC(=O)c2ccccc21 Amb22372319 [0,0,0,1,0,0|2,0,0]=3 2468 B12R2.2028 CN1NC(=O)c2cccnc21 Amb19314984 [0,0,0,1,0,0|3,0,0]=4 2469 B12R2.2028 CN1NC(=S)c2ccccc21 Amb26952885 [0,0,0,1,0,0|2,1,0]=4 2470 B12R2.2028 CN1SC(=O)c2ccccc21 Amb19664923 [0,0,0,1,0,0|1,1,0]=3 2471 B12R2.2028 C[C@@H]1CC(=O)c2ccccc21 Amb24467053 [0,0,0,1,0,0|1,0,0]=2 2472 B12R2.2028 C[C@@H]1C[C@@H](O)c2ccccc21 Amb27623223 [0,0,0,1,0,0|1,0,2]=4 2473 B12R2.2028 C[C@@H]1N[C@@H](C)c2ccccc21 Amb27788108 [0,0,0,1,0,0|2,0,1]=4 2474 B12R2.2028 C[C@@H]1N[C@@H](C)c2ccccc21 Amb35788409 [0,0,0,1,0,0|2,0,1]=4 2475 B12R2.2028 C[C@@H]1OC(=O)c2ccccc21 Amb25892505 [0,0,0,1,0,0|0,0,0]=1 2476 B12R2.2028 C[C@@H]1OC(O)c2ccccc21 Amb26648832 [0,0,0,1,0,0|0,0,2]=3 2477 B12R2.2028 C[C@H]1CC(=O)c2ccccc21 Amb25768595 [0,0,0,1,0,0|1,0,0]=2 2478 B12R2.2028 C[C@H]1O[C@@H](O)c2ccccc21 Amb28142292 [0,0,0,1,0,0|0,0,2]=3 2479 B12R2.2028 Cc1cn(C)c2ccccc12 Amb842585 [0,0,0,1,0,0|3,0,0]=4 2480 B12R2.2028 Cc1nn(C)c2ccccc12 Amb22491231 [0,0,0,1,0,0|3,0,0]=4 2481 B12R2.2028 Cc1oc(C)c2cnccc12 Amb24760345 [0,0,0,1,0,0|2,0,1]=4 2482 B12R2.2028 Cn1cc(Br)c2ccccc21 Amb9210485 [0,0,0,1,0,0|3,0,0]=4 2483 B12R2.2028 Cn1cc(Cl)c2ccccc21 Amb28066534 [0,0,0,1,0,0|3,0,0]=4 2484 B12R2.2028 Cn1cc(N)c2ccccc21 Amb18064415 [0,0,0,1,0,0|3,0,0]=4 2485 B12R2.2028 Cn1cc(N)c2ccccc21 Amb33620933 [0,0,0,1,0,0|3,0,0]=4 2486 B12R2.2028 Cn1cc(O)c2ccccc21 Amb24069283 [0,0,0,1,0,0|2,0,1]=4 2487 B12R2.2028 Cn1cc(S)c2ccccc21 Amb25721189 [0,0,0,1,0,0|2,1,0]=4 2488 B12R2.2028 Cn1nc(Br)c2ccccc21 Amb10604243 [0,0,0,1,0,0|3,0,0]=4 2489 B12R2.2028 Cn1nc(I)c2ccccc21 Amb10608014 [0,0,0,1,0,0|3,0,0]=4 2490 B12R2.2028 Cn1nc(N)c2ccccc21 Amb9677805 [0,0,0,1,0,0|3,0,0]=4 2491 B12R2.2028 N=C1NC(=O)c2ccccc21 Amb21811514 [0,0,0,1,0,0|2,0,1]=4 2492 B12R2.2028 NC1=NC(=O)c2ccccc21 Amb6252622 [0,0,0,1,0,0|2,0,1]=4 2493 B12R2.2028 NC1CC(=O)c2ccccc21 Amb17470381 [0,0,0,1,0,0|2,0,0]=3 2494 B12R2.2028 NC1CC(=O)c2ccccc21 Amb21955324 [0,0,0,1,0,0|2,0,0]=3 2495 B12R2.2028 NC1NC(=O)c2ccccc21 Amb22372261 [0,0,0,1,0,0|2,0,0]=3 2496 B12R2.2028 N[C@@H]1CC(=O)c2ccccc21 Amb27655630 [0,0,0,1,0,0|2,0,0]=3 2497 B12R2.2028 O=C1C=[N+]([O-])c2ccccc21 Amb17843025 [0,0,0,1,0,0|3,0,0]=4 2498 B12R2.2028 O=C1CC(=O)c2ccccc21 Amb1883008 [0,0,0,1,0,0|2,0,1]=4 2499 B12R2.2028 O=C1CC(Br)c2ccccc21 Amb10068269 [0,0,0,1,0,0|2,0,0]=3 2500 B12R2.2028 O=C1CC(Cl)c2ccccc21 Amb26945025 [0,0,0,1,0,0|2,0,0]=3 2501 B12R2.2028 O=C1CC(F)c2ccccc21 Amb26621970 [0,0,0,1,0,0|2,0,0]=3 2502 B12R2.2028 O=C1CC(I)c2ccccc21 Amb28289407 [0,0,0,1,0,0|2,0,0]=3 2503 B12R2.2028 O=C1CC(O)c2ccccc21 Amb27872121 [0,0,0,1,0,0|2,0,0]=3 2504 B12R2.2028 O=C1CC(O)c2cccnc21 Amb22750353 [0,0,0,1,0,0|3,0,0]=4 2505 B12R2.2028 O=C1NC(=O)c2ccccc21 Amb1934252 [0,0,0,1,0,0|2,0,1]=4 2506 B12R2.2028 O=C1NC(=O)c2ccccc21 Amb33868500 [0,0,0,1,0,0|2,0,1]=4 2507 B12R2.2028 O=C1NC(F)c2ccccc21 Amb27165216 [0,0,0,1,0,0|2,0,0]=3 2508 B12R2.2028 O=C1NC(O)c2ccccc21 Amb17593710 [0,0,0,1,0,0|2,0,0]=3 2509 B12R2.2028 O=C1OB(O)c2cccnc21 Amb25694435 [0,0,0,1,0,0|3,0,0]=4 2510 B12R2.2028 O=C1OC(=O)c2ccccc21 Amb17748796 [0,0,0,1,0,0|1,0,1]=3 2511 B12R2.2028 O=C1OC(=O)c2cnccc21 Amb2609992 [0,0,0,1,0,0|2,0,1]=4 2512 B12R2.2028 O=C1OC(=O)c2ncccc21 Amb1106402 [0,0,0,1,0,0|2,0,1]=4 2513 B12R2.2028 O=C1OC(Br)c2ccccc21 Amb2685476 [0,0,0,1,0,0|1,0,0]=2 2514 B12R2.2028 O=C1OC(Cl)c2ccccc21 Amb6297233 [0,0,0,1,0,0|1,0,0]=2 2515 B12R2.2028 O=C1OC(O)c2ccccc21 Amb10552913 [0,0,0,1,0,0|1,0,0]=2 2516 B12R2.2028 O=C1OC(O)c2ccccc21 Amb16226896 [0,0,0,1,0,0|1,0,0]=2 2517 B12R2.2028 O=C1OC(O)c2ccncc21 Amb28240212 [0,0,0,1,0,0|2,0,0]=3 2518 B12R2.2028 O=C1OC(O)c2cnccc21 Amb24426049 [0,0,0,1,0,0|2,0,0]=3 2519 B12R2.2028 O=C1OS(=O)c2ccccc21 Amb27755534 [0,0,0,1,0,0|2,0,0]=3 2520 B12R2.2028 O=C1O[IH2](Cl)c2ccccc21 Amb26012976 [0,0,0,1,0,0|2,0,0]=3 2521 B12R2.2028 O=C1O[IH2](O)c2ccccc21 Amb33548934 [0,0,0,1,0,0|2,0,0]=3 2522 B12R2.2028 O=C1SC(=O)c2ccccc21 Amb2610321 [0,0,0,1,0,0|1,1,1]=4 2523 B12R2.2028 O=C1SC(O)c2ccccc21 Amb28207229 [0,0,0,1,0,0|1,1,0]=3 2524 B12R2.2028 O=C1[N-]C(=O)c2ccccc21 Amb28990952 [0,0,0,1,0,0|2,0,1]=4 2525 B12R2.2028 O=C1[N-]C(=O)c2ccccc21 Amb6365847 [0,0,0,1,0,0|2,0,1]=4 2526 B12R2.2028 O=c1ns(=O)c2ccccc12 Amb4138643 [0,0,0,1,0,0|3,0,0]=4 2527 B12R2.2028 OB1OC(O)c2ccccc21 Amb27425186 [0,0,0,1,0,0|2,0,1]=4 2528 B12R2.2028 OC1NC(=S)c2ccccc21 Amb28198939 [0,0,0,1,0,0|2,1,0]=4 2529 B12R2.2028 OC1OC(O)c2ccccc21 Amb27455100 [0,0,0,1,0,0|1,0,2]=4 2530 B12R2.2047 CCN1C(=O)c2ccccc21 Amb27265881 [0,0,0,1,0,0|1,0,0]=2 2531 B12R2.2047 COC1C(=O)c2ccccc21 Amb28201023 [0,0,0,1,0,0|2,0,0]=3 2532 B12R2.2075 C=C(c1ccccc1)C2CC2 Amb27856321 [0,0,0,1,0,0|2,0,0]=3 2533 B12R2.2075 CN(c1ccccc1)C2CC2 Amb26509274 [0,0,0,1,0,0|3,0,0]=4 2534 B12R2.2075 NC(c1ccccc1)C2CC2 Amb2371625 [0,0,0,1,0,0|2,0,1]=4 2535 B12R2.2075 NC(c1ccccc1)C2CC2 Amb482312 [0,0,0,1,0,0|2,0,1]=4 2536 B12R2.2075 N[C@@H](c1ccccc1)C2CC2 Amb22406366 [0,0,0,1,0,0|2,0,1]=4 2537 B12R2.2075 N[C@@H](c1ccccc1)C2CC2 Amb26960416 [0,0,0,1,0,0|2,0,1]=4 2538 B12R2.2075 N[C@H](c1ccccc1)C2CC2 Amb22406367 [0,0,0,1,0,0|2,0,1]=4 2539 B12R2.2075 N[C@H](c1ccccc1)C2CC2 Amb22744981 [0,0,0,1,0,0|2,0,1]=4 2540 B12R2.2075 O=C(c1ccccc1)C2C=N2 Amb28122438 [0,0,0,1,0,0|2,0,1]=4 2541 B12R2.2075 O=C(c1ccccc1)C2CC2 Amb4115715 [0,0,0,1,0,0|1,0,0]=2 2542 B12R2.2075 O=C(c1ccccn1)C2CC2 Amb20248180 [0,0,0,1,0,0|2,0,0]=3 2543 B12R2.2075 O=C(c1ccccn1)N2CC2 Amb28127209 [0,0,0,1,0,0|2,0,0]=3 2544 B12R2.2075 O=C(c1cccnc1)C2CC2 Amb10607961 [0,0,0,1,0,0|2,0,0]=3 2545 B12R2.2075 O=C(c1ccncc1)C2CC2 Amb23454989 [0,0,0,1,0,0|2,0,0]=3 2546 B12R2.2075 O=C(c1ccncc1)N2CC2 Amb28045530 [0,0,0,1,0,0|2,0,0]=3 2547 B12R2.2075 O=C(c1cnccn1)N2CC2 Amb25848297 [0,0,0,1,0,0|3,0,0]=4 2548 B12R2.2075 O=C(c1ncccn1)C2CC2 Amb28069893 [0,0,0,1,0,0|3,0,0]=4 2549 B12R2.2075 OC(c1ccccc1)C2CC2 Amb33534747 [0,0,0,1,0,0|1,0,2]=4 2550 B12R2.2075 O[C@H](c1ccccc1)C2CC2 Amb27955379 [0,0,0,1,0,0|1,0,2]=4 2551 B12R2.2075 SC(c1ccccc1)C2CC2 Amb33537940 [0,0,0,1,0,0|1,1,1]=4 2552 B10R1.11 CC#CC(=O)c1cccs1 Amb27615141 [0,0,0,0,1,0|2,0,1]=4 2553 B10R1.11 CCCC(=O)c1ccco1 Amb4018004 [0,0,0,0,1,0|2,0,0]=3 2554 B10R1.11 CCCC(=O)c1cccs1 Amb2700563 [0,0,0,0,1,0|2,0,0]=3 2555 B10R1.11 CCCC(=O)c1ccsc1 Amb18791600 [0,0,0,0,1,0|2,0,0]=3 2556 B10R1.11 CCCC(=O)c1ccsn1 Amb27198650 [0,0,0,0,1,0|3,0,0]=4 2557 B10R1.11 CCCC(=O)c1cnsc1 Amb35716786 [0,0,0,0,1,0|3,0,0]=4 2558 B10R1.11 CCCC(=O)c1cscn1 Amb25731997 [0,0,0,0,1,0|3,0,0]=4 2559 B10R1.11 CCCC(=O)c1nccs1 Amb19649390 [0,0,0,0,1,0|3,0,0]=4 2560 B10R1.11 CCCC(=O)n1cccn1 Amb17789979 [0,0,0,0,1,0|3,0,0]=4 2561 B10R1.11 CCNC(=N)c1ccoc1 Amb27164307 [0,0,0,0,1,0|3,0,0]=4 2562 B10R1.11 CCNC(=O)c1ccoc1 Amb26967525 [0,0,0,0,1,0|2,0,0]=3 2563 B10R1.11 CCNC(=O)c1ccsc1 Amb24451235 [0,0,0,0,1,0|2,0,0]=3 2564 B10R1.11 CCNC(=O)c1cnoc1 Amb28205027 [0,0,0,0,1,0|3,0,0]=4 2565 B10R1.11 CCNC(=O)c1cscn1 Amb26961153 [0,0,0,0,1,0|3,0,0]=4 2566 B10R1.11 CCNC(=O)c1nccs1 Amb27777348 [0,0,0,0,1,0|3,0,0]=4 2567 B10R1.11 CCNC(=O)n1cccc1 Amb27265867 [0,0,0,0,1,0|2,0,0]=3 2568 B10R1.11 CCNC(=O)n1cccn1 Amb9828524 [0,0,0,0,1,0|3,0,0]=4 2569 B10R1.11 CCNC(=O)n1ccnc1 Amb7969955 [0,0,0,0,1,0|3,0,0]=4 2570 B10R1.11 CCOC(=N)c1ccco1 Amb27837592 [0,0,0,0,1,0|2,0,0]=3 2571 B10R1.11 CCOC(=N)c1cccs1 Amb18791658 [0,0,0,0,1,0|2,0,0]=3 2572 B10R1.11 CCOC(=N)c1cccs1 Amb20673166 [0,0,0,0,1,0|2,0,0]=3 2573 B10R1.11 CCOC(=N)c1ccns1 Amb35719677 [0,0,0,0,1,0|3,0,0]=4 2574 B10R1.11 CCOC(=N)c1cncs1 Amb27754661 [0,0,0,0,1,0|3,0,0]=4 2575 B10R1.11 CCOC(=N)c1cscn1 Amb28049597 [0,0,0,0,1,0|3,0,0]=4 2576 B10R1.11 CCOC(=O)C1=CCCO1 Amb26450430 [0,0,0,0,1,0|1,0,2]=4 2577 B10R1.11 CCOC(=O)C1=CCNC1 Amb28188895 [0,0,0,0,1,0|1,0,2]=4 2578 B10R1.11 CCOC(=O)C1=CNCC1 Amb28042507 [0,0,0,0,1,0|1,0,2]=4 2579 B10R1.11 CCOC(=O)C1=CNNN1 Amb28056989 [0,0,0,0,1,0|3,0,0]=4 2580 B10R1.11 CCOC(=O)C1=COCC1 Amb26369775 [0,0,0,0,1,0|1,0,2]=4 2581 B10R1.11 CCOC(=O)C1C=CCC1 Amb24356534 [0,0,0,0,1,0|0,0,3]=4 2582 B10R1.11 CCOC(=O)C1C=CCN1 Amb27863713 [0,0,0,0,1,0|1,0,2]=4 2583 B10R1.11 CCOC(=O)C1CC=CC1 Amb8385853 [0,0,0,0,1,0|0,0,3]=4 2584 B10R1.11 CCOC(=O)N1C=CCC1 Amb25144136 [0,0,0,0,1,0|1,0,2]=4 2585 B10R1.11 CCOC(=O)N1CC=CC1 Amb26432637 [0,0,0,0,1,0|1,0,2]=4 2586 B10R1.11 CCOC(=O)[C@H]1C=CCC1 Amb25103016 [0,0,0,0,1,0|0,0,3]=4 2587 B10R1.11 CCOC(=O)[C@H]1C=CCN1 Amb27244801 [0,0,0,0,1,0|1,0,2]=4 2588 B10R1.11 CCOC(=O)c1ccco1 Amb2725474 [0,0,0,0,1,0|1,0,0]=2 2589 B10R1.11 CCOC(=O)c1cccs1 Amb3940403 [0,0,0,0,1,0|1,0,0]=2 2590 B10R1.11 CCOC(=O)c1ccno1 Amb22000977 [0,0,0,0,1,0|2,0,0]=3 2591 B10R1.11 CCOC(=O)c1ccoc1 Amb2725527 [0,0,0,0,1,0|1,0,0]=2 2592 B10R1.11 CCOC(=O)c1ccon1 Amb19930075 [0,0,0,0,1,0|2,0,0]=3 2593 B10R1.11 CCOC(=O)c1ccsc1 Amb9273811 [0,0,0,0,1,0|1,0,0]=2 2594 B10R1.11 CCOC(=O)c1ccsn1 Amb27760364 [0,0,0,0,1,0|2,0,0]=3 2595 B10R1.11 CCOC(=O)c1cnco1 Amb10070742 [0,0,0,0,1,0|2,0,0]=3 2596 B10R1.11 CCOC(=O)c1cncs1 Amb10071288 [0,0,0,0,1,0|2,0,0]=3 2597 B10R1.11 CCOC(=O)c1cncs1 Amb33484290 [0,0,0,0,1,0|2,0,0]=3 2598 B10R1.11 CCOC(=O)c1cnns1 Amb2687944 [0,0,0,0,1,0|3,0,0]=4 2599 B10R1.11 CCOC(=O)c1cnoc1 Amb2447445 [0,0,0,0,1,0|2,0,0]=3 2600 B10R1.11 CCOC(=O)c1cnsc1 Amb27462894 [0,0,0,0,1,0|2,0,0]=3 2601 B10R1.11 CCOC(=O)c1cocn1 Amb6822838 [0,0,0,0,1,0|2,0,0]=3 2602 B10R1.11 CCOC(=O)c1cscn1 Amb1102588 [0,0,0,0,1,0|2,0,0]=3 2603 B10R1.11 CCOC(=O)c1cscn1 Amb22000945 [0,0,0,0,1,0|2,0,0]=3 2604 B10R1.11 CCOC(=O)c1csnn1 Amb1987227 [0,0,0,0,1,0|3,0,0]=4 2605 B10R1.11 CCOC(=O)c1ncco1 Amb19515922 [0,0,0,0,1,0|2,0,0]=3 2606 B10R1.11 CCOC(=O)c1nccs1 Amb6297669 [0,0,0,0,1,0|2,0,0]=3 2607 B10R1.11 CCOC(=O)c1ncns1 Amb22754133 [0,0,0,0,1,0|3,0,0]=4 2608 B10R1.11 CCOC(=O)c1ncon1 Amb2691286 [0,0,0,0,1,0|3,0,0]=4 2609 B10R1.11 CCOC(=O)c1nnco1 Amb25062996 [0,0,0,0,1,0|3,0,0]=4 2610 B10R1.11 CCOC(=O)c1nncs1 Amb22498943 [0,0,0,0,1,0|3,0,0]=4 2611 B10R1.11 CCOC(=O)n1cccc1 Amb17938697 [0,0,0,0,1,0|1,0,0]=2 2612 B10R1.11 CCOC(=O)n1ccnc1 Amb22492423 [0,0,0,0,1,0|2,0,0]=3 2613 B10R1.11 CCOC(=O)n1ccnn1 Amb24555011 [0,0,0,0,1,0|3,0,0]=4 2614 B10R1.11 CNCC(=O)c1ccco1 Amb21862170 [0,0,0,0,1,0|3,0,0]=4 2615 B10R1.11 CNCC(=O)c1cccs1 Amb17232156 [0,0,0,0,1,0|3,0,0]=4 2616 B10R1.11 CNCC(=O)c1ccoc1 Amb25369027 [0,0,0,0,1,0|3,0,0]=4 2617 B10R1.11 CNCC(=O)c1ccsc1 Amb24461147 [0,0,0,0,1,0|3,0,0]=4 2618 B10R1.11 COCC(=O)c1ccco1 Amb9665979 [0,0,0,0,1,0|3,0,0]=4 2619 B10R1.11 COCC(=O)c1ccoc1 Amb27832828 [0,0,0,0,1,0|3,0,0]=4 2620 B10R1.11 CSCC(=O)[c-]1cccc1 Amb27861421 [0,0,0,0,1,0|2,0,1]=4 2621 B10R1.11 CSCC(=O)c1ccco1 Amb18791728 [0,0,0,0,1,0|3,0,0]=4 2622 B10R1.11 CSCC(=O)c1cccs1 Amb18180366 [0,0,0,0,1,0|3,0,0]=4 2623 B10R1.11 NCCC(=O)c1ccco1 Amb18639567 [0,0,0,0,1,0|3,0,0]=4 2624 B10R1.11 NCCC(=O)c1cccs1 Amb17194466 [0,0,0,0,1,0|3,0,0]=4 2625 B10R1.11 NCCC(=O)c1ccoc1 Amb25142291 [0,0,0,0,1,0|3,0,0]=4 2626 B10R1.11 NCCC(=O)c1ccsc1 Amb26893339 [0,0,0,0,1,0|3,0,0]=4 2627 B10R1.11 O=C(CCBr)c1cccs1 Amb17437890 [0,0,0,0,1,0|3,0,0]=4 2628 B10R1.11 O=C(CCCl)C1=CC=CC1 Amb27645257 [0,0,0,0,1,0|2,0,1]=4 2629 B10R1.11 O=C(CCCl)c1ccco1 Amb17138476 [0,0,0,0,1,0|3,0,0]=4 2630 B10R1.11 O=C(CCCl)c1cccs1 Amb6306487 [0,0,0,0,1,0|3,0,0]=4 2631 B10R1.11 O=C(CCI)n1cccc1 Amb27945325 [0,0,0,0,1,0|3,0,0]=4 2632 B10R1.11 O=C(CCO)c1cccs1 Amb18563468 [0,0,0,0,1,0|3,0,0]=4 2633 B10R1.11 O=C(CCS)c1cccs1 Amb17400372 [0,0,0,0,1,0|3,0,0]=4 2634 B10R1.11 O=C(OCF)c1ccco1 Amb24553124 [0,0,0,0,1,0|2,0,0]=3 2635 B10R1.11 O=C(OCF)n1ccnc1 Amb26548301 [0,0,0,0,1,0|3,0,0]=4 2636 B12R1.32 C#CCC(=O)Nc1ccccc1 Amb27234818 [0,0,0,0,0,1|1,0,2]=4 2637 B12R1.32 C#CNC(=O)Nc1ccccc1 Amb27973353 [0,0,0,0,0,1|1,0,2]=4 2638 B12R1.32 C=C(CCN)Cc1ccccc1 Amb32953132 [0,0,0,0,0,1|3,0,0]=4 2639 B12R1.32 C=CCC(=O)Nc1ccccc1 Amb25123880 [0,0,0,0,0,1|1,0,2]=4 2640 B12R1.32 C=CNC(=O)Cc1ccccc1 Amb27455089 [0,0,0,0,0,1|1,0,2]=4 2641 B12R1.32 C=COC(=O)Cc1ccccc1 Amb17934203 [0,0,0,0,0,1|0,0,2]=3 2642 B12R1.32 C=COC(=S)Nc1ccccc1 Amb27969249 [0,0,0,0,0,1|0,1,2]=4 2643 B12R1.32 CC#CC(=O)Nc1ccccn1 Amb27652756 [0,0,0,0,0,1|2,0,1]=4 2644 B12R1.32 CC#CC(=O)Nc1cccnc1 Amb26376069 [0,0,0,0,0,1|2,0,1]=4 2645 B12R1.32 CC#CC(=O)Nc1ccncc1 Amb28363993 [0,0,0,0,0,1|2,0,1]=4 2646 B12R1.32 CCCC(=N)Nc1cccnc1 Amb27973325 [0,0,0,0,0,1|3,0,0]=4 2647 B12R1.32 CCCC(=O)Cc1ccccc1 Amb3940679 [0,0,0,0,0,1|1,0,0]=2 2648 B12R1.32 CCCC(=O)Nc1ccccc1 Amb5794989 [0,0,0,0,0,1|1,0,0]=2 2649 B12R1.32 CCCC(=O)Nc1ccccn1 Amb5794992 [0,0,0,0,0,1|2,0,0]=3 2650 B12R1.32 CCCC(=O)Nc1cccnn1 Amb27853046 [0,0,0,0,0,1|3,0,0]=4 2651 B12R1.32 CCCC(=O)Nc1ccncc1 Amb3367511 [0,0,0,0,0,1|2,0,0]=3 2652 B12R1.32 CCCC(=O)Nc1ncccn1 Amb3365878 [0,0,0,0,0,1|3,0,0]=4 2653 B12R1.32 CCCC(=O)Oc1ccccc1 Amb3103918 [0,0,0,0,0,1|1,0,0]=2 2654 B12R1.32 CCCC(C)Nc1ccccc1 Amb6685188 [0,0,0,0,0,1|2,0,1]=4 2655 B12R1.32 CCCC(N)Cc1ccccc1 Amb18180073 [0,0,0,0,0,1|2,0,1]=4 2656 B12R1.32 CCC\C(I)=C/c1ccccc1 Amb22546627 [0,0,0,0,0,1|2,0,0]=3 2657 B12R1.32 CCNC(=O)C[n+]1ccccc1 Amb26459720 [0,0,0,0,0,1|2,0,0]=3 2658 B12R1.32 CCNC(=O)Cc1cnccn1 Amb27652570 [0,0,0,0,0,1|3,0,0]=4 2659 B12R1.32 CCNC(=O)Nc1ccccc1 Amb1233665 [0,0,0,0,0,1|1,0,0]=2 2660 B12R1.32 CCNC(=O)Nc1ccccn1 Amb25240072 [0,0,0,0,0,1|2,0,0]=3 2661 B12R1.32 CCNC(=O)Nc1cccnc1 Amb13958674 [0,0,0,0,0,1|2,0,0]=3 2662 B12R1.32 CCNC(=O)Nc1ccncc1 Amb4012419 [0,0,0,0,0,1|2,0,0]=3 2663 B12R1.32 CCNC(=O)Oc1ccccc1 Amb2732291 [0,0,0,0,0,1|1,0,0]=2 2664 B12R1.32 CCNC(=S)Cc1ccccn1 Amb27592104 [0,0,0,0,0,1|2,1,0]=4 2665 B12R1.32 CCNC(=S)Nc1ccccc1 Amb2548953 [0,0,0,0,0,1|1,1,0]=3 2666 B12R1.32 CCNC(=S)Nc1cccnc1 Amb2977540 [0,0,0,0,0,1|2,1,0]=4 2667 B12R1.32 CCNC(=S)Oc1ccccc1 Amb28077021 [0,0,0,0,0,1|1,1,0]=3 2668 B12R1.32 CCNC(C)Cc1ccccc1 Amb18552940 [0,0,0,0,0,1|2,0,1]=4 2669 B12R1.32 CCOC(=N)Cc1ccccc1 Amb20673132 [0,0,0,0,0,1|1,0,0]=2 2670 B12R1.32 CCOC(=N)Cc1ccccc1 Amb2612454 [0,0,0,0,0,1|1,0,0]=2 2671 B12R1.32 CCOC(=N)Cc1ccccn1 Amb18792558 [0,0,0,0,0,1|2,0,0]=3 2672 B12R1.32 CCOC(=N)Cc1ccncc1 Amb18800815 [0,0,0,0,0,1|2,0,0]=3 2673 B12R1.32 CCOC(=O)C[n+]1ccccc1 Amb2794684 [0,0,0,0,0,1|1,0,0]=2 2674 B12R1.32 CCOC(=O)C[n+]1ccccc1 Amb3428028 [0,0,0,0,0,1|1,0,0]=2 2675 B12R1.32 CCOC(=O)C[n+]1ccccn1 Amb2613481 [0,0,0,0,0,1|2,0,0]=3 2676 B12R1.32 CCOC(=O)Cc1ccccc1 Amb3940130 [0,0,0,0,0,1|0,0,0]=1 2677 B12R1.32 CCOC(=O)Cc1ccccn1 Amb2724370 [0,0,0,0,0,1|1,0,0]=2 2678 B12R1.32 CCOC(=O)Cc1cccnc1 Amb6356440 [0,0,0,0,0,1|1,0,0]=2 2679 B12R1.32 CCOC(=O)Cc1cccnn1 Amb23440008 [0,0,0,0,0,1|2,0,0]=3 2680 B12R1.32 CCOC(=O)Cc1ccncc1 Amb20621993 [0,0,0,0,0,1|1,0,0]=2 2681 B12R1.32 CCOC(=O)Cc1ccncc1 Amb6357492 [0,0,0,0,0,1|1,0,0]=2 2682 B12R1.32 CCOC(=O)Cc1ccncn1 Amb22001936 [0,0,0,0,0,1|2,0,0]=3 2683 B12R1.32 CCOC(=O)Cc1cnccn1 Amb23399648 [0,0,0,0,0,1|2,0,0]=3 2684 B12R1.32 CCOC(=O)Cc1cncnc1 Amb18801018 [0,0,0,0,0,1|2,0,0]=3 2685 B12R1.32 CCOC(=O)Cc1ncccn1 Amb17935863 [0,0,0,0,0,1|2,0,0]=3 2686 B12R1.32 CCOC(=O)Nc1ccccc1 Amb3101817 [0,0,0,0,0,1|0,0,0]=1 2687 B12R1.32 CCOC(=O)Nc1ccccn1 Amb2609641 [0,0,0,0,0,1|1,0,0]=2 2688 B12R1.32 CCOC(=O)Nc1cccnc1 Amb6892831 [0,0,0,0,0,1|1,0,0]=2 2689 B12R1.32 CCOC(=O)Nc1ccncc1 Amb2692772 [0,0,0,0,0,1|1,0,0]=2 2690 B12R1.32 CCOC(=O)Nc1ccncn1 Amb17602618 [0,0,0,0,0,1|2,0,0]=3 2691 B12R1.32 CCOC(=O)Nc1cnccn1 Amb35663211 [0,0,0,0,0,1|2,0,0]=3 2692 B12R1.32 CCOC(=O)Nc1ncccn1 Amb17862869 [0,0,0,0,0,1|2,0,0]=3 2693 B12R1.32 CCOC(=O)Nc1nccnn1 Amb35684552 [0,0,0,0,0,1|3,0,0]=4 2694 B12R1.32 CCOC(=S)Nc1ccccc1 Amb4017698 [0,0,0,0,0,1|0,1,0]=2 2695 B12R1.32 CCO\C(C)=N\c1ccccc1 Amb17939699 [0,0,0,0,0,1|1,0,0]=2 2696 B12R1.32 CCSC(=N)Nc1ccccc1 Amb4013333 [0,0,0,0,0,1|1,1,0]=3 2697 B12R1.32 CCSC(=N)Nc1cccnc1 Amb27752086 [0,0,0,0,0,1|2,1,0]=4 2698 B12R1.32 CCSC(=O)Nc1ccccc1 Amb24310273 [0,0,0,0,0,1|0,1,0]=2 2699 B12R1.32 CCSC(=O)Nc1ncccn1 Amb28366550 [0,0,0,0,0,1|2,1,0]=4 2700 B12R1.32 CCSC(=S)Nc1ccccc1 Amb24757680 [0,0,0,0,0,1|0,2,0]=3 2701 B12R1.32 CCS\C(N)=N\c1ccccc1 Amb11230603 [0,0,0,0,0,1|1,1,0]=3 2702 B12R1.32 CCS\C(N)=N\c1ccccc1 Amb3432767 [0,0,0,0,0,1|1,1,0]=3 2703 B12R1.32 CC\N=C(\C)Nc1ccccn1 Amb28076928 [0,0,0,0,0,1|3,0,0]=4 2704 B12R1.32 CC\N=C(\N)Cc1ccccc1 Amb23569052 [0,0,0,0,0,1|2,0,0]=3 2705 B12R1.32 CC\N=C(\N)Nc1ccccn1 Amb28204806 [0,0,0,0,0,1|3,0,0]=4 2706 B12R1.32 CC\N=C(\N)Oc1ccccc1 Amb25935972 [0,0,0,0,0,1|2,0,0]=3 2707 B12R1.32 CNCC(=O)Cc1ccccc1 Amb32954289 [0,0,0,0,0,1|2,0,0]=3 2708 B12R1.32 CNCC(=O)Cc1ccccc1 Amb8628392 [0,0,0,0,0,1|2,0,0]=3 2709 B12R1.32 CNCC(=O)Nc1ccccc1 Amb6246115 [0,0,0,0,0,1|2,0,0]=3 2710 B12R1.32 CNCC(=O)Nc1ccccc1 Amb6893116 [0,0,0,0,0,1|2,0,0]=3 2711 B12R1.32 CNCC(=O)Nc1cccnc1 Amb15740831 [0,0,0,0,0,1|3,0,0]=4 2712 B12R1.32 CNCC(=O)Nc1cccnc1 Amb6263744 [0,0,0,0,0,1|3,0,0]=4 2713 B12R1.32 CNC\C(C)=C\c1ccccc1 Amb17100030 [0,0,0,0,0,1|3,0,0]=4 2714 B12R1.32 CNNC(=O)Nc1ccccc1 Amb28252417 [0,0,0,0,0,1|2,0,0]=3 2715 B12R1.32 COCC(=O)Cc1ccccc1 Amb9665963 [0,0,0,0,0,1|2,0,0]=3 2716 B12R1.32 COCC(=O)Nc1ccccc1 Amb3115714 [0,0,0,0,0,1|2,0,0]=3 2717 B12R1.32 COCC(=O)Nc1ccncc1 Amb1832638 [0,0,0,0,0,1|3,0,0]=4 2718 B12R1.32 CONC(=N)Nc1ccccc1 Amb27395144 [0,0,0,0,0,1|3,0,0]=4 2719 B12R1.32 CONC(=O)Cc1ccccc1 Amb16969924 [0,0,0,0,0,1|2,0,0]=3 2720 B12R1.32 CONC(=O)Cc1cccnc1 Amb27180010 [0,0,0,0,0,1|3,0,0]=4 2721 B12R1.32 CONC(=O)Cc1ccncc1 Amb27969875 [0,0,0,0,0,1|3,0,0]=4 2722 B12R1.32 CONC(=O)Nc1ccccn1 Amb27649985 [0,0,0,0,0,1|3,0,0]=4 2723 B12R1.32 CONC(=O)Nc1ccncc1 Amb28185717 [0,0,0,0,0,1|3,0,0]=4 2724 B12R1.32 CO\N=C(\N)Cc1ccccc1 Amb27827154 [0,0,0,0,0,1|3,0,0]=4 2725 B12R1.32 CSCC(=O)Cc1ccccc1 Amb18796330 [0,0,0,0,0,1|2,0,0]=3 2726 B12R1.32 CSCC(=O)Nc1ccccc1 Amb2373904 [0,0,0,0,0,1|2,0,0]=3 2727 B12R1.32 CSCC(=O)Nc1cccnc1 Amb13957856 [0,0,0,0,0,1|3,0,0]=4 2728 B12R1.32 CSCC(=O)Nc1ccncc1 Amb27255972 [0,0,0,0,0,1|3,0,0]=4 2729 B12R1.32 C\C(=C/c1ccccc1)CCBr Amb18063581 [0,0,0,0,0,1|3,0,0]=4 2730 B12R1.32 C\C(=C/c1ccccc1)CCN Amb18063553 [0,0,0,0,0,1|3,0,0]=4 2731 B12R1.32 C\C(=C/c1ccccc1)CCO Amb27792195 [0,0,0,0,0,1|3,0,0]=4 2732 B12R1.32 C\C(=C/c1ccccc1)CCS Amb33381247 [0,0,0,0,0,1|3,0,0]=4 2733 B12R1.32 C\C(=C\CO)Cc1ccccc1 Amb27852825 [0,0,0,0,0,1|3,0,0]=4 2734 B12R1.32 C\C(=C\c1ccccc1)CCBr Amb27445443 [0,0,0,0,0,1|3,0,0]=4 2735 B12R1.32 C\C(=C\c1ccccc1)CCN Amb27843446 [0,0,0,0,0,1|3,0,0]=4 2736 B12R1.32 C\C=C\C(=O)Cc1ccccn1 Amb27190935 [0,0,0,0,0,1|2,0,1]=4 2737 B12R1.32 C\C=C\C(=O)Cc1ccncc1 Amb28063108 [0,0,0,0,0,1|2,0,1]=4 2738 B12R1.32 C\C=C\C(=O)Nc1ccccc1 Amb31280308 [0,0,0,0,0,1|1,0,1]=3 2739 B12R1.32 C\C=C\C(=O)Nc1cccnc1 Amb27766723 [0,0,0,0,0,1|2,0,1]=4 2740 B12R1.32 C\C=C\C(=O)Nc1ccncc1 Amb27858099 [0,0,0,0,0,1|2,0,1]=4 2741 B12R1.32 C\C=C\C(=O)Oc1ccccc1 Amb27857446 [0,0,0,0,0,1|1,0,1]=3 2742 B12R1.32 C\C=C\C(=S)Nc1ccccc1 Amb28285588 [0,0,0,0,0,1|1,1,1]=4 2743 B12R1.32 N#CCC(=O)Cc1ccccc1 Amb17232286 [0,0,0,0,0,1|2,0,1]=4 2744 B12R1.32 N#CCC(=O)Nc1ccccc1 Amb1634628 [0,0,0,0,0,1|2,0,1]=4 2745 B12R1.32 N#CCC(=O)Oc1ccccc1 Amb18645449 [0,0,0,0,0,1|2,0,1]=4 2746 B12R1.32 N#CNC(=O)Nc1ccccc1 Amb17939016 [0,0,0,0,0,1|2,0,1]=4 2747 B12R1.32 N#CNC(=O)Oc1ccccc1 Amb27215212 [0,0,0,0,0,1|2,0,1]=4 2748 B12R1.32 NCCC(=O)Cc1ccccc1 Amb32954715 [0,0,0,0,0,1|2,0,0]=3 2749 B12R1.32 NCCC(=O)Nc1ccccc1 Amb1125528 [0,0,0,0,0,1|2,0,0]=3 2750 B12R1.32 NCCC(=O)Nc1ccccc1 Amb15740909 [0,0,0,0,0,1|2,0,0]=3 2751 B12R1.32 NCCC(=O)Nc1ccccn1 Amb1124759 [0,0,0,0,0,1|3,0,0]=4 2752 B12R1.32 NCCC(=O)Nc1ccccn1 Amb7969782 [0,0,0,0,0,1|3,0,0]=4 2753 B12R1.32 NCCC(=O)Nc1cccnc1 Amb1141841 [0,0,0,0,0,1|3,0,0]=4 2754 B12R1.32 NCCC(=O)Nc1cccnc1 Amb13952219 [0,0,0,0,0,1|3,0,0]=4 2755 B12R1.32 NCCC(=O)Nc1ccncc1 Amb1126146 [0,0,0,0,0,1|3,0,0]=4 2756 B12R1.32 NCCC(=O)Nc1ccncc1 Amb13952138 [0,0,0,0,0,1|3,0,0]=4 2757 B12R1.32 NCCC(=O)Nc1ccncc1 Amb13952153 [0,0,0,0,0,1|3,0,0]=4 2758 B12R1.32 NCCC(=O)Oc1ccccc1 Amb17334633 [0,0,0,0,0,1|2,0,0]=3 2759 B12R1.32 NCCC(=S)Nc1ccccc1 Amb27491751 [0,0,0,0,0,1|2,1,0]=4 2760 B12R1.32 NCCS(=O)Cc1ccccc1 Amb18306046 [0,0,0,0,0,1|3,0,0]=4 2761 B12R1.32 NCC\C(Br)=C\c1ccccc1 Amb27770057 [0,0,0,0,0,1|3,0,0]=4 2762 B12R1.32 NCC\C(Cl)=C/c1ccccc1 Amb27881313 [0,0,0,0,0,1|3,0,0]=4 2763 B12R1.32 NCC\C(Cl)=C\c1ccccc1 Amb27843483 [0,0,0,0,0,1|3,0,0]=4 2764 B12R1.32 NCOC(=O)Nc1ccccc1 Amb27407731 [0,0,0,0,0,1|1,0,0]=2 2765 B12R1.32 NNCC(=O)Nc1ccccc1 Amb26632802 [0,0,0,0,0,1|3,0,0]=4 2766 B12R1.32 NOCC(=O)Oc1ccccc1 Amb24096859 [0,0,0,0,0,1|3,0,0]=4 2767 B12R1.32 O=C(CCBr)Nc1ccccc1 Amb16191990 [0,0,0,0,0,1|2,0,0]=3 2768 B12R1.32 O=C(CCBr)Nc1ccccn1 Amb17324145 [0,0,0,0,0,1|3,0,0]=4 2769 B12R1.32 O=C(CCCl)Nc1ccccc1 Amb6458951 [0,0,0,0,0,1|2,0,0]=3 2770 B12R1.32 O=C(CCCl)Nc1ccccn1 Amb1141371 [0,0,0,0,0,1|3,0,0]=4 2771 B12R1.32 O=C(CCCl)Nc1cccnc1 Amb1133566 [0,0,0,0,0,1|3,0,0]=4 2772 B12R1.32 O=C(CCCl)Nc1cccnc1 Amb22587747 [0,0,0,0,0,1|3,0,0]=4 2773 B12R1.32 O=C(CCCl)Nc1ccncc1 Amb1128057 [0,0,0,0,0,1|3,0,0]=4 2774 B12R1.32 O=C(CCCl)Oc1ccccc1 Amb16230794 [0,0,0,0,0,1|2,0,0]=3 2775 B12R1.32 O=C(CCO)Nc1ccccc1 Amb9421562 [0,0,0,0,0,1|2,0,0]=3 2776 B12R1.32 O=C(CCS)Nc1ccccc1 Amb17305724 [0,0,0,0,0,1|2,0,0]=3 2777 B12R1.32 O=C(CCS)Nc1cccnc1 Amb28044196 [0,0,0,0,0,1|3,0,0]=4 2778 B12R1.32 O=C(Cc1ccccc1)N=C=S Amb9375570 [0,0,0,0,0,1|2,0,1]=4 2779 B12R1.32 O=C(Cc1ccccc1)NCO Amb2720941 [0,0,0,0,0,1|2,0,0]=3 2780 B12R1.32 O=C(N=C=S)Oc1ccccc1 Amb8396451 [0,0,0,0,0,1|2,0,1]=4 2781 B12R1.32 O=C(Nc1ccccc1)OCCl Amb28436871 [0,0,0,0,0,1|1,0,0]=2 2782 B12R1.32 O=C(Nc1ccccn1)OCCl Amb35645061 [0,0,0,0,0,1|2,0,0]=3 2783 B12R1.32 O=C(Nc1cccnc1)OCCl Amb35645060 [0,0,0,0,0,1|2,0,0]=3 2784 B12R1.32 O=C(Nc1cccnn1)OCCl Amb35645066 [0,0,0,0,0,1|3,0,0]=4 2785 B12R1.32 O=C(Nc1ccncc1)OCCl Amb35645063 [0,0,0,0,0,1|2,0,0]=3 2786 B12R1.32 O=C(Nc1cnccn1)OCCl Amb35645067 [0,0,0,0,0,1|3,0,0]=4 2787 B12R1.32 O=C(Nc1cncnc1)OCCl Amb35645065 [0,0,0,0,0,1|3,0,0]=4 2788 B12R1.32 O=C(Nc1ncccn1)OCCl Amb35645068 [0,0,0,0,0,1|3,0,0]=4 2789 B12R1.32 O=C(\C=C\Cl)Nc1ccccc1 Amb28342211 [0,0,0,0,0,1|2,0,1]=4 2790 B12R1.32 O=C(\C=C\F)Nc1ccccc1 Amb24386157 [0,0,0,0,0,1|2,0,1]=4 2791 B12R1.32 O=C(\C=N\O)Nc1ccccc1 Amb1205570 [0,0,0,0,0,1|3,0,0]=4 2792 B12R1.32 O=C=NC(=O)Cc1ccccc1 Amb17232352 [0,0,0,0,0,1|2,0,1]=4 2793 B12R1.32 O=C=NC(=O)Oc1ccccc1 Amb22348017 [0,0,0,0,0,1|2,0,1]=4 2794 B12R1.32 O=CNC(=O)Cc1ccccc1 Amb6360720 [0,0,0,0,0,1|2,0,1]=4 2795 B12R1.32 O=S(CCCl)Nc1ccccc1 Amb27607773 [0,0,0,0,0,1|3,0,0]=4 2796 B12R1.32 OCNC(=S)Cc1ccccc1 Amb27438465 [0,0,0,0,0,1|2,1,0]=4 2797 B12R1.32 OC\C=C(\Cl)Cc1ccccc1 Amb27841976 [0,0,0,0,0,1|3,0,0]=4 2798 B12R1.32 [N-]=[N+]=CC(=O)Cc1ccccc1 Amb749121 [0,0,0,0,0,1|3,0,0]=4 2799 B12R1.32 [N-]=[N+]=NC(=O)Cc1ccccc1 Amb26637629 [0,0,0,0,0,1|3,0,0]=4 2800 B12R1.1564 CCNC(=O)C1C=CC=CC=C1 Amb27258578 [0,0,0,0,0,1|1,0,1]=3 2801 B12R1.1564 CCOC(=O)C1C=CC=CC=C1 Amb25348912 [0,0,0,0,0,1|0,0,1]=2 2802 B12R1.1564 CCOC(=O)N1C=CC=CC=C1 Amb27491662 [0,0,0,0,0,1|1,0,0]=2 2803 B9R0.5 C=C\C=C\CC(=O)OCC Amb32676427 [1,0,1,0,0,0|0,0,1]=3 2804 B9R0.5 C=C\C=C\NC(=O)OCC Amb27226165 [1,0,1,0,0,0|1,0,0]=3 2805 B9R0.5 CCOC(=O)O\C=C\C=O Amb25367363 [1,0,1,0,0,0|2,0,0]=4 2806 B9R0.5 CCOC(=O)\C=C\C=C\Br Amb10066940 [1,0,1,0,0,0|1,0,0]=3 2807 B9R0.5 CCOC(=O)\C=C\CC=O Amb26587773 [1,0,1,0,0,0|1,0,1]=4 2808 B9R0.5 C\C=C\C=C\C(=O)CCC Amb27800019 [1,0,1,0,0,0|1,0,1]=4 2809 B9R0.5 C\C=C\C=C\C(=O)NCC Amb28367204 [1,0,1,0,0,0|1,0,1]=4 2810 B9R0.5 C\C=C\C=C\C(=O)OCC Amb6297204 [1,0,1,0,0,0|0,0,1]=3 2811 B9R0.45 CC\C=C/C=C\C=C\C=O Amb27223181 [1,0,1,0,0,0|2,0,0]=4 2812 B9R0.45 CC\C=C\C=C/C=C/C=O Amb27244697 [1,0,1,0,0,0|2,0,0]=4 2813 B9R0.45 CC\C=C\C=C\C=C\C=O Amb28458226 [1,0,1,0,0,0|2,0,0]=4 2814 B9R0.45 C\C=C\C=C/C=C/CCC Amb22641677 [1,0,1,0,0,0|1,0,1]=4 2815 B9R0.46 C=C\C=C\CCC(=O)OC Amb10605293 [1,0,1,0,0,0|0,0,2]=4 2816 B9R0.46 COC(=O)\C=C\C=C\C=O Amb18643494 [1,0,1,0,0,0|1,0,0]=3 2817 B9R0.46 COC(=O)\C=C\C=C\CBr Amb27801010 [1,0,1,0,0,0|1,0,1]=4 2818 B9R0.46 COC(=O)\C=C\C=C\CCl Amb27204912 [1,0,1,0,0,0|1,0,1]=4 2819 B9R0.46 C\C=C\C\C=C\C(=O)OC Amb27422431 [1,0,1,0,0,0|0,0,2]=4 2820 B9R0.8 C=C\C=C/[C@H](C)C(=O)CC Amb28049881 [1,0,1,0,0,0|0,0,2]=4 2821 B9R0.8 C\C=C\C=C(/C)C(=O)CC Amb28253877 [1,0,1,0,0,0|0,0,2]=4 2822 B9R0.35 C=CCC(=C)C(=O)OCC Amb27636063 [1,0,1,0,0,0|0,0,1]=3 2823 B9R0.35 CCOC(=O)\C(C)=C/C=O Amb19516315 [1,0,1,0,0,0|1,0,1]=4 2824 B9R0.35 CCOC(=O)\C(F)=C/C=O Amb28074735 [1,0,1,0,0,0|2,0,0]=4 2825 B9R0.37 C=CC(C=O)C(=O)OCC Amb28435957 [1,0,1,0,0,0|1,0,1]=4 2826 B9R1.6 C=C(Br)c1ccccc1 Amb8516473 [2,0,0,0,0,0|1,0,1]=4 2827 B9R1.6 C=C(C)c1ccccc1 Amb8394996 [2,0,0,0,0,0|1,0,0]=3 2828 B9R1.6 C=C(C)c1ccccn1 Amb25077592 [2,0,0,0,0,0|2,0,0]=4 2829 B9R1.6 C=C(C)c1cccnc1 Amb26389581 [2,0,0,0,0,0|2,0,0]=4 2830 B9R1.6 C=C(C)c1ccncc1 Amb25126374 [2,0,0,0,0,0|2,0,0]=4 2831 B9R1.6 C=C(Cl)c1ccccc1 Amb27775278 [2,0,0,0,0,0|1,0,1]=4 2832 B9R1.6 C=C(F)c1ccccc1 Amb22738583 [2,0,0,0,0,0|1,0,1]=4 2833 B9R1.6 CC(=N)c1cccnc1 Amb22170296 [2,0,0,0,0,0|2,0,0]=4 2834 B9R1.6 CC(=O)C1C=CC=CN1 Amb27849933 [2,0,0,0,0,0|1,0,1]=4 2835 B9R1.6 CC(=O)c1ccccc1 Amb2792761 [2,0,0,0,0,0|0,0,0]=2 2836 B9R1.6 CC(=O)c1ccccn1 Amb932786 [2,0,0,0,0,0|1,0,0]=3 2837 B9R1.6 CC(=O)c1cccnc1 Amb2610530 [2,0,0,0,0,0|1,0,0]=3 2838 B9R1.6 CC(=O)c1cccnn1 Amb20242017 [2,0,0,0,0,0|2,0,0]=4 2839 B9R1.6 CC(=O)c1ccncc1 Amb2792762 [2,0,0,0,0,0|1,0,0]=3 2840 B9R1.6 CC(=O)c1ccncn1 Amb19959228 [2,0,0,0,0,0|2,0,0]=4 2841 B9R1.6 CC(=O)c1ccnnc1 Amb19958070 [2,0,0,0,0,0|2,0,0]=4 2842 B9R1.6 CC(=O)c1cnccn1 Amb2684281 [2,0,0,0,0,0|2,0,0]=4 2843 B9R1.6 CC(=O)c1cncnc1 Amb8631038 [2,0,0,0,0,0|2,0,0]=4 2844 B9R1.6 CC(=O)c1ncccn1 Amb33534997 [2,0,0,0,0,0|2,0,0]=4 2845 B9R1.6 CC(Br)c1ccccc1 Amb5716854 [2,0,0,0,0,0|1,0,1]=4 2846 B9R1.6 CC(C)c1ccccc1 Amb2793016 [2,0,0,0,0,0|1,0,1]=4 2847 B9R1.6 CC(C)c1ccccc1 Amb33524021 [2,0,0,0,0,0|1,0,1]=4 2848 B9R1.6 CC(Cl)c1ccccc1 Amb5716855 [2,0,0,0,0,0|1,0,1]=4 2849 B9R1.6 CC(N)c1ccccc1 Amb5716844 [2,0,0,0,0,0|1,0,1]=4 2850 B9R1.6 CC(O)c1ccccc1 Amb3940114 [2,0,0,0,0,0|0,0,2]=4 2851 B9R1.6 CC(S)c1ccccc1 Amb6256013 [2,0,0,0,0,0|0,1,1]=4 2852 B9R1.6 CN(C)c1ccccc1 Amb2793014 [2,0,0,0,0,0|2,0,0]=4 2853 B9R1.6 CN(N)c1ccccc1 Amb1153615 [2,0,0,0,0,0|2,0,0]=4 2854 B9R1.6 CN(N)c1ccccc1 Amb22754142 [2,0,0,0,0,0|2,0,0]=4 2855 B9R1.6 CN(N)c1ccccc1 Amb33172726 [2,0,0,0,0,0|2,0,0]=4 2856 B9R1.6 CN(N)c1ccccc1 Amb9677307 [2,0,0,0,0,0|2,0,0]=4 2857 B9R1.6 CN(O)c1ccccc1 Amb28245898 [2,0,0,0,0,0|1,0,1]=4 2858 B9R1.6 CP(Cl)c1ccccc1 Amb25837553 [2,0,0,0,0,0|2,0,0]=4 2859 B9R1.6 CS(=O)c1ccccc1 Amb8516154 [2,0,0,0,0,0|1,0,0]=3 2860 B9R1.6 CS(=O)c1ccccn1 Amb24562247 [2,0,0,0,0,0|2,0,0]=4 2861 B9R1.6 C[C@@H](Br)c1ccccc1 Amb25055693 [2,0,0,0,0,0|1,0,1]=4 2862 B9R1.6 C[C@@H](N)c1ccccc1 Amb22168000 [2,0,0,0,0,0|1,0,1]=4 2863 B9R1.6 C[C@@H](N)c1ccccc1 Amb3940166 [2,0,0,0,0,0|1,0,1]=4 2864 B9R1.6 C[C@@H](O)c1ccccc1 Amb6366772 [2,0,0,0,0,0|0,0,2]=4 2865 B9R1.6 C[C@@H](S)c1ccccc1 Amb28069838 [2,0,0,0,0,0|0,1,1]=4 2866 B9R1.6 C[C@H](N)c1ccccc1 Amb2725550 [2,0,0,0,0,0|1,0,1]=4 2867 B9R1.6 C[C@H](O)c1ccccc1 Amb4021849 [2,0,0,0,0,0|0,0,2]=4 2868 B9R1.6 C[C@H](S)c1ccccc1 Amb25935694 [2,0,0,0,0,0|0,1,1]=4 2869 B9R1.6 C[S+](C)c1ccccc1 Amb27958149 [2,0,0,0,0,0|2,0,0]=4 2870 B9R1.6 C[Si](C)c1ccccc1 Amb33781101 [2,0,0,0,0,0|1,1,0]=4 2871 B9R1.6 N=C(Cl)c1ccccc1 Amb28285285 [2,0,0,0,0,0|2,0,0]=4 2872 B9R1.6 N=C(N)c1ccccc1 Amb10068704 [2,0,0,0,0,0|2,0,0]=4 2873 B9R1.6 N=C(N)c1ccccc1 Amb2371546 [2,0,0,0,0,0|2,0,0]=4 2874 B9R1.6 N=C(N)c1ccccc1 Amb6337518 [2,0,0,0,0,0|2,0,0]=4 2875 B9R1.6 NC(=O)[n+]1ccccc1 Amb27806689 [2,0,0,0,0,0|2,0,0]=4 2876 B9R1.6 NC(=O)c1ccc[nH+]c1 Amb8465811 [2,0,0,0,0,0|2,0,0]=4 2877 B9R1.6 NC(=O)c1ccccc1 Amb6399766 [2,0,0,0,0,0|1,0,0]=3 2878 B9R1.6 NC(=O)c1ccccn1 Amb1219876 [2,0,0,0,0,0|2,0,0]=4 2879 B9R1.6 NC(=O)c1cccnc1 Amb2609940 [2,0,0,0,0,0|2,0,0]=4 2880 B9R1.6 NC(=O)c1ccncc1 Amb5721989 [2,0,0,0,0,0|2,0,0]=4 2881 B9R1.6 NC(=S)c1ccccc1 Amb6338789 [2,0,0,0,0,0|1,1,0]=4 2882 B9R1.6 NS(=O)c1ccccc1 Amb26487323 [2,0,0,0,0,0|2,0,0]=4 2883 B9R1.6 O=C(Br)c1ccccc1 Amb8513573 [2,0,0,0,0,0|1,0,0]=3 2884 B9R1.6 O=C(Cl)c1cc[nH+]cc1 Amb21952993 [2,0,0,0,0,0|2,0,0]=4 2885 B9R1.6 O=C(Cl)c1ccccc1 Amb3939302 [2,0,0,0,0,0|1,0,0]=3 2886 B9R1.6 O=C(Cl)c1ccccn1 Amb22492448 [2,0,0,0,0,0|2,0,0]=4 2887 B9R1.6 O=C(Cl)c1ccccn1 Amb2690341 [2,0,0,0,0,0|2,0,0]=4 2888 B9R1.6 O=C(Cl)c1ccccn1 Amb3939534 [2,0,0,0,0,0|2,0,0]=4 2889 B9R1.6 O=C(Cl)c1cccnc1 Amb33531191 [2,0,0,0,0,0|2,0,0]=4 2890 B9R1.6 O=C(Cl)c1cccnc1 Amb839669 [2,0,0,0,0,0|2,0,0]=4 2891 B9R1.6 O=C(Cl)c1ccncc1 Amb2707217 [2,0,0,0,0,0|2,0,0]=4 2892 B9R1.6 O=C(Cl)c1ccncc1 Amb2720189 [2,0,0,0,0,0|2,0,0]=4 2893 B9R1.6 O=C(F)c1ccccc1 Amb10607152 [2,0,0,0,0,0|1,0,0]=3 2894 B9R1.6 O=C(O)C1=CCOC=C1 Amb27860440 [2,0,0,0,0,0|1,0,1]=4 2895 B9R1.6 O=C(O)C1C=CCC=C1 Amb17593268 [2,0,0,0,0,0|0,0,2]=4 2896 B9R1.6 O=C(O)c1ccccc1 Amb1935196 [2,0,0,0,0,0|0,0,0]=2 2897 B9R1.6 O=C(O)c1ccccc1 Amb22002523 [2,0,0,0,0,0|0,0,0]=2 2898 B9R1.6 O=C(O)c1ccccc1 Amb22336602 [2,0,0,0,0,0|0,0,0]=2 2899 B9R1.6 O=C(O)c1ccccc1 Amb22351742 [2,0,0,0,0,0|0,0,0]=2 2900 B9R1.6 O=C(O)c1ccccn1 Amb1227737 [2,0,0,0,0,0|1,0,0]=3 2901 B9R1.6 O=C(O)c1ccccn1 Amb4035065 [2,0,0,0,0,0|1,0,0]=3 2902 B9R1.6 O=C(O)c1cccnc1 Amb1195995 [2,0,0,0,0,0|1,0,0]=3 2903 B9R1.6 O=C(O)c1cccnn1 Amb33544461 [2,0,0,0,0,0|2,0,0]=4 2904 B9R1.6 O=C(O)c1ccncc1 Amb2609990 [2,0,0,0,0,0|1,0,0]=3 2905 B9R1.6 O=C(O)c1ccncn1 Amb1102414 [2,0,0,0,0,0|2,0,0]=4 2906 B9R1.6 O=C(O)c1ccnnc1 Amb2691390 [2,0,0,0,0,0|2,0,0]=4 2907 B9R1.6 O=C(O)c1cnccn1 Amb2455963 [2,0,0,0,0,0|2,0,0]=4 2908 B9R1.6 O=C(O)c1cncnc1 Amb24099331 [2,0,0,0,0,0|2,0,0]=4 2909 B9R1.6 O=C(O)c1cncnc1 Amb33527289 [2,0,0,0,0,0|2,0,0]=4 2910 B9R1.6 O=C(O)c1ncccn1 Amb19330380 [2,0,0,0,0,0|2,0,0]=4 2911 B9R1.6 O=C(O)c1ncccn1 Amb2720395 [2,0,0,0,0,0|2,0,0]=4 2912 B9R1.6 O=C(S)c1ccccc1 Amb8513358 [2,0,0,0,0,0|0,1,0]=3 2913 B9R1.6 O=C([O-])c1ccccc1 Amb22053472 [2,0,0,0,0,0|0,0,1]=3 2914 B9R1.6 O=C([O-])c1ccccc1 Amb22168438 [2,0,0,0,0,0|0,0,1]=3 2915 B9R1.6 O=C([O-])c1ccccc1 Amb8387740 [2,0,0,0,0,0|0,0,1]=3 2916 B9R1.6 O=C([O-])c1ccccc1 Amb8513916 [2,0,0,0,0,0|0,0,1]=3 2917 B9R1.6 O=C([O-])c1ccccc1 Amb8517378 [2,0,0,0,0,0|0,0,1]=3 2918 B9R1.6 O=C([O-])c1ccccn1 Amb22058087 [2,0,0,0,0,0|1,0,1]=4 2919 B9R1.6 O=C([O-])c1ccccn1 Amb22734923 [2,0,0,0,0,0|1,0,1]=4 2920 B9R1.6 O=C([O-])c1ccccn1 Amb8393579 [2,0,0,0,0,0|1,0,1]=4 2921 B9R1.6 O=C([O-])c1ccccn1 Amb8393582 [2,0,0,0,0,0|1,0,1]=4 2922 B9R1.6 O=C([O-])c1ccncc1 Amb22730239 [2,0,0,0,0,0|1,0,1]=4 2923 B9R1.6 O=I(=O)c1ccccc1 Amb9679129 [2,0,0,0,0,0|1,0,1]=4 2924 B9R1.6 O=S(Cl)c1ccccc1 Amb13881360 [2,0,0,0,0,0|2,0,0]=4 2925 B9R1.6 O=S(O)c1ccccc1 Amb17939345 [2,0,0,0,0,0|1,0,0]=3 2926 B9R1.6 O=S(O)c1cccnc1 Amb24062548 [2,0,0,0,0,0|2,0,0]=4 2927 B9R1.6 O=S(O)c1cccnc1 Amb32674890 [2,0,0,0,0,0|2,0,0]=4 2928 B9R1.6 O=S([O-])c1ccccc1 Amb2684569 [2,0,0,0,0,0|1,0,1]=4 2929 B9R1.6 O=S([O-])c1ccccc1 Amb28536248 [2,0,0,0,0,0|1,0,1]=4 2930 B9R1.6 O=[N+]([O-])c1ccccc1 Amb2793077 [2,0,0,0,0,0|1,0,1]=4 2931 B9R1.6 O=[PH](O)c1ccccc1 Amb3371978 [2,0,0,0,0,0|1,0,0]=3 2932 B9R1.6 O=[Se](O)c1ccccc1 Amb4138617 [2,0,0,0,0,0|1,0,0]=3 2933 B9R1.6 OB(O)c1ccccc1 Amb22587706 [2,0,0,0,0,0|1,0,1]=4 2934 B9R1.6 OB(O)c1ccccc1 Amb6365485 [2,0,0,0,0,0|1,0,1]=4 2935 B9R1.6 OC(=S)c1ccccc1 Amb17942862 [2,0,0,0,0,0|0,1,0]=3 2936 B9R1.6 OC(=S)c1cccnc1 Amb22731908 [2,0,0,0,0,0|1,1,0]=4 2937 B9R1.6 OP(O)c1ccccc1 Amb2684568 [2,0,0,0,0,0|1,0,1]=4 2938 B9R1.6 O[C@@H](Br)c1ccccc1 Amb27233551 [2,0,0,0,0,0|1,0,1]=4 2939 B9R1.6 O[C@@H](Cl)c1ccccc1 Amb28119929 [2,0,0,0,0,0|1,0,1]=4 2940 B9R1.6 S=C(Cl)c1ccccc1 Amb25294215 [2,0,0,0,0,0|1,1,0]=4 2941 B9R1.6 S=C(S)c1ccccc1 Amb22051683 [2,0,0,0,0,0|0,2,0]=4 2942 B9R1.8 Br\C=C/c1ccccc1 Amb24117456 [2,0,0,0,0,0|1,0,1]=4 2943 B9R1.8 Br\C=C\c1ccccc1 Amb3940204 [2,0,0,0,0,0|1,0,1]=4 2944 B9R1.8 C#COc1ccccc1 Amb27194589 [2,0,0,0,0,0|0,0,2]=4 2945 B9R1.8 C=COc1ccccc1 Amb10564213 [2,0,0,0,0,0|0,0,2]=4 2946 B9R1.8 CC#Cc1ccccc1 Amb8513696 [2,0,0,0,0,0|0,0,2]=4 2947 B9R1.8 CCC[n+]1ccccc1 Amb24325390 [2,0,0,0,0,0|1,0,1]=4 2948 B9R1.8 CCCc1ccccc1 Amb2447143 [2,0,0,0,0,0|0,0,1]=3 2949 B9R1.8 CCCc1ccccn1 Amb6366812 [2,0,0,0,0,0|1,0,1]=4 2950 B9R1.8 CCCc1cccnc1 Amb2613018 [2,0,0,0,0,0|1,0,1]=4 2951 B9R1.8 CCCc1ccncc1 Amb4017941 [2,0,0,0,0,0|1,0,1]=4 2952 B9R1.8 CCNc1ccccc1 Amb3940127 [2,0,0,0,0,0|1,0,0]=3 2953 B9R1.8 CCNc1ccccn1 Amb6640743 [2,0,0,0,0,0|2,0,0]=4 2954 B9R1.8 CCNc1cccnc1 Amb6686634 [2,0,0,0,0,0|2,0,0]=4 2955 B9R1.8 CCNc1ccncc1 Amb33545749 [2,0,0,0,0,0|2,0,0]=4 2956 B9R1.8 CCOc1ccccc1 Amb2842270 [2,0,0,0,0,0|0,0,0]=2 2957 B9R1.8 CCOc1ccccn1 Amb2609960 [2,0,0,0,0,0|1,0,0]=3 2958 B9R1.8 CCOc1cccnc1 Amb10573342 [2,0,0,0,0,0|1,0,0]=3 2959 B9R1.8 CCOc1cccnn1 Amb19958352 [2,0,0,0,0,0|2,0,0]=4 2960 B9R1.8 CCOc1ccncc1 Amb8396897 [2,0,0,0,0,0|1,0,0]=3 2961 B9R1.8 CCOc1cnccn1 Amb8387604 [2,0,0,0,0,0|2,0,0]=4 2962 B9R1.8 CCSc1ccccc1 Amb2687929 [2,0,0,0,0,0|0,1,0]=3 2963 B9R1.8 CCSc1ccccn1 Amb26656831 [2,0,0,0,0,0|1,1,0]=4 2964 B9R1.8 CCSc1ccncc1 Amb27766422 [2,0,0,0,0,0|1,1,0]=4 2965 B9R1.8 CNCc1ccccc1 Amb3699562 [2,0,0,0,0,0|1,0,1]=4 2966 B9R1.8 CNNc1ccccc1 Amb20242875 [2,0,0,0,0,0|2,0,0]=4 2967 B9R1.8 CNNc1ccccc1 Amb27969267 [2,0,0,0,0,0|2,0,0]=4 2968 B9R1.8 COCc1ccccc1 Amb2782562 [2,0,0,0,0,0|0,0,1]=3 2969 B9R1.8 COCc1ccccn1 Amb4017561 [2,0,0,0,0,0|1,0,1]=4 2970 B9R1.8 CSSc1ccccc1 Amb4008371 [2,0,0,0,0,0|1,1,0]=4 2971 B9R1.8 C[NH2+]Cc1ccccc1 Amb20648430 [2,0,0,0,0,0|1,0,1]=4 2972 B9R1.8 C\C=C/c1ccccc1 Amb2690400 [2,0,0,0,0,0|0,0,1]=3 2973 B9R1.8 C\C=C\c1ccccc1 Amb6366726 [2,0,0,0,0,0|0,0,1]=3 2974 B9R1.8 C\C=N\c1ccccc1 Amb8392386 [2,0,0,0,0,0|1,0,1]=4 2975 B9R1.8 C\N=C\c1ccccc1 Amb8513063 [2,0,0,0,0,0|1,0,0]=3 2976 B9R1.8 C\N=C\c1ccncc1 Amb22330508 [2,0,0,0,0,0|2,0,0]=4 2977 B9R1.8 ClCCc1ccccc1 Amb535682 [2,0,0,0,0,0|1,0,1]=4 2978 B9R1.8 ClCOc1ccccc1 Amb22059503 [2,0,0,0,0,0|1,0,0]=3 2979 B9R1.8 Cl\C=C\c1ccccc1 Amb10572872 [2,0,0,0,0,0|1,0,1]=4 2980 B9R1.8 F\C=C\c1ccccc1 Amb22641699 [2,0,0,0,0,0|1,0,1]=4 2981 B9R1.8 ICCc1ccccc1 Amb8515353 [2,0,0,0,0,0|1,0,1]=4 2982 B9R1.8 I\C=C\c1ccccc1 Amb24646418 [2,0,0,0,0,0|1,0,1]=4 2983 B9R1.8 N#COc1ccccc1 Amb15692860 [2,0,0,0,0,0|1,0,1]=4 2984 B9R1.8 NCCc1ccccc1 Amb17843439 [2,0,0,0,0,0|1,0,1]=4 2985 B9R1.8 NCCc1ccccc1 Amb2792829 [2,0,0,0,0,0|1,0,1]=4 2986 B9R1.8 NCNc1ccccc1 Amb17117015 [2,0,0,0,0,0|2,0,0]=4 2987 B9R1.8 NCOc1ccccc1 Amb25128781 [2,0,0,0,0,0|1,0,0]=3 2988 B9R1.8 NOCc1ccccc1 Amb1154307 [2,0,0,0,0,0|1,0,1]=4 2989 B9R1.8 NOCc1ccccc1 Amb22489499 [2,0,0,0,0,0|1,0,1]=4 2990 B9R1.8 NOCc1ccccc1 Amb6600539 [2,0,0,0,0,0|1,0,1]=4 2991 B9R1.8 N\N=C\c1ccccc1 Amb31284503 [2,0,0,0,0,0|2,0,0]=4 2992 B9R1.8 O=COc1ccccc1 Amb22002710 [2,0,0,0,0,0|1,0,1]=4 2993 B9R1.8 OCCc1ccccc1 Amb2793058 [2,0,0,0,0,0|1,0,1]=4 2994 B9R1.8 OCSc1ccccc1 Amb27776457 [2,0,0,0,0,0|1,1,0]=4 2995 B9R1.8 O\N=C/c1ccccc1 Amb6298335 [2,0,0,0,0,0|2,0,0]=4 2996 B9R1.8 O\N=C\c1ccccc1 Amb2223191 [2,0,0,0,0,0|2,0,0]=4 2997 B9R1.8 SCCc1ccccc1 Amb6255605 [2,0,0,0,0,0|1,0,1]=4 2998 B9R1.8 [N-]=[N+]=Cc1ccccc1 Amb15692850 [2,0,0,0,0,0|2,0,0]=4 2999 B9R1.8 [NH3+]CCc1ccccc1 Amb17843435 [2,0,0,0,0,0|1,0,1]=4 3000 B9R1.8 [NH3+]OCc1ccccc1 Amb9786371 [2,0,0,0,0,0|1,0,1]=4 3001 B11R1.7 CCC(C)(Br)c1ccccc1 Amb27755440 [1,1,0,0,0,0|1,0,1]=4 3002 B11R1.7 CCC(C)(C)c1ccccc1 Amb8383409 [1,1,0,0,0,0|1,0,1]=4 3003 B11R1.7 CCC(C)(N)c1ccccc1 Amb4036326 [1,1,0,0,0,0|1,0,1]=4 3004 B11R1.7 CCC(C)(N)c1ccccc1 Amb9781829 [1,1,0,0,0,0|1,0,1]=4 3005 B11R1.7 CCC(C)(O)c1ccccc1 Amb4036362 [1,1,0,0,0,0|0,0,2]=4 3006 B11R1.7 CCC(F)(F)c1ccccc1 Amb20670157 [1,1,0,0,0,0|1,0,1]=4 3007 B11R1.7 CCS(=N)(=O)c1ccccc1 Amb27948141 [1,1,0,0,0,0|1,0,0]=3 3008 B11R1.7 CCS(=N)(=O)c1ccccc1 Amb33456347 [1,1,0,0,0,0|1,0,0]=3 3009 B11R1.7 CCS(=N)(=O)c1ccccn1 Amb32667750 [1,1,0,0,0,0|2,0,0]=4 3010 B11R1.7 CCS(=N)(=O)c1ccncc1 Amb32667795 [1,1,0,0,0,0|2,0,0]=4 3011 B11R1.7 CCS(=O)(=O)c1ccccc1 Amb2687930 [1,1,0,0,0,0|1,0,0]=3 3012 B11R1.7 CCS(=O)(=O)c1cccnc1 Amb32672163 [1,1,0,0,0,0|2,0,0]=4 3013 B11R1.7 CC[C@@](C)(N)c1ccccc1 Amb27831677 [1,1,0,0,0,0|1,0,1]=4 3014 B11R1.7 CC[C@](C)(N)c1ccccc1 Amb26955224 [1,1,0,0,0,0|1,0,1]=4 3015 B11R1.7 CC[S@](=N)(=O)c1ccccc1 Amb33743997 [1,1,0,0,0,0|1,0,0]=3 3016 B11R1.7 CC[Si](Cl)(Cl)c1ccccc1 Amb19893874 [1,1,0,0,0,0|1,1,0]=4 3017 B11R1.7 CN=S(C)(=O)c1ccccc1 Amb9826001 [1,1,0,0,0,0|2,0,0]=4 3018 B11R1.7 CNP(=O)(O)c1ccccc1 Amb28343794 [1,1,0,0,0,0|2,0,0]=4 3019 B11R1.7 CNS(=O)(=O)c1ccccc1 Amb1152097 [1,1,0,0,0,0|2,0,0]=4 3020 B11R1.7 COC(O)(O)c1ccccc1 Amb22749915 [1,1,0,0,0,0|0,0,2]=4 3021 B11R1.7 COP(=O)(O)c1ccccc1 Amb25953611 [1,1,0,0,0,0|1,0,0]=3 3022 B11R1.7 COP(C)(=O)c1ccccc1 Amb6365870 [1,1,0,0,0,0|1,0,0]=3 3023 B11R1.7 COP(O)(=S)c1ccccc1 Amb8392131 [1,1,0,0,0,0|1,0,1]=4 3024 B11R1.7 COS(=O)(=O)c1ccccc1 Amb2793093 [1,1,0,0,0,0|1,0,0]=3 3025 B11R1.7 COS(=O)(=O)c1ccccn1 Amb26477444 [1,1,0,0,0,0|2,0,0]=4 3026 B11R1.7 COS(=O)(=O)c1cccnc1 Amb24466050 [1,1,0,0,0,0|2,0,0]=4 3027 B11R1.7 CO[Si](C)(C)c1ccccc1 Amb22047319 [1,1,0,0,0,0|1,1,0]=4 3028 B11R1.7 CP(=O)(CCl)c1ccccc1 Amb27650535 [1,1,0,0,0,0|2,0,0]=4 3029 B11R1.7 NCP(=O)(O)c1ccccc1 Amb27823125 [1,1,0,0,0,0|2,0,0]=4 3030 B11R1.7 O=P(O)(CO)c1ccccc1 Amb27860311 [1,1,0,0,0,0|2,0,0]=4 3031 B11R1.7 O=S(=O)(CBr)c1ccccc1 Amb22353468 [1,1,0,0,0,0|2,0,0]=4 3032 B11R1.7 O=S(=O)(CCl)c1ccccc1 Amb1158067 [1,1,0,0,0,0|2,0,0]=4 3033 B11R1.7 O=S(=O)(CF)c1ccccc1 Amb2688229 [1,1,0,0,0,0|2,0,0]=4 3034 B11R1.12 C=C=C(CBr)c1ccccc1 Amb27792952 [1,1,0,0,0,0|2,0,0]=4 3035 B11R1.12 C=CC(CC)c1ccccc1 Amb24485761 [1,1,0,0,0,0|1,0,1]=4 3036 B11R1.12 CCC(=C=O)c1ccccn1 Amb26359789 [1,1,0,0,0,0|1,0,0]=3 3037 B11R1.12 CCC(C#N)c1ccccc1 Amb4136418 [1,1,0,0,0,0|1,0,1]=4 3038 B11R1.12 CCC(C=O)c1ccccc1 Amb17138422 [1,1,0,0,0,0|0,0,1]=3 3039 B11R1.12 CCC(C=O)c1ccccn1 Amb26423415 [1,1,0,0,0,0|1,0,1]=4 3040 B11R1.12 CCC(C=O)c1cccnc1 Amb27631428 [1,1,0,0,0,0|1,0,1]=4 3041 B11R1.12 CCC(C=O)c1ccncc1 Amb27198828 [1,1,0,0,0,0|1,0,1]=4 3042 B11R1.12 CCC(CBr)c1ccccc1 Amb17241352 [1,1,0,0,0,0|1,0,1]=4 3043 B11R1.12 CCC(CCl)c1ccccc1 Amb8860571 [1,1,0,0,0,0|1,0,1]=4 3044 B11R1.12 CCC(CI)c1ccccc1 Amb26060739 [1,1,0,0,0,0|1,0,1]=4 3045 B11R1.12 CCC(CN)c1ccccc1 Amb2371100 [1,1,0,0,0,0|1,0,1]=4 3046 B11R1.12 CCC(CN)c1ccccc1 Amb431023 [1,1,0,0,0,0|1,0,1]=4 3047 B11R1.12 CCC(CO)c1ccccc1 Amb4019936 [1,1,0,0,0,0|0,0,2]=4 3048 B11R1.12 CCC(NC)c1ccccc1 Amb22492401 [1,1,0,0,0,0|1,0,1]=4 3049 B11R1.12 CCC(NC)c1ccccc1 Amb9705433 [1,1,0,0,0,0|1,0,1]=4 3050 B11R1.12 CCC(NN)c1ccccc1 Amb6245428 [1,1,0,0,0,0|1,0,1]=4 3051 B11R1.12 CCN(C#N)c1ccccc1 Amb25759456 [1,1,0,0,0,0|2,0,0]=4 3052 B11R1.12 CCN(CC)c1ccccc1 Amb10072363 [1,1,0,0,0,0|2,0,0]=4 3053 B11R1.12 CCN(CC)c1ccccc1 Amb6608642 [1,1,0,0,0,0|2,0,0]=4 3054 B11R1.12 CCN(CO)c1ccccc1 Amb20621228 [1,1,0,0,0,0|1,0,1]=4 3055 B11R1.12 CCN(N=O)c1ccccc1 Amb17618581 [1,1,0,0,0,0|1,0,0]=3 3056 B11R1.12 CC[C@@H](C=O)c1ccccc1 Amb27169433 [1,1,0,0,0,0|0,0,1]=3 3057 B11R1.12 CC[C@@H](CBr)c1ccccc1 Amb27839615 [1,1,0,0,0,0|1,0,1]=4 3058 B11R1.12 CC[C@@H](CCl)c1ccccc1 Amb25250668 [1,1,0,0,0,0|1,0,1]=4 3059 B11R1.12 CC[C@@H](CI)c1ccccc1 Amb26641610 [1,1,0,0,0,0|1,0,1]=4 3060 B11R1.12 CC[C@@H](CO)c1ccccc1 Amb27219809 [1,1,0,0,0,0|0,0,2]=4 3061 B11R1.12 CC[C@H](CCl)c1ccccc1 Amb27248249 [1,1,0,0,0,0|1,0,1]=4 3062 B11R1.12 CC[C@H](CN)c1ccccc1 Amb26959455 [1,1,0,0,0,0|1,0,1]=4 3063 B11R1.12 CC[C@H](NC)c1ccccc1 Amb27758866 [1,1,0,0,0,0|1,0,1]=4 3064 B11R1.12 CC\C(=N/N)c1ccccn1 Amb27257054 [1,1,0,0,0,0|2,0,0]=4 3065 B11R1.12 CC\C(=N/O)c1ccccc1 Amb3367838 [1,1,0,0,0,0|0,0,1]=3 3066 B11R1.12 COC(C#N)c1ccccc1 Amb26595696 [1,1,0,0,0,0|1,0,1]=4 3067 B11R1.12 COC(C=O)c1cccnc1 Amb27665895 [1,1,0,0,0,0|1,0,1]=4 3068 B11R1.12 COC(C=O)c1ccncc1 Amb28368633 [1,1,0,0,0,0|1,0,1]=4 3069 B11R1.12 COC(CBr)c1ccccc1 Amb24079930 [1,1,0,0,0,0|1,0,1]=4 3070 B11R1.12 COC(CCl)c1ccccc1 Amb17674030 [1,1,0,0,0,0|1,0,1]=4 3071 B11R1.12 COC(CI)c1ccccc1 Amb25998600 [1,1,0,0,0,0|1,0,1]=4 3072 B11R1.12 COC(CN)c1ccccc1 Amb10609834 [1,1,0,0,0,0|1,0,1]=4 3073 B11R1.12 COC(CN)c1ccccc1 Amb6892239 [1,1,0,0,0,0|1,0,1]=4 3074 B11R1.12 COC(CO)c1ccccc1 Amb3939163 [1,1,0,0,0,0|0,0,2]=4 3075 B11R1.12 COC(OC)c1ccccc1 Amb6297219 [1,1,0,0,0,0|0,0,2]=4 3076 B11R1.12 COP(OC)c1ccccc1 Amb6365796 [1,1,0,0,0,0|1,0,1]=4 3077 B11R1.12 CO[C@@H](CBr)c1ccccc1 Amb28428431 [1,1,0,0,0,0|1,0,1]=4 3078 B11R1.12 CO[C@@H](CN)c1ccccc1 Amb28249989 [1,1,0,0,0,0|1,0,1]=4 3079 B11R1.12 CO[C@H](C=O)c1ccccc1 Amb27455008 [1,1,0,0,0,0|0,0,1]=3 3080 B11R1.12 CO[C@H](CO)c1ccccc1 Amb10807423 [1,1,0,0,0,0|0,0,2]=4 3081 B11R1.12 CSC(C=O)c1ccccc1 Amb18646623 [1,1,0,0,0,0|0,1,1]=4 3082 B11R1.12 C\C=C(/C#N)c1ccccc1 Amb17231965 [1,1,0,0,0,0|1,0,1]=4 3083 B11R1.12 C\C=C(/C=O)c1ccncc1 Amb24418258 [1,1,0,0,0,0|1,0,1]=4 3084 B11R1.12 C\C=C(/CC)c1ccccc1 Amb26588977 [1,1,0,0,0,0|1,0,0]=3 3085 B11R1.12 C\C=C(/CC)c1ccccn1 Amb24101962 [1,1,0,0,0,0|2,0,0]=4 3086 B11R1.12 C\C=C(\CC)c1ccccc1 Amb26421595 [1,1,0,0,0,0|1,0,0]=3 3087 B11R1.12 C\C=C(\CCl)c1ccccc1 Amb27413555 [1,1,0,0,0,0|1,0,1]=4 3088 B11R1.12 C\N=C(/NC)c1ccccc1 Amb8487310 [1,1,0,0,0,0|2,0,0]=4 3089 B11R1.12 C\N=C(/SC)c1ccccc1 Amb32718735 [1,1,0,0,0,0|1,1,0]=4 3090 B11R1.12 F\C=C(\CBr)c1ccccc1 Amb27486280 [1,1,0,0,0,0|2,0,0]=4 3091 B11R1.12 NCC(C=O)c1ccccc1 Amb28282628 [1,1,0,0,0,0|1,0,1]=4 3092 B11R1.12 NC\C(=C/Cl)c1ccccc1 Amb34005133 [1,1,0,0,0,0|2,0,0]=4 3093 B11R1.12 NC\C(=C\Br)c1ccccc1 Amb28319127 [1,1,0,0,0,0|2,0,0]=4 3094 B11R1.12 NC\C(=N\O)c1ccccc1 Amb25368564 [1,1,0,0,0,0|1,0,1]=4 3095 B11R1.12 O=C=C(C=O)c1ccccc1 Amb27643622 [1,1,0,0,0,0|1,0,1]=4 3096 B11R1.12 O=CC(CO)c1ccccc1 Amb27488286 [1,1,0,0,0,0|1,0,1]=4 3097 B11R1.12 O=C\C(=C/O)c1ccccc1 Amb10576572 [1,1,0,0,0,0|1,0,1]=4 3098 B11R1.12 O=C\C(=C\Br)c1ccccc1 Amb24634608 [1,1,0,0,0,0|1,0,1]=4 3099 B11R1.12 O=C\C(=C\Cl)c1ccccc1 Amb17594154 [1,1,0,0,0,0|1,0,1]=4 3100 B11R1.12 O=C\C(=C\O)c1ccccc1 Amb25092916 [1,1,0,0,0,0|1,0,1]=4 3101 B11R1.12 O=C\C(=C\S)c1ccccc1 Amb27622186 [1,1,0,0,0,0|1,0,1]=4 3102 B11R1.12 O=C\C(=N/O)c1ccccc1 Amb28345218 [1,1,0,0,0,0|2,0,0]=4 3103 B11R1.12 O=C\C(=N\O)c1ccccc1 Amb26580467 [1,1,0,0,0,0|2,0,0]=4 3104 B11R1.12 OC\C(=C\F)c1ccccc1 Amb27972253 [1,1,0,0,0,0|2,0,0]=4 3105 B11R1.12 O\N=C(/CBr)c1ccccc1 Amb1047358 [1,1,0,0,0,0|1,0,1]=4 3106 B11R1.12 O\N=C(\CBr)c1ccccc1 Amb22489773 [1,1,0,0,0,0|1,0,1]=4 3107 B11R1.12 O\N=C(\CCl)c1ccccc1 Amb10569199 [1,1,0,0,0,0|1,0,1]=4 3108 B11R1.12 O\N=C(\CF)c1ccccc1 Amb7969465 [1,1,0,0,0,0|1,0,1]=4 3109 B11R1.12 [C-]#[N+]C(CC)c1ccccc1 Amb33732679 [1,1,0,0,0,0|1,0,1]=4 3110 B11R1.12 [C-]#[N+][C@@H](CC)c1ccccc1 Amb33747511 [1,1,0,0,0,0|1,0,1]=4 3111 B11R1.12 [C-]#[N+][C@H](CC)c1ccccc1 Amb33732680 [1,1,0,0,0,0|1,0,1]=4 3112 B11R1.22 C#CC(=O)c1ccc(C)cc1 Amb27617443 [1,1,0,0,0,0|0,0,2]=4 3113 B11R1.22 C#CC(=O)c1ccc(Cl)cc1 Amb25720663 [1,1,0,0,0,0|0,0,2]=4 3114 B11R1.22 C#CC(=O)c1ccc(F)cc1 Amb24447227 [1,1,0,0,0,0|0,0,2]=4 3115 B11R1.22 C#CC(=O)c1ccc(N)cc1 Amb24488157 [1,1,0,0,0,0|0,0,2]=4 3116 B11R1.22 C=C(CBr)c1ccc(Br)cc1 Amb25148237 [1,1,0,0,0,0|2,0,0]=4 3117 B11R1.22 C=C(CBr)c1ccc(C)cc1 Amb27945658 [1,1,0,0,0,0|2,0,0]=4 3118 B11R1.22 C=C(CBr)c1ccc(Cl)cc1 Amb8391740 [1,1,0,0,0,0|2,0,0]=4 3119 B11R1.22 C=C(CBr)c1ccc(F)cc1 Amb8391741 [1,1,0,0,0,0|2,0,0]=4 3120 B11R1.22 C=C(CBr)c1ccc(O)cc1 Amb33007182 [1,1,0,0,0,0|2,0,0]=4 3121 B11R1.22 C=C(CC)c1ccc(Br)cc1 Amb20668394 [1,1,0,0,0,0|1,0,0]=3 3122 B11R1.22 C=C(CC)c1ccc(F)cc1 Amb27803524 [1,1,0,0,0,0|1,0,0]=3 3123 B11R1.22 C=C(CCl)c1ccc(Br)cc1 Amb20000442 [1,1,0,0,0,0|2,0,0]=4 3124 B11R1.22 C=C(CCl)c1ccc(C)cc1 Amb28364907 [1,1,0,0,0,0|2,0,0]=4 3125 B11R1.22 C=C(CCl)c1ccc(Cl)cc1 Amb26350660 [1,1,0,0,0,0|2,0,0]=4 3126 B11R1.22 C=C(CCl)c1ccc(F)cc1 Amb25279495 [1,1,0,0,0,0|2,0,0]=4 3127 B11R1.22 C=C(CCl)c1ccc(O)cc1 Amb33057300 [1,1,0,0,0,0|2,0,0]=4 3128 B11R1.22 C=C(CN)c1ccc(Br)cc1 Amb25121108 [1,1,0,0,0,0|2,0,0]=4 3129 B11R1.22 C=C(CN)c1ccc(C)cc1 Amb18124857 [1,1,0,0,0,0|2,0,0]=4 3130 B11R1.22 C=C(CN)c1ccc(Cl)cc1 Amb18908725 [1,1,0,0,0,0|2,0,0]=4 3131 B11R1.22 C=C(CN)c1ccc(F)cc1 Amb18125278 [1,1,0,0,0,0|2,0,0]=4 3132 B11R1.22 C=C(CN)c1ccc(O)cc1 Amb26880201 [1,1,0,0,0,0|2,0,0]=4 3133 B11R1.22 C=C(OC)c1ccc(Br)cc1 Amb25325540 [1,1,0,0,0,0|1,0,0]=3 3134 B11R1.22 C=CC(=O)c1ccc(Br)cc1 Amb18066306 [1,1,0,0,0,0|0,0,2]=4 3135 B11R1.22 C=CC(=O)c1ccc(C)cc1 Amb18063916 [1,1,0,0,0,0|0,0,2]=4 3136 B11R1.22 C=CC(=O)c1ccc(Cl)cc1 Amb18563779 [1,1,0,0,0,0|0,0,2]=4 3137 B11R1.22 C=CC(=O)c1ccc(F)cc1 Amb18065313 [1,1,0,0,0,0|0,0,2]=4 3138 B11R1.22 C=CC(=O)c1ccc(N)cc1 Amb27253822 [1,1,0,0,0,0|0,0,2]=4 3139 B11R1.22 C=CC(=O)c1ccc(O)cc1 Amb24121488 [1,1,0,0,0,0|0,0,2]=4 3140 B11R1.22 CCC(=O)c1ccc(Br)cc1 Amb267378 [1,1,0,0,0,0|0,0,0]=2 3141 B11R1.22 CCC(=O)c1ccc(Br)cn1 Amb26439328 [1,1,0,0,0,0|1,0,0]=3 3142 B11R1.22 CCC(=O)c1ccc(Br)nc1 Amb23446252 [1,1,0,0,0,0|1,0,0]=3 3143 B11R1.22 CCC(=O)c1ccc(C)cc1 Amb5740248 [1,1,0,0,0,0|0,0,0]=2 3144 B11R1.22 CCC(=O)c1ccc(C)cn1 Amb22898827 [1,1,0,0,0,0|1,0,0]=3 3145 B11R1.22 CCC(=O)c1ccc(C)nc1 Amb28381139 [1,1,0,0,0,0|1,0,0]=3 3146 B11R1.22 CCC(=O)c1ccc(Cl)cc1 Amb6365763 [1,1,0,0,0,0|0,0,0]=2 3147 B11R1.22 CCC(=O)c1ccc(Cl)cn1 Amb27869319 [1,1,0,0,0,0|1,0,0]=3 3148 B11R1.22 CCC(=O)c1ccc(Cl)nc1 Amb2700285 [1,1,0,0,0,0|1,0,0]=3 3149 B11R1.22 CCC(=O)c1ccc(Cl)nn1 Amb32416129 [1,1,0,0,0,0|2,0,0]=4 3150 B11R1.22 CCC(=O)c1ccc(F)cc1 Amb2688408 [1,1,0,0,0,0|0,0,0]=2 3151 B11R1.22 CCC(=O)c1ccc(F)cn1 Amb25759749 [1,1,0,0,0,0|1,0,0]=3 3152 B11R1.22 CCC(=O)c1ccc(F)nc1 Amb26443332 [1,1,0,0,0,0|1,0,0]=3 3153 B11R1.22 CCC(=O)c1ccc(I)cc1 Amb6244842 [1,1,0,0,0,0|0,0,0]=2 3154 B11R1.22 CCC(=O)c1ccc(I)nc1 Amb23446977 [1,1,0,0,0,0|1,0,0]=3 3155 B11R1.22 CCC(=O)c1ccc(N)cc1 Amb2610525 [1,1,0,0,0,0|0,0,0]=2 3156 B11R1.22 CCC(=O)c1ccc(N)cc1 Amb34896232 [1,1,0,0,0,0|0,0,0]=2 3157 B11R1.22 CCC(=O)c1ccc(N)cn1 Amb28058320 [1,1,0,0,0,0|1,0,0]=3 3158 B11R1.22 CCC(=O)c1ccc(N)nc1 Amb23446324 [1,1,0,0,0,0|1,0,0]=3 3159 B11R1.22 CCC(=O)c1ccc(O)cc1 Amb1336085 [1,1,0,0,0,0|0,0,0]=2 3160 B11R1.22 CCC(=O)c1ccc(O)nc1 Amb23446708 [1,1,0,0,0,0|1,0,0]=3 3161 B11R1.22 CCC(=O)c1cnc(Cl)nc1 Amb27401259 [1,1,0,0,0,0|2,0,0]=4 3162 B11R1.22 CCC(=O)c1ncc(Br)cn1 Amb22236248 [1,1,0,0,0,0|2,0,0]=4 3163 B11R1.22 CCC(=O)c1ncc(C)cn1 Amb26335595 [1,1,0,0,0,0|2,0,0]=4 3164 B11R1.22 CCC(Br)c1ccc(Br)cc1 Amb8835448 [1,1,0,0,0,0|1,0,1]=4 3165 B11R1.22 CCC(Br)c1ccc(Cl)cc1 Amb8835385 [1,1,0,0,0,0|1,0,1]=4 3166 B11R1.22 CCC(Br)c1ccc(I)cc1 Amb27776527 [1,1,0,0,0,0|1,0,1]=4 3167 B11R1.22 CCC(C)c1ccc(Br)cc1 Amb6665350 [1,1,0,0,0,0|1,0,1]=4 3168 B11R1.22 CCC(C)c1ccc(Cl)cc1 Amb25715889 [1,1,0,0,0,0|1,0,1]=4 3169 B11R1.22 CCC(C)c1ccc(F)cc1 Amb27635784 [1,1,0,0,0,0|1,0,1]=4 3170 B11R1.22 CCC(C)c1ccc(I)cc1 Amb27442333 [1,1,0,0,0,0|1,0,1]=4 3171 B11R1.22 CCC(C)c1ccc(N)cc1 Amb2792850 [1,1,0,0,0,0|1,0,1]=4 3172 B11R1.22 CCC(C)c1ccc(O)cc1 Amb9702814 [1,1,0,0,0,0|1,0,1]=4 3173 B11R1.22 CCC(C)c1ccc(S)cc1 Amb7773582 [1,1,0,0,0,0|1,0,1]=4 3174 B11R1.22 CCC(Cl)c1ccc(Br)cc1 Amb7766846 [1,1,0,0,0,0|1,0,1]=4 3175 B11R1.22 CCC(Cl)c1ccc(C)cc1 Amb4016677 [1,1,0,0,0,0|1,0,1]=4 3176 B11R1.22 CCC(Cl)c1ccc(Cl)cc1 Amb7766796 [1,1,0,0,0,0|1,0,1]=4 3177 B11R1.22 CCC(Cl)c1ccc(F)cc1 Amb9205028 [1,1,0,0,0,0|1,0,1]=4 3178 B11R1.22 CCC(N)c1ccc(Br)cc1 Amb1106008 [1,1,0,0,0,0|1,0,1]=4 3179 B11R1.22 CCC(N)c1ccc(Br)cc1 Amb6893104 [1,1,0,0,0,0|1,0,1]=4 3180 B11R1.22 CCC(N)c1ccc(C)cc1 Amb1658898 [1,1,0,0,0,0|1,0,1]=4 3181 B11R1.22 CCC(N)c1ccc(C)cc1 Amb8503302 [1,1,0,0,0,0|1,0,1]=4 3182 B11R1.22 CCC(N)c1ccc(Cl)cc1 Amb1995281 [1,1,0,0,0,0|1,0,1]=4 3183 B11R1.22 CCC(N)c1ccc(F)cc1 Amb21955200 [1,1,0,0,0,0|1,0,1]=4 3184 B11R1.22 CCC(N)c1ccc(F)cc1 Amb9703738 [1,1,0,0,0,0|1,0,1]=4 3185 B11R1.22 CCC(N)c1ccc(O)cc1 Amb1117697 [1,1,0,0,0,0|1,0,1]=4 3186 B11R1.22 CCC(N)c1ccc(O)cc1 Amb17622108 [1,1,0,0,0,0|1,0,1]=4 3187 B11R1.22 CCC(O)c1ccc(Br)cc1 Amb9703386 [1,1,0,0,0,0|0,0,2]=4 3188 B11R1.22 CCC(O)c1ccc(C)cc1 Amb9703379 [1,1,0,0,0,0|0,0,2]=4 3189 B11R1.22 CCC(O)c1ccc(Cl)cc1 Amb1109844 [1,1,0,0,0,0|0,0,2]=4 3190 B11R1.22 CCC(O)c1ccc(F)cc1 Amb1111265 [1,1,0,0,0,0|0,0,2]=4 3191 B11R1.22 CCC(O)c1ccc(I)cc1 Amb26869478 [1,1,0,0,0,0|0,0,2]=4 3192 B11R1.22 CCC(O)c1ccc(N)cc1 Amb2697290 [1,1,0,0,0,0|0,0,2]=4 3193 B11R1.22 CCC(O)c1ccc(O)cc1 Amb9704428 [1,1,0,0,0,0|0,0,2]=4 3194 B11R1.22 CCC(S)c1ccc(Br)cc1 Amb7784776 [1,1,0,0,0,0|0,1,1]=4 3195 B11R1.22 CCC(S)c1ccc(C)cc1 Amb9208018 [1,1,0,0,0,0|0,1,1]=4 3196 B11R1.22 CCC(S)c1ccc(Cl)cc1 Amb9208019 [1,1,0,0,0,0|0,1,1]=4 3197 B11R1.22 CCC(S)c1ccc(F)cc1 Amb9208016 [1,1,0,0,0,0|0,1,1]=4 3198 B11R1.22 CCC(S)c1ccc(O)cc1 Amb7784759 [1,1,0,0,0,0|0,1,1]=4 3199 B11R1.22 CCN(C)c1ccc(N)cc1 Amb33868891 [1,1,0,0,0,0|2,0,0]=4 3200 B11R1.22 CCN(C)c1ccc(N)cc1 Amb7765992 [1,1,0,0,0,0|2,0,0]=4 3201 B11R1.22 CCN(C)c1ccc(O)cc1 Amb28200001 [1,1,0,0,0,0|2,0,0]=4 3202 B11R1.22 CCN(N)c1ccc(C)cc1 Amb18799372 [1,1,0,0,0,0|2,0,0]=4 3203 B11R1.22 CCS(=O)c1ccc(Cl)cc1 Amb27215747 [1,1,0,0,0,0|1,0,0]=3 3204 B11R1.22 CC[C@@H](C)c1ccc(F)cc1 Amb26848779 [1,1,0,0,0,0|1,0,1]=4 3205 B11R1.22 CC[C@@H](N)c1ccc(Br)cc1 Amb23440385 [1,1,0,0,0,0|1,0,1]=4 3206 B11R1.22 CC[C@@H](N)c1ccc(Br)cc1 Amb27390209 [1,1,0,0,0,0|1,0,1]=4 3207 B11R1.22 CC[C@@H](N)c1ccc(Cl)cc1 Amb22288632 [1,1,0,0,0,0|1,0,1]=4 3208 B11R1.22 CC[C@@H](N)c1ccc(Cl)cc1 Amb22747472 [1,1,0,0,0,0|1,0,1]=4 3209 B11R1.22 CC[C@@H](N)c1ccc(F)cc1 Amb22298536 [1,1,0,0,0,0|1,0,1]=4 3210 B11R1.22 CC[C@@H](N)c1ccc(F)cc1 Amb26852363 [1,1,0,0,0,0|1,0,1]=4 3211 B11R1.22 CC[C@@H](N)c1ccc(N)cc1 Amb27815084 [1,1,0,0,0,0|1,0,1]=4 3212 B11R1.22 CC[C@@H](O)c1ccc(C)cc1 Amb27399936 [1,1,0,0,0,0|0,0,2]=4 3213 B11R1.22 CC[C@@H](O)c1ccc(Cl)cc1 Amb20240761 [1,1,0,0,0,0|0,0,2]=4 3214 B11R1.22 CC[C@@H](O)c1ccc(F)cc1 Amb20240757 [1,1,0,0,0,0|0,0,2]=4 3215 B11R1.22 CC[C@H](N)c1ccc(Br)cc1 Amb33872478 [1,1,0,0,0,0|1,0,1]=4 3216 B11R1.22 CC[C@H](N)c1ccc(C)cc1 Amb28320710 [1,1,0,0,0,0|1,0,1]=4 3217 B11R1.22 CC[C@H](N)c1ccc(Cl)cc1 Amb22288689 [1,1,0,0,0,0|1,0,1]=4 3218 B11R1.22 CC[C@H](N)c1ccc(Cl)cc1 Amb25848651 [1,1,0,0,0,0|1,0,1]=4 3219 B11R1.22 CC[C@H](N)c1ccc(F)cc1 Amb22298579 [1,1,0,0,0,0|1,0,1]=4 3220 B11R1.22 CC[C@H](N)c1ccc(F)cc1 Amb24477560 [1,1,0,0,0,0|1,0,1]=4 3221 B11R1.22 CC[C@H](O)c1ccc(Br)cc1 Amb26332248 [1,1,0,0,0,0|0,0,2]=4 3222 B11R1.22 CC[C@H](O)c1ccc(Cl)cc1 Amb19889432 [1,1,0,0,0,0|0,0,2]=4 3223 B11R1.22 CC[C@H](O)c1ccc(F)cc1 Amb26505561 [1,1,0,0,0,0|0,0,2]=4 3224 B11R1.22 CC[C@H](O)c1ccc(I)cc1 Amb25732463 [1,1,0,0,0,0|0,0,2]=4 3225 B11R1.22 CC[C@H](O)c1ccc(O)cc1 Amb27258200 [1,1,0,0,0,0|0,0,2]=4 3226 B11R1.22 CNC(=N)c1ccc(Br)cc1 Amb27175134 [1,1,0,0,0,0|2,0,0]=4 3227 B11R1.22 CNC(=N)c1ccc(C)cc1 Amb8480217 [1,1,0,0,0,0|2,0,0]=4 3228 B11R1.22 CNC(=O)C1=CNC(=O)C=C1 Amb18799400 [1,1,0,0,0,0|2,0,0]=4 3229 B11R1.22 CNC(=O)C1=COC(=O)C=C1 Amb27982783 [1,1,0,0,0,0|2,0,0]=4 3230 B11R1.22 CNC(=O)c1ccc(Br)cc1 Amb1232931 [1,1,0,0,0,0|1,0,0]=3 3231 B11R1.22 CNC(=O)c1ccc(Br)cn1 Amb10068169 [1,1,0,0,0,0|2,0,0]=4 3232 B11R1.22 CNC(=O)c1ccc(Br)nc1 Amb19959847 [1,1,0,0,0,0|2,0,0]=4 3233 B11R1.22 CNC(=O)c1ccc(C)cc1 Amb2721101 [1,1,0,0,0,0|1,0,0]=3 3234 B11R1.22 CNC(=O)c1ccc(C)cn1 Amb25151403 [1,1,0,0,0,0|2,0,0]=4 3235 B11R1.22 CNC(=O)c1ccc(Cl)cc1 Amb2707199 [1,1,0,0,0,0|1,0,0]=3 3236 B11R1.22 CNC(=O)c1ccc(Cl)cn1 Amb27601396 [1,1,0,0,0,0|2,0,0]=4 3237 B11R1.22 CNC(=O)c1ccc(Cl)nc1 Amb2106608 [1,1,0,0,0,0|2,0,0]=4 3238 B11R1.22 CNC(=O)c1ccc(F)cc1 Amb3886603 [1,1,0,0,0,0|1,0,0]=3 3239 B11R1.22 CNC(=O)c1ccc(F)cn1 Amb27607820 [1,1,0,0,0,0|2,0,0]=4 3240 B11R1.22 CNC(=O)c1ccc(I)cc1 Amb1230427 [1,1,0,0,0,0|1,0,0]=3 3241 B11R1.22 CNC(=O)c1ccc(I)cn1 Amb27268655 [1,1,0,0,0,0|2,0,0]=4 3242 B11R1.22 CNC(=O)c1ccc(N)cc1 Amb6334818 [1,1,0,0,0,0|1,0,0]=3 3243 B11R1.22 CNC(=O)c1ccc(N)cn1 Amb25923162 [1,1,0,0,0,0|2,0,0]=4 3244 B11R1.22 CNC(=O)c1ccc(N)nc1 Amb18946779 [1,1,0,0,0,0|2,0,0]=4 3245 B11R1.22 CNC(=O)c1ccc(O)cc1 Amb6671651 [1,1,0,0,0,0|1,0,0]=3 3246 B11R1.22 CNC(=O)c1ccc(O)cn1 Amb19895115 [1,1,0,0,0,0|2,0,0]=4 3247 B11R1.22 CNC(=O)c1ccc(S)cc1 Amb24486099 [1,1,0,0,0,0|1,0,0]=3 3248 B11R1.22 CNC(=S)c1ccc(Cl)cc1 Amb28436657 [1,1,0,0,0,0|1,1,0]=4 3249 B11R1.22 CNC(=S)c1ccc(O)cc1 Amb28056735 [1,1,0,0,0,0|1,1,0]=4 3250 B11R1.22 CNS(=O)c1ccc(N)cc1 Amb18862841 [1,1,0,0,0,0|2,0,0]=4 3251 B11R1.22 COC(=N)C1=CNC(=O)C=C1 Amb35593408 [1,1,0,0,0,0|2,0,0]=4 3252 B11R1.22 COC(=N)c1ccc(Br)cn1 Amb28383542 [1,1,0,0,0,0|2,0,0]=4 3253 B11R1.22 COC(=N)c1ccc(C)cc1 Amb22269339 [1,1,0,0,0,0|1,0,0]=3 3254 B11R1.22 COC(=N)c1ccc(C)cc1 Amb28049833 [1,1,0,0,0,0|1,0,0]=3 3255 B11R1.22 COC(=N)c1ccc(C)nc1 Amb28120090 [1,1,0,0,0,0|2,0,0]=4 3256 B11R1.22 COC(=N)c1ccc(Cl)cc1 Amb18180239 [1,1,0,0,0,0|1,0,0]=3 3257 B11R1.22 COC(=N)c1ccc(Cl)cc1 Amb22736537 [1,1,0,0,0,0|1,0,0]=3 3258 B11R1.22 COC(=N)c1ccc(Cl)nc1 Amb27164086 [1,1,0,0,0,0|2,0,0]=4 3259 B11R1.22 COC(=N)c1ccc(I)cc1 Amb27954227 [1,1,0,0,0,0|1,0,0]=3 3260 B11R1.22 COC(=N)c1ccc(I)cn1 Amb27193795 [1,1,0,0,0,0|2,0,0]=4 3261 B11R1.22 COC(=N)c1ccc(O)cc1 Amb18181685 [1,1,0,0,0,0|1,0,0]=3 3262 B11R1.22 COC(=O)C1=CNC(=O)C=C1 Amb18182832 [1,1,0,0,0,0|1,0,0]=3 3263 B11R1.22 COC(=O)C1=CNC(=O)C=C1 Amb19372931 [1,1,0,0,0,0|1,0,0]=3 3264 B11R1.22 COC(=O)C1=CNC(=O)N=C1 Amb21964436 [1,1,0,0,0,0|2,0,0]=4 3265 B11R1.22 COC(=O)C1=COC(=O)C=C1 Amb18796753 [1,1,0,0,0,0|1,0,0]=3 3266 B11R1.22 COC(=O)C1=COC(O)C=C1 Amb26633793 [1,1,0,0,0,0|1,0,1]=4 3267 B11R1.22 COC(=O)C1=NNC(=O)C=C1 Amb18372542 [1,1,0,0,0,0|2,0,0]=4 3268 B11R1.22 COC(=O)C1C=CC(=O)C=C1 Amb26644097 [1,1,0,0,0,0|0,0,1]=3 3269 B11R1.22 COC(=O)c1cc[n+](C)cc1 Amb4005009 [1,1,0,0,0,0|1,0,0]=3 3270 B11R1.22 COC(=O)c1cc[n+]([O-])cc1 Amb4017366 [1,1,0,0,0,0|1,0,0]=3 3271 B11R1.22 COC(=O)c1ccc(Br)cc1 Amb1394975 [1,1,0,0,0,0|0,0,0]=2 3272 B11R1.22 COC(=O)c1ccc(Br)cn1 Amb6366095 [1,1,0,0,0,0|1,0,0]=3 3273 B11R1.22 COC(=O)c1ccc(Br)nc1 Amb2684085 [1,1,0,0,0,0|1,0,0]=3 3274 B11R1.22 COC(=O)c1ccc(Br)nn1 Amb22277068 [1,1,0,0,0,0|2,0,0]=4 3275 B11R1.22 COC(=O)c1ccc(C)cc1 Amb1210121 [1,1,0,0,0,0|0,0,0]=2 3276 B11R1.22 COC(=O)c1ccc(C)cn1 Amb19958650 [1,1,0,0,0,0|1,0,0]=3 3277 B11R1.22 COC(=O)c1ccc(C)nc1 Amb2691851 [1,1,0,0,0,0|1,0,0]=3 3278 B11R1.22 COC(=O)c1ccc(C)nn1 Amb17798484 [1,1,0,0,0,0|2,0,0]=4 3279 B11R1.22 COC(=O)c1ccc(Cl)cc1 Amb2726180 [1,1,0,0,0,0|0,0,0]=2 3280 B11R1.22 COC(=O)c1ccc(Cl)cn1 Amb15695243 [1,1,0,0,0,0|1,0,0]=3 3281 B11R1.22 COC(=O)c1ccc(Cl)cn1 Amb22751028 [1,1,0,0,0,0|1,0,0]=3 3282 B11R1.22 COC(=O)c1ccc(Cl)nc1 Amb2720451 [1,1,0,0,0,0|1,0,0]=3 3283 B11R1.22 COC(=O)c1ccc(Cl)nn1 Amb5720085 [1,1,0,0,0,0|2,0,0]=4 3284 B11R1.22 COC(=O)c1ccc(F)cc1 Amb2227542 [1,1,0,0,0,0|0,0,0]=2 3285 B11R1.22 COC(=O)c1ccc(F)cn1 Amb19930069 [1,1,0,0,0,0|1,0,0]=3 3286 B11R1.22 COC(=O)c1ccc(F)nc1 Amb8393047 [1,1,0,0,0,0|1,0,0]=3 3287 B11R1.22 COC(=O)c1ccc(F)nn1 Amb22750322 [1,1,0,0,0,0|2,0,0]=4 3288 B11R1.22 COC(=O)c1ccc(I)cc1 Amb2411582 [1,1,0,0,0,0|0,0,0]=2 3289 B11R1.22 COC(=O)c1ccc(I)cn1 Amb4561071 [1,1,0,0,0,0|1,0,0]=3 3290 B11R1.22 COC(=O)c1ccc(I)nc1 Amb22057831 [1,1,0,0,0,0|1,0,0]=3 3291 B11R1.22 COC(=O)c1ccc(N)cc1 Amb1215269 [1,1,0,0,0,0|0,0,0]=2 3292 B11R1.22 COC(=O)c1ccc(N)cc1 Amb2726185 [1,1,0,0,0,0|0,0,0]=2 3293 B11R1.22 COC(=O)c1ccc(N)cn1 Amb10603994 [1,1,0,0,0,0|1,0,0]=3 3294 B11R1.22 COC(=O)c1ccc(N)nc1 Amb2413102 [1,1,0,0,0,0|1,0,0]=3 3295 B11R1.22 COC(=O)c1ccc(N)nn1 Amb22492029 [1,1,0,0,0,0|2,0,0]=4 3296 B11R1.22 COC(=O)c1ccc(N)nn1 Amb33534948 [1,1,0,0,0,0|2,0,0]=4 3297 B11R1.22 COC(=O)c1ccc(O)cc1 Amb534309 [1,1,0,0,0,0|0,0,0]=2 3298 B11R1.22 COC(=O)c1ccc(O)cn1 Amb2236633 [1,1,0,0,0,0|1,0,0]=3 3299 B11R1.22 COC(=O)c1ccc(O)nc1 Amb5638116 [1,1,0,0,0,0|1,0,0]=3 3300 B11R1.22 COC(=O)c1ccc(O)nn1 Amb21811761 [1,1,0,0,0,0|2,0,0]=4 3301 B11R1.22 COC(=O)c1ccc(S)cc1 Amb341395 [1,1,0,0,0,0|0,0,0]=2 3302 B11R1.22 COC(=O)c1ccc(S)nc1 Amb23446717 [1,1,0,0,0,0|1,0,0]=3 3303 B11R1.22 COC(=O)c1ccc([O-])cc1 Amb6296112 [1,1,0,0,0,0|0,0,0]=2 3304 B11R1.22 COC(=O)c1cnc(Br)cn1 Amb10603997 [1,1,0,0,0,0|2,0,0]=4 3305 B11R1.22 COC(=O)c1cnc(Br)nc1 Amb22751737 [1,1,0,0,0,0|2,0,0]=4 3306 B11R1.22 COC(=O)c1cnc(C)cn1 Amb2689525 [1,1,0,0,0,0|2,0,0]=4 3307 B11R1.22 COC(=O)c1cnc(C)nc1 Amb13892051 [1,1,0,0,0,0|2,0,0]=4 3308 B11R1.22 COC(=O)c1cnc(Cl)cn1 Amb8386522 [1,1,0,0,0,0|2,0,0]=4 3309 B11R1.22 COC(=O)c1cnc(Cl)nc1 Amb2725044 [1,1,0,0,0,0|2,0,0]=4 3310 B11R1.22 COC(=O)c1cnc(F)cn1 Amb24096170 [1,1,0,0,0,0|2,0,0]=4 3311 B11R1.22 COC(=O)c1cnc(F)nc1 Amb27872497 [1,1,0,0,0,0|2,0,0]=4 3312 B11R1.22 COC(=O)c1cnc(N)cn1 Amb17608285 [1,1,0,0,0,0|2,0,0]=4 3313 B11R1.22 COC(=O)c1cnc(N)cn1 Amb21960728 [1,1,0,0,0,0|2,0,0]=4 3314 B11R1.22 COC(=O)c1cnc(N)nc1 Amb7172638 [1,1,0,0,0,0|2,0,0]=4 3315 B11R1.22 COC(=O)c1cnc(O)cn1 Amb1093992 [1,1,0,0,0,0|2,0,0]=4 3316 B11R1.22 COC(=O)c1ncc(Br)cn1 Amb33549337 [1,1,0,0,0,0|2,0,0]=4 3317 B11R1.22 COC(=O)c1ncc(C)cn1 Amb22304676 [1,1,0,0,0,0|2,0,0]=4 3318 B11R1.22 COC(=O)c1ncc(Cl)cn1 Amb22886749 [1,1,0,0,0,0|2,0,0]=4 3319 B11R1.22 COC(=O)c1ncc(F)cn1 Amb22263818 [1,1,0,0,0,0|2,0,0]=4 3320 B11R1.22 COC(=O)c1ncc(N)cn1 Amb16231456 [1,1,0,0,0,0|2,0,0]=4 3321 B11R1.22 COC(=O)c1ncc(N)cn1 Amb22899758 [1,1,0,0,0,0|2,0,0]=4 3322 B11R1.22 COC(=O)c1ncc(N)cn1 Amb32409392 [1,1,0,0,0,0|2,0,0]=4 3323 B11R1.22 COC(=O)c1ncc(O)cn1 Amb25697454 [1,1,0,0,0,0|2,0,0]=4 3324 B11R1.22 COC(=S)c1ccc(O)cc1 Amb28381287 [1,1,0,0,0,0|0,1,0]=3 3325 B11R1.22 COC(C)c1ccc(Br)cc1 Amb9173692 [1,1,0,0,0,0|1,0,1]=4 3326 B11R1.22 COC(C)c1ccc(F)cc1 Amb18633172 [1,1,0,0,0,0|1,0,1]=4 3327 B11R1.22 COC(C)c1ccc(I)cc1 Amb23568516 [1,1,0,0,0,0|1,0,1]=4 3328 B11R1.22 COC(C)c1ccc(N)cc1 Amb18952191 [1,1,0,0,0,0|1,0,1]=4 3329 B11R1.22 COC(C)c1ccc(S)cc1 Amb23568715 [1,1,0,0,0,0|1,0,1]=4 3330 B11R1.22 COC(Cl)c1ccc(Cl)cc1 Amb27863573 [1,1,0,0,0,0|1,0,1]=4 3331 B11R1.22 COC(O)c1ccc(Cl)cc1 Amb28125744 [1,1,0,0,0,0|0,0,2]=4 3332 B11R1.22 COS(=O)c1ccc(C)cc1 Amb22230928 [1,1,0,0,0,0|1,0,0]=3 3333 B11R1.22 CO[C@@H](C)c1ccc(Br)cc1 Amb27783049 [1,1,0,0,0,0|1,0,1]=4 3334 B11R1.22 CO[C@@H](C)c1ccc(F)cc1 Amb27263640 [1,1,0,0,0,0|1,0,1]=4 3335 B11R1.22 CSC(=N)c1ccc(Cl)cc1 Amb2736622 [1,1,0,0,0,0|1,1,0]=4 3336 B11R1.22 CSC(=O)[n+]1ccc(N)cc1 Amb28072965 [1,1,0,0,0,0|1,1,0]=4 3337 B11R1.22 CSC(=O)c1ccc(N)cc1 Amb27831413 [1,1,0,0,0,0|0,1,0]=3 3338 B11R1.22 CSC(=S)c1ccc(N)cc1 Amb28187106 [1,1,0,0,0,0|0,2,0]=4 3339 B11R1.22 C\C=C(/O)c1ccc(F)cc1 Amb24100278 [1,1,0,0,0,0|0,0,2]=4 3340 B11R1.22 Cc1ccc(C(=O)C#N)cc1 Amb17231996 [1,1,0,0,0,0|1,0,1]=4 3341 B11R1.22 Cc1ccc(C(=O)C=O)cc1 Amb10067935 [1,1,0,0,0,0|1,0,1]=4 3342 B11R1.22 Cc1ccc(C(=O)C=O)cc1 Amb2609863 [1,1,0,0,0,0|1,0,1]=4 3343 B11R1.22 Cc1ccc(C(=O)CBr)cc1 Amb1981331 [1,1,0,0,0,0|1,0,0]=3 3344 B11R1.22 Cc1ccc(C(=O)CBr)cn1 Amb22277086 [1,1,0,0,0,0|2,0,0]=4 3345 B11R1.22 Cc1ccc(C(=O)CBr)nc1 Amb24053939 [1,1,0,0,0,0|2,0,0]=4 3346 B11R1.22 Cc1ccc(C(=O)CCl)cc1 Amb1105496 [1,1,0,0,0,0|1,0,0]=3 3347 B11R1.22 Cc1ccc(C(=O)CCl)cn1 Amb24104209 [1,1,0,0,0,0|2,0,0]=4 3348 B11R1.22 Cc1ccc(C(=O)CCl)nc1 Amb25189273 [1,1,0,0,0,0|2,0,0]=4 3349 B11R1.22 Cc1ccc(C(=O)CF)cc1 Amb24084136 [1,1,0,0,0,0|1,0,0]=3 3350 B11R1.22 Cc1ccc(C(=O)CN)cc1 Amb2693534 [1,1,0,0,0,0|1,0,0]=3 3351 B11R1.22 Cc1ccc(C(=O)CN)cc1 Amb33513193 [1,1,0,0,0,0|1,0,0]=3 3352 B11R1.22 Cc1ccc(C(=O)CN)cc1 Amb5739530 [1,1,0,0,0,0|1,0,0]=3 3353 B11R1.22 Cc1ccc(C(=O)CN)cn1 Amb26546876 [1,1,0,0,0,0|2,0,0]=4 3354 B11R1.22 Cc1ccc(C(=O)CN)nc1 Amb27204900 [1,1,0,0,0,0|2,0,0]=4 3355 B11R1.22 Cc1ccc(C(=O)CO)cc1 Amb5638929 [1,1,0,0,0,0|1,0,0]=3 3356 B11R1.22 Cc1ccc(C(=O)CS)cc1 Amb17400215 [1,1,0,0,0,0|1,0,0]=3 3357 B11R1.22 Cc1ccc(C(=O)C[NH3+])cc1 Amb10606218 [1,1,0,0,0,0|1,0,0]=3 3358 B11R1.22 Cc1ccc(C(=O)NN)cc1 Amb6355393 [1,1,0,0,0,0|2,0,0]=4 3359 B11R1.22 Cc1ccc(C(=O)NO)cc1 Amb6444120 [1,1,0,0,0,0|2,0,0]=4 3360 B11R1.22 Cc1ccc(S(=O)CF)cc1 Amb27391615 [1,1,0,0,0,0|2,0,0]=4 3361 B11R1.22 Cc1ccc(S(=O)O[Na])cc1 Amb6365748 [1,1,0,0,0,0|2,0,0]=4 3362 B11R1.22 Cc1ccc([S@@](=O)CF)cc1 Amb24309140 [1,1,0,0,0,0|2,0,0]=4 3363 B11R1.22 N#CC(=O)c1ccc(Br)cc1 Amb3991577 [1,1,0,0,0,0|1,0,1]=4 3364 B11R1.22 N#CC(=O)c1ccc(Cl)cc1 Amb17939433 [1,1,0,0,0,0|1,0,1]=4 3365 B11R1.22 N#CC(=O)c1ccc(F)cc1 Amb17232050 [1,1,0,0,0,0|1,0,1]=4 3366 B11R1.22 N#CC(=O)c1ccc(I)cc1 Amb22495535 [1,1,0,0,0,0|1,0,1]=4 3367 B11R1.22 NCC(=O)c1ccc(Br)cc1 Amb1811968 [1,1,0,0,0,0|1,0,0]=3 3368 B11R1.22 NCC(=O)c1ccc(Br)cc1 Amb2728641 [1,1,0,0,0,0|1,0,0]=3 3369 B11R1.22 NCC(=O)c1ccc(Br)cc1 Amb3940739 [1,1,0,0,0,0|1,0,0]=3 3370 B11R1.22 NCC(=O)c1ccc(Br)cn1 Amb27169579 [1,1,0,0,0,0|2,0,0]=4 3371 B11R1.22 NCC(=O)c1ccc(Br)cn1 Amb30868020 [1,1,0,0,0,0|2,0,0]=4 3372 B11R1.22 NCC(=O)c1ccc(Br)nc1 Amb25778172 [1,1,0,0,0,0|2,0,0]=4 3373 B11R1.22 NCC(=O)c1ccc(Cl)cc1 Amb1208662 [1,1,0,0,0,0|1,0,0]=3 3374 B11R1.22 NCC(=O)c1ccc(Cl)cc1 Amb2370537 [1,1,0,0,0,0|1,0,0]=3 3375 B11R1.22 NCC(=O)c1ccc(Cl)cn1 Amb28071512 [1,1,0,0,0,0|2,0,0]=4 3376 B11R1.22 NCC(=O)c1ccc(Cl)nc1 Amb26880354 [1,1,0,0,0,0|2,0,0]=4 3377 B11R1.22 NCC(=O)c1ccc(Cl)nc1 Amb32671466 [1,1,0,0,0,0|2,0,0]=4 3378 B11R1.22 NCC(=O)c1ccc(F)cc1 Amb1419069 [1,1,0,0,0,0|1,0,0]=3 3379 B11R1.22 NCC(=O)c1ccc(F)cc1 Amb5739537 [1,1,0,0,0,0|1,0,0]=3 3380 B11R1.22 NCC(=O)c1ccc(F)cc1 Amb6384072 [1,1,0,0,0,0|1,0,0]=3 3381 B11R1.22 NCC(=O)c1ccc(F)cn1 Amb26340235 [1,1,0,0,0,0|2,0,0]=4 3382 B11R1.22 NCC(=O)c1ccc(F)nc1 Amb24106028 [1,1,0,0,0,0|2,0,0]=4 3383 B11R1.22 NCC(=O)c1ccc(I)cc1 Amb21962789 [1,1,0,0,0,0|1,0,0]=3 3384 B11R1.22 NCC(=O)c1ccc(I)cc1 Amb25876415 [1,1,0,0,0,0|1,0,0]=3 3385 B11R1.22 NCC(=O)c1ccc(O)cc1 Amb17593762 [1,1,0,0,0,0|1,0,0]=3 3386 B11R1.22 NCC(=O)c1ccc(O)cc1 Amb22001575 [1,1,0,0,0,0|1,0,0]=3 3387 B11R1.22 NNC(=O)c1ccc(Br)cc1 Amb1207367 [1,1,0,0,0,0|2,0,0]=4 3388 B11R1.22 NNC(=O)c1ccc(Cl)cc1 Amb1209335 [1,1,0,0,0,0|2,0,0]=4 3389 B11R1.22 NNC(=O)c1ccc(F)cc1 Amb1104475 [1,1,0,0,0,0|2,0,0]=4 3390 B11R1.22 NNC(=O)c1ccc(I)cc1 Amb1788092 [1,1,0,0,0,0|2,0,0]=4 3391 B11R1.22 NNC(=O)c1ccc(N)cc1 Amb6335760 [1,1,0,0,0,0|2,0,0]=4 3392 B11R1.22 NNC(=O)c1ccc(O)cc1 Amb1212100 [1,1,0,0,0,0|2,0,0]=4 3393 B11R1.22 NOC(=O)c1ccc(Cl)cc1 Amb24539350 [1,1,0,0,0,0|1,0,0]=3 3394 B11R1.22 Nc1ccc(C(=O)C=O)cc1 Amb28341792 [1,1,0,0,0,0|1,0,1]=4 3395 B11R1.22 Nc1ccc(C(=O)CBr)cc1 Amb8631324 [1,1,0,0,0,0|1,0,0]=3 3396 B11R1.22 Nc1ccc(C(=O)CBr)cn1 Amb25883413 [1,1,0,0,0,0|2,0,0]=4 3397 B11R1.22 Nc1ccc(C(=O)CCl)cc1 Amb9782884 [1,1,0,0,0,0|1,0,0]=3 3398 B11R1.22 Nc1ccc(C(=O)CO)cc1 Amb28255444 [1,1,0,0,0,0|1,0,0]=3 3399 B11R1.22 O=C(CBr)c1ccc(Br)cc1 Amb6337421 [1,1,0,0,0,0|1,0,0]=3 3400 B11R1.22 O=C(CBr)c1ccc(Br)cn1 Amb22831861 [1,1,0,0,0,0|2,0,0]=4 3401 B11R1.22 O=C(CBr)c1ccc(Br)cn1 Amb32652012 [1,1,0,0,0,0|2,0,0]=4 3402 B11R1.22 O=C(CBr)c1ccc(Cl)cc1 Amb2505006 [1,1,0,0,0,0|1,0,0]=3 3403 B11R1.22 O=C(CBr)c1ccc(Cl)cn1 Amb21858525 [1,1,0,0,0,0|2,0,0]=4 3404 B11R1.22 O=C(CBr)c1ccc(Cl)cn1 Amb22001890 [1,1,0,0,0,0|2,0,0]=4 3405 B11R1.22 O=C(CBr)c1ccc(F)cc1 Amb1885038 [1,1,0,0,0,0|1,0,0]=3 3406 B11R1.22 O=C(CBr)c1ccc(F)cn1 Amb23412381 [1,1,0,0,0,0|2,0,0]=4 3407 B11R1.22 O=C(CBr)c1ccc(I)cc1 Amb2612426 [1,1,0,0,0,0|1,0,0]=3 3408 B11R1.22 O=C(CBr)c1ccc(O)cc1 Amb6297896 [1,1,0,0,0,0|1,0,0]=3 3409 B11R1.22 O=C(CCl)c1ccc(Br)cc1 Amb1103620 [1,1,0,0,0,0|1,0,0]=3 3410 B11R1.22 O=C(CCl)c1ccc(Br)cn1 Amb24695456 [1,1,0,0,0,0|2,0,0]=4 3411 B11R1.22 O=C(CCl)c1ccc(Br)nc1 Amb26850302 [1,1,0,0,0,0|2,0,0]=4 3412 B11R1.22 O=C(CCl)c1ccc(Cl)cc1 Amb6608728 [1,1,0,0,0,0|1,0,0]=3 3413 B11R1.22 O=C(CCl)c1ccc(Cl)cn1 Amb24104200 [1,1,0,0,0,0|2,0,0]=4 3414 B11R1.22 O=C(CCl)c1ccc(Cl)nc1 Amb24104206 [1,1,0,0,0,0|2,0,0]=4 3415 B11R1.22 O=C(CCl)c1ccc(F)cc1 Amb1221364 [1,1,0,0,0,0|1,0,0]=3 3416 B11R1.22 O=C(CCl)c1ccc(F)cn1 Amb27232695 [1,1,0,0,0,0|2,0,0]=4 3417 B11R1.22 O=C(CCl)c1ccc(F)nc1 Amb24104207 [1,1,0,0,0,0|2,0,0]=4 3418 B11R1.22 O=C(CCl)c1ccc(I)cc1 Amb420189 [1,1,0,0,0,0|1,0,0]=3 3419 B11R1.22 O=C(CCl)c1ccc(O)cc1 Amb1218323 [1,1,0,0,0,0|1,0,0]=3 3420 B11R1.22 O=C(CF)c1ccc(Br)cc1 Amb26595064 [1,1,0,0,0,0|1,0,0]=3 3421 B11R1.22 O=C(CF)c1ccc(Cl)cc1 Amb10603324 [1,1,0,0,0,0|1,0,0]=3 3422 B11R1.22 O=C(CF)c1ccc(F)cc1 Amb22490651 [1,1,0,0,0,0|1,0,0]=3 3423 B11R1.22 O=C(CI)c1ccc(Br)cc1 Amb23579956 [1,1,0,0,0,0|1,0,0]=3 3424 B11R1.22 O=C(CO)c1ccc(Br)cc1 Amb2726212 [1,1,0,0,0,0|1,0,0]=3 3425 B11R1.22 O=C(CO)c1ccc(Cl)cc1 Amb2736179 [1,1,0,0,0,0|1,0,0]=3 3426 B11R1.22 O=C(CO)c1ccc(F)cc1 Amb2740436 [1,1,0,0,0,0|1,0,0]=3 3427 B11R1.22 O=C(CO)c1ccc(F)cn1 Amb28315278 [1,1,0,0,0,0|2,0,0]=4 3428 B11R1.22 O=C(CO)c1ccc(I)cc1 Amb5638978 [1,1,0,0,0,0|1,0,0]=3 3429 B11R1.22 O=C(CS)c1ccc(Br)cc1 Amb17407556 [1,1,0,0,0,0|1,0,0]=3 3430 B11R1.22 O=C(CS)c1ccc(Cl)cc1 Amb17401093 [1,1,0,0,0,0|1,0,0]=3 3431 B11R1.22 O=C(CS)c1ccc(F)cc1 Amb17400324 [1,1,0,0,0,0|1,0,0]=3 3432 B11R1.22 O=C(NO)c1ccc(Br)cc1 Amb6444119 [1,1,0,0,0,0|2,0,0]=4 3433 B11R1.22 O=C(NO)c1ccc(Cl)cc1 Amb6264774 [1,1,0,0,0,0|2,0,0]=4 3434 B11R1.22 O=C(NO)c1ccc(F)cc1 Amb6271764 [1,1,0,0,0,0|2,0,0]=4 3435 B11R1.22 O=C(NO)c1ccc(I)cc1 Amb7756049 [1,1,0,0,0,0|2,0,0]=4 3436 B11R1.22 O=CC(=O)c1ccc(Br)cc1 Amb10067934 [1,1,0,0,0,0|1,0,1]=4 3437 B11R1.22 O=CC(=O)c1ccc(Br)cc1 Amb8391398 [1,1,0,0,0,0|1,0,1]=4 3438 B11R1.22 O=CC(=O)c1ccc(Cl)cc1 Amb10067933 [1,1,0,0,0,0|1,0,1]=4 3439 B11R1.22 O=CC(=O)c1ccc(Cl)cc1 Amb4479326 [1,1,0,0,0,0|1,0,1]=4 3440 B11R1.22 O=CC(=O)c1ccc(F)cc1 Amb2688344 [1,1,0,0,0,0|1,0,1]=4 3441 B11R1.22 O=CC(=O)c1ccc(F)cc1 Amb9826943 [1,1,0,0,0,0|1,0,1]=4 3442 B11R1.22 O=CC(=O)c1ccc(I)cc1 Amb28455510 [1,1,0,0,0,0|1,0,1]=4 3443 B11R1.22 O=CC(=O)c1ccc(O)cc1 Amb10069044 [1,1,0,0,0,0|1,0,1]=4 3444 B11R1.22 O=CC(=O)c1ccc(O)cc1 Amb6373643 [1,1,0,0,0,0|1,0,1]=4 3445 B11R1.22 [CH2]c1ccc(C(=O)OC)cc1 Amb35825242 [1,1,0,0,0,0|0,0,0]=2 3446 B11R1.22 [NH3+]CC(=O)c1ccc(Br)cc1 Amb24113825 [1,1,0,0,0,0|1,0,0]=3 3447 B11R1.22 [NH3+]CC(=O)c1ccc(Br)cc1 Amb6366127 [1,1,0,0,0,0|1,0,0]=3 3448 B11R1.22 [NH3+]CC(=O)c1ccc(Cl)cc1 Amb33513069 [1,1,0,0,0,0|1,0,0]=3 3449 B11R1.22 [NH3+]CC(=O)c1ccc(Cl)cc1 Amb3987034 [1,1,0,0,0,0|1,0,0]=3 3450 B11R1.22 [NH3+]CC(=O)c1ccc(F)cc1 Amb4014040 [1,1,0,0,0,0|1,0,0]=3 3451 B11R1.22 [NH3+]CC(=O)c1ccc(F)cc1 Amb4324947 [1,1,0,0,0,0|1,0,0]=3 3452 B11R1.23 C#CC(=O)c1cccc(Cl)c1 Amb25687191 [1,1,0,0,0,0|0,0,2]=4 3453 B11R1.23 C#CC(=O)c1cccc(N)c1 Amb24550417 [1,1,0,0,0,0|0,0,2]=4 3454 B11R1.23 C=C(CBr)c1cccc(Br)c1 Amb33451468 [1,1,0,0,0,0|2,0,0]=4 3455 B11R1.23 C=C(CBr)c1cccc(C)c1 Amb26045084 [1,1,0,0,0,0|2,0,0]=4 3456 B11R1.23 C=C(CBr)c1cccc(Cl)c1 Amb33007396 [1,1,0,0,0,0|2,0,0]=4 3457 B11R1.23 C=C(CBr)c1cccc(F)c1 Amb33388009 [1,1,0,0,0,0|2,0,0]=4 3458 B11R1.23 C=C(CBr)c1cccc(O)c1 Amb33477646 [1,1,0,0,0,0|2,0,0]=4 3459 B11R1.23 C=C(CC)c1cccc(Br)c1 Amb27953527 [1,1,0,0,0,0|1,0,0]=3 3460 B11R1.23 C=C(CC)c1cccc(F)c1 Amb28141758 [1,1,0,0,0,0|1,0,0]=3 3461 B11R1.23 C=C(CCl)c1cccc(Br)c1 Amb33451470 [1,1,0,0,0,0|2,0,0]=4 3462 B11R1.23 C=C(CCl)c1cccc(C)c1 Amb25185402 [1,1,0,0,0,0|2,0,0]=4 3463 B11R1.23 C=C(CCl)c1cccc(Cl)c1 Amb27232850 [1,1,0,0,0,0|2,0,0]=4 3464 B11R1.23 C=C(CCl)c1cccc(F)c1 Amb33052845 [1,1,0,0,0,0|2,0,0]=4 3465 B11R1.23 C=C(CCl)c1cccc(O)c1 Amb33258377 [1,1,0,0,0,0|2,0,0]=4 3466 B11R1.23 C=C(CF)c1cccc(Br)c1 Amb33483710 [1,1,0,0,0,0|2,0,0]=4 3467 B11R1.23 C=C(CN)c1cccc(C)c1 Amb18251308 [1,1,0,0,0,0|2,0,0]=4 3468 B11R1.23 C=C(CN)c1cccc(Cl)c1 Amb18908724 [1,1,0,0,0,0|2,0,0]=4 3469 B11R1.23 C=C(CN)c1cccc(F)c1 Amb18908419 [1,1,0,0,0,0|2,0,0]=4 3470 B11R1.23 C=C(CN)c1cccc(O)c1 Amb25326353 [1,1,0,0,0,0|2,0,0]=4 3471 B11R1.23 C=CC(=O)c1cccc(Br)c1 Amb26372631 [1,1,0,0,0,0|0,0,2]=4 3472 B11R1.23 C=CC(=O)c1cccc(C)c1 Amb25861091 [1,1,0,0,0,0|0,0,2]=4 3473 B11R1.23 C=CC(=O)c1cccc(Cl)c1 Amb25783480 [1,1,0,0,0,0|0,0,2]=4 3474 B11R1.23 C=CC(=O)c1cccc(F)c1 Amb26460816 [1,1,0,0,0,0|0,0,2]=4 3475 B11R1.23 C=CC(=O)c1cccc(I)c1 Amb28136092 [1,1,0,0,0,0|0,0,2]=4 3476 B11R1.23 C=CC(=O)c1cccc(N)c1 Amb25291745 [1,1,0,0,0,0|0,0,2]=4 3477 B11R1.23 C=CC(=O)c1cccc(O)c1 Amb18124877 [1,1,0,0,0,0|0,0,2]=4 3478 B11R1.23 CCC(=O)C1=CC(=O)NC=C1 Amb27471883 [1,1,0,0,0,0|1,0,0]=3 3479 B11R1.23 CCC(=O)c1cc(C)ccn1 Amb20247623 [1,1,0,0,0,0|1,0,0]=3 3480 B11R1.23 CCC(=O)c1cc(Cl)ccn1 Amb7172618 [1,1,0,0,0,0|1,0,0]=3 3481 B11R1.23 CCC(=O)c1cccc(Br)c1 Amb1233199 [1,1,0,0,0,0|0,0,0]=2 3482 B11R1.23 CCC(=O)c1cccc(Br)n1 Amb27603923 [1,1,0,0,0,0|1,0,0]=3 3483 B11R1.23 CCC(=O)c1cccc(C)c1 Amb33534981 [1,1,0,0,0,0|0,0,0]=2 3484 B11R1.23 CCC(=O)c1cccc(C)n1 Amb24182056 [1,1,0,0,0,0|1,0,0]=3 3485 B11R1.23 CCC(=O)c1cccc(Cl)c1 Amb2686437 [1,1,0,0,0,0|0,0,0]=2 3486 B11R1.23 CCC(=O)c1cccc(F)c1 Amb2688407 [1,1,0,0,0,0|0,0,0]=2 3487 B11R1.23 CCC(=O)c1cccc(I)c1 Amb27230465 [1,1,0,0,0,0|0,0,0]=2 3488 B11R1.23 CCC(=O)c1cccc(N)c1 Amb3429288 [1,1,0,0,0,0|0,0,0]=2 3489 B11R1.23 CCC(=O)c1cccc(N)n1 Amb25314535 [1,1,0,0,0,0|1,0,0]=3 3490 B11R1.23 CCC(=O)c1cccc(O)c1 Amb8387616 [1,1,0,0,0,0|0,0,0]=2 3491 B11R1.23 CCC(=O)c1ccnc(C)c1 Amb28184697 [1,1,0,0,0,0|1,0,0]=3 3492 B11R1.23 CCC(=O)c1ccnc(C)n1 Amb26847077 [1,1,0,0,0,0|2,0,0]=4 3493 B11R1.23 CCC(=O)c1ccnc(Cl)c1 Amb6301673 [1,1,0,0,0,0|1,0,0]=3 3494 B11R1.23 CCC(=O)c1cncc(Br)c1 Amb23450052 [1,1,0,0,0,0|1,0,0]=3 3495 B11R1.23 CCC(=O)c1cncc(F)c1 Amb18791535 [1,1,0,0,0,0|1,0,0]=3 3496 B11R1.23 CCC(Br)c1cccc(Br)c1 Amb25330622 [1,1,0,0,0,0|1,0,1]=4 3497 B11R1.23 CCC(C)c1cccc(Br)c1 Amb24321311 [1,1,0,0,0,0|1,0,1]=4 3498 B11R1.23 CCC(C)c1cccc(C)c1 Amb22755118 [1,1,0,0,0,0|1,0,1]=4 3499 B11R1.23 CCC(C)c1cccc(Cl)c1 Amb27421860 [1,1,0,0,0,0|1,0,1]=4 3500 B11R1.23 CCC(C)c1cccc(F)c1 Amb26891562 [1,1,0,0,0,0|1,0,1]=4 3501 B11R1.23 CCC(C)c1cccc(N)c1 Amb26880198 [1,1,0,0,0,0|1,0,1]=4 3502 B11R1.23 CCC(C)c1cccc(N)c1 Amb32668333 [1,1,0,0,0,0|1,0,1]=4 3503 B11R1.23 CCC(Cl)c1cccc(Cl)c1 Amb7766801 [1,1,0,0,0,0|1,0,1]=4 3504 B11R1.23 CCC(N)c1cccc(Br)c1 Amb9232335 [1,1,0,0,0,0|1,0,1]=4 3505 B11R1.23 CCC(N)c1cccc(C)c1 Amb17232059 [1,1,0,0,0,0|1,0,1]=4 3506 B11R1.23 CCC(N)c1cccc(C)c1 Amb32662125 [1,1,0,0,0,0|1,0,1]=4 3507 B11R1.23 CCC(N)c1cccc(Cl)c1 Amb1126296 [1,1,0,0,0,0|1,0,1]=4 3508 B11R1.23 CCC(N)c1cccc(F)c1 Amb10839631 [1,1,0,0,0,0|1,0,1]=4 3509 B11R1.23 CCC(N)c1cccc(N)c1 Amb22754502 [1,1,0,0,0,0|1,0,1]=4 3510 B11R1.23 CCC(N)c1cccc(O)c1 Amb27391145 [1,1,0,0,0,0|1,0,1]=4 3511 B11R1.23 CCC(O)c1cccc(Br)c1 Amb9704418 [1,1,0,0,0,0|0,0,2]=4 3512 B11R1.23 CCC(O)c1cccc(C)c1 Amb17232070 [1,1,0,0,0,0|0,0,2]=4 3513 B11R1.23 CCC(O)c1cccc(Cl)c1 Amb9748278 [1,1,0,0,0,0|0,0,2]=4 3514 B11R1.23 CCC(O)c1cccc(F)c1 Amb18035934 [1,1,0,0,0,0|0,0,2]=4 3515 B11R1.23 CCC(S)c1cccc(Br)c1 Amb25853905 [1,1,0,0,0,0|0,1,1]=4 3516 B11R1.23 CCC(S)c1cccc(C)c1 Amb25703808 [1,1,0,0,0,0|0,1,1]=4 3517 B11R1.23 CCC(S)c1cccc(Cl)c1 Amb7784701 [1,1,0,0,0,0|0,1,1]=4 3518 B11R1.23 CCC(S)c1cccc(F)c1 Amb25893398 [1,1,0,0,0,0|0,1,1]=4 3519 B11R1.23 CCN(C)c1cccc(Br)c1 Amb25711222 [1,1,0,0,0,0|2,0,0]=4 3520 B11R1.23 CCN(C)c1cccc(N)c1 Amb33526914 [1,1,0,0,0,0|2,0,0]=4 3521 B11R1.23 CCN(C)c1cccc(O)c1 Amb18125288 [1,1,0,0,0,0|2,0,0]=4 3522 B11R1.23 CCN(N)c1cccc(C)c1 Amb17232077 [1,1,0,0,0,0|2,0,0]=4 3523 B11R1.23 CCS(=O)c1cc(C)ccn1 Amb27246813 [1,1,0,0,0,0|2,0,0]=4 3524 B11R1.23 CCS(=O)c1cccc(Br)c1 Amb27593385 [1,1,0,0,0,0|1,0,0]=3 3525 B11R1.23 CCS(=O)c1cccc(Cl)n1 Amb27193505 [1,1,0,0,0,0|2,0,0]=4 3526 B11R1.23 CCS(=O)c1ccnc(Br)c1 Amb27968080 [1,1,0,0,0,0|2,0,0]=4 3527 B11R1.23 CC[C@@H](N)c1cccc(Br)c1 Amb24533197 [1,1,0,0,0,0|1,0,1]=4 3528 B11R1.23 CC[C@@H](N)c1cccc(C)c1 Amb22298529 [1,1,0,0,0,0|1,0,1]=4 3529 B11R1.23 CC[C@@H](N)c1cccc(C)c1 Amb25145723 [1,1,0,0,0,0|1,0,1]=4 3530 B11R1.23 CC[C@@H](N)c1cccc(Cl)c1 Amb22232293 [1,1,0,0,0,0|1,0,1]=4 3531 B11R1.23 CC[C@@H](N)c1cccc(F)c1 Amb22288627 [1,1,0,0,0,0|1,0,1]=4 3532 B11R1.23 CC[C@@H](N)c1cccc(F)c1 Amb24426877 [1,1,0,0,0,0|1,0,1]=4 3533 B11R1.23 CC[C@@H](N)c1cccc(I)c1 Amb27208917 [1,1,0,0,0,0|1,0,1]=4 3534 B11R1.23 CC[C@@H](O)c1cccc(C)c1 Amb25151427 [1,1,0,0,0,0|0,0,2]=4 3535 B11R1.23 CC[C@@H](O)c1cccc(Cl)c1 Amb24477555 [1,1,0,0,0,0|0,0,2]=4 3536 B11R1.23 CC[C@@H](O)c1cccc(F)c1 Amb26853148 [1,1,0,0,0,0|0,0,2]=4 3537 B11R1.23 CC[C@H](N)c1cccc(Br)c1 Amb27826818 [1,1,0,0,0,0|1,0,1]=4 3538 B11R1.23 CC[C@H](N)c1cccc(C)c1 Amb27975769 [1,1,0,0,0,0|1,0,1]=4 3539 B11R1.23 CC[C@H](N)c1cccc(Cl)c1 Amb22232288 [1,1,0,0,0,0|1,0,1]=4 3540 B11R1.23 CC[C@H](N)c1cccc(F)c1 Amb22288686 [1,1,0,0,0,0|1,0,1]=4 3541 B11R1.23 CC[C@H](N)c1cccc(F)c1 Amb27254065 [1,1,0,0,0,0|1,0,1]=4 3542 B11R1.23 CC[C@H](N)c1cccc(N)c1 Amb25169299 [1,1,0,0,0,0|1,0,1]=4 3543 B11R1.23 CC[C@H](O)c1cccc(Br)c1 Amb28401259 [1,1,0,0,0,0|0,0,2]=4 3544 B11R1.23 CC[C@H](O)c1cccc(C)c1 Amb25794428 [1,1,0,0,0,0|0,0,2]=4 3545 B11R1.23 CC[C@H](O)c1cccc(Cl)c1 Amb27947376 [1,1,0,0,0,0|0,0,2]=4 3546 B11R1.23 CC[C@H](O)c1cccc(F)c1 Amb24447234 [1,1,0,0,0,0|0,0,2]=4 3547 B11R1.23 CC[C@H](O)c1cccc(O)c1 Amb24484509 [1,1,0,0,0,0|0,0,2]=4 3548 B11R1.23 CNC(=N)c1cccc(Br)c1 Amb27484944 [1,1,0,0,0,0|2,0,0]=4 3549 B11R1.23 CNC(=N)c1cccc(F)c1 Amb27395007 [1,1,0,0,0,0|2,0,0]=4 3550 B11R1.23 CNC(=O)C1=CC(=O)NC=C1 Amb27169726 [1,1,0,0,0,0|2,0,0]=4 3551 B11R1.23 CNC(=O)c1cc(Br)ccn1 Amb25312186 [1,1,0,0,0,0|2,0,0]=4 3552 B11R1.23 CNC(=O)c1cc(C)ccn1 Amb26907343 [1,1,0,0,0,0|2,0,0]=4 3553 B11R1.23 CNC(=O)c1cc(Cl)ccn1 Amb1216582 [1,1,0,0,0,0|2,0,0]=4 3554 B11R1.23 CNC(=O)c1cc(Cl)ccn1 Amb17611087 [1,1,0,0,0,0|2,0,0]=4 3555 B11R1.23 CNC(=O)c1cc(I)ccn1 Amb27877595 [1,1,0,0,0,0|2,0,0]=4 3556 B11R1.23 CNC(=O)c1cc(N)ccn1 Amb33531654 [1,1,0,0,0,0|2,0,0]=4 3557 B11R1.23 CNC(=O)c1cc(O)ccn1 Amb22755769 [1,1,0,0,0,0|2,0,0]=4 3558 B11R1.23 CNC(=O)c1ccc[n+](C)c1 Amb27827345 [1,1,0,0,0,0|2,0,0]=4 3559 B11R1.23 CNC(=O)c1ccc[n+](C)c1 Amb29846115 [1,1,0,0,0,0|2,0,0]=4 3560 B11R1.23 CNC(=O)c1cccc(Br)c1 Amb3887216 [1,1,0,0,0,0|1,0,0]=3 3561 B11R1.23 CNC(=O)c1cccc(Br)n1 Amb19959848 [1,1,0,0,0,0|2,0,0]=4 3562 B11R1.23 CNC(=O)c1cccc(C)n1 Amb8333372 [1,1,0,0,0,0|2,0,0]=4 3563 B11R1.23 CNC(=O)c1cccc(Cl)n1 Amb10877696 [1,1,0,0,0,0|2,0,0]=4 3564 B11R1.23 CNC(=O)c1cccc(F)c1 Amb3886602 [1,1,0,0,0,0|1,0,0]=3 3565 B11R1.23 CNC(=O)c1cccc(F)n1 Amb27176229 [1,1,0,0,0,0|2,0,0]=4 3566 B11R1.23 CNC(=O)c1cccc(I)c1 Amb6403460 [1,1,0,0,0,0|1,0,0]=3 3567 B11R1.23 CNC(=O)c1cccc(N)c1 Amb1212262 [1,1,0,0,0,0|1,0,0]=3 3568 B11R1.23 CNC(=O)c1cccc(N)c1 Amb24053079 [1,1,0,0,0,0|1,0,0]=3 3569 B11R1.23 CNC(=O)c1cccc(N)n1 Amb18946961 [1,1,0,0,0,0|2,0,0]=4 3570 B11R1.23 CNC(=O)c1cccc(O)c1 Amb6671640 [1,1,0,0,0,0|1,0,0]=3 3571 B11R1.23 CNC(=O)c1ccnc(Br)c1 Amb15691039 [1,1,0,0,0,0|2,0,0]=4 3572 B11R1.23 CNC(=O)c1ccnc(Cl)c1 Amb6667937 [1,1,0,0,0,0|2,0,0]=4 3573 B11R1.23 CNC(=O)c1ccnc(F)c1 Amb18787496 [1,1,0,0,0,0|2,0,0]=4 3574 B11R1.23 CNC(=O)c1ccnc(N)c1 Amb33529707 [1,1,0,0,0,0|2,0,0]=4 3575 B11R1.23 CNC(=O)c1cncc(N)c1 Amb23452695 [1,1,0,0,0,0|2,0,0]=4 3576 B11R1.23 COC(=N)c1cc(C)ccn1 Amb27216643 [1,1,0,0,0,0|2,0,0]=4 3577 B11R1.23 COC(=N)c1cccc(Br)c1 Amb24420410 [1,1,0,0,0,0|1,0,0]=3 3578 B11R1.23 COC(=N)c1cccc(C)n1 Amb27476072 [1,1,0,0,0,0|2,0,0]=4 3579 B11R1.23 COC(=N)c1ccnc(F)c1 Amb27462629 [1,1,0,0,0,0|2,0,0]=4 3580 B11R1.23 COC(=N)c1cncc(Br)c1 Amb27607653 [1,1,0,0,0,0|2,0,0]=4 3581 B11R1.23 COC(=O)C1=CC(=N)NC=C1 Amb19281876 [1,1,0,0,0,0|1,0,0]=3 3582 B11R1.23 COC(=O)C1=CC(=O)C=NN1 Amb24359096 [1,1,0,0,0,0|2,0,0]=4 3583 B11R1.23 COC(=O)C1=CC(=O)CC=N1 Amb27409531 [1,1,0,0,0,0|1,0,1]=4 3584 B11R1.23 COC(=O)C1=CC(=O)N=CN1 Amb22497602 [1,1,0,0,0,0|2,0,0]=4 3585 B11R1.23 COC(=O)C1=CC(=O)NN=C1 Amb22235613 [1,1,0,0,0,0|2,0,0]=4 3586 B11R1.23 COC(=O)C1=CC=CC(=O)N1 Amb21963502 [1,1,0,0,0,0|1,0,0]=3 3587 B11R1.23 COC(=O)C1=NC(=O)NC=C1 Amb22275937 [1,1,0,0,0,0|2,0,0]=4 3588 B11R1.23 COC(=O)C1=NC=CC(=O)N1 Amb27795334 [1,1,0,0,0,0|2,0,0]=4 3589 B11R1.23 COC(=O)c1c[n+]([O-])ccn1 Amb10552567 [1,1,0,0,0,0|2,0,0]=4 3590 B11R1.23 COC(=O)c1cc(Br)ccn1 Amb33544830 [1,1,0,0,0,0|1,0,0]=3 3591 B11R1.23 COC(=O)c1cc(Br)ncn1 Amb22752399 [1,1,0,0,0,0|2,0,0]=4 3592 B11R1.23 COC(=O)c1cc(C)ccn1 Amb21963460 [1,1,0,0,0,0|1,0,0]=3 3593 B11R1.23 COC(=O)c1cc(C)cnn1 Amb24183592 [1,1,0,0,0,0|2,0,0]=4 3594 B11R1.23 COC(=O)c1cc(C)ncn1 Amb22233997 [1,1,0,0,0,0|2,0,0]=4 3595 B11R1.23 COC(=O)c1cc(Cl)ccn1 Amb22489514 [1,1,0,0,0,0|1,0,0]=3 3596 B11R1.23 COC(=O)c1cc(Cl)ccn1 Amb2425400 [1,1,0,0,0,0|1,0,0]=3 3597 B11R1.23 COC(=O)c1cc(Cl)ccn1 Amb6565037 [1,1,0,0,0,0|1,0,0]=3 3598 B11R1.23 COC(=O)c1cc(Cl)ncn1 Amb20241221 [1,1,0,0,0,0|2,0,0]=4 3599 B11R1.23 COC(=O)c1cc(F)ccn1 Amb21857845 [1,1,0,0,0,0|1,0,0]=3 3600 B11R1.23 COC(=O)c1cc(F)ncn1 Amb27192376 [1,1,0,0,0,0|2,0,0]=4 3601 B11R1.23 COC(=O)c1cc(I)ccn1 Amb10072115 [1,1,0,0,0,0|1,0,0]=3 3602 B11R1.23 COC(=O)c1cc(N)ccn1 Amb33874132 [1,1,0,0,0,0|1,0,0]=3 3603 B11R1.23 COC(=O)c1cc(N)ccn1 Amb8386827 [1,1,0,0,0,0|1,0,0]=3 3604 B11R1.23 COC(=O)c1cc(N)ncn1 Amb21963300 [1,1,0,0,0,0|2,0,0]=4 3605 B11R1.23 COC(=O)c1cc(O)ccn1 Amb10603787 [1,1,0,0,0,0|1,0,0]=3 3606 B11R1.23 COC(=O)c1cc(O)ccn1 Amb22754537 [1,1,0,0,0,0|1,0,0]=3 3607 B11R1.23 COC(=O)c1cc(O)cnn1 Amb35789870 [1,1,0,0,0,0|2,0,0]=4 3608 B11R1.23 COC(=O)c1ccc[n+](C)c1 Amb2610524 [1,1,0,0,0,0|1,0,0]=3 3609 B11R1.23 COC(=O)c1ccc[n+]([O-])c1 Amb2611955 [1,1,0,0,0,0|1,0,0]=3 3610 B11R1.23 COC(=O)c1cccc(Br)c1 Amb3939648 [1,1,0,0,0,0|0,0,0]=2 3611 B11R1.23 COC(=O)c1cccc(Br)n1 Amb2684088 [1,1,0,0,0,0|1,0,0]=3 3612 B11R1.23 COC(=O)c1cccc(C)c1 Amb2726160 [1,1,0,0,0,0|0,0,0]=2 3613 B11R1.23 COC(=O)c1cccc(C)n1 Amb2694578 [1,1,0,0,0,0|1,0,0]=3 3614 B11R1.23 COC(=O)c1cccc(Cl)c1 Amb6365788 [1,1,0,0,0,0|0,0,0]=2 3615 B11R1.23 COC(=O)c1cccc(Cl)n1 Amb1197599 [1,1,0,0,0,0|1,0,0]=3 3616 B11R1.23 COC(=O)c1cccc(F)c1 Amb2689435 [1,1,0,0,0,0|0,0,0]=2 3617 B11R1.23 COC(=O)c1cccc(F)n1 Amb16231928 [1,1,0,0,0,0|1,0,0]=3 3618 B11R1.23 COC(=O)c1cccc(I)c1 Amb4009338 [1,1,0,0,0,0|0,0,0]=2 3619 B11R1.23 COC(=O)c1cccc(I)n1 Amb6565078 [1,1,0,0,0,0|1,0,0]=3 3620 B11R1.23 COC(=O)c1cccc(N)c1 Amb22001392 [1,1,0,0,0,0|0,0,0]=2 3621 B11R1.23 COC(=O)c1cccc(N)c1 Amb6358036 [1,1,0,0,0,0|0,0,0]=2 3622 B11R1.23 COC(=O)c1cccc(N)n1 Amb32992412 [1,1,0,0,0,0|1,0,0]=3 3623 B11R1.23 COC(=O)c1cccc(N)n1 Amb8630858 [1,1,0,0,0,0|1,0,0]=3 3624 B11R1.23 COC(=O)c1cccc(O)c1 Amb6355858 [1,1,0,0,0,0|0,0,0]=2 3625 B11R1.23 COC(=O)c1cccc(S)c1 Amb17617595 [1,1,0,0,0,0|0,0,0]=2 3626 B11R1.23 COC(=O)c1cccc(S)n1 Amb27211042 [1,1,0,0,0,0|1,0,0]=3 3627 B11R1.23 COC(=O)c1ccnc(Br)c1 Amb6565027 [1,1,0,0,0,0|1,0,0]=3 3628 B11R1.23 COC(=O)c1ccnc(Br)n1 Amb21964601 [1,1,0,0,0,0|2,0,0]=4 3629 B11R1.23 COC(=O)c1ccnc(C)c1 Amb19944358 [1,1,0,0,0,0|1,0,0]=3 3630 B11R1.23 COC(=O)c1ccnc(C)c1 Amb35789118 [1,1,0,0,0,0|1,0,0]=3 3631 B11R1.23 COC(=O)c1ccnc(C)n1 Amb20171561 [1,1,0,0,0,0|2,0,0]=4 3632 B11R1.23 COC(=O)c1ccnc(Cl)c1 Amb4477428 [1,1,0,0,0,0|1,0,0]=3 3633 B11R1.23 COC(=O)c1ccnc(Cl)n1 Amb33544512 [1,1,0,0,0,0|2,0,0]=4 3634 B11R1.23 COC(=O)c1ccnc(F)c1 Amb16231929 [1,1,0,0,0,0|1,0,0]=3 3635 B11R1.23 COC(=O)c1ccnc(F)n1 Amb25249346 [1,1,0,0,0,0|2,0,0]=4 3636 B11R1.23 COC(=O)c1ccnc(I)c1 Amb6565067 [1,1,0,0,0,0|1,0,0]=3 3637 B11R1.23 COC(=O)c1ccnc(N)c1 Amb842441 [1,1,0,0,0,0|1,0,0]=3 3638 B11R1.23 COC(=O)c1ccnc(N)n1 Amb22275936 [1,1,0,0,0,0|2,0,0]=4 3639 B11R1.23 COC(=O)c1ccnc(O)c1 Amb22741052 [1,1,0,0,0,0|1,0,0]=3 3640 B11R1.23 COC(=O)c1ccnc(O)c1 Amb35749332 [1,1,0,0,0,0|1,0,0]=3 3641 B11R1.23 COC(=O)c1ccnc(S)c1 Amb2612003 [1,1,0,0,0,0|1,0,0]=3 3642 B11R1.23 COC(=O)c1cncc(Br)c1 Amb2446343 [1,1,0,0,0,0|1,0,0]=3 3643 B11R1.23 COC(=O)c1cncc(Br)n1 Amb19958092 [1,1,0,0,0,0|2,0,0]=4 3644 B11R1.23 COC(=O)c1cncc(C)c1 Amb2689445 [1,1,0,0,0,0|1,0,0]=3 3645 B11R1.23 COC(=O)c1cncc(C)n1 Amb22236001 [1,1,0,0,0,0|2,0,0]=4 3646 B11R1.23 COC(=O)c1cncc(Cl)c1 Amb10603998 [1,1,0,0,0,0|1,0,0]=3 3647 B11R1.23 COC(=O)c1cncc(Cl)n1 Amb10067228 [1,1,0,0,0,0|2,0,0]=4 3648 B11R1.23 COC(=O)c1cncc(F)c1 Amb10606907 [1,1,0,0,0,0|1,0,0]=3 3649 B11R1.23 COC(=O)c1cncc(F)n1 Amb32676656 [1,1,0,0,0,0|2,0,0]=4 3650 B11R1.23 COC(=O)c1cncc(I)c1 Amb13887026 [1,1,0,0,0,0|1,0,0]=3 3651 B11R1.23 COC(=O)c1cncc(I)n1 Amb27791422 [1,1,0,0,0,0|2,0,0]=4 3652 B11R1.23 COC(=O)c1cncc(N)c1 Amb22756402 [1,1,0,0,0,0|1,0,0]=3 3653 B11R1.23 COC(=O)c1cncc(N)c1 Amb2695659 [1,1,0,0,0,0|1,0,0]=3 3654 B11R1.23 COC(=O)c1cncc(N)n1 Amb33544052 [1,1,0,0,0,0|2,0,0]=4 3655 B11R1.23 COC(=O)c1cncc(O)c1 Amb17739876 [1,1,0,0,0,0|1,0,0]=3 3656 B11R1.23 COC(=O)c1cncc(O)c1 Amb580916 [1,1,0,0,0,0|1,0,0]=3 3657 B11R1.23 COC(=O)c1cnnc(Cl)c1 Amb10604004 [1,1,0,0,0,0|2,0,0]=4 3658 B11R1.23 COC(=O)c1nccc(Br)n1 Amb22001872 [1,1,0,0,0,0|2,0,0]=4 3659 B11R1.23 COC(=O)c1nccc(C)n1 Amb21857157 [1,1,0,0,0,0|2,0,0]=4 3660 B11R1.23 COC(=O)c1nccc(Cl)n1 Amb20617427 [1,1,0,0,0,0|2,0,0]=4 3661 B11R1.23 COC(=O)c1nccc(F)n1 Amb26057594 [1,1,0,0,0,0|2,0,0]=4 3662 B11R1.23 COC(=O)c1nccc(N)n1 Amb10067821 [1,1,0,0,0,0|2,0,0]=4 3663 B11R1.23 COC(C)c1cccc(Br)c1 Amb25242655 [1,1,0,0,0,0|1,0,1]=4 3664 B11R1.23 COC(C)c1cccc(N)c1 Amb13952800 [1,1,0,0,0,0|1,0,1]=4 3665 B11R1.23 COC(O)c1cccc(Cl)c1 Amb27775876 [1,1,0,0,0,0|0,0,2]=4 3666 B11R1.23 COS(=O)c1cccc(Br)c1 Amb28368070 [1,1,0,0,0,0|1,0,0]=3 3667 B11R1.23 CSC(=N)c1cccc(Br)c1 Amb28061907 [1,1,0,0,0,0|1,1,0]=4 3668 B11R1.23 C[n+]1cccc(C(=O)CN)c1 Amb27429107 [1,1,0,0,0,0|2,0,0]=4 3669 B11R1.23 C\C=C(/C)c1cccc(F)c1 Amb25837290 [1,1,0,0,0,0|1,0,1]=4 3670 B11R1.23 C\C=C(/C)c1cccc(O)c1 Amb28074810 [1,1,0,0,0,0|1,0,1]=4 3671 B11R1.23 C\C=C(\C)c1cccc(F)c1 Amb26422978 [1,1,0,0,0,0|1,0,1]=4 3672 B11R1.23 Cc1cc(C(=O)CBr)ccn1 Amb27842062 [1,1,0,0,0,0|2,0,0]=4 3673 B11R1.23 Cc1cc(C(=O)CCl)ccn1 Amb24605579 [1,1,0,0,0,0|2,0,0]=4 3674 B11R1.23 Cc1cc(C(=O)CN)ccn1 Amb24106014 [1,1,0,0,0,0|2,0,0]=4 3675 B11R1.23 Cc1cccc(C(=O)C#N)c1 Amb17231995 [1,1,0,0,0,0|1,0,1]=4 3676 B11R1.23 Cc1cccc(C(=O)C=O)c1 Amb24055227 [1,1,0,0,0,0|1,0,1]=4 3677 B11R1.23 Cc1cccc(C(=O)CBr)c1 Amb5395410 [1,1,0,0,0,0|1,0,0]=3 3678 B11R1.23 Cc1cccc(C(=O)CCl)c1 Amb18806064 [1,1,0,0,0,0|1,0,0]=3 3679 B11R1.23 Cc1cccc(C(=O)CCl)n1 Amb24676223 [1,1,0,0,0,0|2,0,0]=4 3680 B11R1.23 Cc1cccc(C(=O)CF)c1 Amb24084129 [1,1,0,0,0,0|1,0,0]=3 3681 B11R1.23 Cc1cccc(C(=O)CN)c1 Amb10976904 [1,1,0,0,0,0|1,0,0]=3 3682 B11R1.23 Cc1cccc(C(=O)CN)c1 Amb20171473 [1,1,0,0,0,0|1,0,0]=3 3683 B11R1.23 Cc1cccc(C(=O)CN)n1 Amb25152776 [1,1,0,0,0,0|2,0,0]=4 3684 B11R1.23 Cc1cccc(C(=O)CO)c1 Amb18182731 [1,1,0,0,0,0|1,0,0]=3 3685 B11R1.23 Cc1cccc(C(=O)NN)c1 Amb6336466 [1,1,0,0,0,0|2,0,0]=4 3686 B11R1.23 Cc1cccc(C(=O)NO)c1 Amb6258947 [1,1,0,0,0,0|2,0,0]=4 3687 B11R1.23 Cc1cccc([PH](=O)CCl)c1 Amb28119868 [1,1,0,0,0,0|2,0,0]=4 3688 B11R1.23 Cc1ccnc(C(=O)CBr)c1 Amb24104033 [1,1,0,0,0,0|2,0,0]=4 3689 B11R1.23 Cc1ccnc(C(=O)CCl)c1 Amb33262614 [1,1,0,0,0,0|2,0,0]=4 3690 B11R1.23 Cc1ccnc(C(=O)CN)c1 Amb24564185 [1,1,0,0,0,0|2,0,0]=4 3691 B11R1.23 Cc1cncc(C(=O)CBr)c1 Amb33249663 [1,1,0,0,0,0|2,0,0]=4 3692 B11R1.23 Cc1cncc(C(=O)CCl)c1 Amb26543140 [1,1,0,0,0,0|2,0,0]=4 3693 B11R1.23 Cc1cncc(C(=O)CN)c1 Amb25800562 [1,1,0,0,0,0|2,0,0]=4 3694 B11R1.23 N#CC(=O)c1cccc(Br)c1 Amb22269768 [1,1,0,0,0,0|1,0,1]=4 3695 B11R1.23 N#CC(=O)c1cccc(Cl)c1 Amb6297070 [1,1,0,0,0,0|1,0,1]=4 3696 B11R1.23 N#CC(=O)c1cccc(F)c1 Amb17232049 [1,1,0,0,0,0|1,0,1]=4 3697 B11R1.23 NCC(=O)c1cc(Cl)ccn1 Amb28197150 [1,1,0,0,0,0|2,0,0]=4 3698 B11R1.23 NCC(=O)c1cc(F)ccn1 Amb33415311 [1,1,0,0,0,0|2,0,0]=4 3699 B11R1.23 NCC(=O)c1cc(N)ccn1 Amb27490821 [1,1,0,0,0,0|2,0,0]=4 3700 B11R1.23 NCC(=O)c1cccc(Br)c1 Amb18281391 [1,1,0,0,0,0|1,0,0]=3 3701 B11R1.23 NCC(=O)c1cccc(Br)c1 Amb2693526 [1,1,0,0,0,0|1,0,0]=3 3702 B11R1.23 NCC(=O)c1cccc(Br)n1 Amb25864894 [1,1,0,0,0,0|2,0,0]=4 3703 B11R1.23 NCC(=O)c1cccc(Cl)c1 Amb18951219 [1,1,0,0,0,0|1,0,0]=3 3704 B11R1.23 NCC(=O)c1cccc(Cl)c1 Amb2693527 [1,1,0,0,0,0|1,0,0]=3 3705 B11R1.23 NCC(=O)c1cccc(Cl)n1 Amb33223300 [1,1,0,0,0,0|2,0,0]=4 3706 B11R1.23 NCC(=O)c1cccc(F)c1 Amb10840040 [1,1,0,0,0,0|1,0,0]=3 3707 B11R1.23 NCC(=O)c1cccc(F)c1 Amb18951218 [1,1,0,0,0,0|1,0,0]=3 3708 B11R1.23 NCC(=O)c1cccc(N)c1 Amb27209101 [1,1,0,0,0,0|1,0,0]=3 3709 B11R1.23 NCC(=O)c1cccc(O)c1 Amb17593761 [1,1,0,0,0,0|1,0,0]=3 3710 B11R1.23 NCC(=O)c1cccc(O)c1 Amb33801517 [1,1,0,0,0,0|1,0,0]=3 3711 B11R1.23 NCC(=O)c1ccnc(Br)c1 Amb28421879 [1,1,0,0,0,0|2,0,0]=4 3712 B11R1.23 NCC(=O)c1cncc(Br)c1 Amb23586097 [1,1,0,0,0,0|2,0,0]=4 3713 B11R1.23 NCC(=O)c1cncc(Br)c1 Amb30584758 [1,1,0,0,0,0|2,0,0]=4 3714 B11R1.23 NCC(=O)c1cncc(F)c1 Amb27170605 [1,1,0,0,0,0|2,0,0]=4 3715 B11R1.23 NCC(=O)c1cncc(O)c1 Amb26339346 [1,1,0,0,0,0|2,0,0]=4 3716 B11R1.23 NCC(=O)c1cncc(O)c1 Amb33096750 [1,1,0,0,0,0|2,0,0]=4 3717 B11R1.23 NNC(=O)c1cccc(Br)c1 Amb1906809 [1,1,0,0,0,0|2,0,0]=4 3718 B11R1.23 NNC(=O)c1cccc(Cl)c1 Amb1207384 [1,1,0,0,0,0|2,0,0]=4 3719 B11R1.23 NNC(=O)c1cccc(F)c1 Amb1129033 [1,1,0,0,0,0|2,0,0]=4 3720 B11R1.23 NNC(=O)c1cccc(I)c1 Amb6402804 [1,1,0,0,0,0|2,0,0]=4 3721 B11R1.23 NNC(=O)c1cccc(N)c1 Amb2712415 [1,1,0,0,0,0|2,0,0]=4 3722 B11R1.23 NNC(=O)c1cccc(O)c1 Amb1208719 [1,1,0,0,0,0|2,0,0]=4 3723 B11R1.23 Nc1cc(C(=O)CBr)ccn1 Amb20670962 [1,1,0,0,0,0|2,0,0]=4 3724 B11R1.23 Nc1cccc(C(=O)CCl)c1 Amb27613503 [1,1,0,0,0,0|1,0,0]=3 3725 B11R1.23 O=C(CBr)c1cc(Cl)ccn1 Amb22728908 [1,1,0,0,0,0|2,0,0]=4 3726 B11R1.23 O=C(CBr)c1cc(F)ccn1 Amb25706118 [1,1,0,0,0,0|2,0,0]=4 3727 B11R1.23 O=C(CBr)c1cccc(Br)c1 Amb2685384 [1,1,0,0,0,0|1,0,0]=3 3728 B11R1.23 O=C(CBr)c1cccc(Br)n1 Amb22756086 [1,1,0,0,0,0|2,0,0]=4 3729 B11R1.23 O=C(CBr)c1cccc(Cl)c1 Amb1224657 [1,1,0,0,0,0|1,0,0]=3 3730 B11R1.23 O=C(CBr)c1cccc(F)c1 Amb33533061 [1,1,0,0,0,0|1,0,0]=3 3731 B11R1.23 O=C(CBr)c1cccc(F)n1 Amb27972816 [1,1,0,0,0,0|2,0,0]=4 3732 B11R1.23 O=C(CBr)c1cccc(I)c1 Amb1885036 [1,1,0,0,0,0|1,0,0]=3 3733 B11R1.23 O=C(CBr)c1cccc(O)c1 Amb1981340 [1,1,0,0,0,0|1,0,0]=3 3734 B11R1.23 O=C(CBr)c1ccnc(Cl)c1 Amb21964312 [1,1,0,0,0,0|2,0,0]=4 3735 B11R1.23 O=C(CBr)c1ccnc(Cl)c1 Amb6572113 [1,1,0,0,0,0|2,0,0]=4 3736 B11R1.23 O=C(CBr)c1ccnc(F)c1 Amb27480331 [1,1,0,0,0,0|2,0,0]=4 3737 B11R1.23 O=C(CBr)c1ccnc(F)c1 Amb33483993 [1,1,0,0,0,0|2,0,0]=4 3738 B11R1.23 O=C(CBr)c1cncc(Br)c1 Amb27866283 [1,1,0,0,0,0|2,0,0]=4 3739 B11R1.23 O=C(CBr)c1cncc(F)c1 Amb27395127 [1,1,0,0,0,0|2,0,0]=4 3740 B11R1.23 O=C(CBr)c1cncc(F)c1 Amb32652635 [1,1,0,0,0,0|2,0,0]=4 3741 B11R1.23 O=C(CCl)c1cc(Cl)ccn1 Amb25748945 [1,1,0,0,0,0|2,0,0]=4 3742 B11R1.23 O=C(CCl)c1cccc(Br)c1 Amb17345812 [1,1,0,0,0,0|1,0,0]=3 3743 B11R1.23 O=C(CCl)c1cccc(Br)n1 Amb33433531 [1,1,0,0,0,0|2,0,0]=4 3744 B11R1.23 O=C(CCl)c1cccc(Cl)c1 Amb8393232 [1,1,0,0,0,0|1,0,0]=3 3745 B11R1.23 O=C(CCl)c1cccc(Cl)n1 Amb24104205 [1,1,0,0,0,0|2,0,0]=4 3746 B11R1.23 O=C(CCl)c1cccc(F)c1 Amb10873159 [1,1,0,0,0,0|1,0,0]=3 3747 B11R1.23 O=C(CCl)c1ccnc(Cl)c1 Amb25101602 [1,1,0,0,0,0|2,0,0]=4 3748 B11R1.23 O=C(CCl)c1cncc(Br)c1 Amb27482864 [1,1,0,0,0,0|2,0,0]=4 3749 B11R1.23 O=C(CCl)c1cncc(F)c1 Amb26461867 [1,1,0,0,0,0|2,0,0]=4 3750 B11R1.23 O=C(CF)c1cc(Br)ccn1 Amb27589786 [1,1,0,0,0,0|2,0,0]=4 3751 B11R1.23 O=C(CF)c1cccc(Br)c1 Amb27786161 [1,1,0,0,0,0|1,0,0]=3 3752 B11R1.23 O=C(CF)c1cccc(Cl)c1 Amb25714827 [1,1,0,0,0,0|1,0,0]=3 3753 B11R1.23 O=C(CF)c1cccc(F)c1 Amb23454840 [1,1,0,0,0,0|1,0,0]=3 3754 B11R1.23 O=C(CI)c1cccc(F)c1 Amb33483673 [1,1,0,0,0,0|1,0,0]=3 3755 B11R1.23 O=C(CO)c1cccc(Br)c1 Amb24579747 [1,1,0,0,0,0|1,0,0]=3 3756 B11R1.23 O=C(CO)c1cccc(Cl)c1 Amb18185666 [1,1,0,0,0,0|1,0,0]=3 3757 B11R1.23 O=C(CO)c1cccc(F)c1 Amb18182894 [1,1,0,0,0,0|1,0,0]=3 3758 B11R1.23 O=C(CO)c1cccc(I)c1 Amb33623872 [1,1,0,0,0,0|1,0,0]=3 3759 B11R1.23 O=C(NO)c1cccc(Br)c1 Amb6275747 [1,1,0,0,0,0|2,0,0]=4 3760 B11R1.23 O=C(NO)c1cccc(Cl)c1 Amb6265167 [1,1,0,0,0,0|2,0,0]=4 3761 B11R1.23 O=C(NO)c1cccc(F)c1 Amb6267435 [1,1,0,0,0,0|2,0,0]=4 3762 B11R1.23 O=C(NO)c1cccc(O)c1 Amb6270436 [1,1,0,0,0,0|2,0,0]=4 3763 B11R1.23 O=C(OO)c1cccc(Cl)c1 Amb6365645 [1,1,0,0,0,0|1,0,0]=3 3764 B11R1.23 O=C(O[Na])c1cc(I)ccn1 Amb21955171 [1,1,0,0,0,0|2,0,0]=4 3765 B11R1.23 O=CC(=O)c1cccc(Br)c1 Amb10067951 [1,1,0,0,0,0|1,0,1]=4 3766 B11R1.23 O=CC(=O)c1cccc(Br)c1 Amb20671217 [1,1,0,0,0,0|1,0,1]=4 3767 B11R1.23 O=CC(=O)c1cccc(Cl)c1 Amb10067952 [1,1,0,0,0,0|1,0,1]=4 3768 B11R1.23 O=CC(=O)c1cccc(Cl)c1 Amb18126569 [1,1,0,0,0,0|1,0,1]=4 3769 B11R1.23 O=CC(=O)c1cccc(F)c1 Amb10605526 [1,1,0,0,0,0|1,0,1]=4 3770 B11R1.23 O=CC(=O)c1cccc(F)c1 Amb10982490 [1,1,0,0,0,0|1,0,1]=4 3771 B11R1.23 O=CC(=O)c1cccc(O)c1 Amb18125054 [1,1,0,0,0,0|1,0,1]=4 3772 B11R1.36 C=C(Br)C(=O)c1ccccc1 Amb25208336 [1,1,0,0,0,0|0,0,2]=4 3773 B11R1.36 C=C(C)C(=O)c1ccccc1 Amb17593661 [1,1,0,0,0,0|0,0,1]=3 3774 B11R1.36 C=C(C)C(=O)c1ccccn1 Amb27648526 [1,1,0,0,0,0|1,0,1]=4 3775 B11R1.36 C=C(C)C(=O)c1cccnc1 Amb25139926 [1,1,0,0,0,0|1,0,1]=4 3776 B11R1.36 C=C(C)C(=O)c1ccncc1 Amb24413658 [1,1,0,0,0,0|1,0,1]=4 3777 B11R1.36 C=C(Cl)C(=O)c1ccccc1 Amb28075337 [1,1,0,0,0,0|0,0,2]=4 3778 B11R1.36 C=C(c1ccccc1)C(C)C Amb27803525 [1,1,0,0,0,0|1,0,0]=3 3779 B11R1.36 C=C(c1ccccc1)C(C)Cl Amb27407746 [1,1,0,0,0,0|1,0,0]=3 3780 B11R1.36 CC(=O)C(=O)c1ccccc1 Amb2099500 [1,1,0,0,0,0|0,0,1]=3 3781 B11R1.36 CC(=O)C(=O)c1ccccn1 Amb26880304 [1,1,0,0,0,0|1,0,1]=4 3782 B11R1.36 CC(=O)C(=O)c1cccnc1 Amb25152863 [1,1,0,0,0,0|1,0,1]=4 3783 B11R1.36 CC(=O)C(=O)c1ccncc1 Amb26074229 [1,1,0,0,0,0|1,0,1]=4 3784 B11R1.36 CC(Br)C(=O)c1ccccc1 Amb9732279 [1,1,0,0,0,0|0,0,0]=2 3785 B11R1.36 CC(Br)C(=O)c1ccccn1 Amb22500042 [1,1,0,0,0,0|1,0,0]=3 3786 B11R1.36 CC(C)=C(C)c1ccccc1 Amb2780673 [1,1,0,0,0,0|1,0,1]=4 3787 B11R1.36 CC(C)C(=O)c1ccccc1 Amb4605986 [1,1,0,0,0,0|0,0,0]=2 3788 B11R1.36 CC(C)C(=O)c1ccccn1 Amb534902 [1,1,0,0,0,0|1,0,0]=3 3789 B11R1.36 CC(C)C(=O)c1cccnc1 Amb10607959 [1,1,0,0,0,0|1,0,0]=3 3790 B11R1.36 CC(C)C(=O)c1ccncc1 Amb19374024 [1,1,0,0,0,0|1,0,0]=3 3791 B11R1.36 CC(C)C(=O)c1cnccn1 Amb18179374 [1,1,0,0,0,0|2,0,0]=4 3792 B11R1.36 CC(C)C(Br)c1ccccc1 Amb20667915 [1,1,0,0,0,0|1,0,1]=4 3793 B11R1.36 CC(C)C(C)c1ccccc1 Amb4017389 [1,1,0,0,0,0|1,0,1]=4 3794 B11R1.36 CC(C)C(Cl)c1ccccc1 Amb17138646 [1,1,0,0,0,0|1,0,1]=4 3795 B11R1.36 CC(C)C(N)c1ccccc1 Amb22001648 [1,1,0,0,0,0|1,0,1]=4 3796 B11R1.36 CC(C)C(N)c1ccccc1 Amb9707459 [1,1,0,0,0,0|1,0,1]=4 3797 B11R1.36 CC(C)C(O)c1ccccc1 Amb9283581 [1,1,0,0,0,0|0,0,2]=4 3798 B11R1.36 CC(C)C(S)c1ccccc1 Amb18180117 [1,1,0,0,0,0|0,1,1]=4 3799 B11R1.36 CC(C)N(N)c1ccccc1 Amb18125185 [1,1,0,0,0,0|2,0,0]=4 3800 B11R1.36 CC(C)S(=O)c1ccccc1 Amb24484364 [1,1,0,0,0,0|1,0,0]=3 3801 B11R1.36 CC(C)[C@@H](C)c1ccccc1 Amb27445308 [1,1,0,0,0,0|1,0,1]=4 3802 B11R1.36 CC(C)[C@@H](N)c1ccccc1 Amb10608147 [1,1,0,0,0,0|1,0,1]=4 3803 B11R1.36 CC(C)[C@@H](N)c1ccccc1 Amb22288656 [1,1,0,0,0,0|1,0,1]=4 3804 B11R1.36 CC(C)[C@@H](O)c1ccccc1 Amb22225177 [1,1,0,0,0,0|0,0,2]=4 3805 B11R1.36 CC(C)[C@H](C)c1ccccc1 Amb27816366 [1,1,0,0,0,0|1,0,1]=4 3806 B11R1.36 CC(C)[C@H](N)c1ccccc1 Amb22284327 [1,1,0,0,0,0|1,0,1]=4 3807 B11R1.36 CC(C)[C@H](N)c1ccccc1 Amb22288702 [1,1,0,0,0,0|1,0,1]=4 3808 B11R1.36 CC(Cl)C(=O)c1ccccc1 Amb477908 [1,1,0,0,0,0|0,0,0]=2 3809 B11R1.36 CC(F)C(=O)c1ccccc1 Amb10603603 [1,1,0,0,0,0|0,0,0]=2 3810 B11R1.36 CC(N)C(=O)c1ccccc1 Amb6543419 [1,1,0,0,0,0|0,0,0]=2 3811 B11R1.36 CC(N)C(=O)c1ccccn1 Amb18201931 [1,1,0,0,0,0|1,0,0]=3 3812 B11R1.36 CC(N)C(=O)c1cccnc1 Amb18201928 [1,1,0,0,0,0|1,0,0]=3 3813 B11R1.36 CC(N)C(=O)c1ccncc1 Amb18201927 [1,1,0,0,0,0|1,0,0]=3 3814 B11R1.36 CC(N)C(=O)c1ccncn1 Amb33269323 [1,1,0,0,0,0|2,0,0]=4 3815 B11R1.36 CC(N)C(=O)c1cnccn1 Amb26911525 [1,1,0,0,0,0|2,0,0]=4 3816 B11R1.36 CC(N)C(=O)c1cncnc1 Amb25291754 [1,1,0,0,0,0|2,0,0]=4 3817 B11R1.36 CC(N)C(=O)c1ncccn1 Amb33270998 [1,1,0,0,0,0|2,0,0]=4 3818 B11R1.36 CC(N)C(C)c1ccccc1 Amb18125050 [1,1,0,0,0,0|1,0,1]=4 3819 B11R1.36 CC(N)C(N)c1ccccc1 Amb18644444 [1,1,0,0,0,0|1,0,1]=4 3820 B11R1.36 CC(N)C(O)c1ccccc1 Amb3940169 [1,1,0,0,0,0|0,0,2]=4 3821 B11R1.36 CC(N)C(O)c1ccccc1 Amb4037026 [1,1,0,0,0,0|0,0,2]=4 3822 B11R1.36 CC(N)[C@@H](O)c1ccccc1 Amb27242684 [1,1,0,0,0,0|0,0,2]=4 3823 B11R1.36 CC(N)[C@H](O)c1ccccc1 Amb26057134 [1,1,0,0,0,0|0,0,2]=4 3824 B11R1.36 CC(O)C(=O)c1ccccc1 Amb18799361 [1,1,0,0,0,0|0,0,0]=2 3825 B11R1.36 CC(O)C(=O)c1ccccn1 Amb26880601 [1,1,0,0,0,0|1,0,0]=3 3826 B11R1.36 CC(O)C(=O)c1cccnc1 Amb25712989 [1,1,0,0,0,0|1,0,0]=3 3827 B11R1.36 CC(O)C(=O)c1ccncc1 Amb28367025 [1,1,0,0,0,0|1,0,0]=3 3828 B11R1.36 CC(O)C(Br)c1ccccc1 Amb28241304 [1,1,0,0,0,0|1,0,1]=4 3829 B11R1.36 CC(O)C(C)c1ccccc1 Amb4020076 [1,1,0,0,0,0|1,0,1]=4 3830 B11R1.36 CC(O)C(N)c1ccccc1 Amb28960311 [1,1,0,0,0,0|1,0,1]=4 3831 B11R1.36 CC(O)C(N)c1ccccc1 Amb8854990 [1,1,0,0,0,0|1,0,1]=4 3832 B11R1.36 CC(S)C(=O)c1ccccc1 Amb25142605 [1,1,0,0,0,0|0,0,0]=2 3833 B11R1.36 CC(S)C(=O)c1ccccn1 Amb27828931 [1,1,0,0,0,0|1,0,0]=3 3834 B11R1.36 CC(c1ccccc1)[C@@H](C)N Amb33081804 [1,1,0,0,0,0|1,0,1]=4 3835 B11R1.36 CC(c1ccccc1)[C@@H](C)O Amb26461660 [1,1,0,0,0,0|1,0,1]=4 3836 B11R1.36 CC(c1ccccc1)[C@H](C)N Amb29867823 [1,1,0,0,0,0|1,0,1]=4 3837 B11R1.36 CC(c1ccccc1)[C@H](C)O Amb4018956 [1,1,0,0,0,0|1,0,1]=4 3838 B11R1.36 CN(C)C(=N)c1ccccc1 Amb23447126 [1,1,0,0,0,0|2,0,0]=4 3839 B11R1.36 CN(C)C(=O)c1ccccc1 Amb33513268 [1,1,0,0,0,0|1,0,0]=3 3840 B11R1.36 CN(C)C(=O)c1ccccc1 Amb3886594 [1,1,0,0,0,0|1,0,0]=3 3841 B11R1.36 CN(C)C(=O)c1cccnc1 Amb3886597 [1,1,0,0,0,0|2,0,0]=4 3842 B11R1.36 CN(C)C(=O)c1ccncc1 Amb8343640 [1,1,0,0,0,0|2,0,0]=4 3843 B11R1.36 CN(C)C(=S)c1ccccc1 Amb2733763 [1,1,0,0,0,0|1,1,0]=4 3844 B11R1.36 CN(N)C(=N)c1ccccc1 Amb10870953 [1,1,0,0,0,0|2,0,0]=4 3845 B11R1.36 CN(N)C(=O)c1ccccc1 Amb18125146 [1,1,0,0,0,0|1,0,0]=3 3846 B11R1.36 CN(N)C(=O)c1ccccn1 Amb27238080 [1,1,0,0,0,0|2,0,0]=4 3847 B11R1.36 CN(N)C(=O)c1cccnc1 Amb839670 [1,1,0,0,0,0|2,0,0]=4 3848 B11R1.36 CN(N)C(=S)c1ccccc1 Amb26880376 [1,1,0,0,0,0|1,1,0]=4 3849 B11R1.36 CN(O)C(=O)c1ccccc1 Amb25082592 [1,1,0,0,0,0|1,0,0]=3 3850 B11R1.36 CN(O)C(=O)c1ccccn1 Amb10572675 [1,1,0,0,0,0|2,0,0]=4 3851 B11R1.36 CN(O)C(=O)c1ccncc1 Amb27949143 [1,1,0,0,0,0|2,0,0]=4 3852 B11R1.36 C[C@@H](Br)C(=O)c1ccccc1 Amb27176347 [1,1,0,0,0,0|0,0,0]=2 3853 B11R1.36 C[C@@H](Cl)[C@H](Cl)c1ccccc1 Amb28396543 [1,1,0,0,0,0|1,0,1]=4 3854 B11R1.36 C[C@@H](N)C(=O)c1ccccc1 Amb25757602 [1,1,0,0,0,0|0,0,0]=2 3855 B11R1.36 C[C@@H](N)C(=O)c1cccnc1 Amb30024811 [1,1,0,0,0,0|1,0,0]=3 3856 B11R1.36 C[C@@H](N)C(=O)c1cnccn1 Amb30024812 [1,1,0,0,0,0|2,0,0]=4 3857 B11R1.36 C[C@@H](N)C(=O)c1cncnc1 Amb30024813 [1,1,0,0,0,0|2,0,0]=4 3858 B11R1.36 C[C@@H](N)C(O)c1ccccc1 Amb27753037 [1,1,0,0,0,0|0,0,2]=4 3859 B11R1.36 C[C@@H](N)[C@@H](F)c1ccccc1 Amb27232785 [1,1,0,0,0,0|1,0,1]=4 3860 B11R1.36 C[C@@H](N)[C@H](F)c1ccccc1 Amb27858730 [1,1,0,0,0,0|1,0,1]=4 3861 B11R1.36 C[C@@H](N)[C@H](S)c1ccccc1 Amb27626864 [1,1,0,0,0,0|0,1,1]=4 3862 B11R1.36 C[C@@H](O)[C@@H](F)c1ccccc1 Amb27664239 [1,1,0,0,0,0|1,0,1]=4 3863 B11R1.36 C[C@@H](c1ccccc1)[C@@H](C)N Amb27253730 [1,1,0,0,0,0|1,0,1]=4 3864 B11R1.36 C[C@@H](c1ccccc1)[C@@H](C)O Amb28256055 [1,1,0,0,0,0|1,0,1]=4 3865 B11R1.36 C[C@H](Br)C(=O)c1ccccc1 Amb25689646 [1,1,0,0,0,0|0,0,0]=2 3866 B11R1.36 C[C@H](Cl)[C@@H](F)c1ccccc1 Amb27955187 [1,1,0,0,0,0|1,0,1]=4 3867 B11R1.36 C[C@H](F)[C@@H](O)c1ccccc1 Amb27220177 [1,1,0,0,0,0|0,0,2]=4 3868 B11R1.36 C[C@H](N)C(=O)c1cccnc1 Amb33131781 [1,1,0,0,0,0|1,0,0]=3 3869 B11R1.36 C[C@H](N)C(=O)c1cnccn1 Amb33131783 [1,1,0,0,0,0|2,0,0]=4 3870 B11R1.36 C[C@H](N)C(=O)c1cncnc1 Amb33131784 [1,1,0,0,0,0|2,0,0]=4 3871 B11R1.36 C[C@H](N)C(O)c1ccccc1 Amb27659372 [1,1,0,0,0,0|0,0,2]=4 3872 B11R1.36 C[C@H](N)[C@@H](Br)c1ccccc1 Amb27205248 [1,1,0,0,0,0|1,0,1]=4 3873 B11R1.36 C[C@H](N)[C@@H](O)c1ccccc1 Amb17619646 [1,1,0,0,0,0|0,0,2]=4 3874 B11R1.36 C[C@H](N)[C@H](C)c1ccccc1 Amb28365429 [1,1,0,0,0,0|1,0,1]=4 3875 B11R1.36 C[C@H](N)[C@H](N)c1ccccc1 Amb27772031 [1,1,0,0,0,0|1,0,1]=4 3876 B11R1.36 C[C@H](N)[C@H](O)c1ccccc1 Amb3939345 [1,1,0,0,0,0|0,0,2]=4 3877 B11R1.36 C[C@H](O)[C@@H](C)c1ccccc1 Amb16210577 [1,1,0,0,0,0|1,0,1]=4 3878 B11R1.36 C[C@H](O)[C@@H](N)c1ccccc1 Amb25791116 [1,1,0,0,0,0|1,0,1]=4 3879 B11R1.36 C[C@H](O)[C@H](Br)c1ccccc1 Amb27390103 [1,1,0,0,0,0|1,0,1]=4 3880 B11R1.36 C[C@H](O)[C@H](N)c1ccccc1 Amb33872242 [1,1,0,0,0,0|1,0,1]=4 3881 B11R1.36 C[C@H](O)[C@H](O)c1ccccc1 Amb25362712 [1,1,0,0,0,0|0,0,2]=4 3882 B11R1.36 C\C(Br)=C(/C)c1ccccc1 Amb4035425 [1,1,0,0,0,0|1,0,1]=4 3883 B11R1.36 C\[N+]([O-])=C(/N)c1ccccc1 Amb27949093 [1,1,0,0,0,0|2,0,0]=4 3884 B11R1.36 C\[N+]([O-])=C(\N)c1ccccc1 Amb33621249 [1,1,0,0,0,0|2,0,0]=4 3885 B11R1.36 N=C(N)C(=O)c1ccccc1 Amb27654024 [1,1,0,0,0,0|1,0,1]=4 3886 B11R1.36 NC(=O)C(=O)c1ccccc1 Amb18560879 [1,1,0,0,0,0|1,0,1]=4 3887 B11R1.36 NC(=S)C(=O)c1ccccc1 Amb6892994 [1,1,0,0,0,0|1,0,1]=4 3888 B11R1.36 O=C(O)C(=O)c1ccccc1 Amb2611302 [1,1,0,0,0,0|1,0,1]=4 3889 B11R1.36 O=C(O)C(=O)c1ccccc1 Amb33204525 [1,1,0,0,0,0|1,0,1]=4 3890 B11R1.36 O=C([O-])C(=O)c1ccccc1 Amb33204524 [1,1,0,0,0,0|1,0,1]=4 3891 B11R1.36 O=C(c1ccccc1)C(Br)Br Amb17940392 [1,1,0,0,0,0|1,0,0]=3 3892 B11R1.36 O=C(c1ccccc1)C(Cl)Cl Amb8513102 [1,1,0,0,0,0|1,0,0]=3 3893 B11R1.36 O=C(c1ccccc1)C(F)Br Amb24104059 [1,1,0,0,0,0|1,0,0]=3 3894 B11R1.36 O=C(c1ccccc1)C(F)F Amb9826858 [1,1,0,0,0,0|1,0,0]=3 3895 B11R1.36 O=C(c1ccccc1)C(O)Cl Amb24528115 [1,1,0,0,0,0|1,0,0]=3 3896 B11R1.36 O=C(c1ccccc1)C(O)O Amb8392241 [1,1,0,0,0,0|1,0,0]=3 3897 B11R1.36 O=C(c1ccccn1)C(Cl)Cl Amb25861197 [1,1,0,0,0,0|2,0,0]=4 3898 B11R1.36 O=C(c1ccccn1)C(F)F Amb10839623 [1,1,0,0,0,0|2,0,0]=4 3899 B11R1.36 O=C(c1ccncc1)C(F)F Amb22388666 [1,1,0,0,0,0|2,0,0]=4 3900 B11R1.36 O=S(c1ccccc1)C(F)Cl Amb27165780 [1,1,0,0,0,0|2,0,0]=4 3901 B11R1.222 C#CC(=O)c1ccccc1Br Amb27391927 [1,1,0,0,0,0|0,0,2]=4 3902 B11R1.222 C#CC(=O)c1ccccc1C Amb28399059 [1,1,0,0,0,0|0,0,2]=4 3903 B11R1.222 C#CC(=O)c1ccccc1Cl Amb25872974 [1,1,0,0,0,0|0,0,2]=4 3904 B11R1.222 C#CC(=O)c1ccccc1F Amb27868130 [1,1,0,0,0,0|0,0,2]=4 3905 B11R1.222 C#CC(=O)c1ccccc1N Amb24351123 [1,1,0,0,0,0|0,0,2]=4 3906 B11R1.222 C=C(CBr)c1ccccc1Br Amb33388003 [1,1,0,0,0,0|2,0,0]=4 3907 B11R1.222 C=C(CBr)c1ccccc1C Amb8391742 [1,1,0,0,0,0|2,0,0]=4 3908 B11R1.222 C=C(CBr)c1ccccc1Cl Amb33451369 [1,1,0,0,0,0|2,0,0]=4 3909 B11R1.222 C=C(CBr)c1ccccc1F Amb33451577 [1,1,0,0,0,0|2,0,0]=4 3910 B11R1.222 C=C(CBr)c1ccccc1O Amb33334201 [1,1,0,0,0,0|2,0,0]=4 3911 B11R1.222 C=C(CCl)c1ccccc1Br Amb33388005 [1,1,0,0,0,0|2,0,0]=4 3912 B11R1.222 C=C(CCl)c1ccccc1C Amb28314273 [1,1,0,0,0,0|2,0,0]=4 3913 B11R1.222 C=C(CCl)c1ccccc1Cl Amb33052720 [1,1,0,0,0,0|2,0,0]=4 3914 B11R1.222 C=C(CCl)c1ccccc1F Amb33052794 [1,1,0,0,0,0|2,0,0]=4 3915 B11R1.222 C=C(CCl)c1ccccc1O Amb33262870 [1,1,0,0,0,0|2,0,0]=4 3916 B11R1.222 C=C(CN)c1ccccc1Br Amb33388495 [1,1,0,0,0,0|2,0,0]=4 3917 B11R1.222 C=C(CN)c1ccccc1C Amb18251307 [1,1,0,0,0,0|2,0,0]=4 3918 B11R1.222 C=C(CN)c1ccccc1Cl Amb18251924 [1,1,0,0,0,0|2,0,0]=4 3919 B11R1.222 C=C(CN)c1ccccc1F Amb18908418 [1,1,0,0,0,0|2,0,0]=4 3920 B11R1.222 C=C(CN)c1ccccc1O Amb33196166 [1,1,0,0,0,0|2,0,0]=4 3921 B11R1.222 C=CC(=O)c1ccccc1Br Amb26333627 [1,1,0,0,0,0|0,0,2]=4 3922 B11R1.222 C=CC(=O)c1ccccc1C Amb28144593 [1,1,0,0,0,0|0,0,2]=4 3923 B11R1.222 C=CC(=O)c1ccccc1Cl Amb25307612 [1,1,0,0,0,0|0,0,2]=4 3924 B11R1.222 C=CC(=O)c1ccccc1F Amb27883395 [1,1,0,0,0,0|0,0,2]=4 3925 B11R1.222 C=CC(=O)c1ccccc1N Amb26987473 [1,1,0,0,0,0|0,0,2]=4 3926 B11R1.222 C=CC(=O)c1ccccc1O Amb17593686 [1,1,0,0,0,0|0,0,2]=4 3927 B11R1.222 CCC(=O)C1=CC=CNC1=O Amb35744761 [1,1,0,0,0,0|1,0,0]=3 3928 B11R1.222 CCC(=O)c1ccccc1Br Amb17339933 [1,1,0,0,0,0|0,0,0]=2 3929 B11R1.222 CCC(=O)c1ccccc1C Amb16185657 [1,1,0,0,0,0|0,0,0]=2 3930 B11R1.222 CCC(=O)c1ccccc1Cl Amb17198735 [1,1,0,0,0,0|0,0,0]=2 3931 B11R1.222 CCC(=O)c1ccccc1F Amb4605916 [1,1,0,0,0,0|0,0,0]=2 3932 B11R1.222 CCC(=O)c1ccccc1I Amb26353010 [1,1,0,0,0,0|0,0,0]=2 3933 B11R1.222 CCC(=O)c1ccccc1N Amb1772753 [1,1,0,0,0,0|0,0,0]=2 3934 B11R1.222 CCC(=O)c1ccccc1O Amb1210123 [1,1,0,0,0,0|0,0,0]=2 3935 B11R1.222 CCC(=O)c1cccnc1C Amb28041295 [1,1,0,0,0,0|1,0,0]=3 3936 B11R1.222 CCC(=O)c1cccnc1Cl Amb10976561 [1,1,0,0,0,0|1,0,0]=3 3937 B11R1.222 CCC(=O)c1cccnc1F Amb25723783 [1,1,0,0,0,0|1,0,0]=3 3938 B11R1.222 CCC(=O)c1cccnc1N Amb8386846 [1,1,0,0,0,0|1,0,0]=3 3939 B11R1.222 CCC(=O)c1ccncc1C Amb28062284 [1,1,0,0,0,0|1,0,0]=3 3940 B11R1.222 CCC(=O)c1ccncc1F Amb23455228 [1,1,0,0,0,0|1,0,0]=3 3941 B11R1.222 CCC(=O)c1ccncc1N Amb23401919 [1,1,0,0,0,0|1,0,0]=3 3942 B11R1.222 CCC(=O)c1cnccc1Cl Amb27781101 [1,1,0,0,0,0|1,0,0]=3 3943 B11R1.222 CCC(=O)c1cnccc1N Amb25293482 [1,1,0,0,0,0|1,0,0]=3 3944 B11R1.222 CCC(=O)c1cncnc1C Amb27217552 [1,1,0,0,0,0|2,0,0]=4 3945 B11R1.222 CCC(=O)c1ncccc1C Amb28251777 [1,1,0,0,0,0|1,0,0]=3 3946 B11R1.222 CCC(=O)c1ncccc1F Amb23412453 [1,1,0,0,0,0|1,0,0]=3 3947 B11R1.222 CCC(=O)c1ncccc1N Amb24433161 [1,1,0,0,0,0|1,0,0]=3 3948 B11R1.222 CCC(=O)c1ncncc1Br Amb23455705 [1,1,0,0,0,0|2,0,0]=4 3949 B11R1.222 CCC(Br)c1ccccc1F Amb25990504 [1,1,0,0,0,0|1,0,1]=4 3950 B11R1.222 CCC(C)c1ccccc1Br Amb20617128 [1,1,0,0,0,0|1,0,1]=4 3951 B11R1.222 CCC(C)c1ccccc1C Amb28455793 [1,1,0,0,0,0|1,0,1]=4 3952 B11R1.222 CCC(C)c1ccccc1Cl Amb27635396 [1,1,0,0,0,0|1,0,1]=4 3953 B11R1.222 CCC(C)c1ccccc1F Amb26891261 [1,1,0,0,0,0|1,0,1]=4 3954 B11R1.222 CCC(C)c1ccccc1I Amb24564175 [1,1,0,0,0,0|1,0,1]=4 3955 B11R1.222 CCC(C)c1ccccc1N Amb9756155 [1,1,0,0,0,0|1,0,1]=4 3956 B11R1.222 CCC(C)c1ccccc1O Amb3939542 [1,1,0,0,0,0|1,0,1]=4 3957 B11R1.222 CCC(C)c1ccccc1S Amb27451633 [1,1,0,0,0,0|1,0,1]=4 3958 B11R1.222 CCC(Cl)c1ccccc1Cl Amb27402010 [1,1,0,0,0,0|1,0,1]=4 3959 B11R1.222 CCC(N)c1ccccc1Br Amb18966096 [1,1,0,0,0,0|1,0,1]=4 3960 B11R1.222 CCC(N)c1ccccc1C Amb17232057 [1,1,0,0,0,0|1,0,1]=4 3961 B11R1.222 CCC(N)c1ccccc1Cl Amb17232736 [1,1,0,0,0,0|1,0,1]=4 3962 B11R1.222 CCC(N)c1ccccc1Cl Amb22276945 [1,1,0,0,0,0|1,0,1]=4 3963 B11R1.222 CCC(N)c1ccccc1F Amb10840595 [1,1,0,0,0,0|1,0,1]=4 3964 B11R1.222 CCC(N)c1ccccc1F Amb30982522 [1,1,0,0,0,0|1,0,1]=4 3965 B11R1.222 CCC(N)c1ccccc1O Amb1118100 [1,1,0,0,0,0|1,0,1]=4 3966 B11R1.222 CCC(N)c1ccccc1O Amb19404313 [1,1,0,0,0,0|1,0,1]=4 3967 B11R1.222 CCC(O)c1ccccc1Br Amb26598101 [1,1,0,0,0,0|0,0,2]=4 3968 B11R1.222 CCC(O)c1ccccc1C Amb17232069 [1,1,0,0,0,0|0,0,2]=4 3969 B11R1.222 CCC(O)c1ccccc1Cl Amb17232794 [1,1,0,0,0,0|0,0,2]=4 3970 B11R1.222 CCC(O)c1ccccc1F Amb6298273 [1,1,0,0,0,0|0,0,2]=4 3971 B11R1.222 CCC(O)c1ccccc1O Amb1111067 [1,1,0,0,0,0|0,0,2]=4 3972 B11R1.222 CCC(S)c1ccccc1F Amb25920899 [1,1,0,0,0,0|0,1,1]=4 3973 B11R1.222 CCC(S)c1ccccc1O Amb7784755 [1,1,0,0,0,0|0,1,1]=4 3974 B11R1.222 CCN(C)c1ccccc1Br Amb28207106 [1,1,0,0,0,0|2,0,0]=4 3975 B11R1.222 CCN(C)c1ccccc1C Amb27806082 [1,1,0,0,0,0|2,0,0]=4 3976 B11R1.222 CCN(C)c1ccccc1Cl Amb28281916 [1,1,0,0,0,0|2,0,0]=4 3977 B11R1.222 CCN(C)c1ccccc1F Amb28065028 [1,1,0,0,0,0|2,0,0]=4 3978 B11R1.222 CCN(C)c1ccccc1N Amb33526915 [1,1,0,0,0,0|2,0,0]=4 3979 B11R1.222 CCN(N)c1ccccc1C Amb18125192 [1,1,0,0,0,0|2,0,0]=4 3980 B11R1.222 CCS(=O)c1ccccc1N Amb18955435 [1,1,0,0,0,0|1,0,0]=3 3981 B11R1.222 CCS(=O)c1ccncc1N Amb18284722 [1,1,0,0,0,0|2,0,0]=4 3982 B11R1.222 CC[C@@H](N)c1ccccc1C Amb22298520 [1,1,0,0,0,0|1,0,1]=4 3983 B11R1.222 CC[C@@H](N)c1ccccc1C Amb25335271 [1,1,0,0,0,0|1,0,1]=4 3984 B11R1.222 CC[C@@H](N)c1ccccc1Cl Amb28457747 [1,1,0,0,0,0|1,0,1]=4 3985 B11R1.222 CC[C@@H](N)c1ccccc1F Amb22288620 [1,1,0,0,0,0|1,0,1]=4 3986 B11R1.222 CC[C@@H](N)c1ccccc1F Amb27788276 [1,1,0,0,0,0|1,0,1]=4 3987 B11R1.222 CC[C@@H](N)c1ccccc1N Amb27590277 [1,1,0,0,0,0|1,0,1]=4 3988 B11R1.222 CC[C@@H](O)c1ccccc1Br Amb28318376 [1,1,0,0,0,0|0,0,2]=4 3989 B11R1.222 CC[C@@H](O)c1ccccc1C Amb27217839 [1,1,0,0,0,0|0,0,2]=4 3990 B11R1.222 CC[C@H](C)c1ccccc1N Amb28456473 [1,1,0,0,0,0|1,0,1]=4 3991 B11R1.222 CC[C@H](C)c1ccccc1O Amb28074773 [1,1,0,0,0,0|1,0,1]=4 3992 B11R1.222 CC[C@H](N)c1ccccc1C Amb25145851 [1,1,0,0,0,0|1,0,1]=4 3993 B11R1.222 CC[C@H](N)c1ccccc1Cl Amb22298557 [1,1,0,0,0,0|1,0,1]=4 3994 B11R1.222 CC[C@H](N)c1ccccc1F Amb22288682 [1,1,0,0,0,0|1,0,1]=4 3995 B11R1.222 CC[C@H](N)c1ccccc1F Amb27640236 [1,1,0,0,0,0|1,0,1]=4 3996 B11R1.222 CC[C@H](N)c1ccccc1I Amb27390094 [1,1,0,0,0,0|1,0,1]=4 3997 B11R1.222 CC[C@H](N)c1ccccc1N Amb27803863 [1,1,0,0,0,0|1,0,1]=4 3998 B11R1.222 CC[C@H](N)c1ccccc1S Amb28206137 [1,1,0,0,0,0|1,0,1]=4 3999 B11R1.222 CC[C@H](O)c1ccccc1Br Amb24447235 [1,1,0,0,0,0|0,0,2]=4 4000 B11R1.222 CC[C@H](O)c1ccccc1C Amb25884212 [1,1,0,0,0,0|0,0,2]=4 4001 B11R1.222 CC[C@H](O)c1ccccc1Cl Amb25188608 [1,1,0,0,0,0|0,0,2]=4 4002 B11R1.222 CC[C@H](O)c1ccccc1F Amb27161900 [1,1,0,0,0,0|0,0,2]=4 4003 B11R1.222 CNC(=N)c1ccccc1Cl Amb24509222 [1,1,0,0,0,0|2,0,0]=4 4004 B11R1.222 CNC(=N)c1ccccc1Cl Amb28652842 [1,1,0,0,0,0|2,0,0]=4 4005 B11R1.222 CNC(=O)C1=CNC=CC1=O Amb25980915 [1,1,0,0,0,0|2,0,0]=4 4006 B11R1.222 CNC(=O)c1ccccc1Br Amb2625865 [1,1,0,0,0,0|1,0,0]=3 4007 B11R1.222 CNC(=O)c1ccccc1C Amb2613120 [1,1,0,0,0,0|1,0,0]=3 4008 B11R1.222 CNC(=O)c1ccccc1I Amb2754649 [1,1,0,0,0,0|1,0,0]=3 4009 B11R1.222 CNC(=O)c1ccccc1N Amb6541338 [1,1,0,0,0,0|1,0,0]=3 4010 B11R1.222 CNC(=O)c1ccccc1N Amb6773994 [1,1,0,0,0,0|1,0,0]=3 4011 B11R1.222 CNC(=O)c1ccccc1O Amb534308 [1,1,0,0,0,0|1,0,0]=3 4012 B11R1.222 CNC(=O)c1cccnc1Br Amb28184490 [1,1,0,0,0,0|2,0,0]=4 4013 B11R1.222 CNC(=O)c1cccnc1Cl Amb6252044 [1,1,0,0,0,0|2,0,0]=4 4014 B11R1.222 CNC(=O)c1cccnc1N Amb16233797 [1,1,0,0,0,0|2,0,0]=4 4015 B11R1.222 CNC(=O)c1cccnc1O Amb18125363 [1,1,0,0,0,0|2,0,0]=4 4016 B11R1.222 CNC(=O)c1ccncc1Br Amb28074145 [1,1,0,0,0,0|2,0,0]=4 4017 B11R1.222 CNC(=O)c1ccncc1Cl Amb27976491 [1,1,0,0,0,0|2,0,0]=4 4018 B11R1.222 CNC(=O)c1ccncc1N Amb23556941 [1,1,0,0,0,0|2,0,0]=4 4019 B11R1.222 CNC(=O)c1cnccc1N Amb22263729 [1,1,0,0,0,0|2,0,0]=4 4020 B11R1.222 CNC(=O)c1ncccc1C Amb24413396 [1,1,0,0,0,0|2,0,0]=4 4021 B11R1.222 CNC(=O)c1ncccc1Cl Amb28127963 [1,1,0,0,0,0|2,0,0]=4 4022 B11R1.222 CNC(=S)c1ccccc1F Amb27412514 [1,1,0,0,0,0|1,1,0]=4 4023 B11R1.222 CNC(=S)c1ccccc1N Amb26845442 [1,1,0,0,0,0|1,1,0]=4 4024 B11R1.222 CNC(=S)c1ccccc1O Amb27215302 [1,1,0,0,0,0|1,1,0]=4 4025 B11R1.222 COC(=N)C1=CC=CNC1=O Amb19650675 [1,1,0,0,0,0|2,0,0]=4 4026 B11R1.222 COC(=N)c1ccccc1C Amb27146037 [1,1,0,0,0,0|1,0,0]=3 4027 B11R1.222 COC(=N)c1ccccc1Cl Amb18180241 [1,1,0,0,0,0|1,0,0]=3 4028 B11R1.222 COC(=N)c1ccccc1F Amb18065389 [1,1,0,0,0,0|1,0,0]=3 4029 B11R1.222 COC(=N)c1ccccc1O Amb25729105 [1,1,0,0,0,0|1,0,0]=3 4030 B11R1.222 COC(=N)c1cnccc1C Amb27832808 [1,1,0,0,0,0|2,0,0]=4 4031 B11R1.222 COC(=O)C1=C(Br)C=CCN1 Amb28365512 [1,1,0,0,0,0|1,0,1]=4 4032 B11R1.222 COC(=O)C1=C(C)NC=CC1 Amb27490951 [1,1,0,0,0,0|1,0,1]=4 4033 B11R1.222 COC(=O)C1=C(O)C=CCC1 Amb17593845 [1,1,0,0,0,0|0,0,2]=4 4034 B11R1.222 COC(=O)C1=CC=CNC1=O Amb19894701 [1,1,0,0,0,0|1,0,0]=3 4035 B11R1.222 COC(=O)C1=CC=CNC1=S Amb33551128 [1,1,0,0,0,0|1,0,0]=3 4036 B11R1.222 COC(=O)C1=CC=COC1=O Amb19894704 [1,1,0,0,0,0|1,0,0]=3 4037 B11R1.222 COC(=O)C1=CC=NNC1=O Amb21857256 [1,1,0,0,0,0|2,0,0]=4 4038 B11R1.222 COC(=O)C1=CN=CNC1=O Amb19887177 [1,1,0,0,0,0|2,0,0]=4 4039 B11R1.222 COC(=O)C1=COC=CC1=O Amb27658839 [1,1,0,0,0,0|1,0,0]=3 4040 B11R1.222 COC(=O)C1N=CC=CC1=N Amb34915821 [1,1,0,0,0,0|1,0,1]=4 4041 B11R1.222 COC(=O)C1OC=CC=C1O Amb27234013 [1,1,0,0,0,0|1,0,1]=4 4042 B11R1.222 COC(=O)c1cccc[n+]1C Amb27880886 [1,1,0,0,0,0|1,0,0]=3 4043 B11R1.222 COC(=O)c1cccc[n+]1[O-] Amb10573355 [1,1,0,0,0,0|1,0,0]=3 4044 B11R1.222 COC(=O)c1ccccc1Br Amb2725116 [1,1,0,0,0,0|0,0,0]=2 4045 B11R1.222 COC(=O)c1ccccc1C Amb2726227 [1,1,0,0,0,0|0,0,0]=2 4046 B11R1.222 COC(=O)c1ccccc1Cl Amb2700777 [1,1,0,0,0,0|0,0,0]=2 4047 B11R1.222 COC(=O)c1ccccc1F Amb2689434 [1,1,0,0,0,0|0,0,0]=2 4048 B11R1.222 COC(=O)c1ccccc1I Amb2689458 [1,1,0,0,0,0|0,0,0]=2 4049 B11R1.222 COC(=O)c1ccccc1N Amb1229837 [1,1,0,0,0,0|0,0,0]=2 4050 B11R1.222 COC(=O)c1ccccc1N Amb22741062 [1,1,0,0,0,0|0,0,0]=2 4051 B11R1.222 COC(=O)c1ccccc1O Amb1200750 [1,1,0,0,0,0|0,0,0]=2 4052 B11R1.222 COC(=O)c1ccccc1S Amb2689742 [1,1,0,0,0,0|0,0,0]=2 4053 B11R1.222 COC(=O)c1cccnc1Br Amb4561101 [1,1,0,0,0,0|1,0,0]=3 4054 B11R1.222 COC(=O)c1cccnc1C Amb8396132 [1,1,0,0,0,0|1,0,0]=3 4055 B11R1.222 COC(=O)c1cccnc1Cl Amb1241121 [1,1,0,0,0,0|1,0,0]=3 4056 B11R1.222 COC(=O)c1cccnc1F Amb8393046 [1,1,0,0,0,0|1,0,0]=3 4057 B11R1.222 COC(=O)c1cccnc1I Amb10070314 [1,1,0,0,0,0|1,0,0]=3 4058 B11R1.222 COC(=O)c1cccnc1N Amb1049688 [1,1,0,0,0,0|1,0,0]=3 4059 B11R1.222 COC(=O)c1cccnc1O Amb10601402 [1,1,0,0,0,0|1,0,0]=3 4060 B11R1.222 COC(=O)c1cccnc1S Amb22282222 [1,1,0,0,0,0|1,0,0]=3 4061 B11R1.222 COC(=O)c1cccnc1S Amb686046 [1,1,0,0,0,0|1,0,0]=3 4062 B11R1.222 COC(=O)c1ccncc1Br Amb10606114 [1,1,0,0,0,0|1,0,0]=3 4063 B11R1.222 COC(=O)c1ccncc1C Amb2694740 [1,1,0,0,0,0|1,0,0]=3 4064 B11R1.222 COC(=O)c1ccncc1Cl Amb8630940 [1,1,0,0,0,0|1,0,0]=3 4065 B11R1.222 COC(=O)c1ccncc1F Amb22411142 [1,1,0,0,0,0|1,0,0]=3 4066 B11R1.222 COC(=O)c1ccncc1I Amb10602323 [1,1,0,0,0,0|1,0,0]=3 4067 B11R1.222 COC(=O)c1ccncc1N Amb2440807 [1,1,0,0,0,0|1,0,0]=3 4068 B11R1.222 COC(=O)c1ccncc1O Amb33321485 [1,1,0,0,0,0|1,0,0]=3 4069 B11R1.222 COC(=O)c1ccncc1O Amb5559272 [1,1,0,0,0,0|1,0,0]=3 4070 B11R1.222 COC(=O)c1ccnnc1N Amb22523474 [1,1,0,0,0,0|2,0,0]=4 4071 B11R1.222 COC(=O)c1cnccc1Br Amb31204789 [1,1,0,0,0,0|1,0,0]=3 4072 B11R1.222 COC(=O)c1cnccc1C Amb16230838 [1,1,0,0,0,0|1,0,0]=3 4073 B11R1.222 COC(=O)c1cnccc1Cl Amb10603776 [1,1,0,0,0,0|1,0,0]=3 4074 B11R1.222 COC(=O)c1cnccc1Cl Amb19957887 [1,1,0,0,0,0|1,0,0]=3 4075 B11R1.222 COC(=O)c1cnccc1F Amb27974486 [1,1,0,0,0,0|1,0,0]=3 4076 B11R1.222 COC(=O)c1cnccc1I Amb26870074 [1,1,0,0,0,0|1,0,0]=3 4077 B11R1.222 COC(=O)c1cnccc1N Amb2697344 [1,1,0,0,0,0|1,0,0]=3 4078 B11R1.222 COC(=O)c1cnccc1O Amb2697989 [1,1,0,0,0,0|1,0,0]=3 4079 B11R1.222 COC(=O)c1cncnc1Br Amb22496090 [1,1,0,0,0,0|2,0,0]=4 4080 B11R1.222 COC(=O)c1cncnc1C Amb23401793 [1,1,0,0,0,0|2,0,0]=4 4081 B11R1.222 COC(=O)c1cncnc1Cl Amb22262999 [1,1,0,0,0,0|2,0,0]=4 4082 B11R1.222 COC(=O)c1cncnc1F Amb27192375 [1,1,0,0,0,0|2,0,0]=4 4083 B11R1.222 COC(=O)c1cncnc1N Amb19957748 [1,1,0,0,0,0|2,0,0]=4 4084 B11R1.222 COC(=O)c1cncnc1O Amb2699795 [1,1,0,0,0,0|2,0,0]=4 4085 B11R1.222 COC(=O)c1cnncc1C Amb22406186 [1,1,0,0,0,0|2,0,0]=4 4086 B11R1.222 COC(=O)c1cnncc1O Amb27636460 [1,1,0,0,0,0|2,0,0]=4 4087 B11R1.222 COC(=O)c1ncccc1Br Amb10975828 [1,1,0,0,0,0|1,0,0]=3 4088 B11R1.222 COC(=O)c1ncccc1C Amb16233270 [1,1,0,0,0,0|1,0,0]=3 4089 B11R1.222 COC(=O)c1ncccc1C Amb22886637 [1,1,0,0,0,0|1,0,0]=3 4090 B11R1.222 COC(=O)c1ncccc1Cl Amb19957514 [1,1,0,0,0,0|1,0,0]=3 4091 B11R1.222 COC(=O)c1ncccc1F Amb10602313 [1,1,0,0,0,0|1,0,0]=3 4092 B11R1.222 COC(=O)c1ncccc1I Amb2612017 [1,1,0,0,0,0|1,0,0]=3 4093 B11R1.222 COC(=O)c1ncccc1N Amb5720886 [1,1,0,0,0,0|1,0,0]=3 4094 B11R1.222 COC(=O)c1ncccc1O Amb2417381 [1,1,0,0,0,0|1,0,0]=3 4095 B11R1.222 COC(=O)c1ncccc1S Amb27171461 [1,1,0,0,0,0|1,0,0]=3 4096 B11R1.222 COC(=O)c1nccnc1Br Amb2797939 [1,1,0,0,0,0|2,0,0]=4 4097 B11R1.222 COC(=O)c1nccnc1C Amb21962549 [1,1,0,0,0,0|2,0,0]=4 4098 B11R1.222 COC(=O)c1nccnc1Cl Amb2696637 [1,1,0,0,0,0|2,0,0]=4 4099 B11R1.222 COC(=O)c1nccnc1F Amb26866309 [1,1,0,0,0,0|2,0,0]=4 4100 B11R1.222 COC(=O)c1nccnc1I Amb19958598 [1,1,0,0,0,0|2,0,0]=4 4101 B11R1.222 COC(=O)c1nccnc1N Amb1157799 [1,1,0,0,0,0|2,0,0]=4 4102 B11R1.222 COC(=O)c1nccnc1O Amb2695550 [1,1,0,0,0,0|2,0,0]=4 4103 B11R1.222 COC(=O)c1ncncc1Br Amb10603996 [1,1,0,0,0,0|2,0,0]=4 4104 B11R1.222 COC(=O)c1ncncc1C Amb27636420 [1,1,0,0,0,0|2,0,0]=4 4105 B11R1.222 COC(=O)c1ncncc1Cl Amb26655959 [1,1,0,0,0,0|2,0,0]=4 4106 B11R1.222 COC(=O)c1ncncc1F Amb28129857 [1,1,0,0,0,0|2,0,0]=4 4107 B11R1.222 COC(=O)c1ncncc1I Amb27171316 [1,1,0,0,0,0|2,0,0]=4 4108 B11R1.222 COC(=O)c1ncncc1N Amb27852807 [1,1,0,0,0,0|2,0,0]=4 4109 B11R1.222 COC(=S)c1ccccc1O Amb22232674 [1,1,0,0,0,0|0,1,0]=3 4110 B11R1.222 COC(C)c1ccccc1O Amb18125398 [1,1,0,0,0,0|1,0,1]=4 4111 B11R1.222 COC(O)c1ccccc1Cl Amb27651946 [1,1,0,0,0,0|0,0,2]=4 4112 B11R1.222 CON(C)c1ccccc1N Amb9492138 [1,1,0,0,0,0|2,0,0]=4 4113 B11R1.222 CSC(=N)c1ccccc1O Amb28122445 [1,1,0,0,0,0|1,1,0]=4 4114 B11R1.222 C\C=C(/C)c1ccccc1N Amb18124838 [1,1,0,0,0,0|1,0,1]=4 4115 B11R1.222 C\C=C(/C)c1ccccc1O Amb18124922 [1,1,0,0,0,0|1,0,1]=4 4116 B11R1.222 C\C=C(\C)c1ccccc1N Amb28422952 [1,1,0,0,0,0|1,0,1]=4 4117 B11R1.222 C\N=C(/C)c1ccccc1O Amb27591596 [1,1,0,0,0,0|2,0,0]=4 4118 B11R1.222 C\N=C(\C)c1ccccc1O Amb27426431 [1,1,0,0,0,0|2,0,0]=4 4119 B11R1.222 C\N=C(\F)c1ccccc1O Amb28132410 [1,1,0,0,0,0|2,0,0]=4 4120 B11R1.222 Cc1ccccc1C(=O)C#N Amb16231820 [1,1,0,0,0,0|1,0,1]=4 4121 B11R1.222 Cc1ccccc1C(=O)C=O Amb18124884 [1,1,0,0,0,0|1,0,1]=4 4122 B11R1.222 Cc1ccccc1C(=O)CBr Amb2792913 [1,1,0,0,0,0|1,0,0]=3 4123 B11R1.222 Cc1ccccc1C(=O)CCl Amb18185586 [1,1,0,0,0,0|1,0,0]=3 4124 B11R1.222 Cc1ccccc1C(=O)CF Amb25807621 [1,1,0,0,0,0|1,0,0]=3 4125 B11R1.222 Cc1ccccc1C(=O)CN Amb18281552 [1,1,0,0,0,0|1,0,0]=3 4126 B11R1.222 Cc1ccccc1C(=O)CN Amb2693529 [1,1,0,0,0,0|1,0,0]=3 4127 B11R1.222 Cc1ccccc1C(=O)CO Amb18182730 [1,1,0,0,0,0|1,0,0]=3 4128 B11R1.222 Cc1ccccc1C(=O)NN Amb6355883 [1,1,0,0,0,0|2,0,0]=4 4129 B11R1.222 Cc1ccccc1C(=O)NO Amb6278426 [1,1,0,0,0,0|2,0,0]=4 4130 B11R1.222 Cc1ccccc1C(=S)CBr Amb28348626 [1,1,0,0,0,0|1,1,0]=4 4131 B11R1.222 Cc1cccnc1C(=O)CCl Amb26477677 [1,1,0,0,0,0|2,0,0]=4 4132 B11R1.222 Cc1cccnc1C(=O)CN Amb26494369 [1,1,0,0,0,0|2,0,0]=4 4133 B11R1.222 Cc1ccncc1C(=O)CCl Amb24104195 [1,1,0,0,0,0|2,0,0]=4 4134 B11R1.222 Cc1ccncc1C(=O)CN Amb18201929 [1,1,0,0,0,0|2,0,0]=4 4135 B11R1.222 Cc1cnccc1C(=O)CCl Amb25080273 [1,1,0,0,0,0|2,0,0]=4 4136 B11R1.222 Cc1cnccc1C(=O)CN Amb33414527 [1,1,0,0,0,0|2,0,0]=4 4137 B11R1.222 Cc1ncccc1C(=O)CBr Amb24106265 [1,1,0,0,0,0|2,0,0]=4 4138 B11R1.222 Cc1ncccc1C(=O)CBr Amb32661632 [1,1,0,0,0,0|2,0,0]=4 4139 B11R1.222 Cc1ncccc1C(=O)CCl Amb24104158 [1,1,0,0,0,0|2,0,0]=4 4140 B11R1.222 Cc1ncccc1C(=O)CN Amb18201918 [1,1,0,0,0,0|2,0,0]=4 4141 B11R1.222 N#CC(=O)c1ccccc1Br Amb22269824 [1,1,0,0,0,0|1,0,1]=4 4142 B11R1.222 N#CC(=O)c1ccccc1Cl Amb6383873 [1,1,0,0,0,0|1,0,1]=4 4143 B11R1.222 N#CC(=O)c1ccccc1F Amb17232048 [1,1,0,0,0,0|1,0,1]=4 4144 B11R1.222 N#CC(=O)c1ccccc1I Amb22367991 [1,1,0,0,0,0|1,0,1]=4 4145 B11R1.222 N#CC(=O)c1ccccc1N Amb27487371 [1,1,0,0,0,0|1,0,1]=4 4146 B11R1.222 NCC(=O)c1ccccc1Br Amb10069326 [1,1,0,0,0,0|1,0,0]=3 4147 B11R1.222 NCC(=O)c1ccccc1Br Amb8383857 [1,1,0,0,0,0|1,0,0]=3 4148 B11R1.222 NCC(=O)c1ccccc1Cl Amb10069325 [1,1,0,0,0,0|1,0,0]=3 4149 B11R1.222 NCC(=O)c1ccccc1Cl Amb8383856 [1,1,0,0,0,0|1,0,0]=3 4150 B11R1.222 NCC(=O)c1ccccc1F Amb10840039 [1,1,0,0,0,0|1,0,0]=3 4151 B11R1.222 NCC(=O)c1ccccc1F Amb8383855 [1,1,0,0,0,0|1,0,0]=3 4152 B11R1.222 NCC(=O)c1ccccc1O Amb18125235 [1,1,0,0,0,0|1,0,0]=3 4153 B11R1.222 NCC(=O)c1ccccc1O Amb32664086 [1,1,0,0,0,0|1,0,0]=3 4154 B11R1.222 NCC(=O)c1ccccc1O Amb33801554 [1,1,0,0,0,0|1,0,0]=3 4155 B11R1.222 NCC(=O)c1cccnc1Br Amb25718599 [1,1,0,0,0,0|2,0,0]=4 4156 B11R1.222 NCC(=O)c1cccnc1Cl Amb27954551 [1,1,0,0,0,0|2,0,0]=4 4157 B11R1.222 NCC(=O)c1cccnc1Cl Amb32671339 [1,1,0,0,0,0|2,0,0]=4 4158 B11R1.222 NCC(=O)c1cccnc1F Amb24106012 [1,1,0,0,0,0|2,0,0]=4 4159 B11R1.222 NCC(=O)c1cccnc1N Amb28282757 [1,1,0,0,0,0|2,0,0]=4 4160 B11R1.222 NCC(=O)c1ccncc1Br Amb33389483 [1,1,0,0,0,0|2,0,0]=4 4161 B11R1.222 NCC(=O)c1ccncc1Cl Amb33413568 [1,1,0,0,0,0|2,0,0]=4 4162 B11R1.222 NCC(=O)c1ccncc1F Amb24680459 [1,1,0,0,0,0|2,0,0]=4 4163 B11R1.222 NCC(=O)c1cnccc1N Amb24586812 [1,1,0,0,0,0|2,0,0]=4 4164 B11R1.222 NCC(=O)c1ncccc1Br Amb33335701 [1,1,0,0,0,0|2,0,0]=4 4165 B11R1.222 NCC(=O)c1ncccc1Cl Amb24601329 [1,1,0,0,0,0|2,0,0]=4 4166 B11R1.222 NCC(=O)c1ncccc1Cl Amb30584717 [1,1,0,0,0,0|2,0,0]=4 4167 B11R1.222 NCC(=O)c1ncccc1F Amb25939616 [1,1,0,0,0,0|2,0,0]=4 4168 B11R1.222 NNC(=O)c1ccccc1Br Amb6366604 [1,1,0,0,0,0|2,0,0]=4 4169 B11R1.222 NNC(=O)c1ccccc1Cl Amb6335230 [1,1,0,0,0,0|2,0,0]=4 4170 B11R1.222 NNC(=O)c1ccccc1F Amb1104489 [1,1,0,0,0,0|2,0,0]=4 4171 B11R1.222 NNC(=O)c1ccccc1F Amb33313449 [1,1,0,0,0,0|2,0,0]=4 4172 B11R1.222 NNC(=O)c1ccccc1I Amb6317927 [1,1,0,0,0,0|2,0,0]=4 4173 B11R1.222 NNC(=O)c1ccccc1N Amb1775193 [1,1,0,0,0,0|2,0,0]=4 4174 B11R1.222 NNC(=O)c1ccccc1O Amb1796080 [1,1,0,0,0,0|2,0,0]=4 4175 B11R1.222 Nc1ccccc1C(=O)NO Amb3094175 [1,1,0,0,0,0|2,0,0]=4 4176 B11R1.222 Nc1ncccc1C(=O)CBr Amb17595839 [1,1,0,0,0,0|2,0,0]=4 4177 B11R1.222 O=C(CBr)C1=CC=CNC1=O Amb25149054 [1,1,0,0,0,0|2,0,0]=4 4178 B11R1.222 O=C(CBr)c1ccccc1Br Amb1106771 [1,1,0,0,0,0|1,0,0]=3 4179 B11R1.222 O=C(CBr)c1ccccc1Cl Amb2608538 [1,1,0,0,0,0|1,0,0]=3 4180 B11R1.222 O=C(CBr)c1ccccc1F Amb1106770 [1,1,0,0,0,0|1,0,0]=3 4181 B11R1.222 O=C(CBr)c1ccccc1I Amb22737619 [1,1,0,0,0,0|1,0,0]=3 4182 B11R1.222 O=C(CBr)c1ccccc1O Amb4418417 [1,1,0,0,0,0|1,0,0]=3 4183 B11R1.222 O=C(CBr)c1cccnc1Cl Amb24056345 [1,1,0,0,0,0|2,0,0]=4 4184 B11R1.222 O=C(CBr)c1ccncc1Br Amb25678043 [1,1,0,0,0,0|2,0,0]=4 4185 B11R1.222 O=C(CBr)c1ccncc1Br Amb33457416 [1,1,0,0,0,0|2,0,0]=4 4186 B11R1.222 O=C(CBr)c1ccncc1Cl Amb24087519 [1,1,0,0,0,0|2,0,0]=4 4187 B11R1.222 O=C(CBr)c1ccncc1Cl Amb25880646 [1,1,0,0,0,0|2,0,0]=4 4188 B11R1.222 O=C(CBr)c1ccncc1F Amb27487332 [1,1,0,0,0,0|2,0,0]=4 4189 B11R1.222 O=C(CBr)c1ccncc1F Amb32662583 [1,1,0,0,0,0|2,0,0]=4 4190 B11R1.222 O=C(CBr)c1cnccc1Br Amb27945478 [1,1,0,0,0,0|2,0,0]=4 4191 B11R1.222 O=C(CBr)c1ncccc1F Amb24377689 [1,1,0,0,0,0|2,0,0]=4 4192 B11R1.222 O=C(CBr)c1ncccc1F Amb31291121 [1,1,0,0,0,0|2,0,0]=4 4193 B11R1.222 O=C(CBr)c1ncccc1O Amb16233294 [1,1,0,0,0,0|2,0,0]=4 4194 B11R1.222 O=C(CBr)c1ncccc1O Amb27200266 [1,1,0,0,0,0|2,0,0]=4 4195 B11R1.222 O=C(CCl)c1ccccc1Cl Amb18330058 [1,1,0,0,0,0|1,0,0]=3 4196 B11R1.222 O=C(CCl)c1ccccc1F Amb18807753 [1,1,0,0,0,0|1,0,0]=3 4197 B11R1.222 O=C(CCl)c1ccccc1O Amb2209413 [1,1,0,0,0,0|1,0,0]=3 4198 B11R1.222 O=C(CCl)c1cccnc1Br Amb25949198 [1,1,0,0,0,0|2,0,0]=4 4199 B11R1.222 O=C(CCl)c1cccnc1Cl Amb24538128 [1,1,0,0,0,0|2,0,0]=4 4200 B11R1.222 O=C(CCl)c1cccnc1F Amb24736127 [1,1,0,0,0,0|2,0,0]=4 4201 B11R1.222 O=C(CCl)c1ccncc1Br Amb27403431 [1,1,0,0,0,0|2,0,0]=4 4202 B11R1.222 O=C(CCl)c1ccncc1Cl Amb26615709 [1,1,0,0,0,0|2,0,0]=4 4203 B11R1.222 O=C(CCl)c1ccncc1F Amb26887236 [1,1,0,0,0,0|2,0,0]=4 4204 B11R1.222 O=C(CCl)c1ncccc1Br Amb25105288 [1,1,0,0,0,0|2,0,0]=4 4205 B11R1.222 O=C(CCl)c1ncccc1F Amb25069387 [1,1,0,0,0,0|2,0,0]=4 4206 B11R1.222 O=C(CF)c1ccccc1Br Amb22489704 [1,1,0,0,0,0|1,0,0]=3 4207 B11R1.222 O=C(CF)c1ccccc1Cl Amb23454835 [1,1,0,0,0,0|1,0,0]=3 4208 B11R1.222 O=C(CF)c1ccccc1F Amb23454839 [1,1,0,0,0,0|1,0,0]=3 4209 B11R1.222 O=C(CF)c1cccnc1Cl Amb27602039 [1,1,0,0,0,0|2,0,0]=4 4210 B11R1.222 O=C(CO)c1ccccc1Br Amb24639690 [1,1,0,0,0,0|1,0,0]=3 4211 B11R1.222 O=C(CO)c1ccccc1Cl Amb18185665 [1,1,0,0,0,0|1,0,0]=3 4212 B11R1.222 O=C(CO)c1ccccc1F Amb18182895 [1,1,0,0,0,0|1,0,0]=3 4213 B11R1.222 O=C(CO)c1ccccc1I Amb33623873 [1,1,0,0,0,0|1,0,0]=3 4214 B11R1.222 O=C(CO)c1ccccc1O Amb18125347 [1,1,0,0,0,0|1,0,0]=3 4215 B11R1.222 O=C(NO)c1ccccc1Br Amb6269839 [1,1,0,0,0,0|2,0,0]=4 4216 B11R1.222 O=C(NO)c1ccccc1Cl Amb6259829 [1,1,0,0,0,0|2,0,0]=4 4217 B11R1.222 O=C(NO)c1ccccc1F Amb6269743 [1,1,0,0,0,0|2,0,0]=4 4218 B11R1.222 O=C(NO)c1ccccc1O Amb2504335 [1,1,0,0,0,0|2,0,0]=4 4219 B11R1.222 O=CC(=O)c1ccccc1Br Amb18131520 [1,1,0,0,0,0|1,0,1]=4 4220 B11R1.222 O=CC(=O)c1ccccc1Cl Amb18126568 [1,1,0,0,0,0|1,0,1]=4 4221 B11R1.222 O=CC(=O)c1ccccc1F Amb10838623 [1,1,0,0,0,0|1,0,1]=4 4222 B11R1.222 O=CC(=O)c1ccccc1F Amb22011841 [1,1,0,0,0,0|1,0,1]=4 4223 B11R1.222 O=CC(=O)c1ccccc1O Amb25269559 [1,1,0,0,0,0|1,0,1]=4 4224 B11R1.222 [Li]OC(=O)c1ccccc1O Amb3150540 [1,1,0,0,0,0|1,0,0]=3 4225 B11R1.1 BrC\C=C\c1ccc(Br)cc1 Amb28388511 [1,1,0,0,0,0|2,0,0]=4 4226 B11R1.1 CC=C=Cc1ccc(F)cc1 Amb27246329 [1,1,0,0,0,0|1,0,1]=4 4227 B11R1.1 CCC#Cc1ccc(Br)cc1 Amb25891498 [1,1,0,0,0,0|1,0,1]=4 4228 B11R1.1 CCC#Cc1ccc(C)cc1 Amb27855532 [1,1,0,0,0,0|1,0,1]=4 4229 B11R1.1 CCC#Cc1ccc(Cl)cc1 Amb26578625 [1,1,0,0,0,0|1,0,1]=4 4230 B11R1.1 CCC#Cc1ccc(F)cc1 Amb24730740 [1,1,0,0,0,0|1,0,1]=4 4231 B11R1.1 CCC#Cc1ccc(I)cc1 Amb26996265 [1,1,0,0,0,0|1,0,1]=4 4232 B11R1.1 CCC#Cc1ccc(N)cc1 Amb27960909 [1,1,0,0,0,0|1,0,1]=4 4233 B11R1.1 CCC#Cc1ccc(O)cc1 Amb26631449 [1,1,0,0,0,0|1,0,1]=4 4234 B11R1.1 CCCCc1ccc(Br)cc1 Amb3939176 [1,1,0,0,0,0|1,0,1]=4 4235 B11R1.1 CCCCc1ccc(C)cc1 Amb22002059 [1,1,0,0,0,0|1,0,1]=4 4236 B11R1.1 CCCCc1ccc(Cl)cc1 Amb6365908 [1,1,0,0,0,0|1,0,1]=4 4237 B11R1.1 CCCCc1ccc(F)cc1 Amb22730516 [1,1,0,0,0,0|1,0,1]=4 4238 B11R1.1 CCCCc1ccc(I)cc1 Amb2726236 [1,1,0,0,0,0|1,0,1]=4 4239 B11R1.1 CCCCc1ccc(N)cc1 Amb2721121 [1,1,0,0,0,0|1,0,1]=4 4240 B11R1.1 CCCCc1ccc(O)cc1 Amb2778508 [1,1,0,0,0,0|1,0,1]=4 4241 B11R1.1 CCCCc1ccc(S)cc1 Amb2685702 [1,1,0,0,0,0|1,0,1]=4 4242 B11R1.1 CCCNc1ccc(Br)cc1 Amb29083384 [1,1,0,0,0,0|2,0,0]=4 4243 B11R1.1 CCCNc1ccc(Br)cc1 Amb4313508 [1,1,0,0,0,0|2,0,0]=4 4244 B11R1.1 CCCNc1ccc(C)cc1 Amb4313501 [1,1,0,0,0,0|2,0,0]=4 4245 B11R1.1 CCCNc1ccc(Cl)cc1 Amb19407162 [1,1,0,0,0,0|2,0,0]=4 4246 B11R1.1 CCCNc1ccc(Cl)cc1 Amb4313503 [1,1,0,0,0,0|2,0,0]=4 4247 B11R1.1 CCCNc1ccc(F)cc1 Amb4313509 [1,1,0,0,0,0|2,0,0]=4 4248 B11R1.1 CCCNc1ccc(I)cc1 Amb7784946 [1,1,0,0,0,0|2,0,0]=4 4249 B11R1.1 CCCOc1ccc(Br)cc1 Amb3428588 [1,1,0,0,0,0|2,0,0]=4 4250 B11R1.1 CCCOc1ccc(C)cc1 Amb26409646 [1,1,0,0,0,0|2,0,0]=4 4251 B11R1.1 CCCOc1ccc(Cl)cc1 Amb25126411 [1,1,0,0,0,0|2,0,0]=4 4252 B11R1.1 CCCOc1ccc(N)cc1 Amb1125044 [1,1,0,0,0,0|2,0,0]=4 4253 B11R1.1 CCCOc1ccc(N)cc1 Amb32409662 [1,1,0,0,0,0|2,0,0]=4 4254 B11R1.1 CCCOc1ccc(O)cc1 Amb1810008 [1,1,0,0,0,0|2,0,0]=4 4255 B11R1.1 CCCOc1ccc(S)cc1 Amb25225762 [1,1,0,0,0,0|2,0,0]=4 4256 B11R1.1 CCCSc1ccc(Br)cc1 Amb28184382 [1,1,0,0,0,0|2,0,0]=4 4257 B11R1.1 CCCSc1ccc(C)cc1 Amb4035211 [1,1,0,0,0,0|2,0,0]=4 4258 B11R1.1 CCCSc1ccc(Cl)cc1 Amb27466470 [1,1,0,0,0,0|2,0,0]=4 4259 B11R1.1 CCCSc1ccc(F)cc1 Amb28365659 [1,1,0,0,0,0|2,0,0]=4 4260 B11R1.1 CCCSc1ccc(N)cc1 Amb22588114 [1,1,0,0,0,0|2,0,0]=4 4261 B11R1.1 CCCSc1ccc(N)cc1 Amb6680313 [1,1,0,0,0,0|2,0,0]=4 4262 B11R1.1 CCCSc1ccc(O)cc1 Amb18180159 [1,1,0,0,0,0|2,0,0]=4 4263 B11R1.1 CCCSc1ccc(S)cc1 Amb24362640 [1,1,0,0,0,0|2,0,0]=4 4264 B11R1.1 CCNCc1ccc(Br)cc1 Amb6864710 [1,1,0,0,0,0|1,0,1]=4 4265 B11R1.1 CCNCc1ccc(Br)cc1 Amb837745 [1,1,0,0,0,0|1,0,1]=4 4266 B11R1.1 CCNCc1ccc(C)cc1 Amb32667090 [1,1,0,0,0,0|1,0,1]=4 4267 B11R1.1 CCNCc1ccc(C)cc1 Amb837583 [1,1,0,0,0,0|1,0,1]=4 4268 B11R1.1 CCNCc1ccc(Cl)cc1 Amb6542591 [1,1,0,0,0,0|1,0,1]=4 4269 B11R1.1 CCNCc1ccc(Cl)cc1 Amb837762 [1,1,0,0,0,0|1,0,1]=4 4270 B11R1.1 CCNCc1ccc(F)cc1 Amb6864711 [1,1,0,0,0,0|1,0,1]=4 4271 B11R1.1 CCNCc1ccc(F)cc1 Amb838198 [1,1,0,0,0,0|1,0,1]=4 4272 B11R1.1 CCNCc1ccc(O)cc1 Amb13952053 [1,1,0,0,0,0|1,0,1]=4 4273 B11R1.1 CCNCc1ccc(O)cc1 Amb6257941 [1,1,0,0,0,0|1,0,1]=4 4274 B11R1.1 CCNCc1ccc(S)cc1 Amb27952729 [1,1,0,0,0,0|1,0,1]=4 4275 B11R1.1 CCOCc1ccc(Br)cc1 Amb19415022 [1,1,0,0,0,0|0,0,1]=3 4276 B11R1.1 CCOCc1ccc(C)cc1 Amb33733834 [1,1,0,0,0,0|0,0,1]=3 4277 B11R1.1 CCOCc1ccc(Cl)cc1 Amb25977812 [1,1,0,0,0,0|0,0,1]=3 4278 B11R1.1 CCOCc1ccc(Cl)nc1 Amb6250703 [1,1,0,0,0,0|1,0,1]=4 4279 B11R1.1 CCOCc1ccc(F)cc1 Amb30594745 [1,1,0,0,0,0|0,0,1]=3 4280 B11R1.1 CCOCc1ccc(N)cc1 Amb1125782 [1,1,0,0,0,0|0,0,1]=3 4281 B11R1.1 CCOCc1ccc(N)cn1 Amb35605374 [1,1,0,0,0,0|1,0,1]=4 4282 B11R1.1 CCOCc1ccc(N)nc1 Amb18295807 [1,1,0,0,0,0|1,0,1]=4 4283 B11R1.1 CCOCc1ccc(O)cc1 Amb18125402 [1,1,0,0,0,0|0,0,1]=3 4284 B11R1.1 CCSCc1ccc(Br)cc1 Amb25684606 [1,1,0,0,0,0|0,1,1]=4 4285 B11R1.1 CCSCc1ccc(C)cc1 Amb24536616 [1,1,0,0,0,0|0,1,1]=4 4286 B11R1.1 CCSCc1ccc(Cl)cc1 Amb24402210 [1,1,0,0,0,0|0,1,1]=4 4287 B11R1.1 CCSCc1ccc(F)cc1 Amb24486978 [1,1,0,0,0,0|0,1,1]=4 4288 B11R1.1 CCSCc1ccc(N)cc1 Amb6680506 [1,1,0,0,0,0|0,1,1]=4 4289 B11R1.1 CC\C=C/c1ccc(F)cc1 Amb24725207 [1,1,0,0,0,0|1,0,0]=3 4290 B11R1.1 CC\C=C\c1ccc(Br)cc1 Amb26968483 [1,1,0,0,0,0|1,0,0]=3 4291 B11R1.1 CC\C=C\c1ccc(C)nc1 Amb27952324 [1,1,0,0,0,0|2,0,0]=4 4292 B11R1.1 CC\N=C\c1ccc(O)cc1 Amb3777289 [1,1,0,0,0,0|1,0,0]=3 4293 B11R1.1 CN\N=C\c1ccc(Cl)cc1 Amb27484285 [1,1,0,0,0,0|2,0,0]=4 4294 B11R1.1 CN\N=C\c1ccc(F)cc1 Amb17805862 [1,1,0,0,0,0|2,0,0]=4 4295 B11R1.1 CN\N=C\c1ccc(O)cc1 Amb17696985 [1,1,0,0,0,0|2,0,0]=4 4296 B11R1.1 CO\N=C\c1ccc(Br)cc1 Amb28282446 [1,1,0,0,0,0|2,0,0]=4 4297 B11R1.1 CO\N=C\c1ccc(C)cc1 Amb27652457 [1,1,0,0,0,0|2,0,0]=4 4298 B11R1.1 CO\N=C\c1ccc(N)cc1 Amb27439385 [1,1,0,0,0,0|2,0,0]=4 4299 B11R1.1 Cc1ccc(COCCl)cc1 Amb27833050 [1,1,0,0,0,0|1,0,1]=4 4300 B11R1.1 Cc1ccc(\C=C\CCl)cc1 Amb26620547 [1,1,0,0,0,0|2,0,0]=4 4301 B11R1.1 Cc1ccc(\C=C\CN)cc1 Amb18563249 [1,1,0,0,0,0|2,0,0]=4 4302 B11R1.1 Cc1ccc(\C=C\CO)cc1 Amb23442829 [1,1,0,0,0,0|2,0,0]=4 4303 B11R1.1 Cc1ccc(\C=N\CO)cc1 Amb27598320 [1,1,0,0,0,0|2,0,0]=4 4304 B11R1.1 ClCOCc1ccc(Cl)cc1 Amb28458528 [1,1,0,0,0,0|1,0,1]=4 4305 B11R1.1 ClC\C=C\c1ccc(Br)cc1 Amb21926649 [1,1,0,0,0,0|2,0,0]=4 4306 B11R1.1 Clc1ccc(\C=C\CBr)cc1 Amb22007806 [1,1,0,0,0,0|2,0,0]=4 4307 B11R1.1 Fc1ccc(COCCl)cc1 Amb27436932 [1,1,0,0,0,0|1,0,1]=4 4308 B11R1.1 Fc1ccc(\C=C\CBr)cc1 Amb25923286 [1,1,0,0,0,0|2,0,0]=4 4309 B11R1.1 Fc1ccc(\C=C\CCl)cc1 Amb25074621 [1,1,0,0,0,0|2,0,0]=4 4310 B11R1.1 Fc1ccc(\C=C\CS)cc1 Amb33201386 [1,1,0,0,0,0|2,0,0]=4 4311 B11R1.1 NC\C=C\c1ccc(Br)cc1 Amb18066634 [1,1,0,0,0,0|2,0,0]=4 4312 B11R1.1 NC\C=C\c1ccc(Br)cc1 Amb30584648 [1,1,0,0,0,0|2,0,0]=4 4313 B11R1.1 NC\C=C\c1ccc(Cl)cc1 Amb18563824 [1,1,0,0,0,0|2,0,0]=4 4314 B11R1.1 NC\C=C\c1ccc(F)cc1 Amb18065348 [1,1,0,0,0,0|2,0,0]=4 4315 B11R1.1 NC\C=C\c1ccc(O)cc1 Amb33361954 [1,1,0,0,0,0|2,0,0]=4 4316 B11R1.1 OC\C=C\c1ccc(Br)cc1 Amb5559245 [1,1,0,0,0,0|2,0,0]=4 4317 B11R1.1 OC\C=C\c1ccc(Cl)cc1 Amb21964138 [1,1,0,0,0,0|2,0,0]=4 4318 B11R1.1 OC\C=C\c1ccc(F)cc1 Amb23442931 [1,1,0,0,0,0|2,0,0]=4 4319 B11R1.1 OC\C=C\c1ccc(O)cc1 Amb2445151 [1,1,0,0,0,0|2,0,0]=4 4320 B11R1.17 CCC#Cc1ccccc1Br Amb27879801 [1,1,0,0,0,0|1,0,1]=4 4321 B11R1.17 CCC#Cc1ccccc1C Amb25891559 [1,1,0,0,0,0|1,0,1]=4 4322 B11R1.17 CCC#Cc1ccccc1Cl Amb25198269 [1,1,0,0,0,0|1,0,1]=4 4323 B11R1.17 CCC#Cc1ccccc1F Amb26984263 [1,1,0,0,0,0|1,0,1]=4 4324 B11R1.17 CCC#Cc1ccccc1I Amb24447638 [1,1,0,0,0,0|1,0,1]=4 4325 B11R1.17 CCC#Cc1ccccc1N Amb24670207 [1,1,0,0,0,0|1,0,1]=4 4326 B11R1.17 CCC#Cc1ccccc1O Amb25320119 [1,1,0,0,0,0|1,0,1]=4 4327 B11R1.17 CCCCc1ccccc1Br Amb15690808 [1,1,0,0,0,0|1,0,1]=4 4328 B11R1.17 CCCCc1ccccc1C Amb25825024 [1,1,0,0,0,0|1,0,1]=4 4329 B11R1.17 CCCCc1ccccc1F Amb24426932 [1,1,0,0,0,0|1,0,1]=4 4330 B11R1.17 CCCCc1ccccc1I Amb25955656 [1,1,0,0,0,0|1,0,1]=4 4331 B11R1.17 CCCCc1ccccc1N Amb4037102 [1,1,0,0,0,0|1,0,1]=4 4332 B11R1.17 CCCCc1ccccc1O Amb25744605 [1,1,0,0,0,0|1,0,1]=4 4333 B11R1.17 CCCNc1ccccc1Br Amb6696451 [1,1,0,0,0,0|2,0,0]=4 4334 B11R1.17 CCCNc1ccccc1C Amb6701222 [1,1,0,0,0,0|2,0,0]=4 4335 B11R1.17 CCCNc1ccccc1Cl Amb4313502 [1,1,0,0,0,0|2,0,0]=4 4336 B11R1.17 CCCNc1ccccc1F Amb6697369 [1,1,0,0,0,0|2,0,0]=4 4337 B11R1.17 CCCNc1ccccc1N Amb440116 [1,1,0,0,0,0|2,0,0]=4 4338 B11R1.17 CCCOc1ccccc1Br Amb6267012 [1,1,0,0,0,0|2,0,0]=4 4339 B11R1.17 CCCOc1ccccc1F Amb21856719 [1,1,0,0,0,0|2,0,0]=4 4340 B11R1.17 CCCOc1ccccc1I Amb27171983 [1,1,0,0,0,0|2,0,0]=4 4341 B11R1.17 CCCOc1ccccc1N Amb1210617 [1,1,0,0,0,0|2,0,0]=4 4342 B11R1.17 CCCOc1ccccc1N Amb840073 [1,1,0,0,0,0|2,0,0]=4 4343 B11R1.17 CCCOc1ccccc1O Amb433886 [1,1,0,0,0,0|2,0,0]=4 4344 B11R1.17 CCCOc1ccccc1S Amb28399283 [1,1,0,0,0,0|2,0,0]=4 4345 B11R1.17 CCCSc1ccccc1Br Amb28046780 [1,1,0,0,0,0|2,0,0]=4 4346 B11R1.17 CCCSc1ccccc1Cl Amb25957434 [1,1,0,0,0,0|2,0,0]=4 4347 B11R1.17 CCCSc1ccccc1F Amb27752807 [1,1,0,0,0,0|2,0,0]=4 4348 B11R1.17 CCCSc1ccccc1N Amb22588094 [1,1,0,0,0,0|2,0,0]=4 4349 B11R1.17 CCCSc1ccccc1N Amb6276699 [1,1,0,0,0,0|2,0,0]=4 4350 B11R1.17 CCCSc1ccccc1S Amb26323053 [1,1,0,0,0,0|2,0,0]=4 4351 B11R1.17 CCNCc1ccccc1Br Amb28872271 [1,1,0,0,0,0|1,0,1]=4 4352 B11R1.17 CCNCc1ccccc1Br Amb6243296 [1,1,0,0,0,0|1,0,1]=4 4353 B11R1.17 CCNCc1ccccc1C Amb5785552 [1,1,0,0,0,0|1,0,1]=4 4354 B11R1.17 CCNCc1ccccc1C Amb6865250 [1,1,0,0,0,0|1,0,1]=4 4355 B11R1.17 CCNCc1ccccc1Cl Amb5785551 [1,1,0,0,0,0|1,0,1]=4 4356 B11R1.17 CCNCc1ccccc1Cl Amb6542581 [1,1,0,0,0,0|1,0,1]=4 4357 B11R1.17 CCNCc1ccccc1F Amb5785550 [1,1,0,0,0,0|1,0,1]=4 4358 B11R1.17 CCNCc1ccccc1F Amb6865249 [1,1,0,0,0,0|1,0,1]=4 4359 B11R1.17 CCNCc1ccccc1N Amb28973216 [1,1,0,0,0,0|1,0,1]=4 4360 B11R1.17 CCNCc1ccccc1N Amb7173571 [1,1,0,0,0,0|1,0,1]=4 4361 B11R1.17 CCNCc1ccccc1O Amb6257868 [1,1,0,0,0,0|1,0,1]=4 4362 B11R1.17 CCOCC1=CC=CNC1=O Amb27186324 [1,1,0,0,0,0|1,0,1]=4 4363 B11R1.17 CCOCN1C=CC=CC1=O Amb27461241 [1,1,0,0,0,0|1,0,1]=4 4364 B11R1.17 CCOCc1ccccc1Br Amb22227882 [1,1,0,0,0,0|0,0,1]=3 4365 B11R1.17 CCOCc1ccccc1N Amb6245712 [1,1,0,0,0,0|0,0,1]=3 4366 B11R1.17 CCOCc1ccccc1O Amb10560038 [1,1,0,0,0,0|0,0,1]=3 4367 B11R1.17 CCSCc1ccccc1Br Amb22228180 [1,1,0,0,0,0|0,1,1]=4 4368 B11R1.17 CCSCc1ccccc1Cl Amb25676288 [1,1,0,0,0,0|0,1,1]=4 4369 B11R1.17 CCSCc1ccccc1F Amb26622298 [1,1,0,0,0,0|0,1,1]=4 4370 B11R1.17 CC\C=C\c1ccccc1N Amb22751020 [1,1,0,0,0,0|1,0,0]=3 4371 B11R1.17 CC\C=C\c1ccccc1O Amb18124914 [1,1,0,0,0,0|1,0,0]=3 4372 B11R1.17 CC\N=C\c1ccccc1N Amb25991917 [1,1,0,0,0,0|1,0,0]=3 4373 B11R1.17 CN\N=C\c1ccccc1F Amb17704011 [1,1,0,0,0,0|2,0,0]=4 4374 B11R1.17 CO\C=C/c1ccccc1O Amb24485852 [1,1,0,0,0,0|2,0,0]=4 4375 B11R1.17 CO\C=C\c1ccccc1C Amb27804452 [1,1,0,0,0,0|2,0,0]=4 4376 B11R1.17 CO\C=C\c1ccccc1O Amb25715988 [1,1,0,0,0,0|2,0,0]=4 4377 B11R1.17 CO\N=C\c1ccccc1Br Amb28400546 [1,1,0,0,0,0|2,0,0]=4 4378 B11R1.17 CO\N=C\c1ccccc1I Amb27853303 [1,1,0,0,0,0|2,0,0]=4 4379 B11R1.17 CO\N=C\c1ccccc1N Amb24605335 [1,1,0,0,0,0|2,0,0]=4 4380 B11R1.17 CO\N=C\c1ccccc1O Amb25740232 [1,1,0,0,0,0|2,0,0]=4 4381 B11R1.17 CS\C=C/c1ccccc1O Amb28351599 [1,1,0,0,0,0|2,0,0]=4 4382 B11R1.17 Cc1ccccc1\C=C\CCl Amb27831983 [1,1,0,0,0,0|2,0,0]=4 4383 B11R1.17 Cc1ccccc1\C=C\CN Amb18065178 [1,1,0,0,0,0|2,0,0]=4 4384 B11R1.17 Cc1ccccc1\C=C\CO Amb23442935 [1,1,0,0,0,0|2,0,0]=4 4385 B11R1.17 ClC\C=C\c1ccccc1Cl Amb27592206 [1,1,0,0,0,0|2,0,0]=4 4386 B11R1.17 Clc1ccccc1\C=C\CBr Amb8392445 [1,1,0,0,0,0|2,0,0]=4 4387 B11R1.17 Fc1ccccc1COCCl Amb27654557 [1,1,0,0,0,0|1,0,1]=4 4388 B11R1.17 Fc1ccccc1\C=C\CCl Amb26495610 [1,1,0,0,0,0|2,0,0]=4 4389 B11R1.17 NC\C=C\c1ccccc1Br Amb18569373 [1,1,0,0,0,0|2,0,0]=4 4390 B11R1.17 NC\C=C\c1ccccc1Cl Amb18065473 [1,1,0,0,0,0|2,0,0]=4 4391 B11R1.17 NC\C=C\c1ccccc1F Amb18065347 [1,1,0,0,0,0|2,0,0]=4 4392 B11R1.17 NC\C=C\c1ccccc1O Amb27442155 [1,1,0,0,0,0|2,0,0]=4 4393 B11R1.17 Nc1ccccc1COCS Amb27659006 [1,1,0,0,0,0|1,0,1]=4 4394 B11R1.17 Nc1ccccc1\C=C\CO Amb34916231 [1,1,0,0,0,0|2,0,0]=4 4395 B11R1.17 OC\C=C\c1ccccc1Br Amb25149289 [1,1,0,0,0,0|2,0,0]=4 4396 B11R1.17 OC\C=C\c1ccccc1Cl Amb8392444 [1,1,0,0,0,0|2,0,0]=4 4397 B11R1.17 OC\C=C\c1ccccc1F Amb23442840 [1,1,0,0,0,0|2,0,0]=4 4398 B11R1.17 OC\C=C\c1ccccc1O Amb33450068 [1,1,0,0,0,0|2,0,0]=4 4399 B11R1.17 Oc1ccccc1\C=C/CBr Amb27759396 [1,1,0,0,0,0|2,0,0]=4 4400 B11R1.17 Oc1ccccc1\C=C\CCl Amb27848186 [1,1,0,0,0,0|2,0,0]=4 4401 B11R1.24 BrC\C=C\c1cccc(Br)c1 Amb27401347 [1,1,0,0,0,0|2,0,0]=4 4402 B11R1.24 CCC#Cc1cccc(Br)c1 Amb27879679 [1,1,0,0,0,0|1,0,1]=4 4403 B11R1.24 CCC#Cc1cccc(C)c1 Amb28185115 [1,1,0,0,0,0|1,0,1]=4 4404 B11R1.24 CCC#Cc1cccc(Cl)c1 Amb27653230 [1,1,0,0,0,0|1,0,1]=4 4405 B11R1.24 CCC#Cc1cccc(F)c1 Amb28061236 [1,1,0,0,0,0|1,0,1]=4 4406 B11R1.24 CCC#Cc1cccc(I)c1 Amb27436600 [1,1,0,0,0,0|1,0,1]=4 4407 B11R1.24 CCC#Cc1cccc(N)c1 Amb26513950 [1,1,0,0,0,0|1,0,1]=4 4408 B11R1.24 CCC#Cc1cccc(O)c1 Amb25139990 [1,1,0,0,0,0|1,0,1]=4 4409 B11R1.24 CCCCc1cccc(Br)c1 Amb19944057 [1,1,0,0,0,0|1,0,1]=4 4410 B11R1.24 CCCCc1cccc(C)c1 Amb22730119 [1,1,0,0,0,0|1,0,1]=4 4411 B11R1.24 CCCCc1cccc(Cl)c1 Amb26984112 [1,1,0,0,0,0|1,0,1]=4 4412 B11R1.24 CCCCc1cccc(F)c1 Amb27221595 [1,1,0,0,0,0|1,0,1]=4 4413 B11R1.24 CCCCc1cccc(I)c1 Amb19944046 [1,1,0,0,0,0|1,0,1]=4 4414 B11R1.24 CCCCc1cccc(N)c1 Amb17593719 [1,1,0,0,0,0|1,0,1]=4 4415 B11R1.24 CCCCc1cccc(O)c1 Amb26463186 [1,1,0,0,0,0|1,0,1]=4 4416 B11R1.24 CCCNc1cccc(Br)c1 Amb6696672 [1,1,0,0,0,0|2,0,0]=4 4417 B11R1.24 CCCNc1cccc(C)c1 Amb6684516 [1,1,0,0,0,0|2,0,0]=4 4418 B11R1.24 CCCNc1cccc(Cl)c1 Amb6695728 [1,1,0,0,0,0|2,0,0]=4 4419 B11R1.24 CCCNc1cccc(F)c1 Amb6695885 [1,1,0,0,0,0|2,0,0]=4 4420 B11R1.24 CCCNc1cccc(N)c1 Amb8825430 [1,1,0,0,0,0|2,0,0]=4 4421 B11R1.24 CCCOc1cccc(Br)c1 Amb33532692 [1,1,0,0,0,0|2,0,0]=4 4422 B11R1.24 CCCOc1cccc(C)c1 Amb10573406 [1,1,0,0,0,0|2,0,0]=4 4423 B11R1.24 CCCOc1cccc(Cl)c1 Amb25787001 [1,1,0,0,0,0|2,0,0]=4 4424 B11R1.24 CCCOc1cccc(F)c1 Amb25700428 [1,1,0,0,0,0|2,0,0]=4 4425 B11R1.24 CCCOc1cccc(I)c1 Amb27393748 [1,1,0,0,0,0|2,0,0]=4 4426 B11R1.24 CCCOc1cccc(N)c1 Amb1138945 [1,1,0,0,0,0|2,0,0]=4 4427 B11R1.24 CCCOc1cccc(O)c1 Amb8837439 [1,1,0,0,0,0|2,0,0]=4 4428 B11R1.24 CCCOc1cccc(S)c1 Amb26554006 [1,1,0,0,0,0|2,0,0]=4 4429 B11R1.24 CCCSc1cccc(Br)c1 Amb24538191 [1,1,0,0,0,0|2,0,0]=4 4430 B11R1.24 CCCSc1cccc(C)c1 Amb28315009 [1,1,0,0,0,0|2,0,0]=4 4431 B11R1.24 CCCSc1cccc(Cl)c1 Amb25801816 [1,1,0,0,0,0|2,0,0]=4 4432 B11R1.24 CCCSc1cccc(N)c1 Amb18289141 [1,1,0,0,0,0|2,0,0]=4 4433 B11R1.24 CCCSc1cccc(S)c1 Amb26337168 [1,1,0,0,0,0|2,0,0]=4 4434 B11R1.24 CCNCc1cccc(Br)c1 Amb13949217 [1,1,0,0,0,0|1,0,1]=4 4435 B11R1.24 CCNCc1cccc(Br)c1 Amb838402 [1,1,0,0,0,0|1,0,1]=4 4436 B11R1.24 CCNCc1cccc(C)c1 Amb6242953 [1,1,0,0,0,0|1,0,1]=4 4437 B11R1.24 CCNCc1cccc(Cl)c1 Amb29845814 [1,1,0,0,0,0|1,0,1]=4 4438 B11R1.24 CCNCc1cccc(Cl)c1 Amb6245035 [1,1,0,0,0,0|1,0,1]=4 4439 B11R1.24 CCNCc1cccc(F)c1 Amb435909 [1,1,0,0,0,0|1,0,1]=4 4440 B11R1.24 CCNCc1cccc(O)c1 Amb6260672 [1,1,0,0,0,0|1,0,1]=4 4441 B11R1.24 CCOCc1cc(N)ccn1 Amb27976333 [1,1,0,0,0,0|1,0,1]=4 4442 B11R1.24 CCOCc1cccc(Br)c1 Amb23512545 [1,1,0,0,0,0|0,0,1]=3 4443 B11R1.24 CCOCc1cccc(Cl)c1 Amb24486866 [1,1,0,0,0,0|0,0,1]=3 4444 B11R1.24 CCOCc1cccc(N)c1 Amb6244214 [1,1,0,0,0,0|0,0,1]=3 4445 B11R1.24 CCOCc1cccc(O)c1 Amb23443319 [1,1,0,0,0,0|0,0,1]=3 4446 B11R1.24 CCOCc1ccnc(N)c1 Amb18298616 [1,1,0,0,0,0|1,0,1]=4 4447 B11R1.24 CCOCc1cncc(Br)c1 Amb26348458 [1,1,0,0,0,0|1,0,1]=4 4448 B11R1.24 CCSCc1cccc(Br)c1 Amb24476579 [1,1,0,0,0,0|0,1,1]=4 4449 B11R1.24 CCSCc1cccc(Cl)c1 Amb25891456 [1,1,0,0,0,0|0,1,1]=4 4450 B11R1.24 CCSCc1cccc(F)c1 Amb27406048 [1,1,0,0,0,0|0,1,1]=4 4451 B11R1.24 CCSCc1cccc(N)c1 Amb6680425 [1,1,0,0,0,0|0,1,1]=4 4452 B11R1.24 CC\C=C\c1cccc(O)c1 Amb16231489 [1,1,0,0,0,0|1,0,0]=3 4453 B11R1.24 CNOCc1cccc(I)c1 Amb32412842 [1,1,0,0,0,0|1,0,1]=4 4454 B11R1.24 CN\N=C\c1cccc(Cl)c1 Amb27261064 [1,1,0,0,0,0|2,0,0]=4 4455 B11R1.24 CO\C=C\c1cccc(Br)c1 Amb27642123 [1,1,0,0,0,0|2,0,0]=4 4456 B11R1.24 CO\C=C\c1cccc(F)c1 Amb27840067 [1,1,0,0,0,0|2,0,0]=4 4457 B11R1.24 CO\N=C\c1cccc(Br)c1 Amb27425154 [1,1,0,0,0,0|2,0,0]=4 4458 B11R1.24 CO\N=C\c1cccc(C)c1 Amb27826264 [1,1,0,0,0,0|2,0,0]=4 4459 B11R1.24 CO\N=C\c1cccc(I)c1 Amb28063598 [1,1,0,0,0,0|2,0,0]=4 4460 B11R1.24 Cc1cccc(\C=C\CN)c1 Amb18065182 [1,1,0,0,0,0|2,0,0]=4 4461 B11R1.24 Cc1cccc(\C=C\CO)c1 Amb23442940 [1,1,0,0,0,0|2,0,0]=4 4462 B11R1.24 ClCOCc1cccc(Br)c1 Amb27489432 [1,1,0,0,0,0|1,0,1]=4 4463 B11R1.24 NC\C=C\c1cccc(Br)c1 Amb18066633 [1,1,0,0,0,0|2,0,0]=4 4464 B11R1.24 NC\C=C\c1cccc(Cl)c1 Amb18065474 [1,1,0,0,0,0|2,0,0]=4 4465 B11R1.24 NC\C=C\c1cccc(F)c1 Amb18065349 [1,1,0,0,0,0|2,0,0]=4 4466 B11R1.24 NC\C=C\c1cccc(O)c1 Amb33474823 [1,1,0,0,0,0|2,0,0]=4 4467 B11R1.24 OC\C=C\c1cccc(Br)c1 Amb19516160 [1,1,0,0,0,0|2,0,0]=4 4468 B11R1.24 OC\C=C\c1cccc(Cl)c1 Amb23442783 [1,1,0,0,0,0|2,0,0]=4 4469 B11R1.24 OC\C=C\c1cccc(F)c1 Amb23442888 [1,1,0,0,0,0|2,0,0]=4 4470 B11R1.24 OC\C=C\c1cccc(I)c1 Amb28322502 [1,1,0,0,0,0|2,0,0]=4 4471 B11R1.24 OC\C=C\c1cccc(O)c1 Amb33136411 [1,1,0,0,0,0|2,0,0]=4 4472 B11R1.28 BrCCCCc1ccccc1 Amb2685395 [1,1,0,0,0,0|1,0,1]=4 4473 B11R1.28 BrCCCOc1ccccc1 Amb1154134 [1,1,0,0,0,0|2,0,0]=4 4474 B11R1.28 BrCCNCc1ccccc1 Amb18131678 [1,1,0,0,0,0|1,0,1]=4 4475 B11R1.28 BrCCOCc1ccccc1 Amb3941567 [1,1,0,0,0,0|0,0,1]=3 4476 B11R1.28 BrCCSCc1ccccc1 Amb9305028 [1,1,0,0,0,0|0,1,1]=4 4477 B11R1.28 BrCC\C=C\c1ccccc1 Amb17140564 [1,1,0,0,0,0|1,0,0]=3 4478 B11R1.28 C#CCOCc1ccccc1 Amb8517297 [1,1,0,0,0,0|0,0,2]=4 4479 B11R1.28 C#CC\C=C\c1ccccc1 Amb33080774 [1,1,0,0,0,0|1,0,1]=4 4480 B11R1.28 C#CC\N=C\c1ccccc1 Amb17609064 [1,1,0,0,0,0|1,0,1]=4 4481 B11R1.28 C=CCOCc1ccccc1 Amb17933917 [1,1,0,0,0,0|0,0,2]=4 4482 B11R1.28 C=CCO[BrH]c1ccccc1 Amb27001649 [1,1,0,0,0,0|1,0,1]=4 4483 B11R1.28 C=CC\C=C\c1ccccc1 Amb8393997 [1,1,0,0,0,0|1,0,1]=4 4484 B11R1.28 CCCC#Cc1ccccc1 Amb2721608 [1,1,0,0,0,0|1,0,1]=4 4485 B11R1.28 CCCCCc1ccccc1 Amb2722921 [1,1,0,0,0,0|1,0,1]=4 4486 B11R1.28 CCCCNc1ccccc1 Amb3940154 [1,1,0,0,0,0|1,0,1]=4 4487 B11R1.28 CCCCOc1ccccc1 Amb2685665 [1,1,0,0,0,0|1,0,1]=4 4488 B11R1.28 CCCCSc1ccccc1 Amb3836105 [1,1,0,0,0,0|1,0,1]=4 4489 B11R1.28 CCCNCc1ccccc1 Amb1105937 [1,1,0,0,0,0|1,0,1]=4 4490 B11R1.28 CCCNCc1ccccc1 Amb6537999 [1,1,0,0,0,0|1,0,1]=4 4491 B11R1.28 CCCSCc1ccccc1 Amb27000631 [1,1,0,0,0,0|0,1,1]=4 4492 B11R1.28 CCC\C=C\c1ccccc1 Amb4017967 [1,1,0,0,0,0|1,0,0]=3 4493 B11R1.28 CCC\C=N\c1ccccc1 Amb16231172 [1,1,0,0,0,0|1,0,0]=3 4494 B11R1.28 CCC\N=C\c1ccccc1 Amb4605889 [1,1,0,0,0,0|1,0,0]=3 4495 B11R1.28 CCC\N=C\c1cccnc1 Amb26446590 [1,1,0,0,0,0|2,0,0]=4 4496 B11R1.28 CCNCCc1ccccc1 Amb33551205 [1,1,0,0,0,0|1,0,1]=4 4497 B11R1.28 CCNCCc1ccccc1 Amb6244873 [1,1,0,0,0,0|1,0,1]=4 4498 B11R1.28 CCNOCc1ccccc1 Amb25923077 [1,1,0,0,0,0|0,0,1]=3 4499 B11R1.28 CCN\C=N\c1ccccn1 Amb27195959 [1,1,0,0,0,0|2,0,0]=4 4500 B11R1.28 CCOCCc1ccccc1 Amb4035236 [1,1,0,0,0,0|0,0,1]=3 4501 B11R1.28 CCOCCc1ccccn1 Amb2722907 [1,1,0,0,0,0|1,0,1]=4 4502 B11R1.28 CCOCOc1ccccc1 Amb28388170 [1,1,0,0,0,0|0,0,1]=3 4503 B11R1.28 CCONCc1ccccc1 Amb25151184 [1,1,0,0,0,0|0,0,1]=3 4504 B11R1.28 CCONCc1ccccn1 Amb27987586 [1,1,0,0,0,0|1,0,1]=4 4505 B11R1.28 CCONCc1cccnc1 Amb27987598 [1,1,0,0,0,0|1,0,1]=4 4506 B11R1.28 CCONCc1ccncc1 Amb27987579 [1,1,0,0,0,0|1,0,1]=4 4507 B11R1.28 CCO\C=C\c1ccccc1 Amb4020955 [1,1,0,0,0,0|0,0,0]=2 4508 B11R1.28 CCO\C=C\c1ccncc1 Amb27253748 [1,1,0,0,0,0|1,0,0]=3 4509 B11R1.28 CCO\C=N\c1ccccc1 Amb9786981 [1,1,0,0,0,0|0,0,0]=2 4510 B11R1.28 CCO\C=N\c1cccnc1 Amb28253382 [1,1,0,0,0,0|1,0,0]=3 4511 B11R1.28 CCO\C=N\c1ccncc1 Amb33140969 [1,1,0,0,0,0|1,0,0]=3 4512 B11R1.28 CCO\N=C/c1ccccn1 Amb26480023 [1,1,0,0,0,0|1,0,0]=3 4513 B11R1.28 CCO\N=C\c1cccnc1 Amb22169409 [1,1,0,0,0,0|1,0,0]=3 4514 B11R1.28 CCO\N=C\c1ccncc1 Amb26971987 [1,1,0,0,0,0|1,0,0]=3 4515 B11R1.28 CCO\N=C\c1ccncn1 Amb27261270 [1,1,0,0,0,0|2,0,0]=4 4516 B11R1.28 CC\C=C\Cc1ccncc1 Amb27230808 [1,1,0,0,0,0|2,0,0]=4 4517 B11R1.28 CC\C=N\Nc1ccccc1 Amb27258240 [1,1,0,0,0,0|2,0,0]=4 4518 B11R1.28 CNCCCc1ccccc1 Amb21954280 [1,1,0,0,0,0|1,0,1]=4 4519 B11R1.28 CNCCCc1ccccc1 Amb2721795 [1,1,0,0,0,0|1,0,1]=4 4520 B11R1.28 CNCCNc1ccccc1 Amb6825621 [1,1,0,0,0,0|2,0,0]=4 4521 B11R1.28 CNCCOc1ccccc1 Amb1105525 [1,1,0,0,0,0|2,0,0]=4 4522 B11R1.28 CNCCOc1ccccc1 Amb2691365 [1,1,0,0,0,0|2,0,0]=4 4523 B11R1.28 CNCCSc1ccccc1 Amb10608735 [1,1,0,0,0,0|2,0,0]=4 4524 B11R1.28 CNCCSc1ccccc1 Amb17622507 [1,1,0,0,0,0|2,0,0]=4 4525 B11R1.28 CNC\C=C/c1cccnc1 Amb28423371 [1,1,0,0,0,0|2,0,0]=4 4526 B11R1.28 CNC\C=C\c1ccccc1 Amb2114273 [1,1,0,0,0,0|1,0,0]=3 4527 B11R1.28 CNC\C=C\c1ccccn1 Amb26859034 [1,1,0,0,0,0|2,0,0]=4 4528 B11R1.28 CNC\C=C\c1cccnc1 Amb23442752 [1,1,0,0,0,0|2,0,0]=4 4529 B11R1.28 CNC\C=C\c1ccncc1 Amb26859033 [1,1,0,0,0,0|2,0,0]=4 4530 B11R1.28 COCC#Cc1ccccc1 Amb25308232 [1,1,0,0,0,0|1,0,1]=4 4531 B11R1.28 COCCNc1ccccc1 Amb596066 [1,1,0,0,0,0|2,0,0]=4 4532 B11R1.28 COCCOc1ccccc1 Amb4018811 [1,1,0,0,0,0|2,0,0]=4 4533 B11R1.28 COCNCc1ccccc1 Amb25053350 [1,1,0,0,0,0|1,0,1]=4 4534 B11R1.28 CO\C=C/Oc1ccccc1 Amb24069136 [1,1,0,0,0,0|2,0,0]=4 4535 B11R1.28 CSCCCc1ccccc1 Amb25383748 [1,1,0,0,0,0|1,0,1]=4 4536 B11R1.28 CSCCNc1ccccc1 Amb17307504 [1,1,0,0,0,0|2,0,0]=4 4537 B11R1.28 CSCCOc1ccccc1 Amb4020915 [1,1,0,0,0,0|2,0,0]=4 4538 B11R1.28 CSCNCc1ccccc1 Amb26414504 [1,1,0,0,0,0|1,0,1]=4 4539 B11R1.28 CSC\C=C\c1ccccc1 Amb27261145 [1,1,0,0,0,0|1,0,0]=3 4540 B11R1.28 C\C=C\C=C\c1ccccc1 Amb27870048 [1,1,0,0,0,0|1,0,1]=4 4541 B11R1.28 ClCCCCc1ccccc1 Amb3940707 [1,1,0,0,0,0|1,0,1]=4 4542 B11R1.28 ClCCCOc1ccccc1 Amb1128627 [1,1,0,0,0,0|2,0,0]=4 4543 B11R1.28 ClCCCSc1ccccc1 Amb1132759 [1,1,0,0,0,0|2,0,0]=4 4544 B11R1.28 ClCCNCc1ccccc1 Amb2880633 [1,1,0,0,0,0|1,0,1]=4 4545 B11R1.28 ClCCNCc1ccccc1 Amb4323279 [1,1,0,0,0,0|1,0,1]=4 4546 B11R1.28 ClCCOCc1ccccc1 Amb8391048 [1,1,0,0,0,0|0,0,1]=3 4547 B11R1.28 ClCCSCc1ccccc1 Amb9270911 [1,1,0,0,0,0|0,1,1]=4 4548 B11R1.28 ClCC\C=C\c1ccccc1 Amb17232628 [1,1,0,0,0,0|1,0,0]=3 4549 B11R1.28 ClCC\C=C\c1cccnc1 Amb28367181 [1,1,0,0,0,0|2,0,0]=4 4550 B11R1.28 ClCO\N=C\c1ccccc1 Amb25838175 [1,1,0,0,0,0|1,0,0]=3 4551 B11R1.28 ClC\C=C\Sc1ccccc1 Amb27452187 [1,1,0,0,0,0|2,0,0]=4 4552 B11R1.28 FCCNCc1ccccc1 Amb24611358 [1,1,0,0,0,0|1,0,1]=4 4553 B11R1.28 FCCSCc1ccccc1 Amb27271863 [1,1,0,0,0,0|0,1,1]=4 4554 B11R1.28 ICCCCc1ccccc1 Amb25380384 [1,1,0,0,0,0|1,0,1]=4 4555 B11R1.28 ICCCOc1ccccc1 Amb27271705 [1,1,0,0,0,0|2,0,0]=4 4556 B11R1.28 ICCOCc1ccccc1 Amb16191915 [1,1,0,0,0,0|0,0,1]=3 4557 B11R1.28 ICC\C=C\c1ccccc1 Amb27261633 [1,1,0,0,0,0|1,0,0]=3 4558 B11R1.28 IC\C=C\Cc1ccccc1 Amb28428997 [1,1,0,0,0,0|2,0,0]=4 4559 B11R1.28 N#CCOCc1ccccc1 Amb4011553 [1,1,0,0,0,0|0,0,2]=4 4560 B11R1.28 N#CC\C=C\c1ccccc1 Amb6268598 [1,1,0,0,0,0|1,0,1]=4 4561 B11R1.28 NCCCCc1ccccc1 Amb1227740 [1,1,0,0,0,0|1,0,1]=4 4562 B11R1.28 NCCCNc1ccccc1 Amb10086594 [1,1,0,0,0,0|2,0,0]=4 4563 B11R1.28 NCCCOc1ccccc1 Amb1108619 [1,1,0,0,0,0|2,0,0]=4 4564 B11R1.28 NCCCOc1ccccc1 Amb2606353 [1,1,0,0,0,0|2,0,0]=4 4565 B11R1.28 NCCCSc1ccccc1 Amb1089343 [1,1,0,0,0,0|2,0,0]=4 4566 B11R1.28 NCCCSc1ccccc1 Amb2099802 [1,1,0,0,0,0|2,0,0]=4 4567 B11R1.28 NCCNCc1ccccc1 Amb2725583 [1,1,0,0,0,0|1,0,1]=4 4568 B11R1.28 NCCOCc1ccccc1 Amb1081962 [1,1,0,0,0,0|0,0,1]=3 4569 B11R1.28 NCCOCc1ccccc1 Amb2137059 [1,1,0,0,0,0|0,0,1]=3 4570 B11R1.28 NCCOCc1ccccc1 Amb28524733 [1,1,0,0,0,0|0,0,1]=3 4571 B11R1.28 NCCOCc1ccccn1 Amb18181726 [1,1,0,0,0,0|1,0,1]=4 4572 B11R1.28 NCCOCc1ccncc1 Amb19020767 [1,1,0,0,0,0|1,0,1]=4 4573 B11R1.28 NCCPCc1ccccc1 Amb27990149 [1,1,0,0,0,0|1,0,1]=4 4574 B11R1.28 NCCSCc1ccccc1 Amb432271 [1,1,0,0,0,0|0,1,1]=4 4575 B11R1.28 NCCSCc1ccccc1 Amb6335199 [1,1,0,0,0,0|0,1,1]=4 4576 B11R1.28 NCC\C=C/c1ccccc1 Amb27254115 [1,1,0,0,0,0|1,0,0]=3 4577 B11R1.28 NCC\C=C/c1cccnc1 Amb27391665 [1,1,0,0,0,0|2,0,0]=4 4578 B11R1.28 NCC\C=C\c1ccccc1 Amb17138419 [1,1,0,0,0,0|1,0,0]=3 4579 B11R1.28 NCC\C=C\c1ccccn1 Amb24383569 [1,1,0,0,0,0|2,0,0]=4 4580 B11R1.28 NCC\C=C\c1cccnc1 Amb25061778 [1,1,0,0,0,0|2,0,0]=4 4581 B11R1.28 NCC\C=C\c1ccncc1 Amb24678309 [1,1,0,0,0,0|2,0,0]=4 4582 B11R1.28 NCC\N=C\c1ccccc1 Amb27760044 [1,1,0,0,0,0|1,0,0]=3 4583 B11R1.28 NCC\N=C\c1ccccn1 Amb28072854 [1,1,0,0,0,0|2,0,0]=4 4584 B11R1.28 NC\C=C\Cc1ccccc1 Amb32951245 [1,1,0,0,0,0|2,0,0]=4 4585 B11R1.28 NNC\C=C\c1ccccc1 Amb33456723 [1,1,0,0,0,0|2,0,0]=4 4586 B11R1.28 NOCOCc1ccccc1 Amb10606697 [1,1,0,0,0,0|1,0,1]=4 4587 B11R1.28 NOC\C=C\c1ccccc1 Amb33136389 [1,1,0,0,0,0|2,0,0]=4 4588 B11R1.28 O=CCOCc1ccccc1 Amb3939958 [1,1,0,0,0,0|0,0,2]=4 4589 B11R1.28 OCCC#Cc1ccccc1 Amb2721612 [1,1,0,0,0,0|1,0,1]=4 4590 B11R1.28 OCCCCc1ccccc1 Amb3939083 [1,1,0,0,0,0|1,0,1]=4 4591 B11R1.28 OCCCNc1ccccc1 Amb17307125 [1,1,0,0,0,0|2,0,0]=4 4592 B11R1.28 OCCCOc1ccccc1 Amb4476987 [1,1,0,0,0,0|2,0,0]=4 4593 B11R1.28 OCCCSc1ccccc1 Amb4018847 [1,1,0,0,0,0|2,0,0]=4 4594 B11R1.28 OCCC[SiH2]c1ccccc1 Amb27989504 [1,1,0,0,0,0|1,1,0]=4 4595 B11R1.28 OCCNCc1ccccc1 Amb1835287 [1,1,0,0,0,0|1,0,1]=4 4596 B11R1.28 OCCNCc1ccccc1 Amb6537902 [1,1,0,0,0,0|1,0,1]=4 4597 B11R1.28 OCCOCc1ccccc1 Amb3939139 [1,1,0,0,0,0|0,0,1]=3 4598 B11R1.28 OCCSCc1ccccc1 Amb2688740 [1,1,0,0,0,0|0,1,1]=4 4599 B11R1.28 OCC\C=C\c1ccccc1 Amb33213896 [1,1,0,0,0,0|1,0,0]=3 4600 B11R1.28 OCC\C=N\c1ccccc1 Amb27805392 [1,1,0,0,0,0|2,0,0]=4 4601 B11R1.28 OCC\N=C\c1cccnc1 Amb28125720 [1,1,0,0,0,0|2,0,0]=4 4602 B11R1.28 OCC\N=C\c1ccncc1 Amb26406078 [1,1,0,0,0,0|2,0,0]=4 4603 B11R1.28 OC\C=C\Cc1ccccc1 Amb32951814 [1,1,0,0,0,0|2,0,0]=4 4604 B11R1.28 OC\C=C\Sc1ccccc1 Amb27164022 [1,1,0,0,0,0|2,0,0]=4 4605 B11R1.28 ONC\C=C\c1ccccc1 Amb33081057 [1,1,0,0,0,0|2,0,0]=4 4606 B11R1.28 SCCCCc1ccccc1 Amb17400224 [1,1,0,0,0,0|1,0,1]=4 4607 B11R1.28 SCCCOc1ccccc1 Amb6255479 [1,1,0,0,0,0|2,0,0]=4 4608 B11R1.28 SCCNCc1ccccc1 Amb4405222 [1,1,0,0,0,0|1,0,1]=4 4609 B11R1.28 SCCOCc1ccccc1 Amb27457406 [1,1,0,0,0,0|0,0,1]=3 4610 B11R1.28 SCC\C=C\c1ccccc1 Amb33081762 [1,1,0,0,0,0|1,0,0]=3 4611 B11R1.28 [C-]#[N+]C\C=C\c1ccccc1 Amb33081342 [1,1,0,0,0,0|1,0,1]=4 4612 B11R1.40 C=C(CC)Nc1ccccc1 Amb27413657 [1,1,0,0,0,0|2,0,0]=4 4613 B11R1.40 CCC(=O)Cc1ccccc1 Amb4605994 [1,1,0,0,0,0|1,0,1]=4 4614 B11R1.40 CCC(=O)Nc1ccccc1 Amb6358816 [1,1,0,0,0,0|2,0,0]=4 4615 B11R1.40 CCC(=O)Oc1ccccc1 Amb2842289 [1,1,0,0,0,0|2,0,0]=4 4616 B11R1.40 CCC(=O)Sc1ccccc1 Amb26857967 [1,1,0,0,0,0|2,0,0]=4 4617 B11R1.40 CCC(Br)Cc1ccccc1 Amb25189250 [1,1,0,0,0,0|1,0,1]=4 4618 B11R1.40 CCC(C)Nc1ccccc1 Amb4017601 [1,1,0,0,0,0|2,0,0]=4 4619 B11R1.40 CCC(C)Oc1ccccc1 Amb24350256 [1,1,0,0,0,0|2,0,0]=4 4620 B11R1.40 CCC(C)Sc1ccccc1 Amb25698974 [1,1,0,0,0,0|2,0,0]=4 4621 B11R1.40 CCC(Cl)Cc1ccccc1 Amb18177890 [1,1,0,0,0,0|1,0,1]=4 4622 B11R1.40 CCC(N)Cc1ccccc1 Amb9428866 [1,1,0,0,0,0|1,0,1]=4 4623 B11R1.40 CCC(O)Cc1ccccc1 Amb4035173 [1,1,0,0,0,0|1,0,1]=4 4624 B11R1.40 CCC(S)Cc1ccccc1 Amb26868958 [1,1,0,0,0,0|1,0,1]=4 4625 B11R1.40 CCN(N)Cc1ccccc1 Amb17232076 [1,1,0,0,0,0|1,0,1]=4 4626 B11R1.40 CC[C@@H](N)Cc1ccccc1 Amb25141525 [1,1,0,0,0,0|1,0,1]=4 4627 B11R1.40 CC[C@@H](O)Cc1ccccc1 Amb19375372 [1,1,0,0,0,0|1,0,1]=4 4628 B11R1.40 CC[C@H](C)Cc1ccccc1 Amb25892475 [1,1,0,0,0,0|1,0,1]=4 4629 B11R1.40 CC[C@H](N)Cc1ccccc1 Amb19929690 [1,1,0,0,0,0|1,0,1]=4 4630 B11R1.40 CC[C@H](O)Cc1ccccc1 Amb27803759 [1,1,0,0,0,0|1,0,1]=4 4631 B11R1.40 CC\C(C)=C/c1ccccc1 Amb22546773 [1,1,0,0,0,0|1,0,0]=3 4632 B11R1.40 CC\C(C)=C\c1ccccc1 Amb4034910 [1,1,0,0,0,0|1,0,0]=3 4633 B11R1.40 CC\C(I)=C/c1ccccc1 Amb22641702 [1,1,0,0,0,0|1,0,0]=3 4634 B11R1.40 CC\[N+]([O-])=C\c1ccccn1 Amb24518451 [1,1,0,0,0,0|2,0,0]=4 4635 B11R1.40 CC\[N+]([O-])=C\c1ccncc1 Amb28059823 [1,1,0,0,0,0|2,0,0]=4 4636 B11R1.40 CN\C(C)=C\c1ccccc1 Amb32758729 [1,1,0,0,0,0|2,0,0]=4 4637 B11R1.40 CO\C(C)=C\c1ccccc1 Amb4020305 [1,1,0,0,0,0|2,0,0]=4 4638 B11R1.40 C\C(=C/c1ccccc1)CBr Amb33136396 [1,1,0,0,0,0|2,0,0]=4 4639 B11R1.40 C\C(=C/c1ccccc1)CCl Amb33136471 [1,1,0,0,0,0|2,0,0]=4 4640 B11R1.40 C\C(=C/c1ccccc1)CN Amb33136473 [1,1,0,0,0,0|2,0,0]=4 4641 B11R1.40 C\C(=C/c1ccccc1)CO Amb9825840 [1,1,0,0,0,0|2,0,0]=4 4642 B11R1.40 C\C(=C/c1ccccc1)CS Amb33381244 [1,1,0,0,0,0|2,0,0]=4 4643 B11R1.40 C\C(=C\c1ccccc1)CN Amb24634730 [1,1,0,0,0,0|2,0,0]=4 4644 B11R1.40 F\C(=C/c1ccccc1)CBr Amb27828070 [1,1,0,0,0,0|2,0,0]=4 4645 B11R1.40 OC\C(Cl)=C/c1ccccc1 Amb27234634 [1,1,0,0,0,0|2,0,0]=4 4646 B11R1.91 C=C(C)OCc1ccccc1 Amb22731238 [1,1,0,0,0,0|0,0,2]=4 4647 B11R1.91 C=C(C)\C=C\c1ccccc1 Amb22546632 [1,1,0,0,0,0|1,0,1]=4 4648 B11R1.91 CC(=O)OCc1ccccc1 Amb8513061 [1,1,0,0,0,0|0,0,2]=4 4649 B11R1.91 CC(=O)O[Hg]c1ccccc1 Amb8385173 [1,1,0,0,0,0|1,0,1]=4 4650 B11R1.91 CC(=O)\C=C\c1ccccc1 Amb1658842 [1,1,0,0,0,0|1,0,1]=4 4651 B11R1.91 CC(=O)\C=C\c1ccccc1 Amb33716963 [1,1,0,0,0,0|1,0,1]=4 4652 B11R1.91 CC(Br)CCc1ccccc1 Amb8835399 [1,1,0,0,0,0|1,0,1]=4 4653 B11R1.91 CC(Br)CNc1ccccc1 Amb28428528 [1,1,0,0,0,0|2,0,0]=4 4654 B11R1.91 CC(Br)COc1ccccc1 Amb25278262 [1,1,0,0,0,0|2,0,0]=4 4655 B11R1.91 CC(Br)CSc1ccccc1 Amb27628746 [1,1,0,0,0,0|2,0,0]=4 4656 B11R1.91 CC(Br)\C=C\c1ccccc1 Amb27401147 [1,1,0,0,0,0|1,0,0]=3 4657 B11R1.91 CC(C)CCc1ccccc1 Amb4477358 [1,1,0,0,0,0|1,0,1]=4 4658 B11R1.91 CC(C)CNc1ccccc1 Amb28960302 [1,1,0,0,0,0|2,0,0]=4 4659 B11R1.91 CC(C)CNc1ccccc1 Amb4304155 [1,1,0,0,0,0|2,0,0]=4 4660 B11R1.91 CC(C)COc1ccccc1 Amb27668259 [1,1,0,0,0,0|2,0,0]=4 4661 B11R1.91 CC(C)CSc1ccccc1 Amb4016673 [1,1,0,0,0,0|2,0,0]=4 4662 B11R1.91 CC(C)NCc1ccccc1 Amb4020804 [1,1,0,0,0,0|1,0,1]=4 4663 B11R1.91 CC(C)NCc1ccccc1 Amb6383293 [1,1,0,0,0,0|1,0,1]=4 4664 B11R1.91 CC(C)OCc1ccccc1 Amb3988003 [1,1,0,0,0,0|0,0,1]=3 4665 B11R1.91 CC(C)SCc1ccccc1 Amb25935134 [1,1,0,0,0,0|0,1,1]=4 4666 B11R1.91 CC(C)\C=C/c1ccccc1 Amb22546593 [1,1,0,0,0,0|1,0,0]=3 4667 B11R1.91 CC(C)\C=C\c1ccccc1 Amb33620440 [1,1,0,0,0,0|1,0,0]=3 4668 B11R1.91 CC(C)\N=C/c1ccncc1 Amb27975465 [1,1,0,0,0,0|2,0,0]=4 4669 B11R1.91 CC(C)\N=C\c1ccccc1 Amb4020035 [1,1,0,0,0,0|1,0,0]=3 4670 B11R1.91 CC(C)\N=C\c1ccncc1 Amb26421831 [1,1,0,0,0,0|2,0,0]=4 4671 B11R1.91 CC(Cl)CCc1ccccc1 Amb9205035 [1,1,0,0,0,0|1,0,1]=4 4672 B11R1.91 CC(Cl)SCc1ccccc1 Amb27638041 [1,1,0,0,0,0|0,1,1]=4 4673 B11R1.91 CC(Cl)\C=C\c1cccnc1 Amb27881248 [1,1,0,0,0,0|2,0,0]=4 4674 B11R1.91 CC(Cl)\C=C\c1ccncc1 Amb27768545 [1,1,0,0,0,0|2,0,0]=4 4675 B11R1.91 CC(F)CNc1ccccc1 Amb27872143 [1,1,0,0,0,0|2,0,0]=4 4676 B11R1.91 CC(N)CCc1ccccc1 Amb5740105 [1,1,0,0,0,0|1,0,1]=4 4677 B11R1.91 CC(N)CCc1ccccc1 Amb6383144 [1,1,0,0,0,0|1,0,1]=4 4678 B11R1.91 CC(N)CNc1ccccc1 Amb18972362 [1,1,0,0,0,0|2,0,0]=4 4679 B11R1.91 CC(N)COc1ccccc1 Amb10609380 [1,1,0,0,0,0|2,0,0]=4 4680 B11R1.91 CC(N)COc1ccccc1 Amb9756346 [1,1,0,0,0,0|2,0,0]=4 4681 B11R1.91 CC(N)CSc1ccccc1 Amb18065472 [1,1,0,0,0,0|2,0,0]=4 4682 B11R1.91 CC(N)CSc1ccccc1 Amb21988436 [1,1,0,0,0,0|2,0,0]=4 4683 B11R1.91 CC(N)\C=C\c1ccccc1 Amb18124854 [1,1,0,0,0,0|1,0,0]=3 4684 B11R1.91 CC(N)\C=C\c1ccccn1 Amb33172666 [1,1,0,0,0,0|2,0,0]=4 4685 B11R1.91 CC(N)\C=C\c1cccnc1 Amb33172475 [1,1,0,0,0,0|2,0,0]=4 4686 B11R1.91 CC(N)\C=C\c1ccncc1 Amb33359059 [1,1,0,0,0,0|2,0,0]=4 4687 B11R1.91 CC(N)\N=N\c1ccccc1 Amb26948832 [1,1,0,0,0,0|2,0,0]=4 4688 B11R1.91 CC(O)C#Cc1ccccc1 Amb534711 [1,1,0,0,0,0|1,0,1]=4 4689 B11R1.91 CC(O)CCc1ccccc1 Amb4009672 [1,1,0,0,0,0|1,0,1]=4 4690 B11R1.91 CC(O)CNc1ccccc1 Amb6537763 [1,1,0,0,0,0|2,0,0]=4 4691 B11R1.91 CC(O)COc1ccccc1 Amb6298844 [1,1,0,0,0,0|2,0,0]=4 4692 B11R1.91 CC(O)CPc1ccccc1 Amb27756306 [1,1,0,0,0,0|2,0,0]=4 4693 B11R1.91 CC(O)CSc1ccccc1 Amb18793066 [1,1,0,0,0,0|2,0,0]=4 4694 B11R1.91 CC(O)\C=C\c1ccccc1 Amb17593695 [1,1,0,0,0,0|1,0,0]=3 4695 B11R1.91 CC(O)\C=C\c1ccccn1 Amb576300 [1,1,0,0,0,0|2,0,0]=4 4696 B11R1.91 CC(O)\C=C\c1cccnc1 Amb25847379 [1,1,0,0,0,0|2,0,0]=4 4697 B11R1.91 CC(O)\C=C\c1ccncc1 Amb616107 [1,1,0,0,0,0|2,0,0]=4 4698 B11R1.91 CC(S)CCc1ccccc1 Amb7784713 [1,1,0,0,0,0|1,0,1]=4 4699 B11R1.91 CC(S)COc1ccccc1 Amb29854435 [1,1,0,0,0,0|2,0,0]=4 4700 B11R1.91 CN(C)\N=C\c1ccccc1 Amb33512938 [1,1,0,0,0,0|2,0,0]=4 4701 B11R1.91 CS(=O)\N=C\c1ccccc1 Amb35681663 [1,1,0,0,0,0|2,0,0]=4 4702 B11R1.91 C[C@@H](N)CCc1ccccc1 Amb8516709 [1,1,0,0,0,0|1,0,1]=4 4703 B11R1.91 C[C@@H](N)COc1ccccc1 Amb18538481 [1,1,0,0,0,0|2,0,0]=4 4704 B11R1.91 C[C@@H](N)\C=C\c1ccccc1 Amb33083236 [1,1,0,0,0,0|1,0,0]=3 4705 B11R1.91 C[C@@H](O)C#Cc1ccccc1 Amb27865137 [1,1,0,0,0,0|1,0,1]=4 4706 B11R1.91 C[C@@H](O)CCc1ccccc1 Amb22049565 [1,1,0,0,0,0|1,0,1]=4 4707 B11R1.91 C[C@@H](O)CNc1ccccc1 Amb27400122 [1,1,0,0,0,0|2,0,0]=4 4708 B11R1.91 C[C@@H](O)COc1ccccc1 Amb27776994 [1,1,0,0,0,0|2,0,0]=4 4709 B11R1.91 C[C@@H](O)\C=C\c1ccccc1 Amb32954507 [1,1,0,0,0,0|1,0,0]=3 4710 B11R1.91 C[C@H](Br)CCc1ccccc1 Amb27592949 [1,1,0,0,0,0|1,0,1]=4 4711 B11R1.91 C[C@H](N)CCc1ccccc1 Amb8516076 [1,1,0,0,0,0|1,0,1]=4 4712 B11R1.91 C[C@H](N)COc1ccccc1 Amb17232092 [1,1,0,0,0,0|2,0,0]=4 4713 B11R1.91 C[C@H](N)\C=C\c1ccccc1 Amb32954166 [1,1,0,0,0,0|1,0,0]=3 4714 B11R1.91 C[C@H](O)C#Cc1ccccc1 Amb27823543 [1,1,0,0,0,0|1,0,1]=4 4715 B11R1.91 C[C@H](O)CCc1ccccc1 Amb19929325 [1,1,0,0,0,0|1,0,1]=4 4716 B11R1.91 C[C@H](O)\C=C\c1ccccc1 Amb27405101 [1,1,0,0,0,0|1,0,0]=3 4717 B11R1.91 C[PH](=O)OCc1ccccc1 Amb8391293 [1,1,0,0,0,0|1,0,1]=4 4718 B11R1.91 ClC(Cl)OCc1ccccc1 Amb28244766 [1,1,0,0,0,0|1,0,1]=4 4719 B11R1.2 CCOC(C=O)c1cccs1 Amb27674237 [0,1,0,0,1,0|1,0,1]=4 4720 B11R1.2 CCOC(C=O)c1ccsc1 Amb27674238 [0,1,0,0,1,0|1,0,1]=4 4721 B11R1.2 CCO\C(=C\Cl)c1ccco1 Amb26944848 [0,1,0,0,1,0|2,0,0]=4 4722 B11R1.15 C=C(OCC)c1csc(Br)c1 Amb33135780 [0,1,0,0,1,0|2,0,0]=4 4723 B11R1.15 C=C1CC=C(C(=O)OCC)C1 Amb24378921 [0,1,0,0,1,0|0,0,2]=4 4724 B11R1.15 CCCC(=O)c1cc(C)cs1 Amb25964776 [0,1,0,0,1,0|2,0,0]=4 4725 B11R1.15 CCCC(=O)c1ccc(Br)o1 Amb27607654 [0,1,0,0,1,0|2,0,0]=4 4726 B11R1.15 CCCC(=O)c1ccc(Br)s1 Amb9173237 [0,1,0,0,1,0|2,0,0]=4 4727 B11R1.15 CCCC(=O)c1ccc(C)s1 Amb2154724 [0,1,0,0,1,0|2,0,0]=4 4728 B11R1.15 CCCC(=O)c1ccc(Cl)s1 Amb6492961 [0,1,0,0,1,0|2,0,0]=4 4729 B11R1.15 CCCC(=O)c1csc(Br)c1 Amb27169037 [0,1,0,0,1,0|2,0,0]=4 4730 B11R1.15 CCCC(=O)c1csc(Cl)c1 Amb28128473 [0,1,0,0,1,0|2,0,0]=4 4731 B11R1.15 CCNC(=O)c1cc(S)cs1 Amb27632181 [0,1,0,0,1,0|2,0,0]=4 4732 B11R1.15 CCNC(=O)c1ccc(Br)o1 Amb6512906 [0,1,0,0,1,0|2,0,0]=4 4733 B11R1.15 CCNC(=O)c1ccc(Br)s1 Amb2111444 [0,1,0,0,1,0|2,0,0]=4 4734 B11R1.15 CCNC(=O)c1ccc(Cl)o1 Amb27176427 [0,1,0,0,1,0|2,0,0]=4 4735 B11R1.15 CCNC(=O)c1ccc(Cl)s1 Amb2227896 [0,1,0,0,1,0|2,0,0]=4 4736 B11R1.15 CCNC(=O)c1ccc(N)o1 Amb18101835 [0,1,0,0,1,0|2,0,0]=4 4737 B11R1.15 CCNC(=O)c1ccc(N)s1 Amb32417997 [0,1,0,0,1,0|2,0,0]=4 4738 B11R1.15 CCNC(=O)c1ccn(C)c1 Amb26549971 [0,1,0,0,1,0|2,0,0]=4 4739 B11R1.15 CCNC(=O)c1csc(I)c1 Amb20643992 [0,1,0,0,1,0|2,0,0]=4 4740 B11R1.15 CCOC(=N)c1cc(Cl)cs1 Amb27272653 [0,1,0,0,1,0|2,0,0]=4 4741 B11R1.15 CCOC(=N)c1ccc(Br)o1 Amb28187477 [0,1,0,0,1,0|2,0,0]=4 4742 B11R1.15 CCOC(=N)c1ccc(C)o1 Amb18179471 [0,1,0,0,1,0|2,0,0]=4 4743 B11R1.15 CCOC(=N)c1ccc(C)s1 Amb18793455 [0,1,0,0,1,0|2,0,0]=4 4744 B11R1.15 CCOC(=N)c1ccc(Cl)s1 Amb19060816 [0,1,0,0,1,0|2,0,0]=4 4745 B11R1.15 CCOC(=O)C1=CC(=O)NN1 Amb21970994 [0,1,0,0,1,0|2,0,0]=4 4746 B11R1.15 CCOC(=O)C1=CC(=O)ON1 Amb25373977 [0,1,0,0,1,0|2,0,0]=4 4747 B11R1.15 CCOC(=O)C1=CNC(=O)N1 Amb27655468 [0,1,0,0,1,0|2,0,0]=4 4748 B11R1.15 CCOC(=O)C1=CNC(=O)O1 Amb19959311 [0,1,0,0,1,0|2,0,0]=4 4749 B11R1.15 CCOC(=O)C1=COC(=O)N1 Amb20171080 [0,1,0,0,1,0|2,0,0]=4 4750 B11R1.15 CCOC(=O)C1=CSC(=N)N1 Amb19914391 [0,1,0,0,1,0|2,0,0]=4 4751 B11R1.15 CCOC(=O)N1C=CC(=O)C1 Amb27860198 [0,1,0,0,1,0|1,0,1]=4 4752 B11R1.15 CCOC(=O)c1cc(Br)cs1 Amb21963828 [0,1,0,0,1,0|1,0,0]=3 4753 B11R1.15 CCOC(=O)c1cc(Br)no1 Amb19957462 [0,1,0,0,1,0|2,0,0]=4 4754 B11R1.15 CCOC(=O)c1cc(C)cs1 Amb22498281 [0,1,0,0,1,0|1,0,0]=3 4755 B11R1.15 CCOC(=O)c1cc(C)no1 Amb8492478 [0,1,0,0,1,0|2,0,0]=4 4756 B11R1.15 CCOC(=O)c1cc(C)on1 Amb1953489 [0,1,0,0,1,0|2,0,0]=4 4757 B11R1.15 CCOC(=O)c1cc(C)sn1 Amb27665164 [0,1,0,0,1,0|2,0,0]=4 4758 B11R1.15 CCOC(=O)c1cc(Cl)on1 Amb23441000 [0,1,0,0,1,0|2,0,0]=4 4759 B11R1.15 CCOC(=O)c1cc(F)cs1 Amb26444710 [0,1,0,0,1,0|1,0,0]=3 4760 B11R1.15 CCOC(=O)c1cc(I)on1 Amb28185092 [0,1,0,0,1,0|2,0,0]=4 4761 B11R1.15 CCOC(=O)c1cc(N)cs1 Amb28121034 [0,1,0,0,1,0|1,0,0]=3 4762 B11R1.15 CCOC(=O)c1cc(N)on1 Amb20670689 [0,1,0,0,1,0|2,0,0]=4 4763 B11R1.15 CCOC(=O)c1cc(N)on1 Amb22298599 [0,1,0,0,1,0|2,0,0]=4 4764 B11R1.15 CCOC(=O)c1cc(O)cs1 Amb27977681 [0,1,0,0,1,0|1,0,0]=3 4765 B11R1.15 CCOC(=O)c1cc(O)no1 Amb22498284 [0,1,0,0,1,0|2,0,0]=4 4766 B11R1.15 CCOC(=O)c1cc(O)on1 Amb6891225 [0,1,0,0,1,0|2,0,0]=4 4767 B11R1.15 CCOC(=O)c1ccc(Br)o1 Amb4010044 [0,1,0,0,1,0|1,0,0]=3 4768 B11R1.15 CCOC(=O)c1ccc(Br)s1 Amb6366083 [0,1,0,0,1,0|1,0,0]=3 4769 B11R1.15 CCOC(=O)c1ccc(C)o1 Amb9243007 [0,1,0,0,1,0|1,0,0]=3 4770 B11R1.15 CCOC(=O)c1ccc(C)s1 Amb9242879 [0,1,0,0,1,0|1,0,0]=3 4771 B11R1.15 CCOC(=O)c1ccc(Cl)o1 Amb26627275 [0,1,0,0,1,0|1,0,0]=3 4772 B11R1.15 CCOC(=O)c1ccc(Cl)s1 Amb6365972 [0,1,0,0,1,0|1,0,0]=3 4773 B11R1.15 CCOC(=O)c1ccc(F)o1 Amb28203657 [0,1,0,0,1,0|1,0,0]=3 4774 B11R1.15 CCOC(=O)c1ccc(F)s1 Amb19892818 [0,1,0,0,1,0|1,0,0]=3 4775 B11R1.15 CCOC(=O)c1ccc(I)o1 Amb24504907 [0,1,0,0,1,0|1,0,0]=3 4776 B11R1.15 CCOC(=O)c1ccc(I)s1 Amb25188527 [0,1,0,0,1,0|1,0,0]=3 4777 B11R1.15 CCOC(=O)c1ccc(N)o1 Amb18125820 [0,1,0,0,1,0|1,0,0]=3 4778 B11R1.15 CCOC(=O)c1ccc(N)s1 Amb17109293 [0,1,0,0,1,0|1,0,0]=3 4779 B11R1.15 CCOC(=O)c1ccc(O)o1 Amb26640329 [0,1,0,0,1,0|1,0,0]=3 4780 B11R1.15 CCOC(=O)c1ccc(O)s1 Amb20242357 [0,1,0,0,1,0|1,0,0]=3 4781 B11R1.15 CCOC(=O)c1ccn(C)c1 Amb23441089 [0,1,0,0,1,0|1,0,0]=3 4782 B11R1.15 CCOC(=O)c1ccn(C)n1 Amb9769238 [0,1,0,0,1,0|2,0,0]=4 4783 B11R1.15 CCOC(=O)c1ccn(O)n1 Amb27860177 [0,1,0,0,1,0|2,0,0]=4 4784 B11R1.15 CCOC(=O)c1cn(C)cn1 Amb17739732 [0,1,0,0,1,0|2,0,0]=4 4785 B11R1.15 CCOC(=O)c1cnc(Br)o1 Amb19957768 [0,1,0,0,1,0|2,0,0]=4 4786 B11R1.15 CCOC(=O)c1cnc(Br)s1 Amb33548862 [0,1,0,0,1,0|2,0,0]=4 4787 B11R1.15 CCOC(=O)c1cnc(C)s1 Amb8630333 [0,1,0,0,1,0|2,0,0]=4 4788 B11R1.15 CCOC(=O)c1cnc(Cl)o1 Amb10069143 [0,1,0,0,1,0|2,0,0]=4 4789 B11R1.15 CCOC(=O)c1cnc(Cl)s1 Amb16232258 [0,1,0,0,1,0|2,0,0]=4 4790 B11R1.15 CCOC(=O)c1cnc(F)s1 Amb26643174 [0,1,0,0,1,0|2,0,0]=4 4791 B11R1.15 CCOC(=O)c1cnc(I)o1 Amb28455184 [0,1,0,0,1,0|2,0,0]=4 4792 B11R1.15 CCOC(=O)c1cnc(N)o1 Amb10071289 [0,1,0,0,1,0|2,0,0]=4 4793 B11R1.15 CCOC(=O)c1cnc(N)s1 Amb10068446 [0,1,0,0,1,0|2,0,0]=4 4794 B11R1.15 CCOC(=O)c1cnc(N)s1 Amb2455927 [0,1,0,0,1,0|2,0,0]=4 4795 B11R1.15 CCOC(=O)c1cnc(O)s1 Amb24330425 [0,1,0,0,1,0|2,0,0]=4 4796 B11R1.15 CCOC(=O)c1cnc(S)s1 Amb22757479 [0,1,0,0,1,0|2,0,0]=4 4797 B11R1.15 CCOC(=O)c1cnn(C)c1 Amb33531553 [0,1,0,0,1,0|2,0,0]=4 4798 B11R1.15 CCOC(=O)c1coc(Br)c1 Amb22583751 [0,1,0,0,1,0|1,0,0]=3 4799 B11R1.15 CCOC(=O)c1coc(Br)n1 Amb10069182 [0,1,0,0,1,0|2,0,0]=4 4800 B11R1.15 CCOC(=O)c1coc(C)c1 Amb21964297 [0,1,0,0,1,0|1,0,0]=3 4801 B11R1.15 CCOC(=O)c1coc(C)n1 Amb6307348 [0,1,0,0,1,0|2,0,0]=4 4802 B11R1.15 CCOC(=O)c1coc(Cl)c1 Amb24651519 [0,1,0,0,1,0|1,0,0]=3 4803 B11R1.15 CCOC(=O)c1coc(Cl)n1 Amb2455677 [0,1,0,0,1,0|2,0,0]=4 4804 B11R1.15 CCOC(=O)c1coc(I)c1 Amb25162858 [0,1,0,0,1,0|1,0,0]=3 4805 B11R1.15 CCOC(=O)c1coc(I)n1 Amb22504351 [0,1,0,0,1,0|2,0,0]=4 4806 B11R1.15 CCOC(=O)c1coc(N)c1 Amb27646668 [0,1,0,0,1,0|1,0,0]=3 4807 B11R1.15 CCOC(=O)c1coc(N)n1 Amb2455681 [0,1,0,0,1,0|2,0,0]=4 4808 B11R1.15 CCOC(=O)c1coc(S)n1 Amb26857406 [0,1,0,0,1,0|2,0,0]=4 4809 B11R1.15 CCOC(=O)c1csc(Br)c1 Amb21520180 [0,1,0,0,1,0|1,0,0]=3 4810 B11R1.15 CCOC(=O)c1csc(Br)n1 Amb2455713 [0,1,0,0,1,0|2,0,0]=4 4811 B11R1.15 CCOC(=O)c1csc(C)c1 Amb22494673 [0,1,0,0,1,0|1,0,0]=3 4812 B11R1.15 CCOC(=O)c1csc(C)n1 Amb6357480 [0,1,0,0,1,0|2,0,0]=4 4813 B11R1.15 CCOC(=O)c1csc(Cl)c1 Amb26360860 [0,1,0,0,1,0|1,0,0]=3 4814 B11R1.15 CCOC(=O)c1csc(Cl)n1 Amb10067792 [0,1,0,0,1,0|2,0,0]=4 4815 B11R1.15 CCOC(=O)c1csc(F)c1 Amb27965598 [0,1,0,0,1,0|1,0,0]=3 4816 B11R1.15 CCOC(=O)c1csc(F)n1 Amb21964349 [0,1,0,0,1,0|2,0,0]=4 4817 B11R1.15 CCOC(=O)c1csc(I)c1 Amb27764686 [0,1,0,0,1,0|1,0,0]=3 4818 B11R1.15 CCOC(=O)c1csc(I)n1 Amb27812375 [0,1,0,0,1,0|2,0,0]=4 4819 B11R1.15 CCOC(=O)c1csc(N)c1 Amb18302898 [0,1,0,0,1,0|1,0,0]=3 4820 B11R1.15 CCOC(=O)c1csc(N)n1 Amb1106793 [0,1,0,0,1,0|2,0,0]=4 4821 B11R1.15 CCOC(=O)c1csc(N)n1 Amb17659102 [0,1,0,0,1,0|2,0,0]=4 4822 B11R1.15 CCOC(=O)c1csc(N)n1 Amb21520416 [0,1,0,0,1,0|2,0,0]=4 4823 B11R1.15 CCOC(=O)c1csc(O)n1 Amb25114134 [0,1,0,0,1,0|2,0,0]=4 4824 B11R1.15 CCOC(=O)c1csc(S)c1 Amb26941115 [0,1,0,0,1,0|1,0,0]=3 4825 B11R1.15 CCOC(=O)c1csc(S)n1 Amb27147782 [0,1,0,0,1,0|2,0,0]=4 4826 B11R1.15 CCOC(=O)c1nc(Br)cs1 Amb13883509 [0,1,0,0,1,0|2,0,0]=4 4827 B11R1.15 CCOC(=O)c1nc(C)co1 Amb21964399 [0,1,0,0,1,0|2,0,0]=4 4828 B11R1.15 CCOC(=O)c1nc(C)cs1 Amb10842198 [0,1,0,0,1,0|2,0,0]=4 4829 B11R1.15 CCOC(=O)c1nc(Cl)cs1 Amb24465884 [0,1,0,0,1,0|2,0,0]=4 4830 B11R1.15 CCOC(=O)c1nc(F)cs1 Amb25927260 [0,1,0,0,1,0|2,0,0]=4 4831 B11R1.15 CCOC(=O)c1nc(N)cs1 Amb28322758 [0,1,0,0,1,0|2,0,0]=4 4832 B11R1.15 CCOC(=O)c1nc(O)cs1 Amb35710165 [0,1,0,0,1,0|2,0,0]=4 4833 B11R1.15 CCOC(=O)c1ncc(Br)s1 Amb22233824 [0,1,0,0,1,0|2,0,0]=4 4834 B11R1.15 CCOC(=O)c1ncc(C)o1 Amb20621703 [0,1,0,0,1,0|2,0,0]=4 4835 B11R1.15 CCOC(=O)c1ncc(Cl)s1 Amb27946194 [0,1,0,0,1,0|2,0,0]=4 4836 B11R1.15 CCOC(=O)c1ncc(I)s1 Amb25884047 [0,1,0,0,1,0|2,0,0]=4 4837 B11R1.15 CCOC(=O)c1ncc(N)s1 Amb20668232 [0,1,0,0,1,0|2,0,0]=4 4838 B11R1.15 CCOC(=O)c1ncc(N)s1 Amb33172792 [0,1,0,0,1,0|2,0,0]=4 4839 B11R1.15 CCOC(=O)n1ccc(C)c1 Amb27590364 [0,1,0,0,1,0|1,0,0]=3 4840 B11R1.15 CCOC(=O)n1ccc(N)n1 Amb27451611 [0,1,0,0,1,0|2,0,0]=4 4841 B11R1.29 C#CCOC(=O)c1ccco1 Amb27471795 [0,1,0,0,1,0|1,0,1]=4 4842 B11R1.29 C#CCOC(=O)c1cccs1 Amb27604140 [0,1,0,0,1,0|1,0,1]=4 4843 B11R1.29 C#CCOC(=O)c1ccoc1 Amb28200833 [0,1,0,0,1,0|1,0,1]=4 4844 B11R1.29 C=CCOC(=O)c1ccoc1 Amb24763033 [0,1,0,0,1,0|1,0,1]=4 4845 B11R1.29 C=CCOC(=O)c1ccsc1 Amb27270318 [0,1,0,0,1,0|1,0,1]=4 4846 B11R1.29 CCCCC(=O)c1ccco1 Amb10070291 [0,1,0,0,1,0|2,0,0]=4 4847 B11R1.29 CCCCC(=O)c1cccs1 Amb8850831 [0,1,0,0,1,0|2,0,0]=4 4848 B11R1.29 CCCCC(=O)c1ccoc1 Amb10562664 [0,1,0,0,1,0|2,0,0]=4 4849 B11R1.29 CCCNC(=O)c1ccoc1 Amb8331910 [0,1,0,0,1,0|2,0,0]=4 4850 B11R1.29 CCCNC(=O)c1ccsc1 Amb25866439 [0,1,0,0,1,0|2,0,0]=4 4851 B11R1.29 CCCOC(=O)c1ccco1 Amb9242873 [0,1,0,0,1,0|1,0,0]=3 4852 B11R1.29 CCCOC(=O)c1ccon1 Amb18182961 [0,1,0,0,1,0|2,0,0]=4 4853 B11R1.29 CCCOC(=O)c1cnco1 Amb28387222 [0,1,0,0,1,0|2,0,0]=4 4854 B11R1.29 CCCOC(=O)c1cocn1 Amb28387223 [0,1,0,0,1,0|2,0,0]=4 4855 B11R1.29 CCCOC(=O)c1ncco1 Amb27492623 [0,1,0,0,1,0|2,0,0]=4 4856 B11R1.29 CCCOC(=O)c1nccs1 Amb28387225 [0,1,0,0,1,0|2,0,0]=4 4857 B11R1.29 CCNCC(=O)c1ccco1 Amb26651169 [0,1,0,0,1,0|2,0,0]=4 4858 B11R1.29 CCNCC(=O)c1cccs1 Amb17314790 [0,1,0,0,1,0|2,0,0]=4 4859 B11R1.29 CCNCC(=O)c1ccoc1 Amb26651176 [0,1,0,0,1,0|2,0,0]=4 4860 B11R1.29 CCNCC(=O)c1ccsc1 Amb26651265 [0,1,0,0,1,0|2,0,0]=4 4861 B11R1.29 CCOCC(=O)c1ccco1 Amb9666059 [0,1,0,0,1,0|1,0,0]=3 4862 B11R1.29 CCOCC(=O)c1ccoc1 Amb27266585 [0,1,0,0,1,0|1,0,0]=3 4863 B11R1.29 CCOCC(=O)c1ccsc1 Amb27266587 [0,1,0,0,1,0|1,0,0]=3 4864 B11R1.29 CCOCC(=O)c1ncco1 Amb27492624 [0,1,0,0,1,0|2,0,0]=4 4865 B11R1.29 CCOCC(=O)c1nccs1 Amb33250596 [0,1,0,0,1,0|2,0,0]=4 4866 B11R1.29 CCONC(=O)c1ccco1 Amb10572673 [0,1,0,0,1,0|1,0,0]=3 4867 B11R1.29 CCONC(=O)c1nccs1 Amb27262285 [0,1,0,0,1,0|2,0,0]=4 4868 B11R1.29 CCO\N=C(/N)c1ccco1 Amb18224352 [0,1,0,0,1,0|2,0,0]=4 4869 B11R1.29 CCO\N=C(/N)c1cccs1 Amb18862840 [0,1,0,0,1,0|2,0,0]=4 4870 B11R1.29 CCSCC(=O)c1ccco1 Amb9668504 [0,1,0,0,1,0|1,1,0]=4 4871 B11R1.29 CC\C=C\C(=O)c1ccoc1 Amb27410280 [0,1,0,0,1,0|2,0,0]=4 4872 B11R1.29 CNCCC(=O)c1ccco1 Amb25382971 [0,1,0,0,1,0|2,0,0]=4 4873 B11R1.29 CNCCC(=O)c1cccs1 Amb17334774 [0,1,0,0,1,0|2,0,0]=4 4874 B11R1.29 CNCCC(=O)c1cccs1 Amb22235115 [0,1,0,0,1,0|2,0,0]=4 4875 B11R1.29 CNCCC(=O)c1ccoc1 Amb26651283 [0,1,0,0,1,0|2,0,0]=4 4876 B11R1.29 CNCCC(=O)c1ccsc1 Amb26651321 [0,1,0,0,1,0|2,0,0]=4 4877 B11R1.29 COCCC(=O)c1ccoc1 Amb27266770 [0,1,0,0,1,0|2,0,0]=4 4878 B11R1.29 COCCC(=O)c1ccsc1 Amb18801855 [0,1,0,0,1,0|2,0,0]=4 4879 B11R1.29 N#CCOC(=O)c1ccco1 Amb25061211 [0,1,0,0,1,0|1,0,1]=4 4880 B11R1.29 N#CCOC(=O)c1ccsc1 Amb27163181 [0,1,0,0,1,0|1,0,1]=4 4881 B11R1.29 NCCCC(=O)c1ccco1 Amb18120247 [0,1,0,0,1,0|2,0,0]=4 4882 B11R1.29 NCCCC(=O)c1cccs1 Amb18623716 [0,1,0,0,1,0|2,0,0]=4 4883 B11R1.29 NCCCC(=O)c1ccoc1 Amb26651270 [0,1,0,0,1,0|2,0,0]=4 4884 B11R1.29 NCCCC(=O)c1ccsc1 Amb26651304 [0,1,0,0,1,0|2,0,0]=4 4885 B11R1.29 NCCNC(=O)c1ccco1 Amb1869482 [0,1,0,0,1,0|2,0,0]=4 4886 B11R1.29 NCCNC(=O)c1ccco1 Amb4026631 [0,1,0,0,1,0|2,0,0]=4 4887 B11R1.29 NCCNC(=O)c1cccs1 Amb1133695 [0,1,0,0,1,0|2,0,0]=4 4888 B11R1.29 NCCNC(=O)c1ccoc1 Amb10610129 [0,1,0,0,1,0|2,0,0]=4 4889 B11R1.29 NCCNC(=O)c1ccoc1 Amb1124187 [0,1,0,0,1,0|2,0,0]=4 4890 B11R1.29 NCCOC(=O)n1ccnc1 Amb27989980 [0,1,0,0,1,0|2,0,0]=4 4891 B11R1.29 O=C(CCCBr)c1ccco1 Amb10562218 [0,1,0,0,1,0|2,0,0]=4 4892 B11R1.29 O=C(CCCBr)c1cccs1 Amb17250552 [0,1,0,0,1,0|2,0,0]=4 4893 B11R1.29 O=C(CCCCl)c1ccco1 Amb17138699 [0,1,0,0,1,0|2,0,0]=4 4894 B11R1.29 O=C(CCCCl)c1cccs1 Amb1159154 [0,1,0,0,1,0|2,0,0]=4 4895 B11R1.29 O=C(CCCO)c1cccs1 Amb1110142 [0,1,0,0,1,0|2,0,0]=4 4896 B11R1.29 O=C(NCCCl)c1ccco1 Amb17103197 [0,1,0,0,1,0|2,0,0]=4 4897 B11R1.29 O=C(NCCCl)c1cccs1 Amb17103198 [0,1,0,0,1,0|2,0,0]=4 4898 B11R1.29 O=C(NCCF)c1cccs1 Amb28048737 [0,1,0,0,1,0|2,0,0]=4 4899 B11R1.29 O=C(NCCI)c1cccs1 Amb28255141 [0,1,0,0,1,0|2,0,0]=4 4900 B11R1.29 O=C(NCCO)c1ccco1 Amb9242269 [0,1,0,0,1,0|2,0,0]=4 4901 B11R1.29 O=C(NCCO)c1cccs1 Amb5719804 [0,1,0,0,1,0|2,0,0]=4 4902 B11R1.29 O=C(NCCO)c1ccsc1 Amb9245231 [0,1,0,0,1,0|2,0,0]=4 4903 B11R1.29 O=C(OCCBr)c1cccs1 Amb33276565 [0,1,0,0,1,0|1,0,0]=3 4904 B11R1.29 O=C(OCCBr)c1ccoc1 Amb33276614 [0,1,0,0,1,0|1,0,0]=3 4905 B11R1.29 O=C(OCCBr)c1ccon1 Amb33276641 [0,1,0,0,1,0|2,0,0]=4 4906 B11R1.29 O=C(OCCBr)c1ccsc1 Amb33050574 [0,1,0,0,1,0|1,0,0]=3 4907 B11R1.29 O=C(OCCBr)c1cnco1 Amb33276633 [0,1,0,0,1,0|2,0,0]=4 4908 B11R1.29 O=C(OCCBr)c1cncs1 Amb33276637 [0,1,0,0,1,0|2,0,0]=4 4909 B11R1.29 O=C(OCCBr)c1cnoc1 Amb33050365 [0,1,0,0,1,0|2,0,0]=4 4910 B11R1.29 O=C(OCCBr)c1cocn1 Amb33051076 [0,1,0,0,1,0|2,0,0]=4 4911 B11R1.29 O=C(OCCBr)c1cscn1 Amb33050409 [0,1,0,0,1,0|2,0,0]=4 4912 B11R1.29 O=C(OCCBr)c1nccs1 Amb33051929 [0,1,0,0,1,0|2,0,0]=4 4913 B11R1.29 O=C(OCCF)c1ccco1 Amb27818404 [0,1,0,0,1,0|1,0,0]=3 4914 B11R1.29 O=C(OCCF)c1cccs1 Amb27818405 [0,1,0,0,1,0|1,0,0]=3 4915 B11R1.29 O=C(OCCF)c1ccoc1 Amb27818407 [0,1,0,0,1,0|1,0,0]=3 4916 B11R1.29 O=C(OCCF)c1ccon1 Amb27818408 [0,1,0,0,1,0|2,0,0]=4 4917 B11R1.29 O=C(OCCF)c1ccsc1 Amb27818409 [0,1,0,0,1,0|1,0,0]=3 4918 B11R1.29 O=C(OCCF)c1cncs1 Amb27818226 [0,1,0,0,1,0|2,0,0]=4 4919 B11R1.29 O=C(OCCO)C1C=CC=C1 Amb25382184 [0,1,0,0,1,0|0,0,1]=3 4920 B11R1.29 O=C(OCCO)c1ccco1 Amb27272304 [0,1,0,0,1,0|1,0,0]=3 4921 B11R1.29 O=C(OCCO)c1cccs1 Amb27000753 [0,1,0,0,1,0|1,0,0]=3 4922 B11R1.29 [NH3+]CCNC(=O)c1cccs1 Amb9816866 [0,1,0,0,1,0|2,0,0]=4 4923 B11R1.31 CCC(=O)C(=O)c1ccco1 Amb27861480 [0,1,0,0,1,0|2,0,0]=4 4924 B11R1.31 CCC(=O)C(=O)c1cccs1 Amb17400253 [0,1,0,0,1,0|2,0,0]=4 4925 B11R1.31 CCC(Br)C(=O)c1ccco1 Amb22500045 [0,1,0,0,1,0|2,0,0]=4 4926 B11R1.31 CCC(Br)C(=O)c1cccs1 Amb17437828 [0,1,0,0,1,0|2,0,0]=4 4927 B11R1.31 CCC(Cl)C(=O)c1ccco1 Amb27949191 [0,1,0,0,1,0|2,0,0]=4 4928 B11R1.31 CCC(Cl)C(=O)c1cccs1 Amb18049327 [0,1,0,0,1,0|2,0,0]=4 4929 B11R1.31 CCC(N)C(=O)c1ccco1 Amb18201130 [0,1,0,0,1,0|2,0,0]=4 4930 B11R1.31 CCC(N)C(=O)c1cccs1 Amb4051109 [0,1,0,0,1,0|2,0,0]=4 4931 B11R1.31 CCC(N)C(=O)c1ccoc1 Amb24667990 [0,1,0,0,1,0|2,0,0]=4 4932 B11R1.31 CCC(N)C(=O)c1ccsc1 Amb25824262 [0,1,0,0,1,0|2,0,0]=4 4933 B11R1.31 CCC(O)C(=O)c1cccs1 Amb27601300 [0,1,0,0,1,0|2,0,0]=4 4934 B11R1.31 CCN(C)C(=O)c1ccco1 Amb28423314 [0,1,0,0,1,0|2,0,0]=4 4935 B11R1.31 CCN(C)C(=O)c1cccs1 Amb28187448 [0,1,0,0,1,0|2,0,0]=4 4936 B11R1.31 CCN(C)C(=O)c1ccsc1 Amb27443872 [0,1,0,0,1,0|2,0,0]=4 4937 B11R1.31 CCN(O)C(=O)c1ccco1 Amb27774355 [0,1,0,0,1,0|2,0,0]=4 4938 B11R1.31 CCN(O)C(=O)c1cccs1 Amb27468102 [0,1,0,0,1,0|2,0,0]=4 4939 B11R1.31 CC[C@@H](N)C(=O)c1ccco1 Amb33131847 [0,1,0,0,1,0|2,0,0]=4 4940 B11R1.31 CC[C@@H](N)C(=O)c1cccs1 Amb33131855 [0,1,0,0,1,0|2,0,0]=4 4941 B11R1.31 CC[C@@H](N)C(=O)c1ccoc1 Amb33131846 [0,1,0,0,1,0|2,0,0]=4 4942 B11R1.31 CC[C@@H](N)C(=O)c1ccsc1 Amb33131854 [0,1,0,0,1,0|2,0,0]=4 4943 B11R1.31 CC[C@H](C)C(=O)c1cccs1 Amb27256551 [0,1,0,0,1,0|2,0,0]=4 4944 B11R1.31 CC[C@H](N)C(=O)c1ccco1 Amb30038865 [0,1,0,0,1,0|2,0,0]=4 4945 B11R1.31 CC[C@H](N)C(=O)c1cccs1 Amb30038009 [0,1,0,0,1,0|2,0,0]=4 4946 B11R1.31 CC[C@H](N)C(=O)c1ccoc1 Amb30038864 [0,1,0,0,1,0|2,0,0]=4 4947 B11R1.31 CC[C@H](N)C(=O)c1ccsc1 Amb30037774 [0,1,0,0,1,0|2,0,0]=4 4948 B11R1.77 CC(C)CC(=O)c1ccco1 Amb17334321 [0,1,0,0,1,0|2,0,0]=4 4949 B11R1.77 CC(C)CC(=O)c1cccs1 Amb9214316 [0,1,0,0,1,0|2,0,0]=4 4950 B11R1.77 CC(C)CC(=O)c1ccsc1 Amb18180157 [0,1,0,0,1,0|2,0,0]=4 4951 B11R1.77 CC(C)NC(=O)c1cccs1 Amb3375143 [0,1,0,0,1,0|2,0,0]=4 4952 B11R1.77 CC(C)NC(=O)c1ccoc1 Amb8330747 [0,1,0,0,1,0|2,0,0]=4 4953 B11R1.77 CC(C)NC(=O)c1ccsc1 Amb8339314 [0,1,0,0,1,0|2,0,0]=4 4954 B11R1.77 CC(C)OC(=O)c1ccco1 Amb10572174 [0,1,0,0,1,0|1,0,0]=3 4955 B11R1.77 CC(C)OC(=O)c1cncs1 Amb26656340 [0,1,0,0,1,0|2,0,0]=4 4956 B11R1.77 CC(C)OC(=O)c1cscn1 Amb25787053 [0,1,0,0,1,0|2,0,0]=4 4957 B11R1.77 CC(C)OC(=O)c1nccs1 Amb27457617 [0,1,0,0,1,0|2,0,0]=4 4958 B11R1.77 CC(C)OC(=O)n1ccnc1 Amb26569600 [0,1,0,0,1,0|2,0,0]=4 4959 B11R1.77 CC(Cl)OC(=O)c1ccco1 Amb27478035 [0,1,0,0,1,0|1,0,0]=3 4960 B11R1.77 CC(N)CC(=O)c1ccco1 Amb20668936 [0,1,0,0,1,0|2,0,0]=4 4961 B11R1.77 CC(N)CC(=O)c1ccco1 Amb22157232 [0,1,0,0,1,0|2,0,0]=4 4962 B11R1.77 CC(N)CC(=O)c1cccs1 Amb25328083 [0,1,0,0,1,0|2,0,0]=4 4963 B11R1.77 CC(N)CC(=O)c1cccs1 Amb30584790 [0,1,0,0,1,0|2,0,0]=4 4964 B11R1.77 CC(N)CC(=O)c1ccoc1 Amb25188641 [0,1,0,0,1,0|2,0,0]=4 4965 B11R1.77 CC(N)CC(=O)c1ccsc1 Amb24745178 [0,1,0,0,1,0|2,0,0]=4 4966 B11R1.77 C[C@@H](N)CC(=O)c1ccco1 Amb33307803 [0,1,0,0,1,0|2,0,0]=4 4967 B11R1.77 C[C@@H](N)CC(=O)c1cccs1 Amb33307812 [0,1,0,0,1,0|2,0,0]=4 4968 B11R1.77 C[C@@H](N)CC(=O)c1ccoc1 Amb33307802 [0,1,0,0,1,0|2,0,0]=4 4969 B11R1.77 C[C@@H](N)CC(=O)c1ccsc1 Amb33307811 [0,1,0,0,1,0|2,0,0]=4 4970 B11R1.77 O=C(OC(F)F)c1ccco1 Amb28188494 [0,1,0,0,1,0|2,0,0]=4 4971 B11R1.199 CCCC(=O)c1ccoc1Br Amb27981141 [0,1,0,0,1,0|2,0,0]=4 4972 B11R1.199 CCCC(=O)c1ccsc1Br Amb29891902 [0,1,0,0,1,0|2,0,0]=4 4973 B11R1.199 CCCC(=O)c1ccsc1Cl Amb28396752 [0,1,0,0,1,0|2,0,0]=4 4974 B11R1.199 CCCC(=O)c1occc1C Amb27163611 [0,1,0,0,1,0|2,0,0]=4 4975 B11R1.199 CCCC(=O)c1sccc1C Amb3940840 [0,1,0,0,1,0|2,0,0]=4 4976 B11R1.199 CCCC(=O)c1sccc1F Amb27176890 [0,1,0,0,1,0|2,0,0]=4 4977 B11R1.199 CCCC(=O)c1sccc1I Amb28424046 [0,1,0,0,1,0|2,0,0]=4 4978 B11R1.199 CCNC(=O)c1cccn1C Amb22001194 [0,1,0,0,1,0|2,0,0]=4 4979 B11R1.199 CCNC(=O)c1ccoc1C Amb6556180 [0,1,0,0,1,0|2,0,0]=4 4980 B11R1.199 CCNC(=O)c1ccoc1Cl Amb27757924 [0,1,0,0,1,0|2,0,0]=4 4981 B11R1.199 CCNC(=O)c1ccsc1Br Amb35712878 [0,1,0,0,1,0|2,0,0]=4 4982 B11R1.199 CCNC(=O)c1ccsc1Cl Amb27592503 [0,1,0,0,1,0|2,0,0]=4 4983 B11R1.199 CCNC(=O)c1occc1C Amb8327838 [0,1,0,0,1,0|2,0,0]=4 4984 B11R1.199 CCNC(=O)c1sccc1I Amb27840081 [0,1,0,0,1,0|2,0,0]=4 4985 B11R1.199 CCNC(=O)c1sccc1N Amb18281745 [0,1,0,0,1,0|2,0,0]=4 4986 B11R1.199 CCOC(=N)c1ccoc1C Amb27658775 [0,1,0,0,1,0|2,0,0]=4 4987 B11R1.199 CCOC(=N)c1occc1C Amb27841957 [0,1,0,0,1,0|2,0,0]=4 4988 B11R1.199 CCOC(=N)c1sccc1Br Amb28289122 [0,1,0,0,1,0|2,0,0]=4 4989 B11R1.199 CCOC(=N)c1sccc1C Amb18180214 [0,1,0,0,1,0|2,0,0]=4 4990 B11R1.199 CCOC(=N)c1sccc1Cl Amb28455882 [0,1,0,0,1,0|2,0,0]=4 4991 B11R1.199 CCOC(=O)C1=CC=CC1=O Amb24608577 [0,1,0,0,1,0|0,0,0]=2 4992 B11R1.199 CCOC(=O)C1=CNOC1=N Amb18526953 [0,1,0,0,1,0|2,0,0]=4 4993 B11R1.199 CCOC(=O)C1=CNOC1=O Amb24053122 [0,1,0,0,1,0|2,0,0]=4 4994 B11R1.199 CCOC(=O)C1=CONC1=O Amb20000465 [0,1,0,0,1,0|2,0,0]=4 4995 B11R1.199 CCOC(=O)C1=NCC=C1C Amb27591639 [0,1,0,0,1,0|1,0,1]=4 4996 B11R1.199 CCOC(=O)N1C=CNC1=S Amb28325737 [0,1,0,0,1,0|2,0,0]=4 4997 B11R1.199 CCOC(=O)N1CC=CC1=O Amb22494811 [0,1,0,0,1,0|1,0,1]=4 4998 B11R1.199 CCOC(=O)c1cccn1C Amb20621241 [0,1,0,0,1,0|1,0,0]=3 4999 B11R1.199 CCOC(=O)c1cccn1N Amb19889828 [0,1,0,0,1,0|1,0,0]=3 5000 B11R1.199 CCOC(=O)c1ccnn1C Amb6890358 [0,1,0,0,1,0|2,0,0]=4 5001 B11R1.199 CCOC(=O)c1ccoc1C Amb2794374 [0,1,0,0,1,0|1,0,0]=3 5002 B11R1.199 CCOC(=O)c1ccoc1Cl Amb27397267 [0,1,0,0,1,0|1,0,0]=3 5003 B11R1.199 CCOC(=O)c1ccoc1N Amb26026845 [0,1,0,0,1,0|1,0,0]=3 5004 B11R1.199 CCOC(=O)c1ccoc1O Amb4003734 [0,1,0,0,1,0|1,0,0]=3 5005 B11R1.199 CCOC(=O)c1ccsc1Br Amb7173233 [0,1,0,0,1,0|1,0,0]=3 5006 B11R1.199 CCOC(=O)c1ccsc1C Amb16233433 [0,1,0,0,1,0|1,0,0]=3 5007 B11R1.199 CCOC(=O)c1ccsc1Cl Amb22750949 [0,1,0,0,1,0|1,0,0]=3 5008 B11R1.199 CCOC(=O)c1ccsc1N Amb6357047 [0,1,0,0,1,0|1,0,0]=3 5009 B11R1.199 CCOC(=O)c1cncn1C Amb16233121 [0,1,0,0,1,0|2,0,0]=4 5010 B11R1.199 CCOC(=O)c1cncn1N Amb22292038 [0,1,0,0,1,0|2,0,0]=4 5011 B11R1.199 CCOC(=O)c1cnoc1C Amb8393138 [0,1,0,0,1,0|2,0,0]=4 5012 B11R1.199 CCOC(=O)c1cnoc1N Amb1092565 [0,1,0,0,1,0|2,0,0]=4 5013 B11R1.199 CCOC(=O)c1cnoc1O Amb6891224 [0,1,0,0,1,0|2,0,0]=4 5014 B11R1.199 CCOC(=O)c1conc1Br Amb24533126 [0,1,0,0,1,0|2,0,0]=4 5015 B11R1.199 CCOC(=O)c1conc1C Amb9809951 [0,1,0,0,1,0|2,0,0]=4 5016 B11R1.199 CCOC(=O)c1conc1N Amb25837458 [0,1,0,0,1,0|2,0,0]=4 5017 B11R1.199 CCOC(=O)c1cscc1Br Amb26608044 [0,1,0,0,1,0|1,0,0]=3 5018 B11R1.199 CCOC(=O)c1cscc1N Amb18118353 [0,1,0,0,1,0|1,0,0]=3 5019 B11R1.199 CCOC(=O)c1cscc1O Amb26637017 [0,1,0,0,1,0|1,0,0]=3 5020 B11R1.199 CCOC(=O)c1csnc1C Amb10071450 [0,1,0,0,1,0|2,0,0]=4 5021 B11R1.199 CCOC(=O)c1nccn1C Amb1071172 [0,1,0,0,1,0|2,0,0]=4 5022 B11R1.199 CCOC(=O)c1nccn1N Amb22292353 [0,1,0,0,1,0|2,0,0]=4 5023 B11R1.199 CCOC(=O)c1ncoc1Br Amb26435269 [0,1,0,0,1,0|2,0,0]=4 5024 B11R1.199 CCOC(=O)c1ncoc1C Amb18179574 [0,1,0,0,1,0|2,0,0]=4 5025 B11R1.199 CCOC(=O)c1ncoc1Cl Amb27839965 [0,1,0,0,1,0|2,0,0]=4 5026 B11R1.199 CCOC(=O)c1ncsc1Br Amb10067421 [0,1,0,0,1,0|2,0,0]=4 5027 B11R1.199 CCOC(=O)c1ncsc1C Amb19737364 [0,1,0,0,1,0|2,0,0]=4 5028 B11R1.199 CCOC(=O)c1ncsc1Cl Amb21964354 [0,1,0,0,1,0|2,0,0]=4 5029 B11R1.199 CCOC(=O)c1ncsc1F Amb27647030 [0,1,0,0,1,0|2,0,0]=4 5030 B11R1.199 CCOC(=O)c1ncsc1N Amb18126892 [0,1,0,0,1,0|2,0,0]=4 5031 B11R1.199 CCOC(=O)c1ncsc1N Amb22494301 [0,1,0,0,1,0|2,0,0]=4 5032 B11R1.199 CCOC(=O)c1ncsc1S Amb18640249 [0,1,0,0,1,0|2,0,0]=4 5033 B11R1.199 CCOC(=O)c1nocc1Br Amb33484314 [0,1,0,0,1,0|2,0,0]=4 5034 B11R1.199 CCOC(=O)c1nocc1C Amb13883732 [0,1,0,0,1,0|2,0,0]=4 5035 B11R1.199 CCOC(=O)c1nocc1N Amb9836301 [0,1,0,0,1,0|2,0,0]=4 5036 B11R1.199 CCOC(=O)c1nscc1N Amb25760710 [0,1,0,0,1,0|2,0,0]=4 5037 B11R1.199 CCOC(=O)c1occc1Br Amb24486752 [0,1,0,0,1,0|1,0,0]=3 5038 B11R1.199 CCOC(=O)c1occc1C Amb9273947 [0,1,0,0,1,0|1,0,0]=3 5039 B11R1.199 CCOC(=O)c1occc1N Amb21857505 [0,1,0,0,1,0|1,0,0]=3 5040 B11R1.199 CCOC(=O)c1occc1N Amb31291643 [0,1,0,0,1,0|1,0,0]=3 5041 B11R1.199 CCOC(=O)c1ocnc1Br Amb19958101 [0,1,0,0,1,0|2,0,0]=4 5042 B11R1.199 CCOC(=O)c1ocnc1C Amb1085910 [0,1,0,0,1,0|2,0,0]=4 5043 B11R1.199 CCOC(=O)c1oncc1C Amb27471935 [0,1,0,0,1,0|2,0,0]=4 5044 B11R1.199 CCOC(=O)c1sccc1Br Amb21858437 [0,1,0,0,1,0|1,0,0]=3 5045 B11R1.199 CCOC(=O)c1sccc1C Amb9242877 [0,1,0,0,1,0|1,0,0]=3 5046 B11R1.199 CCOC(=O)c1sccc1Cl Amb21961313 [0,1,0,0,1,0|1,0,0]=3 5047 B11R1.199 CCOC(=O)c1sccc1F Amb25191175 [0,1,0,0,1,0|1,0,0]=3 5048 B11R1.199 CCOC(=O)c1sccc1I Amb25751041 [0,1,0,0,1,0|1,0,0]=3 5049 B11R1.199 CCOC(=O)c1sccc1N Amb13889596 [0,1,0,0,1,0|1,0,0]=3 5050 B11R1.199 CCOC(=O)c1scnc1Br Amb10602634 [0,1,0,0,1,0|2,0,0]=4 5051 B11R1.199 CCOC(=O)c1scnc1C Amb8391091 [0,1,0,0,1,0|2,0,0]=4 5052 B11R1.199 CCOC(=O)c1scnc1N Amb21864786 [0,1,0,0,1,0|2,0,0]=4 5053 B11R1.199 CCOC(=O)n1cccc1Br Amb25305656 [0,1,0,0,1,0|1,0,0]=3 5054 B11R1.199 CCOC(=O)n1ccnc1C Amb27176287 [0,1,0,0,1,0|2,0,0]=4 5055 B11R1.199 CCOC(=O)n1nccc1Br Amb33297552 [0,1,0,0,1,0|2,0,0]=4 5056 B11R1.199 CCOC(=O)n1nccc1N Amb24485887 [0,1,0,0,1,0|2,0,0]=4 5057 B13R1.19 C=NOC(=O)Nc1ccc(C)cc1 Amb27829831 [0,1,0,0,0,1|1,0,1]=4 5058 B13R1.19 CC#CC(=O)Nc1ccc(I)cc1 Amb28072417 [0,1,0,0,0,1|1,0,1]=4 5059 B13R1.19 CCCC(=N)Nc1ccc(F)cc1 Amb27836927 [0,1,0,0,0,1|2,0,0]=4 5060 B13R1.19 CCCC(=O)Cc1ccc(C)cc1 Amb17138797 [0,1,0,0,0,1|1,0,0]=3 5061 B13R1.19 CCCC(=O)Cc1ccc(Cl)cc1 Amb17139628 [0,1,0,0,0,1|1,0,0]=3 5062 B13R1.19 CCCC(=O)Cc1ccc(F)cc1 Amb17138963 [0,1,0,0,0,1|1,0,0]=3 5063 B13R1.19 CCCC(=O)NC1=CNC(=O)C=C1 Amb27828380 [0,1,0,0,0,1|2,0,0]=4 5064 B13R1.19 CCCC(=O)Nc1ccc(Br)cc1 Amb1195957 [0,1,0,0,0,1|1,0,0]=3 5065 B13R1.19 CCCC(=O)Nc1ccc(Br)cn1 Amb6802022 [0,1,0,0,0,1|2,0,0]=4 5066 B13R1.19 CCCC(=O)Nc1ccc(C)cn1 Amb8333767 [0,1,0,0,0,1|2,0,0]=4 5067 B13R1.19 CCCC(=O)Nc1ccc(C)nc1 Amb27607354 [0,1,0,0,0,1|2,0,0]=4 5068 B13R1.19 CCCC(=O)Nc1ccc(Cl)cn1 Amb3887010 [0,1,0,0,0,1|2,0,0]=4 5069 B13R1.19 CCCC(=O)Nc1ccc(I)cc1 Amb2660684 [0,1,0,0,0,1|1,0,0]=3 5070 B13R1.19 CCCC(=O)Nc1ccc(I)cn1 Amb6460272 [0,1,0,0,0,1|2,0,0]=4 5071 B13R1.19 CCCC(=O)Nc1ccc(N)cc1 Amb1790767 [0,1,0,0,0,1|1,0,0]=3 5072 B13R1.19 CCCC(=O)Nc1ccc(N)cn1 Amb2785102 [0,1,0,0,0,1|2,0,0]=4 5073 B13R1.19 CCCC(=O)Nc1ccc(O)cc1 Amb2661517 [0,1,0,0,0,1|1,0,0]=3 5074 B13R1.19 CCCC(=O)Nc1ccc(S)nc1 Amb17206133 [0,1,0,0,0,1|2,0,0]=4 5075 B13R1.19 CCCC(=O)Oc1ccc(Cl)cc1 Amb2674860 [0,1,0,0,0,1|1,0,0]=3 5076 B13R1.19 CCCS(=O)Nc1ccc(I)cc1 Amb27226932 [0,1,0,0,0,1|2,0,0]=4 5077 B13R1.19 CCCS(=O)Nc1ccc(O)cc1 Amb28437091 [0,1,0,0,0,1|2,0,0]=4 5078 B13R1.19 CCNC(=N)Cc1ccc(Br)cc1 Amb27604696 [0,1,0,0,0,1|2,0,0]=4 5079 B13R1.19 CCNC(=N)Cc1ccc(F)cc1 Amb28126013 [0,1,0,0,0,1|2,0,0]=4 5080 B13R1.19 CCNC(=N)Cc1ccc(O)cc1 Amb28140342 [0,1,0,0,0,1|2,0,0]=4 5081 B13R1.19 CCNC(=N)Nc1ccc(C)cc1 Amb18804672 [0,1,0,0,0,1|2,0,0]=4 5082 B13R1.19 CCNC(=O)Cc1ccc(Br)cc1 Amb6393565 [0,1,0,0,0,1|1,0,0]=3 5083 B13R1.19 CCNC(=O)Cc1ccc(Br)cn1 Amb23586126 [0,1,0,0,0,1|2,0,0]=4 5084 B13R1.19 CCNC(=O)Cc1ccc(F)cc1 Amb3886791 [0,1,0,0,0,1|1,0,0]=3 5085 B13R1.19 CCNC(=O)Cc1ccc(N)cc1 Amb1112064 [0,1,0,0,0,1|1,0,0]=3 5086 B13R1.19 CCNC(=O)Cc1ccc(N)cn1 Amb28254212 [0,1,0,0,0,1|2,0,0]=4 5087 B13R1.19 CCNC(=O)Cc1ccc(O)cc1 Amb26506351 [0,1,0,0,0,1|1,0,0]=3 5088 B13R1.19 CCNC(=O)Nc1ccc(Br)cc1 Amb3987206 [0,1,0,0,0,1|1,0,0]=3 5089 B13R1.19 CCNC(=O)Nc1ccc(Cl)cc1 Amb1233667 [0,1,0,0,0,1|1,0,0]=3 5090 B13R1.19 CCNC(=O)Nc1ccc(Cl)cn1 Amb25309531 [0,1,0,0,0,1|2,0,0]=4 5091 B13R1.19 CCNC(=O)Nc1ccc(F)cc1 Amb8343741 [0,1,0,0,0,1|1,0,0]=3 5092 B13R1.19 CCNC(=O)Nc1ccc(I)cc1 Amb27757790 [0,1,0,0,0,1|1,0,0]=3 5093 B13R1.19 CCNC(=O)Nc1ccc(I)cn1 Amb27223545 [0,1,0,0,0,1|2,0,0]=4 5094 B13R1.19 CCNC(=O)Nc1ccc(N)cc1 Amb9214939 [0,1,0,0,0,1|1,0,0]=3 5095 B13R1.19 CCNC(=O)Oc1ccc(C)cc1 Amb22359936 [0,1,0,0,0,1|1,0,0]=3 5096 B13R1.19 CCNC(=O)Oc1ccc(Cl)cc1 Amb22466857 [0,1,0,0,0,1|1,0,0]=3 5097 B13R1.19 CCNC(=O)Oc1ccc(O)cc1 Amb27960352 [0,1,0,0,0,1|1,0,0]=3 5098 B13R1.19 CCNC(=S)Nc1ccc(Br)cc1 Amb6335015 [0,1,0,0,0,1|1,1,0]=4 5099 B13R1.19 CCNC(=S)Nc1ccc(Cl)cc1 Amb8582479 [0,1,0,0,0,1|1,1,0]=4 5100 B13R1.19 CCNC(=S)Nc1ccc(F)cc1 Amb6334875 [0,1,0,0,0,1|1,1,0]=4 5101 B13R1.19 CCNC(=S)Nc1ccc(I)cc1 Amb6335443 [0,1,0,0,0,1|1,1,0]=4 5102 B13R1.19 CCNC(=S)Nc1ccc(O)cc1 Amb2459583 [0,1,0,0,0,1|1,1,0]=4 5103 B13R1.19 CCNC(=S)Oc1ccc(C)cc1 Amb27234716 [0,1,0,0,0,1|1,1,0]=4 5104 B13R1.19 CCN\C(S)=N\c1ccc(C)cc1 Amb3471627 [0,1,0,0,0,1|1,1,0]=4 5105 B13R1.19 CCOC(=N)Cc1ccc(Br)cc1 Amb20673163 [0,1,0,0,0,1|1,0,0]=3 5106 B13R1.19 CCOC(=N)Cc1ccc(Br)cc1 Amb24089938 [0,1,0,0,0,1|1,0,0]=3 5107 B13R1.19 CCOC(=N)Cc1ccc(C)cc1 Amb20673135 [0,1,0,0,0,1|1,0,0]=3 5108 B13R1.19 CCOC(=N)Cc1ccc(Cl)cc1 Amb20673154 [0,1,0,0,0,1|1,0,0]=3 5109 B13R1.19 CCOC(=N)Cc1ccc(F)cc1 Amb20673149 [0,1,0,0,0,1|1,0,0]=3 5110 B13R1.19 CCOC(=O)Cc1ccc(Br)cc1 Amb6366082 [0,1,0,0,0,1|0,0,0]=2 5111 B13R1.19 CCOC(=O)Cc1ccc(Br)cn1 Amb21963596 [0,1,0,0,0,1|1,0,0]=3 5112 B13R1.19 CCOC(=O)Cc1ccc(C)cc1 Amb2782811 [0,1,0,0,0,1|0,0,0]=2 5113 B13R1.19 CCOC(=O)Cc1ccc(C)cn1 Amb30625639 [0,1,0,0,0,1|1,0,0]=3 5114 B13R1.19 CCOC(=O)Cc1ccc(C)nc1 Amb22899586 [0,1,0,0,0,1|1,0,0]=3 5115 B13R1.19 CCOC(=O)Cc1ccc(Cl)cc1 Amb6383282 [0,1,0,0,0,1|0,0,0]=2 5116 B13R1.19 CCOC(=O)Cc1ccc(Cl)cn1 Amb23402253 [0,1,0,0,0,1|1,0,0]=3 5117 B13R1.19 CCOC(=O)Cc1ccc(Cl)nc1 Amb19515857 [0,1,0,0,0,1|1,0,0]=3 5118 B13R1.19 CCOC(=O)Cc1ccc(Cl)nn1 Amb22499434 [0,1,0,0,0,1|2,0,0]=4 5119 B13R1.19 CCOC(=O)Cc1ccc(F)cc1 Amb9242950 [0,1,0,0,0,1|0,0,0]=2 5120 B13R1.19 CCOC(=O)Cc1ccc(F)cn1 Amb30874102 [0,1,0,0,0,1|1,0,0]=3 5121 B13R1.19 CCOC(=O)Cc1ccc(I)cc1 Amb16230826 [0,1,0,0,0,1|0,0,0]=2 5122 B13R1.19 CCOC(=O)Cc1ccc(I)cn1 Amb24183400 [0,1,0,0,0,1|1,0,0]=3 5123 B13R1.19 CCOC(=O)Cc1ccc(N)cc1 Amb6335373 [0,1,0,0,0,1|0,0,0]=2 5124 B13R1.19 CCOC(=O)Cc1ccc(N)cn1 Amb22234417 [0,1,0,0,0,1|1,0,0]=3 5125 B13R1.19 CCOC(=O)Cc1ccc(N)nc1 Amb22899575 [0,1,0,0,0,1|1,0,0]=3 5126 B13R1.19 CCOC(=O)Cc1ccc(O)cc1 Amb2780417 [0,1,0,0,0,1|0,0,0]=2 5127 B13R1.19 CCOC(=O)Cc1ccc(O)cn1 Amb22405966 [0,1,0,0,0,1|1,0,0]=3 5128 B13R1.19 CCOC(=O)Cc1cnc(Br)nc1 Amb23439669 [0,1,0,0,0,1|2,0,0]=4 5129 B13R1.19 CCOC(=O)Cc1cnc(Cl)nc1 Amb23439853 [0,1,0,0,0,1|2,0,0]=4 5130 B13R1.19 CCOC(=O)Cc1ncc(Br)cn1 Amb10603178 [0,1,0,0,0,1|2,0,0]=4 5131 B13R1.19 CCOC(=O)Cc1ncc(F)cn1 Amb21857271 [0,1,0,0,0,1|2,0,0]=4 5132 B13R1.19 CCOC(=O)Cc1ncc(N)cn1 Amb30640030 [0,1,0,0,0,1|2,0,0]=4 5133 B13R1.19 CCOC(=O)Nc1ccc(Br)cc1 Amb3101834 [0,1,0,0,0,1|0,0,0]=2 5134 B13R1.19 CCOC(=O)Nc1ccc(Br)cn1 Amb6316782 [0,1,0,0,0,1|1,0,0]=3 5135 B13R1.19 CCOC(=O)Nc1ccc(Br)nc1 Amb16982207 [0,1,0,0,0,1|1,0,0]=3 5136 B13R1.19 CCOC(=O)Nc1ccc(C)cc1 Amb2500803 [0,1,0,0,0,1|0,0,0]=2 5137 B13R1.19 CCOC(=O)Nc1ccc(Cl)cc1 Amb1625034 [0,1,0,0,0,1|0,0,0]=2 5138 B13R1.19 CCOC(=O)Nc1ccc(Cl)cn1 Amb8585280 [0,1,0,0,0,1|1,0,0]=3 5139 B13R1.19 CCOC(=O)Nc1ccc(Cl)nc1 Amb27755058 [0,1,0,0,0,1|1,0,0]=3 5140 B13R1.19 CCOC(=O)Nc1ccc(Cl)nn1 Amb27949640 [0,1,0,0,0,1|2,0,0]=4 5141 B13R1.19 CCOC(=O)Nc1ccc(F)cc1 Amb1095971 [0,1,0,0,0,1|0,0,0]=2 5142 B13R1.19 CCOC(=O)Nc1ccc(I)cc1 Amb1538826 [0,1,0,0,0,1|0,0,0]=2 5143 B13R1.19 CCOC(=O)Nc1ccc(N)cc1 Amb6373960 [0,1,0,0,0,1|0,0,0]=2 5144 B13R1.19 CCOC(=O)Nc1ccc(N)nc1 Amb18999686 [0,1,0,0,0,1|1,0,0]=3 5145 B13R1.19 CCOC(=O)Nc1ccc(O)cc1 Amb6738852 [0,1,0,0,0,1|0,0,0]=2 5146 B13R1.19 CCOC(=S)Nc1ccc(C)cc1 Amb24308972 [0,1,0,0,0,1|0,1,0]=3 5147 B13R1.19 CCOC(C)Oc1ccc(Br)cc1 Amb2716342 [0,1,0,0,0,1|1,0,1]=4 5148 B13R1.19 CCSC(=N)Nc1ccc(Cl)cc1 Amb26984060 [0,1,0,0,0,1|1,1,0]=4 5149 B13R1.19 CCSC(=S)Nc1ccc(C)cc1 Amb2459592 [0,1,0,0,0,1|0,2,0]=4 5150 B13R1.19 CNCC(=O)Nc1ccc(Br)cc1 Amb6248627 [0,1,0,0,0,1|2,0,0]=4 5151 B13R1.19 CNCC(=O)Nc1ccc(C)cc1 Amb1105856 [0,1,0,0,0,1|2,0,0]=4 5152 B13R1.19 CNCC(=O)Nc1ccc(C)cc1 Amb6891769 [0,1,0,0,0,1|2,0,0]=4 5153 B13R1.19 CNCC(=O)Nc1ccc(Cl)cc1 Amb2276036 [0,1,0,0,0,1|2,0,0]=4 5154 B13R1.19 CNCC(=O)Nc1ccc(Cl)cc1 Amb2370653 [0,1,0,0,0,1|2,0,0]=4 5155 B13R1.19 CNCC(=O)Nc1ccc(F)cc1 Amb19372369 [0,1,0,0,0,1|2,0,0]=4 5156 B13R1.19 CNCC(=O)Nc1ccc(F)cc1 Amb2370688 [0,1,0,0,0,1|2,0,0]=4 5157 B13R1.19 CNCC(=O)Nc1ccc(I)cc1 Amb7755133 [0,1,0,0,0,1|2,0,0]=4 5158 B13R1.19 CNCC(=O)Nc1ccc(O)cc1 Amb13951398 [0,1,0,0,0,1|2,0,0]=4 5159 B13R1.19 CNCC(=O)Nc1ccc(O)cc1 Amb9231175 [0,1,0,0,0,1|2,0,0]=4 5160 B13R1.19 COCC(=O)Nc1ccc(Br)cc1 Amb1884869 [0,1,0,0,0,1|2,0,0]=4 5161 B13R1.19 COCC(=O)Nc1ccc(C)cc1 Amb2661172 [0,1,0,0,0,1|2,0,0]=4 5162 B13R1.19 COCC(=O)Nc1ccc(Cl)cc1 Amb1775119 [0,1,0,0,0,1|2,0,0]=4 5163 B13R1.19 COCC(=O)Nc1ccc(F)cc1 Amb2627746 [0,1,0,0,0,1|2,0,0]=4 5164 B13R1.19 COCC(=O)Nc1ccc(I)cc1 Amb2661385 [0,1,0,0,0,1|2,0,0]=4 5165 B13R1.19 COCC(=O)Nc1ccc(N)cc1 Amb1118735 [0,1,0,0,0,1|2,0,0]=4 5166 B13R1.19 COCC(=O)Nc1ccc(N)cc1 Amb13949207 [0,1,0,0,0,1|2,0,0]=4 5167 B13R1.19 COCC(=O)Nc1ccc(O)cc1 Amb33551385 [0,1,0,0,0,1|2,0,0]=4 5168 B13R1.19 CONC(=O)Cc1ccc(C)cc1 Amb27618366 [0,1,0,0,0,1|2,0,0]=4 5169 B13R1.19 CONC(=O)Cc1ccc(Cl)cc1 Amb16969926 [0,1,0,0,0,1|2,0,0]=4 5170 B13R1.19 CONC(=O)Cc1ccc(F)cc1 Amb16969925 [0,1,0,0,0,1|2,0,0]=4 5171 B13R1.19 CONC(=O)Cc1ccc(N)cc1 Amb28066521 [0,1,0,0,0,1|2,0,0]=4 5172 B13R1.19 CONC(=O)Cc1ccc(O)cc1 Amb26344557 [0,1,0,0,0,1|2,0,0]=4 5173 B13R1.19 CONC(=O)Nc1ccc(Br)cc1 Amb2819007 [0,1,0,0,0,1|2,0,0]=4 5174 B13R1.19 CONC(=O)Nc1ccc(C)cc1 Amb2818975 [0,1,0,0,0,1|2,0,0]=4 5175 B13R1.19 CONC(=O)Nc1ccc(Cl)cc1 Amb16980467 [0,1,0,0,0,1|2,0,0]=4 5176 B13R1.19 CSCC(=O)Cc1ccc(F)cc1 Amb19055168 [0,1,0,0,0,1|2,0,0]=4 5177 B13R1.19 CSCC(=O)Nc1ccc(Br)cc1 Amb2590081 [0,1,0,0,0,1|2,0,0]=4 5178 B13R1.19 CSCC(=O)Nc1ccc(C)cc1 Amb3440799 [0,1,0,0,0,1|2,0,0]=4 5179 B13R1.19 CSCC(=O)Nc1ccc(Cl)cc1 Amb15701919 [0,1,0,0,0,1|2,0,0]=4 5180 B13R1.19 CSCC(=O)Nc1ccc(N)cc1 Amb18971638 [0,1,0,0,0,1|2,0,0]=4 5181 B13R1.19 CSCC(=O)Nc1ccc(O)cc1 Amb6744917 [0,1,0,0,0,1|2,0,0]=4 5182 B13R1.19 C\C=C\C(=O)Cc1ccc(I)cc1 Amb28197921 [0,1,0,0,0,1|1,0,1]=4 5183 B13R1.19 C\C=C\C(=O)Nc1ccc(Br)cc1 Amb4006569 [0,1,0,0,0,1|1,0,1]=4 5184 B13R1.19 C\C=C\C(=O)Nc1ccc(C)cc1 Amb22366072 [0,1,0,0,0,1|1,0,1]=4 5185 B13R1.19 C\C=C\C(=O)Oc1ccc(C)cc1 Amb22734867 [0,1,0,0,0,1|1,0,1]=4 5186 B13R1.19 C\C=C\C(=O)Oc1ccc(Cl)cc1 Amb9678328 [0,1,0,0,0,1|1,0,1]=4 5187 B13R1.19 Cc1ccc(NC(=O)CCBr)cc1 Amb17325059 [0,1,0,0,0,1|2,0,0]=4 5188 B13R1.19 Cc1ccc(NC(=O)CCCl)cc1 Amb6502798 [0,1,0,0,0,1|2,0,0]=4 5189 B13R1.19 Cc1ccc(NC(=O)CCN)cc1 Amb1132101 [0,1,0,0,0,1|2,0,0]=4 5190 B13R1.19 Cc1ccc(NC(=O)CCN)cc1 Amb13949218 [0,1,0,0,0,1|2,0,0]=4 5191 B13R1.19 Cc1ccc(NC(=O)CCO)cc1 Amb3939510 [0,1,0,0,0,1|2,0,0]=4 5192 B13R1.19 Cc1ccc(NC(=O)CCS)cc1 Amb4010783 [0,1,0,0,0,1|2,0,0]=4 5193 B13R1.19 Cc1ccc(NC(=O)OCCl)cc1 Amb29885598 [0,1,0,0,0,1|1,0,0]=3 5194 B13R1.19 Cc1ccc(NC(=O)OCCl)cn1 Amb29885602 [0,1,0,0,0,1|2,0,0]=4 5195 B13R1.19 Cc1ccc(NC(=O)OCCl)nc1 Amb29885607 [0,1,0,0,0,1|2,0,0]=4 5196 B13R1.19 Cc1ccc(OC(=O)CCN)cc1 Amb17335316 [0,1,0,0,0,1|2,0,0]=4 5197 B13R1.19 NCCC(=O)Nc1ccc(Br)cc1 Amb10609613 [0,1,0,0,0,1|2,0,0]=4 5198 B13R1.19 NCCC(=O)Nc1ccc(Br)cc1 Amb5785018 [0,1,0,0,0,1|2,0,0]=4 5199 B13R1.19 NCCC(=O)Nc1ccc(Cl)cc1 Amb15740945 [0,1,0,0,0,1|2,0,0]=4 5200 B13R1.19 NCCC(=O)Nc1ccc(Cl)cc1 Amb5785011 [0,1,0,0,0,1|2,0,0]=4 5201 B13R1.19 NCCC(=O)Nc1ccc(F)cc1 Amb1137438 [0,1,0,0,0,1|2,0,0]=4 5202 B13R1.19 NCCC(=O)Nc1ccc(F)cc1 Amb17622065 [0,1,0,0,0,1|2,0,0]=4 5203 B13R1.19 NCCC(=O)Nc1ccc(I)cc1 Amb7785133 [0,1,0,0,0,1|2,0,0]=4 5204 B13R1.19 NCCC(=O)Oc1ccc(Br)cc1 Amb17349677 [0,1,0,0,0,1|2,0,0]=4 5205 B13R1.19 NCCC(=O)Oc1ccc(Cl)cc1 Amb17337486 [0,1,0,0,0,1|2,0,0]=4 5206 B13R1.19 NCCC(=O)Oc1ccc(F)cc1 Amb17335605 [0,1,0,0,0,1|2,0,0]=4 5207 B13R1.19 Nc1ccc(NC(=O)CCCl)cc1 Amb27760434 [0,1,0,0,0,1|2,0,0]=4 5208 B13R1.19 O=C(CCBr)Nc1ccc(Br)cc1 Amb2781006 [0,1,0,0,0,1|2,0,0]=4 5209 B13R1.19 O=C(CCBr)Nc1ccc(F)cc1 Amb17331898 [0,1,0,0,0,1|2,0,0]=4 5210 B13R1.19 O=C(CCBr)Nc1ccc(I)cc1 Amb25778088 [0,1,0,0,0,1|2,0,0]=4 5211 B13R1.19 O=C(CCCl)Nc1ccc(Br)cc1 Amb6388016 [0,1,0,0,0,1|2,0,0]=4 5212 B13R1.19 O=C(CCCl)Nc1ccc(Cl)cc1 Amb1130646 [0,1,0,0,0,1|2,0,0]=4 5213 B13R1.19 O=C(CCCl)Nc1ccc(F)cc1 Amb1134991 [0,1,0,0,0,1|2,0,0]=4 5214 B13R1.19 O=C(CCCl)Nc1ccc(I)cc1 Amb7785097 [0,1,0,0,0,1|2,0,0]=4 5215 B13R1.19 O=C(CCCl)Nc1ccc(O)cc1 Amb9337732 [0,1,0,0,0,1|2,0,0]=4 5216 B13R1.19 O=C(CCO)Nc1ccc(Br)cc1 Amb17349664 [0,1,0,0,0,1|2,0,0]=4 5217 B13R1.19 O=C(CCO)Nc1ccc(Cl)cc1 Amb17337474 [0,1,0,0,0,1|2,0,0]=4 5218 B13R1.19 O=C(CCO)Nc1ccc(F)cc1 Amb17335594 [0,1,0,0,0,1|2,0,0]=4 5219 B13R1.19 O=C(CCS)Nc1ccc(Br)cc1 Amb17305728 [0,1,0,0,0,1|2,0,0]=4 5220 B13R1.19 O=C(CCS)Nc1ccc(Cl)cc1 Amb17305726 [0,1,0,0,0,1|2,0,0]=4 5221 B13R1.19 O=C(CCS)Nc1ccc(F)cc1 Amb17305727 [0,1,0,0,0,1|2,0,0]=4 5222 B13R1.19 O=C(CCS)Nc1ccc(I)cc1 Amb27979121 [0,1,0,0,0,1|2,0,0]=4 5223 B13R1.19 O=C(Cc1ccc(Cl)cc1)NCO Amb27234715 [0,1,0,0,0,1|2,0,0]=4 5224 B13R1.19 O=C(Nc1ccc(Br)cc1)OCCl Amb35628677 [0,1,0,0,0,1|1,0,0]=3 5225 B13R1.19 O=C(Nc1ccc(Br)cn1)OCCl Amb35628680 [0,1,0,0,0,1|2,0,0]=4 5226 B13R1.19 O=C(Nc1ccc(Br)nc1)OCCl Amb35628876 [0,1,0,0,0,1|2,0,0]=4 5227 B13R1.19 O=C(Nc1ccc(Cl)cc1)OCCl Amb29880260 [0,1,0,0,0,1|1,0,0]=3 5228 B13R1.19 O=C(Nc1ccc(Cl)cn1)OCCl Amb29880271 [0,1,0,0,0,1|2,0,0]=4 5229 B13R1.19 O=C(Nc1ccc(Cl)nc1)OCCl Amb29880266 [0,1,0,0,0,1|2,0,0]=4 5230 B13R1.19 O=C(Nc1ccc(F)cc1)OCCl Amb30033131 [0,1,0,0,0,1|1,0,0]=3 5231 B13R1.19 O=C(Nc1ccc(F)cn1)OCCl Amb35644933 [0,1,0,0,0,1|2,0,0]=4 5232 B13R1.19 O=C(Nc1ccc(F)nc1)OCCl Amb35644936 [0,1,0,0,0,1|2,0,0]=4 5233 B13R1.19 O=C(Nc1ccc(I)cc1)OCCl Amb35628889 [0,1,0,0,0,1|1,0,0]=3 5234 B13R1.19 O=C(Nc1ccc(O)cc1)OCCl Amb29885611 [0,1,0,0,0,1|1,0,0]=3 5235 B13R1.19 O=C(OCCl)Oc1ccc(Br)cc1 Amb2779791 [0,1,0,0,0,1|1,0,0]=3 5236 B13R1.19 O=C(OCCl)Oc1ccc(Cl)cc1 Amb2779793 [0,1,0,0,0,1|1,0,0]=3 5237 B13R1.19 O=C1C=CC(NC(=O)OCCl)=CN1 Amb29885614 [0,1,0,0,0,1|2,0,0]=4 5238 B13R1.20 CC#CC(=O)Nc1cccc(Cl)c1 Amb22462111 [0,1,0,0,0,1|1,0,1]=4 5239 B13R1.20 CC#CC(=O)Oc1cccc(I)c1 Amb27595315 [0,1,0,0,0,1|1,0,1]=4 5240 B13R1.20 CCCC(=O)Cc1cccc(C)c1 Amb17138796 [0,1,0,0,0,1|1,0,0]=3 5241 B13R1.20 CCCC(=O)Cc1cccc(Cl)c1 Amb17139627 [0,1,0,0,0,1|1,0,0]=3 5242 B13R1.20 CCCC(=O)Cc1cccc(F)c1 Amb17138962 [0,1,0,0,0,1|1,0,0]=3 5243 B13R1.20 CCCC(=O)Nc1cc(C)ccn1 Amb2674365 [0,1,0,0,0,1|2,0,0]=4 5244 B13R1.20 CCCC(=O)Nc1cccc(C)c1 Amb2674380 [0,1,0,0,0,1|1,0,0]=3 5245 B13R1.20 CCCC(=O)Nc1cccc(C)n1 Amb3355401 [0,1,0,0,0,1|2,0,0]=4 5246 B13R1.20 CCCC(=O)Nc1cccc(Cl)c1 Amb2674425 [0,1,0,0,0,1|1,0,0]=3 5247 B13R1.20 CCCC(=O)Nc1cccc(Cl)n1 Amb27413475 [0,1,0,0,0,1|2,0,0]=4 5248 B13R1.20 CCCC(=O)Nc1cccc(F)c1 Amb2674891 [0,1,0,0,0,1|1,0,0]=3 5249 B13R1.20 CCCC(=O)Nc1cccc(N)c1 Amb1798141 [0,1,0,0,0,1|1,0,0]=3 5250 B13R1.20 CCCC(=O)Nc1cccc(N)c1 Amb33549216 [0,1,0,0,0,1|1,0,0]=3 5251 B13R1.20 CCCC(=O)Nc1cccc(O)c1 Amb844198 [0,1,0,0,0,1|1,0,0]=3 5252 B13R1.20 CCCC(=O)Nc1ccnc(Br)c1 Amb27599640 [0,1,0,0,0,1|2,0,0]=4 5253 B13R1.20 CCCC(=O)Nc1ccnc(Cl)c1 Amb27876219 [0,1,0,0,0,1|2,0,0]=4 5254 B13R1.20 CCCC(=O)Nc1ccnc(N)c1 Amb35713246 [0,1,0,0,0,1|2,0,0]=4 5255 B13R1.20 CCCC(=O)Nc1cncc(C)c1 Amb28352350 [0,1,0,0,0,1|2,0,0]=4 5256 B13R1.20 CCCC(=O)Nc1cncc(Cl)c1 Amb35717884 [0,1,0,0,0,1|2,0,0]=4 5257 B13R1.20 CCCC(=O)Oc1cccc(C)c1 Amb24063564 [0,1,0,0,0,1|1,0,0]=3 5258 B13R1.20 CCCS(=O)Nc1cccc(I)c1 Amb27777981 [0,1,0,0,0,1|2,0,0]=4 5259 B13R1.20 CCNC(=N)Nc1cccc(Br)c1 Amb27608248 [0,1,0,0,0,1|2,0,0]=4 5260 B13R1.20 CCNC(=N)Nc1cccc(Cl)c1 Amb18325455 [0,1,0,0,0,1|2,0,0]=4 5261 B13R1.20 CCNC(=O)Cc1cccc(Cl)c1 Amb23086727 [0,1,0,0,0,1|1,0,0]=3 5262 B13R1.20 CCNC(=O)Cc1cccc(F)c1 Amb8050210 [0,1,0,0,0,1|1,0,0]=3 5263 B13R1.20 CCNC(=O)Cc1cccc(N)c1 Amb8426828 [0,1,0,0,0,1|1,0,0]=3 5264 B13R1.20 CCNC(=O)Cc1cccc(O)c1 Amb18178662 [0,1,0,0,0,1|1,0,0]=3 5265 B13R1.20 CCNC(=O)Nc1cc(Br)ccn1 Amb28041421 [0,1,0,0,0,1|2,0,0]=4 5266 B13R1.20 CCNC(=O)Nc1cc(C)ccn1 Amb27207319 [0,1,0,0,0,1|2,0,0]=4 5267 B13R1.20 CCNC(=O)Nc1cccc(Br)c1 Amb4020258 [0,1,0,0,0,1|1,0,0]=3 5268 B13R1.20 CCNC(=O)Nc1cccc(C)c1 Amb1233666 [0,1,0,0,0,1|1,0,0]=3 5269 B13R1.20 CCNC(=O)Nc1cccc(Cl)n1 Amb28125577 [0,1,0,0,0,1|2,0,0]=4 5270 B13R1.20 CCNC(=O)Nc1cccc(I)c1 Amb28067354 [0,1,0,0,0,1|1,0,0]=3 5271 B13R1.20 CCNC(=O)Nc1cccc(N)c1 Amb6614767 [0,1,0,0,0,1|1,0,0]=3 5272 B13R1.20 CCNC(=O)Nc1ccnc(N)c1 Amb35678018 [0,1,0,0,0,1|2,0,0]=4 5273 B13R1.20 CCNC(=O)Nc1cncc(Br)c1 Amb28042177 [0,1,0,0,0,1|2,0,0]=4 5274 B13R1.20 CCNC(=O)Nc1cncc(Cl)c1 Amb35671323 [0,1,0,0,0,1|2,0,0]=4 5275 B13R1.20 CCNC(=O)Oc1cccc(C)c1 Amb24490235 [0,1,0,0,0,1|1,0,0]=3 5276 B13R1.20 CCNC(=O)Oc1cccc(O)c1 Amb28722579 [0,1,0,0,0,1|1,0,0]=3 5277 B13R1.20 CCNC(=S)Nc1cccc(Br)c1 Amb9237211 [0,1,0,0,0,1|1,1,0]=4 5278 B13R1.20 CCNC(=S)Nc1cccc(C)c1 Amb2459582 [0,1,0,0,0,1|1,1,0]=4 5279 B13R1.20 CCNC(=S)Nc1cccc(Cl)c1 Amb4453556 [0,1,0,0,0,1|1,1,0]=4 5280 B13R1.20 CCNC(=S)Nc1cccc(O)c1 Amb6527345 [0,1,0,0,0,1|1,1,0]=4 5281 B13R1.20 CCOC(=N)Cc1cccc(C)c1 Amb20673148 [0,1,0,0,0,1|1,0,0]=3 5282 B13R1.20 CCOC(=N)Cc1cccc(Cl)c1 Amb20673155 [0,1,0,0,0,1|1,0,0]=3 5283 B13R1.20 CCOC(=O)Cc1cc(Br)ccn1 Amb28990639 [0,1,0,0,0,1|1,0,0]=3 5284 B13R1.20 CCOC(=O)Cc1cc(C)ncn1 Amb28989910 [0,1,0,0,0,1|2,0,0]=4 5285 B13R1.20 CCOC(=O)Cc1ccc[n+]([O-])c1 Amb10553693 [0,1,0,0,0,1|1,0,0]=3 5286 B13R1.20 CCOC(=O)Cc1cccc(Br)c1 Amb17349305 [0,1,0,0,0,1|0,0,0]=2 5287 B13R1.20 CCOC(=O)Cc1cccc(Br)n1 Amb22001965 [0,1,0,0,0,1|1,0,0]=3 5288 B13R1.20 CCOC(=O)Cc1cccc(C)c1 Amb6357154 [0,1,0,0,0,1|0,0,0]=2 5289 B13R1.20 CCOC(=O)Cc1cccc(C)n1 Amb15692898 [0,1,0,0,0,1|1,0,0]=3 5290 B13R1.20 CCOC(=O)Cc1cccc(C)n1 Amb24081752 [0,1,0,0,0,1|1,0,0]=3 5291 B13R1.20 CCOC(=O)Cc1cccc(Cl)c1 Amb8517419 [0,1,0,0,0,1|0,0,0]=2 5292 B13R1.20 CCOC(=O)Cc1cccc(Cl)n1 Amb22490590 [0,1,0,0,0,1|1,0,0]=3 5293 B13R1.20 CCOC(=O)Cc1cccc(F)c1 Amb9243013 [0,1,0,0,0,1|0,0,0]=2 5294 B13R1.20 CCOC(=O)Cc1cccc(I)c1 Amb23402106 [0,1,0,0,0,1|0,0,0]=2 5295 B13R1.20 CCOC(=O)Cc1cccc(N)c1 Amb32751199 [0,1,0,0,0,1|0,0,0]=2 5296 B13R1.20 CCOC(=O)Cc1cccc(N)c1 Amb8426813 [0,1,0,0,0,1|0,0,0]=2 5297 B13R1.20 CCOC(=O)Cc1cccc(N)n1 Amb8630464 [0,1,0,0,0,1|1,0,0]=3 5298 B13R1.20 CCOC(=O)Cc1cccc(O)c1 Amb17614082 [0,1,0,0,0,1|0,0,0]=2 5299 B13R1.20 CCOC(=O)Cc1ccnc(Br)c1 Amb33715609 [0,1,0,0,0,1|1,0,0]=3 5300 B13R1.20 CCOC(=O)Cc1ccnc(C)c1 Amb32668552 [0,1,0,0,0,1|1,0,0]=3 5301 B13R1.20 CCOC(=O)Cc1ccnc(C)c1 Amb32668853 [0,1,0,0,0,1|1,0,0]=3 5302 B13R1.20 CCOC(=O)Cc1ccnc(Cl)c1 Amb33291342 [0,1,0,0,0,1|1,0,0]=3 5303 B13R1.20 CCOC(=O)Cc1ccnc(F)c1 Amb32653587 [0,1,0,0,0,1|1,0,0]=3 5304 B13R1.20 CCOC(=O)Cc1ccnc(N)c1 Amb33736993 [0,1,0,0,0,1|1,0,0]=3 5305 B13R1.20 CCOC(=O)Cc1ccnc(N)n1 Amb22899362 [0,1,0,0,0,1|2,0,0]=4 5306 B13R1.20 CCOC(=O)Cc1cncc(Br)c1 Amb21857707 [0,1,0,0,0,1|1,0,0]=3 5307 B13R1.20 CCOC(=O)Cc1cncc(Cl)n1 Amb24087729 [0,1,0,0,0,1|2,0,0]=4 5308 B13R1.20 CCOC(=O)Cc1cncc(F)c1 Amb19068169 [0,1,0,0,0,1|1,0,0]=3 5309 B13R1.20 CCOC(=O)Cc1cncc(N)n1 Amb24087728 [0,1,0,0,0,1|2,0,0]=4 5310 B13R1.20 CCOC(=O)Cc1nccc(N)n1 Amb33745296 [0,1,0,0,0,1|2,0,0]=4 5311 B13R1.20 CCOC(=O)Nc1cc(Br)ccn1 Amb27883427 [0,1,0,0,0,1|1,0,0]=3 5312 B13R1.20 CCOC(=O)Nc1cc(C)ccn1 Amb10553730 [0,1,0,0,0,1|1,0,0]=3 5313 B13R1.20 CCOC(=O)Nc1cc(Cl)ccn1 Amb27481561 [0,1,0,0,0,1|1,0,0]=3 5314 B13R1.20 CCOC(=O)Nc1cccc(C)c1 Amb3101819 [0,1,0,0,0,1|0,0,0]=2 5315 B13R1.20 CCOC(=O)Nc1cccc(C)n1 Amb10553731 [0,1,0,0,0,1|1,0,0]=3 5316 B13R1.20 CCOC(=O)Nc1cccc(Cl)c1 Amb3101832 [0,1,0,0,0,1|0,0,0]=2 5317 B13R1.20 CCOC(=O)Nc1cccc(Cl)n1 Amb27976498 [0,1,0,0,0,1|1,0,0]=3 5318 B13R1.20 CCOC(=O)Nc1cccc(F)n1 Amb24330398 [0,1,0,0,0,1|1,0,0]=3 5319 B13R1.20 CCOC(=O)Nc1cccc(N)c1 Amb13949212 [0,1,0,0,0,1|0,0,0]=2 5320 B13R1.20 CCOC(=O)Nc1cccc(N)c1 Amb6370312 [0,1,0,0,0,1|0,0,0]=2 5321 B13R1.20 CCOC(=O)Nc1cccc(O)c1 Amb379739 [0,1,0,0,0,1|0,0,0]=2 5322 B13R1.20 CCOC(=O)Nc1ccnc(Cl)c1 Amb22462755 [0,1,0,0,0,1|1,0,0]=3 5323 B13R1.20 CCOC(=O)Nc1cncc(Br)c1 Amb2752897 [0,1,0,0,0,1|1,0,0]=3 5324 B13R1.20 CCOC(=O)Nc1cncc(F)c1 Amb27233127 [0,1,0,0,0,1|1,0,0]=3 5325 B13R1.20 CCOC(=S)Nc1cccc(C)c1 Amb24308973 [0,1,0,0,0,1|0,1,0]=3 5326 B13R1.20 CCOC(=S)Nc1cccc(C)n1 Amb27201638 [0,1,0,0,0,1|1,1,0]=4 5327 B13R1.20 CCOC(=S)Nc1cccc(O)c1 Amb27587085 [0,1,0,0,0,1|0,1,0]=3 5328 B13R1.20 CCSC(=O)Nc1cccc(Cl)c1 Amb4414633 [0,1,0,0,0,1|0,1,0]=3 5329 B13R1.20 CCSC(=O)Nc1cccc(F)c1 Amb27794723 [0,1,0,0,0,1|0,1,0]=3 5330 B13R1.20 CNCC(=O)Nc1cccc(C)c1 Amb6246639 [0,1,0,0,0,1|2,0,0]=4 5331 B13R1.20 CNCC(=O)Nc1cccc(Cl)c1 Amb6251066 [0,1,0,0,0,1|2,0,0]=4 5332 B13R1.20 CNCC(=O)Nc1cccc(Cl)c1 Amb7969469 [0,1,0,0,0,1|2,0,0]=4 5333 B13R1.20 CNCC(=O)Nc1cccc(F)c1 Amb2277698 [0,1,0,0,0,1|2,0,0]=4 5334 B13R1.20 CNCC(=O)Nc1cccc(F)c1 Amb2370682 [0,1,0,0,0,1|2,0,0]=4 5335 B13R1.20 CNCC(=O)Nc1cccc(O)c1 Amb18290512 [0,1,0,0,0,1|2,0,0]=4 5336 B13R1.20 COCC(=O)Nc1cccc(Br)c1 Amb6409052 [0,1,0,0,0,1|2,0,0]=4 5337 B13R1.20 COCC(=O)Nc1cccc(I)c1 Amb1882946 [0,1,0,0,0,1|2,0,0]=4 5338 B13R1.20 COCC(=O)Nc1cccc(N)c1 Amb1112513 [0,1,0,0,0,1|2,0,0]=4 5339 B13R1.20 COCC(=O)Nc1cccc(N)c1 Amb17622107 [0,1,0,0,0,1|2,0,0]=4 5340 B13R1.20 CONC(=O)Cc1cccc(Cl)c1 Amb27222030 [0,1,0,0,0,1|2,0,0]=4 5341 B13R1.20 CONC(=O)Cc1cccc(F)c1 Amb10704852 [0,1,0,0,0,1|2,0,0]=4 5342 B13R1.20 CONC(=O)Cc1cccc(N)c1 Amb27766744 [0,1,0,0,0,1|2,0,0]=4 5343 B13R1.20 CONC(=O)Nc1cccc(C)c1 Amb27618342 [0,1,0,0,0,1|2,0,0]=4 5344 B13R1.20 CONC(=O)Nc1cccc(F)c1 Amb28365075 [0,1,0,0,0,1|2,0,0]=4 5345 B13R1.20 CSCC(=O)Nc1cccc(Br)c1 Amb278347 [0,1,0,0,0,1|2,0,0]=4 5346 B13R1.20 CSCC(=O)Nc1cccc(C)c1 Amb28186600 [0,1,0,0,0,1|2,0,0]=4 5347 B13R1.20 CSCC(=O)Nc1cccc(Cl)c1 Amb15701918 [0,1,0,0,0,1|2,0,0]=4 5348 B13R1.20 CSCC(=O)Nc1cccc(F)c1 Amb19382420 [0,1,0,0,0,1|2,0,0]=4 5349 B13R1.20 C\C=C\C(=O)Cc1cccc(C)c1 Amb27474335 [0,1,0,0,0,1|1,0,1]=4 5350 B13R1.20 C\C=C\C(=O)Nc1cccc(C)c1 Amb27455896 [0,1,0,0,0,1|1,0,1]=4 5351 B13R1.20 C\C=C\C(=O)Nc1cccc(Cl)c1 Amb6492085 [0,1,0,0,0,1|1,0,1]=4 5352 B13R1.20 C\C=C\C(=O)Nc1cccc(N)c1 Amb27475926 [0,1,0,0,0,1|1,0,1]=4 5353 B13R1.20 C\C=C\C(=O)Nc1cccc(O)c1 Amb26374829 [0,1,0,0,0,1|1,0,1]=4 5354 B13R1.20 C\C=C\C(=O)Oc1cccc(Br)c1 Amb27766395 [0,1,0,0,0,1|1,0,1]=4 5355 B13R1.20 C\C=C\C(=O)Oc1cccc(Cl)c1 Amb28345182 [0,1,0,0,0,1|1,0,1]=4 5356 B13R1.20 C\C=C\C(=O)Oc1cccc(O)c1 Amb24745741 [0,1,0,0,0,1|1,0,1]=4 5357 B13R1.20 Cc1cc(NC(=O)OCCl)ccn1 Amb29885605 [0,1,0,0,0,1|2,0,0]=4 5358 B13R1.20 Cc1cccc(NC(=O)CCBr)c1 Amb19748477 [0,1,0,0,0,1|2,0,0]=4 5359 B13R1.20 Cc1cccc(NC(=O)CCCl)c1 Amb1126815 [0,1,0,0,0,1|2,0,0]=4 5360 B13R1.20 Cc1cccc(NC(=O)CCN)c1 Amb1138768 [0,1,0,0,0,1|2,0,0]=4 5361 B13R1.20 Cc1cccc(NC(=O)CCN)c1 Amb17622066 [0,1,0,0,0,1|2,0,0]=4 5362 B13R1.20 Cc1cccc(NC(=O)CCO)c1 Amb17335301 [0,1,0,0,0,1|2,0,0]=4 5363 B13R1.20 Cc1cccc(NC(=O)OCCl)c1 Amb29885599 [0,1,0,0,0,1|1,0,0]=3 5364 B13R1.20 Cc1cccc(NC(=O)OCCl)n1 Amb29885609 [0,1,0,0,0,1|2,0,0]=4 5365 B13R1.20 Cc1cccc(OC(=O)CCN)c1 Amb17335314 [0,1,0,0,0,1|2,0,0]=4 5366 B13R1.20 Cc1ccnc(NC(=O)OCCl)c1 Amb29885601 [0,1,0,0,0,1|2,0,0]=4 5367 B13R1.20 Cc1cncc(NC(=O)OCCl)c1 Amb29885610 [0,1,0,0,0,1|2,0,0]=4 5368 B13R1.20 NCCC(=O)Nc1cccc(Br)c1 Amb5785084 [0,1,0,0,0,1|2,0,0]=4 5369 B13R1.20 NCCC(=O)Nc1cccc(Cl)c1 Amb15740944 [0,1,0,0,0,1|2,0,0]=4 5370 B13R1.20 NCCC(=O)Nc1cccc(Cl)c1 Amb5785010 [0,1,0,0,0,1|2,0,0]=4 5371 B13R1.20 NCCC(=O)Nc1cccc(F)c1 Amb1102412 [0,1,0,0,0,1|2,0,0]=4 5372 B13R1.20 NCCC(=O)Nc1cccc(F)c1 Amb13949209 [0,1,0,0,0,1|2,0,0]=4 5373 B13R1.20 NCCC(=O)Oc1cccc(Br)c1 Amb17349675 [0,1,0,0,0,1|2,0,0]=4 5374 B13R1.20 NCCC(=O)Oc1cccc(Cl)c1 Amb17337484 [0,1,0,0,0,1|2,0,0]=4 5375 B13R1.20 NCCC(=O)Oc1cccc(F)c1 Amb17335603 [0,1,0,0,0,1|2,0,0]=4 5376 B13R1.20 Nc1cccc(NC(=O)CCCl)c1 Amb28245259 [0,1,0,0,0,1|2,0,0]=4 5377 B13R1.20 O=C(CCBr)Nc1cccc(Br)c1 Amb25364215 [0,1,0,0,0,1|2,0,0]=4 5378 B13R1.20 O=C(CCBr)Nc1cccc(Cl)c1 Amb17328448 [0,1,0,0,0,1|2,0,0]=4 5379 B13R1.20 O=C(CCBr)Nc1cccc(F)c1 Amb17323635 [0,1,0,0,0,1|2,0,0]=4 5380 B13R1.20 O=C(CCBr)Nc1cccc(I)c1 Amb28070835 [0,1,0,0,0,1|2,0,0]=4 5381 B13R1.20 O=C(CCBr)Nc1cccc(O)c1 Amb17324280 [0,1,0,0,0,1|2,0,0]=4 5382 B13R1.20 O=C(CCCl)Nc1cccc(Br)c1 Amb1126487 [0,1,0,0,0,1|2,0,0]=4 5383 B13R1.20 O=C(CCCl)Nc1cccc(Cl)c1 Amb3205065 [0,1,0,0,0,1|2,0,0]=4 5384 B13R1.20 O=C(CCCl)Nc1cccc(F)c1 Amb6718395 [0,1,0,0,0,1|2,0,0]=4 5385 B13R1.20 O=C(CCCl)Nc1cccc(O)c1 Amb10608630 [0,1,0,0,0,1|2,0,0]=4 5386 B13R1.20 O=C(CCI)Nc1cccc(Cl)c1 Amb28388554 [0,1,0,0,0,1|2,0,0]=4 5387 B13R1.20 O=C(CCI)Nc1cccc(F)c1 Amb27870619 [0,1,0,0,0,1|2,0,0]=4 5388 B13R1.20 O=C(CCO)Nc1cccc(Br)c1 Amb17349666 [0,1,0,0,0,1|2,0,0]=4 5389 B13R1.20 O=C(CCO)Nc1cccc(Cl)c1 Amb9421567 [0,1,0,0,0,1|2,0,0]=4 5390 B13R1.20 O=C(CCO)Nc1cccc(F)c1 Amb9421560 [0,1,0,0,0,1|2,0,0]=4 5391 B13R1.20 O=C(CCO)Nc1cccc(S)c1 Amb27238403 [0,1,0,0,0,1|2,0,0]=4 5392 B13R1.20 O=C(CCS)Nc1cccc(Br)c1 Amb27411416 [0,1,0,0,0,1|2,0,0]=4 5393 B13R1.20 O=C(CCS)Nc1cccc(Cl)c1 Amb27399692 [0,1,0,0,0,1|2,0,0]=4 5394 B13R1.20 O=C(CCS)Nc1cccc(F)c1 Amb28317169 [0,1,0,0,0,1|2,0,0]=4 5395 B13R1.20 O=C(CCS)Nc1cccc(O)c1 Amb27406858 [0,1,0,0,0,1|2,0,0]=4 5396 B13R1.20 O=C(Nc1cc(Br)ccn1)OCCl Amb35628887 [0,1,0,0,0,1|2,0,0]=4 5397 B13R1.20 O=C(Nc1cc(Cl)ccn1)OCCl Amb29880267 [0,1,0,0,0,1|2,0,0]=4 5398 B13R1.20 O=C(Nc1cccc(Br)c1)OCCl Amb35628637 [0,1,0,0,0,1|1,0,0]=3 5399 B13R1.20 O=C(Nc1cccc(Cl)c1)OCCl Amb29880259 [0,1,0,0,0,1|1,0,0]=3 5400 B13R1.20 O=C(Nc1cccc(Cl)n1)OCCl Amb29880264 [0,1,0,0,0,1|2,0,0]=4 5401 B13R1.20 O=C(Nc1cccc(F)c1)OCCl Amb30033147 [0,1,0,0,0,1|1,0,0]=3 5402 B13R1.20 O=C(Nc1cccc(F)n1)OCCl Amb35644934 [0,1,0,0,0,1|2,0,0]=4 5403 B13R1.20 O=C(Nc1cccc(I)c1)OCCl Amb35628890 [0,1,0,0,0,1|1,0,0]=3 5404 B13R1.20 O=C(Nc1cccc(O)c1)OCCl Amb29885612 [0,1,0,0,0,1|1,0,0]=3 5405 B13R1.20 O=C(Nc1ccnc(Br)c1)OCCl Amb35628867 [0,1,0,0,0,1|2,0,0]=4 5406 B13R1.20 O=C(Nc1ccnc(Cl)c1)OCCl Amb29880265 [0,1,0,0,0,1|2,0,0]=4 5407 B13R1.20 O=C(Nc1cncc(Br)c1)OCCl Amb35628886 [0,1,0,0,0,1|2,0,0]=4 5408 B13R1.20 O=C(Nc1cncc(Cl)c1)OCCl Amb30032662 [0,1,0,0,0,1|2,0,0]=4 5409 B13R1.20 O=C(Nc1cncc(F)c1)OCCl Amb35644935 [0,1,0,0,0,1|2,0,0]=4 5410 B13R1.44 C#CCNC(=O)Nc1ccccc1 Amb8334724 [0,1,0,0,0,1|1,0,1]=4 5411 B13R1.44 C#CCNC(=O)Sc1ccccc1 Amb28123148 [0,1,0,0,0,1|1,0,1]=4 5412 B13R1.44 C#CCOC(=O)Nc1ccccc1 Amb2505044 [0,1,0,0,0,1|0,0,1]=3 5413 B13R1.44 C=CCCC(=O)Cc1ccccc1 Amb32676781 [0,1,0,0,0,1|1,0,1]=4 5414 B13R1.44 C=CCCC(=O)Nc1ccccc1 Amb20655805 [0,1,0,0,0,1|1,0,1]=4 5415 B13R1.44 C=CCNC(=O)Nc1ccccc1 Amb1233611 [0,1,0,0,0,1|1,0,1]=4 5416 B13R1.44 C=CCOC(=O)Nc1ccccc1 Amb24365247 [0,1,0,0,0,1|0,0,1]=3 5417 B13R1.44 C=CCOC(=O)Nc1ccncc1 Amb26320252 [0,1,0,0,0,1|1,0,1]=4 5418 B13R1.44 C=CCOC(=O)Oc1ccccc1 Amb22360640 [0,1,0,0,0,1|0,0,1]=3 5419 B13R1.44 C=CCOC(=S)Nc1ccccc1 Amb25926853 [0,1,0,0,0,1|0,1,1]=4 5420 B13R1.44 CC#COC(=O)Nc1ccccc1 Amb28292693 [0,1,0,0,0,1|0,0,1]=3 5421 B13R1.44 CCCCC(=O)Cc1ccccc1 Amb3940684 [0,1,0,0,0,1|1,0,0]=3 5422 B13R1.44 CCCCC(=O)Nc1ccccc1 Amb3104073 [0,1,0,0,0,1|1,0,0]=3 5423 B13R1.44 CCCCC(=O)Nc1ccccn1 Amb2674630 [0,1,0,0,0,1|2,0,0]=4 5424 B13R1.44 CCCCC(=O)Nc1ccncc1 Amb5797736 [0,1,0,0,0,1|2,0,0]=4 5425 B13R1.44 CCCCC(=O)Oc1ccccc1 Amb3123544 [0,1,0,0,0,1|1,0,0]=3 5426 B13R1.44 CCCNC(=N)Nc1ccccc1 Amb18184209 [0,1,0,0,0,1|2,0,0]=4 5427 B13R1.44 CCCNC(=O)Nc1ccccc1 Amb1233730 [0,1,0,0,0,1|1,0,0]=3 5428 B13R1.44 CCCNC(=O)Nc1ccccn1 Amb7106868 [0,1,0,0,0,1|2,0,0]=4 5429 B13R1.44 CCCNC(=O)Nc1cccnc1 Amb23263124 [0,1,0,0,0,1|2,0,0]=4 5430 B13R1.44 CCCNC(=O)Nc1ccncc1 Amb27636320 [0,1,0,0,0,1|2,0,0]=4 5431 B13R1.44 CCCOC(=O)Cc1ccccc1 Amb9242897 [0,1,0,0,0,1|0,0,0]=2 5432 B13R1.44 CCCOC(=O)Nc1ccccc1 Amb3101936 [0,1,0,0,0,1|0,0,0]=2 5433 B13R1.44 CCCOC(=O)Nc1ccccn1 Amb27481583 [0,1,0,0,0,1|1,0,0]=3 5434 B13R1.44 CCCOC(=O)Nc1cccnn1 Amb29872454 [0,1,0,0,0,1|2,0,0]=4 5435 B13R1.44 CCCOC(=O)Nc1cnccn1 Amb35684699 [0,1,0,0,0,1|2,0,0]=4 5436 B13R1.44 CCCOC(=S)Nc1ccccc1 Amb8477119 [0,1,0,0,0,1|0,1,0]=3 5437 B13R1.44 CCCSC(=N)Nc1ccccc1 Amb27792011 [0,1,0,0,0,1|1,1,0]=4 5438 B13R1.44 CCCSC(=O)Nc1ccccc1 Amb4018339 [0,1,0,0,0,1|0,1,0]=3 5439 B13R1.44 CCCSC(=S)Nc1ccccc1 Amb27797240 [0,1,0,0,0,1|0,2,0]=4 5440 B13R1.44 CCNCC(=O)Nc1ccccc1 Amb28600287 [0,1,0,0,0,1|1,0,0]=3 5441 B13R1.44 CCNCC(=O)Nc1ccccc1 Amb6242927 [0,1,0,0,0,1|1,0,0]=3 5442 B13R1.44 CCNCC(=O)Nc1ccccn1 Amb18186353 [0,1,0,0,0,1|2,0,0]=4 5443 B13R1.44 CCNCC(=O)Nc1ccncc1 Amb18809185 [0,1,0,0,0,1|2,0,0]=4 5444 B13R1.44 CCNNC(=S)Nc1ccccc1 Amb25276309 [0,1,0,0,0,1|1,1,0]=4 5445 B13R1.44 CCOCC(=O)Nc1ccccc1 Amb2662084 [0,1,0,0,0,1|0,0,0]=2 5446 B13R1.44 CCOCC(=O)Nc1ncccn1 Amb3445492 [0,1,0,0,0,1|2,0,0]=4 5447 B13R1.44 CCONC(=O)Nc1ccccc1 Amb2818933 [0,1,0,0,0,1|0,0,0]=2 5448 B13R1.44 CCONC(=O)Nc1ccccn1 Amb27256095 [0,1,0,0,0,1|1,0,0]=3 5449 B13R1.44 CCONC(=O)Nc1cncnc1 Amb27485683 [0,1,0,0,0,1|2,0,0]=4 5450 B13R1.44 CCONC(=S)Nc1ccccc1 Amb25733078 [0,1,0,0,0,1|0,1,0]=3 5451 B13R1.44 CCSCC(=O)Cc1ccccc1 Amb9668576 [0,1,0,0,0,1|0,1,0]=3 5452 B13R1.44 CCSCC(=O)Nc1ccccn1 Amb27218782 [0,1,0,0,0,1|1,1,0]=4 5453 B13R1.44 CC\C=C\C(=O)Nc1ccccn1 Amb27752836 [0,1,0,0,0,1|2,0,0]=4 5454 B13R1.44 CC\C=C\C(=O)Nc1cccnc1 Amb27615731 [0,1,0,0,0,1|2,0,0]=4 5455 B13R1.44 CC\C=C\C(=O)Nc1ccncc1 Amb27594498 [0,1,0,0,0,1|2,0,0]=4 5456 B13R1.44 CNCCC(=O)Nc1ccccc1 Amb15740952 [0,1,0,0,0,1|1,0,0]=3 5457 B13R1.44 CNCCC(=O)Nc1ccccc1 Amb9833670 [0,1,0,0,0,1|1,0,0]=3 5458 B13R1.44 CNCCC(=O)Nc1cccnc1 Amb18184496 [0,1,0,0,0,1|2,0,0]=4 5459 B13R1.44 CNCCC(=O)Nc1cccnc1 Amb22014620 [0,1,0,0,0,1|2,0,0]=4 5460 B13R1.44 CNCC\C(C)=C\c1ccccc1 Amb33476406 [0,1,0,0,0,1|2,0,0]=4 5461 B13R1.44 CNNCC(=O)Nc1ccccc1 Amb28251057 [0,1,0,0,0,1|2,0,0]=4 5462 B13R1.44 CN\N=C\C(=O)Nc1ccccc1 Amb26388804 [0,1,0,0,0,1|2,0,0]=4 5463 B13R1.44 COCNC(=O)Nc1ccccc1 Amb350975 [0,1,0,0,0,1|1,0,0]=3 5464 B13R1.44 CO\N=C\C(=O)Nc1ccccc1 Amb28120084 [0,1,0,0,0,1|2,0,0]=4 5465 B13R1.44 CSCCC(=O)Nc1ccccc1 Amb27260793 [0,1,0,0,0,1|1,0,0]=3 5466 B13R1.44 CSCCC(=O)Nc1ccncc1 Amb27443844 [0,1,0,0,0,1|2,0,0]=4 5467 B13R1.44 CSSCC(=O)Nc1ccccc1 Amb27261083 [0,1,0,0,0,1|1,1,0]=4 5468 B13R1.44 CS\C=C\C(=O)Nc1ccccc1 Amb27836656 [0,1,0,0,0,1|1,0,1]=4 5469 B13R1.44 C\C(=C/c1ccccc1)CCCBr Amb33381474 [0,1,0,0,0,1|2,0,0]=4 5470 B13R1.44 C\C(=C/c1ccccc1)CCCN Amb32951765 [0,1,0,0,0,1|2,0,0]=4 5471 B13R1.44 C\C(=C/c1ccccc1)CCCO Amb33081745 [0,1,0,0,0,1|2,0,0]=4 5472 B13R1.44 C\C(=C/c1ccccc1)CCCS Amb33381252 [0,1,0,0,0,1|2,0,0]=4 5473 B13R1.44 C\C=C\CC(=O)Nc1ccccc1 Amb27949573 [0,1,0,0,0,1|1,0,1]=4 5474 B13R1.44 C\C=C\OC(=O)Nc1ccccc1 Amb27864106 [0,1,0,0,0,1|0,0,1]=3 5475 B13R1.44 N#CCCC(=O)Nc1ccccc1 Amb17334976 [0,1,0,0,0,1|1,0,1]=4 5476 B13R1.44 N#CCCC(=O)Oc1ccccc1 Amb17335036 [0,1,0,0,0,1|1,0,1]=4 5477 B13R1.44 N#CCNC(=O)Cc1ccccc1 Amb6347217 [0,1,0,0,0,1|1,0,1]=4 5478 B13R1.44 N#CCNC(=O)Nc1ccccc1 Amb8040596 [0,1,0,0,0,1|1,0,1]=4 5479 B13R1.44 NCCCC(=O)Nc1ccccc1 Amb13952779 [0,1,0,0,0,1|1,0,0]=3 5480 B13R1.44 NCCCC(=O)Nc1ccccc1 Amb5785178 [0,1,0,0,0,1|1,0,0]=3 5481 B13R1.44 NCCCC(=O)Nc1ccccn1 Amb5785302 [0,1,0,0,0,1|2,0,0]=4 5482 B13R1.44 NCCCC(=O)Nc1cccnc1 Amb21895277 [0,1,0,0,0,1|2,0,0]=4 5483 B13R1.44 NCCCC(=O)Nc1cccnc1 Amb6262778 [0,1,0,0,0,1|2,0,0]=4 5484 B13R1.44 NCCCC(=O)Nc1ccncc1 Amb19881194 [0,1,0,0,0,1|2,0,0]=4 5485 B13R1.44 NCCCC(=O)Nc1ccncc1 Amb4424817 [0,1,0,0,0,1|2,0,0]=4 5486 B13R1.44 NCCNC(=O)Cc1ccccc1 Amb33527053 [0,1,0,0,0,1|1,0,0]=3 5487 B13R1.44 NCCNC(=O)Cc1ccccc1 Amb6245780 [0,1,0,0,0,1|1,0,0]=3 5488 B13R1.44 NCCNC(=O)Nc1ccccc1 Amb10808639 [0,1,0,0,0,1|1,0,0]=3 5489 B13R1.44 NCCNC(=O)Nc1ccccc1 Amb15741119 [0,1,0,0,0,1|1,0,0]=3 5490 B13R1.44 NCCNC(=S)Nc1ccccc1 Amb1254362 [0,1,0,0,0,1|1,1,0]=4 5491 B13R1.44 O=C(CCCCl)Nc1ccccc1 Amb1125144 [0,1,0,0,0,1|1,0,0]=3 5492 B13R1.44 O=C(CCCO)Nc1ccccc1 Amb17233533 [0,1,0,0,0,1|1,0,0]=3 5493 B13R1.44 O=C(CCCO)Nc1ccccn1 Amb29872187 [0,1,0,0,0,1|2,0,0]=4 5494 B13R1.44 O=C(CCCO)Nc1cccnc1 Amb27597404 [0,1,0,0,0,1|2,0,0]=4 5495 B13R1.44 O=C(CSCO)Nc1ccccc1 Amb27255517 [0,1,0,0,0,1|1,1,0]=4 5496 B13R1.44 O=C(Cc1ccccc1)NCCCl Amb2429404 [0,1,0,0,0,1|1,0,0]=3 5497 B13R1.44 O=C(Cc1ccccc1)NCCO Amb2437031 [0,1,0,0,0,1|1,0,0]=3 5498 B13R1.44 O=C(Cc1ccccc1)OCCCl Amb24065572 [0,1,0,0,0,1|0,0,0]=2 5499 B13R1.44 O=C(NCCCl)Nc1ccccc1 Amb4022682 [0,1,0,0,0,1|1,0,0]=3 5500 B13R1.44 O=C(NCCCl)Nc1cccnc1 Amb2786660 [0,1,0,0,0,1|2,0,0]=4 5501 B13R1.44 O=C(NCCCl)Nc1ccncc1 Amb2608690 [0,1,0,0,0,1|2,0,0]=4 5502 B13R1.44 O=C(NCCF)Oc1ccccc1 Amb24096857 [0,1,0,0,0,1|1,0,0]=3 5503 B13R1.44 O=C(NCCO)Nc1ccccn1 Amb27660308 [0,1,0,0,0,1|2,0,0]=4 5504 B13R1.44 O=C(NCCO)Oc1ccccc1 Amb9242398 [0,1,0,0,0,1|1,0,0]=3 5505 B13R1.44 O=C(NCCS)Nc1ccccc1 Amb27949630 [0,1,0,0,0,1|1,0,0]=3 5506 B13R1.44 O=C(Nc1ccccc1)OCCBr Amb22346582 [0,1,0,0,0,1|0,0,0]=2 5507 B13R1.44 O=C(Nc1ccccc1)OCCCl Amb22369350 [0,1,0,0,0,1|0,0,0]=2 5508 B13R1.44 O=C(Nc1ccccc1)OCCI Amb28183128 [0,1,0,0,0,1|0,0,0]=2 5509 B13R1.44 O=C(Nc1ccccc1)OCCS Amb27782375 [0,1,0,0,0,1|0,0,0]=2 5510 B13R1.44 O=C(Nc1ccccc1)SCCCl Amb28384991 [0,1,0,0,0,1|0,1,0]=3 5511 B13R1.44 O=C(Nc1ccccn1)OCCO Amb29872188 [0,1,0,0,0,1|1,0,0]=3 5512 B13R1.44 O=C(Nc1cccnc1)OCCCl Amb13952803 [0,1,0,0,0,1|1,0,0]=3 5513 B13R1.44 O=C(Nc1cccnc1)OCCCl Amb27430538 [0,1,0,0,0,1|1,0,0]=3 5514 B13R1.44 O=C(Nc1cccnn1)OCCO Amb29872455 [0,1,0,0,0,1|2,0,0]=4 5515 B13R1.44 O=C(Nc1cnccn1)OCCO Amb35684700 [0,1,0,0,0,1|2,0,0]=4 5516 B13R1.44 O=C(Nc1cncnc1)OCCO Amb28317100 [0,1,0,0,0,1|2,0,0]=4 5517 B13R1.44 O=CCNC(=O)Cc1ccccc1 Amb17102089 [0,1,0,0,0,1|1,0,1]=4 5518 B13R1.44 OCCNC(=S)Nc1ccccc1 Amb6572590 [0,1,0,0,0,1|1,1,0]=4 5519 B13R1.44 OCC\N=C(/S)Nc1ccccc1 Amb8470270 [0,1,0,0,0,1|1,1,0]=4 5520 B13R1.47 C=C(C(=O)OCC)c1ccccc1 Amb10602132 [0,1,0,0,0,1|0,0,0]=2 5521 B13R1.47 CC#CC(=O)N(C)c1ccccc1 Amb27981477 [0,1,0,0,0,1|1,0,1]=4 5522 B13R1.47 CC(C(=O)CCN)c1ccccc1 Amb33081588 [0,1,0,0,0,1|2,0,0]=4 5523 B13R1.47 CCCC(=O)C(=O)c1ccccc1 Amb17594478 [0,1,0,0,0,1|1,0,0]=3 5524 B13R1.47 CCCC(=O)N(N)c1ccccc1 Amb24096809 [0,1,0,0,0,1|1,0,0]=3 5525 B13R1.47 CCCC(=O)N(N)c1ccccn1 Amb33191450 [0,1,0,0,0,1|2,0,0]=4 5526 B13R1.47 CCNC(=N)C(C)c1ccccc1 Amb27415625 [0,1,0,0,0,1|2,0,0]=4 5527 B13R1.47 CCNC(=N)C(N)c1ccccc1 Amb27230276 [0,1,0,0,0,1|2,0,0]=4 5528 B13R1.47 CCNC(=O)C(=O)c1ccccc1 Amb17335165 [0,1,0,0,0,1|1,0,0]=3 5529 B13R1.47 CCNC(=O)C(C)c1ccccn1 Amb27594338 [0,1,0,0,0,1|2,0,0]=4 5530 B13R1.47 CCNC(=O)C(C)c1cccnc1 Amb27196985 [0,1,0,0,0,1|2,0,0]=4 5531 B13R1.47 CCNC(=O)C(Cl)c1ccccc1 Amb8825186 [0,1,0,0,0,1|1,0,0]=3 5532 B13R1.47 CCNC(=O)C(N)c1ccccc1 Amb6275596 [0,1,0,0,0,1|1,0,0]=3 5533 B13R1.47 CCNC(=O)C(N)c1ccccn1 Amb27968449 [0,1,0,0,0,1|2,0,0]=4 5534 B13R1.47 CCNC(=O)C(N)c1cccnc1 Amb24623445 [0,1,0,0,0,1|2,0,0]=4 5535 B13R1.47 CCNC(=O)C(N)c1ccncc1 Amb24361723 [0,1,0,0,0,1|2,0,0]=4 5536 B13R1.47 CCNC(=O)C(O)c1ccccc1 Amb17400707 [0,1,0,0,0,1|1,0,0]=3 5537 B13R1.47 CCNC(=O)N(C)c1ccncc1 Amb27644207 [0,1,0,0,0,1|2,0,0]=4 5538 B13R1.47 CCNC(=O)[C@@H](C)c1ccccc1 Amb27790114 [0,1,0,0,0,1|1,0,0]=3 5539 B13R1.47 CCNC(=O)[C@@H](N)c1ccccc1 Amb17233443 [0,1,0,0,0,1|1,0,0]=3 5540 B13R1.47 CCNC(=S)N(C)c1ccccc1 Amb26425041 [0,1,0,0,0,1|1,1,0]=4 5541 B13R1.47 CCOC(=O)C(=O)c1ccccc1 Amb1216483 [0,1,0,0,0,1|0,0,0]=2 5542 B13R1.47 CCOC(=O)C(=O)c1ccccn1 Amb6301483 [0,1,0,0,0,1|1,0,0]=3 5543 B13R1.47 CCOC(=O)C(=O)c1cccnc1 Amb19957923 [0,1,0,0,0,1|1,0,0]=3 5544 B13R1.47 CCOC(=O)C(Br)c1ccccc1 Amb5722344 [0,1,0,0,0,1|0,0,0]=2 5545 B13R1.47 CCOC(=O)C(Br)c1ccccn1 Amb24066454 [0,1,0,0,0,1|1,0,0]=3 5546 B13R1.47 CCOC(=O)C(Br)c1ccncc1 Amb24309216 [0,1,0,0,0,1|1,0,0]=3 5547 B13R1.47 CCOC(=O)C(C)c1ccccc1 Amb3429835 [0,1,0,0,0,1|0,0,0]=2 5548 B13R1.47 CCOC(=O)C(Cl)c1ccccc1 Amb1647396 [0,1,0,0,0,1|0,0,0]=2 5549 B13R1.47 CCOC(=O)C(N)c1ccccc1 Amb2756639 [0,1,0,0,0,1|0,0,0]=2 5550 B13R1.47 CCOC(=O)C(N)c1ccccc1 Amb7754483 [0,1,0,0,0,1|0,0,0]=2 5551 B13R1.47 CCOC(=O)C(N)c1ccccn1 Amb17935885 [0,1,0,0,0,1|1,0,0]=3 5552 B13R1.47 CCOC(=O)C(N)c1ccccn1 Amb3942220 [0,1,0,0,0,1|1,0,0]=3 5553 B13R1.47 CCOC(=O)C(N)c1cccnc1 Amb19003474 [0,1,0,0,0,1|1,0,0]=3 5554 B13R1.47 CCOC(=O)C(N)c1cccnc1 Amb31059483 [0,1,0,0,0,1|1,0,0]=3 5555 B13R1.47 CCOC(=O)C(O)c1ccccc1 Amb3939668 [0,1,0,0,0,1|0,0,0]=2 5556 B13R1.47 CCOC(=O)C(O)c1cccnc1 Amb18186776 [0,1,0,0,0,1|1,0,0]=3 5557 B13R1.47 CCOC(=O)C(O)c1cccnc1 Amb19351688 [0,1,0,0,0,1|1,0,0]=3 5558 B13R1.47 CCOC(=O)N(C)c1ccccc1 Amb4017512 [0,1,0,0,0,1|0,0,0]=2 5559 B13R1.47 CCOC(=O)N(C)c1ccccn1 Amb24095648 [0,1,0,0,0,1|1,0,0]=3 5560 B13R1.47 CCOC(=O)[C@@H](N)c1ccccc1 Amb10844947 [0,1,0,0,0,1|0,0,0]=2 5561 B13R1.47 CCOC(=O)[C@@H](N)c1ccccc1 Amb17678824 [0,1,0,0,0,1|0,0,0]=2 5562 B13R1.47 CCOC(=O)[C@@H](O)c1ccccc1 Amb3939685 [0,1,0,0,0,1|0,0,0]=2 5563 B13R1.47 CCOC(=O)[C@H](N)C1=CCC=CC1 Amb33803268 [0,1,0,0,0,1|0,0,2]=4 5564 B13R1.47 CCOC(=O)[C@H](N)c1ccccc1 Amb19889826 [0,1,0,0,0,1|0,0,0]=2 5565 B13R1.47 CCOC(=O)[C@H](N)c1ccccc1 Amb3940045 [0,1,0,0,0,1|0,0,0]=2 5566 B13R1.47 CCOC(=O)[C@H](O)c1ccccc1 Amb3939686 [0,1,0,0,0,1|0,0,0]=2 5567 B13R1.47 CC\C=C(/C)C(O)c1ccccc1 Amb22546638 [0,1,0,0,0,1|2,0,0]=4 5568 B13R1.47 CC\C=C(\C)C(=O)c1ccccc1 Amb27252342 [0,1,0,0,0,1|2,0,0]=4 5569 B13R1.47 CC\C=C(\C)C(O)c1ccccc1 Amb28294233 [0,1,0,0,0,1|2,0,0]=4 5570 B13R1.47 CC\C=C(\Cl)C(=O)c1ccccc1 Amb26442043 [0,1,0,0,0,1|2,0,0]=4 5571 B13R1.47 CC\C=C(\F)C(=O)c1ccccc1 Amb26420849 [0,1,0,0,0,1|2,0,0]=4 5572 B13R1.47 CN(C(=O)CCBr)c1ccccc1 Amb17324151 [0,1,0,0,0,1|2,0,0]=4 5573 B13R1.47 CN(C(=O)CCCl)c1ccccc1 Amb1141646 [0,1,0,0,0,1|2,0,0]=4 5574 B13R1.47 CN(C(=O)CCN)c1ccccc1 Amb1134878 [0,1,0,0,0,1|2,0,0]=4 5575 B13R1.47 CN(C(=O)CCN)c1ccccc1 Amb9147569 [0,1,0,0,0,1|2,0,0]=4 5576 B13R1.47 CN(C(=O)CCO)c1ccccc1 Amb17335302 [0,1,0,0,0,1|2,0,0]=4 5577 B13R1.47 CNCC(=O)C(C)c1ccccc1 Amb33223804 [0,1,0,0,0,1|2,0,0]=4 5578 B13R1.47 CNCC(=O)N(C)c1ccccc1 Amb2694351 [0,1,0,0,0,1|2,0,0]=4 5579 B13R1.47 CNCC(=O)N(C)c1ccccc1 Amb6273922 [0,1,0,0,0,1|2,0,0]=4 5580 B13R1.47 COCC(=O)N(N)c1ccccc1 Amb33191333 [0,1,0,0,0,1|2,0,0]=4 5581 B13R1.47 CONC(=O)C(=O)c1ccccc1 Amb27954049 [0,1,0,0,0,1|2,0,0]=4 5582 B13R1.47 CONC(=O)C(C)c1ccccc1 Amb28072728 [0,1,0,0,0,1|2,0,0]=4 5583 B13R1.47 CONC(=O)C(N)c1ccccc1 Amb28243508 [0,1,0,0,0,1|2,0,0]=4 5584 B13R1.47 CONC(=O)[C@@H](N)c1ccccc1 Amb27402365 [0,1,0,0,0,1|2,0,0]=4 5585 B13R1.47 CONC(=O)[C@@H](O)c1ccccc1 Amb27206352 [0,1,0,0,0,1|2,0,0]=4 5586 B13R1.47 CONC(=O)[C@H](N)c1ccccc1 Amb27455721 [0,1,0,0,0,1|2,0,0]=4 5587 B13R1.47 C\C=C\C(=O)C(C)c1ccccc1 Amb24529691 [0,1,0,0,0,1|1,0,1]=4 5588 B13R1.47 C\C=C\C(=O)N(C)c1ccccc1 Amb27174961 [0,1,0,0,0,1|1,0,1]=4 5589 B13R1.47 C\C=C\C(=O)N(N)c1ccccc1 Amb33191338 [0,1,0,0,0,1|1,0,1]=4 5590 B13R1.79 CCC\C(=N/N)Nc1ccccc1 Amb18790856 [0,1,0,0,0,1|2,0,0]=4 5591 B13R1.79 CCO\C(C=O)=C/c1ccccc1 Amb22546895 [0,1,0,0,0,1|0,0,0]=2 5592 B13R1.79 CCS\C(=N/c1ccccc1)NC Amb26434247 [0,1,0,0,0,1|1,1,0]=4 5593 B13R1.135 C=C(CN)C(=O)Nc1ccccc1 Amb27403619 [0,1,0,0,0,1|2,0,0]=4 5594 B13R1.135 C=C(CO)C(=O)Nc1ccccc1 Amb27653164 [0,1,0,0,0,1|2,0,0]=4 5595 B13R1.135 C=C(SC)C(=O)Nc1ccccc1 Amb27797309 [0,1,0,0,0,1|2,0,0]=4 5596 B13R1.135 CC(CCl)C(=O)Nc1ccccc1 Amb18325437 [0,1,0,0,0,1|2,0,0]=4 5597 B13R1.135 CC(CN)C(=O)Nc1ccccc1 Amb18983419 [0,1,0,0,0,1|2,0,0]=4 5598 B13R1.135 CC(CS)C(=O)Nc1ccccc1 Amb11032426 [0,1,0,0,0,1|2,0,0]=4 5599 B13R1.135 CCC(=O)\C(C)=C\c1ccccc1 Amb27428384 [0,1,0,0,0,1|2,0,0]=4 5600 B13R1.135 CCC(Br)C(=O)Nc1ccccc1 Amb10786674 [0,1,0,0,0,1|1,0,0]=3 5601 B13R1.135 CCC(Br)C(=O)Nc1ccccn1 Amb28041874 [0,1,0,0,0,1|2,0,0]=4 5602 B13R1.135 CCC(Br)C(=O)Nc1cccnc1 Amb27495309 [0,1,0,0,0,1|2,0,0]=4 5603 B13R1.135 CCC(C)C(=O)Nc1ccccc1 Amb2642650 [0,1,0,0,0,1|1,0,0]=3 5604 B13R1.135 CCC(C)C(=O)Nc1cccnc1 Amb3886761 [0,1,0,0,0,1|2,0,0]=4 5605 B13R1.135 CCC(C)C(=O)Nc1ccncc1 Amb3886762 [0,1,0,0,0,1|2,0,0]=4 5606 B13R1.135 CCC(Cl)C(=O)Nc1ccccc1 Amb1676622 [0,1,0,0,0,1|1,0,0]=3 5607 B13R1.135 CCC(F)C(=O)Nc1ccccc1 Amb28398458 [0,1,0,0,0,1|1,0,0]=3 5608 B13R1.135 CCC(N)C(=O)Nc1cccnc1 Amb9514104 [0,1,0,0,0,1|2,0,0]=4 5609 B13R1.135 CCC(O)C(=O)Nc1ccccc1 Amb28198048 [0,1,0,0,0,1|1,0,0]=3 5610 B13R1.135 CCC(O)C(=O)Nc1ccncc1 Amb25686819 [0,1,0,0,0,1|2,0,0]=4 5611 B13R1.135 CCN(C)C(=O)Nc1ccccn1 Amb28382139 [0,1,0,0,0,1|2,0,0]=4 5612 B13R1.135 CCN(N)C(=O)Nc1ccccc1 Amb27254668 [0,1,0,0,0,1|1,0,0]=3 5613 B13R1.135 CCN(N)C(=S)Nc1ccccc1 Amb355093 [0,1,0,0,0,1|1,1,0]=4 5614 B13R1.135 CCN(O)C(=O)Nc1ccccc1 Amb27797238 [0,1,0,0,0,1|1,0,0]=3 5615 B13R1.135 CC[C@@H](C)C(=O)Nc1ccccc1 Amb27455047 [0,1,0,0,0,1|1,0,0]=3 5616 B13R1.135 CC[C@@H](O)\C(C)=C\c1ccccc1 Amb27852767 [0,1,0,0,0,1|2,0,0]=4 5617 B13R1.135 CC[C@@H](O)\C(Cl)=C\c1ccccc1 Amb27456661 [0,1,0,0,0,1|2,0,0]=4 5618 B13R1.135 CC[C@H](N)C(=O)Nc1ccccn1 Amb28200324 [0,1,0,0,0,1|2,0,0]=4 5619 B13R1.135 CC[C@H](O)C(=O)Nc1ccccc1 Amb27464403 [0,1,0,0,0,1|1,0,0]=3 5620 B13R1.135 CC[C@H](O)\C(C)=C\c1ccccc1 Amb28281705 [0,1,0,0,0,1|2,0,0]=4 5621 B13R1.135 CNC(=O)C(=O)Cc1ccccc1 Amb17400596 [0,1,0,0,0,1|2,0,0]=4 5622 B13R1.135 CNC(=O)C(=O)Nc1ccccc1 Amb1798389 [0,1,0,0,0,1|2,0,0]=4 5623 B13R1.135 CNC(C)C(=O)Nc1ccccc1 Amb7754252 [0,1,0,0,0,1|2,0,0]=4 5624 B13R1.135 CNN(C)C(=O)Nc1ccccc1 Amb27636937 [0,1,0,0,0,1|2,0,0]=4 5625 B13R1.135 COC(=O)C(=O)Cc1ccccc1 Amb17138843 [0,1,0,0,0,1|2,0,0]=4 5626 B13R1.135 CON(C)C(=O)Cc1ccccc1 Amb20673721 [0,1,0,0,0,1|2,0,0]=4 5627 B13R1.135 CON(C)C(=O)Nc1ccccc1 Amb22369280 [0,1,0,0,0,1|2,0,0]=4 5628 B13R1.135 CSC(C)C(=O)Nc1ccccc1 Amb26348324 [0,1,0,0,0,1|2,0,0]=4 5629 B13R1.135 C\C=C(\C)C(=O)Nc1ccccc1 Amb27604243 [0,1,0,0,0,1|1,0,1]=4 5630 B13R1.135 C\C=C(\C)C(=O)Oc1ccccc1 Amb28126464 [0,1,0,0,0,1|1,0,1]=4 5631 B13R1.135 NC(CO)C(=O)Nc1ccccc1 Amb27631427 [0,1,0,0,0,1|2,0,0]=4 5632 B13R1.135 NCC(N)C(=O)Nc1ccccc1 Amb27429173 [0,1,0,0,0,1|2,0,0]=4 5633 B13R1.135 NCC(O)C(=O)Nc1ccccc1 Amb28143142 [0,1,0,0,0,1|2,0,0]=4 5634 B13R1.135 O=C(Nc1ccccc1)C(Cl)CCl Amb22353137 [0,1,0,0,0,1|2,0,0]=4 5635 B13R1.135 O=C(Nc1ccccc1)C(O)CS Amb27421348 [0,1,0,0,0,1|2,0,0]=4 5636 B13R1.348 C=C(C)NC(=O)Nc1ccccc1 Amb28436709 [0,1,0,0,0,1|1,0,1]=4 5637 B13R1.348 C=C(C)OC(=O)Nc1cccnc1 Amb26453450 [0,1,0,0,0,1|1,0,1]=4 5638 B13R1.348 CC(=O)CC(=O)Cc1ccccc1 Amb15692856 [0,1,0,0,0,1|1,0,1]=4 5639 B13R1.348 CC(=O)CC(=O)Nc1ccccc1 Amb1210069 [0,1,0,0,0,1|1,0,1]=4 5640 B13R1.348 CC(=O)CC(=O)Oc1ccccc1 Amb22586480 [0,1,0,0,0,1|1,0,1]=4 5641 B13R1.348 CC(=O)NC(=O)Nc1ccccc1 Amb4017470 [0,1,0,0,0,1|1,0,1]=4 5642 B13R1.348 CC(=O)NC(=O)Oc1ccccc1 Amb28366948 [0,1,0,0,0,1|1,0,1]=4 5643 B13R1.348 CC(C)=CC(=O)Cc1ccccc1 Amb27871192 [0,1,0,0,0,1|1,0,1]=4 5644 B13R1.348 CC(C)=CC(=O)Nc1ccccc1 Amb3114304 [0,1,0,0,0,1|1,0,1]=4 5645 B13R1.348 CC(C)=CC(=O)Oc1ccccc1 Amb3119550 [0,1,0,0,0,1|1,0,1]=4 5646 B13R1.348 CC(C)=CC(=O)Sc1ccccc1 Amb28242437 [0,1,0,0,0,1|1,0,1]=4 5647 B13R1.348 CC(C)CC(=O)Cc1ccccc1 Amb15690932 [0,1,0,0,0,1|1,0,0]=3 5648 B13R1.348 CC(C)CC(=O)Nc1ccccc1 Amb3109675 [0,1,0,0,0,1|1,0,0]=3 5649 B13R1.348 CC(C)CC(=O)Nc1ccccn1 Amb2661096 [0,1,0,0,0,1|2,0,0]=4 5650 B13R1.348 CC(C)CC(=O)Nc1ccncc1 Amb6398719 [0,1,0,0,0,1|2,0,0]=4 5651 B13R1.348 CC(C)CC(=O)Sc1ccccn1 Amb24097109 [0,1,0,0,0,1|2,0,0]=4 5652 B13R1.348 CC(C)NC(=O)Cc1ccccc1 Amb3099551 [0,1,0,0,0,1|1,0,0]=3 5653 B13R1.348 CC(C)NC(=O)Cc1ccncc1 Amb27662922 [0,1,0,0,0,1|2,0,0]=4 5654 B13R1.348 CC(C)NC(=O)Nc1ccccc1 Amb3365184 [0,1,0,0,0,1|1,0,0]=3 5655 B13R1.348 CC(C)NC(=O)Nc1ccccn1 Amb26064428 [0,1,0,0,0,1|2,0,0]=4 5656 B13R1.348 CC(C)NC(=O)Oc1ccccc1 Amb2732288 [0,1,0,0,0,1|1,0,0]=3 5657 B13R1.348 CC(C)NC(=O)Sc1ccccc1 Amb27643652 [0,1,0,0,0,1|1,0,0]=3 5658 B13R1.348 CC(C)NC(=S)Nc1ccccc1 Amb2689032 [0,1,0,0,0,1|1,1,0]=4 5659 B13R1.348 CC(C)NC(=S)Sc1ccccc1 Amb28366729 [0,1,0,0,0,1|1,1,0]=4 5660 B13R1.348 CC(C)OC(=O)Cc1ccccc1 Amb6357769 [0,1,0,0,0,1|0,0,0]=2 5661 B13R1.348 CC(C)OC(=O)Nc1ccccc1 Amb6358017 [0,1,0,0,0,1|0,0,0]=2 5662 B13R1.348 CC(C)OC(=O)Nc1cccnc1 Amb24668962 [0,1,0,0,0,1|1,0,0]=3 5663 B13R1.348 CC(C)OC(=O)Nc1cccnn1 Amb35734442 [0,1,0,0,0,1|2,0,0]=4 5664 B13R1.348 CC(C)OC(=O)Nc1ccncc1 Amb4021843 [0,1,0,0,0,1|1,0,0]=3 5665 B13R1.348 CC(C)OC(=O)Nc1cnccn1 Amb35708046 [0,1,0,0,0,1|2,0,0]=4 5666 B13R1.348 CC(C)OC(=S)Nc1ccccc1 Amb1625289 [0,1,0,0,0,1|0,1,0]=3 5667 B13R1.348 CC(C)SC(=O)Nc1ccccc1 Amb4011071 [0,1,0,0,0,1|0,1,0]=3 5668 B13R1.348 CC(Cl)CC(=O)Nc1ccccc1 Amb17836214 [0,1,0,0,0,1|1,0,0]=3 5669 B13R1.348 CC(Cl)NC(=O)Nc1ccncc1 Amb27477760 [0,1,0,0,0,1|2,0,0]=4 5670 B13R1.348 CC(N)CC(=O)Nc1ccccc1 Amb18968728 [0,1,0,0,0,1|1,0,0]=3 5671 B13R1.348 CC(O)CC(=O)Nc1ccccc1 Amb2612921 [0,1,0,0,0,1|1,0,0]=3 5672 B13R1.348 CC(S)CC(=O)Nc1ccccc1 Amb32788690 [0,1,0,0,0,1|1,0,0]=3 5673 B13R1.348 CN(C)CC(=O)Cc1ccccc1 Amb32662835 [0,1,0,0,0,1|2,0,0]=4 5674 B13R1.348 CN(C)CC(=O)Cc1ccccc1 Amb9661094 [0,1,0,0,0,1|2,0,0]=4 5675 B13R1.348 CN(C)NC(=O)Nc1ccccc1 Amb9817656 [0,1,0,0,0,1|2,0,0]=4 5676 B13R1.348 CS(=O)CC(=O)Nc1ccccc1 Amb27830060 [0,1,0,0,0,1|2,0,0]=4 5677 B13R1.348 CS(C)=CC(=O)Cc1ccccc1 Amb18048727 [0,1,0,0,0,1|2,0,0]=4 5678 B13R1.348 C\C(=C/C(C)N)Cc1ccccc1 Amb28187105 [0,1,0,0,0,1|2,0,0]=4 5679 B13R1.348 C\C(=C/c1ccccc1)CC(C)Br Amb33476750 [0,1,0,0,0,1|2,0,0]=4 5680 B13R1.348 C\C(=C/c1ccccc1)CC(C)O Amb28190232 [0,1,0,0,0,1|2,0,0]=4 5681 B13R1.348 C\C(=C/c1ccccc1)C[C@@H](C)N Amb33476743 [0,1,0,0,0,1|2,0,0]=4 5682 B13R1.348 C\C(=C/c1ccccc1)C[C@@H](C)O Amb32954504 [0,1,0,0,0,1|2,0,0]=4 5683 B13R1.348 C\C(=C/c1ccccc1)C[C@H](C)N Amb33476746 [0,1,0,0,0,1|2,0,0]=4 5684 B13R1.348 C\C(=C/c1ccccc1)C[C@H](C)O Amb32953325 [0,1,0,0,0,1|2,0,0]=4 5685 B13R1.348 C\C(=C\C(C)C)Nc1ccccc1 Amb27411239 [0,1,0,0,0,1|2,0,0]=4 5686 B13R1.348 C\C(Cl)=C\C(=O)Nc1ccccc1 Amb22462104 [0,1,0,0,0,1|1,0,1]=4 5687 B13R1.348 C\C(N)=C\C(=O)Nc1ccccc1 Amb27407089 [0,1,0,0,0,1|1,0,1]=4 5688 B13R1.470 C=NOC(=O)Nc1ccccc1Cl Amb27749044 [0,1,0,0,0,1|1,0,1]=4 5689 B13R1.470 C=NOC(=O)Nc1ccccc1F Amb28400321 [0,1,0,0,0,1|1,0,1]=4 5690 B13R1.470 CC#CC(=O)Nc1ccccc1F Amb27809959 [0,1,0,0,0,1|1,0,1]=4 5691 B13R1.470 CC#CC(=O)Nc1ccccc1I Amb27215123 [0,1,0,0,0,1|1,0,1]=4 5692 B13R1.470 CCCC(=O)Cc1ccccc1C Amb17138794 [0,1,0,0,0,1|1,0,0]=3 5693 B13R1.470 CCCC(=O)Cc1ccccc1Cl Amb17139625 [0,1,0,0,0,1|1,0,0]=3 5694 B13R1.470 CCCC(=O)Cc1ccccc1F Amb17138960 [0,1,0,0,0,1|1,0,0]=3 5695 B13R1.470 CCCC(=O)Nc1ccccc1Br Amb2587895 [0,1,0,0,0,1|1,0,0]=3 5696 B13R1.470 CCCC(=O)Nc1ccccc1Cl Amb2674431 [0,1,0,0,0,1|1,0,0]=3 5697 B13R1.470 CCCC(=O)Nc1ccccc1I Amb4133453 [0,1,0,0,0,1|1,0,0]=3 5698 B13R1.470 CCCC(=O)Nc1ccccc1N Amb33734468 [0,1,0,0,0,1|1,0,0]=3 5699 B13R1.470 CCCC(=O)Nc1ccccc1N Amb843224 [0,1,0,0,0,1|1,0,0]=3 5700 B13R1.470 CCCC(=O)Nc1ccccc1O Amb2660691 [0,1,0,0,0,1|1,0,0]=3 5701 B13R1.470 CCCC(=O)Nc1cccnc1Cl Amb2661722 [0,1,0,0,0,1|2,0,0]=4 5702 B13R1.470 CCCC(=O)Nc1cccnc1F Amb30018370 [0,1,0,0,0,1|2,0,0]=4 5703 B13R1.470 CCCC(=O)Nc1cccnc1I Amb28051324 [0,1,0,0,0,1|2,0,0]=4 5704 B13R1.470 CCCC(=O)Nc1ccncc1Cl Amb27853058 [0,1,0,0,0,1|2,0,0]=4 5705 B13R1.470 CCCC(=O)Nc1ccncc1I Amb27833342 [0,1,0,0,0,1|2,0,0]=4 5706 B13R1.470 CCCC(=O)Nc1cnccc1O Amb26330467 [0,1,0,0,0,1|2,0,0]=4 5707 B13R1.470 CCCC(=O)Nc1ncccc1Br Amb2867381 [0,1,0,0,0,1|2,0,0]=4 5708 B13R1.470 CCCC(=O)Nc1ncccc1C Amb3356874 [0,1,0,0,0,1|2,0,0]=4 5709 B13R1.470 CCCC(=O)Nc1ncccc1O Amb25125888 [0,1,0,0,0,1|2,0,0]=4 5710 B13R1.470 CCCC(=S)Nc1ccccc1N Amb28323183 [0,1,0,0,0,1|1,1,0]=4 5711 B13R1.470 CCCS(=O)Nc1ccccc1O Amb28437092 [0,1,0,0,0,1|2,0,0]=4 5712 B13R1.470 CCNC(=N)Nc1ccccc1C Amb18804674 [0,1,0,0,0,1|2,0,0]=4 5713 B13R1.470 CCNC(=O)Cc1ccccc1Br Amb22230625 [0,1,0,0,0,1|1,0,0]=3 5714 B13R1.470 CCNC(=O)Cc1ccccc1Cl Amb23014083 [0,1,0,0,0,1|1,0,0]=3 5715 B13R1.470 CCNC(=O)Cc1ccccc1F Amb8341226 [0,1,0,0,0,1|1,0,0]=3 5716 B13R1.470 CCNC(=O)Cc1ccccc1N Amb1121104 [0,1,0,0,0,1|1,0,0]=3 5717 B13R1.470 CCNC(=O)Cc1cccnc1Br Amb28207078 [0,1,0,0,0,1|2,0,0]=4 5718 B13R1.470 CCNC(=O)Cc1cccnc1C Amb28187883 [0,1,0,0,0,1|2,0,0]=4 5719 B13R1.470 CCNC(=O)Cc1ncccc1F Amb27457351 [0,1,0,0,0,1|2,0,0]=4 5720 B13R1.470 CCNC(=O)Nc1ccccc1C Amb2236972 [0,1,0,0,0,1|1,0,0]=3 5721 B13R1.470 CCNC(=O)Nc1ccccc1Cl Amb4018016 [0,1,0,0,0,1|1,0,0]=3 5722 B13R1.470 CCNC(=O)Nc1ccccc1I Amb27414508 [0,1,0,0,0,1|1,0,0]=3 5723 B13R1.470 CCNC(=O)Nc1ccncc1Br Amb27164610 [0,1,0,0,0,1|2,0,0]=4 5724 B13R1.470 CCNC(=O)Nc1ccncc1F Amb27411659 [0,1,0,0,0,1|2,0,0]=4 5725 B13R1.470 CCNC(=O)Nc1ccncc1I Amb27207320 [0,1,0,0,0,1|2,0,0]=4 5726 B13R1.470 CCNC(=O)Nc1ccncc1N Amb18967352 [0,1,0,0,0,1|2,0,0]=4 5727 B13R1.470 CCNC(=O)Nc1ncccc1C Amb27665033 [0,1,0,0,0,1|2,0,0]=4 5728 B13R1.470 CCNC(=O)Oc1ccccc1C Amb24490439 [0,1,0,0,0,1|1,0,0]=3 5729 B13R1.470 CCNC(=O)Oc1ccccc1N Amb27476611 [0,1,0,0,0,1|1,0,0]=3 5730 B13R1.470 CCNC(=O)Oc1cccnc1I Amb2405499 [0,1,0,0,0,1|2,0,0]=4 5731 B13R1.470 CCNC(=S)Nc1ccccc1Br Amb5287444 [0,1,0,0,0,1|1,1,0]=4 5732 B13R1.470 CCNC(=S)Nc1ccccc1C Amb6370100 [0,1,0,0,0,1|1,1,0]=4 5733 B13R1.470 CCNC(=S)Nc1ccccc1Cl Amb5287414 [0,1,0,0,0,1|1,1,0]=4 5734 B13R1.470 CCNC(=S)Nc1ccccc1F Amb4020875 [0,1,0,0,0,1|1,1,0]=4 5735 B13R1.470 CCNC(=S)Nc1ccccc1N Amb2426399 [0,1,0,0,0,1|1,1,0]=4 5736 B13R1.470 CCNC(=S)Nc1ccccc1O Amb27606354 [0,1,0,0,0,1|1,1,0]=4 5737 B13R1.470 CCNC(=S)Sc1ccccc1C Amb28208427 [0,1,0,0,0,1|1,1,0]=4 5738 B13R1.470 CCOC(=N)Cc1ccccc1C Amb20673147 [0,1,0,0,0,1|1,0,0]=3 5739 B13R1.470 CCOC(=N)Cc1ccccc1Cl Amb19083262 [0,1,0,0,0,1|1,0,0]=3 5740 B13R1.470 CCOC(=N)Cc1ccccc1Cl Amb20673156 [0,1,0,0,0,1|1,0,0]=3 5741 B13R1.470 CCOC(=N)Cc1ccccc1F Amb20673150 [0,1,0,0,0,1|1,0,0]=3 5742 B13R1.470 CCOC(=O)CC1=CN=CNC1=O Amb19516969 [0,1,0,0,0,1|2,0,0]=4 5743 B13R1.470 CCOC(=O)CN1C=CC=CC1=O Amb18186767 [0,1,0,0,0,1|1,0,0]=3 5744 B13R1.470 CCOC(=O)CN1N=CC=CC1=O Amb18181548 [0,1,0,0,0,1|2,0,0]=4 5745 B13R1.470 CCOC(=O)C[n+]1ccccc1C Amb2610041 [0,1,0,0,0,1|1,0,0]=3 5746 B13R1.470 CCOC(=O)Cc1ccccc1Br Amb3429172 [0,1,0,0,0,1|0,0,0]=2 5747 B13R1.470 CCOC(=O)Cc1ccccc1C Amb3940131 [0,1,0,0,0,1|0,0,0]=2 5748 B13R1.470 CCOC(=O)Cc1ccccc1Cl Amb9243016 [0,1,0,0,0,1|0,0,0]=2 5749 B13R1.470 CCOC(=O)Cc1ccccc1F Amb6357916 [0,1,0,0,0,1|0,0,0]=2 5750 B13R1.470 CCOC(=O)Cc1ccccc1I Amb22475916 [0,1,0,0,0,1|0,0,0]=2 5751 B13R1.470 CCOC(=O)Cc1ccccc1N Amb2698942 [0,1,0,0,0,1|0,0,0]=2 5752 B13R1.470 CCOC(=O)Cc1ccccc1N Amb2699173 [0,1,0,0,0,1|0,0,0]=2 5753 B13R1.470 CCOC(=O)Cc1ccccc1O Amb17614081 [0,1,0,0,0,1|0,0,0]=2 5754 B13R1.470 CCOC(=O)Cc1cccnc1Cl Amb21960759 [0,1,0,0,0,1|1,0,0]=3 5755 B13R1.470 CCOC(=O)Cc1cccnc1N Amb32938644 [0,1,0,0,0,1|1,0,0]=3 5756 B13R1.470 CCOC(=O)Cc1ccncc1Br Amb21962528 [0,1,0,0,0,1|1,0,0]=3 5757 B13R1.470 CCOC(=O)Cc1ccncc1C Amb22739815 [0,1,0,0,0,1|1,0,0]=3 5758 B13R1.470 CCOC(=O)Cc1ccncc1Cl Amb26304162 [0,1,0,0,0,1|1,0,0]=3 5759 B13R1.470 CCOC(=O)Cc1ccncc1N Amb18128678 [0,1,0,0,0,1|1,0,0]=3 5760 B13R1.470 CCOC(=O)Cc1cnccc1Cl Amb33250358 [0,1,0,0,0,1|1,0,0]=3 5761 B13R1.470 CCOC(=O)Cc1cncnc1Cl Amb22494259 [0,1,0,0,0,1|2,0,0]=4 5762 B13R1.470 CCOC(=O)Cc1cncnc1O Amb22002045 [0,1,0,0,0,1|2,0,0]=4 5763 B13R1.470 CCOC(=O)Cc1ncccc1Br Amb21963898 [0,1,0,0,0,1|1,0,0]=3 5764 B13R1.470 CCOC(=O)Cc1ncccc1C Amb32882432 [0,1,0,0,0,1|1,0,0]=3 5765 B13R1.470 CCOC(=O)Cc1ncccc1I Amb22499041 [0,1,0,0,0,1|1,0,0]=3 5766 B13R1.470 CCOC(=O)Cc1ncccc1N Amb22295863 [0,1,0,0,0,1|1,0,0]=3 5767 B13R1.470 CCOC(=O)Cc1ncccc1O Amb18648470 [0,1,0,0,0,1|1,0,0]=3 5768 B13R1.470 CCOC(=O)Cc1ncncc1Br Amb22499191 [0,1,0,0,0,1|2,0,0]=4 5769 B13R1.470 CCOC(=O)Cc1ncncc1F Amb33719062 [0,1,0,0,0,1|2,0,0]=4 5770 B13R1.470 CCOC(=O)Nc1ccccc1Br Amb6514657 [0,1,0,0,0,1|0,0,0]=2 5771 B13R1.470 CCOC(=O)Nc1ccccc1Cl Amb6514662 [0,1,0,0,0,1|0,0,0]=2 5772 B13R1.470 CCOC(=O)Nc1ccccc1I Amb27400466 [0,1,0,0,0,1|0,0,0]=2 5773 B13R1.470 CCOC(=O)Nc1cccnc1Cl Amb17792635 [0,1,0,0,0,1|1,0,0]=3 5774 B13R1.470 CCOC(=O)Nc1cccnc1F Amb30018373 [0,1,0,0,0,1|1,0,0]=3 5775 B13R1.470 CCOC(=O)Nc1cccnc1O Amb24490364 [0,1,0,0,0,1|1,0,0]=3 5776 B13R1.470 CCOC(=O)Nc1ccncc1Cl Amb27456271 [0,1,0,0,0,1|1,0,0]=3 5777 B13R1.470 CCOC(=O)Nc1ccncc1I Amb27757091 [0,1,0,0,0,1|1,0,0]=3 5778 B13R1.470 CCOC(=O)Nc1ccncc1N Amb19002524 [0,1,0,0,0,1|1,0,0]=3 5779 B13R1.470 CCOC(=O)Nc1cnccc1O Amb18129000 [0,1,0,0,0,1|1,0,0]=3 5780 B13R1.470 CCOC(=O)Nc1ncccc1C Amb3364657 [0,1,0,0,0,1|1,0,0]=3 5781 B13R1.470 CCOC(=O)Nc1ncccc1Cl Amb28204415 [0,1,0,0,0,1|1,0,0]=3 5782 B13R1.470 CCOC(=O)Nc1ncccc1I Amb28051098 [0,1,0,0,0,1|1,0,0]=3 5783 B13R1.470 CCOC(=O)Nc1ncccc1N Amb18128862 [0,1,0,0,0,1|1,0,0]=3 5784 B13R1.470 CCOC(=S)Nc1ccccc1C Amb27947437 [0,1,0,0,0,1|0,1,0]=3 5785 B13R1.470 CCOC(=S)Nc1ccccc1Cl Amb28133428 [0,1,0,0,0,1|0,1,0]=3 5786 B13R1.470 CCSC(=N)Nc1ccccc1Cl Amb27754016 [0,1,0,0,0,1|1,1,0]=4 5787 B13R1.470 CCSC(=O)Nc1ccccc1C Amb27948118 [0,1,0,0,0,1|0,1,0]=3 5788 B13R1.470 CNCC(=O)Nc1ccccc1Br Amb2277697 [0,1,0,0,0,1|2,0,0]=4 5789 B13R1.470 CNCC(=O)Nc1ccccc1Br Amb2370683 [0,1,0,0,0,1|2,0,0]=4 5790 B13R1.470 CNCC(=O)Nc1ccccc1C Amb6251329 [0,1,0,0,0,1|2,0,0]=4 5791 B13R1.470 CNCC(=O)Nc1ccccc1Cl Amb2281752 [0,1,0,0,0,1|2,0,0]=4 5792 B13R1.470 CNCC(=O)Nc1ccccc1Cl Amb2370637 [0,1,0,0,0,1|2,0,0]=4 5793 B13R1.470 CNCC(=O)Nc1ccccc1I Amb7755136 [0,1,0,0,0,1|2,0,0]=4 5794 B13R1.470 CNCC(=O)Nc1ccccc1N Amb28291835 [0,1,0,0,0,1|2,0,0]=4 5795 B13R1.470 COCC(=O)Nc1ccccc1Br Amb6279750 [0,1,0,0,0,1|2,0,0]=4 5796 B13R1.470 COCC(=O)Nc1ccccc1Cl Amb2607592 [0,1,0,0,0,1|2,0,0]=4 5797 B13R1.470 COCC(=O)Nc1ccccc1F Amb3115736 [0,1,0,0,0,1|2,0,0]=4 5798 B13R1.470 COCC(=O)Nc1ccccc1I Amb6593019 [0,1,0,0,0,1|2,0,0]=4 5799 B13R1.470 COCC(=O)Nc1ccccc1N Amb1121544 [0,1,0,0,0,1|2,0,0]=4 5800 B13R1.470 COCC(=O)Nc1ccccc1N Amb17622091 [0,1,0,0,0,1|2,0,0]=4 5801 B13R1.470 CONC(=O)Cc1ccccc1C Amb10694421 [0,1,0,0,0,1|2,0,0]=4 5802 B13R1.470 CONC(=O)Cc1ccccc1N Amb28122050 [0,1,0,0,0,1|2,0,0]=4 5803 B13R1.470 CONC(=O)Nc1ccccc1C Amb2899772 [0,1,0,0,0,1|2,0,0]=4 5804 B13R1.470 CSCC(=O)Cc1ccccc1F Amb19055167 [0,1,0,0,0,1|2,0,0]=4 5805 B13R1.470 CSCC(=O)Nc1ccccc1Cl Amb15701901 [0,1,0,0,0,1|2,0,0]=4 5806 B13R1.470 CSCC(=O)Nc1ccccc1F Amb8328910 [0,1,0,0,0,1|2,0,0]=4 5807 B13R1.470 CSCC(=O)Nc1ccccc1I Amb11214963 [0,1,0,0,0,1|2,0,0]=4 5808 B13R1.470 C\C=C\C(=O)Cc1ccccc1C Amb28041318 [0,1,0,0,0,1|1,0,1]=4 5809 B13R1.470 C\C=C\C(=O)Nc1ccccc1Br Amb6492108 [0,1,0,0,0,1|1,0,1]=4 5810 B13R1.470 C\C=C\C(=O)Nc1ccccc1O Amb26443968 [0,1,0,0,0,1|1,0,1]=4 5811 B13R1.470 C\C=C\C(=O)Oc1ccccc1Br Amb27761278 [0,1,0,0,0,1|1,0,1]=4 5812 B13R1.470 C\C=C\C(=O)Oc1ccccc1C Amb27748839 [0,1,0,0,0,1|1,0,1]=4 5813 B13R1.470 Cc1ccccc1NC(=O)CCBr Amb17327783 [0,1,0,0,0,1|2,0,0]=4 5814 B13R1.470 Cc1ccccc1NC(=O)CCCl Amb6249193 [0,1,0,0,0,1|2,0,0]=4 5815 B13R1.470 Cc1ccccc1NC(=O)CCN Amb17622092 [0,1,0,0,0,1|2,0,0]=4 5816 B13R1.470 Cc1ccccc1NC(=O)CCN Amb843860 [0,1,0,0,0,1|2,0,0]=4 5817 B13R1.470 Cc1ccccc1NC(=O)CCO Amb17335300 [0,1,0,0,0,1|2,0,0]=4 5818 B13R1.470 Cc1ccccc1NC(=O)OCCl Amb29885600 [0,1,0,0,0,1|1,0,0]=3 5819 B13R1.470 Cc1ccccc1OC(=O)CCN Amb17335312 [0,1,0,0,0,1|2,0,0]=4 5820 B13R1.470 Cc1cccnc1NC(=O)OCCl Amb29885608 [0,1,0,0,0,1|2,0,0]=4 5821 B13R1.470 Cc1ccncc1NC(=O)OCCl Amb29885603 [0,1,0,0,0,1|2,0,0]=4 5822 B13R1.470 Cc1cnccc1NC(=O)OCCl Amb29885606 [0,1,0,0,0,1|2,0,0]=4 5823 B13R1.470 Cc1ncccc1NC(=O)OCCl Amb29885604 [0,1,0,0,0,1|2,0,0]=4 5824 B13R1.470 NCCC(=O)Nc1ccccc1Br Amb5785083 [0,1,0,0,0,1|2,0,0]=4 5825 B13R1.470 NCCC(=O)Nc1ccccc1Cl Amb15740943 [0,1,0,0,0,1|2,0,0]=4 5826 B13R1.470 NCCC(=O)Nc1ccccc1Cl Amb5785009 [0,1,0,0,0,1|2,0,0]=4 5827 B13R1.470 NCCC(=O)Nc1ccccc1F Amb1130030 [0,1,0,0,0,1|2,0,0]=4 5828 B13R1.470 NCCC(=O)Nc1ccccc1F Amb17622104 [0,1,0,0,0,1|2,0,0]=4 5829 B13R1.470 NCCC(=O)Nc1ccccc1I Amb7785845 [0,1,0,0,0,1|2,0,0]=4 5830 B13R1.470 NCCC(=O)Nc1ccccc1O Amb25058089 [0,1,0,0,0,1|2,0,0]=4 5831 B13R1.470 NCCC(=O)Oc1ccccc1Br Amb17349673 [0,1,0,0,0,1|2,0,0]=4 5832 B13R1.470 NCCC(=O)Oc1ccccc1Cl Amb17337482 [0,1,0,0,0,1|2,0,0]=4 5833 B13R1.470 NCCC(=O)Oc1ccccc1F Amb17335601 [0,1,0,0,0,1|2,0,0]=4 5834 B13R1.470 O=C(CCBr)Nc1ccccc1Cl Amb17332540 [0,1,0,0,0,1|2,0,0]=4 5835 B13R1.470 O=C(CCBr)Nc1ccccc1F Amb2780998 [0,1,0,0,0,1|2,0,0]=4 5836 B13R1.470 O=C(CCBr)Nc1ccccc1O Amb17331112 [0,1,0,0,0,1|2,0,0]=4 5837 B13R1.470 O=C(CCCl)Nc1ccccc1Br Amb1133055 [0,1,0,0,0,1|2,0,0]=4 5838 B13R1.470 O=C(CCCl)Nc1ccccc1Cl Amb3205120 [0,1,0,0,0,1|2,0,0]=4 5839 B13R1.470 O=C(CCCl)Nc1ccccc1F Amb2792908 [0,1,0,0,0,1|2,0,0]=4 5840 B13R1.470 O=C(CCCl)Nc1ccccc1O Amb1928974 [0,1,0,0,0,1|2,0,0]=4 5841 B13R1.470 O=C(CCO)Nc1ccccc1Br Amb17349665 [0,1,0,0,0,1|2,0,0]=4 5842 B13R1.470 O=C(CCO)Nc1ccccc1Cl Amb9421568 [0,1,0,0,0,1|2,0,0]=4 5843 B13R1.470 O=C(CCO)Nc1ccccc1F Amb9421559 [0,1,0,0,0,1|2,0,0]=4 5844 B13R1.470 O=C(CCS)Nc1ccccc1Cl Amb27450756 [0,1,0,0,0,1|2,0,0]=4 5845 B13R1.470 O=C(NCS)Oc1ccccc1Cl Amb28068762 [0,1,0,0,0,1|2,0,0]=4 5846 B13R1.470 O=C(Nc1ccccc1Br)OCCl Amb35628671 [0,1,0,0,0,1|1,0,0]=3 5847 B13R1.470 O=C(Nc1ccccc1Cl)OCCl Amb29880261 [0,1,0,0,0,1|1,0,0]=3 5848 B13R1.470 O=C(Nc1ccccc1F)OCCl Amb30033148 [0,1,0,0,0,1|1,0,0]=3 5849 B13R1.470 O=C(Nc1ccccc1I)OCCl Amb35628888 [0,1,0,0,0,1|1,0,0]=3 5850 B13R1.470 O=C(Nc1cccnc1Br)OCCl Amb35628681 [0,1,0,0,0,1|2,0,0]=4 5851 B13R1.470 O=C(Nc1cccnc1Cl)OCCl Amb29880270 [0,1,0,0,0,1|2,0,0]=4 5852 B13R1.470 O=C(Nc1cccnc1F)OCCl Amb35628920 [0,1,0,0,0,1|2,0,0]=4 5853 B13R1.470 O=C(Nc1ccncc1Br)OCCl Amb35628678 [0,1,0,0,0,1|2,0,0]=4 5854 B13R1.470 O=C(Nc1ccncc1F)OCCl Amb35644937 [0,1,0,0,0,1|2,0,0]=4 5855 B13R1.470 O=C(Nc1cnccc1Cl)OCCl Amb29880269 [0,1,0,0,0,1|2,0,0]=4 5856 B13R1.470 O=C(Nc1ncccc1Br)OCCl Amb35628679 [0,1,0,0,0,1|2,0,0]=4 5857 B13R1.470 O=C(Nc1ncccc1Cl)OCCl Amb29880268 [0,1,0,0,0,1|2,0,0]=4 5858 B13R1.1327 CCCS(=N)(=O)Nc1ccccc1 Amb35688443 [0,1,0,0,0,1|2,0,0]=4 5859 B13R1.1327 CCCS(=O)(=O)Nc1ccccc1 Amb23496993 [0,1,0,0,0,1|2,0,0]=4 5860 B13R1.1327 CCCS(=O)(=O)Oc1ccccc1 Amb23497027 [0,1,0,0,0,1|2,0,0]=4 5861 B13R1.1327 CCOS(=O)(=O)Cc1ccccc1 Amb32668103 [0,1,0,0,0,1|1,0,0]=3 5862 B13R1.1327 CCO[Si](C)(C)Cc1ccccc1 Amb29469122 [0,1,0,0,0,1|1,1,0]=4 5863 B13R1.463 CCOC(=O)C1CC=CC=CC1O Amb27775814 [0,1,0,0,0,1|0,0,2]=4 5864 B13R1.463 CCOC(=O)N1N=CC=CC=C1C Amb26514915 [0,1,0,0,0,1|1,0,0]=3 5865 B13R1.1462 CCOC(=O)C1=CNC=CC(=O)C1 Amb28061719 [0,1,0,0,0,1|0,0,1]=3 5866 B13R1.1463 CCOC(=O)C1=CCC(=O)NC=C1 Amb27849885 [0,1,0,0,0,1|0,0,1]=3 5867 B13R1.2488 CCCNC(=O)C1C=CC=CC=C1 Amb28051194 [0,1,0,0,0,1|1,0,1]=4 5868 B13R1.2488 CCONC(=O)C1C=CC=CC=C1 Amb27769686 [0,1,0,0,0,1|0,0,1]=3 5869 B13R1.2488 O=C(NCCCl)C1C=CC=CC=C1 Amb28396524 [0,1,0,0,0,1|1,0,1]=4 5870 B13R1.2620 CCN(C)C(=O)C1C=CC=CC=C1 Amb27396653 [0,1,0,0,0,1|1,0,1]=4 5871 B13R1.1 CCC\C(=N\N)c1ccc(Cl)cc1 Amb27823986 [0,2,0,0,0,0|2,0,0]=4 5872 B13R1.1 CCN\C(=N\N)c1ccc(F)cc1 Amb18179032 [0,2,0,0,0,0|2,0,0]=4 5873 B13R1.1 CCN\C(=N\O)c1ccc(Cl)cc1 Amb27165823 [0,2,0,0,0,0|1,0,1]=4 5874 B13R1.1 CCOC(C#N)c1ccc(C)cc1 Amb20623868 [0,2,0,0,0,0|1,0,1]=4 5875 B13R1.1 CCOC(C#N)c1ccc(Cl)cc1 Amb28424063 [0,2,0,0,0,0|1,0,1]=4 5876 B13R1.1 CCOC(C#N)c1ccc(F)cc1 Amb28424064 [0,2,0,0,0,0|1,0,1]=4 5877 B13R1.1 CCOC(CBr)c1ccc(Br)cc1 Amb33349672 [0,2,0,0,0,0|1,0,1]=4 5878 B13R1.1 CCOC(CBr)c1ccc(C)cc1 Amb32710528 [0,2,0,0,0,0|1,0,1]=4 5879 B13R1.1 CCOC(CBr)c1ccc(Cl)cc1 Amb33348169 [0,2,0,0,0,0|1,0,1]=4 5880 B13R1.1 CCOC(CBr)c1ccc(F)cc1 Amb33348044 [0,2,0,0,0,0|1,0,1]=4 5881 B13R1.1 CCOC(CI)c1ccc(Br)cc1 Amb33347954 [0,2,0,0,0,0|1,0,1]=4 5882 B13R1.1 CCOC(CI)c1ccc(C)cc1 Amb33349010 [0,2,0,0,0,0|1,0,1]=4 5883 B13R1.1 CCOC(CI)c1ccc(Cl)cc1 Amb32710563 [0,2,0,0,0,0|1,0,1]=4 5884 B13R1.1 CCOC(CI)c1ccc(F)cc1 Amb33349165 [0,2,0,0,0,0|1,0,1]=4 5885 B13R1.1 CCOC(CN)c1ccc(Br)cc1 Amb17605996 [0,2,0,0,0,0|1,0,1]=4 5886 B13R1.1 CCOC(CN)c1ccc(C)cc1 Amb17606011 [0,2,0,0,0,0|1,0,1]=4 5887 B13R1.1 CCOC(CN)c1ccc(Cl)cc1 Amb17606012 [0,2,0,0,0,0|1,0,1]=4 5888 B13R1.1 CCO\C(=N\N)c1ccc(C)cc1 Amb2697119 [0,2,0,0,0,0|1,0,0]=3 5889 B13R1.1 CC\C=C(/C#N)c1ccc(Br)cc1 Amb17252668 [0,2,0,0,0,0|2,0,0]=4 5890 B13R1.1 CC\C=C(/C#N)c1ccc(C)cc1 Amb17232823 [0,2,0,0,0,0|2,0,0]=4 5891 B13R1.1 CC\C=C(/C#N)c1ccc(Cl)cc1 Amb17235304 [0,2,0,0,0,0|2,0,0]=4 5892 B13R1.1 CC\C=C(/C#N)c1ccc(F)cc1 Amb17233073 [0,2,0,0,0,0|2,0,0]=4 5893 B13R1.1 CC\C=C(\C#N)c1ccc(C)cc1 Amb27191517 [0,2,0,0,0,0|2,0,0]=4 5894 B13R1.1 CC\C=C(\C#N)c1ccc(Cl)cc1 Amb27185893 [0,2,0,0,0,0|2,0,0]=4 5895 B13R1.1 CC\C=C(\C=O)c1ccc(Cl)cc1 Amb27830140 [0,2,0,0,0,0|1,0,0]=3 5896 B13R1.1 CS\C=C(\C=O)c1ccc(C)cc1 Amb27620486 [0,2,0,0,0,0|2,0,0]=4 5897 B13R1.2 CCN\C(=N\N)c1cccc(Cl)c1 Amb19044791 [0,2,0,0,0,0|2,0,0]=4 5898 B13R1.2 CCOC(C#N)c1cccc(C)c1 Amb27193689 [0,2,0,0,0,0|1,0,1]=4 5899 B13R1.2 CCOC(C#N)c1cccc(Cl)c1 Amb27180666 [0,2,0,0,0,0|1,0,1]=4 5900 B13R1.2 CCOC(C#N)c1cccc(I)c1 Amb27267689 [0,2,0,0,0,0|1,0,1]=4 5901 B13R1.2 CCOC(CBr)c1cccc(Br)c1 Amb32710429 [0,2,0,0,0,0|1,0,1]=4 5902 B13R1.2 CCOC(CBr)c1cccc(C)c1 Amb32710549 [0,2,0,0,0,0|1,0,1]=4 5903 B13R1.2 CCOC(CBr)c1cccc(Cl)c1 Amb33348386 [0,2,0,0,0,0|1,0,1]=4 5904 B13R1.2 CCOC(CBr)c1cccc(F)c1 Amb33347816 [0,2,0,0,0,0|1,0,1]=4 5905 B13R1.2 CCOC(CI)c1cccc(Br)c1 Amb33348068 [0,2,0,0,0,0|1,0,1]=4 5906 B13R1.2 CCOC(CI)c1cccc(C)c1 Amb33348848 [0,2,0,0,0,0|1,0,1]=4 5907 B13R1.2 CCOC(CI)c1cccc(Cl)c1 Amb33347840 [0,2,0,0,0,0|1,0,1]=4 5908 B13R1.2 CCOC(CI)c1cccc(F)c1 Amb33349480 [0,2,0,0,0,0|1,0,1]=4 5909 B13R1.2 CCOC(CN)c1cccc(Br)c1 Amb17606016 [0,2,0,0,0,0|1,0,1]=4 5910 B13R1.2 CCOC(CN)c1cccc(Cl)c1 Amb17605998 [0,2,0,0,0,0|1,0,1]=4 5911 B13R1.2 CCOC(CN)c1cccc(F)c1 Amb17606013 [0,2,0,0,0,0|1,0,1]=4 5912 B13R1.26 C#C\C(=C\CCCl)c1ccccc1 Amb27859219 [0,2,0,0,0,0|2,0,0]=4 5913 B13R1.26 CCC(OCCBr)c1ccccc1 Amb32664681 [0,2,0,0,0,0|1,0,1]=4 5914 B13R1.26 CCC(OCCN)c1ccccc1 Amb32584154 [0,2,0,0,0,0|1,0,1]=4 5915 B13R1.26 CCC(OCCO)c1ccccc1 Amb28556150 [0,2,0,0,0,0|1,0,1]=4 5916 B13R1.26 CCCNC(=S=O)c1ccncc1 Amb27608659 [0,2,0,0,0,0|2,0,0]=4 5917 B13R1.26 CCCOC(CBr)c1ccccc1 Amb33348514 [0,2,0,0,0,0|1,0,1]=4 5918 B13R1.26 CCCOC(CI)c1ccccc1 Amb33349130 [0,2,0,0,0,0|1,0,1]=4 5919 B13R1.26 CCC\N=C(\NC)c1ccccc1 Amb27253556 [0,2,0,0,0,0|2,0,0]=4 5920 B13R1.26 CCN\C=C(/C#N)c1ccccc1 Amb27415557 [0,2,0,0,0,0|2,0,0]=4 5921 B13R1.26 CCO\C=C(\C#N)c1ccccc1 Amb27603692 [0,2,0,0,0,0|1,0,0]=3 5922 B13R1.26 NCC(OCCO)c1ccccc1 Amb23580589 [0,2,0,0,0,0|1,0,1]=4 5923 B13R1.26 NCCC\C(=N/O)c1ccccc1 Amb6892138 [0,2,0,0,0,0|1,0,1]=4 5924 B13R1.26 NCCC\C(=N\O)c1ccccc1 Amb33299882 [0,2,0,0,0,0|1,0,1]=4 5925 B13R1.173 CCN\C(=N\N)c1ccccc1F Amb18179031 [0,2,0,0,0,0|2,0,0]=4 5926 B13R1.173 CCOC(C#N)c1ccccc1F Amb27810673 [0,2,0,0,0,0|1,0,1]=4 5927 B13R1.173 CCOC(CBr)c1ccccc1Br Amb32710281 [0,2,0,0,0,0|1,0,1]=4 5928 B13R1.173 CCOC(CBr)c1ccccc1C Amb32710406 [0,2,0,0,0,0|1,0,1]=4 5929 B13R1.173 CCOC(CBr)c1ccccc1Cl Amb33348551 [0,2,0,0,0,0|1,0,1]=4 5930 B13R1.173 CCOC(CBr)c1ccccc1F Amb33347930 [0,2,0,0,0,0|1,0,1]=4 5931 B13R1.173 CCOC(CI)c1ccccc1Br Amb33348092 [0,2,0,0,0,0|1,0,1]=4 5932 B13R1.173 CCOC(CI)c1ccccc1C Amb33348828 [0,2,0,0,0,0|1,0,1]=4 5933 B13R1.173 CCOC(CI)c1ccccc1Cl Amb32710590 [0,2,0,0,0,0|1,0,1]=4 5934 B13R1.173 CCOC(CI)c1ccccc1F Amb33349334 [0,2,0,0,0,0|1,0,1]=4 5935 B13R1.173 CCOC(CN)c1ccccc1C Amb17606025 [0,2,0,0,0,0|1,0,1]=4 5936 B13R1.173 CCOC(CN)c1ccccc1Cl Amb17606018 [0,2,0,0,0,0|1,0,1]=4 5937 B13R1.173 CCOC(CN)c1ccccc1F Amb17606019 [0,2,0,0,0,0|1,0,1]=4 5938 B13R1.173 CC\C=C(\CC)c1ccccc1N Amb27779032 [0,2,0,0,0,0|2,0,0]=4 5939 B13R1.173 CC\N=C(\C#N)c1ccccc1O Amb27640671 [0,2,0,0,0,0|2,0,0]=4 5940 B13R1.398 CC=C=C(CC=O)c1ccccc1 Amb27799824 [0,2,0,0,0,0|1,0,1]=4 5941 B13R1.398 CCC\C(=C\C#N)c1ccccc1 Amb28127674 [0,2,0,0,0,0|2,0,0]=4 5942 B13R1.398 CCN\C(=N\C#N)c1ccccc1 Amb26575416 [0,2,0,0,0,0|2,0,0]=4 5943 B13R1.398 CCOC(CCCl)c1ccccc1 Amb24093905 [0,2,0,0,0,0|1,0,1]=4 5944 B13R1.398 CCOC(CNC)c1ccccc1 Amb17605900 [0,2,0,0,0,0|1,0,1]=4 5945 B13R1.398 CCOC(OCC)c1ccccc1 Amb10561865 [0,2,0,0,0,0|0,0,2]=4 5946 B13R1.398 CCOP(OCC)c1ccccc1 Amb4297360 [0,2,0,0,0,0|1,0,1]=4 5947 B13R1.398 CC\C=C(\N=C=O)c1ccccc1 Amb27864538 [0,2,0,0,0,0|1,0,0]=3 5948 B13R1.398 CC\N=C(\NCC)c1ccccc1 Amb27482585 [0,2,0,0,0,0|2,0,0]=4 5949 B13R1.398 C\C=C\C(=C/C=O)c1ccccc1 Amb27440033 [0,2,0,0,0,0|1,0,1]=4 5950 B13R1.402 CCCC(C)(C=O)c1ccccc1 Amb33503697 [0,2,0,0,0,0|1,0,1]=4 5951 B13R1.402 CCOC(C)(CBr)c1ccccc1 Amb32710258 [0,2,0,0,0,0|1,0,1]=4 5952 B13R1.402 CCOC(C)(CI)c1ccccc1 Amb33348660 [0,2,0,0,0,0|1,0,1]=4 5953 B13R1.405 CCCC(C(=O)O)c1ccccc1 Amb374793 [0,2,0,0,0,0|1,0,1]=4 5954 B13R1.405 CCNC(C(=O)O)c1ccccc1 Amb28600297 [0,2,0,0,0,0|1,0,1]=4 5955 B13R1.405 CCNC(C(N)=O)c1ccccc1 Amb17335239 [0,2,0,0,0,0|1,0,1]=4 5956 B13R1.405 CCN[C@@H](C(=O)O)c1ccccc1 Amb33347495 [0,2,0,0,0,0|1,0,1]=4 5957 B13R1.405 CCN[C@H](C(=O)O)c1ccccc1 Amb33347477 [0,2,0,0,0,0|1,0,1]=4 5958 B13R1.405 CCOC(C(=O)O)c1ccccc1 Amb6278785 [0,2,0,0,0,0|0,0,1]=3 5959 B13R1.405 CN=C=C(C(N)=O)c1ccccc1 Amb27858707 [0,2,0,0,0,0|2,0,0]=4 5960 B13R1.405 CO\C=C(\C(C)=O)c1ccccc1 Amb26041309 [0,2,0,0,0,0|2,0,0]=4 5961 B13R1.405 CO\N=C(\C(N)=O)c1ccccc1 Amb28071289 [0,2,0,0,0,0|2,0,0]=4 5962 B13R1.532 C=C=C(C(=O)CC)c1ccccc1 Amb27461623 [0,2,0,0,0,0|2,0,0]=4 5963 B13R1.532 CC\C(C)=C(/C=O)c1ccccc1 Amb27166148 [0,2,0,0,0,0|1,0,0]=3 5964 B13R1.532 CC\C(C)=C(\C=O)c1ccccc1 Amb25725942 [0,2,0,0,0,0|1,0,0]=3 5965 B13R1.532 CC\C(Cl)=C(\C=O)c1ccccc1 Amb27608875 [0,2,0,0,0,0|1,0,0]=3 5966 B13R1.532 C\C=C(/c1ccccc1)C(O)CC Amb27405279 [0,2,0,0,0,0|2,0,0]=4 5967 B13R1.532 C\C=C(/c1ccccc1)[C@H](O)CC Amb28455224 [0,2,0,0,0,0|2,0,0]=4 5968 B13R1.532 C\C=C(\C(=O)CC)c1ccccc1 Amb25318877 [0,2,0,0,0,0|2,0,0]=4 5969 B13R1.713 CC(=O)O\C(=C/Cl)c1ccccc1 Amb28061096 [0,2,0,0,0,0|1,0,1]=4 5970 B13R1.713 CC(C)CC(C=O)c1ccccc1 Amb33362241 [0,2,0,0,0,0|1,0,1]=4 5971 B13R1.713 CC(C)N\C(=N\O)c1ccccc1 Amb27790804 [0,2,0,0,0,0|1,0,1]=4 5972 B13R1.713 CC(C)OC(C=O)c1ccccc1 Amb32661039 [0,2,0,0,0,0|0,0,1]=3 5973 B13R1.713 CC(C)OC(CBr)c1ccccc1 Amb32660984 [0,2,0,0,0,0|1,0,1]=4 5974 B13R1.713 CC(C)OC(CI)c1ccccc1 Amb33349129 [0,2,0,0,0,0|1,0,1]=4 5975 B13R1.713 CC(C)OC(CN)c1ccccc1 Amb17605965 [0,2,0,0,0,0|1,0,1]=4 5976 B13R1.713 CC(C)OC(CO)c1ccccc1 Amb28556149 [0,2,0,0,0,0|0,0,2]=4 5977 B13R1.713 CC(C)\C=C(/C#N)c1ccccc1 Amb17232821 [0,2,0,0,0,0|2,0,0]=4 5978 B13R1.713 CC(C)\C=C(/C=O)c1ccccc1 Amb21618696 [0,2,0,0,0,0|1,0,0]=3 5979 B13R1.713 CC(C)\C=C(\C#N)c1ccccc1 Amb27776902 [0,2,0,0,0,0|2,0,0]=4 5980 B13R1.713 CC(O)C\C(=N\O)c1ccccc1 Amb27753088 [0,2,0,0,0,0|1,0,1]=4 5981 B13R1.713 CC\C(=C\C(C)O)c1ccccc1 Amb27443422 [0,2,0,0,0,0|2,0,0]=4 5982 B13R1.713 CC\C(=C\[C@@H](C)O)c1ccccc1 Amb27757403 [0,2,0,0,0,0|2,0,0]=4 5983 B13R1.713 CN(C)\C=C(/C=O)c1ccccc1 Amb17335056 [0,2,0,0,0,0|2,0,0]=4 5984 B13R1.713 CN(C)\C=C(\C=O)c1ccccc1 Amb24712659 [0,2,0,0,0,0|2,0,0]=4 5985 B13R1.713 CN(C)\N=C(\C=O)c1ccccc1 Amb28457462 [0,2,0,0,0,0|2,0,0]=4 5986 B13R1.713 C\C=C(\CC(C)N)c1ccccc1 Amb27607649 [0,2,0,0,0,0|2,0,0]=4 5987 B13R1.17 C#CCCC(=O)c1ccc(C)cc1 Amb18118076 [0,2,0,0,0,0|1,0,1]=4 5988 B13R1.17 C#CCCC(=O)c1ccc(Cl)cc1 Amb18118077 [0,2,0,0,0,0|1,0,1]=4 5989 B13R1.17 C#CCCC(=O)c1ccc(F)cc1 Amb18636117 [0,2,0,0,0,0|1,0,1]=4 5990 B13R1.17 C#CCNC(=O)c1ccc(Br)cc1 Amb6275578 [0,2,0,0,0,0|1,0,1]=4 5991 B13R1.17 C#CCNC(=O)c1ccc(Cl)cc1 Amb8343935 [0,2,0,0,0,0|1,0,1]=4 5992 B13R1.17 C#CCNC(=O)c1ccc(F)cc1 Amb8333170 [0,2,0,0,0,0|1,0,1]=4 5993 B13R1.17 C#CCNC(=O)c1ccc(I)cc1 Amb7854297 [0,2,0,0,0,0|1,0,1]=4 5994 B13R1.17 C#CCOC(=O)c1ccc(Br)nc1 Amb27979208 [0,2,0,0,0,0|1,0,1]=4 5995 B13R1.17 C#CCOC(=O)c1ccc(C)cc1 Amb27769544 [0,2,0,0,0,0|0,0,1]=3 5996 B13R1.17 C#CCOC(=O)c1ccc(Cl)nc1 Amb27595110 [0,2,0,0,0,0|1,0,1]=4 5997 B13R1.17 C#CCOC(=O)c1ccc(N)cc1 Amb24391549 [0,2,0,0,0,0|0,0,1]=3 5998 B13R1.17 C#CCOC(=O)c1ccc(O)cc1 Amb18929622 [0,2,0,0,0,0|0,0,1]=3 5999 B13R1.17 C=CCCC(=O)c1ccc(Br)cc1 Amb34002069 [0,2,0,0,0,0|1,0,1]=4 6000 B13R1.17 C=CCNC(=O)c1ccc(Br)cc1 Amb6426729 [0,2,0,0,0,0|1,0,1]=4 6001 B13R1.17 C=CCNC(=O)c1ccc(C)cc1 Amb2552445 [0,2,0,0,0,0|1,0,1]=4 6002 B13R1.17 C=CCNC(=O)c1ccc(F)cc1 Amb5836150 [0,2,0,0,0,0|1,0,1]=4 6003 B13R1.17 C=CCNC(=O)c1ccc(I)cc1 Amb1770773 [0,2,0,0,0,0|1,0,1]=4 6004 B13R1.17 C=CCNC(=O)c1ccc(N)cc1 Amb6258239 [0,2,0,0,0,0|1,0,1]=4 6005 B13R1.17 C=CCOC(=O)c1ccc(Cl)cc1 Amb24092505 [0,2,0,0,0,0|0,0,1]=3 6006 B13R1.17 C=CCOC(=O)c1ccc(N)cc1 Amb18127835 [0,2,0,0,0,0|0,0,1]=3 6007 B13R1.17 C=CCOC(=O)c1ccc(O)cc1 Amb18128069 [0,2,0,0,0,0|0,0,1]=3 6008 B13R1.17 CC(OCCN)c1ccc(Br)cc1 Amb18071618 [0,2,0,0,0,0|1,0,1]=4 6009 B13R1.17 CC(OCCN)c1ccc(Cl)cc1 Amb17079523 [0,2,0,0,0,0|1,0,1]=4 6010 B13R1.17 CC(OCCN)c1ccc(F)cc1 Amb17079492 [0,2,0,0,0,0|1,0,1]=4 6011 B13R1.17 CC(OCCO)c1ccc(Cl)cc1 Amb32410600 [0,2,0,0,0,0|1,0,1]=4 6012 B13R1.17 CCCCC(=O)c1ccc(Br)cc1 Amb2732106 [0,2,0,0,0,0|1,0,0]=3 6013 B13R1.17 CCCCC(=O)c1ccc(C)cc1 Amb3940682 [0,2,0,0,0,0|1,0,0]=3 6014 B13R1.17 CCCCC(=O)c1ccc(Cl)cc1 Amb2720435 [0,2,0,0,0,0|1,0,0]=3 6015 B13R1.17 CCCCC(=O)c1ccc(F)cc1 Amb1233185 [0,2,0,0,0,0|1,0,0]=3 6016 B13R1.17 CCCCC(=O)c1ccc(N)cc1 Amb17138824 [0,2,0,0,0,0|1,0,0]=3 6017 B13R1.17 CCCCC(=O)c1ccc(O)cc1 Amb3939022 [0,2,0,0,0,0|1,0,0]=3 6018 B13R1.17 CCCNC(=N)c1ccc(Br)cc1 Amb27826768 [0,2,0,0,0,0|2,0,0]=4 6019 B13R1.17 CCCNC(=O)C1=COC(=O)C=C1 Amb27661731 [0,2,0,0,0,0|2,0,0]=4 6020 B13R1.17 CCCNC(=O)c1cc[n+]([O-])cc1 Amb27207653 [0,2,0,0,0,0|2,0,0]=4 6021 B13R1.17 CCCNC(=O)c1ccc(Br)cc1 Amb6342181 [0,2,0,0,0,0|1,0,0]=3 6022 B13R1.17 CCCNC(=O)c1ccc(Br)cn1 Amb10068261 [0,2,0,0,0,0|2,0,0]=4 6023 B13R1.17 CCCNC(=O)c1ccc(Br)nc1 Amb27222518 [0,2,0,0,0,0|2,0,0]=4 6024 B13R1.17 CCCNC(=O)c1ccc(C)cc1 Amb3366999 [0,2,0,0,0,0|1,0,0]=3 6025 B13R1.17 CCCNC(=O)c1ccc(C)nc1 Amb8332931 [0,2,0,0,0,0|2,0,0]=4 6026 B13R1.17 CCCNC(=O)c1ccc(Cl)cc1 Amb6342183 [0,2,0,0,0,0|1,0,0]=3 6027 B13R1.17 CCCNC(=O)c1ccc(Cl)nc1 Amb6244010 [0,2,0,0,0,0|2,0,0]=4 6028 B13R1.17 CCCNC(=O)c1ccc(F)cc1 Amb3357865 [0,2,0,0,0,0|1,0,0]=3 6029 B13R1.17 CCCNC(=O)c1ccc(I)cc1 Amb8574063 [0,2,0,0,0,0|1,0,0]=3 6030 B13R1.17 CCCNC(=O)c1ccc(N)cc1 Amb10627439 [0,2,0,0,0,0|1,0,0]=3 6031 B13R1.17 CCCNC(=O)c1ccc(N)cc1 Amb1112696 [0,2,0,0,0,0|1,0,0]=3 6032 B13R1.17 CCCNC(=O)c1ccc(N)cn1 Amb25744147 [0,2,0,0,0,0|2,0,0]=4 6033 B13R1.17 CCCNC(=O)c1ccc(N)nc1 Amb18295533 [0,2,0,0,0,0|2,0,0]=4 6034 B13R1.17 CCCNC(=O)c1ccc(O)cc1 Amb6434010 [0,2,0,0,0,0|1,0,0]=3 6035 B13R1.17 CCCNS(=O)c1ccc(N)cc1 Amb18864175 [0,2,0,0,0,0|2,0,0]=4 6036 B13R1.17 CCCOC(=O)c1ccc(Cl)cc1 Amb9242870 [0,2,0,0,0,0|0,0,0]=2 6037 B13R1.17 CCCOC(=O)c1ccc(N)cc1 Amb6336510 [0,2,0,0,0,0|0,0,0]=2 6038 B13R1.17 CCCOC(=O)c1ccc(O)cc1 Amb6336478 [0,2,0,0,0,0|0,0,0]=2 6039 B13R1.17 CCCOC(=O)c1ccc([O-])cc1 Amb8387096 [0,2,0,0,0,0|0,0,0]=2 6040 B13R1.17 CCCOC(C)c1ccc(I)cc1 Amb33512233 [0,2,0,0,0,0|1,0,1]=4 6041 B13R1.17 CCNCC(=O)c1ccc(F)cc1 Amb17314099 [0,2,0,0,0,0|1,0,0]=3 6042 B13R1.17 CCNCC(=O)c1ccc(N)cc1 Amb18550894 [0,2,0,0,0,0|1,0,0]=3 6043 B13R1.17 CCONC(=O)C1=CNC(=O)C=C1 Amb27212562 [0,2,0,0,0,0|1,0,0]=3 6044 B13R1.17 CCONC(=O)C1=NNC(=O)C=C1 Amb27465875 [0,2,0,0,0,0|2,0,0]=4 6045 B13R1.17 CCONC(=O)c1ccc(C)cc1 Amb27232306 [0,2,0,0,0,0|0,0,0]=2 6046 B13R1.17 CCONC(=O)c1ccc(F)cc1 Amb28255404 [0,2,0,0,0,0|0,0,0]=2 6047 B13R1.17 CCO\N=C(/C)c1ccc(O)cc1 Amb27749772 [0,2,0,0,0,0|1,0,0]=3 6048 B13R1.17 CCO\N=C(/N)c1ccc(Br)cc1 Amb18227772 [0,2,0,0,0,0|1,0,0]=3 6049 B13R1.17 CCO\N=C(/N)c1ccc(C)cc1 Amb18224608 [0,2,0,0,0,0|1,0,0]=3 6050 B13R1.17 CCO\N=C(/N)c1ccc(Cl)cc1 Amb18225012 [0,2,0,0,0,0|1,0,0]=3 6051 B13R1.17 CCO\N=C(/N)c1ccc(F)cc1 Amb18224739 [0,2,0,0,0,0|1,0,0]=3 6052 B13R1.17 CCO\N=C(\C)c1ccc(Br)cn1 Amb28122137 [0,2,0,0,0,0|2,0,0]=4 6053 B13R1.17 CCO\N=C(\C)c1ccc(C)cc1 Amb27769565 [0,2,0,0,0,0|1,0,0]=3 6054 B13R1.17 CCO\N=C(\C)c1ccc(O)cc1 Amb27589566 [0,2,0,0,0,0|1,0,0]=3 6055 B13R1.17 CCSCC(=O)c1ccc(Br)cc1 Amb9668501 [0,2,0,0,0,0|0,1,0]=3 6056 B13R1.17 CCSCC(=O)c1ccc(C)cc1 Amb9668523 [0,2,0,0,0,0|0,1,0]=3 6057 B13R1.17 CCSCC(=O)c1ccc(Cl)cc1 Amb9668530 [0,2,0,0,0,0|0,1,0]=3 6058 B13R1.17 CCSCC(=O)c1ccc(F)cc1 Amb9668531 [0,2,0,0,0,0|0,1,0]=3 6059 B13R1.17 CCSCC(=O)c1ccc(I)cc1 Amb9668506 [0,2,0,0,0,0|0,1,0]=3 6060 B13R1.17 CCSCC(=O)c1ccc(N)cc1 Amb17202017 [0,2,0,0,0,0|0,1,0]=3 6061 B13R1.17 CCSCC(=O)c1ccc(O)cc1 Amb9668512 [0,2,0,0,0,0|0,1,0]=3 6062 B13R1.17 CC\C=C/C(=O)c1ccc(C)cc1 Amb8391622 [0,2,0,0,0,0|1,0,0]=3 6063 B13R1.17 CC\C=C\C(=O)c1ccc(Br)cc1 Amb25329848 [0,2,0,0,0,0|1,0,0]=3 6064 B13R1.17 CC\C=C\C(=O)c1ccc(F)cc1 Amb27273131 [0,2,0,0,0,0|1,0,0]=3 6065 B13R1.17 CNCCC(=O)c1ccc(Br)cc1 Amb17349007 [0,2,0,0,0,0|1,0,0]=3 6066 B13R1.17 CNCCC(=O)c1ccc(C)cc1 Amb17335181 [0,2,0,0,0,0|1,0,0]=3 6067 B13R1.17 CNCCC(=O)c1ccc(Cl)cc1 Amb17337252 [0,2,0,0,0,0|1,0,0]=3 6068 B13R1.17 CNCCC(=O)c1ccc(F)cc1 Amb17335484 [0,2,0,0,0,0|1,0,0]=3 6069 B13R1.17 CNCCC(=O)c1ccc(F)cc1 Amb23458615 [0,2,0,0,0,0|1,0,0]=3 6070 B13R1.17 CNC\C=C(/C)c1ccc(Br)cc1 Amb31137993 [0,2,0,0,0,0|2,0,0]=4 6071 B13R1.17 CNC\C=C(/C)c1ccc(C)cc1 Amb31174807 [0,2,0,0,0,0|2,0,0]=4 6072 B13R1.17 CNC\C=C(/C)c1ccc(Cl)cc1 Amb31135084 [0,2,0,0,0,0|2,0,0]=4 6073 B13R1.17 CNC\C=C(/C)c1ccc(F)cc1 Amb31174820 [0,2,0,0,0,0|2,0,0]=4 6074 B13R1.17 CNC\C=C(\C)c1ccc(F)cc1 Amb28256760 [0,2,0,0,0,0|2,0,0]=4 6075 B13R1.17 COCCC(=O)c1ccc(C)cc1 Amb17233414 [0,2,0,0,0,0|1,0,0]=3 6076 B13R1.17 COCCC(=O)c1ccc(F)cc1 Amb9659798 [0,2,0,0,0,0|1,0,0]=3 6077 B13R1.17 COCCC(=O)c1ccc(N)cc1 Amb17202007 [0,2,0,0,0,0|1,0,0]=3 6078 B13R1.17 CSCCC(=O)c1ccc(F)cc1 Amb18321922 [0,2,0,0,0,0|1,0,0]=3 6079 B13R1.17 C[n+]1ccc(C(=O)NCCO)cc1 Amb1790779 [0,2,0,0,0,0|2,0,0]=4 6080 B13R1.17 C[n+]1ccc(C(=O)NCCO)cc1 Amb2581657 [0,2,0,0,0,0|2,0,0]=4 6081 B13R1.17 C\C(=C/CCBr)c1ccc(C)cc1 Amb17254612 [0,2,0,0,0,0|2,0,0]=4 6082 B13R1.17 C\C(=C/CCBr)c1ccc(Cl)cc1 Amb17267353 [0,2,0,0,0,0|2,0,0]=4 6083 B13R1.17 C\C(=C/CCBr)c1ccc(F)cc1 Amb17256417 [0,2,0,0,0,0|2,0,0]=4 6084 B13R1.17 C\C(=C/CCCl)c1ccc(Br)cc1 Amb17267355 [0,2,0,0,0,0|2,0,0]=4 6085 B13R1.17 C\C(=C/CCCl)c1ccc(C)cc1 Amb17236136 [0,2,0,0,0,0|2,0,0]=4 6086 B13R1.17 C\C(=C/CCCl)c1ccc(Cl)cc1 Amb17241874 [0,2,0,0,0,0|2,0,0]=4 6087 B13R1.17 C\C(=C/CCCl)c1ccc(F)cc1 Amb17236847 [0,2,0,0,0,0|2,0,0]=4 6088 B13R1.17 C\C(=C/CCN)c1ccc(Br)cc1 Amb17255080 [0,2,0,0,0,0|2,0,0]=4 6089 B13R1.17 C\C(=C/CCN)c1ccc(C)cc1 Amb17233136 [0,2,0,0,0,0|2,0,0]=4 6090 B13R1.17 C\C(=C/CCN)c1ccc(Cl)cc1 Amb17236337 [0,2,0,0,0,0|2,0,0]=4 6091 B13R1.17 C\C(=C/CCN)c1ccc(F)cc1 Amb17233548 [0,2,0,0,0,0|2,0,0]=4 6092 B13R1.17 C\C(=C\CCBr)c1ccc(Br)cc1 Amb29880785 [0,2,0,0,0,0|2,0,0]=4 6093 B13R1.17 C\C(=C\CCCl)c1ccc(Br)cc1 Amb27776905 [0,2,0,0,0,0|2,0,0]=4 6094 B13R1.17 C\C(=C\CCCl)c1ccc(F)cc1 Amb27415953 [0,2,0,0,0,0|2,0,0]=4 6095 B13R1.17 C\C=N\NC(=O)c1ccc(Cl)cc1 Amb1675058 [0,2,0,0,0,0|1,0,1]=4 6096 B13R1.17 Cc1ccc(C(=O)CCC#N)cc1 Amb2436500 [0,2,0,0,0,0|1,0,1]=4 6097 B13R1.17 Cc1ccc(C(=O)CCCBr)cc1 Amb17255484 [0,2,0,0,0,0|1,0,0]=3 6098 B13R1.17 Cc1ccc(C(=O)CCCCl)cc1 Amb2720467 [0,2,0,0,0,0|1,0,0]=3 6099 B13R1.17 Cc1ccc(C(=O)CCCN)cc1 Amb18623672 [0,2,0,0,0,0|1,0,0]=3 6100 B13R1.17 Cc1ccc(C(=O)CCCN)cn1 Amb18824862 [0,2,0,0,0,0|2,0,0]=4 6101 B13R1.17 Cc1ccc(C(=O)CCCO)cc1 Amb17335232 [0,2,0,0,0,0|1,0,0]=3 6102 B13R1.17 Cc1ccc(C(=O)NCC#N)cc1 Amb1632834 [0,2,0,0,0,0|1,0,1]=4 6103 B13R1.17 Cc1ccc(C(=O)NCC=O)cc1 Amb17102068 [0,2,0,0,0,0|1,0,1]=4 6104 B13R1.17 Cc1ccc(C(=O)NCCCl)cc1 Amb3429418 [0,2,0,0,0,0|1,0,0]=3 6105 B13R1.17 Cc1ccc(C(=O)NCCCl)cn1 Amb18316690 [0,2,0,0,0,0|2,0,0]=4 6106 B13R1.17 Cc1ccc(C(=O)NCCF)cc1 Amb27769505 [0,2,0,0,0,0|1,0,0]=3 6107 B13R1.17 Cc1ccc(C(=O)NCCI)cc1 Amb28456799 [0,2,0,0,0,0|1,0,0]=3 6108 B13R1.17 Cc1ccc(C(=O)NCCN)cc1 Amb1130582 [0,2,0,0,0,0|1,0,0]=3 6109 B13R1.17 Cc1ccc(C(=O)NCCN)cc1 Amb19514976 [0,2,0,0,0,0|1,0,0]=3 6110 B13R1.17 Cc1ccc(C(=O)NCCN)cn1 Amb1138112 [0,2,0,0,0,0|2,0,0]=4 6111 B13R1.17 Cc1ccc(C(=O)NCCO)cc1 Amb2757617 [0,2,0,0,0,0|1,0,0]=3 6112 B13R1.17 Cc1ccc(C(=O)OCC#N)nc1 Amb27255161 [0,2,0,0,0,0|1,0,1]=4 6113 B13R1.17 Cc1ccc(C(=O)OCCO)cc1 Amb34105350 [0,2,0,0,0,0|0,0,0]=2 6114 B13R1.17 Cc1ccc(C(=S)NCCO)cc1 Amb1091835 [0,2,0,0,0,0|1,1,0]=4 6115 B13R1.17 Cc1ccc(C(C)OCCN)cc1 Amb17079448 [0,2,0,0,0,0|1,0,1]=4 6116 B13R1.17 Cc1ccc(\C(Cl)=C\CCCl)cc1 Amb27205732 [0,2,0,0,0,0|2,0,0]=4 6117 B13R1.17 N#CCCC(=O)c1ccc(Br)cc1 Amb3941062 [0,2,0,0,0,0|1,0,1]=4 6118 B13R1.17 N#CCCC(=O)c1ccc(Cl)cc1 Amb2433159 [0,2,0,0,0,0|1,0,1]=4 6119 B13R1.17 N#CCCC(=O)c1ccc(I)cc1 Amb28241009 [0,2,0,0,0,0|1,0,1]=4 6120 B13R1.17 N#CCNC(=O)c1ccc(Br)cc1 Amb6347170 [0,2,0,0,0,0|1,0,1]=4 6121 B13R1.17 N#CCNC(=O)c1ccc(Cl)cc1 Amb6347182 [0,2,0,0,0,0|1,0,1]=4 6122 B13R1.17 N#CCNC(=O)c1ccc(F)cc1 Amb6347633 [0,2,0,0,0,0|1,0,1]=4 6123 B13R1.17 N#CCNC(=O)c1ccc(O)cc1 Amb18180565 [0,2,0,0,0,0|1,0,1]=4 6124 B13R1.17 N#CCOC(=O)c1cc[n+]([O-])cc1 Amb28369608 [0,2,0,0,0,0|1,0,1]=4 6125 B13R1.17 N#CCOC(=O)c1ccc(Br)cn1 Amb27956350 [0,2,0,0,0,0|1,0,1]=4 6126 B13R1.17 N#CCOC(=O)c1ccc(Cl)cn1 Amb28253183 [0,2,0,0,0,0|1,0,1]=4 6127 B13R1.17 N#CCOC(=O)c1ccc(F)cc1 Amb28183933 [0,2,0,0,0,0|0,0,1]=3 6128 B13R1.17 N#CCOC(=O)c1ccc(I)cc1 Amb4626695 [0,2,0,0,0,0|0,0,1]=3 6129 B13R1.17 NCCCC(=O)c1ccc(Br)cc1 Amb18105772 [0,2,0,0,0,0|1,0,0]=3 6130 B13R1.17 NCCCC(=O)c1ccc(Cl)cc1 Amb18105773 [0,2,0,0,0,0|1,0,0]=3 6131 B13R1.17 NCCCC(=O)c1ccc(F)cc1 Amb18105774 [0,2,0,0,0,0|1,0,0]=3 6132 B13R1.17 NCCNC(=O)c1ccc(Br)cc1 Amb1138758 [0,2,0,0,0,0|1,0,0]=3 6133 B13R1.17 NCCNC(=O)c1ccc(Br)cn1 Amb19000785 [0,2,0,0,0,0|2,0,0]=4 6134 B13R1.17 NCCNC(=O)c1ccc(Br)cn1 Amb28555905 [0,2,0,0,0,0|2,0,0]=4 6135 B13R1.17 NCCNC(=O)c1ccc(Br)nc1 Amb27397995 [0,2,0,0,0,0|2,0,0]=4 6136 B13R1.17 NCCNC(=O)c1ccc(Cl)cc1 Amb1136020 [0,2,0,0,0,0|1,0,0]=3 6137 B13R1.17 NCCNC(=O)c1ccc(Cl)cc1 Amb318176 [0,2,0,0,0,0|1,0,0]=3 6138 B13R1.17 NCCNC(=O)c1ccc(Cl)cn1 Amb22265049 [0,2,0,0,0,0|2,0,0]=4 6139 B13R1.17 NCCNC(=O)c1ccc(Cl)cn1 Amb22370035 [0,2,0,0,0,0|2,0,0]=4 6140 B13R1.17 NCCNC(=O)c1ccc(F)cc1 Amb1126919 [0,2,0,0,0,0|1,0,0]=3 6141 B13R1.17 NCCNC(=O)c1ccc(F)cc1 Amb19373529 [0,2,0,0,0,0|1,0,0]=3 6142 B13R1.17 NCCNC(=O)c1ccc(F)nc1 Amb27482265 [0,2,0,0,0,0|2,0,0]=4 6143 B13R1.17 NCCNC(=O)c1ccc(I)cc1 Amb33379021 [0,2,0,0,0,0|1,0,0]=3 6144 B13R1.17 NCCNC(=O)c1ccc(I)cc1 Amb9208205 [0,2,0,0,0,0|1,0,0]=3 6145 B13R1.17 NCCNC(=O)c1ccc(N)cc1 Amb18290747 [0,2,0,0,0,0|1,0,0]=3 6146 B13R1.17 NCCNC(=O)c1ccc(N)nc1 Amb25898366 [0,2,0,0,0,0|2,0,0]=4 6147 B13R1.17 NCCNC(=O)c1ccc(O)cc1 Amb6245910 [0,2,0,0,0,0|1,0,0]=3 6148 B13R1.17 NCCNC(=O)c1ccc(S)cc1 Amb27775740 [0,2,0,0,0,0|1,0,0]=3 6149 B13R1.17 Nc1ccc(C(=O)CCCCl)cc1 Amb17202013 [0,2,0,0,0,0|1,0,0]=3 6150 B13R1.17 Nc1ccc(C(=O)NCCO)cc1 Amb6875088 [0,2,0,0,0,0|1,0,0]=3 6151 B13R1.17 Nc1ccc(C(=O)NCCO)cn1 Amb32641729 [0,2,0,0,0,0|2,0,0]=4 6152 B13R1.17 Nc1ccc(C(=O)NCCO)nc1 Amb27865324 [0,2,0,0,0,0|2,0,0]=4 6153 B13R1.17 O=C(CCCBr)c1ccc(Cl)cc1 Amb17268805 [0,2,0,0,0,0|1,0,0]=3 6154 B13R1.17 O=C(CCCBr)c1ccc(F)cc1 Amb17257478 [0,2,0,0,0,0|1,0,0]=3 6155 B13R1.17 O=C(CCCCl)c1ccc(Br)cc1 Amb6364995 [0,2,0,0,0,0|1,0,0]=3 6156 B13R1.17 O=C(CCCCl)c1ccc(Cl)cc1 Amb4008510 [0,2,0,0,0,0|1,0,0]=3 6157 B13R1.17 O=C(CCCCl)c1ccc(F)cc1 Amb2720115 [0,2,0,0,0,0|1,0,0]=3 6158 B13R1.17 O=C(CCCCl)c1ccc(O)cc1 Amb6366849 [0,2,0,0,0,0|1,0,0]=3 6159 B13R1.17 O=C(CCCO)c1ccc(Br)cc1 Amb17349306 [0,2,0,0,0,0|1,0,0]=3 6160 B13R1.17 O=C(CCCO)c1ccc(Cl)cc1 Amb17337360 [0,2,0,0,0,0|1,0,0]=3 6161 B13R1.17 O=C(CCCO)c1ccc(F)cc1 Amb1110902 [0,2,0,0,0,0|1,0,0]=3 6162 B13R1.17 O=C(NCCBr)c1ccc(Br)cc1 Amb4311467 [0,2,0,0,0,0|1,0,0]=3 6163 B13R1.17 O=C(NCCBr)c1ccc(Cl)cn1 Amb27450964 [0,2,0,0,0,0|2,0,0]=4 6164 B13R1.17 O=C(NCCBr)c1ccc(F)cc1 Amb4311498 [0,2,0,0,0,0|1,0,0]=3 6165 B13R1.17 O=C(NCCCl)c1ccc(Br)cc1 Amb17103206 [0,2,0,0,0,0|1,0,0]=3 6166 B13R1.17 O=C(NCCCl)c1ccc(Cl)cc1 Amb17103234 [0,2,0,0,0,0|1,0,0]=3 6167 B13R1.17 O=C(NCCCl)c1ccc(F)cc1 Amb17103203 [0,2,0,0,0,0|1,0,0]=3 6168 B13R1.17 O=C(NCCCl)c1ccc(O)cc1 Amb27171794 [0,2,0,0,0,0|1,0,0]=3 6169 B13R1.17 O=C(NCCF)c1ccc(Cl)cc1 Amb27588319 [0,2,0,0,0,0|1,0,0]=3 6170 B13R1.17 O=C(NCCF)c1ccc(Cl)cn1 Amb28189908 [0,2,0,0,0,0|2,0,0]=4 6171 B13R1.17 O=C(NCCF)c1ccc(S)cc1 Amb27769031 [0,2,0,0,0,0|1,0,0]=3 6172 B13R1.17 O=C(NCCI)c1ccc(Cl)cn1 Amb27664422 [0,2,0,0,0,0|2,0,0]=4 6173 B13R1.17 O=C(NCCO)c1ccc(Br)cc1 Amb5559240 [0,2,0,0,0,0|1,0,0]=3 6174 B13R1.17 O=C(NCCO)c1ccc(Br)cn1 Amb19356851 [0,2,0,0,0,0|2,0,0]=4 6175 B13R1.17 O=C(NCCO)c1ccc(Cl)cc1 Amb2228542 [0,2,0,0,0,0|1,0,0]=3 6176 B13R1.17 O=C(NCCO)c1ccc(F)cc1 Amb5798911 [0,2,0,0,0,0|1,0,0]=3 6177 B13R1.17 O=C(NCCO)c1ccc(I)cc1 Amb8573905 [0,2,0,0,0,0|1,0,0]=3 6178 B13R1.17 O=C(NCCO)c1ccc(O)cc1 Amb4318081 [0,2,0,0,0,0|1,0,0]=3 6179 B13R1.17 O=C(NCCS)c1ccc(Cl)cc1 Amb25818259 [0,2,0,0,0,0|1,0,0]=3 6180 B13R1.17 O=C(OCCO)c1ccc(O)cc1 Amb18128983 [0,2,0,0,0,0|0,0,0]=2 6181 B13R1.17 O=C(\C=C\CO)c1ccc(Cl)cc1 Amb28064138 [0,2,0,0,0,0|1,0,1]=4 6182 B13R1.17 O=C1C=CC(C(=O)NCCBr)=CN1 Amb27976854 [0,2,0,0,0,0|2,0,0]=4 6183 B13R1.17 O=CCNC(=O)c1ccc(Br)cc1 Amb17102074 [0,2,0,0,0,0|1,0,1]=4 6184 B13R1.17 O=CCNC(=O)c1ccc(Cl)cc1 Amb17102105 [0,2,0,0,0,0|1,0,1]=4 6185 B13R1.17 O=CCNC(=O)c1ccc(F)cc1 Amb17102071 [0,2,0,0,0,0|1,0,1]=4 6186 B13R1.17 O=COCC(=O)c1ccc(Br)cc1 Amb3583915 [0,2,0,0,0,0|1,0,1]=4 6187 B13R1.17 OCCNC(=S)c1ccc(Br)cc1 Amb22356238 [0,2,0,0,0,0|1,1,0]=4 6188 B13R1.21 C=C(CO)C(=O)c1ccc(F)cc1 Amb27484797 [0,2,0,0,0,0|2,0,0]=4 6189 B13R1.21 CC(CCl)C(=O)c1ccc(Cl)cc1 Amb27787749 [0,2,0,0,0,0|2,0,0]=4 6190 B13R1.21 CC(CN)C(=O)c1ccc(Br)cc1 Amb18156173 [0,2,0,0,0,0|2,0,0]=4 6191 B13R1.21 CC(CO)C(=O)c1ccc(Br)cc1 Amb26058136 [0,2,0,0,0,0|2,0,0]=4 6192 B13R1.21 CC(CO)C(=O)c1ccc(Cl)cc1 Amb27451604 [0,2,0,0,0,0|2,0,0]=4 6193 B13R1.21 CC(CO)C(=O)c1ccc(O)cc1 Amb2612093 [0,2,0,0,0,0|2,0,0]=4 6194 B13R1.21 CCC(=O)C(=O)c1ccc(Br)cc1 Amb17410342 [0,2,0,0,0,0|1,0,0]=3 6195 B13R1.21 CCC(=O)C(=O)c1ccc(C)cc1 Amb17400549 [0,2,0,0,0,0|1,0,0]=3 6196 B13R1.21 CCC(=O)C(=O)c1ccc(Cl)cc1 Amb17402166 [0,2,0,0,0,0|1,0,0]=3 6197 B13R1.21 CCC(=O)C(=O)c1ccc(F)cc1 Amb17400753 [0,2,0,0,0,0|1,0,0]=3 6198 B13R1.21 CCC(Br)C(=O)c1ccc(C)cc1 Amb17437802 [0,2,0,0,0,0|1,0,0]=3 6199 B13R1.21 CCC(Br)C(=O)c1ccc(Cl)cc1 Amb17437808 [0,2,0,0,0,0|1,0,0]=3 6200 B13R1.21 CCC(Br)C(=O)c1ccc(F)cc1 Amb17437809 [0,2,0,0,0,0|1,0,0]=3 6201 B13R1.21 CCC(Br)C(=O)c1ccc(I)cc1 Amb27966591 [0,2,0,0,0,0|1,0,0]=3 6202 B13R1.21 CCC(Br)C(=O)c1ccc(O)cc1 Amb26515526 [0,2,0,0,0,0|1,0,0]=3 6203 B13R1.21 CCC(C)C(=O)c1ccc(Br)cc1 Amb8850512 [0,2,0,0,0,0|1,0,0]=3 6204 B13R1.21 CCC(C)C(=O)c1ccc(Br)cn1 Amb27656481 [0,2,0,0,0,0|2,0,0]=4 6205 B13R1.21 CCC(C)C(=O)c1ccc(C)cc1 Amb9214341 [0,2,0,0,0,0|1,0,0]=3 6206 B13R1.21 CCC(C)C(=O)c1ccc(C)cn1 Amb27845260 [0,2,0,0,0,0|2,0,0]=4 6207 B13R1.21 CCC(C)C(=O)c1ccc(C)nc1 Amb27626464 [0,2,0,0,0,0|2,0,0]=4 6208 B13R1.21 CCC(C)C(=O)c1ccc(Cl)cn1 Amb27416219 [0,2,0,0,0,0|2,0,0]=4 6209 B13R1.21 CCC(C)C(=O)c1ccc(Cl)nc1 Amb27609457 [0,2,0,0,0,0|2,0,0]=4 6210 B13R1.21 CCC(C)C(=O)c1ccc(F)cn1 Amb27618081 [0,2,0,0,0,0|2,0,0]=4 6211 B13R1.21 CCC(C)C(=O)c1ccc(N)cc1 Amb28316490 [0,2,0,0,0,0|1,0,0]=3 6212 B13R1.21 CCC(Cl)C(=O)c1ccc(Br)cc1 Amb18049316 [0,2,0,0,0,0|1,0,0]=3 6213 B13R1.21 CCC(Cl)C(=O)c1ccc(C)cc1 Amb18048914 [0,2,0,0,0,0|1,0,0]=3 6214 B13R1.21 CCC(Cl)C(=O)c1ccc(Cl)cc1 Amb18049317 [0,2,0,0,0,0|1,0,0]=3 6215 B13R1.21 CCC(Cl)C(=O)c1ccc(F)cc1 Amb18049089 [0,2,0,0,0,0|1,0,0]=3 6216 B13R1.21 CCC(N)C(=O)c1ccc(Br)cc1 Amb17159231 [0,2,0,0,0,0|1,0,0]=3 6217 B13R1.21 CCC(N)C(=O)c1ccc(C)cc1 Amb17138820 [0,2,0,0,0,0|1,0,0]=3 6218 B13R1.21 CCC(N)C(=O)c1ccc(Cl)cc1 Amb9690153 [0,2,0,0,0,0|1,0,0]=3 6219 B13R1.21 CCC(N)C(=O)c1ccc(F)cc1 Amb16765989 [0,2,0,0,0,0|1,0,0]=3 6220 B13R1.21 CCC(O)C(=O)c1ccc(Br)cc1 Amb35591591 [0,2,0,0,0,0|1,0,0]=3 6221 B13R1.21 CCC(O)C(=O)c1ccc(F)cc1 Amb27596477 [0,2,0,0,0,0|1,0,0]=3 6222 B13R1.21 CCN(C)C(=O)c1ccc(C)cn1 Amb28051154 [0,2,0,0,0,0|2,0,0]=4 6223 B13R1.21 CCN(C)C(=O)c1ccc(Cl)nc1 Amb8873941 [0,2,0,0,0,0|2,0,0]=4 6224 B13R1.21 CCN(C)C(=O)c1ccc(F)cn1 Amb27457301 [0,2,0,0,0,0|2,0,0]=4 6225 B13R1.21 CCN(C)C(=O)c1ccc(N)cc1 Amb8890261 [0,2,0,0,0,0|1,0,0]=3 6226 B13R1.21 CCN(N)C(=O)c1ccc(F)cc1 Amb28060932 [0,2,0,0,0,0|1,0,0]=3 6227 B13R1.21 CCN(O)C(=O)C1=CNC(=O)C=C1 Amb27253417 [0,2,0,0,0,0|2,0,0]=4 6228 B13R1.21 CCN(O)C(=O)c1ccc(Br)cn1 Amb28195488 [0,2,0,0,0,0|2,0,0]=4 6229 B13R1.21 CCN(O)C(=O)c1ccc(F)nc1 Amb27216385 [0,2,0,0,0,0|2,0,0]=4 6230 B13R1.21 CCN(O)C(=O)c1ccc(I)cc1 Amb27205332 [0,2,0,0,0,0|1,0,0]=3 6231 B13R1.21 CCN(O)C(=O)c1ccc(N)cc1 Amb27882034 [0,2,0,0,0,0|1,0,0]=3 6232 B13R1.21 CCN(O)C(=O)c1ccc(N)cn1 Amb28345858 [0,2,0,0,0,0|2,0,0]=4 6233 B13R1.21 CC[C@@H](C)C(=O)c1ccc(N)cc1 Amb27251532 [0,2,0,0,0,0|1,0,0]=3 6234 B13R1.21 CC[C@@H](N)C(=O)c1ccc(Br)cc1 Amb35659396 [0,2,0,0,0,0|1,0,0]=3 6235 B13R1.21 CC[C@@H](N)C(=O)c1ccc(C)cc1 Amb30024579 [0,2,0,0,0,0|1,0,0]=3 6236 B13R1.21 CC[C@@H](N)C(=O)c1ccc(C)nc1 Amb30024584 [0,2,0,0,0,0|2,0,0]=4 6237 B13R1.21 CC[C@@H](N)C(=O)c1ccc(Cl)cc1 Amb35602686 [0,2,0,0,0,0|1,0,0]=3 6238 B13R1.21 CC[C@@H](N)C(=O)c1ccc(F)cc1 Amb30024589 [0,2,0,0,0,0|1,0,0]=3 6239 B13R1.21 CC[C@H](N)C(=O)c1ccc(Br)cc1 Amb35601335 [0,2,0,0,0,0|1,0,0]=3 6240 B13R1.21 CC[C@H](N)C(=O)c1ccc(C)cc1 Amb35599743 [0,2,0,0,0,0|1,0,0]=3 6241 B13R1.21 CC[C@H](N)C(=O)c1ccc(C)nc1 Amb35600741 [0,2,0,0,0,0|2,0,0]=4 6242 B13R1.21 CC[C@H](N)C(=O)c1ccc(Cl)cc1 Amb35659359 [0,2,0,0,0,0|1,0,0]=3 6243 B13R1.21 CC[C@H](N)C(=O)c1ccc(F)cc1 Amb35600745 [0,2,0,0,0,0|1,0,0]=3 6244 B13R1.21 CN(CO)C(=O)c1ccc(Cl)cc1 Amb27484811 [0,2,0,0,0,0|2,0,0]=4 6245 B13R1.21 CNC(=O)C(=O)c1ccc(Br)cc1 Amb17349001 [0,2,0,0,0,0|2,0,0]=4 6246 B13R1.21 CNC(=O)C(=O)c1ccc(C)cc1 Amb17335167 [0,2,0,0,0,0|2,0,0]=4 6247 B13R1.21 CNC(=O)C(=O)c1ccc(Cl)cc1 Amb17337245 [0,2,0,0,0,0|2,0,0]=4 6248 B13R1.21 CNC(=O)C(=O)c1ccc(F)cc1 Amb17335466 [0,2,0,0,0,0|2,0,0]=4 6249 B13R1.21 CNC(C)C(=O)c1ccc(Br)cc1 Amb17312906 [0,2,0,0,0,0|2,0,0]=4 6250 B13R1.21 CNC(C)C(=O)c1ccc(C)cc1 Amb18540236 [0,2,0,0,0,0|2,0,0]=4 6251 B13R1.21 CNC(C)C(=O)c1ccc(Cl)cc1 Amb17312952 [0,2,0,0,0,0|2,0,0]=4 6252 B13R1.21 CNC(C)C(=O)c1ccc(F)cc1 Amb17313013 [0,2,0,0,0,0|2,0,0]=4 6253 B13R1.21 CNC(C)C(=O)c1ccc(N)cc1 Amb18051421 [0,2,0,0,0,0|2,0,0]=4 6254 B13R1.21 CNC(C)C(=O)c1ccc(O)cc1 Amb27239640 [0,2,0,0,0,0|2,0,0]=4 6255 B13R1.21 CN[C@@H](C)C(=O)c1ccc(Br)cc1 Amb35662339 [0,2,0,0,0,0|2,0,0]=4 6256 B13R1.21 CN[C@@H](C)C(=O)c1ccc(C)cc1 Amb35659958 [0,2,0,0,0,0|2,0,0]=4 6257 B13R1.21 CN[C@@H](C)C(=O)c1ccc(Cl)cc1 Amb29891463 [0,2,0,0,0,0|2,0,0]=4 6258 B13R1.21 CN[C@@H](C)C(=O)c1ccc(F)cc1 Amb35659967 [0,2,0,0,0,0|2,0,0]=4 6259 B13R1.21 COC(=O)C(=O)c1ccc(Br)cc1 Amb17349298 [0,2,0,0,0,0|2,0,0]=4 6260 B13R1.21 COC(=O)C(=O)c1ccc(C)cc1 Amb17335210 [0,2,0,0,0,0|2,0,0]=4 6261 B13R1.21 COC(=O)C(=O)c1ccc(Cl)cc1 Amb10562341 [0,2,0,0,0,0|2,0,0]=4 6262 B13R1.21 COC(=O)C(=O)c1ccc(F)cc1 Amb17335522 [0,2,0,0,0,0|2,0,0]=4 6263 B13R1.21 COC(=O)C(=O)c1ccc(N)cc1 Amb25897257 [0,2,0,0,0,0|2,0,0]=4 6264 B13R1.21 COC(=O)C(=O)c1ccc(O)cc1 Amb18128547 [0,2,0,0,0,0|2,0,0]=4 6265 B13R1.21 COC(C)C(=O)c1ccc(Cl)cc1 Amb9665988 [0,2,0,0,0,0|2,0,0]=4 6266 B13R1.21 COC(O)C(=O)c1ccc(F)cc1 Amb27197994 [0,2,0,0,0,0|2,0,0]=4 6267 B13R1.21 CON(C)C(=O)c1ccc(Br)cc1 Amb8387472 [0,2,0,0,0,0|2,0,0]=4 6268 B13R1.21 CON(C)C(=O)c1ccc(C)cc1 Amb8387598 [0,2,0,0,0,0|2,0,0]=4 6269 B13R1.21 CON(C)C(=O)c1ccc(Cl)cc1 Amb8387495 [0,2,0,0,0,0|2,0,0]=4 6270 B13R1.21 CON(C)C(=O)c1ccc(F)cc1 Amb8387611 [0,2,0,0,0,0|2,0,0]=4 6271 B13R1.21 CON(C)C(=O)c1ccc(I)cc1 Amb19888546 [0,2,0,0,0,0|2,0,0]=4 6272 B13R1.21 CON(C)C(=O)c1ccc(N)cc1 Amb9492077 [0,2,0,0,0,0|2,0,0]=4 6273 B13R1.21 CON(C)C(=O)c1ccc(O)cc1 Amb8388104 [0,2,0,0,0,0|2,0,0]=4 6274 B13R1.21 CSC(C)C(=O)c1ccc(Br)cc1 Amb24356936 [0,2,0,0,0,0|2,0,0]=4 6275 B13R1.21 CSC(C)C(=O)c1ccc(C)cc1 Amb18321261 [0,2,0,0,0,0|2,0,0]=4 6276 B13R1.21 CSC(C)C(=O)c1ccc(Cl)cc1 Amb26994193 [0,2,0,0,0,0|2,0,0]=4 6277 B13R1.21 CSC(C)C(=O)c1ccc(F)cc1 Amb19055166 [0,2,0,0,0,0|2,0,0]=4 6278 B13R1.21 C\C=C(/C)C(=O)c1ccc(C)cc1 Amb28122474 [0,2,0,0,0,0|1,0,1]=4 6279 B13R1.21 C\C=C(\O)C(=O)c1ccc(C)cc1 Amb28131964 [0,2,0,0,0,0|1,0,1]=4 6280 B13R1.21 Cc1ccc(C(=O)C(=O)CBr)cc1 Amb17410341 [0,2,0,0,0,0|2,0,0]=4 6281 B13R1.21 Cc1ccc(C(=O)C(Br)CBr)cc1 Amb28132876 [0,2,0,0,0,0|2,0,0]=4 6282 B13R1.21 Cc1ccc(C(=O)C(Br)CCl)cc1 Amb17358595 [0,2,0,0,0,0|2,0,0]=4 6283 B13R1.21 Cc1ccc(C(=O)C(Cl)CCl)cc1 Amb17340710 [0,2,0,0,0,0|2,0,0]=4 6284 B13R1.21 NC(CO)C(=O)c1ccc(Cl)cc1 Amb27430570 [0,2,0,0,0,0|2,0,0]=4 6285 B13R1.21 O=C(CBr)C(=O)c1ccc(Cl)cc1 Amb17416542 [0,2,0,0,0,0|2,0,0]=4 6286 B13R1.21 O=C(CBr)C(=O)c1ccc(F)cc1 Amb17411210 [0,2,0,0,0,0|2,0,0]=4 6287 B13R1.21 O=C(c1ccc(Cl)cc1)C(Cl)CCl Amb17347590 [0,2,0,0,0,0|2,0,0]=4 6288 B13R1.21 O=C(c1ccc(F)cc1)C(Br)CCl Amb17361080 [0,2,0,0,0,0|2,0,0]=4 6289 B13R1.21 O=C(c1ccc(F)cc1)C(Cl)CCl Amb17341867 [0,2,0,0,0,0|2,0,0]=4 6290 B13R1.29 CCCS(=O)(=O)c1ccc(Br)cc1 Amb18065195 [0,2,0,0,0,0|2,0,0]=4 6291 B13R1.29 CCCS(=O)(=O)c1ccc(C)cc1 Amb2614671 [0,2,0,0,0,0|2,0,0]=4 6292 B13R1.29 CCCS(=O)(=O)c1ccc(Cl)cc1 Amb25220282 [0,2,0,0,0,0|2,0,0]=4 6293 B13R1.29 CCCS(=O)(=O)c1ccc(N)cc1 Amb6265649 [0,2,0,0,0,0|2,0,0]=4 6294 B13R1.29 CCN=S(C)(=O)c1ccc(N)cc1 Amb27179246 [0,2,0,0,0,0|2,0,0]=4 6295 B13R1.29 CCNS(=O)(=O)c1ccc(Br)cc1 Amb1570719 [0,2,0,0,0,0|2,0,0]=4 6296 B13R1.29 CCNS(=O)(=O)c1ccc(C)cc1 Amb6572569 [0,2,0,0,0,0|2,0,0]=4 6297 B13R1.29 CCNS(=O)(=O)c1ccc(Cl)cc1 Amb3360410 [0,2,0,0,0,0|2,0,0]=4 6298 B13R1.29 CCNS(=O)(=O)c1ccc(F)cc1 Amb2736031 [0,2,0,0,0,0|2,0,0]=4 6299 B13R1.29 CCNS(=O)(=O)c1ccc(I)cc1 Amb3015449 [0,2,0,0,0,0|2,0,0]=4 6300 B13R1.29 CCNS(=O)(=O)c1ccc(N)cc1 Amb1129488 [0,2,0,0,0,0|2,0,0]=4 6301 B13R1.29 CCOP(=O)(Cl)c1ccc(C)cc1 Amb27664086 [0,2,0,0,0,0|1,0,0]=3 6302 B13R1.29 CCOP(=O)(O)c1ccc(N)cc1 Amb27827362 [0,2,0,0,0,0|1,0,0]=3 6303 B13R1.29 CCOP(C)(=O)c1ccc(N)nc1 Amb28067825 [0,2,0,0,0,0|2,0,0]=4 6304 B13R1.29 CCOS(=O)(=O)c1ccc(C)cc1 Amb2765039 [0,2,0,0,0,0|1,0,0]=3 6305 B13R1.29 CCOS(=O)(=O)c1ccc(N)cc1 Amb8426933 [0,2,0,0,0,0|1,0,0]=3 6306 B13R1.29 CCO[PH](=O)(=O)c1ccc(C)cc1 Amb20246811 [0,2,0,0,0,0|1,0,0]=3 6307 B13R1.29 CNOS(=O)(=O)c1ccc(C)cc1 Amb25353774 [0,2,0,0,0,0|2,0,0]=4 6308 B13R1.29 Cc1ccc(S(=O)(=O)OCCl)cc1 Amb20248148 [0,2,0,0,0,0|2,0,0]=4 6309 B13R1.29 Cc1ccc(S(=O)(=O)OCF)cc1 Amb22737786 [0,2,0,0,0,0|2,0,0]=4 6310 B13R1.132 C=C(C)CC(=O)c1ccc(Br)cc1 Amb18071332 [0,2,0,0,0,0|1,0,1]=4 6311 B13R1.132 C=C(C)CC(=O)c1ccc(C)cc1 Amb18065524 [0,2,0,0,0,0|1,0,1]=4 6312 B13R1.132 C=C(C)CC(=O)c1ccc(Cl)cc1 Amb18066346 [0,2,0,0,0,0|1,0,1]=4 6313 B13R1.132 C=C(C)CC(=O)c1ccc(F)cc1 Amb18065745 [0,2,0,0,0,0|1,0,1]=4 6314 B13R1.132 CC(=O)CC(=O)c1ccc(Br)cc1 Amb433065 [0,2,0,0,0,0|1,0,1]=4 6315 B13R1.132 CC(=O)CC(=O)c1ccc(C)cc1 Amb1209108 [0,2,0,0,0,0|1,0,1]=4 6316 B13R1.132 CC(=O)CC(=O)c1ccc(Cl)cc1 Amb369962 [0,2,0,0,0,0|1,0,1]=4 6317 B13R1.132 CC(=O)CC(=O)c1ccc(F)cc1 Amb379515 [0,2,0,0,0,0|1,0,1]=4 6318 B13R1.132 CC(=O)CC(=O)c1ccc(I)cc1 Amb25040567 [0,2,0,0,0,0|1,0,1]=4 6319 B13R1.132 CC(=O)CC(=O)c1ccc(N)cc1 Amb985049 [0,2,0,0,0,0|1,0,1]=4 6320 B13R1.132 CC(=O)CC(=O)c1ccc(O)cc1 Amb18128073 [0,2,0,0,0,0|1,0,1]=4 6321 B13R1.132 CC(=O)NC(=O)c1ccc(Br)cc1 Amb27445328 [0,2,0,0,0,0|1,0,1]=4 6322 B13R1.132 CC(=O)NC(=O)c1ccc(C)cc1 Amb27268533 [0,2,0,0,0,0|1,0,1]=4 6323 B13R1.132 CC(=O)NC(=O)c1ccc(F)cc1 Amb18178968 [0,2,0,0,0,0|1,0,1]=4 6324 B13R1.132 CC(=O)NC(=O)c1ccc(O)cc1 Amb18128318 [0,2,0,0,0,0|1,0,1]=4 6325 B13R1.132 CC(=S)NC(=O)c1ccc(Cl)cc1 Amb28367114 [0,2,0,0,0,0|1,0,1]=4 6326 B13R1.132 CC(C)=CC(=O)c1ccc(Br)cc1 Amb27231409 [0,2,0,0,0,0|1,0,1]=4 6327 B13R1.132 CC(C)=CC(=O)c1ccc(C)cc1 Amb4019872 [0,2,0,0,0,0|1,0,1]=4 6328 B13R1.132 CC(C)=CC(=O)c1ccc(F)cc1 Amb24567517 [0,2,0,0,0,0|1,0,1]=4 6329 B13R1.132 CC(C)=CC(=O)c1ccc(I)cc1 Amb27206902 [0,2,0,0,0,0|1,0,1]=4 6330 B13R1.132 CC(C)CC(=O)C1=CNC(=S)C=C1 Amb26612063 [0,2,0,0,0,0|2,0,0]=4 6331 B13R1.132 CC(C)CC(=O)c1ccc(Br)cc1 Amb8850519 [0,2,0,0,0,0|1,0,0]=3 6332 B13R1.132 CC(C)CC(=O)c1ccc(Cl)cc1 Amb8850483 [0,2,0,0,0,0|1,0,0]=3 6333 B13R1.132 CC(C)CC(=O)c1ccc(Cl)cn1 Amb27976827 [0,2,0,0,0,0|2,0,0]=4 6334 B13R1.132 CC(C)CC(=O)c1ccc(Cl)nc1 Amb28314808 [0,2,0,0,0,0|2,0,0]=4 6335 B13R1.132 CC(C)CC(=O)c1ccc(F)cc1 Amb8850014 [0,2,0,0,0,0|1,0,0]=3 6336 B13R1.132 CC(C)CC(=O)c1ccc(F)cn1 Amb27403870 [0,2,0,0,0,0|2,0,0]=4 6337 B13R1.132 CC(C)CC(=O)c1ccc(N)cc1 Amb17101638 [0,2,0,0,0,0|1,0,0]=3 6338 B13R1.132 CC(C)CC(=O)c1ccc(O)cc1 Amb17233400 [0,2,0,0,0,0|1,0,0]=3 6339 B13R1.132 CC(C)CS(=O)c1ccc(F)cc1 Amb28456166 [0,2,0,0,0,0|2,0,0]=4 6340 B13R1.132 CC(C)NC(=O)c1cc[n+]([O-])cc1 Amb27588817 [0,2,0,0,0,0|2,0,0]=4 6341 B13R1.132 CC(C)NC(=O)c1ccc(Br)cc1 Amb3360940 [0,2,0,0,0,0|1,0,0]=3 6342 B13R1.132 CC(C)NC(=O)c1ccc(Br)cn1 Amb10068271 [0,2,0,0,0,0|2,0,0]=4 6343 B13R1.132 CC(C)NC(=O)c1ccc(Br)nc1 Amb26467917 [0,2,0,0,0,0|2,0,0]=4 6344 B13R1.132 CC(C)NC(=O)c1ccc(Cl)cc1 Amb1251856 [0,2,0,0,0,0|1,0,0]=3 6345 B13R1.132 CC(C)NC(=O)c1ccc(Cl)nc1 Amb2611979 [0,2,0,0,0,0|2,0,0]=4 6346 B13R1.132 CC(C)NC(=O)c1ccc(F)cc1 Amb6347643 [0,2,0,0,0,0|1,0,0]=3 6347 B13R1.132 CC(C)NC(=O)c1ccc(I)cc1 Amb6417033 [0,2,0,0,0,0|1,0,0]=3 6348 B13R1.132 CC(C)NC(=O)c1ccc(N)cc1 Amb1118876 [0,2,0,0,0,0|1,0,0]=3 6349 B13R1.132 CC(C)NC(=O)c1ccc(N)cc1 Amb32582538 [0,2,0,0,0,0|1,0,0]=3 6350 B13R1.132 CC(C)NC(=O)c1ccc(N)cn1 Amb28399995 [0,2,0,0,0,0|2,0,0]=4 6351 B13R1.132 CC(C)NC(=O)c1ccc(N)nc1 Amb18284688 [0,2,0,0,0,0|2,0,0]=4 6352 B13R1.132 CC(C)NC(=O)c1ccc(O)cc1 Amb6361704 [0,2,0,0,0,0|1,0,0]=3 6353 B13R1.132 CC(C)NC(=O)c1ccc(S)cc1 Amb27652632 [0,2,0,0,0,0|1,0,0]=3 6354 B13R1.132 CC(C)NC(=S)c1ccc(F)cc1 Amb28367171 [0,2,0,0,0,0|1,1,0]=4 6355 B13R1.132 CC(C)NS(=O)c1ccc(N)cc1 Amb18225002 [0,2,0,0,0,0|2,0,0]=4 6356 B13R1.132 CC(C)OC(=O)C1=COC(=O)C=C1 Amb28423985 [0,2,0,0,0,0|1,0,0]=3 6357 B13R1.132 CC(C)OC(=O)C1=NNC(=O)C=C1 Amb26880893 [0,2,0,0,0,0|2,0,0]=4 6358 B13R1.132 CC(C)OC(=O)c1cc[n+](C)cc1 Amb2613634 [0,2,0,0,0,0|1,0,0]=3 6359 B13R1.132 CC(C)OC(=O)c1cc[n+]([O-])cc1 Amb27806284 [0,2,0,0,0,0|1,0,0]=3 6360 B13R1.132 CC(C)OC(=O)c1ccc(Br)cc1 Amb27870600 [0,2,0,0,0,0|0,0,0]=2 6361 B13R1.132 CC(C)OC(=O)c1ccc(Cl)cc1 Amb17509361 [0,2,0,0,0,0|0,0,0]=2 6362 B13R1.132 CC(C)OC(=O)c1ccc(Cl)nc1 Amb22167146 [0,2,0,0,0,0|1,0,0]=3 6363 B13R1.132 CC(C)OC(=O)c1ccc(Cl)nn1 Amb19957705 [0,2,0,0,0,0|2,0,0]=4 6364 B13R1.132 CC(C)OC(=O)c1ccc(F)cc1 Amb17509362 [0,2,0,0,0,0|0,0,0]=2 6365 B13R1.132 CC(C)OC(=O)c1ccc(F)cn1 Amb26971615 [0,2,0,0,0,0|1,0,0]=3 6366 B13R1.132 CC(C)OC(=O)c1ccc(F)nc1 Amb27489656 [0,2,0,0,0,0|1,0,0]=3 6367 B13R1.132 CC(C)OC(=O)c1ccc(I)cc1 Amb27231113 [0,2,0,0,0,0|0,0,0]=2 6368 B13R1.132 CC(C)OC(=O)c1ccc(N)cc1 Amb6335635 [0,2,0,0,0,0|0,0,0]=2 6369 B13R1.132 CC(C)OC(=O)c1ccc(N)nc1 Amb22831621 [0,2,0,0,0,0|1,0,0]=3 6370 B13R1.132 CC(C)OC(=O)c1ccc(O)cc1 Amb2122034 [0,2,0,0,0,0|0,0,0]=2 6371 B13R1.132 CC(C)OC(=O)c1cnc(Cl)cn1 Amb27224596 [0,2,0,0,0,0|2,0,0]=4 6372 B13R1.132 CC(C)OC(C)c1ccc(Br)cc1 Amb23443734 [0,2,0,0,0,0|1,0,1]=4 6373 B13R1.132 CC(C)OC(C)c1ccc(I)cc1 Amb33512231 [0,2,0,0,0,0|1,0,1]=4 6374 B13R1.132 CC(Cl)CC(=O)c1ccc(F)cc1 Amb24669020 [0,2,0,0,0,0|1,0,0]=3 6375 B13R1.132 CC(N)CC(=O)c1ccc(Br)cn1 Amb35702472 [0,2,0,0,0,0|2,0,0]=4 6376 B13R1.132 CC(N)CC(=O)c1ccc(Cl)cc1 Amb27607284 [0,2,0,0,0,0|1,0,0]=3 6377 B13R1.132 CC(N)CC(=O)c1ccc(Cl)cn1 Amb29854056 [0,2,0,0,0,0|2,0,0]=4 6378 B13R1.132 CC(N)CC(=O)c1ccc(F)cc1 Amb20669281 [0,2,0,0,0,0|1,0,0]=3 6379 B13R1.132 CC(N)CC(=O)c1ccc(F)cc1 Amb22059436 [0,2,0,0,0,0|1,0,0]=3 6380 B13R1.132 CC(N)CS(=O)c1ccc(Br)cc1 Amb27667645 [0,2,0,0,0,0|2,0,0]=4 6381 B13R1.132 CC(N)CS(=O)c1ccc(Cl)cc1 Amb27795624 [0,2,0,0,0,0|2,0,0]=4 6382 B13R1.132 CC(N)CS(=O)c1ccc(F)cc1 Amb28186253 [0,2,0,0,0,0|2,0,0]=4 6383 B13R1.132 CC(O)CC(=O)c1ccc(Br)cc1 Amb28190131 [0,2,0,0,0,0|1,0,0]=3 6384 B13R1.132 CC(O)CC(=O)c1ccc(F)cc1 Amb28460709 [0,2,0,0,0,0|1,0,0]=3 6385 B13R1.132 CC(O)CC(=O)c1ccc(O)cc1 Amb4010871 [0,2,0,0,0,0|1,0,0]=3 6386 B13R1.132 CC(O)CS(=O)c1ccc(F)cc1 Amb28046570 [0,2,0,0,0,0|2,0,0]=4 6387 B13R1.132 CC(O)CS(=O)c1ccc(N)cc1 Amb28317482 [0,2,0,0,0,0|2,0,0]=4 6388 B13R1.132 CC(O)NC(=O)c1ccc(N)cc1 Amb33513157 [0,2,0,0,0,0|1,0,0]=3 6389 B13R1.132 CN(C)CC(=O)c1ccc(Br)cc1 Amb9217327 [0,2,0,0,0,0|2,0,0]=4 6390 B13R1.132 CN(C)CC(=O)c1ccc(Cl)cc1 Amb4442842 [0,2,0,0,0,0|2,0,0]=4 6391 B13R1.132 CN(C)CC(=O)c1ccc(F)cc1 Amb9217326 [0,2,0,0,0,0|2,0,0]=4 6392 B13R1.132 CN(C)CC(=O)c1ccc(N)cc1 Amb17090484 [0,2,0,0,0,0|2,0,0]=4 6393 B13R1.132 CN(C)NC(=O)c1ccc(Br)cc1 Amb27165481 [0,2,0,0,0,0|2,0,0]=4 6394 B13R1.132 CS(=O)CC(=O)c1ccc(Br)cc1 Amb28368018 [0,2,0,0,0,0|2,0,0]=4 6395 B13R1.132 C[S+](C)[N-]C(=O)c1ccc(Cl)cc1 Amb2610818 [0,2,0,0,0,0|2,0,0]=4 6396 B13R1.132 C\C(=C\C(C)O)c1ccc(C)cc1 Amb27834437 [0,2,0,0,0,0|2,0,0]=4 6397 B13R1.132 C\C(=C\C(C)O)c1ccc(Cl)cc1 Amb27970634 [0,2,0,0,0,0|2,0,0]=4 6398 B13R1.132 C\C(N)=C\C(=O)c1ccc(Br)cc1 Amb27617894 [0,2,0,0,0,0|1,0,1]=4 6399 B13R1.132 C\C(N)=C\C(=O)c1ccc(C)cc1 Amb25253088 [0,2,0,0,0,0|1,0,1]=4 6400 B13R1.132 C\C(N)=C\C(=O)c1ccc(F)cc1 Amb26880811 [0,2,0,0,0,0|1,0,1]=4 6401 B13R1.132 C\C(O)=C\C(=O)c1ccc(O)cc1 Amb25860094 [0,2,0,0,0,0|1,0,1]=4 6402 B13R1.132 Cc1ccc(C(=O)CC(C)C)cc1 Amb8851005 [0,2,0,0,0,0|1,0,0]=3 6403 B13R1.132 Cc1ccc(C(=O)CC(C)N)cc1 Amb27404635 [0,2,0,0,0,0|1,0,0]=3 6404 B13R1.132 Cc1ccc(C(=O)CC(C)N)cn1 Amb27881457 [0,2,0,0,0,0|2,0,0]=4 6405 B13R1.132 Cc1ccc(C(=O)CN(C)C)cc1 Amb9217338 [0,2,0,0,0,0|2,0,0]=4 6406 B13R1.132 Cc1ccc(C(=O)C[C@@H](C)O)cc1 Amb27205399 [0,2,0,0,0,0|1,0,0]=3 6407 B13R1.132 Cc1ccc(C(=O)NC(C)N)cc1 Amb27789845 [0,2,0,0,0,0|1,0,0]=3 6408 B13R1.132 Cc1ccc(C(=O)OC(C)C)cc1 Amb18940752 [0,2,0,0,0,0|0,0,0]=2 6409 B13R1.132 Cc1ccc(C(=O)[N-][S+](C)C)cc1 Amb2610817 [0,2,0,0,0,0|2,0,0]=4 6410 B13R1.132 Cc1ccc(S(=O)CC(C)N)cc1 Amb27867151 [0,2,0,0,0,0|2,0,0]=4 6411 B13R1.132 Cc1ccc(S(=O)C[C@@H](C)N)cc1 Amb27400693 [0,2,0,0,0,0|2,0,0]=4 6412 B13R1.132 Cc1ccc(S(=O)C[C@@H](C)O)cc1 Amb27752360 [0,2,0,0,0,0|2,0,0]=4 6413 B13R1.132 Cc1ccc(S(=O)C[C@H](C)O)cc1 Amb27617824 [0,2,0,0,0,0|2,0,0]=4 6414 B13R1.132 O=C(CC(F)F)c1ccc(F)cc1 Amb28127637 [0,2,0,0,0,0|2,0,0]=4 6415 B13R1.452 C#Cc1ccc(C(=O)CCN)cc1 Amb32877910 [0,2,0,0,0,0|2,0,0]=4 6416 B13R1.452 C#Cc1ccc(C(=O)CNC)cc1 Amb32877905 [0,2,0,0,0,0|2,0,0]=4 6417 B13R1.452 C#Cc1ccc(C(=O)NCC)cn1 Amb28051390 [0,2,0,0,0,0|2,0,0]=4 6418 B13R1.452 C#Cc1ccc(C(=O)NCC)nc1 Amb27841997 [0,2,0,0,0,0|2,0,0]=4 6419 B13R1.452 C#Cc1ccc(C(=O)OCC)cc1 Amb22411554 [0,2,0,0,0,0|0,0,0]=2 6420 B13R1.452 C#Cc1ccc(C(=O)OCC)nc1 Amb28070781 [0,2,0,0,0,0|1,0,0]=3 6421 B13R1.452 C=C(OCC)c1ccc(C=O)cc1 Amb33136268 [0,2,0,0,0,0|1,0,0]=3 6422 B13R1.452 C=C(OCC)c1ccc(CN)cc1 Amb33136116 [0,2,0,0,0,0|1,0,0]=3 6423 B13R1.452 C=C(OCC)c1ccc(NC)cc1 Amb33136271 [0,2,0,0,0,0|1,0,0]=3 6424 B13R1.452 C=Cc1ccc(C(=O)NCC)nc1 Amb24405066 [0,2,0,0,0,0|2,0,0]=4 6425 B13R1.452 C=Cc1ccc(C(=O)\C=C\C)cc1 Amb27753110 [0,2,0,0,0,0|1,0,1]=4 6426 B13R1.452 CC#CC(=O)c1ccc(C=O)cc1 Amb27762499 [0,2,0,0,0,0|1,0,1]=4 6427 B13R1.452 CCCC(=O)c1ccc(C#N)cc1 Amb17334930 [0,2,0,0,0,0|1,0,0]=3 6428 B13R1.452 CCCC(=O)c1ccc(CC)cc1 Amb8850530 [0,2,0,0,0,0|1,0,0]=3 6429 B13R1.452 CCCC(=O)c1ccc(OC)cc1 Amb2781537 [0,2,0,0,0,0|1,0,0]=3 6430 B13R1.452 CCCC(=O)c1ccc(SC)cc1 Amb17481545 [0,2,0,0,0,0|1,0,0]=3 6431 B13R1.452 CCNC(=N)c1ccc(SC)cc1 Amb27856379 [0,2,0,0,0,0|2,0,0]=4 6432 B13R1.452 CCNC(=O)c1ccc(C=O)cc1 Amb18648034 [0,2,0,0,0,0|1,0,0]=3 6433 B13R1.452 CCNC(=O)c1ccc(CC)cc1 Amb27609565 [0,2,0,0,0,0|1,0,0]=3 6434 B13R1.452 CCNC(=O)c1ccc(CCl)cc1 Amb8846428 [0,2,0,0,0,0|1,0,0]=3 6435 B13R1.452 CCNC(=O)c1ccc(CN)cc1 Amb1121471 [0,2,0,0,0,0|1,0,0]=3 6436 B13R1.452 CCNC(=O)c1ccc(CN)cc1 Amb21988247 [0,2,0,0,0,0|1,0,0]=3 6437 B13R1.452 CCNC(=O)c1ccc(CN)cn1 Amb18252482 [0,2,0,0,0,0|2,0,0]=4 6438 B13R1.452 CCNC(=O)c1ccc(CN)nc1 Amb18252481 [0,2,0,0,0,0|2,0,0]=4 6439 B13R1.452 CCNC(=O)c1ccc(NN)cc1 Amb18809198 [0,2,0,0,0,0|1,0,0]=3 6440 B13R1.452 CCNC(=O)c1ccc(OC)cc1 Amb8339733 [0,2,0,0,0,0|1,0,0]=3 6441 B13R1.452 CCNC(=O)c1ccc(SC)nc1 Amb28051418 [0,2,0,0,0,0|2,0,0]=4 6442 B13R1.452 CCOC(=N)c1ccc(C#N)cn1 Amb17594443 [0,2,0,0,0,0|2,0,0]=4 6443 B13R1.452 CCOC(=N)c1ccc(NC)cc1 Amb27493392 [0,2,0,0,0,0|1,0,0]=3 6444 B13R1.452 CCOC(=N)c1ccc(OC)cc1 Amb20673136 [0,2,0,0,0,0|1,0,0]=3 6445 B13R1.452 CCOC(=O)N1C=CC(OC)=CC1 Amb24060039 [0,2,0,0,0,0|1,0,1]=4 6446 B13R1.452 CCOC(=O)c1ccc(C#N)cc1 Amb1770679 [0,2,0,0,0,0|0,0,0]=2 6447 B13R1.452 CCOC(=O)c1ccc(C#N)cn1 Amb6384303 [0,2,0,0,0,0|1,0,0]=3 6448 B13R1.452 CCOC(=O)c1ccc(C#N)nc1 Amb8388066 [0,2,0,0,0,0|1,0,0]=3 6449 B13R1.452 CCOC(=O)c1ccc(C=O)cc1 Amb18128103 [0,2,0,0,0,0|0,0,0]=2 6450 B13R1.452 CCOC(=O)c1ccc(CBr)cc1 Amb8391192 [0,2,0,0,0,0|0,0,0]=2 6451 B13R1.452 CCOC(=O)c1ccc(CBr)cn1 Amb32662663 [0,2,0,0,0,0|1,0,0]=3 6452 B13R1.452 CCOC(=O)c1ccc(CBr)cn1 Amb33204450 [0,2,0,0,0,0|1,0,0]=3 6453 B13R1.452 CCOC(=O)c1ccc(CBr)nc1 Amb17621484 [0,2,0,0,0,0|1,0,0]=3 6454 B13R1.452 CCOC(=O)c1ccc(CBr)nc1 Amb32661667 [0,2,0,0,0,0|1,0,0]=3 6455 B13R1.452 CCOC(=O)c1ccc(CC)cc1 Amb6298443 [0,2,0,0,0,0|0,0,0]=2 6456 B13R1.452 CCOC(=O)c1ccc(CCl)cc1 Amb16231654 [0,2,0,0,0,0|0,0,0]=2 6457 B13R1.452 CCOC(=O)c1ccc(CCl)cn1 Amb24106334 [0,2,0,0,0,0|1,0,0]=3 6458 B13R1.452 CCOC(=O)c1ccc(CCl)nc1 Amb22235467 [0,2,0,0,0,0|1,0,0]=3 6459 B13R1.452 CCOC(=O)c1ccc(CN)cc1 Amb2697338 [0,2,0,0,0,0|0,0,0]=2 6460 B13R1.452 CCOC(=O)c1ccc(CN)cc1 Amb9429 [0,2,0,0,0,0|0,0,0]=2 6461 B13R1.452 CCOC(=O)c1ccc(CN)cn1 Amb33727225 [0,2,0,0,0,0|1,0,0]=3 6462 B13R1.452 CCOC(=O)c1ccc(CN)nc1 Amb22728822 [0,2,0,0,0,0|1,0,0]=3 6463 B13R1.452 CCOC(=O)c1ccc(CN)nc1 Amb33229513 [0,2,0,0,0,0|1,0,0]=3 6464 B13R1.452 CCOC(=O)c1ccc(CO)cn1 Amb22263372 [0,2,0,0,0,0|1,0,0]=3 6465 B13R1.452 CCOC(=O)c1ccc(CO)nc1 Amb17621633 [0,2,0,0,0,0|1,0,0]=3 6466 B13R1.452 CCOC(=O)c1ccc(NC)cc1 Amb17305788 [0,2,0,0,0,0|0,0,0]=2 6467 B13R1.452 CCOC(=O)c1ccc(NC)cn1 Amb33745287 [0,2,0,0,0,0|1,0,0]=3 6468 B13R1.452 CCOC(=O)c1ccc(NC)nc1 Amb6630602 [0,2,0,0,0,0|1,0,0]=3 6469 B13R1.452 CCOC(=O)c1ccc(NC)nn1 Amb26399445 [0,2,0,0,0,0|2,0,0]=4 6470 B13R1.452 CCOC(=O)c1ccc(NN)cc1 Amb2692642 [0,2,0,0,0,0|0,0,0]=2 6471 B13R1.452 CCOC(=O)c1ccc(NN)cc1 Amb2699744 [0,2,0,0,0,0|0,0,0]=2 6472 B13R1.452 CCOC(=O)c1ccc(NN)nc1 Amb19651320 [0,2,0,0,0,0|1,0,0]=3 6473 B13R1.452 CCOC(=O)c1ccc(NO)cc1 Amb22753287 [0,2,0,0,0,0|0,0,0]=2 6474 B13R1.452 CCOC(=O)c1ccc(OC)cc1 Amb4302707 [0,2,0,0,0,0|0,0,0]=2 6475 B13R1.452 CCOC(=O)c1ccc(OC)cn1 Amb2386889 [0,2,0,0,0,0|1,0,0]=3 6476 B13R1.452 CCOC(=O)c1ccc(SC)cc1 Amb18942913 [0,2,0,0,0,0|0,0,0]=2 6477 B13R1.452 CCOC(=O)c1ccc(SC)nc1 Amb34911616 [0,2,0,0,0,0|1,0,0]=3 6478 B13R1.452 CCOC(=O)c1ccc([N+]#N)cc1 Amb27759468 [0,2,0,0,0,0|0,0,0]=2 6479 B13R1.452 CCOC(=O)c1cnc(C#N)nc1 Amb30628579 [0,2,0,0,0,0|2,0,0]=4 6480 B13R1.452 CCOC(=O)c1cnc(CC)nc1 Amb23401502 [0,2,0,0,0,0|2,0,0]=4 6481 B13R1.452 CCOC(=O)c1cnc(CN)nc1 Amb33728250 [0,2,0,0,0,0|2,0,0]=4 6482 B13R1.452 CCOC(=O)c1cnc(NC)cn1 Amb24430631 [0,2,0,0,0,0|2,0,0]=4 6483 B13R1.452 CCOC(=O)c1cnc(NN)nc1 Amb23450350 [0,2,0,0,0,0|2,0,0]=4 6484 B13R1.452 CCOC(=O)c1cnc(OC)cn1 Amb21857364 [0,2,0,0,0,0|2,0,0]=4 6485 B13R1.452 CCOC(=O)c1cnc(OC)nc1 Amb33994361 [0,2,0,0,0,0|2,0,0]=4 6486 B13R1.452 CCOC(=O)c1cnc(SC)nc1 Amb8393832 [0,2,0,0,0,0|2,0,0]=4 6487 B13R1.452 CCc1ccc(C(=O)CCBr)cc1 Amb17437863 [0,2,0,0,0,0|2,0,0]=4 6488 B13R1.452 CCc1ccc(C(=O)CCCl)cc1 Amb17109137 [0,2,0,0,0,0|2,0,0]=4 6489 B13R1.452 CCc1ccc(C(=O)CCN)cc1 Amb17194508 [0,2,0,0,0,0|2,0,0]=4 6490 B13R1.452 CCc1ccc(C(=O)CCO)cc1 Amb18065757 [0,2,0,0,0,0|2,0,0]=4 6491 B13R1.452 CCc1ccc(C(=O)CCS)cc1 Amb17401969 [0,2,0,0,0,0|2,0,0]=4 6492 B13R1.452 CCc1ccc(C(=O)CNC)cc1 Amb17233277 [0,2,0,0,0,0|2,0,0]=4 6493 B13R1.452 CCc1ccc(C(=O)CSC)cc1 Amb18321260 [0,2,0,0,0,0|2,0,0]=4 6494 B13R1.452 CNCC(=O)c1ccc(C#N)cc1 Amb26337982 [0,2,0,0,0,0|2,0,0]=4 6495 B13R1.452 CNCC(=O)c1ccc(OC)cc1 Amb17233534 [0,2,0,0,0,0|2,0,0]=4 6496 B13R1.452 CNCC(=O)c1ccc(OC)cc1 Amb33877530 [0,2,0,0,0,0|2,0,0]=4 6497 B13R1.452 CNCC(=O)c1ccc(SC)cc1 Amb18894528 [0,2,0,0,0,0|2,0,0]=4 6498 B13R1.452 CONC(=O)c1ccc(C#N)cc1 Amb10693925 [0,2,0,0,0,0|2,0,0]=4 6499 B13R1.452 CONC(=O)c1ccc(OC)cc1 Amb10703357 [0,2,0,0,0,0|2,0,0]=4 6500 B13R1.452 COc1ccc(C(=O)CCBr)cc1 Amb4066425 [0,2,0,0,0,0|2,0,0]=4 6501 B13R1.452 COc1ccc(C(=O)CCCl)cc1 Amb6304963 [0,2,0,0,0,0|2,0,0]=4 6502 B13R1.452 COc1ccc(C(=O)CCN)cc1 Amb17194534 [0,2,0,0,0,0|2,0,0]=4 6503 B13R1.452 COc1ccc(C(=O)CCO)cc1 Amb18065906 [0,2,0,0,0,0|2,0,0]=4 6504 B13R1.452 COc1ccc(C(=O)CCS)cc1 Amb17402127 [0,2,0,0,0,0|2,0,0]=4 6505 B13R1.452 COc1ccc(C(=O)CSC)cc1 Amb18321460 [0,2,0,0,0,0|2,0,0]=4 6506 B13R1.452 COc1ccc(C(=O)NCO)cc1 Amb2620094 [0,2,0,0,0,0|2,0,0]=4 6507 B13R1.452 CSCC(=O)c1ccc(C#N)cc1 Amb19050196 [0,2,0,0,0,0|2,0,0]=4 6508 B13R1.452 CSCC(=O)c1ccc(SC)cc1 Amb32682829 [0,2,0,0,0,0|2,0,0]=4 6509 B13R1.452 CSc1ccc(C(=O)CCN)cc1 Amb18244070 [0,2,0,0,0,0|2,0,0]=4 6510 B13R1.452 N#Cc1ccc(C(=O)CCBr)cc1 Amb27969109 [0,2,0,0,0,0|2,0,0]=4 6511 B13R1.452 N#Cc1ccc(C(=O)CCCl)cc1 Amb27180353 [0,2,0,0,0,0|2,0,0]=4 6512 B13R1.452 N#Cc1ccc(C(=O)CCN)cc1 Amb33226949 [0,2,0,0,0,0|2,0,0]=4 6513 B13R1.452 [C-]#[N+]c1ccc(C(=O)OCC)cc1 Amb33728451 [0,2,0,0,0,0|0,0,0]=2 6514 B13R1.466 C=C(OCC)C1=CNC(=O)C(C)=C1 Amb33136127 [0,2,0,0,0,0|2,0,0]=4 6515 B13R1.466 C=C(OCC)c1cc(C)c(N)cn1 Amb33135845 [0,2,0,0,0,0|2,0,0]=4 6516 B13R1.466 C=C(OCC)c1ccc(C)c(N)c1 Amb33136099 [0,2,0,0,0,0|1,0,0]=3 6517 B13R1.466 C=C(OCC)c1ccc(Cl)c(N)c1 Amb33135854 [0,2,0,0,0,0|1,0,0]=3 6518 B13R1.466 C=C(OCC)c1ccc(Cl)c(O)c1 Amb33135703 [0,2,0,0,0,0|1,0,0]=3 6519 B13R1.466 C=C(OCC)c1ccc(N)c(C)c1 Amb33136190 [0,2,0,0,0,0|1,0,0]=3 6520 B13R1.466 C=C(OCC)c1ccc(N)c(C)n1 Amb33136060 [0,2,0,0,0,0|2,0,0]=4 6521 B13R1.466 C=C(OCC)c1ccc(N)c(Cl)c1 Amb33135856 [0,2,0,0,0,0|1,0,0]=3 6522 B13R1.466 C=C(OCC)c1ccc(N)c(F)c1 Amb33135849 [0,2,0,0,0,0|1,0,0]=3 6523 B13R1.466 C=C(OCC)c1ccc(N)c(N)c1 Amb33136061 [0,2,0,0,0,0|1,0,0]=3 6524 B13R1.466 C=C(OCC)c1ccc(O)c(C)c1 Amb33135804 [0,2,0,0,0,0|1,0,0]=3 6525 B13R1.466 C=C(OCC)c1ccc(O)c(Cl)c1 Amb33136346 [0,2,0,0,0,0|1,0,0]=3 6526 B13R1.466 C=C(OCC)c1ccc(O)c(F)c1 Amb33136329 [0,2,0,0,0,0|1,0,0]=3 6527 B13R1.466 C=C(OCC)c1cnc(F)c(F)c1 Amb33136115 [0,2,0,0,0,0|2,0,0]=4 6528 B13R1.466 C=C(OCC)c1cnc(N)c(C)c1 Amb33136209 [0,2,0,0,0,0|2,0,0]=4 6529 B13R1.466 CCCC(=O)c1ccc(Br)c(C)c1 Amb17348646 [0,2,0,0,0,0|1,0,0]=3 6530 B13R1.466 CCCC(=O)c1ccc(C)c(Br)c1 Amb17193988 [0,2,0,0,0,0|1,0,0]=3 6531 B13R1.466 CCCC(=O)c1ccc(C)c(C)c1 Amb6753817 [0,2,0,0,0,0|1,0,0]=3 6532 B13R1.466 CCCC(=O)c1ccc(C)c(Cl)c1 Amb17337143 [0,2,0,0,0,0|1,0,0]=3 6533 B13R1.466 CCCC(=O)c1ccc(Cl)c(Br)c1 Amb21856728 [0,2,0,0,0,0|1,0,0]=3 6534 B13R1.466 CCCC(=O)c1ccc(Cl)c(C)c1 Amb17109158 [0,2,0,0,0,0|1,0,0]=3 6535 B13R1.466 CCCC(=O)c1ccc(Cl)c(Cl)c1 Amb8995767 [0,2,0,0,0,0|1,0,0]=3 6536 B13R1.466 CCCC(=O)c1ccc(Cl)c(F)c1 Amb27654106 [0,2,0,0,0,0|1,0,0]=3 6537 B13R1.466 CCCC(=O)c1ccc(Cl)c(N)c1 Amb27477916 [0,2,0,0,0,0|1,0,0]=3 6538 B13R1.466 CCCC(=O)c1ccc(Cl)c(O)c1 Amb27959713 [0,2,0,0,0,0|1,0,0]=3 6539 B13R1.466 CCCC(=O)c1ccc(F)c(Br)c1 Amb17193989 [0,2,0,0,0,0|1,0,0]=3 6540 B13R1.466 CCCC(=O)c1ccc(F)c(C)c1 Amb17109190 [0,2,0,0,0,0|1,0,0]=3 6541 B13R1.466 CCCC(=O)c1ccc(F)c(Cl)c1 Amb17337616 [0,2,0,0,0,0|1,0,0]=3 6542 B13R1.466 CCCC(=O)c1ccc(F)c(F)c1 Amb6844464 [0,2,0,0,0,0|1,0,0]=3 6543 B13R1.466 CCCC(=O)c1ccc(N)c(C)c1 Amb17138826 [0,2,0,0,0,0|1,0,0]=3 6544 B13R1.466 CCCC(=O)c1ccc(N)c(F)c1 Amb28197711 [0,2,0,0,0,0|1,0,0]=3 6545 B13R1.466 CCCC(=O)c1ccc(N)c(N)c1 Amb17202028 [0,2,0,0,0,0|1,0,0]=3 6546 B13R1.466 CCCC(=O)c1ccc(N)c(S)c1 Amb27647550 [0,2,0,0,0,0|1,0,0]=3 6547 B13R1.466 CCCC(=O)c1ccc(O)c(Br)c1 Amb24556288 [0,2,0,0,0,0|1,0,0]=3 6548 B13R1.466 CCCC(=O)c1ccc(O)c(C)c1 Amb17233423 [0,2,0,0,0,0|1,0,0]=3 6549 B13R1.466 CCCC(=O)c1ccc(O)c(Cl)c1 Amb17236842 [0,2,0,0,0,0|1,0,0]=3 6550 B13R1.466 CCCC(=O)c1ccc(O)c(F)c1 Amb28256328 [0,2,0,0,0,0|1,0,0]=3 6551 B13R1.466 CCCC(=O)c1ccc(O)c(N)c1 Amb17218506 [0,2,0,0,0,0|1,0,0]=3 6552 B13R1.466 CCCC(=O)c1ccc(O)c(O)c1 Amb17613040 [0,2,0,0,0,0|1,0,0]=3 6553 B13R1.466 CCCS(=O)c1ccc(C)c(Br)c1 Amb25237284 [0,2,0,0,0,0|2,0,0]=4 6554 B13R1.466 CCCS(=O)c1ccc(N)c(N)c1 Amb27490955 [0,2,0,0,0,0|2,0,0]=4 6555 B13R1.466 CCNC(=N)c1ccc(Cl)c(Br)c1 Amb27599457 [0,2,0,0,0,0|2,0,0]=4 6556 B13R1.466 CCNC(=N)c1ccc(Cl)c(Cl)c1 Amb27592756 [0,2,0,0,0,0|2,0,0]=4 6557 B13R1.466 CCNC(=N)c1ccc(F)c(Cl)c1 Amb28242219 [0,2,0,0,0,0|2,0,0]=4 6558 B13R1.466 CCNC(=N)c1ccc(F)c(F)c1 Amb27760916 [0,2,0,0,0,0|2,0,0]=4 6559 B13R1.466 CCNC(=N)c1ccc(O)c(F)c1 Amb27831264 [0,2,0,0,0,0|2,0,0]=4 6560 B13R1.466 CCNC(=O)C1=CN(C)C(=O)C=C1 Amb25835724 [0,2,0,0,0,0|2,0,0]=4 6561 B13R1.466 CCNC(=O)c1cc(C)c(Br)cn1 Amb32414277 [0,2,0,0,0,0|2,0,0]=4 6562 B13R1.466 CCNC(=O)c1ccc(Br)c(C)c1 Amb22001134 [0,2,0,0,0,0|1,0,0]=3 6563 B13R1.466 CCNC(=O)c1ccc(Br)c(F)c1 Amb12605722 [0,2,0,0,0,0|1,0,0]=3 6564 B13R1.466 CCNC(=O)c1ccc(Br)c(N)c1 Amb17159429 [0,2,0,0,0,0|1,0,0]=3 6565 B13R1.466 CCNC(=O)c1ccc(C)c(Br)c1 Amb27603833 [0,2,0,0,0,0|1,0,0]=3 6566 B13R1.466 CCNC(=O)c1ccc(C)c(C)c1 Amb3364032 [0,2,0,0,0,0|1,0,0]=3 6567 B13R1.466 CCNC(=O)c1ccc(C)c(F)n1 Amb33495847 [0,2,0,0,0,0|2,0,0]=4 6568 B13R1.466 CCNC(=O)c1ccc(C)c(I)c1 Amb20642284 [0,2,0,0,0,0|1,0,0]=3 6569 B13R1.466 CCNC(=O)c1ccc(C)c(N)c1 Amb1116889 [0,2,0,0,0,0|1,0,0]=3 6570 B13R1.466 CCNC(=O)c1ccc(C)c(N)c1 Amb17622100 [0,2,0,0,0,0|1,0,0]=3 6571 B13R1.466 CCNC(=O)c1ccc(Cl)c(Br)c1 Amb27162078 [0,2,0,0,0,0|1,0,0]=3 6572 B13R1.466 CCNC(=O)c1ccc(Cl)c(C)c1 Amb27238185 [0,2,0,0,0,0|1,0,0]=3 6573 B13R1.466 CCNC(=O)c1ccc(Cl)c(N)c1 Amb1117288 [0,2,0,0,0,0|1,0,0]=3 6574 B13R1.466 CCNC(=O)c1ccc(Cl)c(O)c1 Amb33068446 [0,2,0,0,0,0|1,0,0]=3 6575 B13R1.466 CCNC(=O)c1ccc(F)c(Br)c1 Amb22231308 [0,2,0,0,0,0|1,0,0]=3 6576 B13R1.466 CCNC(=O)c1ccc(F)c(I)c1 Amb28051415 [0,2,0,0,0,0|1,0,0]=3 6577 B13R1.466 CCNC(=O)c1ccc(F)c(N)c1 Amb9295349 [0,2,0,0,0,0|1,0,0]=3 6578 B13R1.466 CCNC(=O)c1ccc(F)c(O)c1 Amb24658606 [0,2,0,0,0,0|1,0,0]=3 6579 B13R1.466 CCNC(=O)c1ccc(I)c(Br)c1 Amb11321783 [0,2,0,0,0,0|1,0,0]=3 6580 B13R1.466 CCNC(=O)c1ccc(N)c(C)c1 Amb1112970 [0,2,0,0,0,0|1,0,0]=3 6581 B13R1.466 CCNC(=O)c1ccc(N)c(C)c1 Amb17622101 [0,2,0,0,0,0|1,0,0]=3 6582 B13R1.466 CCNC(=O)c1ccc(N)c(Cl)c1 Amb27244910 [0,2,0,0,0,0|1,0,0]=3 6583 B13R1.466 CCNC(=O)c1ccc(N)c(F)c1 Amb18963303 [0,2,0,0,0,0|1,0,0]=3 6584 B13R1.466 CCNC(=O)c1ccc(N)c(N)c1 Amb28042859 [0,2,0,0,0,0|1,0,0]=3 6585 B13R1.466 CCNC(=O)c1ccc(N)c(O)c1 Amb26657029 [0,2,0,0,0,0|1,0,0]=3 6586 B13R1.466 CCNC(=O)c1ccc(O)c(N)c1 Amb24669872 [0,2,0,0,0,0|1,0,0]=3 6587 B13R1.466 CCNC(=O)c1ccc(O)c(O)c1 Amb28124453 [0,2,0,0,0,0|1,0,0]=3 6588 B13R1.466 CCNC(=O)c1cnc(Cl)c(Br)c1 Amb28288987 [0,2,0,0,0,0|2,0,0]=4 6589 B13R1.466 CCNC(=O)c1cnc(N)c(Br)c1 Amb28410733 [0,2,0,0,0,0|2,0,0]=4 6590 B13R1.466 CCOC(=N)c1ccc(C)c(F)c1 Amb18796415 [0,2,0,0,0,0|1,0,0]=3 6591 B13R1.466 CCOC(=N)c1ccc(Cl)c(Cl)c1 Amb27753957 [0,2,0,0,0,0|1,0,0]=3 6592 B13R1.466 CCOC(=N)c1ccc(F)c(Br)c1 Amb27180917 [0,2,0,0,0,0|1,0,0]=3 6593 B13R1.466 CCOC(=N)c1ccc(F)c(F)c1 Amb22285009 [0,2,0,0,0,0|1,0,0]=3 6594 B13R1.466 CCOC(=N)c1ccc(N)c(Br)c1 Amb27181136 [0,2,0,0,0,0|1,0,0]=3 6595 B13R1.466 CCOC(=N)c1ccc(O)c(Br)c1 Amb27748790 [0,2,0,0,0,0|1,0,0]=3 6596 B13R1.466 CCOC(=N)c1ccc(O)c(Cl)c1 Amb18331433 [0,2,0,0,0,0|1,0,0]=3 6597 B13R1.466 CCOC(=N)c1ccc(O)c(O)c1 Amb28054840 [0,2,0,0,0,0|1,0,0]=3 6598 B13R1.466 CCOC(=O)C1=CC(=O)C(O)=CO1 Amb25842152 [0,2,0,0,0,0|1,0,0]=3 6599 B13R1.466 CCOC(=O)C1=CC(=O)N(C)C=C1 Amb19374603 [0,2,0,0,0,0|1,0,0]=3 6600 B13R1.466 CCOC(=O)C1=CC(=O)N(C)N=C1 Amb26988990 [0,2,0,0,0,0|2,0,0]=4 6601 B13R1.466 CCOC(=O)C1=CC=C(C)C(=O)N1 Amb26509734 [0,2,0,0,0,0|1,0,0]=3 6602 B13R1.466 CCOC(=O)C1=CN(C)C(=O)C=C1 Amb22277008 [0,2,0,0,0,0|1,0,0]=3 6603 B13R1.466 CCOC(=O)C1=CNC(=O)C(C)=C1 Amb22494893 [0,2,0,0,0,0|1,0,0]=3 6604 B13R1.466 CCOC(=O)C1=CNC(=O)C(I)=C1 Amb26840910 [0,2,0,0,0,0|1,0,0]=3 6605 B13R1.466 CCOC(=O)C1=NN(C)C(=O)C=C1 Amb24623723 [0,2,0,0,0,0|2,0,0]=4 6606 B13R1.466 CCOC(=O)C1=NNC(=O)C(Br)=C1 Amb32416208 [0,2,0,0,0,0|2,0,0]=4 6607 B13R1.466 CCOC(=O)c1cc(Br)c(C)cn1 Amb22495199 [0,2,0,0,0,0|1,0,0]=3 6608 B13R1.466 CCOC(=O)c1cc(Br)c(F)cn1 Amb25312387 [0,2,0,0,0,0|1,0,0]=3 6609 B13R1.466 CCOC(=O)c1cc(Br)c(N)cn1 Amb25780919 [0,2,0,0,0,0|1,0,0]=3 6610 B13R1.466 CCOC(=O)c1cc(Br)c(N)nn1 Amb33727532 [0,2,0,0,0,0|2,0,0]=4 6611 B13R1.466 CCOC(=O)c1cc(Br)c(O)cn1 Amb25276666 [0,2,0,0,0,0|1,0,0]=3 6612 B13R1.466 CCOC(=O)c1cc(C)c(Br)cn1 Amb22388891 [0,2,0,0,0,0|1,0,0]=3 6613 B13R1.466 CCOC(=O)c1cc(C)c(F)cn1 Amb26056721 [0,2,0,0,0,0|1,0,0]=3 6614 B13R1.466 CCOC(=O)c1cc(Cl)c(Br)cn1 Amb25723985 [0,2,0,0,0,0|1,0,0]=3 6615 B13R1.466 CCOC(=O)c1cc(Cl)c(C)cn1 Amb22436778 [0,2,0,0,0,0|1,0,0]=3 6616 B13R1.466 CCOC(=O)c1cc(Cl)c(Cl)cn1 Amb27199517 [0,2,0,0,0,0|1,0,0]=3 6617 B13R1.466 CCOC(=O)c1cc(Cl)c(Cl)nn1 Amb32416209 [0,2,0,0,0,0|2,0,0]=4 6618 B13R1.466 CCOC(=O)c1cc(Cl)c(F)cn1 Amb28421811 [0,2,0,0,0,0|1,0,0]=3 6619 B13R1.466 CCOC(=O)c1cc(F)c(Br)cn1 Amb25920068 [0,2,0,0,0,0|1,0,0]=3 6620 B13R1.466 CCOC(=O)c1cc(F)c(Cl)cn1 Amb26419229 [0,2,0,0,0,0|1,0,0]=3 6621 B13R1.466 CCOC(=O)c1cc(F)c(F)cn1 Amb27225184 [0,2,0,0,0,0|1,0,0]=3 6622 B13R1.466 CCOC(=O)c1cc(F)c(I)cn1 Amb27240029 [0,2,0,0,0,0|1,0,0]=3 6623 B13R1.466 CCOC(=O)c1cc(F)c(N)cn1 Amb27429126 [0,2,0,0,0,0|1,0,0]=3 6624 B13R1.466 CCOC(=O)c1cc(I)c(F)cn1 Amb27623559 [0,2,0,0,0,0|1,0,0]=3 6625 B13R1.466 CCOC(=O)c1cc(N)c(Br)cn1 Amb24501517 [0,2,0,0,0,0|1,0,0]=3 6626 B13R1.466 CCOC(=O)c1cc(N)c(C)cn1 Amb27449829 [0,2,0,0,0,0|1,0,0]=3 6627 B13R1.466 CCOC(=O)c1cc(N)c(F)cn1 Amb26423539 [0,2,0,0,0,0|1,0,0]=3 6628 B13R1.466 CCOC(=O)c1cc(O)c(Br)cn1 Amb24441130 [0,2,0,0,0,0|1,0,0]=3 6629 B13R1.466 CCOC(=O)c1cc(O)c(C)cn1 Amb27202377 [0,2,0,0,0,0|1,0,0]=3 6630 B13R1.466 CCOC(=O)c1cc(O)c(F)cn1 Amb24743788 [0,2,0,0,0,0|1,0,0]=3 6631 B13R1.466 CCOC(=O)c1cc(O)c(O)cn1 Amb18648725 [0,2,0,0,0,0|1,0,0]=3 6632 B13R1.466 CCOC(=O)c1ccc(Br)c(Br)c1 Amb20621214 [0,2,0,0,0,0|0,0,0]=2 6633 B13R1.466 CCOC(=O)c1ccc(Br)c(C)c1 Amb16231785 [0,2,0,0,0,0|0,0,0]=2 6634 B13R1.466 CCOC(=O)c1ccc(Br)c(C)n1 Amb22494647 [0,2,0,0,0,0|1,0,0]=3 6635 B13R1.466 CCOC(=O)c1ccc(Br)c(Cl)c1 Amb21981731 [0,2,0,0,0,0|0,0,0]=2 6636 B13R1.466 CCOC(=O)c1ccc(Br)c(Cl)n1 Amb21857413 [0,2,0,0,0,0|1,0,0]=3 6637 B13R1.466 CCOC(=O)c1ccc(Br)c(F)c1 Amb22057676 [0,2,0,0,0,0|0,0,0]=2 6638 B13R1.466 CCOC(=O)c1ccc(Br)c(I)c1 Amb10601545 [0,2,0,0,0,0|0,0,0]=2 6639 B13R1.466 CCOC(=O)c1ccc(Br)c(N)c1 Amb18294790 [0,2,0,0,0,0|0,0,0]=2 6640 B13R1.466 CCOC(=O)c1ccc(Br)c(N)n1 Amb22498431 [0,2,0,0,0,0|1,0,0]=3 6641 B13R1.466 CCOC(=O)c1ccc(Br)c(O)c1 Amb22500445 [0,2,0,0,0,0|0,0,0]=2 6642 B13R1.466 CCOC(=O)c1ccc(Br)c(O)n1 Amb21857420 [0,2,0,0,0,0|1,0,0]=3 6643 B13R1.466 CCOC(=O)c1ccc(C)c(Br)c1 Amb22288817 [0,2,0,0,0,0|0,0,0]=2 6644 B13R1.466 CCOC(=O)c1ccc(C)c(Br)n1 Amb22495089 [0,2,0,0,0,0|1,0,0]=3 6645 B13R1.466 CCOC(=O)c1ccc(C)c(C)c1 Amb4035901 [0,2,0,0,0,0|0,0,0]=2 6646 B13R1.466 CCOC(=O)c1ccc(C)c(Cl)c1 Amb22750096 [0,2,0,0,0,0|0,0,0]=2 6647 B13R1.466 CCOC(=O)c1ccc(C)c(Cl)n1 Amb22001691 [0,2,0,0,0,0|1,0,0]=3 6648 B13R1.466 CCOC(=O)c1ccc(C)c(F)c1 Amb9273662 [0,2,0,0,0,0|0,0,0]=2 6649 B13R1.466 CCOC(=O)c1ccc(C)c(I)c1 Amb16232640 [0,2,0,0,0,0|0,0,0]=2 6650 B13R1.466 CCOC(=O)c1ccc(C)c(N)c1 Amb844779 [0,2,0,0,0,0|0,0,0]=2 6651 B13R1.466 CCOC(=O)c1ccc(C)c(N)n1 Amb25073595 [0,2,0,0,0,0|1,0,0]=3 6652 B13R1.466 CCOC(=O)c1ccc(C)c(O)c1 Amb9273954 [0,2,0,0,0,0|0,0,0]=2 6653 B13R1.466 CCOC(=O)c1ccc(Cl)c(Br)c1 Amb22001520 [0,2,0,0,0,0|0,0,0]=2 6654 B13R1.466 CCOC(=O)c1ccc(Cl)c(Br)n1 Amb28323201 [0,2,0,0,0,0|1,0,0]=3 6655 B13R1.466 CCOC(=O)c1ccc(Cl)c(C)c1 Amb18277108 [0,2,0,0,0,0|0,0,0]=2 6656 B13R1.466 CCOC(=O)c1ccc(Cl)c(C)n1 Amb27250536 [0,2,0,0,0,0|1,0,0]=3 6657 B13R1.466 CCOC(=O)c1ccc(Cl)c(Cl)c1 Amb9242894 [0,2,0,0,0,0|0,0,0]=2 6658 B13R1.466 CCOC(=O)c1ccc(Cl)c(Cl)n1 Amb26870338 [0,2,0,0,0,0|1,0,0]=3 6659 B13R1.466 CCOC(=O)c1ccc(Cl)c(F)c1 Amb21964735 [0,2,0,0,0,0|0,0,0]=2 6660 B13R1.466 CCOC(=O)c1ccc(Cl)c(I)c1 Amb19888181 [0,2,0,0,0,0|0,0,0]=2 6661 B13R1.466 CCOC(=O)c1ccc(Cl)c(N)c1 Amb7755234 [0,2,0,0,0,0|0,0,0]=2 6662 B13R1.466 CCOC(=O)c1ccc(Cl)c(O)c1 Amb21961764 [0,2,0,0,0,0|0,0,0]=2 6663 B13R1.466 CCOC(=O)c1ccc(Cl)c(O)n1 Amb25195300 [0,2,0,0,0,0|1,0,0]=3 6664 B13R1.466 CCOC(=O)c1ccc(Cl)c(S)c1 Amb27865147 [0,2,0,0,0,0|0,0,0]=2 6665 B13R1.466 CCOC(=O)c1ccc(F)c(Br)c1 Amb10839797 [0,2,0,0,0,0|0,0,0]=2 6666 B13R1.466 CCOC(=O)c1ccc(F)c(Br)n1 Amb27866252 [0,2,0,0,0,0|1,0,0]=3 6667 B13R1.466 CCOC(=O)c1ccc(F)c(C)c1 Amb18940053 [0,2,0,0,0,0|0,0,0]=2 6668 B13R1.466 CCOC(=O)c1ccc(F)c(Cl)c1 Amb984989 [0,2,0,0,0,0|0,0,0]=2 6669 B13R1.466 CCOC(=O)c1ccc(F)c(F)c1 Amb2687828 [0,2,0,0,0,0|0,0,0]=2 6670 B13R1.466 CCOC(=O)c1ccc(F)c(F)n1 Amb28243427 [0,2,0,0,0,0|1,0,0]=3 6671 B13R1.466 CCOC(=O)c1ccc(F)c(I)c1 Amb25877727 [0,2,0,0,0,0|0,0,0]=2 6672 B13R1.466 CCOC(=O)c1ccc(F)c(I)n1 Amb25996974 [0,2,0,0,0,0|1,0,0]=3 6673 B13R1.466 CCOC(=O)c1ccc(F)c(N)c1 Amb6298217 [0,2,0,0,0,0|0,0,0]=2 6674 B13R1.466 CCOC(=O)c1ccc(F)c(N)n1 Amb25365584 [0,2,0,0,0,0|1,0,0]=3 6675 B13R1.466 CCOC(=O)c1ccc(F)c(O)c1 Amb23437510 [0,2,0,0,0,0|0,0,0]=2 6676 B13R1.466 CCOC(=O)c1ccc(I)c(Br)c1 Amb22371469 [0,2,0,0,0,0|0,0,0]=2 6677 B13R1.466 CCOC(=O)c1ccc(I)c(Cl)c1 Amb19887811 [0,2,0,0,0,0|0,0,0]=2 6678 B13R1.466 CCOC(=O)c1ccc(I)c(F)c1 Amb19887815 [0,2,0,0,0,0|0,0,0]=2 6679 B13R1.466 CCOC(=O)c1ccc(I)c(F)n1 Amb24740257 [0,2,0,0,0,0|1,0,0]=3 6680 B13R1.466 CCOC(=O)c1ccc(I)c(I)c1 Amb25155255 [0,2,0,0,0,0|0,0,0]=2 6681 B13R1.466 CCOC(=O)c1ccc(I)c(N)c1 Amb21857083 [0,2,0,0,0,0|0,0,0]=2 6682 B13R1.466 CCOC(=O)c1ccc(I)c(O)c1 Amb20621412 [0,2,0,0,0,0|0,0,0]=2 6683 B13R1.466 CCOC(=O)c1ccc(N)c(Br)c1 Amb2695798 [0,2,0,0,0,0|0,0,0]=2 6684 B13R1.466 CCOC(=O)c1ccc(N)c(Br)n1 Amb27833571 [0,2,0,0,0,0|1,0,0]=3 6685 B13R1.466 CCOC(=O)c1ccc(N)c(C)c1 Amb844781 [0,2,0,0,0,0|0,0,0]=2 6686 B13R1.466 CCOC(=O)c1ccc(N)c(C)n1 Amb33727527 [0,2,0,0,0,0|1,0,0]=3 6687 B13R1.466 CCOC(=O)c1ccc(N)c(Cl)c1 Amb844784 [0,2,0,0,0,0|0,0,0]=2 6688 B13R1.466 CCOC(=O)c1ccc(N)c(Cl)n1 Amb27608399 [0,2,0,0,0,0|1,0,0]=3 6689 B13R1.466 CCOC(=O)c1ccc(N)c(F)c1 Amb18994988 [0,2,0,0,0,0|0,0,0]=2 6690 B13R1.466 CCOC(=O)c1ccc(N)c(F)n1 Amb27225395 [0,2,0,0,0,0|1,0,0]=3 6691 B13R1.466 CCOC(=O)c1ccc(N)c(I)c1 Amb8492971 [0,2,0,0,0,0|0,0,0]=2 6692 B13R1.466 CCOC(=O)c1ccc(N)c(I)n1 Amb27186344 [0,2,0,0,0,0|1,0,0]=3 6693 B13R1.466 CCOC(=O)c1ccc(N)c(N)c1 Amb2687820 [0,2,0,0,0,0|0,0,0]=2 6694 B13R1.466 CCOC(=O)c1ccc(N)c(N)n1 Amb28128823 [0,2,0,0,0,0|1,0,0]=3 6695 B13R1.466 CCOC(=O)c1ccc(N)c(O)c1 Amb17205818 [0,2,0,0,0,0|0,0,0]=2 6696 B13R1.466 CCOC(=O)c1ccc(O)c(Br)c1 Amb6540587 [0,2,0,0,0,0|0,0,0]=2 6697 B13R1.466 CCOC(=O)c1ccc(O)c(Br)n1 Amb27482114 [0,2,0,0,0,0|1,0,0]=3 6698 B13R1.466 CCOC(=O)c1ccc(O)c(C)c1 Amb18128630 [0,2,0,0,0,0|0,0,0]=2 6699 B13R1.466 CCOC(=O)c1ccc(O)c(C)n1 Amb27192582 [0,2,0,0,0,0|1,0,0]=3 6700 B13R1.466 CCOC(=O)c1ccc(O)c(Cl)c1 Amb9243026 [0,2,0,0,0,0|0,0,0]=2 6701 B13R1.466 CCOC(=O)c1ccc(O)c(Cl)n1 Amb26444185 [0,2,0,0,0,0|1,0,0]=3 6702 B13R1.466 CCOC(=O)c1ccc(O)c(F)c1 Amb18648839 [0,2,0,0,0,0|0,0,0]=2 6703 B13R1.466 CCOC(=O)c1ccc(O)c(I)c1 Amb16232641 [0,2,0,0,0,0|0,0,0]=2 6704 B13R1.466 CCOC(=O)c1ccc(O)c(N)c1 Amb1950700 [0,2,0,0,0,0|0,0,0]=2 6705 B13R1.466 CCOC(=O)c1ccc(O)c(O)c1 Amb6296032 [0,2,0,0,0,0|0,0,0]=2 6706 B13R1.466 CCOC(=O)c1ccc(S)c(F)c1 Amb27771518 [0,2,0,0,0,0|0,0,0]=2 6707 B13R1.466 CCOC(=O)c1cnc(Br)c(Br)n1 Amb28051717 [0,2,0,0,0,0|2,0,0]=4 6708 B13R1.466 CCOC(=O)c1cnc(Br)c(C)c1 Amb24654001 [0,2,0,0,0,0|1,0,0]=3 6709 B13R1.466 CCOC(=O)c1cnc(Br)c(Cl)c1 Amb24677538 [0,2,0,0,0,0|1,0,0]=3 6710 B13R1.466 CCOC(=O)c1cnc(Br)c(F)c1 Amb26850815 [0,2,0,0,0,0|1,0,0]=3 6711 B13R1.466 CCOC(=O)c1cnc(Br)c(N)c1 Amb27790832 [0,2,0,0,0,0|1,0,0]=3 6712 B13R1.466 CCOC(=O)c1cnc(Br)c(N)n1 Amb33730602 [0,2,0,0,0,0|2,0,0]=4 6713 B13R1.466 CCOC(=O)c1cnc(Br)c(O)c1 Amb26381302 [0,2,0,0,0,0|1,0,0]=3 6714 B13R1.466 CCOC(=O)c1cnc(C)c(Br)c1 Amb22728303 [0,2,0,0,0,0|1,0,0]=3 6715 B13R1.466 CCOC(=O)c1cnc(C)c(C)c1 Amb17614029 [0,2,0,0,0,0|1,0,0]=3 6716 B13R1.466 CCOC(=O)c1cnc(C)c(F)c1 Amb28243732 [0,2,0,0,0,0|1,0,0]=3 6717 B13R1.466 CCOC(=O)c1cnc(C)c(I)c1 Amb27411295 [0,2,0,0,0,0|1,0,0]=3 6718 B13R1.466 CCOC(=O)c1cnc(C)c(N)c1 Amb22235230 [0,2,0,0,0,0|1,0,0]=3 6719 B13R1.466 CCOC(=O)c1cnc(C)c(O)c1 Amb18648472 [0,2,0,0,0,0|1,0,0]=3 6720 B13R1.466 CCOC(=O)c1cnc(Cl)c(Br)c1 Amb22752622 [0,2,0,0,0,0|1,0,0]=3 6721 B13R1.466 CCOC(=O)c1cnc(Cl)c(Br)n1 Amb33038962 [0,2,0,0,0,0|2,0,0]=4 6722 B13R1.466 CCOC(=O)c1cnc(Cl)c(C)c1 Amb22492869 [0,2,0,0,0,0|1,0,0]=3 6723 B13R1.466 CCOC(=O)c1cnc(Cl)c(Cl)c1 Amb1094135 [0,2,0,0,0,0|1,0,0]=3 6724 B13R1.466 CCOC(=O)c1cnc(Cl)c(F)c1 Amb27233843 [0,2,0,0,0,0|1,0,0]=3 6725 B13R1.466 CCOC(=O)c1cnc(Cl)c(N)c1 Amb22739938 [0,2,0,0,0,0|1,0,0]=3 6726 B13R1.466 CCOC(=O)c1cnc(Cl)c(O)c1 Amb25729833 [0,2,0,0,0,0|1,0,0]=3 6727 B13R1.466 CCOC(=O)c1cnc(F)c(Br)c1 Amb23400017 [0,2,0,0,0,0|1,0,0]=3 6728 B13R1.466 CCOC(=O)c1cnc(F)c(C)c1 Amb24679502 [0,2,0,0,0,0|1,0,0]=3 6729 B13R1.466 CCOC(=O)c1cnc(F)c(Cl)c1 Amb23399973 [0,2,0,0,0,0|1,0,0]=3 6730 B13R1.466 CCOC(=O)c1cnc(F)c(I)c1 Amb26894838 [0,2,0,0,0,0|1,0,0]=3 6731 B13R1.466 CCOC(=O)c1cnc(I)c(F)c1 Amb27670002 [0,2,0,0,0,0|1,0,0]=3 6732 B13R1.466 CCOC(=O)c1cnc(I)c(O)c1 Amb20242056 [0,2,0,0,0,0|1,0,0]=3 6733 B13R1.466 CCOC(=O)c1cnc(N)c(Br)c1 Amb10069041 [0,2,0,0,0,0|1,0,0]=3 6734 B13R1.466 CCOC(=O)c1cnc(N)c(Br)n1 Amb33745903 [0,2,0,0,0,0|2,0,0]=4 6735 B13R1.466 CCOC(=O)c1cnc(N)c(C)c1 Amb26994918 [0,2,0,0,0,0|1,0,0]=3 6736 B13R1.466 CCOC(=O)c1cnc(N)c(C)n1 Amb24441342 [0,2,0,0,0,0|2,0,0]=4 6737 B13R1.466 CCOC(=O)c1cnc(N)c(Cl)c1 Amb22736300 [0,2,0,0,0,0|1,0,0]=3 6738 B13R1.466 CCOC(=O)c1cnc(N)c(F)c1 Amb27215849 [0,2,0,0,0,0|1,0,0]=3 6739 B13R1.466 CCOC(=O)c1cnc(N)c(N)c1 Amb27453463 [0,2,0,0,0,0|1,0,0]=3 6740 B13R1.466 CCOC(=O)c1cnc(N)c(O)c1 Amb26607102 [0,2,0,0,0,0|1,0,0]=3 6741 B13R1.466 CCOC(=O)c1cnc(O)c(Cl)c1 Amb22736448 [0,2,0,0,0,0|1,0,0]=3 6742 B13R1.466 CCOC(=O)c1cnc(O)c(F)c1 Amb26419792 [0,2,0,0,0,0|1,0,0]=3 6743 B13R1.466 CCOC(=O)c1ncc(Br)c(Cl)n1 Amb24396678 [0,2,0,0,0,0|2,0,0]=4 6744 B13R1.466 CCOC(=O)c1ncc(Br)c(N)n1 Amb33727934 [0,2,0,0,0,0|2,0,0]=4 6745 B13R1.466 CCOC(=O)c1ncc(Br)c(O)n1 Amb27829075 [0,2,0,0,0,0|2,0,0]=4 6746 B13R1.466 CCOC(=O)c1ncc(C)c(O)n1 Amb27192589 [0,2,0,0,0,0|2,0,0]=4 6747 B13R1.466 CCOC(=O)c1ncc(Cl)c(Cl)n1 Amb24664602 [0,2,0,0,0,0|2,0,0]=4 6748 B13R1.466 CCOC(=O)c1ncc(I)c(Cl)n1 Amb32667552 [0,2,0,0,0,0|2,0,0]=4 6749 B13R1.466 CCOC(=O)c1ncc(O)c(C)n1 Amb25364471 [0,2,0,0,0,0|2,0,0]=4 6750 B13R1.466 CNCC(=O)c1ccc(Br)c(C)c1 Amb18227887 [0,2,0,0,0,0|2,0,0]=4 6751 B13R1.466 CNCC(=O)c1ccc(Br)c(Cl)c1 Amb24379078 [0,2,0,0,0,0|2,0,0]=4 6752 B13R1.466 CNCC(=O)c1ccc(Br)c(F)c1 Amb25342778 [0,2,0,0,0,0|2,0,0]=4 6753 B13R1.466 CNCC(=O)c1ccc(Br)c(N)c1 Amb18227846 [0,2,0,0,0,0|2,0,0]=4 6754 B13R1.466 CNCC(=O)c1ccc(Br)c(O)c1 Amb27840942 [0,2,0,0,0,0|2,0,0]=4 6755 B13R1.466 CNCC(=O)c1ccc(C)c(Br)c1 Amb18872420 [0,2,0,0,0,0|2,0,0]=4 6756 B13R1.466 CNCC(=O)c1ccc(C)c(C)c1 Amb17233278 [0,2,0,0,0,0|2,0,0]=4 6757 B13R1.466 CNCC(=O)c1ccc(C)c(Cl)c1 Amb18224989 [0,2,0,0,0,0|2,0,0]=4 6758 B13R1.466 CNCC(=O)c1ccc(C)c(F)c1 Amb26026492 [0,2,0,0,0,0|2,0,0]=4 6759 B13R1.466 CNCC(=O)c1ccc(C)c(N)c1 Amb18862930 [0,2,0,0,0,0|2,0,0]=4 6760 B13R1.466 CNCC(=O)c1ccc(C)c(O)c1 Amb25786501 [0,2,0,0,0,0|2,0,0]=4 6761 B13R1.466 CNCC(=O)c1ccc(Cl)c(Br)c1 Amb26607182 [0,2,0,0,0,0|2,0,0]=4 6762 B13R1.466 CNCC(=O)c1ccc(Cl)c(C)c1 Amb17314398 [0,2,0,0,0,0|2,0,0]=4 6763 B13R1.466 CNCC(=O)c1ccc(Cl)c(Cl)c1 Amb17314508 [0,2,0,0,0,0|2,0,0]=4 6764 B13R1.466 CNCC(=O)c1ccc(Cl)c(F)c1 Amb25180475 [0,2,0,0,0,0|2,0,0]=4 6765 B13R1.466 CNCC(=O)c1ccc(Cl)c(N)c1 Amb18864185 [0,2,0,0,0,0|2,0,0]=4 6766 B13R1.466 CNCC(=O)c1ccc(Cl)c(O)c1 Amb27480951 [0,2,0,0,0,0|2,0,0]=4 6767 B13R1.466 CNCC(=O)c1ccc(F)c(Br)c1 Amb25158269 [0,2,0,0,0,0|2,0,0]=4 6768 B13R1.466 CNCC(=O)c1ccc(F)c(C)c1 Amb17233788 [0,2,0,0,0,0|2,0,0]=4 6769 B13R1.466 CNCC(=O)c1ccc(F)c(Cl)c1 Amb18864487 [0,2,0,0,0,0|2,0,0]=4 6770 B13R1.466 CNCC(=O)c1ccc(F)c(F)c1 Amb17335732 [0,2,0,0,0,0|2,0,0]=4 6771 B13R1.466 CNCC(=O)c1ccc(F)c(N)c1 Amb18863009 [0,2,0,0,0,0|2,0,0]=4 6772 B13R1.466 CNCC(=O)c1ccc(F)c(O)c1 Amb28189338 [0,2,0,0,0,0|2,0,0]=4 6773 B13R1.466 CNCC(=O)c1ccc(N)c(O)c1 Amb27876604 [0,2,0,0,0,0|2,0,0]=4 6774 B13R1.466 CNCC(=O)c1ccc(O)c(Br)c1 Amb33388528 [0,2,0,0,0,0|2,0,0]=4 6775 B13R1.466 CNCC(=O)c1ccc(O)c(C)c1 Amb26591394 [0,2,0,0,0,0|2,0,0]=4 6776 B13R1.466 CNCC(=O)c1ccc(O)c(Cl)c1 Amb27866436 [0,2,0,0,0,0|2,0,0]=4 6777 B13R1.466 CNCC(=O)c1ccc(O)c(F)c1 Amb26413911 [0,2,0,0,0,0|2,0,0]=4 6778 B13R1.466 CNCC(=O)c1ccc(O)c(N)c1 Amb27776841 [0,2,0,0,0,0|2,0,0]=4 6779 B13R1.466 CNCC(=O)c1ccc(O)c(O)c1 Amb532937 [0,2,0,0,0,0|2,0,0]=4 6780 B13R1.466 CNCC(=O)c1ccc(O)c(O)c1 Amb9786586 [0,2,0,0,0,0|2,0,0]=4 6781 B13R1.466 CNNC(=O)c1ccc(N)c(O)c1 Amb28252114 [0,2,0,0,0,0|2,0,0]=4 6782 B13R1.466 COCC(=O)c1ccc(Br)c(F)c1 Amb27603213 [0,2,0,0,0,0|2,0,0]=4 6783 B13R1.466 COCC(=O)c1ccc(C)c(N)c1 Amb27881464 [0,2,0,0,0,0|2,0,0]=4 6784 B13R1.466 COCC(=O)c1ccc(Cl)c(C)c1 Amb17198822 [0,2,0,0,0,0|2,0,0]=4 6785 B13R1.466 COCC(=O)c1ccc(Cl)c(F)c1 Amb27790913 [0,2,0,0,0,0|2,0,0]=4 6786 B13R1.466 COCC(=O)c1ccc(F)c(F)c1 Amb9666018 [0,2,0,0,0,0|2,0,0]=4 6787 B13R1.466 COCC(=O)c1ccc(N)c(N)c1 Amb17202029 [0,2,0,0,0,0|2,0,0]=4 6788 B13R1.466 CONC(=O)c1ccc(Br)c(F)c1 Amb11600891 [0,2,0,0,0,0|2,0,0]=4 6789 B13R1.466 CONC(=O)c1ccc(C)c(C)c1 Amb10704851 [0,2,0,0,0,0|2,0,0]=4 6790 B13R1.466 CONC(=O)c1ccc(C)c(F)c1 Amb10704856 [0,2,0,0,0,0|2,0,0]=4 6791 B13R1.466 CONC(=O)c1ccc(C)c(I)c1 Amb19473098 [0,2,0,0,0,0|2,0,0]=4 6792 B13R1.466 CONC(=O)c1ccc(Cl)c(I)c1 Amb28138213 [0,2,0,0,0,0|2,0,0]=4 6793 B13R1.466 CONC(=O)c1ccc(F)c(Cl)c1 Amb28203583 [0,2,0,0,0,0|2,0,0]=4 6794 B13R1.466 CONC(=O)c1ccc(F)c(I)c1 Amb27823785 [0,2,0,0,0,0|2,0,0]=4 6795 B13R1.466 CONC(=O)c1ccc(F)c(N)c1 Amb26026775 [0,2,0,0,0,0|2,0,0]=4 6796 B13R1.466 CONC(=O)c1ccc(I)c(Br)c1 Amb27651389 [0,2,0,0,0,0|2,0,0]=4 6797 B13R1.466 CONC(=O)c1ccc(I)c(C)c1 Amb19477393 [0,2,0,0,0,0|2,0,0]=4 6798 B13R1.466 CONC(=O)c1ccc(I)c(F)c1 Amb19480405 [0,2,0,0,0,0|2,0,0]=4 6799 B13R1.466 CSCC(=O)c1ccc(C)c(C)c1 Amb18321258 [0,2,0,0,0,0|2,0,0]=4 6800 B13R1.466 CSCC(=O)c1ccc(C)c(Cl)c1 Amb27272973 [0,2,0,0,0,0|2,0,0]=4 6801 B13R1.466 CSCC(=O)c1ccc(Cl)c(Br)c1 Amb28048412 [0,2,0,0,0,0|2,0,0]=4 6802 B13R1.466 CSCC(=O)c1ccc(Cl)c(Cl)c1 Amb25995965 [0,2,0,0,0,0|2,0,0]=4 6803 B13R1.466 CSCC(=O)c1ccc(Cl)c(F)c1 Amb28061984 [0,2,0,0,0,0|2,0,0]=4 6804 B13R1.466 CSCC(=O)c1ccc(F)c(Br)c1 Amb27252700 [0,2,0,0,0,0|2,0,0]=4 6805 B13R1.466 CSCC(=O)c1ccc(F)c(F)c1 Amb26422158 [0,2,0,0,0,0|2,0,0]=4 6806 B13R1.466 CSCC(=O)c1ccc(I)c(Cl)c1 Amb28457013 [0,2,0,0,0,0|2,0,0]=4 6807 B13R1.466 CSCC(=O)c1ccc(O)c(O)c1 Amb18321908 [0,2,0,0,0,0|2,0,0]=4 6808 B13R1.466 C[NH2+]CC(=O)c1ccc(O)c(O)c1 Amb24113842 [0,2,0,0,0,0|2,0,0]=4 6809 B13R1.466 C[NH2+]CC(=O)c1ccc(O)c(O)c1 Amb3990140 [0,2,0,0,0,0|2,0,0]=4 6810 B13R1.466 C\C=C\C(=O)c1ccc(Br)c(Cl)c1 Amb27588247 [0,2,0,0,0,0|1,0,1]=4 6811 B13R1.466 C\C=C\C(=O)c1ccc(Br)c(F)c1 Amb27164433 [0,2,0,0,0,0|1,0,1]=4 6812 B13R1.466 C\C=C\C(=O)c1ccc(Cl)c(C)c1 Amb26346858 [0,2,0,0,0,0|1,0,1]=4 6813 B13R1.466 C\C=C\C(=O)c1ccc(O)c(O)c1 Amb18128091 [0,2,0,0,0,0|1,0,1]=4 6814 B13R1.466 Cc1cc(C(=O)CCBr)ccc1Br Amb24426339 [0,2,0,0,0,0|2,0,0]=4 6815 B13R1.466 Cc1cc(C(=O)CCBr)ccc1Cl Amb17437875 [0,2,0,0,0,0|2,0,0]=4 6816 B13R1.466 Cc1cc(C(=O)CCBr)ccc1F Amb17437901 [0,2,0,0,0,0|2,0,0]=4 6817 B13R1.466 Cc1cc(C(=O)CCBr)ccc1I Amb24382171 [0,2,0,0,0,0|2,0,0]=4 6818 B13R1.466 Cc1cc(C(=O)CCBr)ccc1N Amb27209256 [0,2,0,0,0,0|2,0,0]=4 6819 B13R1.466 Cc1cc(C(=O)CCBr)ccc1O Amb27199957 [0,2,0,0,0,0|2,0,0]=4 6820 B13R1.466 Cc1cc(C(=O)CCCl)ccc1Cl Amb17109160 [0,2,0,0,0,0|2,0,0]=4 6821 B13R1.466 Cc1cc(C(=O)CCCl)ccc1F Amb17109193 [0,2,0,0,0,0|2,0,0]=4 6822 B13R1.466 Cc1cc(C(=O)CCCl)ccc1I Amb25099023 [0,2,0,0,0,0|2,0,0]=4 6823 B13R1.466 Cc1cc(C(=O)CCCl)ccc1N Amb26645392 [0,2,0,0,0,0|2,0,0]=4 6824 B13R1.466 Cc1cc(C(=O)CCCl)ccc1O Amb27179191 [0,2,0,0,0,0|2,0,0]=4 6825 B13R1.466 Cc1cc(C(=O)CCN)ccc1Br Amb33332373 [0,2,0,0,0,0|2,0,0]=4 6826 B13R1.466 Cc1cc(C(=O)CCN)ccc1Cl Amb18105611 [0,2,0,0,0,0|2,0,0]=4 6827 B13R1.466 Cc1cc(C(=O)CCN)ccc1F Amb17194545 [0,2,0,0,0,0|2,0,0]=4 6828 B13R1.466 Cc1cc(C(=O)CCN)ccc1O Amb27399741 [0,2,0,0,0,0|2,0,0]=4 6829 B13R1.466 Cc1cc(C(=O)CCO)ccc1F Amb18066061 [0,2,0,0,0,0|2,0,0]=4 6830 B13R1.466 Cc1cc(C(=O)CCS)ccc1F Amb17402256 [0,2,0,0,0,0|2,0,0]=4 6831 B13R1.466 Cc1ccc(C(=O)CCBr)cc1C Amb17437862 [0,2,0,0,0,0|2,0,0]=4 6832 B13R1.466 Cc1ccc(C(=O)CCBr)cc1I Amb28400223 [0,2,0,0,0,0|2,0,0]=4 6833 B13R1.466 Cc1ccc(C(=O)CCBr)cc1N Amb24679225 [0,2,0,0,0,0|2,0,0]=4 6834 B13R1.466 Cc1ccc(C(=O)CCBr)cc1O Amb27636258 [0,2,0,0,0,0|2,0,0]=4 6835 B13R1.466 Cc1ccc(C(=O)CCCl)cc1Br Amb17358597 [0,2,0,0,0,0|2,0,0]=4 6836 B13R1.466 Cc1ccc(C(=O)CCCl)cc1C Amb17109230 [0,2,0,0,0,0|2,0,0]=4 6837 B13R1.466 Cc1ccc(C(=O)CCCl)cc1Cl Amb28119057 [0,2,0,0,0,0|2,0,0]=4 6838 B13R1.466 Cc1ccc(C(=O)CCCl)cc1F Amb25804266 [0,2,0,0,0,0|2,0,0]=4 6839 B13R1.466 Cc1ccc(C(=O)CCCl)cc1I Amb25771854 [0,2,0,0,0,0|2,0,0]=4 6840 B13R1.466 Cc1ccc(C(=O)CCCl)cc1N Amb25270772 [0,2,0,0,0,0|2,0,0]=4 6841 B13R1.466 Cc1ccc(C(=O)CCCl)cc1O Amb25920093 [0,2,0,0,0,0|2,0,0]=4 6842 B13R1.466 Cc1ccc(C(=O)CCCl)cc1S Amb26989092 [0,2,0,0,0,0|2,0,0]=4 6843 B13R1.466 Cc1ccc(C(=O)CCN)cc1Br Amb33334972 [0,2,0,0,0,0|2,0,0]=4 6844 B13R1.466 Cc1ccc(C(=O)CCN)cc1C Amb17194509 [0,2,0,0,0,0|2,0,0]=4 6845 B13R1.466 Cc1ccc(C(=O)CCN)cc1Cl Amb26455908 [0,2,0,0,0,0|2,0,0]=4 6846 B13R1.466 Cc1ccc(C(=O)CCN)cc1F Amb26022701 [0,2,0,0,0,0|2,0,0]=4 6847 B13R1.466 Cc1ccc(C(=O)CCN)cc1O Amb33372655 [0,2,0,0,0,0|2,0,0]=4 6848 B13R1.466 Cc1ccc(C(=O)CCO)cc1C Amb18065758 [0,2,0,0,0,0|2,0,0]=4 6849 B13R1.466 Cc1ccc(C(=O)CCS)cc1C Amb17401971 [0,2,0,0,0,0|2,0,0]=4 6850 B13R1.466 NCCC(=O)c1ccc(Br)c(Cl)c1 Amb33389386 [0,2,0,0,0,0|2,0,0]=4 6851 B13R1.466 NCCC(=O)c1ccc(Br)c(F)c1 Amb33007267 [0,2,0,0,0,0|2,0,0]=4 6852 B13R1.466 NCCC(=O)c1ccc(Cl)c(Br)c1 Amb33335330 [0,2,0,0,0,0|2,0,0]=4 6853 B13R1.466 NCCC(=O)c1ccc(Cl)c(Cl)c1 Amb18623874 [0,2,0,0,0,0|2,0,0]=4 6854 B13R1.466 NCCC(=O)c1ccc(F)c(Br)c1 Amb33389459 [0,2,0,0,0,0|2,0,0]=4 6855 B13R1.466 NCCC(=O)c1ccc(F)c(Cl)c1 Amb18244117 [0,2,0,0,0,0|2,0,0]=4 6856 B13R1.466 NCCC(=O)c1ccc(F)c(F)c1 Amb17194570 [0,2,0,0,0,0|2,0,0]=4 6857 B13R1.466 NCCC(=O)c1ccc(O)c(Br)c1 Amb33388525 [0,2,0,0,0,0|2,0,0]=4 6858 B13R1.466 NCCC(=O)c1ccc(O)c(Cl)c1 Amb27813136 [0,2,0,0,0,0|2,0,0]=4 6859 B13R1.466 NCCC(=O)c1ccc(O)c(F)c1 Amb28044931 [0,2,0,0,0,0|2,0,0]=4 6860 B13R1.466 NCCC(=O)c1ccc(O)c(O)c1 Amb26644177 [0,2,0,0,0,0|2,0,0]=4 6861 B13R1.466 Nc1cc(C(=O)CCBr)ccc1Br Amb26424507 [0,2,0,0,0,0|2,0,0]=4 6862 B13R1.466 Nc1cc(C(=O)CCBr)ccc1Cl Amb27613748 [0,2,0,0,0,0|2,0,0]=4 6863 B13R1.466 Nc1cc(C(=O)CCBr)ccc1I Amb27613685 [0,2,0,0,0,0|2,0,0]=4 6864 B13R1.466 Nc1cc(C(=O)CCCl)ccc1Br Amb27192593 [0,2,0,0,0,0|2,0,0]=4 6865 B13R1.466 Nc1cc(C(=O)CCCl)ccc1S Amb28251304 [0,2,0,0,0,0|2,0,0]=4 6866 B13R1.466 Nc1ccc(C(=O)CCBr)cc1Br Amb27615940 [0,2,0,0,0,0|2,0,0]=4 6867 B13R1.466 Nc1ccc(C(=O)CCBr)cc1F Amb28286910 [0,2,0,0,0,0|2,0,0]=4 6868 B13R1.466 Nc1ccc(C(=O)CCBr)cc1I Amb27967516 [0,2,0,0,0,0|2,0,0]=4 6869 B13R1.466 Nc1ccc(C(=O)CCBr)cc1N Amb27200742 [0,2,0,0,0,0|2,0,0]=4 6870 B13R1.466 Nc1ccc(C(=O)CCCl)cc1Br Amb24566647 [0,2,0,0,0,0|2,0,0]=4 6871 B13R1.466 Nc1ccc(C(=O)CCCl)cc1F Amb27624828 [0,2,0,0,0,0|2,0,0]=4 6872 B13R1.466 Nc1ccc(C(=O)CCCl)cc1I Amb27846977 [0,2,0,0,0,0|2,0,0]=4 6873 B13R1.466 Nc1ccc(C(=O)CCCl)cc1N Amb17202032 [0,2,0,0,0,0|2,0,0]=4 6874 B13R1.466 O=C(CCBr)c1ccc(Br)c(Br)c1 Amb27181143 [0,2,0,0,0,0|2,0,0]=4 6875 B13R1.466 O=C(CCBr)c1ccc(Br)c(Cl)c1 Amb26905238 [0,2,0,0,0,0|2,0,0]=4 6876 B13R1.466 O=C(CCBr)c1ccc(Br)c(F)c1 Amb25732374 [0,2,0,0,0,0|2,0,0]=4 6877 B13R1.466 O=C(CCBr)c1ccc(Br)c(I)c1 Amb25155358 [0,2,0,0,0,0|2,0,0]=4 6878 B13R1.466 O=C(CCBr)c1ccc(Br)c(O)c1 Amb25068997 [0,2,0,0,0,0|2,0,0]=4 6879 B13R1.466 O=C(CCBr)c1ccc(Cl)c(Br)c1 Amb25131203 [0,2,0,0,0,0|2,0,0]=4 6880 B13R1.466 O=C(CCBr)c1ccc(Cl)c(Cl)c1 Amb17437916 [0,2,0,0,0,0|2,0,0]=4 6881 B13R1.466 O=C(CCBr)c1ccc(Cl)c(F)c1 Amb26352480 [0,2,0,0,0,0|2,0,0]=4 6882 B13R1.466 O=C(CCBr)c1ccc(Cl)c(I)c1 Amb26004940 [0,2,0,0,0,0|2,0,0]=4 6883 B13R1.466 O=C(CCBr)c1ccc(Cl)c(O)c1 Amb25288974 [0,2,0,0,0,0|2,0,0]=4 6884 B13R1.466 O=C(CCBr)c1ccc(Cl)c(S)c1 Amb27428177 [0,2,0,0,0,0|2,0,0]=4 6885 B13R1.466 O=C(CCBr)c1ccc(F)c(Br)c1 Amb27238678 [0,2,0,0,0,0|2,0,0]=4 6886 B13R1.466 O=C(CCBr)c1ccc(F)c(Cl)c1 Amb26001655 [0,2,0,0,0,0|2,0,0]=4 6887 B13R1.466 O=C(CCBr)c1ccc(F)c(F)c1 Amb17437923 [0,2,0,0,0,0|2,0,0]=4 6888 B13R1.466 O=C(CCBr)c1ccc(F)c(I)c1 Amb27462065 [0,2,0,0,0,0|2,0,0]=4 6889 B13R1.466 O=C(CCBr)c1ccc(F)c(S)c1 Amb26988089 [0,2,0,0,0,0|2,0,0]=4 6890 B13R1.466 O=C(CCBr)c1ccc(I)c(Cl)c1 Amb25103233 [0,2,0,0,0,0|2,0,0]=4 6891 B13R1.466 O=C(CCBr)c1ccc(I)c(F)c1 Amb28123477 [0,2,0,0,0,0|2,0,0]=4 6892 B13R1.466 O=C(CCBr)c1ccc(I)c(I)c1 Amb25981626 [0,2,0,0,0,0|2,0,0]=4 6893 B13R1.466 O=C(CCBr)c1ccc(I)c(O)c1 Amb27771489 [0,2,0,0,0,0|2,0,0]=4 6894 B13R1.466 O=C(CCBr)c1ccc(I)c(S)c1 Amb27199554 [0,2,0,0,0,0|2,0,0]=4 6895 B13R1.466 O=C(CCBr)c1ccc(O)c(Br)c1 Amb25109553 [0,2,0,0,0,0|2,0,0]=4 6896 B13R1.466 O=C(CCBr)c1ccc(O)c(Cl)c1 Amb26867990 [0,2,0,0,0,0|2,0,0]=4 6897 B13R1.466 O=C(CCBr)c1ccc(O)c(F)c1 Amb26355971 [0,2,0,0,0,0|2,0,0]=4 6898 B13R1.466 O=C(CCBr)c1ccc(O)c(I)c1 Amb24658731 [0,2,0,0,0,0|2,0,0]=4 6899 B13R1.466 O=C(CCBr)c1ccc(O)c(O)c1 Amb18136877 [0,2,0,0,0,0|2,0,0]=4 6900 B13R1.466 O=C(CCBr)c1ccc(O)c(S)c1 Amb27423603 [0,2,0,0,0,0|2,0,0]=4 6901 B13R1.466 O=C(CCBr)c1ccc(S)c(Br)c1 Amb27642712 [0,2,0,0,0,0|2,0,0]=4 6902 B13R1.466 O=C(CCBr)c1ccc(S)c(Cl)c1 Amb27670193 [0,2,0,0,0,0|2,0,0]=4 6903 B13R1.466 O=C(CCBr)c1ccc(S)c(F)c1 Amb27964624 [0,2,0,0,0,0|2,0,0]=4 6904 B13R1.466 O=C(CCBr)c1ccc(S)c(I)c1 Amb26005453 [0,2,0,0,0,0|2,0,0]=4 6905 B13R1.466 O=C(CCBr)c1ccc(S)c(O)c1 Amb27423604 [0,2,0,0,0,0|2,0,0]=4 6906 B13R1.466 O=C(CCCl)c1ccc(Br)c(Br)c1 Amb27441118 [0,2,0,0,0,0|2,0,0]=4 6907 B13R1.466 O=C(CCCl)c1ccc(Br)c(Cl)c1 Amb25376944 [0,2,0,0,0,0|2,0,0]=4 6908 B13R1.466 O=C(CCCl)c1ccc(Br)c(I)c1 Amb26532859 [0,2,0,0,0,0|2,0,0]=4 6909 B13R1.466 O=C(CCCl)c1ccc(Cl)c(Br)c1 Amb17371796 [0,2,0,0,0,0|2,0,0]=4 6910 B13R1.466 O=C(CCCl)c1ccc(Cl)c(Cl)c1 Amb17198800 [0,2,0,0,0,0|2,0,0]=4 6911 B13R1.466 O=C(CCCl)c1ccc(Cl)c(F)c1 Amb24461725 [0,2,0,0,0,0|2,0,0]=4 6912 B13R1.466 O=C(CCCl)c1ccc(Cl)c(I)c1 Amb25154874 [0,2,0,0,0,0|2,0,0]=4 6913 B13R1.466 O=C(CCCl)c1ccc(Cl)c(O)c1 Amb27177351 [0,2,0,0,0,0|2,0,0]=4 6914 B13R1.466 O=C(CCCl)c1ccc(F)c(Br)c1 Amb17361081 [0,2,0,0,0,0|2,0,0]=4 6915 B13R1.466 O=C(CCCl)c1ccc(F)c(Cl)c1 Amb25252942 [0,2,0,0,0,0|2,0,0]=4 6916 B13R1.466 O=C(CCCl)c1ccc(F)c(F)c1 Amb17194890 [0,2,0,0,0,0|2,0,0]=4 6917 B13R1.466 O=C(CCCl)c1ccc(F)c(I)c1 Amb25800207 [0,2,0,0,0,0|2,0,0]=4 6918 B13R1.466 O=C(CCCl)c1ccc(F)c(S)c1 Amb27423709 [0,2,0,0,0,0|2,0,0]=4 6919 B13R1.466 O=C(CCCl)c1ccc(I)c(Br)c1 Amb27962542 [0,2,0,0,0,0|2,0,0]=4 6920 B13R1.466 O=C(CCCl)c1ccc(I)c(Cl)c1 Amb27462091 [0,2,0,0,0,0|2,0,0]=4 6921 B13R1.466 O=C(CCCl)c1ccc(I)c(F)c1 Amb24678889 [0,2,0,0,0,0|2,0,0]=4 6922 B13R1.466 O=C(CCCl)c1ccc(I)c(O)c1 Amb26636166 [0,2,0,0,0,0|2,0,0]=4 6923 B13R1.466 O=C(CCCl)c1ccc(I)c(S)c1 Amb27796433 [0,2,0,0,0,0|2,0,0]=4 6924 B13R1.466 O=C(CCCl)c1ccc(O)c(Br)c1 Amb24666835 [0,2,0,0,0,0|2,0,0]=4 6925 B13R1.466 O=C(CCCl)c1ccc(O)c(Cl)c1 Amb25941275 [0,2,0,0,0,0|2,0,0]=4 6926 B13R1.466 O=C(CCCl)c1ccc(O)c(F)c1 Amb25328407 [0,2,0,0,0,0|2,0,0]=4 6927 B13R1.466 O=C(CCCl)c1ccc(O)c(I)c1 Amb27793515 [0,2,0,0,0,0|2,0,0]=4 6928 B13R1.466 O=C(CCCl)c1ccc(S)c(O)c1 Amb27423606 [0,2,0,0,0,0|2,0,0]=4 6929 B13R1.466 O=C(CCO)c1ccc(Cl)c(Cl)c1 Amb24397009 [0,2,0,0,0,0|2,0,0]=4 6930 B13R1.466 O=C(CCO)c1ccc(F)c(Cl)c1 Amb25699935 [0,2,0,0,0,0|2,0,0]=4 6931 B13R1.466 O=C(CCO)c1ccc(F)c(F)c1 Amb18564363 [0,2,0,0,0,0|2,0,0]=4 6932 B13R1.1511 C=C(OCC)c1ccc(C)cc1N Amb33135843 [0,2,0,0,0,0|1,0,0]=3 6933 B13R1.1511 C=C(OCC)c1ccc(C)cc1O Amb33135982 [0,2,0,0,0,0|1,0,0]=3 6934 B13R1.1511 C=C(OCC)c1ccc(C)nc1N Amb33136122 [0,2,0,0,0,0|2,0,0]=4 6935 B13R1.1511 C=C(OCC)c1ccc(Cl)cc1N Amb33136113 [0,2,0,0,0,0|1,0,0]=3 6936 B13R1.1511 C=C(OCC)c1ccc(F)cc1N Amb33135851 [0,2,0,0,0,0|1,0,0]=3 6937 B13R1.1511 C=C(OCC)c1ccc(F)cc1O Amb33135970 [0,2,0,0,0,0|1,0,0]=3 6938 B13R1.1511 C=C(OCC)c1ccc(N)cc1C Amb33135975 [0,2,0,0,0,0|1,0,0]=3 6939 B13R1.1511 C=C(OCC)c1ccc(N)cc1Cl Amb33135855 [0,2,0,0,0,0|1,0,0]=3 6940 B13R1.1511 C=C(OCC)c1ccc(N)cc1F Amb33136002 [0,2,0,0,0,0|1,0,0]=3 6941 B13R1.1511 C=C(OCC)c1ccc(N)nc1C Amb33135844 [0,2,0,0,0,0|2,0,0]=4 6942 B13R1.1511 C=C(OCC)c1ccc(O)cc1C Amb33135803 [0,2,0,0,0,0|1,0,0]=3 6943 B13R1.1511 C=C(OCC)c1ccc(O)cc1F Amb33136106 [0,2,0,0,0,0|1,0,0]=3 6944 B13R1.1511 C=C(OCC)c1cnc(N)cc1C Amb33135847 [0,2,0,0,0,0|2,0,0]=4 6945 B13R1.1511 C=C(OCC)c1ncc(C)cc1N Amb33136059 [0,2,0,0,0,0|2,0,0]=4 6946 B13R1.1511 C=C(OCC)c1ncc(Cl)cc1N Amb33136307 [0,2,0,0,0,0|2,0,0]=4 6947 B13R1.1511 C=C(OCC)c1ncc(N)cc1C Amb33135846 [0,2,0,0,0,0|2,0,0]=4 6948 B13R1.1511 C=COC(=O)c1ccc(N)cc1O Amb27401901 [0,2,0,0,0,0|0,0,2]=4 6949 B13R1.1511 CCCC(=O)c1ccc(Br)cc1Br Amb28317192 [0,2,0,0,0,0|1,0,0]=3 6950 B13R1.1511 CCCC(=O)c1ccc(Br)cc1C Amb17348645 [0,2,0,0,0,0|1,0,0]=3 6951 B13R1.1511 CCCC(=O)c1ccc(Br)cc1F Amb20171340 [0,2,0,0,0,0|1,0,0]=3 6952 B13R1.1511 CCCC(=O)c1ccc(C)cc1Br Amb17348644 [0,2,0,0,0,0|1,0,0]=3 6953 B13R1.1511 CCCC(=O)c1ccc(C)cc1C Amb9214221 [0,2,0,0,0,0|1,0,0]=3 6954 B13R1.1511 CCCC(=O)c1ccc(Cl)cc1Br Amb28317496 [0,2,0,0,0,0|1,0,0]=3 6955 B13R1.1511 CCCC(=O)c1ccc(Cl)cc1C Amb17337142 [0,2,0,0,0,0|1,0,0]=3 6956 B13R1.1511 CCCC(=O)c1ccc(Cl)cc1Cl Amb8393598 [0,2,0,0,0,0|1,0,0]=3 6957 B13R1.1511 CCCC(=O)c1ccc(Cl)cc1O Amb18130566 [0,2,0,0,0,0|1,0,0]=3 6958 B13R1.1511 CCCC(=O)c1ccc(F)cc1C Amb18184741 [0,2,0,0,0,0|1,0,0]=3 6959 B13R1.1511 CCCC(=O)c1ccc(F)cc1F Amb8850024 [0,2,0,0,0,0|1,0,0]=3 6960 B13R1.1511 CCCC(=O)c1ccc(N)cc1Br Amb27451787 [0,2,0,0,0,0|1,0,0]=3 6961 B13R1.1511 CCCC(=O)c1ccc(O)cc1C Amb18554274 [0,2,0,0,0,0|1,0,0]=3 6962 B13R1.1511 CCCC(=O)c1ccc(O)cc1Cl Amb18057543 [0,2,0,0,0,0|1,0,0]=3 6963 B13R1.1511 CCCC(=O)c1ccc(O)cc1O Amb9794812 [0,2,0,0,0,0|1,0,0]=3 6964 B13R1.1511 CCCC(=O)c1ncc(C)cc1C Amb27754893 [0,2,0,0,0,0|2,0,0]=4 6965 B13R1.1511 CCCS(=O)c1ccc(C)cc1N Amb27608749 [0,2,0,0,0,0|2,0,0]=4 6966 B13R1.1511 CCCS(=O)c1ccc(N)cc1C Amb27608750 [0,2,0,0,0,0|2,0,0]=4 6967 B13R1.1511 CCNC(=N)c1ccc(Br)cc1C Amb28316635 [0,2,0,0,0,0|2,0,0]=4 6968 B13R1.1511 CCNC(=N)c1ccc(C)cc1Br Amb27480602 [0,2,0,0,0,0|2,0,0]=4 6969 B13R1.1511 CCNC(=N)c1ccc(Cl)cc1O Amb27666827 [0,2,0,0,0,0|2,0,0]=4 6970 B13R1.1511 CCNC(=O)c1ccc(Br)cc1Br Amb28317199 [0,2,0,0,0,0|1,0,0]=3 6971 B13R1.1511 CCNC(=O)c1ccc(Br)cc1C Amb26483133 [0,2,0,0,0,0|1,0,0]=3 6972 B13R1.1511 CCNC(=O)c1ccc(Br)cc1Cl Amb25052607 [0,2,0,0,0,0|1,0,0]=3 6973 B13R1.1511 CCNC(=O)c1ccc(Br)cc1F Amb6257650 [0,2,0,0,0,0|1,0,0]=3 6974 B13R1.1511 CCNC(=O)c1ccc(Br)cc1O Amb11584905 [0,2,0,0,0,0|1,0,0]=3 6975 B13R1.1511 CCNC(=O)c1ccc(Br)nc1C Amb27598385 [0,2,0,0,0,0|2,0,0]=4 6976 B13R1.1511 CCNC(=O)c1ccc(C)cc1C Amb3747534 [0,2,0,0,0,0|1,0,0]=3 6977 B13R1.1511 CCNC(=O)c1ccc(C)cc1Cl Amb19531816 [0,2,0,0,0,0|1,0,0]=3 6978 B13R1.1511 CCNC(=O)c1ccc(C)nc1Br Amb27804842 [0,2,0,0,0,0|2,0,0]=4 6979 B13R1.1511 CCNC(=O)c1ccc(C)nc1C Amb28317745 [0,2,0,0,0,0|2,0,0]=4 6980 B13R1.1511 CCNC(=O)c1ccc(C)nc1Cl Amb26964662 [0,2,0,0,0,0|2,0,0]=4 6981 B13R1.1511 CCNC(=O)c1ccc(C)nc1N Amb35648601 [0,2,0,0,0,0|2,0,0]=4 6982 B13R1.1511 CCNC(=O)c1ccc(Cl)cc1Br Amb28370303 [0,2,0,0,0,0|1,0,0]=3 6983 B13R1.1511 CCNC(=O)c1ccc(Cl)cc1C Amb27489616 [0,2,0,0,0,0|1,0,0]=3 6984 B13R1.1511 CCNC(=O)c1ccc(Cl)cc1Cl Amb6347123 [0,2,0,0,0,0|1,0,0]=3 6985 B13R1.1511 CCNC(=O)c1ccc(Cl)cc1N Amb1121355 [0,2,0,0,0,0|1,0,0]=3 6986 B13R1.1511 CCNC(=O)c1ccc(Cl)cc1O Amb6671668 [0,2,0,0,0,0|1,0,0]=3 6987 B13R1.1511 CCNC(=O)c1ccc(F)cc1Br Amb6266445 [0,2,0,0,0,0|1,0,0]=3 6988 B13R1.1511 CCNC(=O)c1ccc(F)cc1Cl Amb6511485 [0,2,0,0,0,0|1,0,0]=3 6989 B13R1.1511 CCNC(=O)c1ccc(F)cc1F Amb931354 [0,2,0,0,0,0|1,0,0]=3 6990 B13R1.1511 CCNC(=O)c1ccc(F)cc1I Amb11335177 [0,2,0,0,0,0|1,0,0]=3 6991 B13R1.1511 CCNC(=O)c1ccc(F)cc1O Amb28367223 [0,2,0,0,0,0|1,0,0]=3 6992 B13R1.1511 CCNC(=O)c1ccc(I)cc1Cl Amb27205935 [0,2,0,0,0,0|1,0,0]=3 6993 B13R1.1511 CCNC(=O)c1ccc(N)cc1Cl Amb1120144 [0,2,0,0,0,0|1,0,0]=3 6994 B13R1.1511 CCNC(=O)c1ccc(N)cc1Cl Amb13949225 [0,2,0,0,0,0|1,0,0]=3 6995 B13R1.1511 CCNC(=O)c1ccc(N)cc1F Amb18956449 [0,2,0,0,0,0|1,0,0]=3 6996 B13R1.1511 CCNC(=O)c1ccc(N)cc1O Amb25269366 [0,2,0,0,0,0|1,0,0]=3 6997 B13R1.1511 CCNC(=O)c1ccc(O)cc1C Amb27755192 [0,2,0,0,0,0|1,0,0]=3 6998 B13R1.1511 CCNC(=O)c1ccc(O)cc1O Amb27949589 [0,2,0,0,0,0|1,0,0]=3 6999 B13R1.1511 CCNC(=O)c1ccc(O)nc1C Amb28051416 [0,2,0,0,0,0|2,0,0]=4 7000 B13R1.1511 CCNC(=O)c1ncc(Br)cc1Br Amb28185758 [0,2,0,0,0,0|2,0,0]=4 7001 B13R1.1511 CCNC(=O)c1ncc(C)cc1O Amb27451834 [0,2,0,0,0,0|2,0,0]=4 7002 B13R1.1511 CCNC(=S)c1ccc(C)cc1N Amb27415515 [0,2,0,0,0,0|1,1,0]=4 7003 B13R1.1511 CCNC(=S)c1ccc(Cl)cc1F Amb27427161 [0,2,0,0,0,0|1,1,0]=4 7004 B13R1.1511 CCNC(=S)c1ccc(O)cc1C Amb27772021 [0,2,0,0,0,0|1,1,0]=4 7005 B13R1.1511 CCNC(=S)c1ccc(O)cc1O Amb27259382 [0,2,0,0,0,0|1,1,0]=4 7006 B13R1.1511 CCOC(=N)c1ccc(Br)cc1Cl Amb27463240 [0,2,0,0,0,0|1,0,0]=3 7007 B13R1.1511 CCOC(=N)c1ccc(C)cc1Cl Amb30013091 [0,2,0,0,0,0|1,0,0]=3 7008 B13R1.1511 CCOC(=N)c1ccc(Cl)cc1C Amb28366581 [0,2,0,0,0,0|1,0,0]=3 7009 B13R1.1511 CCOC(=N)c1ccc(Cl)cc1Cl Amb25081253 [0,2,0,0,0,0|1,0,0]=3 7010 B13R1.1511 CCOC(=N)c1ccc(Cl)cc1Cl Amb32648409 [0,2,0,0,0,0|1,0,0]=3 7011 B13R1.1511 CCOC(=N)c1ccc(F)cc1Br Amb27259472 [0,2,0,0,0,0|1,0,0]=3 7012 B13R1.1511 CCOC(=N)c1ccc(F)cc1F Amb28250793 [0,2,0,0,0,0|1,0,0]=3 7013 B13R1.1511 CCOC(=N)c1ccc(O)cc1Cl Amb28076056 [0,2,0,0,0,0|1,0,0]=3 7014 B13R1.1511 CCOC(=N)c1ccc(O)cc1F Amb35688533 [0,2,0,0,0,0|1,0,0]=3 7015 B13R1.1511 CCOC(=O)C1=C(C)NC(=O)C=C1 Amb19958715 [0,2,0,0,0,0|1,0,0]=3 7016 B13R1.1511 CCOC(=O)C1=C(C)NC(=S)N=C1 Amb22756914 [0,2,0,0,0,0|2,0,0]=4 7017 B13R1.1511 CCOC(=O)C1=C(N)NC(=O)N=C1 Amb19752969 [0,2,0,0,0,0|2,0,0]=4 7018 B13R1.1511 CCOC(=O)C1=C(N)NC(=S)N=C1 Amb19812342 [0,2,0,0,0,0|2,0,0]=4 7019 B13R1.1511 CCOC(=O)C1=CN=C(C)NC1=O Amb17993355 [0,2,0,0,0,0|2,0,0]=4 7020 B13R1.1511 CCOC(=O)C1=CN=C(N)NC1=O Amb18984540 [0,2,0,0,0,0|2,0,0]=4 7021 B13R1.1511 CCOC(=O)C1=CN=C(S)NC1=O Amb20308298 [0,2,0,0,0,0|2,0,0]=4 7022 B13R1.1511 CCOC(=O)C1=CNC(=O)C=C1O Amb22411537 [0,2,0,0,0,0|1,0,0]=3 7023 B13R1.1511 CCOC(=O)C1=CNC(=O)N=C1C Amb22435952 [0,2,0,0,0,0|2,0,0]=4 7024 B13R1.1511 CCOC(=O)C1=CNC(=O)N=C1O Amb19958290 [0,2,0,0,0,0|2,0,0]=4 7025 B13R1.1511 CCOC(=O)C1=CNC(=O)NC1=O Amb20179331 [0,2,0,0,0,0|2,0,0]=4 7026 B13R1.1511 CCOC(=O)C1=CNC(=O)NC1=O Amb30640054 [0,2,0,0,0,0|2,0,0]=4 7027 B13R1.1511 CCOC(=O)C1=CNC(=S)N=C1N Amb19816935 [0,2,0,0,0,0|2,0,0]=4 7028 B13R1.1511 CCOC(=O)C1=CNC(=S)NC1=O Amb20654027 [0,2,0,0,0,0|2,0,0]=4 7029 B13R1.1511 CCOC(=O)c1cc[n+]([O-])cc1C Amb28239747 [0,2,0,0,0,0|1,0,0]=3 7030 B13R1.1511 CCOC(=O)c1ccc(Br)cc1Br Amb28138888 [0,2,0,0,0,0|0,0,0]=2 7031 B13R1.1511 CCOC(=O)c1ccc(Br)cc1C Amb9494692 [0,2,0,0,0,0|0,0,0]=2 7032 B13R1.1511 CCOC(=O)c1ccc(Br)cc1Cl Amb9672243 [0,2,0,0,0,0|0,0,0]=2 7033 B13R1.1511 CCOC(=O)c1ccc(Br)cc1F Amb9273943 [0,2,0,0,0,0|0,0,0]=2 7034 B13R1.1511 CCOC(=O)c1ccc(Br)cc1I Amb27230222 [0,2,0,0,0,0|0,0,0]=2 7035 B13R1.1511 CCOC(=O)c1ccc(Br)cc1N Amb18969849 [0,2,0,0,0,0|0,0,0]=2 7036 B13R1.1511 CCOC(=O)c1ccc(Br)cc1O Amb24182177 [0,2,0,0,0,0|0,0,0]=2 7037 B13R1.1511 CCOC(=O)c1ccc(Br)cc1S Amb27265561 [0,2,0,0,0,0|0,0,0]=2 7038 B13R1.1511 CCOC(=O)c1ccc(Br)nc1Br Amb27666332 [0,2,0,0,0,0|1,0,0]=3 7039 B13R1.1511 CCOC(=O)c1ccc(Br)nc1C Amb27397579 [0,2,0,0,0,0|1,0,0]=3 7040 B13R1.1511 CCOC(=O)c1ccc(Br)nc1F Amb27177247 [0,2,0,0,0,0|1,0,0]=3 7041 B13R1.1511 CCOC(=O)c1ccc(Br)nc1N Amb26987804 [0,2,0,0,0,0|1,0,0]=3 7042 B13R1.1511 CCOC(=O)c1ccc(C)cc1Br Amb22285063 [0,2,0,0,0,0|0,0,0]=2 7043 B13R1.1511 CCOC(=O)c1ccc(C)cc1C Amb6357753 [0,2,0,0,0,0|0,0,0]=2 7044 B13R1.1511 CCOC(=O)c1ccc(C)cc1Cl Amb22750097 [0,2,0,0,0,0|0,0,0]=2 7045 B13R1.1511 CCOC(=O)c1ccc(C)cc1F Amb25083067 [0,2,0,0,0,0|0,0,0]=2 7046 B13R1.1511 CCOC(=O)c1ccc(C)cc1N Amb26881316 [0,2,0,0,0,0|0,0,0]=2 7047 B13R1.1511 CCOC(=O)c1ccc(C)nc1Br Amb26572921 [0,2,0,0,0,0|1,0,0]=3 7048 B13R1.1511 CCOC(=O)c1ccc(C)nc1C Amb8389681 [0,2,0,0,0,0|1,0,0]=3 7049 B13R1.1511 CCOC(=O)c1ccc(C)nc1N Amb18128680 [0,2,0,0,0,0|1,0,0]=3 7050 B13R1.1511 CCOC(=O)c1ccc(Cl)cc1Br Amb22001114 [0,2,0,0,0,0|0,0,0]=2 7051 B13R1.1511 CCOC(=O)c1ccc(Cl)cc1C Amb22750095 [0,2,0,0,0,0|0,0,0]=2 7052 B13R1.1511 CCOC(=O)c1ccc(Cl)cc1Cl Amb2725247 [0,2,0,0,0,0|0,0,0]=2 7053 B13R1.1511 CCOC(=O)c1ccc(Cl)cc1F Amb2687803 [0,2,0,0,0,0|0,0,0]=2 7054 B13R1.1511 CCOC(=O)c1ccc(Cl)cc1I Amb27229944 [0,2,0,0,0,0|0,0,0]=2 7055 B13R1.1511 CCOC(=O)c1ccc(Cl)cc1N Amb7755232 [0,2,0,0,0,0|0,0,0]=2 7056 B13R1.1511 CCOC(=O)c1ccc(Cl)cc1O Amb9243024 [0,2,0,0,0,0|0,0,0]=2 7057 B13R1.1511 CCOC(=O)c1ccc(Cl)cc1S Amb27807959 [0,2,0,0,0,0|0,0,0]=2 7058 B13R1.1511 CCOC(=O)c1ccc(Cl)nc1C Amb21856770 [0,2,0,0,0,0|1,0,0]=3 7059 B13R1.1511 CCOC(=O)c1ccc(Cl)nc1Cl Amb8630430 [0,2,0,0,0,0|1,0,0]=3 7060 B13R1.1511 CCOC(=O)c1ccc(Cl)nc1F Amb27665670 [0,2,0,0,0,0|1,0,0]=3 7061 B13R1.1511 CCOC(=O)c1ccc(Cl)nc1N Amb10808728 [0,2,0,0,0,0|1,0,0]=3 7062 B13R1.1511 CCOC(=O)c1ccc(Cl)nc1O Amb26444186 [0,2,0,0,0,0|1,0,0]=3 7063 B13R1.1511 CCOC(=O)c1ccc(F)cc1Br Amb9273652 [0,2,0,0,0,0|0,0,0]=2 7064 B13R1.1511 CCOC(=O)c1ccc(F)cc1C Amb23400332 [0,2,0,0,0,0|0,0,0]=2 7065 B13R1.1511 CCOC(=O)c1ccc(F)cc1Cl Amb9242980 [0,2,0,0,0,0|0,0,0]=2 7066 B13R1.1511 CCOC(=O)c1ccc(F)cc1F Amb2687827 [0,2,0,0,0,0|0,0,0]=2 7067 B13R1.1511 CCOC(=O)c1ccc(F)cc1I Amb24443870 [0,2,0,0,0,0|0,0,0]=2 7068 B13R1.1511 CCOC(=O)c1ccc(F)cc1N Amb22234002 [0,2,0,0,0,0|0,0,0]=2 7069 B13R1.1511 CCOC(=O)c1ccc(F)cc1N Amb7764609 [0,2,0,0,0,0|0,0,0]=2 7070 B13R1.1511 CCOC(=O)c1ccc(F)cc1O Amb16230832 [0,2,0,0,0,0|0,0,0]=2 7071 B13R1.1511 CCOC(=O)c1ccc(F)nc1Br Amb27230121 [0,2,0,0,0,0|1,0,0]=3 7072 B13R1.1511 CCOC(=O)c1ccc(F)nc1C Amb27860188 [0,2,0,0,0,0|1,0,0]=3 7073 B13R1.1511 CCOC(=O)c1ccc(F)nc1Cl Amb27633204 [0,2,0,0,0,0|1,0,0]=3 7074 B13R1.1511 CCOC(=O)c1ccc(F)nc1I Amb27962430 [0,2,0,0,0,0|1,0,0]=3 7075 B13R1.1511 CCOC(=O)c1ccc(F)nc1N Amb23438877 [0,2,0,0,0,0|1,0,0]=3 7076 B13R1.1511 CCOC(=O)c1ccc(F)nc1O Amb25971364 [0,2,0,0,0,0|1,0,0]=3 7077 B13R1.1511 CCOC(=O)c1ccc(I)cc1Br Amb27400561 [0,2,0,0,0,0|0,0,0]=2 7078 B13R1.1511 CCOC(=O)c1ccc(I)cc1Cl Amb19944222 [0,2,0,0,0,0|0,0,0]=2 7079 B13R1.1511 CCOC(=O)c1ccc(I)cc1F Amb16231914 [0,2,0,0,0,0|0,0,0]=2 7080 B13R1.1511 CCOC(=O)c1ccc(I)cc1N Amb24685585 [0,2,0,0,0,0|0,0,0]=2 7081 B13R1.1511 CCOC(=O)c1ccc(I)cc1O Amb28382639 [0,2,0,0,0,0|0,0,0]=2 7082 B13R1.1511 CCOC(=O)c1ccc(N)cc1Br Amb21980117 [0,2,0,0,0,0|0,0,0]=2 7083 B13R1.1511 CCOC(=O)c1ccc(N)cc1C Amb6296565 [0,2,0,0,0,0|0,0,0]=2 7084 B13R1.1511 CCOC(=O)c1ccc(N)cc1Cl Amb844787 [0,2,0,0,0,0|0,0,0]=2 7085 B13R1.1511 CCOC(=O)c1ccc(N)cc1F Amb18982410 [0,2,0,0,0,0|0,0,0]=2 7086 B13R1.1511 CCOC(=O)c1ccc(N)cc1I Amb28188683 [0,2,0,0,0,0|0,0,0]=2 7087 B13R1.1511 CCOC(=O)c1ccc(N)cc1N Amb18291229 [0,2,0,0,0,0|0,0,0]=2 7088 B13R1.1511 CCOC(=O)c1ccc(N)cc1O Amb7762508 [0,2,0,0,0,0|0,0,0]=2 7089 B13R1.1511 CCOC(=O)c1ccc(N)nc1Br Amb24400298 [0,2,0,0,0,0|1,0,0]=3 7090 B13R1.1511 CCOC(=O)c1ccc(N)nc1C Amb28188584 [0,2,0,0,0,0|1,0,0]=3 7091 B13R1.1511 CCOC(=O)c1ccc(N)nc1F Amb26419122 [0,2,0,0,0,0|1,0,0]=3 7092 B13R1.1511 CCOC(=O)c1ccc(O)cc1Br Amb26536483 [0,2,0,0,0,0|0,0,0]=2 7093 B13R1.1511 CCOC(=O)c1ccc(O)cc1C Amb18128611 [0,2,0,0,0,0|0,0,0]=2 7094 B13R1.1511 CCOC(=O)c1ccc(O)cc1Cl Amb22230640 [0,2,0,0,0,0|0,0,0]=2 7095 B13R1.1511 CCOC(=O)c1ccc(O)cc1F Amb23402004 [0,2,0,0,0,0|0,0,0]=2 7096 B13R1.1511 CCOC(=O)c1ccc(O)cc1N Amb27789532 [0,2,0,0,0,0|0,0,0]=2 7097 B13R1.1511 CCOC(=O)c1ccc(O)cc1O Amb2613949 [0,2,0,0,0,0|0,0,0]=2 7098 B13R1.1511 CCOC(=O)c1ccc(O)nc1Br Amb24391800 [0,2,0,0,0,0|1,0,0]=3 7099 B13R1.1511 CCOC(=O)c1ccc(O)nc1Cl Amb24397183 [0,2,0,0,0,0|1,0,0]=3 7100 B13R1.1511 CCOC(=O)c1cnc(Br)cc1C Amb24596060 [0,2,0,0,0,0|1,0,0]=3 7101 B13R1.1511 CCOC(=O)c1cnc(Br)cc1Cl Amb24527981 [0,2,0,0,0,0|1,0,0]=3 7102 B13R1.1511 CCOC(=O)c1cnc(Br)cc1O Amb26381304 [0,2,0,0,0,0|1,0,0]=3 7103 B13R1.1511 CCOC(=O)c1cnc(Br)nc1Br Amb23437100 [0,2,0,0,0,0|2,0,0]=4 7104 B13R1.1511 CCOC(=O)c1cnc(Br)nc1C Amb24624581 [0,2,0,0,0,0|2,0,0]=4 7105 B13R1.1511 CCOC(=O)c1cnc(C)cc1Br Amb28051057 [0,2,0,0,0,0|1,0,0]=3 7106 B13R1.1511 CCOC(=O)c1cnc(C)cc1C Amb25926895 [0,2,0,0,0,0|1,0,0]=3 7107 B13R1.1511 CCOC(=O)c1cnc(C)cc1Cl Amb10604372 [0,2,0,0,0,0|1,0,0]=3 7108 B13R1.1511 CCOC(=O)c1cnc(C)cc1O Amb18128827 [0,2,0,0,0,0|1,0,0]=3 7109 B13R1.1511 CCOC(=O)c1cnc(C)nc1Br Amb26859465 [0,2,0,0,0,0|2,0,0]=4 7110 B13R1.1511 CCOC(=O)c1cnc(C)nc1C Amb10067178 [0,2,0,0,0,0|2,0,0]=4 7111 B13R1.1511 CCOC(=O)c1cnc(C)nc1Cl Amb7172726 [0,2,0,0,0,0|2,0,0]=4 7112 B13R1.1511 CCOC(=O)c1cnc(C)nc1N Amb16230859 [0,2,0,0,0,0|2,0,0]=4 7113 B13R1.1511 CCOC(=O)c1cnc(Cl)cc1C Amb25347366 [0,2,0,0,0,0|1,0,0]=3 7114 B13R1.1511 CCOC(=O)c1cnc(Cl)cc1Cl Amb2609629 [0,2,0,0,0,0|1,0,0]=3 7115 B13R1.1511 CCOC(=O)c1cnc(Cl)cc1N Amb2615452 [0,2,0,0,0,0|1,0,0]=3 7116 B13R1.1511 CCOC(=O)c1cnc(Cl)nc1C Amb10842192 [0,2,0,0,0,0|2,0,0]=4 7117 B13R1.1511 CCOC(=O)c1cnc(Cl)nc1Cl Amb8630925 [0,2,0,0,0,0|2,0,0]=4 7118 B13R1.1511 CCOC(=O)c1cnc(Cl)nc1I Amb28185059 [0,2,0,0,0,0|2,0,0]=4 7119 B13R1.1511 CCOC(=O)c1cnc(Cl)nc1N Amb19957984 [0,2,0,0,0,0|2,0,0]=4 7120 B13R1.1511 CCOC(=O)c1cnc(F)cc1Br Amb28436213 [0,2,0,0,0,0|1,0,0]=3 7121 B13R1.1511 CCOC(=O)c1cnc(F)cc1C Amb25187744 [0,2,0,0,0,0|1,0,0]=3 7122 B13R1.1511 CCOC(=O)c1cnc(F)cc1N Amb27438927 [0,2,0,0,0,0|1,0,0]=3 7123 B13R1.1511 CCOC(=O)c1cnc(F)cc1O Amb27642817 [0,2,0,0,0,0|1,0,0]=3 7124 B13R1.1511 CCOC(=O)c1cnc(F)nc1C Amb34142149 [0,2,0,0,0,0|2,0,0]=4 7125 B13R1.1511 CCOC(=O)c1cnc(I)cc1F Amb27665844 [0,2,0,0,0,0|1,0,0]=3 7126 B13R1.1511 CCOC(=O)c1cnc(I)nc1C Amb27832059 [0,2,0,0,0,0|2,0,0]=4 7127 B13R1.1511 CCOC(=O)c1cnc(N)cc1Br Amb27403703 [0,2,0,0,0,0|1,0,0]=3 7128 B13R1.1511 CCOC(=O)c1cnc(N)cc1C Amb25730996 [0,2,0,0,0,0|1,0,0]=3 7129 B13R1.1511 CCOC(=O)c1cnc(N)cc1Cl Amb25190187 [0,2,0,0,0,0|1,0,0]=3 7130 B13R1.1511 CCOC(=O)c1cnc(N)cc1F Amb27966481 [0,2,0,0,0,0|1,0,0]=3 7131 B13R1.1511 CCOC(=O)c1cnc(N)nc1C Amb2724213 [0,2,0,0,0,0|2,0,0]=4 7132 B13R1.1511 CCOC(=O)c1cnc(N)nc1Cl Amb23437066 [0,2,0,0,0,0|2,0,0]=4 7133 B13R1.1511 CCOC(=O)c1cnc(N)nc1N Amb6761095 [0,2,0,0,0,0|2,0,0]=4 7134 B13R1.1511 CCOC(=O)c1cnc(N)nc1O Amb4001548 [0,2,0,0,0,0|2,0,0]=4 7135 B13R1.1511 CCOC(=O)c1cnc(O)cc1Br Amb25780279 [0,2,0,0,0,0|1,0,0]=3 7136 B13R1.1511 CCOC(=O)c1cnc(O)cc1C Amb18128819 [0,2,0,0,0,0|1,0,0]=3 7137 B13R1.1511 CCOC(=O)c1cnc(O)cc1Cl Amb25058883 [0,2,0,0,0,0|1,0,0]=3 7138 B13R1.1511 CCOC(=O)c1cnc(O)cc1O Amb2610127 [0,2,0,0,0,0|1,0,0]=3 7139 B13R1.1511 CCOC(=O)c1cnc(O)nc1C Amb746629 [0,2,0,0,0,0|2,0,0]=4 7140 B13R1.1511 CCOC(=O)c1cnc(O)nc1N Amb4006551 [0,2,0,0,0,0|2,0,0]=4 7141 B13R1.1511 CCOC(=O)c1cnc(S)nc1C Amb6761091 [0,2,0,0,0,0|2,0,0]=4 7142 B13R1.1511 CCOC(=O)c1cnc(S)nc1N Amb1912368 [0,2,0,0,0,0|2,0,0]=4 7143 B13R1.1511 CCOC(=O)c1cnc(S)nc1O Amb2731593 [0,2,0,0,0,0|2,0,0]=4 7144 B13R1.1511 CCOC(=O)c1cnc([S-])nc1N Amb2303454 [0,2,0,0,0,0|2,0,0]=4 7145 B13R1.1511 CCOC(=O)c1ncc(Br)cc1Br Amb23440929 [0,2,0,0,0,0|1,0,0]=3 7146 B13R1.1511 CCOC(=O)c1ncc(Br)cc1C Amb25076709 [0,2,0,0,0,0|1,0,0]=3 7147 B13R1.1511 CCOC(=O)c1ncc(Br)cc1F Amb23399909 [0,2,0,0,0,0|1,0,0]=3 7148 B13R1.1511 CCOC(=O)c1ncc(Br)cc1N Amb19895092 [0,2,0,0,0,0|1,0,0]=3 7149 B13R1.1511 CCOC(=O)c1ncc(Br)nc1Br Amb25113800 [0,2,0,0,0,0|2,0,0]=4 7150 B13R1.1511 CCOC(=O)c1ncc(Br)nc1C Amb25869299 [0,2,0,0,0,0|2,0,0]=4 7151 B13R1.1511 CCOC(=O)c1ncc(C)cc1Br Amb27861118 [0,2,0,0,0,0|1,0,0]=3 7152 B13R1.1511 CCOC(=O)c1ncc(C)cc1C Amb26519884 [0,2,0,0,0,0|1,0,0]=3 7153 B13R1.1511 CCOC(=O)c1ncc(C)cc1Cl Amb22043821 [0,2,0,0,0,0|1,0,0]=3 7154 B13R1.1511 CCOC(=O)c1ncc(C)cc1N Amb26905745 [0,2,0,0,0,0|1,0,0]=3 7155 B13R1.1511 CCOC(=O)c1ncc(C)cc1O Amb23403493 [0,2,0,0,0,0|1,0,0]=3 7156 B13R1.1511 CCOC(=O)c1ncc(C)nc1C Amb25829425 [0,2,0,0,0,0|2,0,0]=4 7157 B13R1.1511 CCOC(=O)c1ncc(C)nc1O Amb22489778 [0,2,0,0,0,0|2,0,0]=4 7158 B13R1.1511 CCOC(=O)c1ncc(Cl)cc1F Amb22752616 [0,2,0,0,0,0|1,0,0]=3 7159 B13R1.1511 CCOC(=O)c1ncc(Cl)cc1N Amb21964719 [0,2,0,0,0,0|1,0,0]=3 7160 B13R1.1511 CCOC(=O)c1ncc(Cl)cc1O Amb26005121 [0,2,0,0,0,0|1,0,0]=3 7161 B13R1.1511 CCOC(=O)c1ncc(Cl)nc1C Amb27481007 [0,2,0,0,0,0|2,0,0]=4 7162 B13R1.1511 CCOC(=O)c1ncc(Cl)nc1Cl Amb28368403 [0,2,0,0,0,0|2,0,0]=4 7163 B13R1.1511 CCOC(=O)c1ncc(Cl)nc1N Amb22276007 [0,2,0,0,0,0|2,0,0]=4 7164 B13R1.1511 CCOC(=O)c1ncc(F)cc1Br Amb25742500 [0,2,0,0,0,0|1,0,0]=3 7165 B13R1.1511 CCOC(=O)c1ncc(F)cc1C Amb27633324 [0,2,0,0,0,0|1,0,0]=3 7166 B13R1.1511 CCOC(=O)c1ncc(F)cc1Cl Amb24383027 [0,2,0,0,0,0|1,0,0]=3 7167 B13R1.1511 CCOC(=O)c1ncc(F)cc1F Amb25715682 [0,2,0,0,0,0|1,0,0]=3 7168 B13R1.1511 CCOC(=O)c1ncc(F)cc1N Amb27229435 [0,2,0,0,0,0|1,0,0]=3 7169 B13R1.1511 CCOC(=O)c1ncc(F)cc1O Amb27634245 [0,2,0,0,0,0|1,0,0]=3 7170 B13R1.1511 CCOC(=O)c1ncc(I)cc1F Amb24596721 [0,2,0,0,0,0|1,0,0]=3 7171 B13R1.1511 CCOC(=O)c1ncc(N)cc1Br Amb27864425 [0,2,0,0,0,0|1,0,0]=3 7172 B13R1.1511 CCOC(=O)c1ncc(N)cc1C Amb26065833 [0,2,0,0,0,0|1,0,0]=3 7173 B13R1.1511 CCOC(=O)c1ncc(N)cc1Cl Amb22495498 [0,2,0,0,0,0|1,0,0]=3 7174 B13R1.1511 CCOC(=O)c1ncc(N)cc1N Amb25713806 [0,2,0,0,0,0|1,0,0]=3 7175 B13R1.1511 CCOC(=O)c1ncc(N)nc1Cl Amb27617909 [0,2,0,0,0,0|2,0,0]=4 7176 B13R1.1511 CCOC(=O)c1ncc(O)cc1Br Amb28397549 [0,2,0,0,0,0|1,0,0]=3 7177 B13R1.1511 CCOC(=O)c1ncc(O)cc1C Amb23403489 [0,2,0,0,0,0|1,0,0]=3 7178 B13R1.1511 CCOC(=O)c1ncc(O)cc1Cl Amb27429061 [0,2,0,0,0,0|1,0,0]=3 7179 B13R1.1511 CCOC(=O)c1ncc(O)cc1F Amb28368745 [0,2,0,0,0,0|1,0,0]=3 7180 B13R1.1511 CCOC(=O)c1nnc(Cl)cc1Cl Amb19516015 [0,2,0,0,0,0|2,0,0]=4 7181 B13R1.1511 CCOC(=O)c1nnc(Cl)cc1N Amb24066510 [0,2,0,0,0,0|2,0,0]=4 7182 B13R1.1511 CCOC(=O)c1nnc(O)cc1O Amb21963707 [0,2,0,0,0,0|2,0,0]=4 7183 B13R1.1511 CCOC(C)c1ccc(C)cc1C Amb27211082 [0,2,0,0,0,0|1,0,1]=4 7184 B13R1.1511 CCSC(=N)c1ccc(O)cc1O Amb28367156 [0,2,0,0,0,0|1,1,0]=4 7185 B13R1.1511 CNCC(=O)c1ccc(Br)cc1C Amb18227884 [0,2,0,0,0,0|2,0,0]=4 7186 B13R1.1511 CNCC(=O)c1ccc(Br)cc1Cl Amb25066509 [0,2,0,0,0,0|2,0,0]=4 7187 B13R1.1511 CNCC(=O)c1ccc(Br)cc1F Amb27495667 [0,2,0,0,0,0|2,0,0]=4 7188 B13R1.1511 CNCC(=O)c1ccc(Br)cc1O Amb33388517 [0,2,0,0,0,0|2,0,0]=4 7189 B13R1.1511 CNCC(=O)c1ccc(C)cc1Br Amb24533505 [0,2,0,0,0,0|2,0,0]=4 7190 B13R1.1511 CNCC(=O)c1ccc(C)cc1C Amb17233281 [0,2,0,0,0,0|2,0,0]=4 7191 B13R1.1511 CNCC(=O)c1ccc(C)cc1Cl Amb27478735 [0,2,0,0,0,0|2,0,0]=4 7192 B13R1.1511 CNCC(=O)c1ccc(C)cc1F Amb25157233 [0,2,0,0,0,0|2,0,0]=4 7193 B13R1.1511 CNCC(=O)c1ccc(C)cc1O Amb25723071 [0,2,0,0,0,0|2,0,0]=4 7194 B13R1.1511 CNCC(=O)c1ccc(Cl)cc1Br Amb27466526 [0,2,0,0,0,0|2,0,0]=4 7195 B13R1.1511 CNCC(=O)c1ccc(Cl)cc1C Amb18224988 [0,2,0,0,0,0|2,0,0]=4 7196 B13R1.1511 CNCC(=O)c1ccc(Cl)cc1Cl Amb17314180 [0,2,0,0,0,0|2,0,0]=4 7197 B13R1.1511 CNCC(=O)c1ccc(Cl)cc1F Amb25327295 [0,2,0,0,0,0|2,0,0]=4 7198 B13R1.1511 CNCC(=O)c1ccc(Cl)cc1O Amb33260069 [0,2,0,0,0,0|2,0,0]=4 7199 B13R1.1511 CNCC(=O)c1ccc(F)cc1Br Amb27953197 [0,2,0,0,0,0|2,0,0]=4 7200 B13R1.1511 CNCC(=O)c1ccc(F)cc1C Amb26968105 [0,2,0,0,0,0|2,0,0]=4 7201 B13R1.1511 CNCC(=O)c1ccc(F)cc1Cl Amb27840969 [0,2,0,0,0,0|2,0,0]=4 7202 B13R1.1511 CNCC(=O)c1ccc(F)cc1F Amb18564319 [0,2,0,0,0,0|2,0,0]=4 7203 B13R1.1511 CNCC(=O)c1ccc(F)cc1O Amb27831581 [0,2,0,0,0,0|2,0,0]=4 7204 B13R1.1511 CNCC(=O)c1ccc(O)cc1C Amb27466310 [0,2,0,0,0,0|2,0,0]=4 7205 B13R1.1511 CNCC(=O)c1ccc(O)cc1Cl Amb28188889 [0,2,0,0,0,0|2,0,0]=4 7206 B13R1.1511 CNCC(=O)c1ccc(O)cc1F Amb27173019 [0,2,0,0,0,0|2,0,0]=4 7207 B13R1.1511 CNCC(=O)c1ccc(O)cc1O Amb25180646 [0,2,0,0,0,0|2,0,0]=4 7208 B13R1.1511 COCC(=O)c1ccc(Br)cc1C Amb27465775 [0,2,0,0,0,0|2,0,0]=4 7209 B13R1.1511 COCC(=O)c1ccc(C)cc1Br Amb27465774 [0,2,0,0,0,0|2,0,0]=4 7210 B13R1.1511 COCC(=O)c1ccc(C)cc1F Amb28249719 [0,2,0,0,0,0|2,0,0]=4 7211 B13R1.1511 COCC(=O)c1ccc(Cl)cc1C Amb28316347 [0,2,0,0,0,0|2,0,0]=4 7212 B13R1.1511 COCC(=O)c1ccc(Cl)cc1Cl Amb9666024 [0,2,0,0,0,0|2,0,0]=4 7213 B13R1.1511 COCC(=O)c1ccc(N)cc1Br Amb28077651 [0,2,0,0,0,0|2,0,0]=4 7214 B13R1.1511 COCC(=O)c1ccc(O)cc1O Amb2778486 [0,2,0,0,0,0|2,0,0]=4 7215 B13R1.1511 CONC(=O)c1ccc(Br)cc1C Amb11415618 [0,2,0,0,0,0|2,0,0]=4 7216 B13R1.1511 CONC(=O)c1ccc(C)cc1C Amb10704849 [0,2,0,0,0,0|2,0,0]=4 7217 B13R1.1511 CONC(=O)c1ccc(C)cc1F Amb27492918 [0,2,0,0,0,0|2,0,0]=4 7218 B13R1.1511 CONC(=O)c1ccc(C)cc1O Amb28064365 [0,2,0,0,0,0|2,0,0]=4 7219 B13R1.1511 CONC(=O)c1ccc(Cl)cc1Cl Amb8211176 [0,2,0,0,0,0|2,0,0]=4 7220 B13R1.1511 CONC(=O)c1ccc(Cl)cc1F Amb16073227 [0,2,0,0,0,0|2,0,0]=4 7221 B13R1.1511 CONC(=O)c1ccc(F)cc1C Amb27175266 [0,2,0,0,0,0|2,0,0]=4 7222 B13R1.1511 CONC(=O)c1ccc(F)cc1Cl Amb8221428 [0,2,0,0,0,0|2,0,0]=4 7223 B13R1.1511 CONC(=O)c1ccc(F)cc1F Amb10704848 [0,2,0,0,0,0|2,0,0]=4 7224 B13R1.1511 CONC(=O)c1ccc(F)cc1I Amb11338471 [0,2,0,0,0,0|2,0,0]=4 7225 B13R1.1511 CONC(=O)c1ccc(I)cc1Cl Amb27605130 [0,2,0,0,0,0|2,0,0]=4 7226 B13R1.1511 CONC(=O)c1ccc(N)cc1Cl Amb28454876 [0,2,0,0,0,0|2,0,0]=4 7227 B13R1.1511 CONC(=O)c1ccc(O)cc1F Amb27617734 [0,2,0,0,0,0|2,0,0]=4 7228 B13R1.1511 CONC(=O)c1ccc(O)cc1O Amb27955001 [0,2,0,0,0,0|2,0,0]=4 7229 B13R1.1511 CSCC(=O)c1ccc(Br)cc1Br Amb27405613 [0,2,0,0,0,0|2,0,0]=4 7230 B13R1.1511 CSCC(=O)c1ccc(C)cc1Br Amb28285471 [0,2,0,0,0,0|2,0,0]=4 7231 B13R1.1511 CSCC(=O)c1ccc(C)cc1C Amb19051957 [0,2,0,0,0,0|2,0,0]=4 7232 B13R1.1511 CSCC(=O)c1ccc(C)cc1Cl Amb28186351 [0,2,0,0,0,0|2,0,0]=4 7233 B13R1.1511 CSCC(=O)c1ccc(C)cc1F Amb27834254 [0,2,0,0,0,0|2,0,0]=4 7234 B13R1.1511 CSCC(=O)c1ccc(Cl)cc1Cl Amb24653210 [0,2,0,0,0,0|2,0,0]=4 7235 B13R1.1511 CSCC(=O)c1ccc(Cl)cc1F Amb28042108 [0,2,0,0,0,0|2,0,0]=4 7236 B13R1.1511 CSCC(=O)c1ccc(F)cc1F Amb28251716 [0,2,0,0,0,0|2,0,0]=4 7237 B13R1.1511 CSCC(=O)c1ccc(F)cc1I Amb28317499 [0,2,0,0,0,0|2,0,0]=4 7238 B13R1.1511 CSCC(=O)c1ccc(O)cc1O Amb18321907 [0,2,0,0,0,0|2,0,0]=4 7239 B13R1.1511 C\C=C\C(=O)c1ccc(Br)cc1Cl Amb27588918 [0,2,0,0,0,0|1,0,1]=4 7240 B13R1.1511 C\C=C\C(=O)c1ccc(Br)cc1F Amb28292162 [0,2,0,0,0,0|1,0,1]=4 7241 B13R1.1511 C\C=C\C(=O)c1ccc(C)cc1Cl Amb27486599 [0,2,0,0,0,0|1,0,1]=4 7242 B13R1.1511 C\C=C\C(=O)c1ccc(C)cc1F Amb27653175 [0,2,0,0,0,0|1,0,1]=4 7243 B13R1.1511 C\C=C\C(=O)c1ccc(Cl)cc1F Amb27248164 [0,2,0,0,0,0|1,0,1]=4 7244 B13R1.1511 C\C=C\C(=O)c1ccc(F)cc1C Amb27450313 [0,2,0,0,0,0|1,0,1]=4 7245 B13R1.1511 Cc1cc(Br)ccc1C(=O)CCBr Amb24343927 [0,2,0,0,0,0|2,0,0]=4 7246 B13R1.1511 Cc1cc(Br)ccc1C(=O)CCN Amb33431160 [0,2,0,0,0,0|2,0,0]=4 7247 B13R1.1511 Cc1cc(Cl)ccc1C(=O)CCBr Amb26618501 [0,2,0,0,0,0|2,0,0]=4 7248 B13R1.1511 Cc1cc(Cl)ccc1C(=O)CCCl Amb25328063 [0,2,0,0,0,0|2,0,0]=4 7249 B13R1.1511 Cc1cc(Cl)ccc1C(=O)CCN Amb33261918 [0,2,0,0,0,0|2,0,0]=4 7250 B13R1.1511 Cc1cc(F)ccc1C(=O)CCBr Amb26631935 [0,2,0,0,0,0|2,0,0]=4 7251 B13R1.1511 Cc1cc(F)ccc1C(=O)CCCl Amb25856902 [0,2,0,0,0,0|2,0,0]=4 7252 B13R1.1511 Cc1cc(F)ccc1C(=O)CCN Amb26947285 [0,2,0,0,0,0|2,0,0]=4 7253 B13R1.1511 Cc1cc(I)ccc1C(=O)CCBr Amb25263837 [0,2,0,0,0,0|2,0,0]=4 7254 B13R1.1511 Cc1cc(N)ccc1C(=O)CCCl Amb24536768 [0,2,0,0,0,0|2,0,0]=4 7255 B13R1.1511 Cc1cc(O)ccc1C(=O)CCBr Amb25311744 [0,2,0,0,0,0|2,0,0]=4 7256 B13R1.1511 Cc1cc(O)ccc1C(=O)CCCl Amb18055435 [0,2,0,0,0,0|2,0,0]=4 7257 B13R1.1511 Cc1cc(S)ccc1C(=O)CCBr Amb26397509 [0,2,0,0,0,0|2,0,0]=4 7258 B13R1.1511 Cc1cc(S)ccc1C(=O)CCCl Amb27963881 [0,2,0,0,0,0|2,0,0]=4 7259 B13R1.1511 Cc1ccc(C(=O)CCBr)c(Br)c1 Amb27482861 [0,2,0,0,0,0|2,0,0]=4 7260 B13R1.1511 Cc1ccc(C(=O)CCBr)c(C)c1 Amb17437873 [0,2,0,0,0,0|2,0,0]=4 7261 B13R1.1511 Cc1ccc(C(=O)CCBr)c(Cl)c1 Amb27608462 [0,2,0,0,0,0|2,0,0]=4 7262 B13R1.1511 Cc1ccc(C(=O)CCBr)c(F)c1 Amb26609991 [0,2,0,0,0,0|2,0,0]=4 7263 B13R1.1511 Cc1ccc(C(=O)CCBr)c(I)c1 Amb24727317 [0,2,0,0,0,0|2,0,0]=4 7264 B13R1.1511 Cc1ccc(C(=O)CCBr)c(N)c1 Amb27616084 [0,2,0,0,0,0|2,0,0]=4 7265 B13R1.1511 Cc1ccc(C(=O)CCBr)c(O)c1 Amb25312287 [0,2,0,0,0,0|2,0,0]=4 7266 B13R1.1511 Cc1ccc(C(=O)CCBr)c(S)c1 Amb24539769 [0,2,0,0,0,0|2,0,0]=4 7267 B13R1.1511 Cc1ccc(C(=O)CCCl)c(Br)c1 Amb28367771 [0,2,0,0,0,0|2,0,0]=4 7268 B13R1.1511 Cc1ccc(C(=O)CCCl)c(C)c1 Amb17194754 [0,2,0,0,0,0|2,0,0]=4 7269 B13R1.1511 Cc1ccc(C(=O)CCCl)c(Cl)c1 Amb28397967 [0,2,0,0,0,0|2,0,0]=4 7270 B13R1.1511 Cc1ccc(C(=O)CCCl)c(F)c1 Amb25055665 [0,2,0,0,0,0|2,0,0]=4 7271 B13R1.1511 Cc1ccc(C(=O)CCCl)c(S)c1 Amb28130551 [0,2,0,0,0,0|2,0,0]=4 7272 B13R1.1511 Cc1ccc(C(=O)CCN)c(Br)c1 Amb33450420 [0,2,0,0,0,0|2,0,0]=4 7273 B13R1.1511 Cc1ccc(C(=O)CCN)c(C)c1 Amb17194511 [0,2,0,0,0,0|2,0,0]=4 7274 B13R1.1511 Cc1ccc(C(=O)CCN)c(Cl)c1 Amb33390552 [0,2,0,0,0,0|2,0,0]=4 7275 B13R1.1511 Cc1ccc(C(=O)CCN)c(F)c1 Amb33324395 [0,2,0,0,0,0|2,0,0]=4 7276 B13R1.1511 Cc1ccc(C(=O)CCN)c(O)c1 Amb25047653 [0,2,0,0,0,0|2,0,0]=4 7277 B13R1.1511 Cc1ccc(C(=O)CCO)c(C)c1 Amb18564080 [0,2,0,0,0,0|2,0,0]=4 7278 B13R1.1511 Cc1ccc(C(=O)CCS)c(C)c1 Amb17401973 [0,2,0,0,0,0|2,0,0]=4 7279 B13R1.1511 NCCC(=O)c1ccc(Br)cc1Cl Amb33334300 [0,2,0,0,0,0|2,0,0]=4 7280 B13R1.1511 NCCC(=O)c1ccc(Br)cc1F Amb33450263 [0,2,0,0,0,0|2,0,0]=4 7281 B13R1.1511 NCCC(=O)c1ccc(Br)cc1O Amb33388420 [0,2,0,0,0,0|2,0,0]=4 7282 B13R1.1511 NCCC(=O)c1ccc(Cl)cc1Br Amb33450943 [0,2,0,0,0,0|2,0,0]=4 7283 B13R1.1511 NCCC(=O)c1ccc(Cl)cc1Cl Amb18623683 [0,2,0,0,0,0|2,0,0]=4 7284 B13R1.1511 NCCC(=O)c1ccc(Cl)cc1Cl Amb32656069 [0,2,0,0,0,0|2,0,0]=4 7285 B13R1.1511 NCCC(=O)c1ccc(Cl)cc1F Amb27253715 [0,2,0,0,0,0|2,0,0]=4 7286 B13R1.1511 NCCC(=O)c1ccc(Cl)cc1O Amb24593495 [0,2,0,0,0,0|2,0,0]=4 7287 B13R1.1511 NCCC(=O)c1ccc(F)cc1Br Amb33336200 [0,2,0,0,0,0|2,0,0]=4 7288 B13R1.1511 NCCC(=O)c1ccc(F)cc1Cl Amb33258063 [0,2,0,0,0,0|2,0,0]=4 7289 B13R1.1511 NCCC(=O)c1ccc(F)cc1F Amb18066157 [0,2,0,0,0,0|2,0,0]=4 7290 B13R1.1511 NCCC(=O)c1ccc(F)cc1O Amb27812297 [0,2,0,0,0,0|2,0,0]=4 7291 B13R1.1511 NCCC(=O)c1ccc(O)cc1Cl Amb26955540 [0,2,0,0,0,0|2,0,0]=4 7292 B13R1.1511 NCCC(=O)c1ccc(O)cc1F Amb28366439 [0,2,0,0,0,0|2,0,0]=4 7293 B13R1.1511 NCCC(=O)c1ccc(O)cc1O Amb27150284 [0,2,0,0,0,0|2,0,0]=4 7294 B13R1.1511 Nc1cc(Br)ccc1C(=O)CCCl Amb22899321 [0,2,0,0,0,0|2,0,0]=4 7295 B13R1.1511 Nc1cc(I)ccc1C(=O)CCBr Amb27246537 [0,2,0,0,0,0|2,0,0]=4 7296 B13R1.1511 Nc1ccc(C(=O)CCBr)c(I)c1 Amb27877027 [0,2,0,0,0,0|2,0,0]=4 7297 B13R1.1511 Nc1ccc(C(=O)CCBr)c(N)c1 Amb27795290 [0,2,0,0,0,0|2,0,0]=4 7298 B13R1.1511 Nc1ccc(C(=O)CCBr)c(O)c1 Amb27965614 [0,2,0,0,0,0|2,0,0]=4 7299 B13R1.1511 Nc1ccc(C(=O)CCCl)c(I)c1 Amb27613880 [0,2,0,0,0,0|2,0,0]=4 7300 B13R1.1511 Nc1ccc(C(=O)CCCl)c(O)c1 Amb28135594 [0,2,0,0,0,0|2,0,0]=4 7301 B13R1.1511 Nc1ccc(C(=O)CCCl)c(S)c1 Amb27445537 [0,2,0,0,0,0|2,0,0]=4 7302 B13R1.1511 O=C(CCBr)c1ccc(Br)cc1Br Amb27181140 [0,2,0,0,0,0|2,0,0]=4 7303 B13R1.1511 O=C(CCBr)c1ccc(Br)cc1Cl Amb25784596 [0,2,0,0,0,0|2,0,0]=4 7304 B13R1.1511 O=C(CCBr)c1ccc(Br)cc1F Amb27408322 [0,2,0,0,0,0|2,0,0]=4 7305 B13R1.1511 O=C(CCBr)c1ccc(Br)cc1I Amb27771496 [0,2,0,0,0,0|2,0,0]=4 7306 B13R1.1511 O=C(CCBr)c1ccc(Br)cc1O Amb25827053 [0,2,0,0,0,0|2,0,0]=4 7307 B13R1.1511 O=C(CCBr)c1ccc(Br)cc1S Amb24727552 [0,2,0,0,0,0|2,0,0]=4 7308 B13R1.1511 O=C(CCBr)c1ccc(Cl)cc1Br Amb26965582 [0,2,0,0,0,0|2,0,0]=4 7309 B13R1.1511 O=C(CCBr)c1ccc(Cl)cc1Cl Amb17437869 [0,2,0,0,0,0|2,0,0]=4 7310 B13R1.1511 O=C(CCBr)c1ccc(Cl)cc1F Amb24444319 [0,2,0,0,0,0|2,0,0]=4 7311 B13R1.1511 O=C(CCBr)c1ccc(Cl)cc1S Amb27625187 [0,2,0,0,0,0|2,0,0]=4 7312 B13R1.1511 O=C(CCBr)c1ccc(F)cc1Br Amb28048799 [0,2,0,0,0,0|2,0,0]=4 7313 B13R1.1511 O=C(CCBr)c1ccc(F)cc1Cl Amb27180865 [0,2,0,0,0,0|2,0,0]=4 7314 B13R1.1511 O=C(CCBr)c1ccc(F)cc1I Amb27403604 [0,2,0,0,0,0|2,0,0]=4 7315 B13R1.1511 O=C(CCBr)c1ccc(F)cc1O Amb24641390 [0,2,0,0,0,0|2,0,0]=4 7316 B13R1.1511 O=C(CCBr)c1ccc(I)cc1Br Amb24727063 [0,2,0,0,0,0|2,0,0]=4 7317 B13R1.1511 O=C(CCBr)c1ccc(I)cc1Cl Amb25096327 [0,2,0,0,0,0|2,0,0]=4 7318 B13R1.1511 O=C(CCBr)c1ccc(I)cc1F Amb27608510 [0,2,0,0,0,0|2,0,0]=4 7319 B13R1.1511 O=C(CCBr)c1ccc(I)cc1I Amb28129978 [0,2,0,0,0,0|2,0,0]=4 7320 B13R1.1511 O=C(CCBr)c1ccc(I)cc1S Amb27423760 [0,2,0,0,0,0|2,0,0]=4 7321 B13R1.1511 O=C(CCBr)c1ccc(O)cc1Cl Amb27264573 [0,2,0,0,0,0|2,0,0]=4 7322 B13R1.1511 O=C(CCBr)c1ccc(O)cc1F Amb27866256 [0,2,0,0,0,0|2,0,0]=4 7323 B13R1.1511 O=C(CCBr)c1ccc(O)cc1I Amb26331895 [0,2,0,0,0,0|2,0,0]=4 7324 B13R1.1511 O=C(CCBr)c1ccc(S)cc1Br Amb24664595 [0,2,0,0,0,0|2,0,0]=4 7325 B13R1.1511 O=C(CCBr)c1ccc(S)cc1Cl Amb27428176 [0,2,0,0,0,0|2,0,0]=4 7326 B13R1.1511 O=C(CCBr)c1ccc(S)cc1F Amb25942534 [0,2,0,0,0,0|2,0,0]=4 7327 B13R1.1511 O=C(CCBr)c1ccc(S)cc1I Amb25268035 [0,2,0,0,0,0|2,0,0]=4 7328 B13R1.1511 O=C(CCBr)c1ccc(S)cc1O Amb27474828 [0,2,0,0,0,0|2,0,0]=4 7329 B13R1.1511 O=C(CCBr)c1ccc(S)cc1S Amb27795049 [0,2,0,0,0,0|2,0,0]=4 7330 B13R1.1511 O=C(CCCl)c1ccc(Br)cc1Cl Amb28119157 [0,2,0,0,0,0|2,0,0]=4 7331 B13R1.1511 O=C(CCCl)c1ccc(Br)cc1F Amb26580043 [0,2,0,0,0,0|2,0,0]=4 7332 B13R1.1511 O=C(CCCl)c1ccc(Br)cc1I Amb26532858 [0,2,0,0,0,0|2,0,0]=4 7333 B13R1.1511 O=C(CCCl)c1ccc(Br)cc1O Amb27613862 [0,2,0,0,0,0|2,0,0]=4 7334 B13R1.1511 O=C(CCCl)c1ccc(Br)cc1S Amb28323526 [0,2,0,0,0,0|2,0,0]=4 7335 B13R1.1511 O=C(CCCl)c1ccc(Cl)cc1Br Amb25351647 [0,2,0,0,0,0|2,0,0]=4 7336 B13R1.1511 O=C(CCCl)c1ccc(Cl)cc1Cl Amb17198856 [0,2,0,0,0,0|2,0,0]=4 7337 B13R1.1511 O=C(CCCl)c1ccc(Cl)cc1F Amb27618183 [0,2,0,0,0,0|2,0,0]=4 7338 B13R1.1511 O=C(CCCl)c1ccc(Cl)cc1I Amb25729887 [0,2,0,0,0,0|2,0,0]=4 7339 B13R1.1511 O=C(CCCl)c1ccc(Cl)cc1O Amb27164262 [0,2,0,0,0,0|2,0,0]=4 7340 B13R1.1511 O=C(CCCl)c1ccc(Cl)cc1S Amb27796691 [0,2,0,0,0,0|2,0,0]=4 7341 B13R1.1511 O=C(CCCl)c1ccc(F)cc1Cl Amb26856771 [0,2,0,0,0,0|2,0,0]=4 7342 B13R1.1511 O=C(CCCl)c1ccc(F)cc1F Amb27264572 [0,2,0,0,0,0|2,0,0]=4 7343 B13R1.1511 O=C(CCCl)c1ccc(F)cc1I Amb28075174 [0,2,0,0,0,0|2,0,0]=4 7344 B13R1.1511 O=C(CCCl)c1ccc(F)cc1O Amb24637964 [0,2,0,0,0,0|2,0,0]=4 7345 B13R1.1511 O=C(CCCl)c1ccc(I)cc1Br Amb27667335 [0,2,0,0,0,0|2,0,0]=4 7346 B13R1.1511 O=C(CCCl)c1ccc(I)cc1Cl Amb25154960 [0,2,0,0,0,0|2,0,0]=4 7347 B13R1.1511 O=C(CCCl)c1ccc(I)cc1F Amb25742472 [0,2,0,0,0,0|2,0,0]=4 7348 B13R1.1511 O=C(CCCl)c1ccc(I)cc1O Amb26995792 [0,2,0,0,0,0|2,0,0]=4 7349 B13R1.1511 O=C(CCCl)c1ccc(O)cc1Br Amb27463535 [0,2,0,0,0,0|2,0,0]=4 7350 B13R1.1511 O=C(CCCl)c1ccc(O)cc1Cl Amb18057545 [0,2,0,0,0,0|2,0,0]=4 7351 B13R1.1511 O=C(CCCl)c1ccc(O)cc1F Amb24342241 [0,2,0,0,0,0|2,0,0]=4 7352 B13R1.1511 O=C(CCCl)c1ccc(O)cc1I Amb25365009 [0,2,0,0,0,0|2,0,0]=4 7353 B13R1.1511 O=C(CCCl)c1ccc(O)cc1O Amb18553703 [0,2,0,0,0,0|2,0,0]=4 7354 B13R1.1511 O=C(CCCl)c1ccc(S)cc1Cl Amb27670194 [0,2,0,0,0,0|2,0,0]=4 7355 B13R1.1511 O=C(CCCl)c1ccc(S)cc1O Amb28288220 [0,2,0,0,0,0|2,0,0]=4 7356 B13R1.1511 O=C(CCCl)c1ccc(S)cc1S Amb27963089 [0,2,0,0,0,0|2,0,0]=4 7357 B13R1.1511 O=C(CCO)c1ccc(Cl)cc1Cl Amb26357621 [0,2,0,0,0,0|2,0,0]=4 7358 B13R1.1511 O=C(CCO)c1ccc(F)cc1F Amb18066168 [0,2,0,0,0,0|2,0,0]=4 7359 B13R1.1511 O=C(OCCl)c1ccc(Cl)cc1Cl Amb24556077 [0,2,0,0,0,0|1,0,0]=3 7360 B13R1.12 C=C(OCC)c1cccc(C)c1N Amb33136223 [0,2,0,0,0,0|1,0,0]=3 7361 B13R1.12 C=C(OCC)c1cccc(F)c1N Amb33136205 [0,2,0,0,0,0|1,0,0]=3 7362 B13R1.12 C=C(OCC)c1cccc(F)c1O Amb33135990 [0,2,0,0,0,0|1,0,0]=3 7363 B13R1.12 C=C(OCC)c1cccc(N)c1C Amb33135841 [0,2,0,0,0,0|1,0,0]=3 7364 B13R1.12 C=C(OCC)c1cccc(N)c1Cl Amb33135870 [0,2,0,0,0,0|1,0,0]=3 7365 B13R1.12 C=C(OCC)c1cccc(N)c1F Amb33136320 [0,2,0,0,0,0|1,0,0]=3 7366 B13R1.12 C=C(OCC)c1cccc(O)c1F Amb33135923 [0,2,0,0,0,0|1,0,0]=3 7367 B13R1.12 C=C(OCC)c1cncc(N)c1C Amb33136081 [0,2,0,0,0,0|2,0,0]=4 7368 B13R1.12 C=C(OCC)c1nccc(C)c1N Amb33136272 [0,2,0,0,0,0|2,0,0]=4 7369 B13R1.12 CCCC(=O)C1=CC=CN(C)C1=O Amb28321848 [0,2,0,0,0,0|2,0,0]=4 7370 B13R1.12 CCCC(=O)c1cccc(C)c1Br Amb27478292 [0,2,0,0,0,0|1,0,0]=3 7371 B13R1.12 CCCC(=O)c1cccc(C)c1C Amb17233221 [0,2,0,0,0,0|1,0,0]=3 7372 B13R1.12 CCCC(=O)c1cccc(C)c1N Amb28135258 [0,2,0,0,0,0|1,0,0]=3 7373 B13R1.12 CCCC(=O)c1cccc(C)c1O Amb17233421 [0,2,0,0,0,0|1,0,0]=3 7374 B13R1.12 CCCC(=O)c1cccc(Cl)c1C Amb17337140 [0,2,0,0,0,0|1,0,0]=3 7375 B13R1.12 CCCC(=O)c1cccc(Cl)c1Cl Amb17340709 [0,2,0,0,0,0|1,0,0]=3 7376 B13R1.12 CCCC(=O)c1cccc(Cl)c1O Amb17236840 [0,2,0,0,0,0|1,0,0]=3 7377 B13R1.12 CCCC(=O)c1cccc(F)c1C Amb27663040 [0,2,0,0,0,0|1,0,0]=3 7378 B13R1.12 CCCC(=O)c1cccc(F)c1O Amb17233891 [0,2,0,0,0,0|1,0,0]=3 7379 B13R1.12 CCCC(=O)c1cccc(O)c1F Amb27970186 [0,2,0,0,0,0|1,0,0]=3 7380 B13R1.12 CCNC(=N)c1cccc(C)c1C Amb35580414 [0,2,0,0,0,0|2,0,0]=4 7381 B13R1.12 CCNC(=O)C1=C(O)C(=S)C=CO1 Amb28343251 [0,2,0,0,0,0|2,0,0]=4 7382 B13R1.12 CCNC(=O)C1=CC=CN(C)C1=O Amb28074064 [0,2,0,0,0,0|2,0,0]=4 7383 B13R1.12 CCNC(=O)c1cccc(Br)c1N Amb18273751 [0,2,0,0,0,0|1,0,0]=3 7384 B13R1.12 CCNC(=O)c1cccc(C)c1Br Amb27196120 [0,2,0,0,0,0|1,0,0]=3 7385 B13R1.12 CCNC(=O)c1cccc(C)c1Cl Amb27607469 [0,2,0,0,0,0|1,0,0]=3 7386 B13R1.12 CCNC(=O)c1cccc(C)c1N Amb1114292 [0,2,0,0,0,0|1,0,0]=3 7387 B13R1.12 CCNC(=O)c1cccc(C)c1O Amb6671672 [0,2,0,0,0,0|1,0,0]=3 7388 B13R1.12 CCNC(=O)c1cccc(Cl)c1Cl Amb8235435 [0,2,0,0,0,0|1,0,0]=3 7389 B13R1.12 CCNC(=O)c1cccc(F)c1I Amb27651447 [0,2,0,0,0,0|1,0,0]=3 7390 B13R1.12 CCNC(=O)c1cccc(F)c1N Amb18286746 [0,2,0,0,0,0|1,0,0]=3 7391 B13R1.12 CCNC(=O)c1cccc(F)c1O Amb28400070 [0,2,0,0,0,0|1,0,0]=3 7392 B13R1.12 CCNC(=O)c1cccc(N)c1C Amb1116858 [0,2,0,0,0,0|1,0,0]=3 7393 B13R1.12 CCNC(=O)c1cccc(N)c1Cl Amb27652375 [0,2,0,0,0,0|1,0,0]=3 7394 B13R1.12 CCNC(=O)c1cccc(N)c1F Amb27233073 [0,2,0,0,0,0|1,0,0]=3 7395 B13R1.12 CCNC(=O)c1cccc(O)c1O Amb28255788 [0,2,0,0,0,0|1,0,0]=3 7396 B13R1.12 CCNC(=O)c1ccnc(F)c1F Amb28316894 [0,2,0,0,0,0|2,0,0]=4 7397 B13R1.12 CCNC(=O)c1cncc(Br)c1C Amb27479028 [0,2,0,0,0,0|2,0,0]=4 7398 B13R1.12 CCNC(=O)c1cncc(C)c1O Amb27766213 [0,2,0,0,0,0|2,0,0]=4 7399 B13R1.12 CCNC(=O)c1cncc(N)c1C Amb27840946 [0,2,0,0,0,0|2,0,0]=4 7400 B13R1.12 CCNC(=O)c1nccc(Cl)c1O Amb27650031 [0,2,0,0,0,0|2,0,0]=4 7401 B13R1.12 CCOC(=N)c1cccc(Br)c1F Amb27859056 [0,2,0,0,0,0|1,0,0]=3 7402 B13R1.12 CCOC(=N)c1cccc(Cl)c1Cl Amb28365934 [0,2,0,0,0,0|1,0,0]=3 7403 B13R1.12 CCOC(=N)c1cccc(F)c1F Amb24376282 [0,2,0,0,0,0|1,0,0]=3 7404 B13R1.12 CCOC(=N)c1cccc(O)c1Cl Amb27822752 [0,2,0,0,0,0|1,0,0]=3 7405 B13R1.12 CCOC(=O)C1=C(Br)C(=O)NC=N1 Amb22011475 [0,2,0,0,0,0|2,0,0]=4 7406 B13R1.12 CCOC(=O)C1=C(Cl)C(=O)NC=C1 Amb24494403 [0,2,0,0,0,0|1,0,0]=3 7407 B13R1.12 CCOC(=O)C1=C(N)C(=N)C=CN1 Amb25669344 [0,2,0,0,0,0|1,0,0]=3 7408 B13R1.12 CCOC(=O)C1=C(N)C(=N)N=CN1 Amb25152965 [0,2,0,0,0,0|2,0,0]=4 7409 B13R1.12 CCOC(=O)C1=C(O)C(=O)NC=C1 Amb23590702 [0,2,0,0,0,0|1,0,0]=3 7410 B13R1.12 CCOC(=O)C1=CC=CC(=O)N1C Amb22494718 [0,2,0,0,0,0|1,0,0]=3 7411 B13R1.12 CCOC(=O)C1=CC=CN(C)C1=O Amb22500755 [0,2,0,0,0,0|1,0,0]=3 7412 B13R1.12 CCOC(=O)C1=CC=NN(C)C1=O Amb25969368 [0,2,0,0,0,0|2,0,0]=4 7413 B13R1.12 CCOC(=O)C1=CN=CN(C)C1=O Amb28190530 [0,2,0,0,0,0|2,0,0]=4 7414 B13R1.12 CCOC(=O)N1C=CN=C(Cl)C1=O Amb21960896 [0,2,0,0,0,0|2,0,0]=4 7415 B13R1.12 CCOC(=O)N1C=CNC(=O)C1=O Amb22728049 [0,2,0,0,0,0|2,0,0]=4 7416 B13R1.12 CCOC(=O)c1ccc[n+]([O-])c1C Amb25998836 [0,2,0,0,0,0|1,0,0]=3 7417 B13R1.12 CCOC(=O)c1cccc(Br)c1Br Amb27753686 [0,2,0,0,0,0|0,0,0]=2 7418 B13R1.12 CCOC(=O)c1cccc(Br)c1C Amb26864333 [0,2,0,0,0,0|0,0,0]=2 7419 B13R1.12 CCOC(=O)c1cccc(Br)c1Cl Amb25731174 [0,2,0,0,0,0|0,0,0]=2 7420 B13R1.12 CCOC(=O)c1cccc(Br)c1I Amb26998793 [0,2,0,0,0,0|0,0,0]=2 7421 B13R1.12 CCOC(=O)c1cccc(Br)c1N Amb18968669 [0,2,0,0,0,0|0,0,0]=2 7422 B13R1.12 CCOC(=O)c1cccc(C)c1C Amb9242957 [0,2,0,0,0,0|0,0,0]=2 7423 B13R1.12 CCOC(=O)c1cccc(C)c1Cl Amb22750101 [0,2,0,0,0,0|0,0,0]=2 7424 B13R1.12 CCOC(=O)c1cccc(C)c1F Amb27817779 [0,2,0,0,0,0|0,0,0]=2 7425 B13R1.12 CCOC(=O)c1cccc(C)c1I Amb25996612 [0,2,0,0,0,0|0,0,0]=2 7426 B13R1.12 CCOC(=O)c1cccc(C)c1N Amb7762509 [0,2,0,0,0,0|0,0,0]=2 7427 B13R1.12 CCOC(=O)c1cccc(C)c1O Amb33531495 [0,2,0,0,0,0|0,0,0]=2 7428 B13R1.12 CCOC(=O)c1cccc(C)c1S Amb27475610 [0,2,0,0,0,0|0,0,0]=2 7429 B13R1.12 CCOC(=O)c1cccc(Cl)c1Br Amb25827083 [0,2,0,0,0,0|0,0,0]=2 7430 B13R1.12 CCOC(=O)c1cccc(Cl)c1C Amb24745578 [0,2,0,0,0,0|0,0,0]=2 7431 B13R1.12 CCOC(=O)c1cccc(Cl)c1Cl Amb9242922 [0,2,0,0,0,0|0,0,0]=2 7432 B13R1.12 CCOC(=O)c1cccc(Cl)c1F Amb20671108 [0,2,0,0,0,0|0,0,0]=2 7433 B13R1.12 CCOC(=O)c1cccc(Cl)c1N Amb18968011 [0,2,0,0,0,0|0,0,0]=2 7434 B13R1.12 CCOC(=O)c1cccc(Cl)c1O Amb27452196 [0,2,0,0,0,0|0,0,0]=2 7435 B13R1.12 CCOC(=O)c1cccc(F)c1Br Amb28252097 [0,2,0,0,0,0|0,0,0]=2 7436 B13R1.12 CCOC(=O)c1cccc(F)c1C Amb22001732 [0,2,0,0,0,0|0,0,0]=2 7437 B13R1.12 CCOC(=O)c1cccc(F)c1Cl Amb22499763 [0,2,0,0,0,0|0,0,0]=2 7438 B13R1.12 CCOC(=O)c1cccc(F)c1I Amb24534219 [0,2,0,0,0,0|0,0,0]=2 7439 B13R1.12 CCOC(=O)c1cccc(F)c1N Amb18968680 [0,2,0,0,0,0|0,0,0]=2 7440 B13R1.12 CCOC(=O)c1cccc(F)c1O Amb25865501 [0,2,0,0,0,0|0,0,0]=2 7441 B13R1.12 CCOC(=O)c1cccc(I)c1Br Amb28456445 [0,2,0,0,0,0|0,0,0]=2 7442 B13R1.12 CCOC(=O)c1cccc(I)c1C Amb22266259 [0,2,0,0,0,0|0,0,0]=2 7443 B13R1.12 CCOC(=O)c1cccc(I)c1Cl Amb26023808 [0,2,0,0,0,0|0,0,0]=2 7444 B13R1.12 CCOC(=O)c1cccc(I)c1F Amb23402041 [0,2,0,0,0,0|0,0,0]=2 7445 B13R1.12 CCOC(=O)c1cccc(I)c1N Amb27794431 [0,2,0,0,0,0|0,0,0]=2 7446 B13R1.12 CCOC(=O)c1cccc(I)c1O Amb25329546 [0,2,0,0,0,0|0,0,0]=2 7447 B13R1.12 CCOC(=O)c1cccc(N)c1Br Amb22490440 [0,2,0,0,0,0|0,0,0]=2 7448 B13R1.12 CCOC(=O)c1cccc(N)c1C Amb844785 [0,2,0,0,0,0|0,0,0]=2 7449 B13R1.12 CCOC(=O)c1cccc(N)c1Cl Amb26981313 [0,2,0,0,0,0|0,0,0]=2 7450 B13R1.12 CCOC(=O)c1cccc(N)c1F Amb22490329 [0,2,0,0,0,0|0,0,0]=2 7451 B13R1.12 CCOC(=O)c1cccc(N)c1I Amb27862912 [0,2,0,0,0,0|0,0,0]=2 7452 B13R1.12 CCOC(=O)c1cccc(N)c1N Amb18128674 [0,2,0,0,0,0|0,0,0]=2 7453 B13R1.12 CCOC(=O)c1cccc(N)c1O Amb28316499 [0,2,0,0,0,0|0,0,0]=2 7454 B13R1.12 CCOC(=O)c1cccc(O)c1Br Amb24400245 [0,2,0,0,0,0|0,0,0]=2 7455 B13R1.12 CCOC(=O)c1cccc(O)c1C Amb27240586 [0,2,0,0,0,0|0,0,0]=2 7456 B13R1.12 CCOC(=O)c1cccc(O)c1Cl Amb28383380 [0,2,0,0,0,0|0,0,0]=2 7457 B13R1.12 CCOC(=O)c1cccc(O)c1F Amb18648838 [0,2,0,0,0,0|0,0,0]=2 7458 B13R1.12 CCOC(=O)c1cccc(O)c1I Amb27146518 [0,2,0,0,0,0|0,0,0]=2 7459 B13R1.12 CCOC(=O)c1cccc(O)c1N Amb18128813 [0,2,0,0,0,0|0,0,0]=2 7460 B13R1.12 CCOC(=O)c1cccc(O)c1O Amb2780503 [0,2,0,0,0,0|0,0,0]=2 7461 B13R1.12 CCOC(=O)c1cccc(S)c1F Amb25201793 [0,2,0,0,0,0|0,0,0]=2 7462 B13R1.12 CCOC(=O)c1cccc(S)c1N Amb18273959 [0,2,0,0,0,0|0,0,0]=2 7463 B13R1.12 CCOC(=O)c1ccnc(Br)c1Br Amb26895099 [0,2,0,0,0,0|1,0,0]=3 7464 B13R1.12 CCOC(=O)c1ccnc(Br)c1C Amb25047238 [0,2,0,0,0,0|1,0,0]=3 7465 B13R1.12 CCOC(=O)c1ccnc(Br)c1Cl Amb28350005 [0,2,0,0,0,0|1,0,0]=3 7466 B13R1.12 CCOC(=O)c1ccnc(Br)c1F Amb26619562 [0,2,0,0,0,0|1,0,0]=3 7467 B13R1.12 CCOC(=O)c1ccnc(Br)c1N Amb25364876 [0,2,0,0,0,0|1,0,0]=3 7468 B13R1.12 CCOC(=O)c1ccnc(Br)c1O Amb24653941 [0,2,0,0,0,0|1,0,0]=3 7469 B13R1.12 CCOC(=O)c1ccnc(C)c1Cl Amb24496855 [0,2,0,0,0,0|1,0,0]=3 7470 B13R1.12 CCOC(=O)c1ccnc(C)c1O Amb18128822 [0,2,0,0,0,0|1,0,0]=3 7471 B13R1.12 CCOC(=O)c1ccnc(Cl)c1Br Amb27180700 [0,2,0,0,0,0|1,0,0]=3 7472 B13R1.12 CCOC(=O)c1ccnc(Cl)c1C Amb20240833 [0,2,0,0,0,0|1,0,0]=3 7473 B13R1.12 CCOC(=O)c1ccnc(Cl)c1Cl Amb25351651 [0,2,0,0,0,0|1,0,0]=3 7474 B13R1.12 CCOC(=O)c1ccnc(Cl)c1F Amb25670295 [0,2,0,0,0,0|1,0,0]=3 7475 B13R1.12 CCOC(=O)c1ccnc(Cl)c1I Amb27150883 [0,2,0,0,0,0|1,0,0]=3 7476 B13R1.12 CCOC(=O)c1ccnc(Cl)c1N Amb25751995 [0,2,0,0,0,0|1,0,0]=3 7477 B13R1.12 CCOC(=O)c1ccnc(Cl)c1O Amb26854568 [0,2,0,0,0,0|1,0,0]=3 7478 B13R1.12 CCOC(=O)c1ccnc(F)c1F Amb27172781 [0,2,0,0,0,0|1,0,0]=3 7479 B13R1.12 CCOC(=O)c1ccnc(F)c1N Amb24548483 [0,2,0,0,0,0|1,0,0]=3 7480 B13R1.12 CCOC(=O)c1ccnc(F)c1O Amb27209399 [0,2,0,0,0,0|1,0,0]=3 7481 B13R1.12 CCOC(=O)c1ccnc(I)c1F Amb27259890 [0,2,0,0,0,0|1,0,0]=3 7482 B13R1.12 CCOC(=O)c1ccnc(N)c1Br Amb24356810 [0,2,0,0,0,0|1,0,0]=3 7483 B13R1.12 CCOC(=O)c1ccnc(N)c1C Amb26330294 [0,2,0,0,0,0|1,0,0]=3 7484 B13R1.12 CCOC(=O)c1ccnc(N)c1Cl Amb32666937 [0,2,0,0,0,0|1,0,0]=3 7485 B13R1.12 CCOC(=O)c1ccnc(N)c1F Amb25918145 [0,2,0,0,0,0|1,0,0]=3 7486 B13R1.12 CCOC(=O)c1ccnc(O)c1Br Amb28388830 [0,2,0,0,0,0|1,0,0]=3 7487 B13R1.12 CCOC(=O)c1ccnc(O)c1N Amb27181171 [0,2,0,0,0,0|1,0,0]=3 7488 B13R1.12 CCOC(=O)c1cncc(Br)c1Br Amb26509665 [0,2,0,0,0,0|1,0,0]=3 7489 B13R1.12 CCOC(=O)c1cncc(Br)c1C Amb26025627 [0,2,0,0,0,0|1,0,0]=3 7490 B13R1.12 CCOC(=O)c1cncc(Br)c1Cl Amb27491833 [0,2,0,0,0,0|1,0,0]=3 7491 B13R1.12 CCOC(=O)c1cncc(Br)c1F Amb28246026 [0,2,0,0,0,0|1,0,0]=3 7492 B13R1.12 CCOC(=O)c1cncc(Br)c1N Amb22498269 [0,2,0,0,0,0|1,0,0]=3 7493 B13R1.12 CCOC(=O)c1cncc(C)c1F Amb25972453 [0,2,0,0,0,0|1,0,0]=3 7494 B13R1.12 CCOC(=O)c1cncc(C)c1N Amb20671592 [0,2,0,0,0,0|1,0,0]=3 7495 B13R1.12 CCOC(=O)c1cncc(C)c1O Amb20671594 [0,2,0,0,0,0|1,0,0]=3 7496 B13R1.12 CCOC(=O)c1cncc(Cl)c1Cl Amb25976478 [0,2,0,0,0,0|1,0,0]=3 7497 B13R1.12 CCOC(=O)c1cncc(Cl)c1F Amb27209095 [0,2,0,0,0,0|1,0,0]=3 7498 B13R1.12 CCOC(=O)c1cncc(Cl)c1O Amb27756989 [0,2,0,0,0,0|1,0,0]=3 7499 B13R1.12 CCOC(=O)c1cncc(F)c1C Amb28422520 [0,2,0,0,0,0|1,0,0]=3 7500 B13R1.12 CCOC(=O)c1cncc(F)c1Cl Amb25789440 [0,2,0,0,0,0|1,0,0]=3 7501 B13R1.12 CCOC(=O)c1cncc(F)c1F Amb26568229 [0,2,0,0,0,0|1,0,0]=3 7502 B13R1.12 CCOC(=O)c1cncc(F)c1I Amb24628204 [0,2,0,0,0,0|1,0,0]=3 7503 B13R1.12 CCOC(=O)c1cncc(F)c1N Amb22498566 [0,2,0,0,0,0|1,0,0]=3 7504 B13R1.12 CCOC(=O)c1cncc(I)c1F Amb27795178 [0,2,0,0,0,0|1,0,0]=3 7505 B13R1.12 CCOC(=O)c1cncc(I)c1N Amb22498561 [0,2,0,0,0,0|1,0,0]=3 7506 B13R1.12 CCOC(=O)c1cncc(N)c1Br Amb25799718 [0,2,0,0,0,0|1,0,0]=3 7507 B13R1.12 CCOC(=O)c1cncc(N)c1C Amb24353598 [0,2,0,0,0,0|1,0,0]=3 7508 B13R1.12 CCOC(=O)c1cncc(N)c1N Amb24183881 [0,2,0,0,0,0|1,0,0]=3 7509 B13R1.12 CCOC(=O)c1cncc(O)c1Cl Amb25217186 [0,2,0,0,0,0|1,0,0]=3 7510 B13R1.12 CCOC(=O)c1cncc(O)c1F Amb26532628 [0,2,0,0,0,0|1,0,0]=3 7511 B13R1.12 CCOC(=O)c1nccc(Br)c1Br Amb26946481 [0,2,0,0,0,0|1,0,0]=3 7512 B13R1.12 CCOC(=O)c1nccc(Br)c1C Amb27443119 [0,2,0,0,0,0|1,0,0]=3 7513 B13R1.12 CCOC(=O)c1nccc(Br)c1Cl Amb24558811 [0,2,0,0,0,0|1,0,0]=3 7514 B13R1.12 CCOC(=O)c1nccc(Br)c1F Amb25920067 [0,2,0,0,0,0|1,0,0]=3 7515 B13R1.12 CCOC(=O)c1nccc(Br)c1N Amb24745364 [0,2,0,0,0,0|1,0,0]=3 7516 B13R1.12 CCOC(=O)c1nccc(Br)c1O Amb24374919 [0,2,0,0,0,0|1,0,0]=3 7517 B13R1.12 CCOC(=O)c1nccc(C)c1Br Amb24564138 [0,2,0,0,0,0|1,0,0]=3 7518 B13R1.12 CCOC(=O)c1nccc(C)c1N Amb24420024 [0,2,0,0,0,0|1,0,0]=3 7519 B13R1.12 CCOC(=O)c1nccc(C)c1O Amb27627684 [0,2,0,0,0,0|1,0,0]=3 7520 B13R1.12 CCOC(=O)c1nccc(Cl)c1Br Amb28251308 [0,2,0,0,0,0|1,0,0]=3 7521 B13R1.12 CCOC(=O)c1nccc(Cl)c1Cl Amb26905854 [0,2,0,0,0,0|1,0,0]=3 7522 B13R1.12 CCOC(=O)c1nccc(Cl)c1F Amb25834712 [0,2,0,0,0,0|1,0,0]=3 7523 B13R1.12 CCOC(=O)c1nccc(F)c1Br Amb24708177 [0,2,0,0,0,0|1,0,0]=3 7524 B13R1.12 CCOC(=O)c1nccc(F)c1Cl Amb24528491 [0,2,0,0,0,0|1,0,0]=3 7525 B13R1.12 CCOC(=O)c1nccc(F)c1F Amb27209951 [0,2,0,0,0,0|1,0,0]=3 7526 B13R1.12 CCOC(=O)c1nccc(F)c1I Amb27616183 [0,2,0,0,0,0|1,0,0]=3 7527 B13R1.12 CCOC(=O)c1nccc(F)c1N Amb24564803 [0,2,0,0,0,0|1,0,0]=3 7528 B13R1.12 CCOC(=O)c1nccc(F)c1O Amb26532627 [0,2,0,0,0,0|1,0,0]=3 7529 B13R1.12 CCOC(=O)c1nccc(I)c1F Amb27441863 [0,2,0,0,0,0|1,0,0]=3 7530 B13R1.12 CCOC(=O)c1nccc(N)c1Br Amb24501509 [0,2,0,0,0,0|1,0,0]=3 7531 B13R1.12 CCOC(=O)c1nccc(N)c1C Amb22522204 [0,2,0,0,0,0|1,0,0]=3 7532 B13R1.12 CCOC(=O)c1nccc(N)c1F Amb27813497 [0,2,0,0,0,0|1,0,0]=3 7533 B13R1.12 CCOC(=O)c1nccc(O)c1Br Amb25311366 [0,2,0,0,0,0|1,0,0]=3 7534 B13R1.12 CCOC(=O)c1nccc(O)c1C Amb22522284 [0,2,0,0,0,0|1,0,0]=3 7535 B13R1.12 CCOC(=O)c1nccc(O)c1F Amb26653642 [0,2,0,0,0,0|1,0,0]=3 7536 B13R1.12 CCOC(=O)c1ncnc(Cl)c1Br Amb27866415 [0,2,0,0,0,0|2,0,0]=4 7537 B13R1.12 CCOC(=O)c1ncnc(Cl)c1C Amb24183397 [0,2,0,0,0,0|2,0,0]=4 7538 B13R1.12 CCOC(=O)c1ncnc(Cl)c1Cl Amb22234814 [0,2,0,0,0,0|2,0,0]=4 7539 B13R1.12 CCOC(=O)c1ncnc(N)c1Cl Amb22234813 [0,2,0,0,0,0|2,0,0]=4 7540 B13R1.12 CCOC(=O)c1ncnc(O)c1C Amb26451895 [0,2,0,0,0,0|2,0,0]=4 7541 B13R1.12 CCOC(=O)c1ncnc(O)c1Cl Amb24367880 [0,2,0,0,0,0|2,0,0]=4 7542 B13R1.12 CCON(C)c1cccc(Br)c1N Amb27195385 [0,2,0,0,0,0|2,0,0]=4 7543 B13R1.12 CCON(C)c1cccc(Cl)c1N Amb27788354 [0,2,0,0,0,0|2,0,0]=4 7544 B13R1.12 CCON(C)c1cccc(F)c1N Amb27488996 [0,2,0,0,0,0|2,0,0]=4 7545 B13R1.12 CCO\C(O)=C1\C=CN=C(Cl)C1=O Amb28454401 [0,2,0,0,0,0|1,0,1]=4 7546 B13R1.12 CNCC(=O)c1cccc(Br)c1C Amb27411578 [0,2,0,0,0,0|2,0,0]=4 7547 B13R1.12 CNCC(=O)c1cccc(Br)c1Cl Amb25038829 [0,2,0,0,0,0|2,0,0]=4 7548 B13R1.12 CNCC(=O)c1cccc(Br)c1F Amb25158632 [0,2,0,0,0,0|2,0,0]=4 7549 B13R1.12 CNCC(=O)c1cccc(Br)c1O Amb33332271 [0,2,0,0,0,0|2,0,0]=4 7550 B13R1.12 CNCC(=O)c1cccc(C)c1Br Amb24463728 [0,2,0,0,0,0|2,0,0]=4 7551 B13R1.12 CNCC(=O)c1cccc(C)c1C Amb18224566 [0,2,0,0,0,0|2,0,0]=4 7552 B13R1.12 CNCC(=O)c1cccc(C)c1Cl Amb27213736 [0,2,0,0,0,0|2,0,0]=4 7553 B13R1.12 CNCC(=O)c1cccc(C)c1F Amb24685079 [0,2,0,0,0,0|2,0,0]=4 7554 B13R1.12 CNCC(=O)c1cccc(C)c1O Amb25048342 [0,2,0,0,0,0|2,0,0]=4 7555 B13R1.12 CNCC(=O)c1cccc(Cl)c1Br Amb26502374 [0,2,0,0,0,0|2,0,0]=4 7556 B13R1.12 CNCC(=O)c1cccc(Cl)c1C Amb18224962 [0,2,0,0,0,0|2,0,0]=4 7557 B13R1.12 CNCC(=O)c1cccc(Cl)c1Cl Amb18866812 [0,2,0,0,0,0|2,0,0]=4 7558 B13R1.12 CNCC(=O)c1cccc(Cl)c1F Amb25997945 [0,2,0,0,0,0|2,0,0]=4 7559 B13R1.12 CNCC(=O)c1cccc(Cl)c1O Amb28410502 [0,2,0,0,0,0|2,0,0]=4 7560 B13R1.12 CNCC(=O)c1cccc(F)c1Br Amb27172367 [0,2,0,0,0,0|2,0,0]=4 7561 B13R1.12 CNCC(=O)c1cccc(F)c1C Amb25158393 [0,2,0,0,0,0|2,0,0]=4 7562 B13R1.12 CNCC(=O)c1cccc(F)c1Cl Amb26942698 [0,2,0,0,0,0|2,0,0]=4 7563 B13R1.12 CNCC(=O)c1cccc(F)c1F Amb25795369 [0,2,0,0,0,0|2,0,0]=4 7564 B13R1.12 CNCC(=O)c1cccc(F)c1O Amb25320557 [0,2,0,0,0,0|2,0,0]=4 7565 B13R1.12 CNCC(=O)c1cccc(O)c1Br Amb27610301 [0,2,0,0,0,0|2,0,0]=4 7566 B13R1.12 CNCC(=O)c1cccc(O)c1C Amb26081142 [0,2,0,0,0,0|2,0,0]=4 7567 B13R1.12 CNCC(=O)c1cccc(O)c1Cl Amb26481823 [0,2,0,0,0,0|2,0,0]=4 7568 B13R1.12 CNCC(=O)c1cccc(O)c1F Amb25755292 [0,2,0,0,0,0|2,0,0]=4 7569 B13R1.12 CNCC(=O)c1cccc(O)c1O Amb33269498 [0,2,0,0,0,0|2,0,0]=4 7570 B13R1.12 COCC(=O)c1cccc(C)c1I Amb27206299 [0,2,0,0,0,0|2,0,0]=4 7571 B13R1.12 COCC(=O)c1cccc(Cl)c1F Amb24520727 [0,2,0,0,0,0|2,0,0]=4 7572 B13R1.12 COCC(=O)c1cccc(F)c1C Amb27599947 [0,2,0,0,0,0|2,0,0]=4 7573 B13R1.12 CONC(=O)c1cccc(C)c1Cl Amb27831241 [0,2,0,0,0,0|2,0,0]=4 7574 B13R1.12 CONC(=O)c1cccc(C)c1F Amb27664560 [0,2,0,0,0,0|2,0,0]=4 7575 B13R1.12 CONC(=O)c1cccc(Cl)c1F Amb27444890 [0,2,0,0,0,0|2,0,0]=4 7576 B13R1.12 CONC(=O)c1cccc(F)c1I Amb28190122 [0,2,0,0,0,0|2,0,0]=4 7577 B13R1.12 CONC(=O)c1cccc(I)c1O Amb28318653 [0,2,0,0,0,0|2,0,0]=4 7578 B13R1.12 CSCC(=O)c1cccc(C)c1F Amb28248856 [0,2,0,0,0,0|2,0,0]=4 7579 B13R1.12 CSCC(=O)c1cccc(C)c1I Amb27646179 [0,2,0,0,0,0|2,0,0]=4 7580 B13R1.12 CSCC(=O)c1cccc(Cl)c1F Amb27232566 [0,2,0,0,0,0|2,0,0]=4 7581 B13R1.12 C\C=C\C(=O)c1cccc(F)c1Cl Amb28207161 [0,2,0,0,0,0|1,0,1]=4 7582 B13R1.12 Cc1c(Br)cccc1C(=O)CCBr Amb27876655 [0,2,0,0,0,0|2,0,0]=4 7583 B13R1.12 Cc1c(Br)cccc1C(=O)CCCl Amb27246883 [0,2,0,0,0,0|2,0,0]=4 7584 B13R1.12 Cc1c(Br)cccc1C(=O)CCN Amb33227524 [0,2,0,0,0,0|2,0,0]=4 7585 B13R1.12 Cc1c(Cl)cccc1C(=O)CCBr Amb26995911 [0,2,0,0,0,0|2,0,0]=4 7586 B13R1.12 Cc1c(Cl)cccc1C(=O)CCCl Amb25300477 [0,2,0,0,0,0|2,0,0]=4 7587 B13R1.12 Cc1c(F)cccc1C(=O)CCCl Amb26445149 [0,2,0,0,0,0|2,0,0]=4 7588 B13R1.12 Cc1c(F)cccc1C(=O)CCN Amb33372769 [0,2,0,0,0,0|2,0,0]=4 7589 B13R1.12 Cc1c(I)cccc1C(=O)CCCl Amb25055277 [0,2,0,0,0,0|2,0,0]=4 7590 B13R1.12 Cc1c(O)cccc1C(=O)CCBr Amb27793912 [0,2,0,0,0,0|2,0,0]=4 7591 B13R1.12 Cc1c(S)cccc1C(=O)CCBr Amb24669593 [0,2,0,0,0,0|2,0,0]=4 7592 B13R1.12 Cc1c(S)cccc1C(=O)CCCl Amb26397512 [0,2,0,0,0,0|2,0,0]=4 7593 B13R1.12 Cc1cccc(C(=O)CCBr)c1Br Amb27458128 [0,2,0,0,0,0|2,0,0]=4 7594 B13R1.12 Cc1cccc(C(=O)CCBr)c1C Amb25826566 [0,2,0,0,0,0|2,0,0]=4 7595 B13R1.12 Cc1cccc(C(=O)CCBr)c1F Amb28119132 [0,2,0,0,0,0|2,0,0]=4 7596 B13R1.12 Cc1cccc(C(=O)CCBr)c1N Amb27616083 [0,2,0,0,0,0|2,0,0]=4 7597 B13R1.12 Cc1cccc(C(=O)CCBr)c1O Amb26917208 [0,2,0,0,0,0|2,0,0]=4 7598 B13R1.12 Cc1cccc(C(=O)CCBr)c1S Amb27779252 [0,2,0,0,0,0|2,0,0]=4 7599 B13R1.12 Cc1cccc(C(=O)CCCl)c1Br Amb26532700 [0,2,0,0,0,0|2,0,0]=4 7600 B13R1.12 Cc1cccc(C(=O)CCCl)c1C Amb27862100 [0,2,0,0,0,0|2,0,0]=4 7601 B13R1.12 Cc1cccc(C(=O)CCCl)c1F Amb25301313 [0,2,0,0,0,0|2,0,0]=4 7602 B13R1.12 Cc1cccc(C(=O)CCCl)c1I Amb25957544 [0,2,0,0,0,0|2,0,0]=4 7603 B13R1.12 Cc1cccc(C(=O)CCCl)c1O Amb2612985 [0,2,0,0,0,0|2,0,0]=4 7604 B13R1.12 Cc1cccc(C(=O)CCCl)c1S Amb26989869 [0,2,0,0,0,0|2,0,0]=4 7605 B13R1.12 Cc1cccc(C(=O)CCN)c1C Amb24453094 [0,2,0,0,0,0|2,0,0]=4 7606 B13R1.12 Cc1cccc(C(=O)CCN)c1F Amb24463887 [0,2,0,0,0,0|2,0,0]=4 7607 B13R1.12 NCCC(=O)c1cccc(Br)c1F Amb26867699 [0,2,0,0,0,0|2,0,0]=4 7608 B13R1.12 NCCC(=O)c1cccc(Br)c1O Amb33332259 [0,2,0,0,0,0|2,0,0]=4 7609 B13R1.12 NCCC(=O)c1cccc(Cl)c1Cl Amb27625909 [0,2,0,0,0,0|2,0,0]=4 7610 B13R1.12 NCCC(=O)c1cccc(Cl)c1F Amb33222954 [0,2,0,0,0,0|2,0,0]=4 7611 B13R1.12 NCCC(=O)c1cccc(Cl)c1O Amb33056854 [0,2,0,0,0,0|2,0,0]=4 7612 B13R1.12 NCCC(=O)c1cccc(F)c1Br Amb33450208 [0,2,0,0,0,0|2,0,0]=4 7613 B13R1.12 NCCC(=O)c1cccc(F)c1F Amb25367082 [0,2,0,0,0,0|2,0,0]=4 7614 B13R1.12 NCCC(=O)c1cccc(F)c1O Amb25699189 [0,2,0,0,0,0|2,0,0]=4 7615 B13R1.12 NCCC(=O)c1cccc(O)c1Br Amb33386524 [0,2,0,0,0,0|2,0,0]=4 7616 B13R1.12 NCCC(=O)c1cccc(O)c1N Amb26491478 [0,2,0,0,0,0|2,0,0]=4 7617 B13R1.12 NCCC(=O)c1cccc(O)c1N Amb33250322 [0,2,0,0,0,0|2,0,0]=4 7618 B13R1.12 NCCC(=O)c1cccc(O)c1O Amb33269532 [0,2,0,0,0,0|2,0,0]=4 7619 B13R1.12 Nc1c(Br)cccc1C(=O)CCBr Amb27239125 [0,2,0,0,0,0|2,0,0]=4 7620 B13R1.12 Nc1c(Br)cccc1C(=O)CCCl Amb27615947 [0,2,0,0,0,0|2,0,0]=4 7621 B13R1.12 Nc1c(Cl)cccc1C(=O)CCCl Amb27613753 [0,2,0,0,0,0|2,0,0]=4 7622 B13R1.12 Nc1c(I)cccc1C(=O)CCBr Amb27624756 [0,2,0,0,0,0|2,0,0]=4 7623 B13R1.12 Nc1c(I)cccc1C(=O)CCCl Amb28199225 [0,2,0,0,0,0|2,0,0]=4 7624 B13R1.12 Nc1c(O)cccc1C(=O)CCCl Amb27796355 [0,2,0,0,0,0|2,0,0]=4 7625 B13R1.12 Nc1c(S)cccc1C(=O)CCBr Amb28434770 [0,2,0,0,0,0|2,0,0]=4 7626 B13R1.12 Nc1cccc(C(=O)CCBr)c1Br Amb27967995 [0,2,0,0,0,0|2,0,0]=4 7627 B13R1.12 Nc1cccc(C(=O)CCBr)c1Cl Amb27613747 [0,2,0,0,0,0|2,0,0]=4 7628 B13R1.12 Nc1cccc(C(=O)CCBr)c1F Amb28130010 [0,2,0,0,0,0|2,0,0]=4 7629 B13R1.12 Nc1cccc(C(=O)CCBr)c1I Amb27613684 [0,2,0,0,0,0|2,0,0]=4 7630 B13R1.12 Nc1cccc(C(=O)CCBr)c1N Amb27963015 [0,2,0,0,0,0|2,0,0]=4 7631 B13R1.12 Nc1cccc(C(=O)CCCl)c1Br Amb27615948 [0,2,0,0,0,0|2,0,0]=4 7632 B13R1.12 Nc1cccc(C(=O)CCCl)c1Cl Amb27796717 [0,2,0,0,0,0|2,0,0]=4 7633 B13R1.12 O=C(CCBr)c1cccc(Br)c1Br Amb27848949 [0,2,0,0,0,0|2,0,0]=4 7634 B13R1.12 O=C(CCBr)c1cccc(Br)c1Cl Amb24520869 [0,2,0,0,0,0|2,0,0]=4 7635 B13R1.12 O=C(CCBr)c1cccc(Br)c1F Amb25363999 [0,2,0,0,0,0|2,0,0]=4 7636 B13R1.12 O=C(CCBr)c1cccc(Br)c1I Amb26331476 [0,2,0,0,0,0|2,0,0]=4 7637 B13R1.12 O=C(CCBr)c1cccc(Br)c1O Amb24597052 [0,2,0,0,0,0|2,0,0]=4 7638 B13R1.12 O=C(CCBr)c1cccc(Br)c1S Amb26645424 [0,2,0,0,0,0|2,0,0]=4 7639 B13R1.12 O=C(CCBr)c1cccc(Cl)c1Cl Amb26571981 [0,2,0,0,0,0|2,0,0]=4 7640 B13R1.12 O=C(CCBr)c1cccc(Cl)c1F Amb25040085 [0,2,0,0,0,0|2,0,0]=4 7641 B13R1.12 O=C(CCBr)c1cccc(Cl)c1I Amb27585395 [0,2,0,0,0,0|2,0,0]=4 7642 B13R1.12 O=C(CCBr)c1cccc(Cl)c1O Amb28385057 [0,2,0,0,0,0|2,0,0]=4 7643 B13R1.12 O=C(CCBr)c1cccc(F)c1Br Amb27796216 [0,2,0,0,0,0|2,0,0]=4 7644 B13R1.12 O=C(CCBr)c1cccc(F)c1Cl Amb27177096 [0,2,0,0,0,0|2,0,0]=4 7645 B13R1.12 O=C(CCBr)c1cccc(F)c1F Amb28252320 [0,2,0,0,0,0|2,0,0]=4 7646 B13R1.12 O=C(CCBr)c1cccc(F)c1I Amb28186433 [0,2,0,0,0,0|2,0,0]=4 7647 B13R1.12 O=C(CCBr)c1cccc(F)c1O Amb25155135 [0,2,0,0,0,0|2,0,0]=4 7648 B13R1.12 O=C(CCBr)c1cccc(F)c1S Amb26608185 [0,2,0,0,0,0|2,0,0]=4 7649 B13R1.12 O=C(CCBr)c1cccc(I)c1Br Amb24695418 [0,2,0,0,0,0|2,0,0]=4 7650 B13R1.12 O=C(CCBr)c1cccc(I)c1Cl Amb25192126 [0,2,0,0,0,0|2,0,0]=4 7651 B13R1.12 O=C(CCBr)c1cccc(I)c1F Amb24399422 [0,2,0,0,0,0|2,0,0]=4 7652 B13R1.12 O=C(CCBr)c1cccc(I)c1I Amb26067747 [0,2,0,0,0,0|2,0,0]=4 7653 B13R1.12 O=C(CCBr)c1cccc(I)c1O Amb25070925 [0,2,0,0,0,0|2,0,0]=4 7654 B13R1.12 O=C(CCBr)c1cccc(I)c1S Amb27423759 [0,2,0,0,0,0|2,0,0]=4 7655 B13R1.12 O=C(CCBr)c1cccc(O)c1Br Amb27462189 [0,2,0,0,0,0|2,0,0]=4 7656 B13R1.12 O=C(CCBr)c1cccc(O)c1Cl Amb27608282 [0,2,0,0,0,0|2,0,0]=4 7657 B13R1.12 O=C(CCBr)c1cccc(O)c1F Amb25942958 [0,2,0,0,0,0|2,0,0]=4 7658 B13R1.12 O=C(CCBr)c1cccc(O)c1I Amb28252209 [0,2,0,0,0,0|2,0,0]=4 7659 B13R1.12 O=C(CCBr)c1cccc(O)c1O Amb24666001 [0,2,0,0,0,0|2,0,0]=4 7660 B13R1.12 O=C(CCBr)c1cccc(S)c1Br Amb26576236 [0,2,0,0,0,0|2,0,0]=4 7661 B13R1.12 O=C(CCBr)c1cccc(S)c1S Amb25940858 [0,2,0,0,0,0|2,0,0]=4 7662 B13R1.12 O=C(CCCl)c1cccc(Br)c1Br Amb25046914 [0,2,0,0,0,0|2,0,0]=4 7663 B13R1.12 O=C(CCCl)c1cccc(Br)c1Cl Amb27268274 [0,2,0,0,0,0|2,0,0]=4 7664 B13R1.12 O=C(CCCl)c1cccc(Br)c1F Amb27444518 [0,2,0,0,0,0|2,0,0]=4 7665 B13R1.12 O=C(CCCl)c1cccc(Br)c1O Amb27209863 [0,2,0,0,0,0|2,0,0]=4 7666 B13R1.12 O=C(CCCl)c1cccc(Cl)c1Cl Amb25286793 [0,2,0,0,0,0|2,0,0]=4 7667 B13R1.12 O=C(CCCl)c1cccc(Cl)c1F Amb25123725 [0,2,0,0,0,0|2,0,0]=4 7668 B13R1.12 O=C(CCCl)c1cccc(Cl)c1I Amb26849183 [0,2,0,0,0,0|2,0,0]=4 7669 B13R1.12 O=C(CCCl)c1cccc(Cl)c1O Amb25766603 [0,2,0,0,0,0|2,0,0]=4 7670 B13R1.12 O=C(CCCl)c1cccc(Cl)c1S Amb27638853 [0,2,0,0,0,0|2,0,0]=4 7671 B13R1.12 O=C(CCCl)c1cccc(F)c1Br Amb28323375 [0,2,0,0,0,0|2,0,0]=4 7672 B13R1.12 O=C(CCCl)c1cccc(F)c1Cl Amb27778449 [0,2,0,0,0,0|2,0,0]=4 7673 B13R1.12 O=C(CCCl)c1cccc(F)c1I Amb26349275 [0,2,0,0,0,0|2,0,0]=4 7674 B13R1.12 O=C(CCCl)c1cccc(F)c1O Amb24435843 [0,2,0,0,0,0|2,0,0]=4 7675 B13R1.12 O=C(CCCl)c1cccc(F)c1S Amb27423694 [0,2,0,0,0,0|2,0,0]=4 7676 B13R1.12 O=C(CCCl)c1cccc(I)c1Cl Amb25377091 [0,2,0,0,0,0|2,0,0]=4 7677 B13R1.12 O=C(CCCl)c1cccc(I)c1F Amb27608490 [0,2,0,0,0,0|2,0,0]=4 7678 B13R1.12 O=C(CCCl)c1cccc(I)c1O Amb25270100 [0,2,0,0,0,0|2,0,0]=4 7679 B13R1.12 O=C(CCCl)c1cccc(O)c1Br Amb25216322 [0,2,0,0,0,0|2,0,0]=4 7680 B13R1.12 O=C(CCCl)c1cccc(O)c1Cl Amb27748656 [0,2,0,0,0,0|2,0,0]=4 7681 B13R1.12 O=C(CCCl)c1cccc(O)c1I Amb25935728 [0,2,0,0,0,0|2,0,0]=4 7682 B13R1.12 O=C(CCCl)c1cccc(O)c1O Amb27225086 [0,2,0,0,0,0|2,0,0]=4 7683 B13R1.12 O=C(CCCl)c1cccc(S)c1F Amb27423693 [0,2,0,0,0,0|2,0,0]=4 7684 B13R1.12 O=C(CCCl)c1cccc(S)c1I Amb28135670 [0,2,0,0,0,0|2,0,0]=4 7685 B13R1.18 C#CCCC(=O)c1cccc(Br)c1 Amb28242144 [0,2,0,0,0,0|1,0,1]=4 7686 B13R1.18 C#CCNC(=O)c1cccc(Cl)c1 Amb8343990 [0,2,0,0,0,0|1,0,1]=4 7687 B13R1.18 C#CCNC(=O)c1cccc(F)c1 Amb8339744 [0,2,0,0,0,0|1,0,1]=4 7688 B13R1.18 C#CCNC(=O)c1cccc(O)c1 Amb6671239 [0,2,0,0,0,0|1,0,1]=4 7689 B13R1.18 C#CCOC(=O)c1cccc(Br)n1 Amb27218844 [0,2,0,0,0,0|1,0,1]=4 7690 B13R1.18 C#CCOC(=O)c1cccc(I)c1 Amb28182725 [0,2,0,0,0,0|0,0,1]=3 7691 B13R1.18 C#CCOC(=O)c1cccc(O)c1 Amb18929623 [0,2,0,0,0,0|0,0,1]=3 7692 B13R1.18 C#CCOC(=O)c1ccnc(C)c1 Amb27771294 [0,2,0,0,0,0|1,0,1]=4 7693 B13R1.18 C#CCOC(=O)c1ccnc(F)c1 Amb28256523 [0,2,0,0,0,0|1,0,1]=4 7694 B13R1.18 C=CCCC(=O)c1cccc(Cl)c1 Amb32755842 [0,2,0,0,0,0|1,0,1]=4 7695 B13R1.18 C=CCNC(=O)c1cccc(Br)c1 Amb6345710 [0,2,0,0,0,0|1,0,1]=4 7696 B13R1.18 C=CCNC(=O)c1cccc(Cl)c1 Amb3098986 [0,2,0,0,0,0|1,0,1]=4 7697 B13R1.18 C=CCNC(=O)c1cccc(I)c1 Amb6392047 [0,2,0,0,0,0|1,0,1]=4 7698 B13R1.18 C=CCNC(=O)c1cccc(N)c1 Amb6277944 [0,2,0,0,0,0|1,0,1]=4 7699 B13R1.18 CC#CCC(=O)c1cccc(Cl)c1 Amb19061628 [0,2,0,0,0,0|1,0,1]=4 7700 B13R1.18 CC(OCCN)c1cccc(Cl)c1 Amb17079509 [0,2,0,0,0,0|1,0,1]=4 7701 B13R1.18 CC(OCCN)c1cccc(F)c1 Amb17079471 [0,2,0,0,0,0|1,0,1]=4 7702 B13R1.18 CCCCC(=O)c1cccc(Br)c1 Amb17198774 [0,2,0,0,0,0|1,0,0]=3 7703 B13R1.18 CCCCC(=O)c1cccc(C)c1 Amb8391611 [0,2,0,0,0,0|1,0,0]=3 7704 B13R1.18 CCCCC(=O)c1cccc(Cl)c1 Amb17198754 [0,2,0,0,0,0|1,0,0]=3 7705 B13R1.18 CCCCC(=O)c1cccc(I)c1 Amb8391591 [0,2,0,0,0,0|1,0,0]=3 7706 B13R1.18 CCCCC(=O)c1ccnc(Cl)c1 Amb6301675 [0,2,0,0,0,0|2,0,0]=4 7707 B13R1.18 CCCCS(=O)c1cccc(Br)c1 Amb33858729 [0,2,0,0,0,0|2,0,0]=4 7708 B13R1.18 CCCNC(=N)c1cccc(Br)c1 Amb27197251 [0,2,0,0,0,0|2,0,0]=4 7709 B13R1.18 CCCNC(=N)c1cccc(Cl)c1 Amb27650919 [0,2,0,0,0,0|2,0,0]=4 7710 B13R1.18 CCCNC(=O)C1=CC=CC(=O)N1 Amb27979071 [0,2,0,0,0,0|2,0,0]=4 7711 B13R1.18 CCCNC(=O)c1cc(Cl)ccn1 Amb8335273 [0,2,0,0,0,0|2,0,0]=4 7712 B13R1.18 CCCNC(=O)c1ccc[n+]([O-])c1 Amb27431229 [0,2,0,0,0,0|2,0,0]=4 7713 B13R1.18 CCCNC(=O)c1cccc(Br)c1 Amb6351274 [0,2,0,0,0,0|1,0,0]=3 7714 B13R1.18 CCCNC(=O)c1cccc(F)c1 Amb17775273 [0,2,0,0,0,0|1,0,0]=3 7715 B13R1.18 CCCNC(=O)c1cccc(F)n1 Amb27817702 [0,2,0,0,0,0|2,0,0]=4 7716 B13R1.18 CCCNC(=O)c1cccc(I)c1 Amb3888975 [0,2,0,0,0,0|1,0,0]=3 7717 B13R1.18 CCCNC(=O)c1cccc(N)c1 Amb1113441 [0,2,0,0,0,0|1,0,0]=3 7718 B13R1.18 CCCNC(=O)c1cccc(N)n1 Amb18987778 [0,2,0,0,0,0|2,0,0]=4 7719 B13R1.18 CCCNC(=O)c1cccc(O)c1 Amb6671458 [0,2,0,0,0,0|1,0,0]=3 7720 B13R1.18 CCCNC(=O)c1ccnc(Br)c1 Amb27832997 [0,2,0,0,0,0|2,0,0]=4 7721 B13R1.18 CCCNC(=O)c1ccnc(Cl)c1 Amb6667922 [0,2,0,0,0,0|2,0,0]=4 7722 B13R1.18 CCCNC(=O)c1ccnc(N)c1 Amb18986828 [0,2,0,0,0,0|2,0,0]=4 7723 B13R1.18 CCCNC(=O)c1cncc(Br)c1 Amb19959738 [0,2,0,0,0,0|2,0,0]=4 7724 B13R1.18 CCCNC(=O)c1cncc(Cl)c1 Amb27178774 [0,2,0,0,0,0|2,0,0]=4 7725 B13R1.18 CCCNC(=O)c1cncc(F)c1 Amb27236469 [0,2,0,0,0,0|2,0,0]=4 7726 B13R1.18 CCCNC(=O)c1cncc(I)c1 Amb28051288 [0,2,0,0,0,0|2,0,0]=4 7727 B13R1.18 CCCNC(=O)c1cncc(N)c1 Amb27466249 [0,2,0,0,0,0|2,0,0]=4 7728 B13R1.18 CCCNC(=O)c1cncc(O)c1 Amb28241848 [0,2,0,0,0,0|2,0,0]=4 7729 B13R1.18 CCCOC(=O)c1cccc(N)c1 Amb8873722 [0,2,0,0,0,0|0,0,0]=2 7730 B13R1.18 CCNCC(=O)c1cccc(Br)c1 Amb17315031 [0,2,0,0,0,0|1,0,0]=3 7731 B13R1.18 CCNCC(=O)c1cccc(N)c1 Amb18550939 [0,2,0,0,0,0|1,0,0]=3 7732 B13R1.18 CCNCC(=O)c1cccc(O)c1 Amb17594589 [0,2,0,0,0,0|1,0,0]=3 7733 B13R1.18 CCOCC(=O)c1ccnc(Cl)c1 Amb6301691 [0,2,0,0,0,0|1,0,0]=3 7734 B13R1.18 CCONC(=O)C1=CC=CC(=O)N1 Amb28366563 [0,2,0,0,0,0|1,0,0]=3 7735 B13R1.18 CCONC(=O)c1cc(N)ccn1 Amb28248087 [0,2,0,0,0,0|1,0,0]=3 7736 B13R1.18 CCONC(=O)c1ccc[n+]([O-])c1 Amb27771149 [0,2,0,0,0,0|1,0,0]=3 7737 B13R1.18 CCONC(=O)c1cccc(C)c1 Amb27213148 [0,2,0,0,0,0|0,0,0]=2 7738 B13R1.18 CCONC(=O)c1cccc(F)n1 Amb28437223 [0,2,0,0,0,0|1,0,0]=3 7739 B13R1.18 CCONC(=O)c1cccc(N)c1 Amb27771451 [0,2,0,0,0,0|0,0,0]=2 7740 B13R1.18 CCONC(=O)c1ccnc(F)c1 Amb27394975 [0,2,0,0,0,0|1,0,0]=3 7741 B13R1.18 CCONC(=O)c1cncc(Br)c1 Amb8272385 [0,2,0,0,0,0|1,0,0]=3 7742 B13R1.18 CCONC(=O)c1cncc(Cl)n1 Amb28317225 [0,2,0,0,0,0|2,0,0]=4 7743 B13R1.18 CCONC(C)c1cccc(Br)c1 Amb32655879 [0,2,0,0,0,0|1,0,1]=4 7744 B13R1.18 CCO\N=C(/N)c1cccc(Br)c1 Amb18227733 [0,2,0,0,0,0|1,0,0]=3 7745 B13R1.18 CCO\N=C(/N)c1cccc(C)c1 Amb18224607 [0,2,0,0,0,0|1,0,0]=3 7746 B13R1.18 CCO\N=C(/N)c1cccc(Cl)c1 Amb18225013 [0,2,0,0,0,0|1,0,0]=3 7747 B13R1.18 CCO\N=C(/N)c1cccc(F)c1 Amb18224740 [0,2,0,0,0,0|1,0,0]=3 7748 B13R1.18 CCO\N=C(\C)c1cccc(F)c1 Amb27394704 [0,2,0,0,0,0|1,0,0]=3 7749 B13R1.18 CCO\N=C(\C)c1ccnc(F)c1 Amb27261171 [0,2,0,0,0,0|2,0,0]=4 7750 B13R1.18 CCO\N=C(\C)c1cncc(F)c1 Amb27769597 [0,2,0,0,0,0|2,0,0]=4 7751 B13R1.18 CCSCC(=O)c1cccc(Br)c1 Amb9668525 [0,2,0,0,0,0|0,1,0]=3 7752 B13R1.18 CCSCC(=O)c1cccc(C)c1 Amb9668496 [0,2,0,0,0,0|0,1,0]=3 7753 B13R1.18 CCSCC(=O)c1cccc(Cl)c1 Amb9668522 [0,2,0,0,0,0|0,1,0]=3 7754 B13R1.18 CCSCC(=O)c1cccc(F)c1 Amb9668513 [0,2,0,0,0,0|0,1,0]=3 7755 B13R1.18 CC\C=C\C(=O)c1cncc(C)c1 Amb28136485 [0,2,0,0,0,0|2,0,0]=4 7756 B13R1.18 CC\C=C\C(=O)c1cncc(F)c1 Amb27664354 [0,2,0,0,0,0|2,0,0]=4 7757 B13R1.18 CNCCC(=O)c1cccc(N)c1 Amb18862931 [0,2,0,0,0,0|1,0,0]=3 7758 B13R1.18 CNC\C=C(/C)c1cccc(Br)c1 Amb31137994 [0,2,0,0,0,0|2,0,0]=4 7759 B13R1.18 CNC\C=C(/C)c1cccc(C)c1 Amb31174809 [0,2,0,0,0,0|2,0,0]=4 7760 B13R1.18 CNC\C=C(/C)c1cccc(F)c1 Amb31174822 [0,2,0,0,0,0|2,0,0]=4 7761 B13R1.18 CNC\C=C(\C)c1cccc(F)c1 Amb27426868 [0,2,0,0,0,0|2,0,0]=4 7762 B13R1.18 COCCC(=O)c1cccc(C)c1 Amb17233413 [0,2,0,0,0,0|1,0,0]=3 7763 B13R1.18 COCCC(=O)c1cccc(Cl)c1 Amb17236837 [0,2,0,0,0,0|1,0,0]=3 7764 B13R1.18 COCCC(=O)c1cccc(F)c1 Amb17233889 [0,2,0,0,0,0|1,0,0]=3 7765 B13R1.18 C\C(=C/CCBr)c1cccc(C)c1 Amb17254616 [0,2,0,0,0,0|2,0,0]=4 7766 B13R1.18 C\C(=C/CCBr)c1cccc(Cl)c1 Amb17267357 [0,2,0,0,0,0|2,0,0]=4 7767 B13R1.18 C\C(=C/CCBr)c1cccc(F)c1 Amb17256419 [0,2,0,0,0,0|2,0,0]=4 7768 B13R1.18 C\C(=C/CCCl)c1cccc(C)c1 Amb17236143 [0,2,0,0,0,0|2,0,0]=4 7769 B13R1.18 C\C(=C/CCCl)c1cccc(Cl)c1 Amb17241876 [0,2,0,0,0,0|2,0,0]=4 7770 B13R1.18 C\C(=C/CCCl)c1cccc(F)c1 Amb17236850 [0,2,0,0,0,0|2,0,0]=4 7771 B13R1.18 C\C(=C/CCN)c1cccc(Br)c1 Amb31137996 [0,2,0,0,0,0|2,0,0]=4 7772 B13R1.18 C\C(=C/CCN)c1cccc(C)c1 Amb17233143 [0,2,0,0,0,0|2,0,0]=4 7773 B13R1.18 C\C(=C/CCN)c1cccc(Cl)c1 Amb17236341 [0,2,0,0,0,0|2,0,0]=4 7774 B13R1.18 C\C(=C/CCN)c1cccc(F)c1 Amb17233552 [0,2,0,0,0,0|2,0,0]=4 7775 B13R1.18 C\C(=C\CCBr)c1cccc(Br)c1 Amb29880788 [0,2,0,0,0,0|2,0,0]=4 7776 B13R1.18 C\C(=C\CCCl)c1cccc(Br)c1 Amb29880787 [0,2,0,0,0,0|2,0,0]=4 7777 B13R1.18 C\C(=C\CCCl)c1cccc(F)c1 Amb27415845 [0,2,0,0,0,0|2,0,0]=4 7778 B13R1.18 C\C(=C\CCN)c1cccc(Cl)c1 Amb28251959 [0,2,0,0,0,0|2,0,0]=4 7779 B13R1.18 C\C(=C\CCN)c1cccc(F)c1 Amb27637986 [0,2,0,0,0,0|2,0,0]=4 7780 B13R1.18 C\C=C/OC(=O)c1cccc(O)c1 Amb27256345 [0,2,0,0,0,0|0,0,1]=3 7781 B13R1.18 C\C=N\NC(=O)c1cccc(Br)c1 Amb2591878 [0,2,0,0,0,0|1,0,1]=4 7782 B13R1.18 Cc1cc(C(=O)NCCF)ccn1 Amb28292064 [0,2,0,0,0,0|2,0,0]=4 7783 B13R1.18 Cc1cccc(C(=O)CCC#N)c1 Amb9472188 [0,2,0,0,0,0|1,0,1]=4 7784 B13R1.18 Cc1cccc(C(=O)CCCN)c1 Amb18195909 [0,2,0,0,0,0|1,0,0]=3 7785 B13R1.18 Cc1cccc(C(=O)NCC#N)c1 Amb6407931 [0,2,0,0,0,0|1,0,1]=4 7786 B13R1.18 Cc1cccc(C(=O)NCC=O)c1 Amb17102067 [0,2,0,0,0,0|1,0,1]=4 7787 B13R1.18 Cc1cccc(C(=O)NCCCl)c1 Amb17103200 [0,2,0,0,0,0|1,0,0]=3 7788 B13R1.18 Cc1cccc(C(=O)NCCF)n1 Amb27982656 [0,2,0,0,0,0|2,0,0]=4 7789 B13R1.18 Cc1cccc(C(=O)NCCI)c1 Amb27396208 [0,2,0,0,0,0|1,0,0]=3 7790 B13R1.18 Cc1cccc(C(=O)NCCN)c1 Amb1128047 [0,2,0,0,0,0|1,0,0]=3 7791 B13R1.18 Cc1cccc(C(=O)NCCN)n1 Amb1129601 [0,2,0,0,0,0|2,0,0]=4 7792 B13R1.18 Cc1cccc(C(=O)NCCO)c1 Amb1211722 [0,2,0,0,0,0|1,0,0]=3 7793 B13R1.18 Cc1cccc(C(C)OCCN)c1 Amb17079426 [0,2,0,0,0,0|1,0,1]=4 7794 B13R1.18 Cc1ccnc(C(=O)CCCN)c1 Amb18195254 [0,2,0,0,0,0|2,0,0]=4 7795 B13R1.18 Cc1cncc(C(=O)NCCF)c1 Amb27774687 [0,2,0,0,0,0|2,0,0]=4 7796 B13R1.18 Cc1cncc(C(=O)NCCI)c1 Amb27870639 [0,2,0,0,0,0|2,0,0]=4 7797 B13R1.18 N#CCCC(=O)c1cccc(Br)c1 Amb3941060 [0,2,0,0,0,0|1,0,1]=4 7798 B13R1.18 N#CCCC(=O)c1cccc(Cl)c1 Amb6301834 [0,2,0,0,0,0|1,0,1]=4 7799 B13R1.18 N#CCCC(=O)c1cccc(I)c1 Amb6301848 [0,2,0,0,0,0|1,0,1]=4 7800 B13R1.18 N#CCCC(=O)c1cccc(O)c1 Amb17133643 [0,2,0,0,0,0|1,0,1]=4 7801 B13R1.18 N#CCNC(=O)c1cccc(Br)c1 Amb6407057 [0,2,0,0,0,0|1,0,1]=4 7802 B13R1.18 N#CCNC(=O)c1cccc(Cl)c1 Amb3886956 [0,2,0,0,0,0|1,0,1]=4 7803 B13R1.18 N#CCOC(=O)C1=CC(=O)NC=C1 Amb27980146 [0,2,0,0,0,0|1,0,1]=4 7804 B13R1.18 N#CCOC(=O)c1cccc(Br)n1 Amb28205703 [0,2,0,0,0,0|1,0,1]=4 7805 B13R1.18 N#CCOC(=O)c1cccc(Cl)c1 Amb27254956 [0,2,0,0,0,0|0,0,1]=3 7806 B13R1.18 N#CCOC(=O)c1cccc(Cl)n1 Amb27255951 [0,2,0,0,0,0|1,0,1]=4 7807 B13R1.18 N#CCOC(=O)c1cccc(I)c1 Amb388793 [0,2,0,0,0,0|0,0,1]=3 7808 B13R1.18 N#CCOC(=O)c1cncc(N)c1 Amb28189845 [0,2,0,0,0,0|1,0,1]=4 7809 B13R1.18 NCCCC(=O)c1cccc(Cl)c1 Amb18188152 [0,2,0,0,0,0|1,0,0]=3 7810 B13R1.18 NCCNC(=O)C1=CC(=O)NC=C1 Amb27596259 [0,2,0,0,0,0|2,0,0]=4 7811 B13R1.18 NCCNC(=O)C1=CC=CC(=O)N1 Amb28366940 [0,2,0,0,0,0|2,0,0]=4 7812 B13R1.18 NCCNC(=O)c1ccc[n+]([O-])c1 Amb27660480 [0,2,0,0,0,0|2,0,0]=4 7813 B13R1.18 NCCNC(=O)c1cccc(Br)c1 Amb13952146 [0,2,0,0,0,0|1,0,0]=3 7814 B13R1.18 NCCNC(=O)c1cccc(Br)c1 Amb6271229 [0,2,0,0,0,0|1,0,0]=3 7815 B13R1.18 NCCNC(=O)c1cccc(Cl)c1 Amb1139275 [0,2,0,0,0,0|1,0,0]=3 7816 B13R1.18 NCCNC(=O)c1cccc(Cl)n1 Amb18987800 [0,2,0,0,0,0|2,0,0]=4 7817 B13R1.18 NCCNC(=O)c1cccc(F)c1 Amb1128710 [0,2,0,0,0,0|1,0,0]=3 7818 B13R1.18 NCCNC(=O)c1cccc(N)n1 Amb27648072 [0,2,0,0,0,0|2,0,0]=4 7819 B13R1.18 NCCNC(=O)c1cccc(O)c1 Amb1125097 [0,2,0,0,0,0|1,0,0]=3 7820 B13R1.18 NCCNC(=O)c1ccnc(Cl)c1 Amb18290742 [0,2,0,0,0,0|2,0,0]=4 7821 B13R1.18 NCCNC(=O)c1cncc(Br)c1 Amb9208294 [0,2,0,0,0,0|2,0,0]=4 7822 B13R1.18 NCCNC(=O)c1cncc(Cl)c1 Amb28386211 [0,2,0,0,0,0|2,0,0]=4 7823 B13R1.18 NCCNC(=O)c1cncc(O)c1 Amb28427905 [0,2,0,0,0,0|2,0,0]=4 7824 B13R1.18 Nc1cc(C(=O)NCCF)ccn1 Amb28381536 [0,2,0,0,0,0|2,0,0]=4 7825 B13R1.18 Nc1cc(C(=O)NCCO)ccn1 Amb27180259 [0,2,0,0,0,0|2,0,0]=4 7826 B13R1.18 Nc1cccc(C(=O)NCCF)c1 Amb27225434 [0,2,0,0,0,0|1,0,0]=3 7827 B13R1.18 Nc1cccc(C(=O)NCCO)c1 Amb13952051 [0,2,0,0,0,0|1,0,0]=3 7828 B13R1.18 Nc1cccc(C(=O)NCCO)c1 Amb8997248 [0,2,0,0,0,0|1,0,0]=3 7829 B13R1.18 Nc1cncc(C(=O)NCCO)c1 Amb24412892 [0,2,0,0,0,0|2,0,0]=4 7830 B13R1.18 O=C(CCCCl)c1cccc(Br)c1 Amb6301790 [0,2,0,0,0,0|1,0,0]=3 7831 B13R1.18 O=C(CCCCl)c1cccc(Cl)c1 Amb6301861 [0,2,0,0,0,0|1,0,0]=3 7832 B13R1.18 O=C(CCCCl)c1ccnc(Cl)c1 Amb6301693 [0,2,0,0,0,0|2,0,0]=4 7833 B13R1.18 O=C(CCCCl)c1cncc(Br)c1 Amb32405034 [0,2,0,0,0,0|2,0,0]=4 7834 B13R1.18 O=C(NCCBr)c1cncc(Br)c1 Amb8825008 [0,2,0,0,0,0|2,0,0]=4 7835 B13R1.18 O=C(NCCCl)c1cccc(Br)c1 Amb17103205 [0,2,0,0,0,0|1,0,0]=3 7836 B13R1.18 O=C(NCCCl)c1cccc(Cl)c1 Amb17103233 [0,2,0,0,0,0|1,0,0]=3 7837 B13R1.18 O=C(NCCCl)c1cccc(F)c1 Amb17103202 [0,2,0,0,0,0|1,0,0]=3 7838 B13R1.18 O=C(NCCCl)c1cccc(I)c1 Amb27455874 [0,2,0,0,0,0|1,0,0]=3 7839 B13R1.18 O=C(NCCCl)c1cccc(O)c1 Amb27587091 [0,2,0,0,0,0|1,0,0]=3 7840 B13R1.18 O=C(NCCCl)c1cncc(Br)c1 Amb27414545 [0,2,0,0,0,0|2,0,0]=4 7841 B13R1.18 O=C(NCCF)c1ccc[n+]([O-])c1 Amb27406607 [0,2,0,0,0,0|2,0,0]=4 7842 B13R1.18 O=C(NCCF)c1cccc(Br)c1 Amb27223755 [0,2,0,0,0,0|1,0,0]=3 7843 B13R1.18 O=C(NCCF)c1cccc(Cl)c1 Amb28125429 [0,2,0,0,0,0|1,0,0]=3 7844 B13R1.18 O=C(NCCF)c1cccc(Cl)n1 Amb27814789 [0,2,0,0,0,0|2,0,0]=4 7845 B13R1.18 O=C(NCCF)c1cccc(F)c1 Amb27771164 [0,2,0,0,0,0|1,0,0]=3 7846 B13R1.18 O=C(NCCF)c1cccc(O)c1 Amb27413341 [0,2,0,0,0,0|1,0,0]=3 7847 B13R1.18 O=C(NCCF)c1cccc(S)c1 Amb27952804 [0,2,0,0,0,0|1,0,0]=3 7848 B13R1.18 O=C(NCCF)c1cncc(F)c1 Amb27968878 [0,2,0,0,0,0|2,0,0]=4 7849 B13R1.18 O=C(NCCI)c1cncc(F)c1 Amb28382410 [0,2,0,0,0,0|2,0,0]=4 7850 B13R1.18 O=C(NCCO)c1cc(Br)ccn1 Amb27793875 [0,2,0,0,0,0|2,0,0]=4 7851 B13R1.18 O=C(NCCO)c1ccc[n+]([O-])c1 Amb27857193 [0,2,0,0,0,0|2,0,0]=4 7852 B13R1.18 O=C(NCCO)c1cccc(Br)c1 Amb9242281 [0,2,0,0,0,0|1,0,0]=3 7853 B13R1.18 O=C(NCCO)c1cccc(Cl)c1 Amb6328036 [0,2,0,0,0,0|1,0,0]=3 7854 B13R1.18 O=C(NCCO)c1cccc(Cl)n1 Amb18333896 [0,2,0,0,0,0|2,0,0]=4 7855 B13R1.18 O=C(NCCO)c1cccc(F)c1 Amb931590 [0,2,0,0,0,0|1,0,0]=3 7856 B13R1.18 O=C(NCCO)c1cccc(I)c1 Amb6430137 [0,2,0,0,0,0|1,0,0]=3 7857 B13R1.18 O=C(NCCO)c1cccc(O)c1 Amb4318080 [0,2,0,0,0,0|1,0,0]=3 7858 B13R1.18 O=C(NCCO)c1cccc(S)c1 Amb27472358 [0,2,0,0,0,0|1,0,0]=3 7859 B13R1.18 O=C(NCCO)c1ccnc(Cl)c1 Amb19091272 [0,2,0,0,0,0|2,0,0]=4 7860 B13R1.18 O=C(NCCO)c1ccnc(F)c1 Amb19045361 [0,2,0,0,0,0|2,0,0]=4 7861 B13R1.18 O=C(NCCO)c1cncc(Br)c1 Amb9242307 [0,2,0,0,0,0|2,0,0]=4 7862 B13R1.18 O=CCNC(=O)c1cccc(Br)c1 Amb17102073 [0,2,0,0,0,0|1,0,1]=4 7863 B13R1.18 O=CCNC(=O)c1cccc(Cl)c1 Amb17102104 [0,2,0,0,0,0|1,0,1]=4 7864 B13R1.18 O=CCNC(=O)c1cccc(F)c1 Amb17102070 [0,2,0,0,0,0|1,0,1]=4 7865 B13R1.18 OCCNC(=S)c1cccc(Cl)c1 Amb28197194 [0,2,0,0,0,0|1,1,0]=4 7866 B13R1.22 CC(CN)C(=O)c1cccc(Br)c1 Amb30021566 [0,2,0,0,0,0|2,0,0]=4 7867 B13R1.22 CCC(=O)C(=O)c1cccc(Br)c1 Amb25244807 [0,2,0,0,0,0|1,0,0]=3 7868 B13R1.22 CCC(=O)C(=O)c1cccc(C)c1 Amb26862253 [0,2,0,0,0,0|1,0,0]=3 7869 B13R1.22 CCC(=O)C(=O)c1cccc(F)c1 Amb25873316 [0,2,0,0,0,0|1,0,0]=3 7870 B13R1.22 CCC(C)C(=O)c1cccc(Br)c1 Amb27668477 [0,2,0,0,0,0|1,0,0]=3 7871 B13R1.22 CCC(C)C(=O)c1cccc(Cl)c1 Amb28041298 [0,2,0,0,0,0|1,0,0]=3 7872 B13R1.22 CCC(C)C(=O)c1ccnc(Cl)c1 Amb27763316 [0,2,0,0,0,0|2,0,0]=4 7873 B13R1.22 CCC(C)C(=O)c1cncc(Br)c1 Amb27647760 [0,2,0,0,0,0|2,0,0]=4 7874 B13R1.22 CCC(C)C(=O)c1cncc(F)c1 Amb28288891 [0,2,0,0,0,0|2,0,0]=4 7875 B13R1.22 CCC(C)S(=O)c1cccc(F)c1 Amb28434577 [0,2,0,0,0,0|2,0,0]=4 7876 B13R1.22 CCC(C)S(=O)c1cccc(N)c1 Amb27609099 [0,2,0,0,0,0|2,0,0]=4 7877 B13R1.22 CCC(Cl)C(=O)c1cccc(Br)c1 Amb18049338 [0,2,0,0,0,0|1,0,0]=3 7878 B13R1.22 CCC(Cl)C(=O)c1cccc(Cl)c1 Amb28071315 [0,2,0,0,0,0|1,0,0]=3 7879 B13R1.22 CCC(N)C(=O)c1cccc(Br)c1 Amb18156128 [0,2,0,0,0,0|1,0,0]=3 7880 B13R1.22 CCC(N)C(=O)c1cccc(C)c1 Amb18195907 [0,2,0,0,0,0|1,0,0]=3 7881 B13R1.22 CCC(O)C(=O)c1cccc(Br)c1 Amb35614572 [0,2,0,0,0,0|1,0,0]=3 7882 B13R1.22 CCC(O)C(=O)c1cncc(F)c1 Amb27852629 [0,2,0,0,0,0|2,0,0]=4 7883 B13R1.22 CCN(C)C(=O)C1=CC(=O)NC=C1 Amb27627226 [0,2,0,0,0,0|2,0,0]=4 7884 B13R1.22 CCN(C)C(=O)C1=CC=CC(=O)N1 Amb28070652 [0,2,0,0,0,0|2,0,0]=4 7885 B13R1.22 CCN(C)C(=O)c1cc(Cl)ccn1 Amb8873900 [0,2,0,0,0,0|2,0,0]=4 7886 B13R1.22 CCN(C)C(=O)c1ccc[n+]([O-])c1 Amb27834852 [0,2,0,0,0,0|2,0,0]=4 7887 B13R1.22 CCN(C)C(=O)c1cccc(N)c1 Amb33526911 [0,2,0,0,0,0|1,0,0]=3 7888 B13R1.22 CCN(C)C(=O)c1cccc(N)n1 Amb18959763 [0,2,0,0,0,0|2,0,0]=4 7889 B13R1.22 CCN(C)C(=O)c1cccc(O)c1 Amb8891040 [0,2,0,0,0,0|1,0,0]=3 7890 B13R1.22 CCN(C)C(=O)c1cncc(I)c1 Amb28249461 [0,2,0,0,0,0|2,0,0]=4 7891 B13R1.22 CCN(O)C(=O)C1=CC(=O)NC=C1 Amb27640400 [0,2,0,0,0,0|2,0,0]=4 7892 B13R1.22 CCN(O)C(=O)c1cccc(Br)n1 Amb27216867 [0,2,0,0,0,0|2,0,0]=4 7893 B13R1.22 CCN(O)C(=O)c1cccc(N)c1 Amb27625763 [0,2,0,0,0,0|1,0,0]=3 7894 B13R1.22 CCN(O)C(=O)c1cccc(N)n1 Amb27202456 [0,2,0,0,0,0|2,0,0]=4 7895 B13R1.22 CCN(O)C(=O)c1ccnc(Br)c1 Amb27975906 [0,2,0,0,0,0|2,0,0]=4 7896 B13R1.22 CCN(O)C(=O)c1ccnc(Cl)c1 Amb27210463 [0,2,0,0,0,0|2,0,0]=4 7897 B13R1.22 CC[C@@H](N)C(=O)c1cccc(Br)c1 Amb35659397 [0,2,0,0,0,0|1,0,0]=3 7898 B13R1.22 CC[C@@H](N)C(=O)c1cccc(C)c1 Amb30024578 [0,2,0,0,0,0|1,0,0]=3 7899 B13R1.22 CC[C@@H](N)C(=O)c1cccc(Cl)c1 Amb35602685 [0,2,0,0,0,0|1,0,0]=3 7900 B13R1.22 CC[C@@H](N)C(=O)c1cccc(F)c1 Amb30024588 [0,2,0,0,0,0|1,0,0]=3 7901 B13R1.22 CC[C@@H](N)C(=O)c1cncc(C)c1 Amb30024583 [0,2,0,0,0,0|2,0,0]=4 7902 B13R1.22 CC[C@@H](N)C(=O)c1cncc(F)c1 Amb35601711 [0,2,0,0,0,0|2,0,0]=4 7903 B13R1.22 CC[C@H](N)C(=O)c1cccc(Br)c1 Amb35601336 [0,2,0,0,0,0|1,0,0]=3 7904 B13R1.22 CC[C@H](N)C(=O)c1cccc(C)c1 Amb35599736 [0,2,0,0,0,0|1,0,0]=3 7905 B13R1.22 CC[C@H](N)C(=O)c1cccc(Cl)c1 Amb35659328 [0,2,0,0,0,0|1,0,0]=3 7906 B13R1.22 CC[C@H](N)C(=O)c1cccc(F)c1 Amb35600744 [0,2,0,0,0,0|1,0,0]=3 7907 B13R1.22 CC[C@H](N)C(=O)c1cncc(C)c1 Amb35600740 [0,2,0,0,0,0|2,0,0]=4 7908 B13R1.22 CC[C@H](N)C(=O)c1cncc(F)c1 Amb35600752 [0,2,0,0,0,0|2,0,0]=4 7909 B13R1.22 CNC(=O)C(=O)c1cccc(C)c1 Amb33231721 [0,2,0,0,0,0|2,0,0]=4 7910 B13R1.22 CNC(C)C(=O)c1cccc(Br)c1 Amb26877485 [0,2,0,0,0,0|2,0,0]=4 7911 B13R1.22 CNC(C)C(=O)c1cccc(C)c1 Amb27873898 [0,2,0,0,0,0|2,0,0]=4 7912 B13R1.22 CNC(C)C(=O)c1cccc(Cl)c1 Amb19889606 [0,2,0,0,0,0|2,0,0]=4 7913 B13R1.22 CNC(C)C(=O)c1cccc(F)c1 Amb28282705 [0,2,0,0,0,0|2,0,0]=4 7914 B13R1.22 CNC(C)C(=O)c1cccc(N)c1 Amb28140764 [0,2,0,0,0,0|2,0,0]=4 7915 B13R1.22 CN[C@@H](C)C(=O)c1cccc(Br)c1 Amb35662340 [0,2,0,0,0,0|2,0,0]=4 7916 B13R1.22 CN[C@@H](C)C(=O)c1cccc(C)c1 Amb35659957 [0,2,0,0,0,0|2,0,0]=4 7917 B13R1.22 CN[C@@H](C)C(=O)c1cccc(Cl)c1 Amb29891462 [0,2,0,0,0,0|2,0,0]=4 7918 B13R1.22 CN[C@@H](C)C(=O)c1cccc(F)c1 Amb35659966 [0,2,0,0,0,0|2,0,0]=4 7919 B13R1.22 COC(=O)C(=O)c1cccc(Br)c1 Amb22498288 [0,2,0,0,0,0|2,0,0]=4 7920 B13R1.22 COC(=O)C(=O)c1cccc(C)c1 Amb22755054 [0,2,0,0,0,0|2,0,0]=4 7921 B13R1.22 COC(=O)C(=O)c1cccc(Cl)c1 Amb22755093 [0,2,0,0,0,0|2,0,0]=4 7922 B13R1.22 COC(=O)C(=O)c1cccc(F)c1 Amb25160749 [0,2,0,0,0,0|2,0,0]=4 7923 B13R1.22 COC(=O)C(=O)c1cccc(I)c1 Amb25738459 [0,2,0,0,0,0|2,0,0]=4 7924 B13R1.22 COC(=O)C(=O)c1cccc(N)c1 Amb27449913 [0,2,0,0,0,0|2,0,0]=4 7925 B13R1.22 COC(C)C(=O)c1cccc(Br)c1 Amb35614573 [0,2,0,0,0,0|2,0,0]=4 7926 B13R1.22 COC(C)C(=O)c1cccc(F)c1 Amb27663099 [0,2,0,0,0,0|2,0,0]=4 7927 B13R1.22 CON(C)C(=O)c1cccc(Br)c1 Amb8387471 [0,2,0,0,0,0|2,0,0]=4 7928 B13R1.22 CON(C)C(=O)c1cccc(C)c1 Amb8387597 [0,2,0,0,0,0|2,0,0]=4 7929 B13R1.22 CON(C)C(=O)c1cccc(Cl)c1 Amb8387494 [0,2,0,0,0,0|2,0,0]=4 7930 B13R1.22 CON(C)C(=O)c1cccc(F)c1 Amb8387610 [0,2,0,0,0,0|2,0,0]=4 7931 B13R1.22 CON(C)C(=O)c1cccc(N)c1 Amb9492081 [0,2,0,0,0,0|2,0,0]=4 7932 B13R1.22 CON(C)C(=O)c1cccc(O)c1 Amb28241933 [0,2,0,0,0,0|2,0,0]=4 7933 B13R1.22 CSC(C)C(=O)c1cccc(Cl)c1 Amb25110469 [0,2,0,0,0,0|2,0,0]=4 7934 B13R1.22 O=C(c1cccc(Br)c1)C(Cl)CCl Amb17371797 [0,2,0,0,0,0|2,0,0]=4 7935 B13R1.22 O=C(c1cccc(Cl)c1)C(Br)CBr Amb27804121 [0,2,0,0,0,0|2,0,0]=4 7936 B13R1.30 CCCS(=O)(=O)c1cccc(Br)c1 Amb18065211 [0,2,0,0,0,0|2,0,0]=4 7937 B13R1.30 CCNS(=O)(=O)c1cccc(Br)c1 Amb1570721 [0,2,0,0,0,0|2,0,0]=4 7938 B13R1.30 CCNS(=O)(=O)c1cccc(C)c1 Amb8872722 [0,2,0,0,0,0|2,0,0]=4 7939 B13R1.30 CCNS(=O)(=O)c1cccc(Cl)c1 Amb42626 [0,2,0,0,0,0|2,0,0]=4 7940 B13R1.30 CCNS(=O)(=O)c1cccc(F)c1 Amb40218 [0,2,0,0,0,0|2,0,0]=4 7941 B13R1.30 CCNS(=O)(=O)c1cccc(I)c1 Amb24344601 [0,2,0,0,0,0|2,0,0]=4 7942 B13R1.30 CCNS(=O)(=O)c1cccc(N)c1 Amb1130466 [0,2,0,0,0,0|2,0,0]=4 7943 B13R1.30 CCNS(=O)(=O)c1cccc(O)c1 Amb27608745 [0,2,0,0,0,0|2,0,0]=4 7944 B13R1.30 CCOS(=O)(=O)c1cccc(Br)c1 Amb22044924 [0,2,0,0,0,0|1,0,0]=3 7945 B13R1.30 CCOS(=O)(=O)c1cccc(N)c1 Amb8426918 [0,2,0,0,0,0|1,0,0]=3 7946 B13R1.147 C=C(C)CC(=O)c1cccc(Br)c1 Amb18071326 [0,2,0,0,0,0|1,0,1]=4 7947 B13R1.147 C=C(C)CC(=O)c1cccc(C)c1 Amb18065523 [0,2,0,0,0,0|1,0,1]=4 7948 B13R1.147 C=C(C)CC(=O)c1cccc(Cl)c1 Amb18066345 [0,2,0,0,0,0|1,0,1]=4 7949 B13R1.147 C=C(C)CC(=O)c1cccc(F)c1 Amb18065746 [0,2,0,0,0,0|1,0,1]=4 7950 B13R1.147 C=C(C)CC(=O)c1cccc(N)c1 Amb27756343 [0,2,0,0,0,0|1,0,1]=4 7951 B13R1.147 CC(=O)CC(=O)c1cccc(Br)c1 Amb7762484 [0,2,0,0,0,0|1,0,1]=4 7952 B13R1.147 CC(=O)CC(=O)c1cccc(C)c1 Amb18178269 [0,2,0,0,0,0|1,0,1]=4 7953 B13R1.147 CC(=O)CC(=O)c1cccc(Cl)c1 Amb7762491 [0,2,0,0,0,0|1,0,1]=4 7954 B13R1.147 CC(=O)CC(=O)c1cccc(F)c1 Amb7762487 [0,2,0,0,0,0|1,0,1]=4 7955 B13R1.147 CC(C)=CC(=O)c1cccc(Br)c1 Amb27794194 [0,2,0,0,0,0|1,0,1]=4 7956 B13R1.147 CC(C)=CC(=O)c1cccc(C)c1 Amb28124557 [0,2,0,0,0,0|1,0,1]=4 7957 B13R1.147 CC(C)=CC(=O)c1cccc(F)c1 Amb27639818 [0,2,0,0,0,0|1,0,1]=4 7958 B13R1.147 CC(C)CC(=O)c1cccc(Br)c1 Amb17198775 [0,2,0,0,0,0|1,0,0]=3 7959 B13R1.147 CC(C)CC(=O)c1cccc(Cl)c1 Amb17198755 [0,2,0,0,0,0|1,0,0]=3 7960 B13R1.147 CC(C)CC(=O)c1cccc(F)c1 Amb17233681 [0,2,0,0,0,0|1,0,0]=3 7961 B13R1.147 CC(C)CC(=O)c1cccc(N)c1 Amb17335171 [0,2,0,0,0,0|1,0,0]=3 7962 B13R1.147 CC(C)CC(=O)c1cccc(O)c1 Amb17335231 [0,2,0,0,0,0|1,0,0]=3 7963 B13R1.147 CC(C)CC(=O)c1ccnc(Cl)c1 Amb6301710 [0,2,0,0,0,0|2,0,0]=4 7964 B13R1.147 CC(C)NC(=N)c1cccc(O)c1 Amb28317287 [0,2,0,0,0,0|2,0,0]=4 7965 B13R1.147 CC(C)NC(=O)C1=CC(=S)NC=C1 Amb27980262 [0,2,0,0,0,0|2,0,0]=4 7966 B13R1.147 CC(C)NC(=O)C1=CC=CC(=O)N1 Amb25180106 [0,2,0,0,0,0|2,0,0]=4 7967 B13R1.147 CC(C)NC(=O)c1cc(Br)ccn1 Amb28061878 [0,2,0,0,0,0|2,0,0]=4 7968 B13R1.147 CC(C)NC(=O)c1cc(Cl)ccn1 Amb8323442 [0,2,0,0,0,0|2,0,0]=4 7969 B13R1.147 CC(C)NC(=O)c1cc(N)ccn1 Amb18284818 [0,2,0,0,0,0|2,0,0]=4 7970 B13R1.147 CC(C)NC(=O)c1ccc[n+]([O-])c1 Amb26001009 [0,2,0,0,0,0|2,0,0]=4 7971 B13R1.147 CC(C)NC(=O)c1cccc(Br)c1 Amb6347751 [0,2,0,0,0,0|1,0,0]=3 7972 B13R1.147 CC(C)NC(=O)c1cccc(Cl)c1 Amb6347598 [0,2,0,0,0,0|1,0,0]=3 7973 B13R1.147 CC(C)NC(=O)c1cccc(Cl)n1 Amb19088730 [0,2,0,0,0,0|2,0,0]=4 7974 B13R1.147 CC(C)NC(=O)c1cccc(F)c1 Amb3110255 [0,2,0,0,0,0|1,0,0]=3 7975 B13R1.147 CC(C)NC(=O)c1cccc(F)n1 Amb27172812 [0,2,0,0,0,0|2,0,0]=4 7976 B13R1.147 CC(C)NC(=O)c1cccc(I)c1 Amb6381780 [0,2,0,0,0,0|1,0,0]=3 7977 B13R1.147 CC(C)NC(=O)c1cccc(N)c1 Amb1114824 [0,2,0,0,0,0|1,0,0]=3 7978 B13R1.147 CC(C)NC(=O)c1cccc(N)n1 Amb18959757 [0,2,0,0,0,0|2,0,0]=4 7979 B13R1.147 CC(C)NC(=O)c1cccc(S)c1 Amb27753492 [0,2,0,0,0,0|1,0,0]=3 7980 B13R1.147 CC(C)NC(=O)c1ccnc(Cl)c1 Amb6667929 [0,2,0,0,0,0|2,0,0]=4 7981 B13R1.147 CC(C)NC(=O)c1ccnc(N)c1 Amb18284820 [0,2,0,0,0,0|2,0,0]=4 7982 B13R1.147 CC(C)NC(=O)c1cncc(Br)c1 Amb1081541 [0,2,0,0,0,0|2,0,0]=4 7983 B13R1.147 CC(C)NC(=O)c1cncc(F)c1 Amb25819996 [0,2,0,0,0,0|2,0,0]=4 7984 B13R1.147 CC(C)NC(=O)c1cncc(N)c1 Amb27665194 [0,2,0,0,0,0|2,0,0]=4 7985 B13R1.147 CC(C)NC(=O)c1cncc(O)c1 Amb27817367 [0,2,0,0,0,0|2,0,0]=4 7986 B13R1.147 CC(C)OC(=O)C1=CC(=O)NC=C1 Amb27760236 [0,2,0,0,0,0|1,0,0]=3 7987 B13R1.147 CC(C)OC(=O)c1ccc[n+]([O-])c1 Amb8449663 [0,2,0,0,0,0|1,0,0]=3 7988 B13R1.147 CC(C)OC(=O)c1cccc(Br)c1 Amb25081713 [0,2,0,0,0,0|0,0,0]=2 7989 B13R1.147 CC(C)OC(=O)c1cccc(Cl)c1 Amb27464135 [0,2,0,0,0,0|0,0,0]=2 7990 B13R1.147 CC(C)OC(=O)c1cccc(F)n1 Amb28046766 [0,2,0,0,0,0|1,0,0]=3 7991 B13R1.147 CC(C)OC(=O)c1cccc(N)c1 Amb6739898 [0,2,0,0,0,0|0,0,0]=2 7992 B13R1.147 CC(C)OC(=O)c1cccc(O)c1 Amb2123403 [0,2,0,0,0,0|0,0,0]=2 7993 B13R1.147 CC(C)OC(=O)c1ccnc(F)c1 Amb28070858 [0,2,0,0,0,0|1,0,0]=3 7994 B13R1.147 CC(C)OC(=O)c1cncc(Br)c1 Amb27464134 [0,2,0,0,0,0|1,0,0]=3 7995 B13R1.147 CC(C)OC(=O)c1cncc(F)c1 Amb27469485 [0,2,0,0,0,0|1,0,0]=3 7996 B13R1.147 CC(N)CC(=O)c1cncc(Br)c1 Amb35702471 [0,2,0,0,0,0|2,0,0]=4 7997 B13R1.147 CC(N)CS(=O)c1cccc(F)c1 Amb27829148 [0,2,0,0,0,0|2,0,0]=4 7998 B13R1.147 CC(O)CS(=O)c1cccc(F)c1 Amb27415993 [0,2,0,0,0,0|2,0,0]=4 7999 B13R1.147 CN(C)CC(=O)c1cccc(N)c1 Amb17090521 [0,2,0,0,0,0|2,0,0]=4 8000 B13R1.147 CN(C)NC(=O)c1cccc(N)c1 Amb28245637 [0,2,0,0,0,0|2,0,0]=4 8001 B13R1.147 CS(=O)CC(=O)c1cccc(Cl)c1 Amb28387763 [0,2,0,0,0,0|2,0,0]=4 8002 B13R1.147 C\C(=N/C(C)C)c1cccc(O)c1 Amb27948710 [0,2,0,0,0,0|2,0,0]=4 8003 B13R1.147 C\C(N)=C\C(=O)c1cccc(Br)c1 Amb27652090 [0,2,0,0,0,0|1,0,1]=4 8004 B13R1.147 Cc1cccc(C(=O)CC(C)C)c1 Amb17198737 [0,2,0,0,0,0|1,0,0]=3 8005 B13R1.147 Cc1cccc(C(=O)OC(C)C)n1 Amb27488120 [0,2,0,0,0,0|1,0,0]=3 8006 B13R1.147 Cc1ccnc(C(=O)CC(C)C)c1 Amb28242212 [0,2,0,0,0,0|2,0,0]=4 8007 B13R1.147 Cc1ccnc(C(=O)OC(C)C)n1 Amb26410155 [0,2,0,0,0,0|2,0,0]=4 8008 B13R1.147 Cc1cncc(C(=O)CC(C)C)c1 Amb28126001 [0,2,0,0,0,0|2,0,0]=4 8009 B13R1.147 Cc1nccc(C(=O)OC(C)C)n1 Amb24393688 [0,2,0,0,0,0|2,0,0]=4 8010 B13R1.147 O=C(CC(F)F)c1cccc(F)c1 Amb27442456 [0,2,0,0,0,0|2,0,0]=4 8011 B13R1.446 C=C(CCC)c1cc(C)ccc1C Amb25230186 [0,2,0,0,0,0|2,0,0]=4 8012 B13R1.446 C=C(OCC)c1cc(C)ccc1N Amb33136347 [0,2,0,0,0,0|1,0,0]=3 8013 B13R1.446 C=C(OCC)c1cc(C)ccc1O Amb33136185 [0,2,0,0,0,0|1,0,0]=3 8014 B13R1.446 C=C(OCC)c1cc(Cl)ccc1N Amb33136145 [0,2,0,0,0,0|1,0,0]=3 8015 B13R1.446 C=C(OCC)c1cc(Cl)ccc1O Amb33135806 [0,2,0,0,0,0|1,0,0]=3 8016 B13R1.446 C=C(OCC)c1cc(F)ccc1N Amb33136281 [0,2,0,0,0,0|1,0,0]=3 8017 B13R1.446 C=C(OCC)c1cc(F)ccc1O Amb33136211 [0,2,0,0,0,0|1,0,0]=3 8018 B13R1.446 C=C(OCC)c1cc(N)ccc1C Amb33135953 [0,2,0,0,0,0|1,0,0]=3 8019 B13R1.446 C=C(OCC)c1cc(N)ccc1F Amb33135850 [0,2,0,0,0,0|1,0,0]=3 8020 B13R1.446 C=C(OCC)c1cc(O)ccc1C Amb33136245 [0,2,0,0,0,0|1,0,0]=3 8021 B13R1.446 CC#CC(=O)c1cc(Cl)ccc1N Amb27415645 [0,2,0,0,0,0|1,0,1]=4 8022 B13R1.446 CCCC(=O)c1cc(Br)ccc1F Amb17198936 [0,2,0,0,0,0|1,0,0]=3 8023 B13R1.446 CCCC(=O)c1cc(Br)ccc1O Amb26630083 [0,2,0,0,0,0|1,0,0]=3 8024 B13R1.446 CCCC(=O)c1cc(C)ccc1C Amb8849713 [0,2,0,0,0,0|1,0,0]=3 8025 B13R1.446 CCCC(=O)c1cc(C)ccc1Cl Amb17198876 [0,2,0,0,0,0|1,0,0]=3 8026 B13R1.446 CCCC(=O)c1cc(C)ccc1F Amb18805024 [0,2,0,0,0,0|1,0,0]=3 8027 B13R1.446 CCCC(=O)c1cc(C)ccc1O Amb4023462 [0,2,0,0,0,0|1,0,0]=3 8028 B13R1.446 CCCC(=O)c1cc(Cl)ccc1Br Amb27449189 [0,2,0,0,0,0|1,0,0]=3 8029 B13R1.446 CCCC(=O)c1cc(Cl)ccc1C Amb17337141 [0,2,0,0,0,0|1,0,0]=3 8030 B13R1.446 CCCC(=O)c1cc(Cl)ccc1N Amb27165763 [0,2,0,0,0,0|1,0,0]=3 8031 B13R1.446 CCCC(=O)c1cc(Cl)ccc1O Amb17236841 [0,2,0,0,0,0|1,0,0]=3 8032 B13R1.446 CCCC(=O)c1cc(Cl)cnc1N Amb27221736 [0,2,0,0,0,0|2,0,0]=4 8033 B13R1.446 CCCC(=O)c1cc(F)ccc1C Amb18184736 [0,2,0,0,0,0|1,0,0]=3 8034 B13R1.446 CCCC(=O)c1cc(F)ccc1F Amb8849836 [0,2,0,0,0,0|1,0,0]=3 8035 B13R1.446 CCCC(=O)c1cc(F)ccc1N Amb27252824 [0,2,0,0,0,0|1,0,0]=3 8036 B13R1.446 CCCC(=O)c1cc(F)ccc1O Amb17233892 [0,2,0,0,0,0|1,0,0]=3 8037 B13R1.446 CCCC(=O)c1cc(N)ccc1C Amb25303615 [0,2,0,0,0,0|1,0,0]=3 8038 B13R1.446 CCCC(=O)c1cc(N)ccc1F Amb25767241 [0,2,0,0,0,0|1,0,0]=3 8039 B13R1.446 CCCC(=O)c1cc(N)ccc1O Amb27267851 [0,2,0,0,0,0|1,0,0]=3 8040 B13R1.446 CCCS(=O)c1cc(Br)ccc1N Amb27268107 [0,2,0,0,0,0|2,0,0]=4 8041 B13R1.446 CCCS(=O)c1cc(C)ccc1N Amb28247867 [0,2,0,0,0,0|2,0,0]=4 8042 B13R1.446 CCCS(=O)c1cc(N)ccc1C Amb27468132 [0,2,0,0,0,0|2,0,0]=4 8043 B13R1.446 CCCS(=O)c1cc(O)ccc1Cl Amb28202198 [0,2,0,0,0,0|2,0,0]=4 8044 B13R1.446 CCNC(=O)C1=CC(Br)=CNC1=S Amb28051226 [0,2,0,0,0,0|2,0,0]=4 8045 B13R1.446 CCNC(=O)C1=CC(N)=CNC1=O Amb26639351 [0,2,0,0,0,0|2,0,0]=4 8046 B13R1.446 CCNC(=O)c1cc(Br)ccc1C Amb27831061 [0,2,0,0,0,0|1,0,0]=3 8047 B13R1.446 CCNC(=O)c1cc(Br)ccc1Cl Amb6436581 [0,2,0,0,0,0|1,0,0]=3 8048 B13R1.446 CCNC(=O)c1cc(Br)ccc1F Amb6267795 [0,2,0,0,0,0|1,0,0]=3 8049 B13R1.446 CCNC(=O)c1cc(Br)ccc1I Amb11217880 [0,2,0,0,0,0|1,0,0]=3 8050 B13R1.446 CCNC(=O)c1cc(Br)ccc1N Amb18273760 [0,2,0,0,0,0|1,0,0]=3 8051 B13R1.446 CCNC(=O)c1cc(Br)cnc1Cl Amb27397277 [0,2,0,0,0,0|2,0,0]=4 8052 B13R1.446 CCNC(=O)c1cc(C)ccc1C Amb3747624 [0,2,0,0,0,0|1,0,0]=3 8053 B13R1.446 CCNC(=O)c1cc(C)ccc1F Amb18186809 [0,2,0,0,0,0|1,0,0]=3 8054 B13R1.446 CCNC(=O)c1cc(C)ccc1N Amb18286226 [0,2,0,0,0,0|1,0,0]=3 8055 B13R1.446 CCNC(=O)c1cc(Cl)ccc1Cl Amb6338956 [0,2,0,0,0,0|1,0,0]=3 8056 B13R1.446 CCNC(=O)c1cc(Cl)ccc1F Amb28342050 [0,2,0,0,0,0|1,0,0]=3 8057 B13R1.446 CCNC(=O)c1cc(Cl)ccc1N Amb1118181 [0,2,0,0,0,0|1,0,0]=3 8058 B13R1.446 CCNC(=O)c1cc(F)ccc1Br Amb6279012 [0,2,0,0,0,0|1,0,0]=3 8059 B13R1.446 CCNC(=O)c1cc(F)ccc1Cl Amb27255082 [0,2,0,0,0,0|1,0,0]=3 8060 B13R1.446 CCNC(=O)c1cc(F)ccc1I Amb20641873 [0,2,0,0,0,0|1,0,0]=3 8061 B13R1.446 CCNC(=O)c1cc(F)ccc1N Amb8825282 [0,2,0,0,0,0|1,0,0]=3 8062 B13R1.446 CCNC(=O)c1cc(F)ccc1O Amb27837013 [0,2,0,0,0,0|1,0,0]=3 8063 B13R1.446 CCNC(=O)c1cc(I)ccc1Br Amb27834607 [0,2,0,0,0,0|1,0,0]=3 8064 B13R1.446 CCNC(=O)c1cc(I)ccc1C Amb28051090 [0,2,0,0,0,0|1,0,0]=3 8065 B13R1.446 CCNC(=O)c1cc(I)ccc1F Amb27752850 [0,2,0,0,0,0|1,0,0]=3 8066 B13R1.446 CCNC(=O)c1cc(I)ccc1I Amb27431196 [0,2,0,0,0,0|1,0,0]=3 8067 B13R1.446 CCNC(=O)c1cc(N)ccc1C Amb18952834 [0,2,0,0,0,0|1,0,0]=3 8068 B13R1.446 CCNC(=O)c1cc(N)ccc1Cl Amb1114508 [0,2,0,0,0,0|1,0,0]=3 8069 B13R1.446 CCNC(=O)c1cc(N)ccc1Cl Amb13949223 [0,2,0,0,0,0|1,0,0]=3 8070 B13R1.446 CCNC(=O)c1cc(N)ccc1F Amb9371463 [0,2,0,0,0,0|1,0,0]=3 8071 B13R1.446 CCNC(=O)c1cc(O)ccc1O Amb27268442 [0,2,0,0,0,0|1,0,0]=3 8072 B13R1.446 CCNC(=O)c1cc(S)ccc1C Amb27431585 [0,2,0,0,0,0|1,0,0]=3 8073 B13R1.446 CCNC(=O)c1cc(S)ccc1Cl Amb28454018 [0,2,0,0,0,0|1,0,0]=3 8074 B13R1.446 CCNC(=O)c1nc(Br)ccc1C Amb28126344 [0,2,0,0,0,0|2,0,0]=4 8075 B13R1.446 CCOC(=N)c1cc(Br)ccc1Cl Amb27804377 [0,2,0,0,0,0|1,0,0]=3 8076 B13R1.446 CCOC(=N)c1cc(Br)cnc1O Amb28042903 [0,2,0,0,0,0|2,0,0]=4 8077 B13R1.446 CCOC(=N)c1cc(C)ccc1C Amb18180671 [0,2,0,0,0,0|1,0,0]=3 8078 B13R1.446 CCOC(=N)c1cc(Cl)ccc1C Amb27471898 [0,2,0,0,0,0|1,0,0]=3 8079 B13R1.446 CCOC(=N)c1cc(Cl)ccc1Cl Amb27639196 [0,2,0,0,0,0|1,0,0]=3 8080 B13R1.446 CCOC(=N)c1cc(F)ccc1C Amb18185004 [0,2,0,0,0,0|1,0,0]=3 8081 B13R1.446 CCOC(=N)c1cc(F)ccc1F Amb26519607 [0,2,0,0,0,0|1,0,0]=3 8082 B13R1.446 CCOC(=N)c1cc(I)ccc1F Amb27623148 [0,2,0,0,0,0|1,0,0]=3 8083 B13R1.446 CCOC(=O)C1=C(C)C=CC(=O)N1 Amb25785587 [0,2,0,0,0,0|1,0,0]=3 8084 B13R1.446 CCOC(=O)C1=C(Cl)C=CC(=O)N1 Amb22751770 [0,2,0,0,0,0|1,0,0]=3 8085 B13R1.446 CCOC(=O)C1=CC(C)=NNC1=O Amb19930080 [0,2,0,0,0,0|2,0,0]=4 8086 B13R1.446 CCOC(=O)C1=CC(Cl)=CNC1=O Amb24601927 [0,2,0,0,0,0|1,0,0]=3 8087 B13R1.446 CCOC(=O)C1=CC(Cl)=NNC1=O Amb22523487 [0,2,0,0,0,0|2,0,0]=4 8088 B13R1.446 CCOC(=O)c1cc(Br)ccc1Br Amb27667864 [0,2,0,0,0,0|0,0,0]=2 8089 B13R1.446 CCOC(=O)c1cc(Br)ccc1C Amb16232898 [0,2,0,0,0,0|0,0,0]=2 8090 B13R1.446 CCOC(=O)c1cc(Br)ccc1Cl Amb2725505 [0,2,0,0,0,0|0,0,0]=2 8091 B13R1.446 CCOC(=O)c1cc(Br)ccc1F Amb9273799 [0,2,0,0,0,0|0,0,0]=2 8092 B13R1.446 CCOC(=O)c1cc(Br)ccc1I Amb19888237 [0,2,0,0,0,0|0,0,0]=2 8093 B13R1.446 CCOC(=O)c1cc(Br)ccc1N Amb2695801 [0,2,0,0,0,0|0,0,0]=2 8094 B13R1.446 CCOC(=O)c1cc(Br)ccc1O Amb6541244 [0,2,0,0,0,0|0,0,0]=2 8095 B13R1.446 CCOC(=O)c1cc(Br)cnc1C Amb19889836 [0,2,0,0,0,0|1,0,0]=3 8096 B13R1.446 CCOC(=O)c1cc(Br)cnc1Cl Amb22752623 [0,2,0,0,0,0|1,0,0]=3 8097 B13R1.446 CCOC(=O)c1cc(Br)cnc1F Amb25055205 [0,2,0,0,0,0|1,0,0]=3 8098 B13R1.446 CCOC(=O)c1cc(Br)cnc1N Amb6383905 [0,2,0,0,0,0|1,0,0]=3 8099 B13R1.446 CCOC(=O)c1cc(Br)cnc1O Amb27230340 [0,2,0,0,0,0|1,0,0]=3 8100 B13R1.446 CCOC(=O)c1cc(Br)ncc1Br Amb27180935 [0,2,0,0,0,0|1,0,0]=3 8101 B13R1.446 CCOC(=O)c1cc(Br)ncc1C Amb26057281 [0,2,0,0,0,0|1,0,0]=3 8102 B13R1.446 CCOC(=O)c1cc(Br)ncc1Cl Amb24666576 [0,2,0,0,0,0|1,0,0]=3 8103 B13R1.446 CCOC(=O)c1cc(Br)ncc1F Amb27640273 [0,2,0,0,0,0|1,0,0]=3 8104 B13R1.446 CCOC(=O)c1cc(Br)ncc1N Amb22640980 [0,2,0,0,0,0|1,0,0]=3 8105 B13R1.446 CCOC(=O)c1cc(Br)ncc1O Amb26381338 [0,2,0,0,0,0|1,0,0]=3 8106 B13R1.446 CCOC(=O)c1cc(C)ccc1Br Amb27225001 [0,2,0,0,0,0|0,0,0]=2 8107 B13R1.446 CCOC(=O)c1cc(C)ccc1C Amb9242939 [0,2,0,0,0,0|0,0,0]=2 8108 B13R1.446 CCOC(=O)c1cc(C)ccc1Cl Amb22750100 [0,2,0,0,0,0|0,0,0]=2 8109 B13R1.446 CCOC(=O)c1cc(C)ccc1F Amb18187070 [0,2,0,0,0,0|0,0,0]=2 8110 B13R1.446 CCOC(=O)c1cc(C)ccc1I Amb10069354 [0,2,0,0,0,0|0,0,0]=2 8111 B13R1.446 CCOC(=O)c1cc(C)ccc1N Amb4450746 [0,2,0,0,0,0|0,0,0]=2 8112 B13R1.446 CCOC(=O)c1cc(C)ccc1O Amb3940892 [0,2,0,0,0,0|0,0,0]=2 8113 B13R1.446 CCOC(=O)c1cc(C)ccc1S Amb27598004 [0,2,0,0,0,0|0,0,0]=2 8114 B13R1.446 CCOC(=O)c1cc(C)cnc1Br Amb21857315 [0,2,0,0,0,0|1,0,0]=3 8115 B13R1.446 CCOC(=O)c1cc(C)cnc1Cl Amb21857313 [0,2,0,0,0,0|1,0,0]=3 8116 B13R1.446 CCOC(=O)c1cc(C)ncc1Br Amb25269790 [0,2,0,0,0,0|1,0,0]=3 8117 B13R1.446 CCOC(=O)c1cc(C)ncc1F Amb25939113 [0,2,0,0,0,0|1,0,0]=3 8118 B13R1.446 CCOC(=O)c1cc(C)ncc1N Amb26053539 [0,2,0,0,0,0|1,0,0]=3 8119 B13R1.446 CCOC(=O)c1cc(C)ncc1O Amb26551210 [0,2,0,0,0,0|1,0,0]=3 8120 B13R1.446 CCOC(=O)c1cc(C)nnc1C Amb19987163 [0,2,0,0,0,0|2,0,0]=4 8121 B13R1.446 CCOC(=O)c1cc(C)nnc1Cl Amb22498724 [0,2,0,0,0,0|2,0,0]=4 8122 B13R1.446 CCOC(=O)c1cc(Cl)ccc1Br Amb24065402 [0,2,0,0,0,0|0,0,0]=2 8123 B13R1.446 CCOC(=O)c1cc(Cl)ccc1C Amb22750098 [0,2,0,0,0,0|0,0,0]=2 8124 B13R1.446 CCOC(=O)c1cc(Cl)ccc1Cl Amb6365863 [0,2,0,0,0,0|0,0,0]=2 8125 B13R1.446 CCOC(=O)c1cc(Cl)ccc1F Amb9273666 [0,2,0,0,0,0|0,0,0]=2 8126 B13R1.446 CCOC(=O)c1cc(Cl)ccc1I Amb16185428 [0,2,0,0,0,0|0,0,0]=2 8127 B13R1.446 CCOC(=O)c1cc(Cl)ccc1N Amb2695805 [0,2,0,0,0,0|0,0,0]=2 8128 B13R1.446 CCOC(=O)c1cc(Cl)ccc1O Amb9243055 [0,2,0,0,0,0|0,0,0]=2 8129 B13R1.446 CCOC(=O)c1cc(Cl)cnc1Br Amb22495410 [0,2,0,0,0,0|1,0,0]=3 8130 B13R1.446 CCOC(=O)c1cc(Cl)cnc1C Amb19944704 [0,2,0,0,0,0|1,0,0]=3 8131 B13R1.446 CCOC(=O)c1cc(Cl)cnc1Cl Amb1090904 [0,2,0,0,0,0|1,0,0]=3 8132 B13R1.446 CCOC(=O)c1cc(Cl)cnc1F Amb22491901 [0,2,0,0,0,0|1,0,0]=3 8133 B13R1.446 CCOC(=O)c1cc(Cl)cnc1N Amb19958440 [0,2,0,0,0,0|1,0,0]=3 8134 B13R1.446 CCOC(=O)c1cc(Cl)ncc1Br Amb13882792 [0,2,0,0,0,0|1,0,0]=3 8135 B13R1.446 CCOC(=O)c1cc(Cl)ncc1Cl Amb6751994 [0,2,0,0,0,0|1,0,0]=3 8136 B13R1.446 CCOC(=O)c1cc(Cl)ncc1N Amb21926654 [0,2,0,0,0,0|1,0,0]=3 8137 B13R1.446 CCOC(=O)c1cc(Cl)ncc1O Amb27793666 [0,2,0,0,0,0|1,0,0]=3 8138 B13R1.446 CCOC(=O)c1cc(Cl)nnc1Cl Amb19515923 [0,2,0,0,0,0|2,0,0]=4 8139 B13R1.446 CCOC(=O)c1cc(Cl)nnc1N Amb24361604 [0,2,0,0,0,0|2,0,0]=4 8140 B13R1.446 CCOC(=O)c1cc(Cl)nnc1O Amb18130871 [0,2,0,0,0,0|2,0,0]=4 8141 B13R1.446 CCOC(=O)c1cc(F)ccc1Br Amb9273658 [0,2,0,0,0,0|0,0,0]=2 8142 B13R1.446 CCOC(=O)c1cc(F)ccc1C Amb18805490 [0,2,0,0,0,0|0,0,0]=2 8143 B13R1.446 CCOC(=O)c1cc(F)ccc1Cl Amb26645236 [0,2,0,0,0,0|0,0,0]=2 8144 B13R1.446 CCOC(=O)c1cc(F)ccc1F Amb9273814 [0,2,0,0,0,0|0,0,0]=2 8145 B13R1.446 CCOC(=O)c1cc(F)ccc1I Amb26995715 [0,2,0,0,0,0|0,0,0]=2 8146 B13R1.446 CCOC(=O)c1cc(F)ccc1N Amb7755320 [0,2,0,0,0,0|0,0,0]=2 8147 B13R1.446 CCOC(=O)c1cc(F)ccc1O Amb10576342 [0,2,0,0,0,0|0,0,0]=2 8148 B13R1.446 CCOC(=O)c1cc(F)ccc1S Amb22337257 [0,2,0,0,0,0|0,0,0]=2 8149 B13R1.446 CCOC(=O)c1cc(F)cnc1C Amb28399397 [0,2,0,0,0,0|1,0,0]=3 8150 B13R1.446 CCOC(=O)c1cc(F)cnc1Cl Amb8393042 [0,2,0,0,0,0|1,0,0]=3 8151 B13R1.446 CCOC(=O)c1cc(F)cnc1F Amb25102751 [0,2,0,0,0,0|1,0,0]=3 8152 B13R1.446 CCOC(=O)c1cc(F)cnc1I Amb26907665 [0,2,0,0,0,0|1,0,0]=3 8153 B13R1.446 CCOC(=O)c1cc(F)cnc1N Amb23438886 [0,2,0,0,0,0|1,0,0]=3 8154 B13R1.446 CCOC(=O)c1cc(F)ncc1Br Amb25155256 [0,2,0,0,0,0|1,0,0]=3 8155 B13R1.446 CCOC(=O)c1cc(F)ncc1C Amb27829128 [0,2,0,0,0,0|1,0,0]=3 8156 B13R1.446 CCOC(=O)c1cc(F)ncc1Cl Amb28286705 [0,2,0,0,0,0|1,0,0]=3 8157 B13R1.446 CCOC(=O)c1cc(F)ncc1N Amb24496819 [0,2,0,0,0,0|1,0,0]=3 8158 B13R1.446 CCOC(=O)c1cc(I)ccc1Br Amb19888257 [0,2,0,0,0,0|0,0,0]=2 8159 B13R1.446 CCOC(=O)c1cc(I)ccc1C Amb16232911 [0,2,0,0,0,0|0,0,0]=2 8160 B13R1.446 CCOC(=O)c1cc(I)ccc1F Amb19887822 [0,2,0,0,0,0|0,0,0]=2 8161 B13R1.446 CCOC(=O)c1cc(I)ccc1N Amb10068700 [0,2,0,0,0,0|0,0,0]=2 8162 B13R1.446 CCOC(=O)c1cc(I)ccc1O Amb16232638 [0,2,0,0,0,0|0,0,0]=2 8163 B13R1.446 CCOC(=O)c1cc(I)cnc1Cl Amb27172151 [0,2,0,0,0,0|1,0,0]=3 8164 B13R1.446 CCOC(=O)c1cc(I)cnc1F Amb24563986 [0,2,0,0,0,0|1,0,0]=3 8165 B13R1.446 CCOC(=O)c1cc(I)cnc1N Amb26487291 [0,2,0,0,0,0|1,0,0]=3 8166 B13R1.446 CCOC(=O)c1cc(I)cnc1O Amb24384148 [0,2,0,0,0,0|1,0,0]=3 8167 B13R1.446 CCOC(=O)c1cc(I)ncc1F Amb27616184 [0,2,0,0,0,0|1,0,0]=3 8168 B13R1.446 CCOC(=O)c1cc(N)ccc1Br Amb18294542 [0,2,0,0,0,0|0,0,0]=2 8169 B13R1.446 CCOC(=O)c1cc(N)ccc1C Amb18291232 [0,2,0,0,0,0|0,0,0]=2 8170 B13R1.446 CCOC(=O)c1cc(N)ccc1Cl Amb32646041 [0,2,0,0,0,0|0,0,0]=2 8171 B13R1.446 CCOC(=O)c1cc(N)ccc1Cl Amb844782 [0,2,0,0,0,0|0,0,0]=2 8172 B13R1.446 CCOC(=O)c1cc(N)ccc1F Amb18984956 [0,2,0,0,0,0|0,0,0]=2 8173 B13R1.446 CCOC(=O)c1cc(N)ccc1I Amb26880783 [0,2,0,0,0,0|0,0,0]=2 8174 B13R1.446 CCOC(=O)c1cc(N)ccc1N Amb18975485 [0,2,0,0,0,0|0,0,0]=2 8175 B13R1.446 CCOC(=O)c1cc(N)ccc1O Amb7762506 [0,2,0,0,0,0|0,0,0]=2 8176 B13R1.446 CCOC(=O)c1cc(N)cnc1Br Amb27793682 [0,2,0,0,0,0|1,0,0]=3 8177 B13R1.446 CCOC(=O)c1cc(N)cnc1C Amb18976369 [0,2,0,0,0,0|1,0,0]=3 8178 B13R1.446 CCOC(=O)c1cc(N)cnc1Cl Amb2699275 [0,2,0,0,0,0|1,0,0]=3 8179 B13R1.446 CCOC(=O)c1cc(N)cnc1F Amb25918142 [0,2,0,0,0,0|1,0,0]=3 8180 B13R1.446 CCOC(=O)c1cc(N)cnc1N Amb25288142 [0,2,0,0,0,0|1,0,0]=3 8181 B13R1.446 CCOC(=O)c1cc(N)cnc1O Amb25083708 [0,2,0,0,0,0|1,0,0]=3 8182 B13R1.446 CCOC(=O)c1cc(N)ncc1Br Amb20620207 [0,2,0,0,0,0|1,0,0]=3 8183 B13R1.446 CCOC(=O)c1cc(N)ncc1C Amb28243224 [0,2,0,0,0,0|1,0,0]=3 8184 B13R1.446 CCOC(=O)c1cc(N)ncc1N Amb27617706 [0,2,0,0,0,0|1,0,0]=3 8185 B13R1.446 CCOC(=O)c1cc(O)ccc1C Amb28316392 [0,2,0,0,0,0|0,0,0]=2 8186 B13R1.446 CCOC(=O)c1cc(O)ccc1Cl Amb22001181 [0,2,0,0,0,0|0,0,0]=2 8187 B13R1.446 CCOC(=O)c1cc(O)ccc1F Amb26497993 [0,2,0,0,0,0|0,0,0]=2 8188 B13R1.446 CCOC(=O)c1cc(O)ccc1I Amb10553667 [0,2,0,0,0,0|0,0,0]=2 8189 B13R1.446 CCOC(=O)c1cc(O)ccc1N Amb18977547 [0,2,0,0,0,0|0,0,0]=2 8190 B13R1.446 CCOC(=O)c1cc(O)cnc1Br Amb25350682 [0,2,0,0,0,0|1,0,0]=3 8191 B13R1.446 CCOC(=O)c1cc(O)cnc1C Amb22263373 [0,2,0,0,0,0|1,0,0]=3 8192 B13R1.446 CCOC(=O)c1cc(O)cnc1Cl Amb24528293 [0,2,0,0,0,0|1,0,0]=3 8193 B13R1.446 CCOC(=O)c1cc(O)cnc1F Amb25223618 [0,2,0,0,0,0|1,0,0]=3 8194 B13R1.446 CCOC(=O)c1cc(O)cnc1N Amb26451470 [0,2,0,0,0,0|1,0,0]=3 8195 B13R1.446 CCOC(=O)c1cc(O)ncc1Br Amb27965490 [0,2,0,0,0,0|1,0,0]=3 8196 B13R1.446 CCOC(=O)c1cc(O)ncc1C Amb27954572 [0,2,0,0,0,0|1,0,0]=3 8197 B13R1.446 CCOC(=O)c1cc(S)ccc1N Amb27477753 [0,2,0,0,0,0|0,0,0]=2 8198 B13R1.446 CCOC(=O)c1nc(Br)ccc1Br Amb19959824 [0,2,0,0,0,0|1,0,0]=3 8199 B13R1.446 CCOC(=O)c1nc(Br)ccc1C Amb27827179 [0,2,0,0,0,0|1,0,0]=3 8200 B13R1.446 CCOC(=O)c1nc(Br)ccc1N Amb19516200 [0,2,0,0,0,0|1,0,0]=3 8201 B13R1.446 CCOC(=O)c1nc(Br)ccc1O Amb23541703 [0,2,0,0,0,0|1,0,0]=3 8202 B13R1.446 CCOC(=O)c1nc(Br)cnc1Br Amb28289427 [0,2,0,0,0,0|2,0,0]=4 8203 B13R1.446 CCOC(=O)c1nc(Br)cnc1N Amb25364974 [0,2,0,0,0,0|2,0,0]=4 8204 B13R1.446 CCOC(=O)c1nc(Br)cnc1O Amb26332027 [0,2,0,0,0,0|2,0,0]=4 8205 B13R1.446 CCOC(=O)c1nc(C)ccc1Br Amb28285511 [0,2,0,0,0,0|1,0,0]=3 8206 B13R1.446 CCOC(=O)c1nc(C)ccc1C Amb25898266 [0,2,0,0,0,0|1,0,0]=3 8207 B13R1.446 CCOC(=O)c1nc(C)ccc1Cl Amb25926897 [0,2,0,0,0,0|1,0,0]=3 8208 B13R1.446 CCOC(=O)c1nc(C)ccc1F Amb24638346 [0,2,0,0,0,0|1,0,0]=3 8209 B13R1.446 CCOC(=O)c1nc(C)ccc1N Amb23440297 [0,2,0,0,0,0|1,0,0]=3 8210 B13R1.446 CCOC(=O)c1nc(C)ccc1O Amb27880416 [0,2,0,0,0,0|1,0,0]=3 8211 B13R1.446 CCOC(=O)c1nc(C)cnc1C Amb23401638 [0,2,0,0,0,0|2,0,0]=4 8212 B13R1.446 CCOC(=O)c1nc(C)cnc1N Amb26463989 [0,2,0,0,0,0|2,0,0]=4 8213 B13R1.446 CCOC(=O)c1nc(C)cnc1O Amb24715548 [0,2,0,0,0,0|2,0,0]=4 8214 B13R1.446 CCOC(=O)c1nc(C)ncc1C Amb25331923 [0,2,0,0,0,0|2,0,0]=4 8215 B13R1.446 CCOC(=O)c1nc(C)ncc1O Amb27192590 [0,2,0,0,0,0|2,0,0]=4 8216 B13R1.446 CCOC(=O)c1nc(Cl)ccc1Br Amb19959855 [0,2,0,0,0,0|1,0,0]=3 8217 B13R1.446 CCOC(=O)c1nc(Cl)ccc1F Amb27176980 [0,2,0,0,0,0|1,0,0]=3 8218 B13R1.446 CCOC(=O)c1nc(Cl)ccc1N Amb22755379 [0,2,0,0,0,0|1,0,0]=3 8219 B13R1.446 CCOC(=O)c1nc(Cl)ccc1O Amb26064731 [0,2,0,0,0,0|1,0,0]=3 8220 B13R1.446 CCOC(=O)c1nc(Cl)cnc1C Amb27947177 [0,2,0,0,0,0|2,0,0]=4 8221 B13R1.446 CCOC(=O)c1nc(Cl)cnc1N Amb24468388 [0,2,0,0,0,0|2,0,0]=4 8222 B13R1.446 CCOC(=O)c1nc(Cl)cnc1O Amb25314720 [0,2,0,0,0,0|2,0,0]=4 8223 B13R1.446 CCOC(=O)c1nc(Cl)ncc1Br Amb22498355 [0,2,0,0,0,0|2,0,0]=4 8224 B13R1.446 CCOC(=O)c1nc(Cl)ncc1C Amb28318417 [0,2,0,0,0,0|2,0,0]=4 8225 B13R1.446 CCOC(=O)c1nc(Cl)ncc1Cl Amb24733689 [0,2,0,0,0,0|2,0,0]=4 8226 B13R1.446 CCOC(=O)c1nc(Cl)ncc1F Amb33521816 [0,2,0,0,0,0|2,0,0]=4 8227 B13R1.446 CCOC(=O)c1nc(Cl)ncc1N Amb18130813 [0,2,0,0,0,0|2,0,0]=4 8228 B13R1.446 CCOC(=O)c1nc(F)ccc1Br Amb27148841 [0,2,0,0,0,0|1,0,0]=3 8229 B13R1.446 CCOC(=O)c1nc(F)ccc1F Amb25065168 [0,2,0,0,0,0|1,0,0]=3 8230 B13R1.446 CCOC(=O)c1nc(F)ccc1I Amb27259891 [0,2,0,0,0,0|1,0,0]=3 8231 B13R1.446 CCOC(=O)c1nc(F)ccc1N Amb25970530 [0,2,0,0,0,0|1,0,0]=3 8232 B13R1.446 CCOC(=O)c1nc(F)ccc1O Amb26583787 [0,2,0,0,0,0|1,0,0]=3 8233 B13R1.446 CCOC(=O)c1nc(I)ccc1Cl Amb22752630 [0,2,0,0,0,0|1,0,0]=3 8234 B13R1.446 CCOC(=O)c1nc(N)ccc1Br Amb19959836 [0,2,0,0,0,0|1,0,0]=3 8235 B13R1.446 CCOC(=O)c1nc(N)ccc1C Amb25742519 [0,2,0,0,0,0|1,0,0]=3 8236 B13R1.446 CCOC(=O)c1nc(N)ccc1Cl Amb26537057 [0,2,0,0,0,0|1,0,0]=3 8237 B13R1.446 CCOC(=O)c1nc(N)ccc1F Amb27638193 [0,2,0,0,0,0|1,0,0]=3 8238 B13R1.446 CCOC(=O)c1nc(N)cnc1C Amb27972274 [0,2,0,0,0,0|2,0,0]=4 8239 B13R1.446 CCOC(=O)c1nc(N)ncc1Br Amb22497869 [0,2,0,0,0,0|2,0,0]=4 8240 B13R1.446 CCOC(=O)c1nc(N)ncc1C Amb25673669 [0,2,0,0,0,0|2,0,0]=4 8241 B13R1.446 CCOC(=O)c1nc(O)ccc1Br Amb19959837 [0,2,0,0,0,0|1,0,0]=3 8242 B13R1.446 CCOC(=O)c1nc(O)ccc1F Amb25253427 [0,2,0,0,0,0|1,0,0]=3 8243 B13R1.446 CCOC(=O)c1nc(O)cnc1C Amb28316717 [0,2,0,0,0,0|2,0,0]=4 8244 B13R1.446 CCOC(=O)c1nc(O)ncc1C Amb27192587 [0,2,0,0,0,0|2,0,0]=4 8245 B13R1.446 CCON(C)c1cc(C)ccc1N Amb27204786 [0,2,0,0,0,0|2,0,0]=4 8246 B13R1.446 CCON(C)c1cc(F)ccc1N Amb27488998 [0,2,0,0,0,0|2,0,0]=4 8247 B13R1.446 CCO\C(O)=C1\C=C(C)N=CC1=O Amb28340638 [0,2,0,0,0,0|1,0,1]=4 8248 B13R1.446 CNCC(=O)c1cc(Br)ccc1C Amb27147599 [0,2,0,0,0,0|2,0,0]=4 8249 B13R1.446 CNCC(=O)c1cc(Br)ccc1Cl Amb25936939 [0,2,0,0,0,0|2,0,0]=4 8250 B13R1.446 CNCC(=O)c1cc(Br)ccc1F Amb25153485 [0,2,0,0,0,0|2,0,0]=4 8251 B13R1.446 CNCC(=O)c1cc(Br)ccc1O Amb33333206 [0,2,0,0,0,0|2,0,0]=4 8252 B13R1.446 CNCC(=O)c1cc(C)ccc1Br Amb26607203 [0,2,0,0,0,0|2,0,0]=4 8253 B13R1.446 CNCC(=O)c1cc(C)ccc1C Amb17233279 [0,2,0,0,0,0|2,0,0]=4 8254 B13R1.446 CNCC(=O)c1cc(C)ccc1Cl Amb27840874 [0,2,0,0,0,0|2,0,0]=4 8255 B13R1.446 CNCC(=O)c1cc(C)ccc1F Amb28423075 [0,2,0,0,0,0|2,0,0]=4 8256 B13R1.446 CNCC(=O)c1cc(C)ccc1O Amb27607699 [0,2,0,0,0,0|2,0,0]=4 8257 B13R1.446 CNCC(=O)c1cc(Cl)ccc1Br Amb27808526 [0,2,0,0,0,0|2,0,0]=4 8258 B13R1.446 CNCC(=O)c1cc(Cl)ccc1C Amb18864129 [0,2,0,0,0,0|2,0,0]=4 8259 B13R1.446 CNCC(=O)c1cc(Cl)ccc1Cl Amb18225699 [0,2,0,0,0,0|2,0,0]=4 8260 B13R1.446 CNCC(=O)c1cc(Cl)ccc1F Amb18894775 [0,2,0,0,0,0|2,0,0]=4 8261 B13R1.446 CNCC(=O)c1cc(Cl)ccc1O Amb33052474 [0,2,0,0,0,0|2,0,0]=4 8262 B13R1.446 CNCC(=O)c1cc(F)ccc1Br Amb25191402 [0,2,0,0,0,0|2,0,0]=4 8263 B13R1.446 CNCC(=O)c1cc(F)ccc1C Amb25820145 [0,2,0,0,0,0|2,0,0]=4 8264 B13R1.446 CNCC(=O)c1cc(F)ccc1Cl Amb27639643 [0,2,0,0,0,0|2,0,0]=4 8265 B13R1.446 CNCC(=O)c1cc(F)ccc1F Amb17335731 [0,2,0,0,0,0|2,0,0]=4 8266 B13R1.446 CNCC(=O)c1cc(F)ccc1O Amb26611607 [0,2,0,0,0,0|2,0,0]=4 8267 B13R1.446 CNCC(=O)c1cc(O)ccc1Br Amb27762933 [0,2,0,0,0,0|2,0,0]=4 8268 B13R1.446 CNCC(=O)c1cc(O)ccc1C Amb26502184 [0,2,0,0,0,0|2,0,0]=4 8269 B13R1.446 CNCC(=O)c1cc(O)ccc1Cl Amb26026154 [0,2,0,0,0,0|2,0,0]=4 8270 B13R1.446 CNCC(=O)c1cc(O)ccc1F Amb26478016 [0,2,0,0,0,0|2,0,0]=4 8271 B13R1.446 CNCC(=O)c1cc(O)ccc1O Amb28187132 [0,2,0,0,0,0|2,0,0]=4 8272 B13R1.446 COCC(=O)c1cc(Cl)ccc1Br Amb28317210 [0,2,0,0,0,0|2,0,0]=4 8273 B13R1.446 COCC(=O)c1cc(Cl)ccc1F Amb28074867 [0,2,0,0,0,0|2,0,0]=4 8274 B13R1.446 COCC(=O)c1cc(Cl)ccc1N Amb35584204 [0,2,0,0,0,0|2,0,0]=4 8275 B13R1.446 COCC(=O)c1cc(F)ccc1N Amb27391402 [0,2,0,0,0,0|2,0,0]=4 8276 B13R1.446 COCC(=O)c1cc(I)ccc1Br Amb27832284 [0,2,0,0,0,0|2,0,0]=4 8277 B13R1.446 CONC(=O)c1cc(C)ccc1F Amb27245540 [0,2,0,0,0,0|2,0,0]=4 8278 B13R1.446 CONC(=O)c1cc(C)ccc1N Amb27803544 [0,2,0,0,0,0|2,0,0]=4 8279 B13R1.446 CONC(=O)c1cc(C)ccc1O Amb28137415 [0,2,0,0,0,0|2,0,0]=4 8280 B13R1.446 CONC(=O)c1cc(Cl)ccc1C Amb27862253 [0,2,0,0,0,0|2,0,0]=4 8281 B13R1.446 CONC(=O)c1cc(Cl)ccc1I Amb11338467 [0,2,0,0,0,0|2,0,0]=4 8282 B13R1.446 CONC(=O)c1cc(F)ccc1Br Amb16073211 [0,2,0,0,0,0|2,0,0]=4 8283 B13R1.446 CONC(=O)c1cc(F)ccc1Cl Amb27836597 [0,2,0,0,0,0|2,0,0]=4 8284 B13R1.446 CONC(=O)c1cc(F)ccc1F Amb13980627 [0,2,0,0,0,0|2,0,0]=4 8285 B13R1.446 CONC(=O)c1cc(I)ccc1C Amb28284044 [0,2,0,0,0,0|2,0,0]=4 8286 B13R1.446 CONC(=O)c1cc(N)ccc1Br Amb27659588 [0,2,0,0,0,0|2,0,0]=4 8287 B13R1.446 CONC(=O)c1cc(N)ccc1C Amb25899848 [0,2,0,0,0,0|2,0,0]=4 8288 B13R1.446 CONC(=O)c1cc(O)ccc1Cl Amb28242331 [0,2,0,0,0,0|2,0,0]=4 8289 B13R1.446 CSCC(=O)c1cc(Br)ccc1F Amb27162084 [0,2,0,0,0,0|2,0,0]=4 8290 B13R1.446 CSCC(=O)c1cc(C)ccc1Br Amb27608808 [0,2,0,0,0,0|2,0,0]=4 8291 B13R1.446 CSCC(=O)c1cc(C)ccc1C Amb18321259 [0,2,0,0,0,0|2,0,0]=4 8292 B13R1.446 CSCC(=O)c1cc(Cl)ccc1C Amb27213644 [0,2,0,0,0,0|2,0,0]=4 8293 B13R1.446 CSCC(=O)c1cc(Cl)ccc1Cl Amb27201554 [0,2,0,0,0,0|2,0,0]=4 8294 B13R1.446 CSCC(=O)c1cc(Cl)ccc1I Amb27599799 [0,2,0,0,0,0|2,0,0]=4 8295 B13R1.446 CSCC(=O)c1cc(F)ccc1Cl Amb28317089 [0,2,0,0,0,0|2,0,0]=4 8296 B13R1.446 CSCC(=O)c1cc(F)ccc1F Amb25303096 [0,2,0,0,0,0|2,0,0]=4 8297 B13R1.446 CSCC(=O)c1cc(F)ccc1O Amb19047945 [0,2,0,0,0,0|2,0,0]=4 8298 B13R1.446 C\C=C/C(=O)c1cc(C)ccc1O Amb28321989 [0,2,0,0,0,0|1,0,1]=4 8299 B13R1.446 Cc1ccc(Br)c(C(=O)CCBr)c1 Amb24375698 [0,2,0,0,0,0|2,0,0]=4 8300 B13R1.446 Cc1ccc(Br)c(C(=O)CCCl)c1 Amb26966012 [0,2,0,0,0,0|2,0,0]=4 8301 B13R1.446 Cc1ccc(Br)c(C(=O)CCN)c1 Amb33477207 [0,2,0,0,0,0|2,0,0]=4 8302 B13R1.446 Cc1ccc(Br)cc1C(=O)CCBr Amb24344101 [0,2,0,0,0,0|2,0,0]=4 8303 B13R1.446 Cc1ccc(Br)cc1C(=O)CCCl Amb25135181 [0,2,0,0,0,0|2,0,0]=4 8304 B13R1.446 Cc1ccc(Br)cc1C(=O)CCN Amb24555459 [0,2,0,0,0,0|2,0,0]=4 8305 B13R1.446 Cc1ccc(Br)cc1C(=O)CCO Amb28316671 [0,2,0,0,0,0|2,0,0]=4 8306 B13R1.446 Cc1ccc(C)c(C(=O)CCBr)c1 Amb27177198 [0,2,0,0,0,0|2,0,0]=4 8307 B13R1.446 Cc1ccc(C)c(C(=O)CCCl)c1 Amb17139623 [0,2,0,0,0,0|2,0,0]=4 8308 B13R1.446 Cc1ccc(C)c(C(=O)CCN)c1 Amb17194510 [0,2,0,0,0,0|2,0,0]=4 8309 B13R1.446 Cc1ccc(C)c(C(=O)CCO)c1 Amb18065759 [0,2,0,0,0,0|2,0,0]=4 8310 B13R1.446 Cc1ccc(C)c(C(=O)CCS)c1 Amb17401972 [0,2,0,0,0,0|2,0,0]=4 8311 B13R1.446 Cc1ccc(Cl)c(C(=O)CCBr)c1 Amb26467990 [0,2,0,0,0,0|2,0,0]=4 8312 B13R1.446 Cc1ccc(Cl)c(C(=O)CCCl)c1 Amb17198880 [0,2,0,0,0,0|2,0,0]=4 8313 B13R1.446 Cc1ccc(Cl)c(C(=O)CCN)c1 Amb25114851 [0,2,0,0,0,0|2,0,0]=4 8314 B13R1.446 Cc1ccc(Cl)cc1C(=O)CCBr Amb28199718 [0,2,0,0,0,0|2,0,0]=4 8315 B13R1.446 Cc1ccc(Cl)cc1C(=O)CCCl Amb25689613 [0,2,0,0,0,0|2,0,0]=4 8316 B13R1.446 Cc1ccc(Cl)cc1C(=O)CCN Amb18121503 [0,2,0,0,0,0|2,0,0]=4 8317 B13R1.446 Cc1ccc(F)c(C(=O)CCBr)c1 Amb27154236 [0,2,0,0,0,0|2,0,0]=4 8318 B13R1.446 Cc1ccc(F)c(C(=O)CCCl)c1 Amb24392269 [0,2,0,0,0,0|2,0,0]=4 8319 B13R1.446 Cc1ccc(F)c(C(=O)CCN)c1 Amb27831662 [0,2,0,0,0,0|2,0,0]=4 8320 B13R1.446 Cc1ccc(F)cc1C(=O)CCBr Amb24426858 [0,2,0,0,0,0|2,0,0]=4 8321 B13R1.446 Cc1ccc(F)cc1C(=O)CCCl Amb27462035 [0,2,0,0,0,0|2,0,0]=4 8322 B13R1.446 Cc1ccc(F)cc1C(=O)CCN Amb26947389 [0,2,0,0,0,0|2,0,0]=4 8323 B13R1.446 Cc1ccc(I)c(C(=O)CCBr)c1 Amb25192026 [0,2,0,0,0,0|2,0,0]=4 8324 B13R1.446 Cc1ccc(I)c(C(=O)CCCl)c1 Amb27223881 [0,2,0,0,0,0|2,0,0]=4 8325 B13R1.446 Cc1ccc(I)cc1C(=O)CCBr Amb25732923 [0,2,0,0,0,0|2,0,0]=4 8326 B13R1.446 Cc1ccc(I)cc1C(=O)CCCl Amb25180618 [0,2,0,0,0,0|2,0,0]=4 8327 B13R1.446 Cc1ccc(N)c(C(=O)CCCl)c1 Amb26914956 [0,2,0,0,0,0|2,0,0]=4 8328 B13R1.446 Cc1ccc(N)cc1C(=O)CCBr Amb24637195 [0,2,0,0,0,0|2,0,0]=4 8329 B13R1.446 Cc1ccc(N)cc1C(=O)CCCl Amb27638464 [0,2,0,0,0,0|2,0,0]=4 8330 B13R1.446 Cc1ccc(O)c(C(=O)CCBr)c1 Amb27246543 [0,2,0,0,0,0|2,0,0]=4 8331 B13R1.446 Cc1ccc(O)c(C(=O)CCCl)c1 Amb18054568 [0,2,0,0,0,0|2,0,0]=4 8332 B13R1.446 Cc1ccc(O)c(C(=O)CCN)c1 Amb25800893 [0,2,0,0,0,0|2,0,0]=4 8333 B13R1.446 Cc1ccc(O)cc1C(=O)CCBr Amb25248658 [0,2,0,0,0,0|2,0,0]=4 8334 B13R1.446 Cc1ccc(O)cc1C(=O)CCCl Amb27259780 [0,2,0,0,0,0|2,0,0]=4 8335 B13R1.446 Cc1ccc(S)c(C(=O)CCBr)c1 Amb26023939 [0,2,0,0,0,0|2,0,0]=4 8336 B13R1.446 Cc1ccc(S)c(C(=O)CCCl)c1 Amb24572837 [0,2,0,0,0,0|2,0,0]=4 8337 B13R1.446 Cc1ccc(S)cc1C(=O)CCBr Amb25278637 [0,2,0,0,0,0|2,0,0]=4 8338 B13R1.446 NCCC(=O)c1cc(Br)ccc1Cl Amb33450949 [0,2,0,0,0,0|2,0,0]=4 8339 B13R1.446 NCCC(=O)c1cc(Br)ccc1F Amb25791337 [0,2,0,0,0,0|2,0,0]=4 8340 B13R1.446 NCCC(=O)c1cc(Br)ccc1O Amb33333189 [0,2,0,0,0,0|2,0,0]=4 8341 B13R1.446 NCCC(=O)c1cc(Cl)ccc1Br Amb33450946 [0,2,0,0,0,0|2,0,0]=4 8342 B13R1.446 NCCC(=O)c1cc(Cl)ccc1Cl Amb24673767 [0,2,0,0,0,0|2,0,0]=4 8343 B13R1.446 NCCC(=O)c1cc(Cl)ccc1F Amb18244118 [0,2,0,0,0,0|2,0,0]=4 8344 B13R1.446 NCCC(=O)c1cc(Cl)ccc1O Amb18641512 [0,2,0,0,0,0|2,0,0]=4 8345 B13R1.446 NCCC(=O)c1cc(F)ccc1Br Amb33008288 [0,2,0,0,0,0|2,0,0]=4 8346 B13R1.446 NCCC(=O)c1cc(F)ccc1Cl Amb27143498 [0,2,0,0,0,0|2,0,0]=4 8347 B13R1.446 NCCC(=O)c1cc(F)ccc1F Amb17194572 [0,2,0,0,0,0|2,0,0]=4 8348 B13R1.446 NCCC(=O)c1cc(F)ccc1O Amb25276121 [0,2,0,0,0,0|2,0,0]=4 8349 B13R1.446 NCCC(=O)c1cc(O)ccc1Br Amb33478651 [0,2,0,0,0,0|2,0,0]=4 8350 B13R1.446 NCCC(=O)c1cc(O)ccc1N Amb28385738 [0,2,0,0,0,0|2,0,0]=4 8351 B13R1.446 NCCC(=O)c1cc(O)ccc1O Amb26419525 [0,2,0,0,0,0|2,0,0]=4 8352 B13R1.446 Nc1ccc(Br)c(C(=O)CCBr)c1 Amb27445654 [0,2,0,0,0,0|2,0,0]=4 8353 B13R1.446 Nc1ccc(Br)c(C(=O)CCCl)c1 Amb27968226 [0,2,0,0,0,0|2,0,0]=4 8354 B13R1.446 Nc1ccc(Br)cc1C(=O)CCBr Amb26905974 [0,2,0,0,0,0|2,0,0]=4 8355 B13R1.446 Nc1ccc(Br)cc1C(=O)CCCl Amb25942602 [0,2,0,0,0,0|2,0,0]=4 8356 B13R1.446 Nc1ccc(Cl)c(C(=O)CCCl)c1 Amb27613755 [0,2,0,0,0,0|2,0,0]=4 8357 B13R1.446 Nc1ccc(F)cc1C(=O)CCCl Amb27438652 [0,2,0,0,0,0|2,0,0]=4 8358 B13R1.446 Nc1ccc(I)cc1C(=O)CCCl Amb27613879 [0,2,0,0,0,0|2,0,0]=4 8359 B13R1.446 Nc1ccc(S)c(C(=O)CCBr)c1 Amb28245463 [0,2,0,0,0,0|2,0,0]=4 8360 B13R1.446 Nc1ccc(S)c(C(=O)CCCl)c1 Amb28140829 [0,2,0,0,0,0|2,0,0]=4 8361 B13R1.446 Nc1ccc(S)cc1C(=O)CCBr Amb27616200 [0,2,0,0,0,0|2,0,0]=4 8362 B13R1.446 O=C(CCBr)c1cc(Br)ccc1Br Amb26326058 [0,2,0,0,0,0|2,0,0]=4 8363 B13R1.446 O=C(CCBr)c1cc(Br)ccc1Cl Amb27180835 [0,2,0,0,0,0|2,0,0]=4 8364 B13R1.446 O=C(CCBr)c1cc(Br)ccc1F Amb25366050 [0,2,0,0,0,0|2,0,0]=4 8365 B13R1.446 O=C(CCBr)c1cc(Br)ccc1O Amb27433182 [0,2,0,0,0,0|2,0,0]=4 8366 B13R1.446 O=C(CCBr)c1cc(Br)ccc1S Amb27200629 [0,2,0,0,0,0|2,0,0]=4 8367 B13R1.446 O=C(CCBr)c1cc(Cl)ccc1Cl Amb24727284 [0,2,0,0,0,0|2,0,0]=4 8368 B13R1.446 O=C(CCBr)c1cc(Cl)ccc1F Amb24724108 [0,2,0,0,0,0|2,0,0]=4 8369 B13R1.446 O=C(CCBr)c1cc(Cl)ccc1I Amb27845606 [0,2,0,0,0,0|2,0,0]=4 8370 B13R1.446 O=C(CCBr)c1cc(Cl)ccc1O Amb27393704 [0,2,0,0,0,0|2,0,0]=4 8371 B13R1.446 O=C(CCBr)c1cc(F)ccc1Br Amb25326271 [0,2,0,0,0,0|2,0,0]=4 8372 B13R1.446 O=C(CCBr)c1cc(F)ccc1F Amb17437922 [0,2,0,0,0,0|2,0,0]=4 8373 B13R1.446 O=C(CCBr)c1cc(F)ccc1I Amb24544662 [0,2,0,0,0,0|2,0,0]=4 8374 B13R1.446 O=C(CCBr)c1cc(F)ccc1O Amb28186445 [0,2,0,0,0,0|2,0,0]=4 8375 B13R1.446 O=C(CCBr)c1cc(F)ccc1S Amb27847051 [0,2,0,0,0,0|2,0,0]=4 8376 B13R1.446 O=C(CCBr)c1cc(I)ccc1Br Amb27834966 [0,2,0,0,0,0|2,0,0]=4 8377 B13R1.446 O=C(CCBr)c1cc(I)ccc1Cl Amb26496219 [0,2,0,0,0,0|2,0,0]=4 8378 B13R1.446 O=C(CCBr)c1cc(I)ccc1F Amb27225791 [0,2,0,0,0,0|2,0,0]=4 8379 B13R1.446 O=C(CCBr)c1cc(I)ccc1I Amb27968275 [0,2,0,0,0,0|2,0,0]=4 8380 B13R1.446 O=C(CCBr)c1cc(I)ccc1O Amb25791094 [0,2,0,0,0,0|2,0,0]=4 8381 B13R1.446 O=C(CCBr)c1cc(I)ccc1S Amb28196070 [0,2,0,0,0,0|2,0,0]=4 8382 B13R1.446 O=C(CCBr)c1cc(O)ccc1Br Amb27876636 [0,2,0,0,0,0|2,0,0]=4 8383 B13R1.446 O=C(CCBr)c1cc(O)ccc1Cl Amb24695420 [0,2,0,0,0,0|2,0,0]=4 8384 B13R1.446 O=C(CCBr)c1cc(O)ccc1O Amb26416726 [0,2,0,0,0,0|2,0,0]=4 8385 B13R1.446 O=C(CCBr)c1cc(S)ccc1Br Amb25270365 [0,2,0,0,0,0|2,0,0]=4 8386 B13R1.446 O=C(CCBr)c1cc(S)ccc1Cl Amb28129902 [0,2,0,0,0,0|2,0,0]=4 8387 B13R1.446 O=C(CCBr)c1cc(S)ccc1F Amb27259799 [0,2,0,0,0,0|2,0,0]=4 8388 B13R1.446 O=C(CCBr)c1cc(S)ccc1I Amb27423758 [0,2,0,0,0,0|2,0,0]=4 8389 B13R1.446 O=C(CCBr)c1cc(S)ccc1O Amb27460216 [0,2,0,0,0,0|2,0,0]=4 8390 B13R1.446 O=C(CCBr)c1cc(S)ccc1S Amb27441423 [0,2,0,0,0,0|2,0,0]=4 8391 B13R1.446 O=C(CCCl)c1cc(Br)ccc1I Amb27638791 [0,2,0,0,0,0|2,0,0]=4 8392 B13R1.446 O=C(CCCl)c1cc(Br)ccc1O Amb24579298 [0,2,0,0,0,0|2,0,0]=4 8393 B13R1.446 O=C(CCCl)c1cc(Cl)ccc1Br Amb27751252 [0,2,0,0,0,0|2,0,0]=4 8394 B13R1.446 O=C(CCCl)c1cc(Cl)ccc1Cl Amb17198785 [0,2,0,0,0,0|2,0,0]=4 8395 B13R1.446 O=C(CCCl)c1cc(Cl)ccc1F Amb27180830 [0,2,0,0,0,0|2,0,0]=4 8396 B13R1.446 O=C(CCCl)c1cc(Cl)ccc1I Amb27180941 [0,2,0,0,0,0|2,0,0]=4 8397 B13R1.446 O=C(CCCl)c1cc(F)ccc1Br Amb25940262 [0,2,0,0,0,0|2,0,0]=4 8398 B13R1.446 O=C(CCCl)c1cc(F)ccc1Cl Amb25784770 [0,2,0,0,0,0|2,0,0]=4 8399 B13R1.446 O=C(CCCl)c1cc(F)ccc1F Amb17194891 [0,2,0,0,0,0|2,0,0]=4 8400 B13R1.446 O=C(CCCl)c1cc(F)ccc1I Amb27618415 [0,2,0,0,0,0|2,0,0]=4 8401 B13R1.446 O=C(CCCl)c1cc(F)ccc1O Amb18556461 [0,2,0,0,0,0|2,0,0]=4 8402 B13R1.446 O=C(CCCl)c1cc(F)ccc1S Amb27624816 [0,2,0,0,0,0|2,0,0]=4 8403 B13R1.446 O=C(CCCl)c1cc(I)ccc1Br Amb27670101 [0,2,0,0,0,0|2,0,0]=4 8404 B13R1.446 O=C(CCCl)c1cc(I)ccc1Cl Amb26352030 [0,2,0,0,0,0|2,0,0]=4 8405 B13R1.446 O=C(CCCl)c1cc(I)ccc1F Amb27965480 [0,2,0,0,0,0|2,0,0]=4 8406 B13R1.446 O=C(CCCl)c1cc(I)ccc1O Amb24605626 [0,2,0,0,0,0|2,0,0]=4 8407 B13R1.446 O=C(CCCl)c1cc(O)ccc1F Amb25155063 [0,2,0,0,0,0|2,0,0]=4 8408 B13R1.446 O=C(CCCl)c1cc(O)ccc1I Amb26078032 [0,2,0,0,0,0|2,0,0]=4 8409 B13R1.446 O=C(CCCl)c1cc(O)ccc1S Amb27423605 [0,2,0,0,0,0|2,0,0]=4 8410 B13R1.446 O=C(CCCl)c1cc(S)ccc1Cl Amb27428180 [0,2,0,0,0,0|2,0,0]=4 8411 B13R1.446 O=C(CCCl)c1cc(S)ccc1F Amb28196074 [0,2,0,0,0,0|2,0,0]=4 8412 B13R1.446 O=C(CCCl)c1cc(S)ccc1O Amb27787481 [0,2,0,0,0,0|2,0,0]=4 8413 B13R1.446 O=C(CCO)c1cc(Br)ccc1F Amb28044029 [0,2,0,0,0,0|2,0,0]=4 8414 B13R1.446 O=C(CCO)c1cc(Cl)ccc1F Amb27603471 [0,2,0,0,0,0|2,0,0]=4 8415 B13R1.446 O=C(CCO)c1cc(F)ccc1F Amb18564362 [0,2,0,0,0,0|2,0,0]=4 8416 B13R1.450 C=C(OCC)c1cc(C)cc(N)c1 Amb33135840 [0,2,0,0,0,0|1,0,0]=3 8417 B13R1.450 C=C(OCC)c1cc(N)cc(Br)c1 Amb33136342 [0,2,0,0,0,0|1,0,0]=3 8418 B13R1.450 C=C(OCC)c1cc(N)cc(F)c1 Amb33136216 [0,2,0,0,0,0|1,0,0]=3 8419 B13R1.450 C=C(OCC)c1cc(O)cc(F)c1 Amb33136302 [0,2,0,0,0,0|1,0,0]=3 8420 B13R1.450 CCCC(=O)c1cc(Br)cc(Br)c1 Amb28317354 [0,2,0,0,0,0|1,0,0]=3 8421 B13R1.450 CCCC(=O)c1cc(C)cc(C)c1 Amb17233218 [0,2,0,0,0,0|1,0,0]=3 8422 B13R1.450 CCCC(=O)c1cc(C)cc(C)n1 Amb27768960 [0,2,0,0,0,0|2,0,0]=4 8423 B13R1.450 CCCC(=O)c1cc(C)cc(Cl)c1 Amb27755080 [0,2,0,0,0,0|1,0,0]=3 8424 B13R1.450 CCCC(=O)c1cc(C)cc(F)c1 Amb26621903 [0,2,0,0,0,0|1,0,0]=3 8425 B13R1.450 CCCC(=O)c1cc(C)nc(C)c1 Amb28317021 [0,2,0,0,0,0|2,0,0]=4 8426 B13R1.450 CCCC(=O)c1cc(Cl)cc(Cl)c1 Amb17340708 [0,2,0,0,0,0|1,0,0]=3 8427 B13R1.450 CCCC(=O)c1cc(F)cc(Cl)c1 Amb24709112 [0,2,0,0,0,0|1,0,0]=3 8428 B13R1.450 CCCC(=O)c1cc(F)cc(F)c1 Amb17234061 [0,2,0,0,0,0|1,0,0]=3 8429 B13R1.450 CCCC(=O)c1cc(O)cc(O)c1 Amb24726186 [0,2,0,0,0,0|1,0,0]=3 8430 B13R1.450 CCNC(=N)c1cc(F)cc(Br)c1 Amb27263514 [0,2,0,0,0,0|2,0,0]=4 8431 B13R1.450 CCNC(=O)C1=CC(O)=CC(=O)O1 Amb28051091 [0,2,0,0,0,0|2,0,0]=4 8432 B13R1.450 CCNC(=O)c1cc(Br)cc(Br)c1 Amb27413496 [0,2,0,0,0,0|1,0,0]=3 8433 B13R1.450 CCNC(=O)c1cc(C)cc(Br)c1 Amb28347453 [0,2,0,0,0,0|1,0,0]=3 8434 B13R1.450 CCNC(=O)c1cc(C)cc(C)c1 Amb3742022 [0,2,0,0,0,0|1,0,0]=3 8435 B13R1.450 CCNC(=O)c1cc(Cl)cc(Br)c1 Amb27791344 [0,2,0,0,0,0|1,0,0]=3 8436 B13R1.450 CCNC(=O)c1cc(Cl)cc(Cl)c1 Amb3997831 [0,2,0,0,0,0|1,0,0]=3 8437 B13R1.450 CCNC(=O)c1cc(F)cc(Br)c1 Amb25114505 [0,2,0,0,0,0|1,0,0]=3 8438 B13R1.450 CCNC(=O)c1cc(N)cc(Br)c1 Amb26351021 [0,2,0,0,0,0|1,0,0]=3 8439 B13R1.450 CCNC(=O)c1cc(N)cc(Cl)c1 Amb27609074 [0,2,0,0,0,0|1,0,0]=3 8440 B13R1.450 CCNC(=O)c1cc(N)cc(F)c1 Amb25101450 [0,2,0,0,0,0|1,0,0]=3 8441 B13R1.450 CCNC(=O)c1cc(N)cc(I)c1 Amb27398032 [0,2,0,0,0,0|1,0,0]=3 8442 B13R1.450 CCNC(=O)c1cc(N)cc(N)c1 Amb18281738 [0,2,0,0,0,0|1,0,0]=3 8443 B13R1.450 CCNC(=O)c1cc(N)cc(O)c1 Amb32993702 [0,2,0,0,0,0|1,0,0]=3 8444 B13R1.450 CCNC(=O)c1cc(O)cc(F)c1 Amb27959711 [0,2,0,0,0,0|1,0,0]=3 8445 B13R1.450 CCOC(=N)c1cc(Br)cc(Br)c1 Amb28196310 [0,2,0,0,0,0|1,0,0]=3 8446 B13R1.450 CCOC(=N)c1cc(C)cc(C)c1 Amb18804646 [0,2,0,0,0,0|1,0,0]=3 8447 B13R1.450 CCOC(=N)c1cc(F)cc(Br)c1 Amb27813323 [0,2,0,0,0,0|1,0,0]=3 8448 B13R1.450 CCOC(=N)c1cc(F)cc(Cl)c1 Amb27453319 [0,2,0,0,0,0|1,0,0]=3 8449 B13R1.450 CCOC(=N)c1cc(F)cc(F)c1 Amb19069198 [0,2,0,0,0,0|1,0,0]=3 8450 B13R1.450 CCOC(=N)c1cc(O)cc(F)c1 Amb27250121 [0,2,0,0,0,0|1,0,0]=3 8451 B13R1.450 CCOC(=O)C1=CC(=O)NC(N)=N1 Amb28325612 [0,2,0,0,0,0|2,0,0]=4 8452 B13R1.450 CCOC(=O)C1=CC(S)=NC(=O)N1 Amb20031211 [0,2,0,0,0,0|2,0,0]=4 8453 B13R1.450 CCOC(=O)c1cc(Br)cc(Br)c1 Amb19888238 [0,2,0,0,0,0|0,0,0]=2 8454 B13R1.450 CCOC(=O)c1cc(Br)cc(Br)n1 Amb23400806 [0,2,0,0,0,0|1,0,0]=3 8455 B13R1.450 CCOC(=O)c1cc(Br)cc(Cl)n1 Amb23400684 [0,2,0,0,0,0|1,0,0]=3 8456 B13R1.450 CCOC(=O)c1cc(Br)cc(F)n1 Amb25351865 [0,2,0,0,0,0|1,0,0]=3 8457 B13R1.450 CCOC(=O)c1cc(Br)cc(I)c1 Amb22285058 [0,2,0,0,0,0|0,0,0]=2 8458 B13R1.450 CCOC(=O)c1cc(Br)cc(N)n1 Amb24653842 [0,2,0,0,0,0|1,0,0]=3 8459 B13R1.450 CCOC(=O)c1cc(Br)cc(O)n1 Amb26381368 [0,2,0,0,0,0|1,0,0]=3 8460 B13R1.450 CCOC(=O)c1cc(Br)nc(Br)c1 Amb27401043 [0,2,0,0,0,0|1,0,0]=3 8461 B13R1.450 CCOC(=O)c1cc(C)cc(Br)c1 Amb22498272 [0,2,0,0,0,0|0,0,0]=2 8462 B13R1.450 CCOC(=O)c1cc(C)cc(Br)n1 Amb28284359 [0,2,0,0,0,0|1,0,0]=3 8463 B13R1.450 CCOC(=O)c1cc(C)cc(C)c1 Amb6357754 [0,2,0,0,0,0|0,0,0]=2 8464 B13R1.450 CCOC(=O)c1cc(C)cc(C)n1 Amb28243546 [0,2,0,0,0,0|1,0,0]=3 8465 B13R1.450 CCOC(=O)c1cc(C)cc(Cl)n1 Amb19515772 [0,2,0,0,0,0|1,0,0]=3 8466 B13R1.450 CCOC(=O)c1cc(C)cc(F)c1 Amb27225471 [0,2,0,0,0,0|0,0,0]=2 8467 B13R1.450 CCOC(=O)c1cc(C)cc(F)n1 Amb25939112 [0,2,0,0,0,0|1,0,0]=3 8468 B13R1.450 CCOC(=O)c1cc(C)cc(I)c1 Amb27402600 [0,2,0,0,0,0|0,0,0]=2 8469 B13R1.450 CCOC(=O)c1cc(C)cc(N)c1 Amb19002000 [0,2,0,0,0,0|0,0,0]=2 8470 B13R1.450 CCOC(=O)c1cc(C)cc(N)n1 Amb25350847 [0,2,0,0,0,0|1,0,0]=3 8471 B13R1.450 CCOC(=O)c1cc(C)cc(O)c1 Amb23452662 [0,2,0,0,0,0|0,0,0]=2 8472 B13R1.450 CCOC(=O)c1cc(C)cc(O)n1 Amb27439850 [0,2,0,0,0,0|1,0,0]=3 8473 B13R1.450 CCOC(=O)c1cc(C)nc(Br)c1 Amb28312885 [0,2,0,0,0,0|1,0,0]=3 8474 B13R1.450 CCOC(=O)c1cc(C)nc(C)c1 Amb22490764 [0,2,0,0,0,0|1,0,0]=3 8475 B13R1.450 CCOC(=O)c1cc(C)nc(Cl)c1 Amb8383453 [0,2,0,0,0,0|1,0,0]=3 8476 B13R1.450 CCOC(=O)c1cc(C)nc(Cl)n1 Amb6572511 [0,2,0,0,0,0|2,0,0]=4 8477 B13R1.450 CCOC(=O)c1cc(C)nc(F)c1 Amb27180441 [0,2,0,0,0,0|1,0,0]=3 8478 B13R1.450 CCOC(=O)c1cc(C)nc(N)n1 Amb19844277 [0,2,0,0,0,0|2,0,0]=4 8479 B13R1.450 CCOC(=O)c1cc(C)nc(O)c1 Amb10807883 [0,2,0,0,0,0|1,0,0]=3 8480 B13R1.450 CCOC(=O)c1cc(Cl)cc(Br)c1 Amb19944219 [0,2,0,0,0,0|0,0,0]=2 8481 B13R1.450 CCOC(=O)c1cc(Cl)cc(Br)n1 Amb23400805 [0,2,0,0,0,0|1,0,0]=3 8482 B13R1.450 CCOC(=O)c1cc(Cl)cc(C)n1 Amb21926544 [0,2,0,0,0,0|1,0,0]=3 8483 B13R1.450 CCOC(=O)c1cc(Cl)cc(Cl)c1 Amb2726237 [0,2,0,0,0,0|0,0,0]=2 8484 B13R1.450 CCOC(=O)c1cc(Cl)cc(Cl)n1 Amb19958236 [0,2,0,0,0,0|1,0,0]=3 8485 B13R1.450 CCOC(=O)c1cc(Cl)cc(O)n1 Amb25270121 [0,2,0,0,0,0|1,0,0]=3 8486 B13R1.450 CCOC(=O)c1cc(Cl)nc(C)n1 Amb22263784 [0,2,0,0,0,0|2,0,0]=4 8487 B13R1.450 CCOC(=O)c1cc(Cl)nc(Cl)c1 Amb17621583 [0,2,0,0,0,0|1,0,0]=3 8488 B13R1.450 CCOC(=O)c1cc(Cl)nc(Cl)n1 Amb22170309 [0,2,0,0,0,0|2,0,0]=4 8489 B13R1.450 CCOC(=O)c1cc(Cl)nc(N)n1 Amb22498858 [0,2,0,0,0,0|2,0,0]=4 8490 B13R1.450 CCOC(=O)c1cc(F)cc(Br)c1 Amb9336771 [0,2,0,0,0,0|0,0,0]=2 8491 B13R1.450 CCOC(=O)c1cc(F)cc(Br)n1 Amb25920066 [0,2,0,0,0,0|1,0,0]=3 8492 B13R1.450 CCOC(=O)c1cc(F)cc(C)n1 Amb24665997 [0,2,0,0,0,0|1,0,0]=3 8493 B13R1.450 CCOC(=O)c1cc(F)cc(Cl)c1 Amb27463151 [0,2,0,0,0,0|0,0,0]=2 8494 B13R1.450 CCOC(=O)c1cc(F)cc(Cl)n1 Amb27877004 [0,2,0,0,0,0|1,0,0]=3 8495 B13R1.450 CCOC(=O)c1cc(F)cc(I)c1 Amb20670533 [0,2,0,0,0,0|0,0,0]=2 8496 B13R1.450 CCOC(=O)c1cc(F)cc(I)n1 Amb25217828 [0,2,0,0,0,0|1,0,0]=3 8497 B13R1.450 CCOC(=O)c1cc(F)cc(O)n1 Amb25208606 [0,2,0,0,0,0|1,0,0]=3 8498 B13R1.450 CCOC(=O)c1cc(F)nc(Br)c1 Amb27748638 [0,2,0,0,0,0|1,0,0]=3 8499 B13R1.450 CCOC(=O)c1cc(F)nc(Cl)c1 Amb27177379 [0,2,0,0,0,0|1,0,0]=3 8500 B13R1.450 CCOC(=O)c1cc(F)nc(F)c1 Amb27952637 [0,2,0,0,0,0|1,0,0]=3 8501 B13R1.450 CCOC(=O)c1cc(F)nc(I)c1 Amb27616181 [0,2,0,0,0,0|1,0,0]=3 8502 B13R1.450 CCOC(=O)c1cc(I)cc(I)c1 Amb19882293 [0,2,0,0,0,0|0,0,0]=2 8503 B13R1.450 CCOC(=O)c1cc(N)cc(Br)c1 Amb19001986 [0,2,0,0,0,0|0,0,0]=2 8504 B13R1.450 CCOC(=O)c1cc(N)cc(Br)n1 Amb24501508 [0,2,0,0,0,0|1,0,0]=3 8505 B13R1.450 CCOC(=O)c1cc(N)cc(Cl)c1 Amb18302896 [0,2,0,0,0,0|0,0,0]=2 8506 B13R1.450 CCOC(=O)c1cc(N)cc(F)c1 Amb2687768 [0,2,0,0,0,0|0,0,0]=2 8507 B13R1.450 CCOC(=O)c1cc(N)cc(F)n1 Amb25212616 [0,2,0,0,0,0|1,0,0]=3 8508 B13R1.450 CCOC(=O)c1cc(N)cc(I)c1 Amb25884993 [0,2,0,0,0,0|0,0,0]=2 8509 B13R1.450 CCOC(=O)c1cc(N)cc(N)c1 Amb6298848 [0,2,0,0,0,0|0,0,0]=2 8510 B13R1.450 CCOC(=O)c1cc(N)cc(O)c1 Amb26081174 [0,2,0,0,0,0|0,0,0]=2 8511 B13R1.450 CCOC(=O)c1cc(N)nc(Br)c1 Amb28071496 [0,2,0,0,0,0|1,0,0]=3 8512 B13R1.450 CCOC(=O)c1cc(N)nc(C)n1 Amb27495532 [0,2,0,0,0,0|2,0,0]=4 8513 B13R1.450 CCOC(=O)c1cc(N)nc(Cl)c1 Amb26422324 [0,2,0,0,0,0|1,0,0]=3 8514 B13R1.450 CCOC(=O)c1cc(N)nc(Cl)n1 Amb23402900 [0,2,0,0,0,0|2,0,0]=4 8515 B13R1.450 CCOC(=O)c1cc(N)nc(N)c1 Amb26641799 [0,2,0,0,0,0|1,0,0]=3 8516 B13R1.450 CCOC(=O)c1cc(O)cc(Br)n1 Amb26361396 [0,2,0,0,0,0|1,0,0]=3 8517 B13R1.450 CCOC(=O)c1cc(O)cc(C)n1 Amb27640378 [0,2,0,0,0,0|1,0,0]=3 8518 B13R1.450 CCOC(=O)c1cc(O)cc(Cl)n1 Amb24528292 [0,2,0,0,0,0|1,0,0]=3 8519 B13R1.450 CCOC(=O)c1cc(O)cc(F)c1 Amb25352349 [0,2,0,0,0,0|0,0,0]=2 8520 B13R1.450 CCOC(=O)c1cc(O)cc(O)c1 Amb2613950 [0,2,0,0,0,0|0,0,0]=2 8521 B13R1.450 CCOC(=O)c1cc(O)nc(Br)c1 Amb28077343 [0,2,0,0,0,0|1,0,0]=3 8522 B13R1.450 CCOC(=O)c1cc(O)nc(Cl)n1 Amb24664146 [0,2,0,0,0,0|2,0,0]=4 8523 B13R1.450 CCOC(=O)c1cc(O)nc(O)n1 Amb21962478 [0,2,0,0,0,0|2,0,0]=4 8524 B13R1.450 CCOC(=O)c1cc(O)nc(S)n1 Amb18130665 [0,2,0,0,0,0|2,0,0]=4 8525 B13R1.450 CCOC(=O)c1nc(C)cc(O)n1 Amb27966161 [0,2,0,0,0,0|2,0,0]=4 8526 B13R1.450 CCOC(=O)c1nc(Cl)cc(Cl)n1 Amb22490975 [0,2,0,0,0,0|2,0,0]=4 8527 B13R1.450 CNCC(=O)c1cc(C)cc(Br)c1 Amb27398419 [0,2,0,0,0,0|2,0,0]=4 8528 B13R1.450 CNCC(=O)c1cc(C)cc(C)c1 Amb18862918 [0,2,0,0,0,0|2,0,0]=4 8529 B13R1.450 CNCC(=O)c1cc(C)cc(Cl)c1 Amb26026490 [0,2,0,0,0,0|2,0,0]=4 8530 B13R1.450 CNCC(=O)c1cc(C)cc(F)c1 Amb25155763 [0,2,0,0,0,0|2,0,0]=4 8531 B13R1.450 CNCC(=O)c1cc(C)cc(O)c1 Amb24379656 [0,2,0,0,0,0|2,0,0]=4 8532 B13R1.450 CNCC(=O)c1cc(Cl)cc(Br)c1 Amb24456871 [0,2,0,0,0,0|2,0,0]=4 8533 B13R1.450 CNCC(=O)c1cc(Cl)cc(Cl)c1 Amb18225701 [0,2,0,0,0,0|2,0,0]=4 8534 B13R1.450 CNCC(=O)c1cc(F)cc(Br)c1 Amb24472526 [0,2,0,0,0,0|2,0,0]=4 8535 B13R1.450 CNCC(=O)c1cc(F)cc(Cl)c1 Amb26633466 [0,2,0,0,0,0|2,0,0]=4 8536 B13R1.450 CNCC(=O)c1cc(F)cc(F)c1 Amb25698006 [0,2,0,0,0,0|2,0,0]=4 8537 B13R1.450 CNCC(=O)c1cc(O)cc(Br)c1 Amb27481059 [0,2,0,0,0,0|2,0,0]=4 8538 B13R1.450 CNCC(=O)c1cc(O)cc(Cl)c1 Amb25180539 [0,2,0,0,0,0|2,0,0]=4 8539 B13R1.450 CNCC(=O)c1cc(O)cc(F)c1 Amb25094521 [0,2,0,0,0,0|2,0,0]=4 8540 B13R1.450 CNCC(=O)c1cc(O)cc(O)c1 Amb27224027 [0,2,0,0,0,0|2,0,0]=4 8541 B13R1.450 COCC(=O)c1cc(C)cc(N)c1 Amb27415411 [0,2,0,0,0,0|2,0,0]=4 8542 B13R1.450 COCC(=O)c1cc(Cl)cc(Cl)c1 Amb28186545 [0,2,0,0,0,0|2,0,0]=4 8543 B13R1.450 COCC(=O)c1cc(F)cc(Cl)c1 Amb27238729 [0,2,0,0,0,0|2,0,0]=4 8544 B13R1.450 CONC(=O)c1cc(C)cc(Br)c1 Amb28347454 [0,2,0,0,0,0|2,0,0]=4 8545 B13R1.450 CONC(=O)c1cc(Cl)cc(Br)c1 Amb16989016 [0,2,0,0,0,0|2,0,0]=4 8546 B13R1.450 CONC(=O)c1cc(Cl)cc(Cl)c1 Amb13980624 [0,2,0,0,0,0|2,0,0]=4 8547 B13R1.450 CONC(=O)c1cc(F)cc(F)c1 Amb10704854 [0,2,0,0,0,0|2,0,0]=4 8548 B13R1.450 CONC(=O)c1cc(N)cc(Br)c1 Amb27951874 [0,2,0,0,0,0|2,0,0]=4 8549 B13R1.450 CONC(=O)c1cc(N)cc(Cl)c1 Amb27868961 [0,2,0,0,0,0|2,0,0]=4 8550 B13R1.450 CSCC(=O)c1cc(C)cc(C)c1 Amb18324784 [0,2,0,0,0,0|2,0,0]=4 8551 B13R1.450 CSCC(=O)c1cc(C)cc(F)c1 Amb28061359 [0,2,0,0,0,0|2,0,0]=4 8552 B13R1.450 CSCC(=O)c1cc(F)cc(F)c1 Amb27668897 [0,2,0,0,0,0|2,0,0]=4 8553 B13R1.450 C\C=C\C(=O)c1cc(Cl)cc(Cl)c1 Amb27264743 [0,2,0,0,0,0|1,0,1]=4 8554 B13R1.450 C\C=C\C(=O)c1cc(F)cc(Cl)c1 Amb24529390 [0,2,0,0,0,0|1,0,1]=4 8555 B13R1.450 Cc1cc(Br)cc(C(=O)CCBr)c1 Amb27608536 [0,2,0,0,0,0|2,0,0]=4 8556 B13R1.450 Cc1cc(Br)cc(C(=O)CCN)c1 Amb33435982 [0,2,0,0,0,0|2,0,0]=4 8557 B13R1.450 Cc1cc(C)cc(C(=O)CCBr)c1 Amb27225925 [0,2,0,0,0,0|2,0,0]=4 8558 B13R1.450 Cc1cc(C)cc(C(=O)CCCl)c1 Amb27964966 [0,2,0,0,0,0|2,0,0]=4 8559 B13R1.450 Cc1cc(C)cc(C(=O)CCN)c1 Amb26047013 [0,2,0,0,0,0|2,0,0]=4 8560 B13R1.450 Cc1cc(Cl)cc(C(=O)CCBr)c1 Amb25826636 [0,2,0,0,0,0|2,0,0]=4 8561 B13R1.450 Cc1cc(Cl)cc(C(=O)CCCl)c1 Amb25844087 [0,2,0,0,0,0|2,0,0]=4 8562 B13R1.450 Cc1cc(F)cc(C(=O)CCCl)c1 Amb25155376 [0,2,0,0,0,0|2,0,0]=4 8563 B13R1.450 Cc1cc(F)cc(C(=O)CCN)c1 Amb26503241 [0,2,0,0,0,0|2,0,0]=4 8564 B13R1.450 Cc1cc(I)cc(C(=O)CCBr)c1 Amb27202710 [0,2,0,0,0,0|2,0,0]=4 8565 B13R1.450 Cc1cc(I)cc(C(=O)CCCl)c1 Amb27181206 [0,2,0,0,0,0|2,0,0]=4 8566 B13R1.450 Cc1cc(N)cc(C(=O)CCBr)c1 Amb27193403 [0,2,0,0,0,0|2,0,0]=4 8567 B13R1.450 Cc1cc(N)cc(C(=O)CCCl)c1 Amb26445290 [0,2,0,0,0,0|2,0,0]=4 8568 B13R1.450 Cc1cc(O)cc(C(=O)CCBr)c1 Amb26005384 [0,2,0,0,0,0|2,0,0]=4 8569 B13R1.450 Cc1cc(O)cc(C(=O)CCCl)c1 Amb27877088 [0,2,0,0,0,0|2,0,0]=4 8570 B13R1.450 Cc1cc(S)cc(C(=O)CCBr)c1 Amb27644099 [0,2,0,0,0,0|2,0,0]=4 8571 B13R1.450 NCCC(=O)c1cc(Cl)cc(Br)c1 Amb33435151 [0,2,0,0,0,0|2,0,0]=4 8572 B13R1.450 NCCC(=O)c1cc(Cl)cc(Cl)c1 Amb33258733 [0,2,0,0,0,0|2,0,0]=4 8573 B13R1.450 NCCC(=O)c1cc(F)cc(Br)c1 Amb33434964 [0,2,0,0,0,0|2,0,0]=4 8574 B13R1.450 NCCC(=O)c1cc(F)cc(Cl)c1 Amb33256571 [0,2,0,0,0,0|2,0,0]=4 8575 B13R1.450 NCCC(=O)c1cc(F)cc(F)c1 Amb27415022 [0,2,0,0,0,0|2,0,0]=4 8576 B13R1.450 Nc1cc(Br)cc(C(=O)CCBr)c1 Amb26424508 [0,2,0,0,0,0|2,0,0]=4 8577 B13R1.450 Nc1cc(Br)cc(C(=O)CCCl)c1 Amb27192594 [0,2,0,0,0,0|2,0,0]=4 8578 B13R1.450 Nc1cc(Cl)cc(C(=O)CCCl)c1 Amb27613754 [0,2,0,0,0,0|2,0,0]=4 8579 B13R1.450 Nc1cc(I)cc(C(=O)CCBr)c1 Amb27613686 [0,2,0,0,0,0|2,0,0]=4 8580 B13R1.450 O=C(CCBr)c1cc(Br)cc(Br)c1 Amb27876666 [0,2,0,0,0,0|2,0,0]=4 8581 B13R1.450 O=C(CCBr)c1cc(Br)cc(I)c1 Amb26594085 [0,2,0,0,0,0|2,0,0]=4 8582 B13R1.450 O=C(CCBr)c1cc(Cl)cc(Br)c1 Amb27667834 [0,2,0,0,0,0|2,0,0]=4 8583 B13R1.450 O=C(CCBr)c1cc(Cl)cc(Cl)c1 Amb24383012 [0,2,0,0,0,0|2,0,0]=4 8584 B13R1.450 O=C(CCBr)c1cc(Cl)cc(I)c1 Amb27485222 [0,2,0,0,0,0|2,0,0]=4 8585 B13R1.450 O=C(CCBr)c1cc(F)cc(Br)c1 Amb26529015 [0,2,0,0,0,0|2,0,0]=4 8586 B13R1.450 O=C(CCBr)c1cc(F)cc(I)c1 Amb27392136 [0,2,0,0,0,0|2,0,0]=4 8587 B13R1.450 O=C(CCBr)c1cc(F)cc(S)c1 Amb25247661 [0,2,0,0,0,0|2,0,0]=4 8588 B13R1.450 O=C(CCBr)c1cc(O)cc(Br)c1 Amb27646659 [0,2,0,0,0,0|2,0,0]=4 8589 B13R1.450 O=C(CCBr)c1cc(O)cc(F)c1 Amb26393062 [0,2,0,0,0,0|2,0,0]=4 8590 B13R1.450 O=C(CCBr)c1cc(O)cc(I)c1 Amb27608360 [0,2,0,0,0,0|2,0,0]=4 8591 B13R1.450 O=C(CCBr)c1cc(O)cc(O)c1 Amb24566668 [0,2,0,0,0,0|2,0,0]=4 8592 B13R1.450 O=C(CCBr)c1cc(O)cc(S)c1 Amb27624158 [0,2,0,0,0,0|2,0,0]=4 8593 B13R1.450 O=C(CCBr)c1cc(S)cc(Br)c1 Amb26398016 [0,2,0,0,0,0|2,0,0]=4 8594 B13R1.450 O=C(CCBr)c1cc(S)cc(Cl)c1 Amb27623738 [0,2,0,0,0,0|2,0,0]=4 8595 B13R1.450 O=C(CCCl)c1cc(Br)cc(Br)c1 Amb27412521 [0,2,0,0,0,0|2,0,0]=4 8596 B13R1.450 O=C(CCCl)c1cc(Br)cc(I)c1 Amb26583758 [0,2,0,0,0,0|2,0,0]=4 8597 B13R1.450 O=C(CCCl)c1cc(Cl)cc(Br)c1 Amb27986202 [0,2,0,0,0,0|2,0,0]=4 8598 B13R1.450 O=C(CCCl)c1cc(Cl)cc(Cl)c1 Amb24440439 [0,2,0,0,0,0|2,0,0]=4 8599 B13R1.450 O=C(CCCl)c1cc(Cl)cc(I)c1 Amb26849602 [0,2,0,0,0,0|2,0,0]=4 8600 B13R1.450 O=C(CCCl)c1cc(F)cc(Br)c1 Amb25248655 [0,2,0,0,0,0|2,0,0]=4 8601 B13R1.450 O=C(CCCl)c1cc(F)cc(Cl)c1 Amb27608365 [0,2,0,0,0,0|2,0,0]=4 8602 B13R1.450 O=C(CCCl)c1cc(F)cc(F)c1 Amb27772007 [0,2,0,0,0,0|2,0,0]=4 8603 B13R1.450 O=C(CCCl)c1cc(F)cc(I)c1 Amb25729942 [0,2,0,0,0,0|2,0,0]=4 8604 B13R1.450 O=C(CCCl)c1cc(F)cc(S)c1 Amb28196075 [0,2,0,0,0,0|2,0,0]=4 8605 B13R1.450 O=C(CCCl)c1cc(O)cc(Br)c1 Amb26952871 [0,2,0,0,0,0|2,0,0]=4 8606 B13R1.450 O=C(CCCl)c1cc(O)cc(F)c1 Amb26594047 [0,2,0,0,0,0|2,0,0]=4 8607 B13R1.450 O=C(CCCl)c1cc(O)cc(I)c1 Amb26594076 [0,2,0,0,0,0|2,0,0]=4 8608 B13R1.450 O=C(CCCl)c1cc(O)cc(S)c1 Amb27632933 [0,2,0,0,0,0|2,0,0]=4 8609 B13R1.450 O=C(CCCl)c1cc(S)cc(I)c1 Amb27638418 [0,2,0,0,0,0|2,0,0]=4 8610 B13R1.460 C#Cc1cccc(C(=O)CCN)c1 Amb33267711 [0,2,0,0,0,0|2,0,0]=4 8611 B13R1.460 C#Cc1cccc(C(=O)CNC)c1 Amb33267704 [0,2,0,0,0,0|2,0,0]=4 8612 B13R1.460 C#Cc1cccc(C(=O)NCC)c1 Amb33226283 [0,2,0,0,0,0|1,0,0]=3 8613 B13R1.460 C#Cc1cccc(C(=O)NCC)n1 Amb27597203 [0,2,0,0,0,0|2,0,0]=4 8614 B13R1.460 C#Cc1cccc(C(=O)OCC)c1 Amb23412172 [0,2,0,0,0,0|0,0,0]=2 8615 B13R1.460 C#Cc1cccc(C(=O)OCC)n1 Amb21857618 [0,2,0,0,0,0|1,0,0]=3 8616 B13R1.460 C#Cc1cncc(C(=O)NCC)c1 Amb24360604 [0,2,0,0,0,0|2,0,0]=4 8617 B13R1.460 C=C(OCC)c1cccc(C=O)c1 Amb33136085 [0,2,0,0,0,0|1,0,0]=3 8618 B13R1.460 C=C(OCC)c1cccc(CN)c1 Amb33135944 [0,2,0,0,0,0|1,0,0]=3 8619 B13R1.460 C=C(OCC)c1cncc(C=O)c1 Amb33136125 [0,2,0,0,0,0|2,0,0]=4 8620 B13R1.460 C=C(OCC)c1cncc(CN)c1 Amb33135946 [0,2,0,0,0,0|2,0,0]=4 8621 B13R1.460 C=Cc1cccc(C(=O)NCC)c1 Amb33226282 [0,2,0,0,0,0|1,0,0]=3 8622 B13R1.460 C=Cc1cccc(C(=O)OCC)c1 Amb16185424 [0,2,0,0,0,0|0,0,0]=2 8623 B13R1.460 CCCC(=O)c1cccc(OC)c1 Amb17198739 [0,2,0,0,0,0|1,0,0]=3 8624 B13R1.460 CCNC(=N)c1cccc(OC)c1 Amb27451736 [0,2,0,0,0,0|2,0,0]=4 8625 B13R1.460 CCNC(=O)c1cc(CC)ccn1 Amb28051089 [0,2,0,0,0,0|2,0,0]=4 8626 B13R1.460 CCNC(=O)c1cc(CN)ccn1 Amb33229522 [0,2,0,0,0,0|2,0,0]=4 8627 B13R1.460 CCNC(=O)c1cc(OC)ccn1 Amb28051092 [0,2,0,0,0,0|2,0,0]=4 8628 B13R1.460 CCNC(=O)c1cccc(C#N)c1 Amb6268136 [0,2,0,0,0,0|1,0,0]=3 8629 B13R1.460 CCNC(=O)c1cccc(C=O)c1 Amb24066803 [0,2,0,0,0,0|1,0,0]=3 8630 B13R1.460 CCNC(=O)c1cccc(CBr)c1 Amb17328942 [0,2,0,0,0,0|1,0,0]=3 8631 B13R1.460 CCNC(=O)c1cccc(CCl)c1 Amb8846427 [0,2,0,0,0,0|1,0,0]=3 8632 B13R1.460 CCNC(=O)c1cccc(CN)c1 Amb10203503 [0,2,0,0,0,0|1,0,0]=3 8633 B13R1.460 CCNC(=O)c1cccc(CN)c1 Amb1120583 [0,2,0,0,0,0|1,0,0]=3 8634 B13R1.460 CCNC(=O)c1cccc(CO)c1 Amb24066804 [0,2,0,0,0,0|1,0,0]=3 8635 B13R1.460 CCNC(=O)c1cccc(CS)c1 Amb33342940 [0,2,0,0,0,0|1,0,0]=3 8636 B13R1.460 CCNC(=O)c1cccc(NC)c1 Amb19002845 [0,2,0,0,0,0|1,0,0]=3 8637 B13R1.460 CCNC(=O)c1cccc(NN)c1 Amb33342934 [0,2,0,0,0,0|1,0,0]=3 8638 B13R1.460 CCNC(=O)c1cccc(OC)c1 Amb6347881 [0,2,0,0,0,0|1,0,0]=3 8639 B13R1.460 CCNC(=O)c1ccnc(OC)c1 Amb27834867 [0,2,0,0,0,0|2,0,0]=4 8640 B13R1.460 CCNC(=O)c1cncc(C#N)c1 Amb28118424 [0,2,0,0,0,0|2,0,0]=4 8641 B13R1.460 CCNC(=O)c1cncc(CC)c1 Amb28051286 [0,2,0,0,0,0|2,0,0]=4 8642 B13R1.460 CCOC(=N)c1cccc(OC)c1 Amb20673137 [0,2,0,0,0,0|1,0,0]=3 8643 B13R1.460 CCOC(=O)c1cc(C#N)ccn1 Amb6384300 [0,2,0,0,0,0|1,0,0]=3 8644 B13R1.460 CCOC(=O)c1cc(C#N)ncn1 Amb25172451 [0,2,0,0,0,0|2,0,0]=4 8645 B13R1.460 CCOC(=O)c1cc(CBr)ccn1 Amb23401269 [0,2,0,0,0,0|1,0,0]=3 8646 B13R1.460 CCOC(=O)c1cc(CCl)ccn1 Amb23401270 [0,2,0,0,0,0|1,0,0]=3 8647 B13R1.460 CCOC(=O)c1cc(CN)ccn1 Amb33229519 [0,2,0,0,0,0|1,0,0]=3 8648 B13R1.460 CCOC(=O)c1cc(CO)ccn1 Amb21964018 [0,2,0,0,0,0|1,0,0]=3 8649 B13R1.460 CCOC(=O)c1cc(OC)cnn1 Amb33714695 [0,2,0,0,0,0|2,0,0]=4 8650 B13R1.460 CCOC(=O)c1cccc(C#N)c1 Amb9243009 [0,2,0,0,0,0|0,0,0]=2 8651 B13R1.460 CCOC(=O)c1cccc(C#N)n1 Amb18127623 [0,2,0,0,0,0|1,0,0]=3 8652 B13R1.460 CCOC(=O)c1cccc(C=O)c1 Amb10807492 [0,2,0,0,0,0|0,0,0]=2 8653 B13R1.460 CCOC(=O)c1cccc(C=O)n1 Amb19889851 [0,2,0,0,0,0|1,0,0]=3 8654 B13R1.460 CCOC(=O)c1cccc(CBr)c1 Amb22002428 [0,2,0,0,0,0|0,0,0]=2 8655 B13R1.460 CCOC(=O)c1cccc(CBr)n1 Amb6307217 [0,2,0,0,0,0|1,0,0]=3 8656 B13R1.460 CCOC(=O)c1cccc(CC)c1 Amb34911646 [0,2,0,0,0,0|0,0,0]=2 8657 B13R1.460 CCOC(=O)c1cccc(CCl)c1 Amb10071038 [0,2,0,0,0,0|0,0,0]=2 8658 B13R1.460 CCOC(=O)c1cccc(CCl)n1 Amb17205204 [0,2,0,0,0,0|1,0,0]=3 8659 B13R1.460 CCOC(=O)c1cccc(CCl)n1 Amb21857623 [0,2,0,0,0,0|1,0,0]=3 8660 B13R1.460 CCOC(=O)c1cccc(CN)c1 Amb22499039 [0,2,0,0,0,0|0,0,0]=2 8661 B13R1.460 CCOC(=O)c1cccc(CN)n1 Amb22727978 [0,2,0,0,0,0|1,0,0]=3 8662 B13R1.460 CCOC(=O)c1cccc(CO)n1 Amb6308495 [0,2,0,0,0,0|1,0,0]=3 8663 B13R1.460 CCOC(=O)c1cccc(NC)c1 Amb19037540 [0,2,0,0,0,0|0,0,0]=2 8664 B13R1.460 CCOC(=O)c1cccc(NC)c1 Amb31145809 [0,2,0,0,0,0|0,0,0]=2 8665 B13R1.460 CCOC(=O)c1cccc(NC)n1 Amb33748694 [0,2,0,0,0,0|1,0,0]=3 8666 B13R1.460 CCOC(=O)c1cccc(NN)c1 Amb10604175 [0,2,0,0,0,0|0,0,0]=2 8667 B13R1.460 CCOC(=O)c1cccc(NN)c1 Amb2699805 [0,2,0,0,0,0|0,0,0]=2 8668 B13R1.460 CCOC(=O)c1cccc(OC)c1 Amb4302708 [0,2,0,0,0,0|0,0,0]=2 8669 B13R1.460 CCOC(=O)c1cccc([Zn]I)c1 Amb22000407 [0,2,0,0,0,0|0,0,0]=2 8670 B13R1.460 CCOC(=O)c1ccnc(C#N)c1 Amb18127622 [0,2,0,0,0,0|1,0,0]=3 8671 B13R1.460 CCOC(=O)c1ccnc(C=O)c1 Amb21857369 [0,2,0,0,0,0|1,0,0]=3 8672 B13R1.460 CCOC(=O)c1ccnc(CC)c1 Amb32412109 [0,2,0,0,0,0|1,0,0]=3 8673 B13R1.460 CCOC(=O)c1ccnc(CC)n1 Amb32694562 [0,2,0,0,0,0|2,0,0]=4 8674 B13R1.460 CCOC(=O)c1ccnc(CCl)c1 Amb32651481 [0,2,0,0,0,0|1,0,0]=3 8675 B13R1.460 CCOC(=O)c1ccnc(CCl)n1 Amb22276833 [0,2,0,0,0,0|2,0,0]=4 8676 B13R1.460 CCOC(=O)c1ccnc(CF)c1 Amb24053069 [0,2,0,0,0,0|1,0,0]=3 8677 B13R1.460 CCOC(=O)c1ccnc(CN)c1 Amb10808510 [0,2,0,0,0,0|1,0,0]=3 8678 B13R1.460 CCOC(=O)c1ccnc(CN)c1 Amb22490759 [0,2,0,0,0,0|1,0,0]=3 8679 B13R1.460 CCOC(=O)c1ccnc(CO)c1 Amb22490843 [0,2,0,0,0,0|1,0,0]=3 8680 B13R1.460 CCOC(=O)c1ccnc(CO)n1 Amb22304275 [0,2,0,0,0,0|2,0,0]=4 8681 B13R1.460 CCOC(=O)c1ccnc(NC)c1 Amb33747691 [0,2,0,0,0,0|1,0,0]=3 8682 B13R1.460 CCOC(=O)c1ccnc(NC)n1 Amb27762025 [0,2,0,0,0,0|2,0,0]=4 8683 B13R1.460 CCOC(=O)c1ccnc(OC)c1 Amb21962214 [0,2,0,0,0,0|1,0,0]=3 8684 B13R1.460 CCOC(=O)c1ccnc(SC)n1 Amb16233315 [0,2,0,0,0,0|2,0,0]=4 8685 B13R1.460 CCOC(=O)c1cncc(C#N)c1 Amb2612124 [0,2,0,0,0,0|1,0,0]=3 8686 B13R1.460 CCOC(=O)c1cncc(CBr)c1 Amb22276055 [0,2,0,0,0,0|1,0,0]=3 8687 B13R1.460 CCOC(=O)c1cncc(CCl)c1 Amb22276054 [0,2,0,0,0,0|1,0,0]=3 8688 B13R1.460 CCOC(=O)c1cncc(CN)c1 Amb32430539 [0,2,0,0,0,0|1,0,0]=3 8689 B13R1.460 CCOC(=O)c1cncc(CO)c1 Amb22233966 [0,2,0,0,0,0|1,0,0]=3 8690 B13R1.460 CCOC(=O)c1cncc(NN)c1 Amb23559893 [0,2,0,0,0,0|1,0,0]=3 8691 B13R1.460 CCOC(=O)c1cncc(OC)c1 Amb23401209 [0,2,0,0,0,0|1,0,0]=3 8692 B13R1.460 CCOC(=O)c1cnnc(NN)c1 Amb30982934 [0,2,0,0,0,0|2,0,0]=4 8693 B13R1.460 CCOC(=O)c1nccc(NC)n1 Amb33745226 [0,2,0,0,0,0|2,0,0]=4 8694 B13R1.460 CCc1cccc(C(=O)CCN)c1 Amb33358780 [0,2,0,0,0,0|2,0,0]=4 8695 B13R1.460 CCc1cccc(C(=O)CNC)c1 Amb32953387 [0,2,0,0,0,0|2,0,0]=4 8696 B13R1.460 CNCC(=O)c1cccc(C#N)c1 Amb33318842 [0,2,0,0,0,0|2,0,0]=4 8697 B13R1.460 CNCC(=O)c1cccc(OC)c1 Amb17233536 [0,2,0,0,0,0|2,0,0]=4 8698 B13R1.460 CNCC(=O)c1cccc(SC)c1 Amb33144875 [0,2,0,0,0,0|2,0,0]=4 8699 B13R1.460 CONC(=O)c1cccc(C#N)c1 Amb10704497 [0,2,0,0,0,0|2,0,0]=4 8700 B13R1.460 CONC(=O)c1cccc(C=O)c1 Amb24461753 [0,2,0,0,0,0|2,0,0]=4 8701 B13R1.460 CONC(=O)c1cccc(CCl)c1 Amb28205549 [0,2,0,0,0,0|2,0,0]=4 8702 B13R1.460 CONC(=O)c1cccc(CN)c1 Amb27598989 [0,2,0,0,0,0|2,0,0]=4 8703 B13R1.460 COc1cccc(C(=O)CCBr)c1 Amb17437882 [0,2,0,0,0,0|2,0,0]=4 8704 B13R1.460 COc1cccc(C(=O)CCN)c1 Amb18065831 [0,2,0,0,0,0|2,0,0]=4 8705 B13R1.460 COc1cccc(C(=O)CCO)c1 Amb18065908 [0,2,0,0,0,0|2,0,0]=4 8706 B13R1.460 COc1cccc(C(=O)CCS)c1 Amb17402131 [0,2,0,0,0,0|2,0,0]=4 8707 B13R1.460 COc1cccc(C(=O)CSC)c1 Amb18321459 [0,2,0,0,0,0|2,0,0]=4 8708 B13R1.460 COc1cccc(C(=O)NCCl)c1 Amb7807830 [0,2,0,0,0,0|2,0,0]=4 8709 B13R1.460 CSc1cccc(C(=O)CCN)c1 Amb33144876 [0,2,0,0,0,0|2,0,0]=4 8710 B13R1.460 C\C=C\C(=O)c1cccc(CC)c1 Amb27656443 [0,2,0,0,0,0|1,0,1]=4 8711 B13R1.460 N#Cc1cccc(C(=O)CCBr)c1 Amb25681385 [0,2,0,0,0,0|2,0,0]=4 8712 B13R1.460 N#Cc1cccc(C(=O)CCN)c1 Amb33417624 [0,2,0,0,0,0|2,0,0]=4 8713 B13R1.460 [C-]#[N+]c1cccc(C(=O)NCC)c1 Amb33145058 [0,2,0,0,0,0|1,0,0]=3 8714 B13R1.11 C#CC(C)NC(=O)c1cccnc1 Amb27764409 [0,2,0,0,0,0|2,0,0]=4 8715 B13R1.11 C#CC(C)OC(=O)c1ccncn1 Amb27457263 [0,2,0,0,0,0|2,0,0]=4 8716 B13R1.11 C#CC(O)CC(=O)c1ccccc1 Amb27861397 [0,2,0,0,0,0|1,0,1]=4 8717 B13R1.11 C#C[C@@H](C)CC(=O)c1ccccc1 Amb28202138 [0,2,0,0,0,0|1,0,0]=3 8718 B13R1.11 C=C(NC(=O)CC)c1ccccc1 Amb26619762 [0,2,0,0,0,0|2,0,0]=4 8719 B13R1.11 C=CC(C)NC(=O)c1ccccn1 Amb27188415 [0,2,0,0,0,0|2,0,0]=4 8720 B13R1.11 C=C[C@@H](C)NC(=O)c1ccccc1 Amb27799733 [0,2,0,0,0,0|1,0,0]=3 8721 B13R1.11 C=C[C@H](C)NC(=O)c1ccccc1 Amb27408534 [0,2,0,0,0,0|1,0,0]=3 8722 B13R1.11 C=C\C(C)=C/C(=O)c1ccccc1 Amb27256419 [0,2,0,0,0,0|1,0,1]=4 8723 B13R1.11 CC(C#N)CC(=O)c1ccccc1 Amb17334921 [0,2,0,0,0,0|1,0,0]=3 8724 B13R1.11 CC(C#N)CC(=O)c1ccccn1 Amb17133612 [0,2,0,0,0,0|2,0,0]=4 8725 B13R1.11 CC(C#N)CC(=O)c1cccnc1 Amb17133613 [0,2,0,0,0,0|2,0,0]=4 8726 B13R1.11 CC(C#N)CC(=O)c1ccncc1 Amb17133614 [0,2,0,0,0,0|2,0,0]=4 8727 B13R1.11 CC(C#N)NC(=N)c1ccccc1 Amb27949511 [0,2,0,0,0,0|2,0,0]=4 8728 B13R1.11 CC(C#N)NC(=O)c1ccccc1 Amb17400426 [0,2,0,0,0,0|1,0,0]=3 8729 B13R1.11 CC(C#N)NC(=O)c1cccnc1 Amb17400484 [0,2,0,0,0,0|2,0,0]=4 8730 B13R1.11 CC(C#N)OC(=O)c1ccccc1 Amb20668158 [0,2,0,0,0,0|0,0,0]=2 8731 B13R1.11 CC(C#N)OC(=O)c1ccccn1 Amb25160805 [0,2,0,0,0,0|1,0,0]=3 8732 B13R1.11 CC(C#N)OC(=O)c1cccnc1 Amb25936686 [0,2,0,0,0,0|1,0,0]=3 8733 B13R1.11 CC(C#N)OC(=O)c1ccncc1 Amb26017799 [0,2,0,0,0,0|1,0,0]=3 8734 B13R1.11 CC(C#N)OC(=O)c1cncnc1 Amb27457337 [0,2,0,0,0,0|2,0,0]=4 8735 B13R1.11 CC(CBr)NC(=O)c1ccccn1 Amb27833233 [0,2,0,0,0,0|2,0,0]=4 8736 B13R1.11 CC(CBr)NC(=O)c1cccnc1 Amb28207742 [0,2,0,0,0,0|2,0,0]=4 8737 B13R1.11 CC(CCl)NC(=O)c1ccccc1 Amb4026667 [0,2,0,0,0,0|1,0,0]=3 8738 B13R1.11 CC(CCl)\N=C(\Cl)c1ccccc1 Amb27264894 [0,2,0,0,0,0|2,0,0]=4 8739 B13R1.11 CC(CF)NC(=O)c1cccnc1 Amb25167393 [0,2,0,0,0,0|2,0,0]=4 8740 B13R1.11 CC(CN)NC(=O)c1ccccn1 Amb18909097 [0,2,0,0,0,0|2,0,0]=4 8741 B13R1.11 CC(CN)NC(=O)c1cccnc1 Amb18252469 [0,2,0,0,0,0|2,0,0]=4 8742 B13R1.11 CC(CN)NC(=O)c1cccnc1 Amb33743970 [0,2,0,0,0,0|2,0,0]=4 8743 B13R1.11 CC(CN)NC(=O)c1ccncc1 Amb18909096 [0,2,0,0,0,0|2,0,0]=4 8744 B13R1.11 CC(CO)NC(=O)c1ccccc1 Amb4026987 [0,2,0,0,0,0|1,0,0]=3 8745 B13R1.11 CC(CO)NC(=O)c1cccnc1 Amb9275923 [0,2,0,0,0,0|2,0,0]=4 8746 B13R1.11 CC(CO)NC(=O)c1ccncc1 Amb9275935 [0,2,0,0,0,0|2,0,0]=4 8747 B13R1.11 CCC(=O)CC(=O)c1ccccc1 Amb7766301 [0,2,0,0,0,0|1,0,0]=3 8748 B13R1.11 CCC(=O)CC(=O)c1ccccn1 Amb7766277 [0,2,0,0,0,0|2,0,0]=4 8749 B13R1.11 CCC(=O)CC(=O)c1cccnc1 Amb7766279 [0,2,0,0,0,0|2,0,0]=4 8750 B13R1.11 CCC(=O)CC(=O)c1ccncc1 Amb7761964 [0,2,0,0,0,0|2,0,0]=4 8751 B13R1.11 CCC(=O)OC(=O)c1ccccc1 Amb22500123 [0,2,0,0,0,0|0,0,0]=2 8752 B13R1.11 CCC(=O)OC(C)c1ccccc1 Amb6357162 [0,2,0,0,0,0|1,0,1]=4 8753 B13R1.11 CCC(=O)\C=C(/C)c1ccccc1 Amb27802793 [0,2,0,0,0,0|2,0,0]=4 8754 B13R1.11 CCC(=O)\C=C(\N)c1ccccc1 Amb27252260 [0,2,0,0,0,0|2,0,0]=4 8755 B13R1.11 CCC(C)CC(=O)c1ccccn1 Amb6301498 [0,2,0,0,0,0|2,0,0]=4 8756 B13R1.11 CCC(C)NC(=N)c1ccccc1 Amb28254013 [0,2,0,0,0,0|2,0,0]=4 8757 B13R1.11 CCS(=O)\N=C(\C)c1ccccc1 Amb35726570 [0,2,0,0,0,0|1,1,0]=4 8758 B13R1.11 CC[C@@H](C)NC(=O)c1ccccc1 Amb28239508 [0,2,0,0,0,0|1,0,0]=3 8759 B13R1.11 CC[C@H](O)\C=C(\C)c1ccccc1 Amb27255183 [0,2,0,0,0,0|2,0,0]=4 8760 B13R1.11 CC\C(N)=N\C(=O)c1ccccc1 Amb27232979 [0,2,0,0,0,0|1,0,0]=3 8761 B13R1.11 CC\C(N)=N\C(=S)c1ccccc1 Amb27407020 [0,2,0,0,0,0|1,1,0]=4 8762 B13R1.11 CNC(=O)CC(=O)c1ccccc1 Amb24361603 [0,2,0,0,0,0|1,0,1]=4 8763 B13R1.11 CNC(=O)NC(=O)c1ccccc1 Amb28287343 [0,2,0,0,0,0|1,0,1]=4 8764 B13R1.11 CNC(=S)CC(=O)c1ccccc1 Amb27394060 [0,2,0,0,0,0|1,0,1]=4 8765 B13R1.11 CNC(=S)NC(=O)c1ccccc1 Amb1625173 [0,2,0,0,0,0|1,0,1]=4 8766 B13R1.11 CNC(=S)SC(=O)c1ccccc1 Amb28287334 [0,2,0,0,0,0|0,1,1]=4 8767 B13R1.11 CNC(C)\C=C(\C)c1ccccc1 Amb28247465 [0,2,0,0,0,0|2,0,0]=4 8768 B13R1.11 COC(=O)CC(=O)c1ccccc1 Amb10553935 [0,2,0,0,0,0|1,0,1]=4 8769 B13R1.11 COC(=O)OC(=O)c1ccccn1 Amb32658041 [0,2,0,0,0,0|1,0,1]=4 8770 B13R1.11 COC(=S)NC(=O)c1ccccc1 Amb10553666 [0,2,0,0,0,0|1,0,1]=4 8771 B13R1.11 CO\C(C)=C\C(=O)c1ccccc1 Amb25988190 [0,2,0,0,0,0|1,0,1]=4 8772 B13R1.11 CSC(=N)NC(=O)c1ccccc1 Amb3362080 [0,2,0,0,0,0|1,0,1]=4 8773 B13R1.11 C[C@@H](C=O)NC(=O)c1ccccc1 Amb27215399 [0,2,0,0,0,0|1,0,0]=3 8774 B13R1.11 C[C@@H](CO)NC(=O)c1ccccc1 Amb24346934 [0,2,0,0,0,0|1,0,0]=3 8775 B13R1.11 C[C@@H](CO)NC(=O)c1cccnc1 Amb25727732 [0,2,0,0,0,0|2,0,0]=4 8776 B13R1.11 C[C@@H](CO)NC(=O)c1ccncc1 Amb25350029 [0,2,0,0,0,0|2,0,0]=4 8777 B13R1.11 C[C@@H](CO)NC(=S)c1ccccc1 Amb27405275 [0,2,0,0,0,0|1,1,0]=4 8778 B13R1.11 C[C@H](C#N)CC(=O)c1ccccc1 Amb27272758 [0,2,0,0,0,0|1,0,0]=3 8779 B13R1.11 C[C@H](C#N)NC(=O)c1ccncc1 Amb27854120 [0,2,0,0,0,0|2,0,0]=4 8780 B13R1.11 C[C@H](CN)NC(=O)c1cccnc1 Amb27975372 [0,2,0,0,0,0|2,0,0]=4 8781 B13R1.11 C[C@H](CO)NC(=O)c1ccccc1 Amb27174563 [0,2,0,0,0,0|1,0,0]=3 8782 B13R1.11 C[C@H](CO)NC(=O)c1ccncc1 Amb27948308 [0,2,0,0,0,0|2,0,0]=4 8783 B13R1.11 C\C(=C/C(=O)c1ccccc1)CCl Amb28044413 [0,2,0,0,0,0|1,0,1]=4 8784 B13R1.11 C\C(CC(=O)c1ccccc1)=N\O Amb27164559 [0,2,0,0,0,0|1,0,1]=4 8785 B13R1.11 NCC(=O)NC(=O)c1ccccc1 Amb25782184 [0,2,0,0,0,0|1,0,1]=4 8786 B13R1.11 NCC(=S)NC(=O)c1ccccc1 Amb27179084 [0,2,0,0,0,0|1,0,1]=4 8787 B13R1.11 N\C(=C\C(=O)c1ccccc1)CO Amb27493445 [0,2,0,0,0,0|1,0,1]=4 8788 B13R1.11 O=C(CCl)NC(=O)c1ccccc1 Amb6374171 [0,2,0,0,0,0|1,0,1]=4 8789 B13R1.11 O=C(CO)NC(=O)c1ccccc1 Amb1109639 [0,2,0,0,0,0|1,0,1]=4 8790 B13R1.11 O=C(\C=C(/Cl)CCl)c1ccccc1 Amb25780102 [0,2,0,0,0,0|1,0,1]=4 8791 B13R1.24 C#CCCNC(=O)c1cccnc1 Amb28137707 [0,2,0,0,0,0|2,0,0]=4 8792 B13R1.24 C#CCCOC(=O)c1ccncn1 Amb2615456 [0,2,0,0,0,0|2,0,0]=4 8793 B13R1.24 C#CCONC(=O)c1ccccc1 Amb28044729 [0,2,0,0,0,0|0,0,1]=3 8794 B13R1.24 C#CCONC(=O)c1ccncc1 Amb27619572 [0,2,0,0,0,0|1,0,1]=4 8795 B13R1.24 C=CCCCC(=O)c1ccccc1 Amb31307896 [0,2,0,0,0,0|1,0,0]=3 8796 B13R1.24 C=CCSCC(=O)c1ccccc1 Amb32682808 [0,2,0,0,0,0|0,1,1]=4 8797 B13R1.24 CC#CC#CC(=O)c1ccccc1 Amb28282631 [0,2,0,0,0,0|1,0,1]=4 8798 B13R1.24 CC#CCCC(=O)c1ccccc1 Amb18802901 [0,2,0,0,0,0|1,0,0]=3 8799 B13R1.24 CC#CCCC(=O)c1ccccn1 Amb27968864 [0,2,0,0,0,0|2,0,0]=4 8800 B13R1.24 CC#CCOC(=O)c1ccccc1 Amb27662044 [0,2,0,0,0,0|0,0,0]=2 8801 B13R1.24 CC#CCOC(=O)c1cnccn1 Amb27188507 [0,2,0,0,0,0|2,0,0]=4 8802 B13R1.24 CC#CCOC(=O)c1ncccn1 Amb27188812 [0,2,0,0,0,0|2,0,0]=4 8803 B13R1.24 CC(OCCC#N)c1ccccc1 Amb6259524 [0,2,0,0,0,0|1,0,1]=4 8804 B13R1.24 CC(OCCCN)c1ccccc1 Amb9729503 [0,2,0,0,0,0|1,0,1]=4 8805 B13R1.24 CCCCCC(=O)c1ccccc1 Amb6608934 [0,2,0,0,0,0|1,0,0]=3 8806 B13R1.24 CCCCCC(=O)c1ccccn1 Amb6301473 [0,2,0,0,0,0|2,0,0]=4 8807 B13R1.24 CCCCCC(=O)c1cccnc1 Amb18184182 [0,2,0,0,0,0|2,0,0]=4 8808 B13R1.24 CCCCCC(=O)c1ccncc1 Amb18804653 [0,2,0,0,0,0|2,0,0]=4 8809 B13R1.24 CCCCOC(=O)c1ccccc1 Amb6357093 [0,2,0,0,0,0|0,0,0]=2 8810 B13R1.24 CCCCOC(=O)c1ccccn1 Amb4019959 [0,2,0,0,0,0|1,0,0]=3 8811 B13R1.24 CCCCOC(=O)c1cccnc1 Amb17509605 [0,2,0,0,0,0|1,0,0]=3 8812 B13R1.24 CCCN\C=C(/N)c1ccccc1 Amb27165205 [0,2,0,0,0,0|2,0,0]=4 8813 B13R1.24 CCCSCC(=O)c1ccccc1 Amb9668634 [0,2,0,0,0,0|0,1,0]=3 8814 B13R1.24 CCN\C=C/C(=O)c1ccccc1 Amb27415685 [0,2,0,0,0,0|1,0,0]=3 8815 B13R1.24 CCOC#C[C@@H](O)c1ccccc1 Amb28207129 [0,2,0,0,0,0|0,0,2]=4 8816 B13R1.24 CCOC#C[C@H](O)c1ccccc1 Amb28435723 [0,2,0,0,0,0|0,0,2]=4 8817 B13R1.24 CCOCNC(=O)c1ccccc1 Amb24072678 [0,2,0,0,0,0|0,0,0]=2 8818 B13R1.24 CCO\C=C\C(=O)c1ccccc1 Amb33291556 [0,2,0,0,0,0|0,0,0]=2 8819 B13R1.24 CCO\C=C\C(=O)c1ccccn1 Amb33355208 [0,2,0,0,0,0|1,0,0]=3 8820 B13R1.24 CCO\C=C\C(=O)c1cccnc1 Amb33355207 [0,2,0,0,0,0|1,0,0]=3 8821 B13R1.24 CCO\C=C\C(=O)c1ccncc1 Amb33355206 [0,2,0,0,0,0|1,0,0]=3 8822 B13R1.24 CCO\C=C\C(=O)c1ccncn1 Amb33355631 [0,2,0,0,0,0|2,0,0]=4 8823 B13R1.24 CCO\C=C\C(=O)c1cnccn1 Amb33355209 [0,2,0,0,0,0|2,0,0]=4 8824 B13R1.24 CCSCCC(=O)c1ccccc1 Amb32683148 [0,2,0,0,0,0|0,1,0]=3 8825 B13R1.24 CNCCNC(=O)c1ccccc1 Amb19028050 [0,2,0,0,0,0|1,0,0]=3 8826 B13R1.24 CSCCCC(=O)c1ccccc1 Amb18321257 [0,2,0,0,0,0|1,0,0]=3 8827 B13R1.24 CSCCOC(=O)c1cccnc1 Amb24081199 [0,2,0,0,0,0|1,0,0]=3 8828 B13R1.24 C\C(=C/CCCN)c1ccccc1 Amb18065585 [0,2,0,0,0,0|2,0,0]=4 8829 B13R1.24 N#CCCCC(=O)c1ccccc1 Amb4376113 [0,2,0,0,0,0|1,0,0]=3 8830 B13R1.24 N#CCCNC(=O)c1ccccc1 Amb17400429 [0,2,0,0,0,0|1,0,0]=3 8831 B13R1.24 N#CCCNC(=O)c1cccnc1 Amb17400486 [0,2,0,0,0,0|2,0,0]=4 8832 B13R1.24 N#CCCNC(=O)c1ccncc1 Amb10573746 [0,2,0,0,0,0|2,0,0]=4 8833 B13R1.24 N#CCCOC(=O)c1ccccc1 Amb28556109 [0,2,0,0,0,0|0,0,0]=2 8834 B13R1.24 N#CCC\N=C(\N)c1ccccc1 Amb25815391 [0,2,0,0,0,0|2,0,0]=4 8835 B13R1.24 N#CC\N=C\C(=O)c1ccccc1 Amb27432585 [0,2,0,0,0,0|1,0,1]=4 8836 B13R1.24 NCCCNC(=O)c1ccccc1 Amb33506255 [0,2,0,0,0,0|1,0,0]=3 8837 B13R1.24 NCCCNC(=O)c1ccccc1 Amb6281166 [0,2,0,0,0,0|1,0,0]=3 8838 B13R1.24 NCCCNC(=O)c1ccccn1 Amb2153284 [0,2,0,0,0,0|2,0,0]=4 8839 B13R1.24 NCCCNC(=O)c1cccnc1 Amb6263995 [0,2,0,0,0,0|2,0,0]=4 8840 B13R1.24 NCCOCC(=O)c1ccccc1 Amb18111539 [0,2,0,0,0,0|0,0,0]=2 8841 B13R1.24 NCCONC(=O)c1ccccc1 Amb24096446 [0,2,0,0,0,0|0,0,0]=2 8842 B13R1.24 NOCCNC(=O)c1ccccc1 Amb17138954 [0,2,0,0,0,0|1,0,0]=3 8843 B13R1.24 NOCCNC(=O)c1cccnc1 Amb17139001 [0,2,0,0,0,0|2,0,0]=4 8844 B13R1.24 O=C(C#CCCO)c1ccccc1 Amb27954135 [0,2,0,0,0,0|1,0,0]=3 8845 B13R1.24 O=C(CCCCCl)c1ccccc1 Amb6301784 [0,2,0,0,0,0|1,0,0]=3 8846 B13R1.24 O=C(CSCCO)c1ccccc1 Amb4165982 [0,2,0,0,0,0|0,1,0]=3 8847 B13R1.24 O=C(NCCCCl)c1ccccc1 Amb3887000 [0,2,0,0,0,0|1,0,0]=3 8848 B13R1.24 O=C(NCCCCl)c1cccnc1 Amb2125791 [0,2,0,0,0,0|2,0,0]=4 8849 B13R1.24 O=C(NCCCO)c1ccccc1 Amb9243498 [0,2,0,0,0,0|1,0,0]=3 8850 B13R1.24 O=C(NCCCO)c1cccnc1 Amb4285241 [0,2,0,0,0,0|2,0,0]=4 8851 B13R1.24 O=C(NCCCO)c1ccncc1 Amb3467240 [0,2,0,0,0,0|2,0,0]=4 8852 B13R1.24 O=C(N\N=C\CCl)c1ccccc1 Amb1104998 [0,2,0,0,0,0|1,0,1]=4 8853 B13R1.24 O=C(OCCCCl)c1ccccc1 Amb24099970 [0,2,0,0,0,0|0,0,0]=2 8854 B13R1.24 O=CCCNC(=O)c1ccccc1 Amb17102177 [0,2,0,0,0,0|1,0,0]=3 8855 B13R1.24 O=CCCNC(=O)c1cccnc1 Amb17102219 [0,2,0,0,0,0|2,0,0]=4 8856 B13R1.45 C=C(Br)CNC(=O)c1ccccc1 Amb14063723 [0,2,0,0,0,0|1,0,1]=4 8857 B13R1.45 C=C(C)CNC(=N)c1ccccc1 Amb27166001 [0,2,0,0,0,0|2,0,0]=4 8858 B13R1.45 C=C(C)CNC(=O)c1ccccn1 Amb28119591 [0,2,0,0,0,0|2,0,0]=4 8859 B13R1.45 C=C(C)CNC(=S)c1ccccc1 Amb27831279 [0,2,0,0,0,0|1,1,0]=4 8860 B13R1.45 C=C(COC(C)=O)c1ccccc1 Amb17778927 [0,2,0,0,0,0|1,0,1]=4 8861 B13R1.45 C=C(Cl)CCC(=O)c1ccccc1 Amb17595128 [0,2,0,0,0,0|1,0,1]=4 8862 B13R1.45 CC(=O)CCC(=O)c1ccccc1 Amb6357807 [0,2,0,0,0,0|1,0,0]=3 8863 B13R1.45 CC(=O)CCC(=O)c1ccccn1 Amb6301488 [0,2,0,0,0,0|2,0,0]=4 8864 B13R1.45 CC(=O)CCC(=O)c1cccnc1 Amb9472228 [0,2,0,0,0,0|2,0,0]=4 8865 B13R1.45 CC(=O)CCC(=O)c1ccncc1 Amb9472251 [0,2,0,0,0,0|2,0,0]=4 8866 B13R1.45 CC(=O)CNC(=O)c1ccccc1 Amb9836069 [0,2,0,0,0,0|1,0,0]=3 8867 B13R1.45 CC(=O)COC(=O)c1ccccc1 Amb22497327 [0,2,0,0,0,0|0,0,0]=2 8868 B13R1.45 CC(=O)C\C=C(/C)c1ccccc1 Amb27169026 [0,2,0,0,0,0|2,0,0]=4 8869 B13R1.45 CC(=O)NCC(=O)c1ccccc1 Amb17335159 [0,2,0,0,0,0|1,0,1]=4 8870 B13R1.45 CC(=O)OCC(=O)c1ccccc1 Amb4017907 [0,2,0,0,0,0|0,0,1]=3 8871 B13R1.45 CC(=O)ONC(=O)c1ccccn1 Amb24745497 [0,2,0,0,0,0|1,0,1]=4 8872 B13R1.45 CC(=O)ONC(=O)c1cccnc1 Amb25924033 [0,2,0,0,0,0|1,0,1]=4 8873 B13R1.45 CC(=O)ONC(=O)c1ccncc1 Amb25160710 [0,2,0,0,0,0|1,0,1]=4 8874 B13R1.45 CC(=O)O\C=C(/C)c1ccccc1 Amb17778975 [0,2,0,0,0,0|1,0,1]=4 8875 B13R1.45 CC(=O)O\C=C(\C)c1ccccc1 Amb25290986 [0,2,0,0,0,0|1,0,1]=4 8876 B13R1.45 CC(=S)SCC(=O)c1ccccc1 Amb24309338 [0,2,0,0,0,0|0,1,1]=4 8877 B13R1.45 CC(C)=C=CC(=O)c1ccccc1 Amb28197507 [0,2,0,0,0,0|1,0,1]=4 8878 B13R1.45 CC(C)=NNC(=O)c1ccccc1 Amb1652225 [0,2,0,0,0,0|1,0,1]=4 8879 B13R1.45 CC(C)=NOC(=O)c1ccccc1 Amb22733229 [0,2,0,0,0,0|0,0,1]=3 8880 B13R1.45 CC(C)CCC(=O)c1ccccc1 Amb3940666 [0,2,0,0,0,0|1,0,0]=3 8881 B13R1.45 CC(C)CCC(=O)c1ccccn1 Amb6301499 [0,2,0,0,0,0|2,0,0]=4 8882 B13R1.45 CC(C)CCC(=O)c1cccnc1 Amb17233267 [0,2,0,0,0,0|2,0,0]=4 8883 B13R1.45 CC(C)CNC(=N)c1ccccc1 Amb23447122 [0,2,0,0,0,0|2,0,0]=4 8884 B13R1.45 CC(C)CNC(=N)c1ccccc1 Amb32663656 [0,2,0,0,0,0|2,0,0]=4 8885 B13R1.45 CC(C)CNC(=O)c1ccccc1 Amb2703716 [0,2,0,0,0,0|1,0,0]=3 8886 B13R1.45 CC(C)CNC(=O)c1ccccn1 Amb8344418 [0,2,0,0,0,0|2,0,0]=4 8887 B13R1.45 CC(C)CNC(=O)c1cccnc1 Amb6347269 [0,2,0,0,0,0|2,0,0]=4 8888 B13R1.45 CC(C)CNC(=S)c1ccccc1 Amb10553418 [0,2,0,0,0,0|1,1,0]=4 8889 B13R1.45 CC(C)COC(=O)c1ccccc1 Amb6357326 [0,2,0,0,0,0|0,0,0]=2 8890 B13R1.45 CC(C)COC(=O)c1ccncc1 Amb17509537 [0,2,0,0,0,0|1,0,0]=3 8891 B13R1.45 CC(C)C\N=C(\Cl)c1ccccc1 Amb28048149 [0,2,0,0,0,0|2,0,0]=4 8892 B13R1.45 CC(C)NCC(=O)c1ccccc1 Amb6357665 [0,2,0,0,0,0|1,0,0]=3 8893 B13R1.45 CC(C)NNC(=O)c1ccccc1 Amb8484604 [0,2,0,0,0,0|1,0,0]=3 8894 B13R1.45 CC(C)NNC(=O)c1ccccn1 Amb27760379 [0,2,0,0,0,0|2,0,0]=4 8895 B13R1.45 CC(C)NNC(=O)c1ccncc1 Amb22728324 [0,2,0,0,0,0|2,0,0]=4 8896 B13R1.45 CC(C)NNC(=O)c1ccncc1 Amb2612372 [0,2,0,0,0,0|2,0,0]=4 8897 B13R1.45 CC(C)OC[C@@H](N)c1ccccc1 Amb17061653 [0,2,0,0,0,0|1,0,1]=4 8898 B13R1.45 CC(C)ONC(=O)c1ccncn1 Amb28199345 [0,2,0,0,0,0|2,0,0]=4 8899 B13R1.45 CC(C)ONC(=O)c1ccnnc1 Amb27434115 [0,2,0,0,0,0|2,0,0]=4 8900 B13R1.45 CC(C)ONC(=O)c1cncnc1 Amb28253543 [0,2,0,0,0,0|2,0,0]=4 8901 B13R1.45 CC(C)O\N=C(/N)c1ccccc1 Amb18862929 [0,2,0,0,0,0|1,0,0]=3 8902 B13R1.45 CC(C)O\N=C(/N)c1ccccn1 Amb18224638 [0,2,0,0,0,0|2,0,0]=4 8903 B13R1.45 CC(C)O\N=C(/N)c1cccnc1 Amb18224639 [0,2,0,0,0,0|2,0,0]=4 8904 B13R1.45 CC(C)O\N=C(/N)c1ccncc1 Amb18224640 [0,2,0,0,0,0|2,0,0]=4 8905 B13R1.45 CC(C)SCC(=O)c1ccccc1 Amb19051955 [0,2,0,0,0,0|0,1,0]=3 8906 B13R1.45 CC(Cl)CNC(=O)c1ccccc1 Amb27983667 [0,2,0,0,0,0|1,0,0]=3 8907 B13R1.45 CC(Cl)CNC(=O)c1ccncc1 Amb27590984 [0,2,0,0,0,0|2,0,0]=4 8908 B13R1.45 CC(F)\C=C\C(=O)c1ccccc1 Amb26556366 [0,2,0,0,0,0|1,0,0]=3 8909 B13R1.45 CC(O)C#CC(=O)c1ccccc1 Amb28351381 [0,2,0,0,0,0|1,0,0]=3 8910 B13R1.45 CC(O)CNC(=O)c1ccccc1 Amb9244613 [0,2,0,0,0,0|1,0,0]=3 8911 B13R1.45 CC(O)CNC(=O)c1cccnc1 Amb20624855 [0,2,0,0,0,0|2,0,0]=4 8912 B13R1.45 CC(O)CNC(=O)c1cccnc1 Amb9246552 [0,2,0,0,0,0|2,0,0]=4 8913 B13R1.45 CC(O)CNC(=S)c1ccccc1 Amb27795710 [0,2,0,0,0,0|1,1,0]=4 8914 B13R1.45 CN(C)CCC(=O)c1ccccc1 Amb1106335 [0,2,0,0,0,0|1,0,0]=3 8915 B13R1.45 CN(C)CCC(=O)c1ccccc1 Amb1197569 [0,2,0,0,0,0|1,0,0]=3 8916 B13R1.45 CN(C)CCC(=O)c1ccccc1 Amb4421073 [0,2,0,0,0,0|1,0,0]=3 8917 B13R1.45 CN(C)CCC(=O)c1ccccn1 Amb24119362 [0,2,0,0,0,0|2,0,0]=4 8918 B13R1.45 CN(C)CCC(=O)c1cccnc1 Amb32680342 [0,2,0,0,0,0|2,0,0]=4 8919 B13R1.45 CN(C)CCC(=O)c1ccncc1 Amb24119350 [0,2,0,0,0,0|2,0,0]=4 8920 B13R1.45 CN(C)CNC(=O)c1ccccc1 Amb10565604 [0,2,0,0,0,0|1,0,0]=3 8921 B13R1.45 CN(C)C\C=C(/N)c1ccccc1 Amb27180265 [0,2,0,0,0,0|2,0,0]=4 8922 B13R1.45 CN(C)C\C=C(\N)c1ccccc1 Amb28051772 [0,2,0,0,0,0|2,0,0]=4 8923 B13R1.45 CN(C)\C=C/C(=O)c1ccccc1 Amb9769748 [0,2,0,0,0,0|1,0,1]=4 8924 B13R1.45 CN(C)\C=C\C(=O)c1ccccc1 Amb2384234 [0,2,0,0,0,0|1,0,1]=4 8925 B13R1.45 CN(C)\C=N\C(=O)c1ccccc1 Amb16231122 [0,2,0,0,0,0|1,0,1]=4 8926 B13R1.45 C[C@@H](F)C#CC(=O)c1ccccc1 Amb27948609 [0,2,0,0,0,0|1,0,0]=3 8927 B13R1.45 C[C@@H](O)CNC(=O)c1ccccc1 Amb27427140 [0,2,0,0,0,0|1,0,0]=3 8928 B13R1.45 C[C@@H](O)CNC(=O)c1ccccn1 Amb28289979 [0,2,0,0,0,0|2,0,0]=4 8929 B13R1.45 C[C@@H](O)CNC(=O)c1cccnc1 Amb27586972 [0,2,0,0,0,0|2,0,0]=4 8930 B13R1.45 C[C@H](O)C#CC(=O)c1ccccc1 Amb27772530 [0,2,0,0,0,0|1,0,0]=3 8931 B13R1.45 C[C@H](O)CNC(=O)c1ccccc1 Amb27446628 [0,2,0,0,0,0|1,0,0]=3 8932 B13R1.45 C[C@H](O)CNC(=O)c1ccncc1 Amb27812527 [0,2,0,0,0,0|2,0,0]=4 8933 B13R1.45 C[C@H](O)\C=C\C(=O)c1ccccc1 Amb27409583 [0,2,0,0,0,0|1,0,0]=3 8934 B13R1.45 C\C(=C\NC(C)C)c1ccccc1 Amb28247065 [0,2,0,0,0,0|2,0,0]=4 8935 B13R1.45 NC(=O)CCC(=O)c1ccccc1 Amb17233256 [0,2,0,0,0,0|1,0,1]=4 8936 B13R1.45 NC(=O)CNC(=O)c1ccccc1 Amb2761003 [0,2,0,0,0,0|1,0,1]=4 8937 B13R1.45 NC(=S)CNC(=O)c1ccccc1 Amb1678248 [0,2,0,0,0,0|1,0,1]=4 8938 B13R1.45 NC(=S)COC(=O)c1ccccc1 Amb8386798 [0,2,0,0,0,0|0,0,1]=3 8939 B13R1.45 O=C(CC[N+](=O)[O-])c1ccccc1 Amb16231607 [0,2,0,0,0,0|2,0,0]=4 8940 B13R1.45 O=C(Cl)COC(=O)c1ccccc1 Amb32643994 [0,2,0,0,0,0|0,0,1]=3 8941 B13R1.45 O=C(Cl)OCC(=O)c1ccccc1 Amb33297274 [0,2,0,0,0,0|1,0,1]=4 8942 B13R1.45 O=C(F)CNC(=O)c1ccccc1 Amb27815208 [0,2,0,0,0,0|1,0,1]=4 8943 B13R1.45 O=C(NCB(O)O)c1ccccc1 Amb8392101 [0,2,0,0,0,0|2,0,0]=4 8944 B13R1.45 O=C(NCC(Cl)Cl)c1ccccn1 Amb27973689 [0,2,0,0,0,0|2,0,0]=4 8945 B13R1.45 O=C(NCC(Cl)Cl)c1cccnc1 Amb27953818 [0,2,0,0,0,0|2,0,0]=4 8946 B13R1.45 O=C(NCC(F)F)c1ccccn1 Amb27771577 [0,2,0,0,0,0|2,0,0]=4 8947 B13R1.45 O=C(NCC(F)F)c1cccnc1 Amb28182852 [0,2,0,0,0,0|2,0,0]=4 8948 B13R1.45 O=C(NCS(=O)O)c1ccccc1 Amb27631286 [0,2,0,0,0,0|2,0,0]=4 8949 B13R1.45 O=C(O)CCC(=O)c1ccccc1 Amb1224638 [0,2,0,0,0,0|1,0,1]=4 8950 B13R1.45 O=C(O)CNC(=O)c1ccccc1 Amb1006961 [0,2,0,0,0,0|1,0,1]=4 8951 B13R1.45 O=C(O)COC(=O)c1ccccc1 Amb17594607 [0,2,0,0,0,0|0,0,1]=3 8952 B13R1.45 O=C(O)COC(=O)c1cccnc1 Amb1966283 [0,2,0,0,0,0|1,0,1]=4 8953 B13R1.122 C#CCOS(=O)(=O)c1ccccc1 Amb10807517 [0,2,0,0,0,0|1,0,1]=4 8954 B13R1.122 CC(C)(OCCN)c1ccccc1 Amb10790060 [0,2,0,0,0,0|1,0,1]=4 8955 B13R1.122 CCCNS(=O)(=O)c1ccccc1 Amb6599904 [0,2,0,0,0,0|2,0,0]=4 8956 B13R1.122 CCCOC(C)(C)c1ccccc1 Amb24079810 [0,2,0,0,0,0|1,0,1]=4 8957 B13R1.122 CCCOS(=O)(=O)c1ccccc1 Amb22056098 [0,2,0,0,0,0|1,0,0]=3 8958 B13R1.122 CNCCS(=O)(=O)c1ccccc1 Amb3940948 [0,2,0,0,0,0|2,0,0]=4 8959 B13R1.122 NCCCS(=O)(=O)c1ccccc1 Amb10068882 [0,2,0,0,0,0|2,0,0]=4 8960 B13R1.122 NCCCS(=O)(=O)c1ccccc1 Amb5743058 [0,2,0,0,0,0|2,0,0]=4 8961 B13R1.122 NCCNS(=O)(=O)c1ccccc1 Amb6446295 [0,2,0,0,0,0|2,0,0]=4 8962 B13R1.122 NCCNS(=O)(=O)c1ccccc1 Amb6892269 [0,2,0,0,0,0|2,0,0]=4 8963 B13R1.122 NCCOC(F)(F)c1ccccc1 Amb33082539 [0,2,0,0,0,0|1,0,1]=4 8964 B13R1.122 NCCOS(=O)(=O)c1ccccc1 Amb18107652 [0,2,0,0,0,0|1,0,0]=3 8965 B13R1.122 O=S(=O)(CCCBr)c1ccccc1 Amb33527222 [0,2,0,0,0,0|2,0,0]=4 8966 B13R1.122 O=S(=O)(CCCCl)c1ccccc1 Amb1127097 [0,2,0,0,0,0|2,0,0]=4 8967 B13R1.122 O=S(=O)(CCCO)c1ccccc1 Amb17106257 [0,2,0,0,0,0|2,0,0]=4 8968 B13R1.122 O=S(=O)(NCCBr)c1ccccc1 Amb4311487 [0,2,0,0,0,0|2,0,0]=4 8969 B13R1.122 O=S(=O)(NCCCl)c1ccccc1 Amb6334929 [0,2,0,0,0,0|2,0,0]=4 8970 B13R1.122 O=S(=O)(NCCO)c1ccccc1 Amb2661162 [0,2,0,0,0,0|2,0,0]=4 8971 B13R1.122 O=S(=O)(OCCO)c1ccccc1 Amb24082570 [0,2,0,0,0,0|1,0,0]=3 8972 B13R1.674 C#CCCC(=O)c1ccccc1I Amb28044523 [0,2,0,0,0,0|1,0,1]=4 8973 B13R1.674 C#CCNC(=O)c1ccccc1Br Amb6258400 [0,2,0,0,0,0|1,0,1]=4 8974 B13R1.674 C#CCNC(=O)c1ccccc1C Amb8336326 [0,2,0,0,0,0|1,0,1]=4 8975 B13R1.674 C#CCNC(=O)c1ccccc1Cl Amb8337700 [0,2,0,0,0,0|1,0,1]=4 8976 B13R1.674 C#CCNC(=O)c1ccccc1F Amb10672065 [0,2,0,0,0,0|1,0,1]=4 8977 B13R1.674 C#CCNC(=O)c1ccccc1N Amb10609189 [0,2,0,0,0,0|1,0,1]=4 8978 B13R1.674 C#CCNC(=O)c1ccccc1N Amb1216613 [0,2,0,0,0,0|1,0,1]=4 8979 B13R1.674 C#CCNC(=O)c1ccccc1O Amb6671238 [0,2,0,0,0,0|1,0,1]=4 8980 B13R1.674 C#CCOC(=O)c1cccc[n+]1[O-] Amb28189932 [0,2,0,0,0,0|1,0,1]=4 8981 B13R1.674 C#CCOC(=O)c1ccccc1F Amb27207353 [0,2,0,0,0,0|0,0,1]=3 8982 B13R1.674 C#CCOC(=O)c1ccccc1O Amb18266739 [0,2,0,0,0,0|0,0,1]=3 8983 B13R1.674 C#CCOC(=O)c1cccnc1Cl Amb27762241 [0,2,0,0,0,0|1,0,1]=4 8984 B13R1.674 C#CCOC(=O)c1cccnc1F Amb28344787 [0,2,0,0,0,0|1,0,1]=4 8985 B13R1.674 C#CCOC(=O)c1cccnc1N Amb28458047 [0,2,0,0,0,0|1,0,1]=4 8986 B13R1.674 C#CCOC(=O)c1cccnc1O Amb28182651 [0,2,0,0,0,0|1,0,1]=4 8987 B13R1.674 C#CCOC(=O)c1ccncc1I Amb27455975 [0,2,0,0,0,0|1,0,1]=4 8988 B13R1.674 C#CCOC(=O)c1ncccc1N Amb28189037 [0,2,0,0,0,0|1,0,1]=4 8989 B13R1.674 C=C(NCCC)c1ccccc1O Amb27481665 [0,2,0,0,0,0|2,0,0]=4 8990 B13R1.674 C=CCNC(=O)c1ccccc1Br Amb2552442 [0,2,0,0,0,0|1,0,1]=4 8991 B13R1.674 C=CCNC(=O)c1ccccc1C Amb6395799 [0,2,0,0,0,0|1,0,1]=4 8992 B13R1.674 C=CCNC(=O)c1ccccc1Cl Amb2434805 [0,2,0,0,0,0|1,0,1]=4 8993 B13R1.674 C=CCNC(=O)c1ccccc1N Amb1105964 [0,2,0,0,0,0|1,0,1]=4 8994 B13R1.674 C=CCNC(=O)c1ccccc1O Amb6360481 [0,2,0,0,0,0|1,0,1]=4 8995 B13R1.674 C=CCOC(=O)c1ccccc1O Amb17594533 [0,2,0,0,0,0|0,0,1]=3 8996 B13R1.674 CC#CCC(=O)c1ccccc1Br Amb28313078 [0,2,0,0,0,0|1,0,1]=4 8997 B13R1.674 CC#CCC(=O)c1ccccc1C Amb18183693 [0,2,0,0,0,0|1,0,1]=4 8998 B13R1.674 CCCCC(=O)c1ccccc1C Amb8391610 [0,2,0,0,0,0|1,0,0]=3 8999 B13R1.674 CCCCC(=O)c1ccccc1Cl Amb17198752 [0,2,0,0,0,0|1,0,0]=3 9000 B13R1.674 CCCCC(=O)c1ccccc1F Amb17198741 [0,2,0,0,0,0|1,0,0]=3 9001 B13R1.674 CCCCC(=O)c1ccccc1O Amb17621754 [0,2,0,0,0,0|1,0,0]=3 9002 B13R1.674 CCCCC(=O)c1ncccc1C Amb18184185 [0,2,0,0,0,0|2,0,0]=4 9003 B13R1.674 CCCNC(=N)c1ccccc1Cl Amb28069894 [0,2,0,0,0,0|2,0,0]=4 9004 B13R1.674 CCCNC(=O)C1=CC=CNC1=S Amb25317174 [0,2,0,0,0,0|2,0,0]=4 9005 B13R1.674 CCCNC(=O)C1=CNC=CC1=O Amb27397987 [0,2,0,0,0,0|2,0,0]=4 9006 B13R1.674 CCCNC(=O)c1ccccc1Br Amb6347208 [0,2,0,0,0,0|1,0,0]=3 9007 B13R1.674 CCCNC(=O)c1ccccc1C Amb3360258 [0,2,0,0,0,0|1,0,0]=3 9008 B13R1.674 CCCNC(=O)c1ccccc1F Amb3357857 [0,2,0,0,0,0|1,0,0]=3 9009 B13R1.674 CCCNC(=O)c1ccccc1I Amb6381553 [0,2,0,0,0,0|1,0,0]=3 9010 B13R1.674 CCCNC(=O)c1ccccc1N Amb6342878 [0,2,0,0,0,0|1,0,0]=3 9011 B13R1.674 CCCNC(=O)c1ccccc1O Amb3939503 [0,2,0,0,0,0|1,0,0]=3 9012 B13R1.674 CCCNC(=O)c1ccccc1S Amb26006940 [0,2,0,0,0,0|1,0,0]=3 9013 B13R1.674 CCCNC(=O)c1cccnc1Cl Amb6537146 [0,2,0,0,0,0|2,0,0]=4 9014 B13R1.674 CCCNC(=O)c1cccnc1N Amb18986230 [0,2,0,0,0,0|2,0,0]=4 9015 B13R1.674 CCCNC(=O)c1cccnc1O Amb28051274 [0,2,0,0,0,0|2,0,0]=4 9016 B13R1.674 CCCNC(=O)c1ccncc1C Amb27188756 [0,2,0,0,0,0|2,0,0]=4 9017 B13R1.674 CCCNC(=O)c1ccncc1N Amb27448958 [0,2,0,0,0,0|2,0,0]=4 9018 B13R1.674 CCCNC(=O)c1cnccc1C Amb27598384 [0,2,0,0,0,0|2,0,0]=4 9019 B13R1.674 CCCNC(=O)c1cnccc1N Amb27608967 [0,2,0,0,0,0|2,0,0]=4 9020 B13R1.674 CCCNC(=O)c1ncccc1C Amb28366009 [0,2,0,0,0,0|2,0,0]=4 9021 B13R1.674 CCCNC(=O)c1ncccc1N Amb27589295 [0,2,0,0,0,0|2,0,0]=4 9022 B13R1.674 CCCNC(=S)c1ccccc1N Amb26478422 [0,2,0,0,0,0|1,1,0]=4 9023 B13R1.674 CCCOC(=O)c1ccccc1Cl Amb9242862 [0,2,0,0,0,0|0,0,0]=2 9024 B13R1.674 CCCOC(=O)c1ccccc1N Amb8873709 [0,2,0,0,0,0|0,0,0]=2 9025 B13R1.674 CCC\N=C(\C)c1ccccc1O Amb4020297 [0,2,0,0,0,0|2,0,0]=4 9026 B13R1.674 CCONC(=O)c1cccc[n+]1[O-] Amb27842023 [0,2,0,0,0,0|1,0,0]=3 9027 B13R1.674 CCONC(=O)c1ccccc1C Amb10704492 [0,2,0,0,0,0|0,0,0]=2 9028 B13R1.674 CCONC(=O)c1cccnc1N Amb35671699 [0,2,0,0,0,0|1,0,0]=3 9029 B13R1.674 CCONC(=O)c1cccnc1O Amb28127478 [0,2,0,0,0,0|1,0,0]=3 9030 B13R1.674 CCONC(=O)c1ccncc1C Amb28348979 [0,2,0,0,0,0|1,0,0]=3 9031 B13R1.674 CCONC(=O)c1ccncc1I Amb27771232 [0,2,0,0,0,0|1,0,0]=3 9032 B13R1.674 CCONC(=O)c1ncccc1C Amb27249669 [0,2,0,0,0,0|1,0,0]=3 9033 B13R1.674 CCONC(=O)c1nccnc1N Amb10706855 [0,2,0,0,0,0|2,0,0]=4 9034 B13R1.674 CCO\C=C(/C)c1ccccc1N Amb18127957 [0,2,0,0,0,0|1,0,0]=3 9035 B13R1.674 CCO\N=C(/C)c1ccccc1N Amb27165165 [0,2,0,0,0,0|1,0,0]=3 9036 B13R1.674 CCO\N=C(/N)c1ccccc1Br Amb18227820 [0,2,0,0,0,0|1,0,0]=3 9037 B13R1.674 CCO\N=C(/N)c1ccccc1C Amb18224606 [0,2,0,0,0,0|1,0,0]=3 9038 B13R1.674 CCO\N=C(/N)c1ccccc1Cl Amb18864184 [0,2,0,0,0,0|1,0,0]=3 9039 B13R1.674 CCO\N=C(/N)c1ccccc1F Amb18224738 [0,2,0,0,0,0|1,0,0]=3 9040 B13R1.674 CCO\N=C(\C)c1ccccc1Br Amb27458441 [0,2,0,0,0,0|1,0,0]=3 9041 B13R1.674 CCO\N=C(\C)c1ccccc1C Amb27458442 [0,2,0,0,0,0|1,0,0]=3 9042 B13R1.674 CCO\N=C(\C)c1ccccc1Cl Amb27771239 [0,2,0,0,0,0|1,0,0]=3 9043 B13R1.674 CCO\N=C(\C)c1ccccc1F Amb27982553 [0,2,0,0,0,0|1,0,0]=3 9044 B13R1.674 CCO\N=C(\C)c1ccccc1I Amb27774672 [0,2,0,0,0,0|1,0,0]=3 9045 B13R1.674 CCO\N=C(\Cl)c1ccccc1O Amb27440500 [0,2,0,0,0,0|1,0,0]=3 9046 B13R1.674 CCSCC(=O)c1ccccc1Br Amb9668521 [0,2,0,0,0,0|0,1,0]=3 9047 B13R1.674 CCSCC(=O)c1ccccc1C Amb9668580 [0,2,0,0,0,0|0,1,0]=3 9048 B13R1.674 CCSCC(=O)c1ccccc1Cl Amb9668549 [0,2,0,0,0,0|0,1,0]=3 9049 B13R1.674 CCSCC(=O)c1ccccc1F Amb9668526 [0,2,0,0,0,0|0,1,0]=3 9050 B13R1.674 CC\C=C\C(=O)c1ccccc1C Amb27164404 [0,2,0,0,0,0|1,0,0]=3 9051 B13R1.674 CC\C=C\C(=O)c1cccnc1N Amb27979475 [0,2,0,0,0,0|2,0,0]=4 9052 B13R1.674 CC\C=C\C(=O)c1ccncc1F Amb27446889 [0,2,0,0,0,0|2,0,0]=4 9053 B13R1.674 CC\C=C\C(=O)c1cnccc1C Amb27866938 [0,2,0,0,0,0|2,0,0]=4 9054 B13R1.674 CNC\C=C(/C)c1ccccc1C Amb31174808 [0,2,0,0,0,0|2,0,0]=4 9055 B13R1.674 CNC\C=C(/C)c1ccccc1F Amb31174821 [0,2,0,0,0,0|2,0,0]=4 9056 B13R1.674 CNC\C=C(\C)c1ccccc1C Amb27610365 [0,2,0,0,0,0|2,0,0]=4 9057 B13R1.674 COCCC(=O)c1ccccc1C Amb17233410 [0,2,0,0,0,0|1,0,0]=3 9058 B13R1.674 COCCC(=O)c1ccccc1Cl Amb17236834 [0,2,0,0,0,0|1,0,0]=3 9059 B13R1.674 COCCC(=O)c1ccccc1F Amb17233887 [0,2,0,0,0,0|1,0,0]=3 9060 B13R1.674 COCOC(=O)c1ccccc1O Amb17594676 [0,2,0,0,0,0|0,0,0]=2 9061 B13R1.674 CO\C=N/C(=O)c1ccccc1O Amb25073282 [0,2,0,0,0,0|1,0,1]=4 9062 B13R1.674 C\C(=C/CCBr)c1ccccc1C Amb17254615 [0,2,0,0,0,0|2,0,0]=4 9063 B13R1.674 C\C(=C/CCBr)c1ccccc1Cl Amb17267356 [0,2,0,0,0,0|2,0,0]=4 9064 B13R1.674 C\C(=C/CCBr)c1ccccc1F Amb17256418 [0,2,0,0,0,0|2,0,0]=4 9065 B13R1.674 C\C(=C/CCCl)c1ccccc1C Amb17236142 [0,2,0,0,0,0|2,0,0]=4 9066 B13R1.674 C\C(=C/CCCl)c1ccccc1Cl Amb17241875 [0,2,0,0,0,0|2,0,0]=4 9067 B13R1.674 C\C(=C/CCCl)c1ccccc1F Amb17236849 [0,2,0,0,0,0|2,0,0]=4 9068 B13R1.674 C\C(=C/CCN)c1ccccc1C Amb17233141 [0,2,0,0,0,0|2,0,0]=4 9069 B13R1.674 C\C(=C/CCN)c1ccccc1Cl Amb17236339 [0,2,0,0,0,0|2,0,0]=4 9070 B13R1.674 C\C(=C/CCN)c1ccccc1F Amb17233550 [0,2,0,0,0,0|2,0,0]=4 9071 B13R1.674 C\C(=C\CCBr)c1ccccc1F Amb27258536 [0,2,0,0,0,0|2,0,0]=4 9072 B13R1.674 C\C(=C\CCCl)c1ccccc1Cl Amb27810632 [0,2,0,0,0,0|2,0,0]=4 9073 B13R1.674 C\C(=C\CCN)c1ccccc1Br Amb27229642 [0,2,0,0,0,0|2,0,0]=4 9074 B13R1.674 C\C(=C\CCN)c1ccccc1F Amb27187328 [0,2,0,0,0,0|2,0,0]=4 9075 B13R1.674 C\C(=N/CCO)c1ccccc1O Amb4018348 [0,2,0,0,0,0|2,0,0]=4 9076 B13R1.674 C\C(=N\CCO)c1ccccc1O Amb28133853 [0,2,0,0,0,0|2,0,0]=4 9077 B13R1.674 C\C(=N\CCS)c1ccccc1O Amb27440046 [0,2,0,0,0,0|2,0,0]=4 9078 B13R1.674 C\C=C/NC(=O)c1ccccc1N Amb28054801 [0,2,0,0,0,0|1,0,1]=4 9079 B13R1.674 C\C=C\NC(=O)c1ccccc1N Amb18127743 [0,2,0,0,0,0|1,0,1]=4 9080 B13R1.674 C\C=N\NC(=O)c1ccccc1N Amb25873847 [0,2,0,0,0,0|1,0,1]=4 9081 B13R1.674 Cc1ccccc1C(=O)CCC#N Amb9472183 [0,2,0,0,0,0|1,0,1]=4 9082 B13R1.674 Cc1ccccc1C(=O)CCCN Amb18824969 [0,2,0,0,0,0|1,0,0]=3 9083 B13R1.674 Cc1ccccc1C(=O)NCC#N Amb6347234 [0,2,0,0,0,0|1,0,1]=4 9084 B13R1.674 Cc1ccccc1C(=O)NCC=O Amb17102066 [0,2,0,0,0,0|1,0,1]=4 9085 B13R1.674 Cc1ccccc1C(=O)NCCCl Amb17103199 [0,2,0,0,0,0|1,0,0]=3 9086 B13R1.674 Cc1ccccc1C(=O)NCCN Amb1131147 [0,2,0,0,0,0|1,0,0]=3 9087 B13R1.674 Cc1ccccc1C(=O)NCCN Amb29838291 [0,2,0,0,0,0|1,0,0]=3 9088 B13R1.674 Cc1ccccc1C(=O)NCCO Amb9242306 [0,2,0,0,0,0|1,0,0]=3 9089 B13R1.674 Cc1ccccc1C(=O)OCC#N Amb27774639 [0,2,0,0,0,0|0,0,1]=3 9090 B13R1.674 Cc1ccccc1C(=O)\C=C\CO Amb24582580 [0,2,0,0,0,0|1,0,1]=4 9091 B13R1.674 Cc1cccnc1C(=O)NCCO Amb18184701 [0,2,0,0,0,0|2,0,0]=4 9092 B13R1.674 Cc1ccncc1C(=O)CCCN Amb18195255 [0,2,0,0,0,0|2,0,0]=4 9093 B13R1.674 Cc1ccncc1C(=O)NCCBr Amb30009521 [0,2,0,0,0,0|2,0,0]=4 9094 B13R1.674 Cc1ccncc1C(=O)NCCCl Amb30009505 [0,2,0,0,0,0|2,0,0]=4 9095 B13R1.674 Cc1ccncc1C(=O)NCCI Amb30009522 [0,2,0,0,0,0|2,0,0]=4 9096 B13R1.674 Cc1ccncc1C(=O)NCCN Amb35700461 [0,2,0,0,0,0|2,0,0]=4 9097 B13R1.674 Cc1ccncc1C(=O)NCCO Amb27599187 [0,2,0,0,0,0|2,0,0]=4 9098 B13R1.674 Cc1ccncc1C(=O)OCC#N Amb27748922 [0,2,0,0,0,0|1,0,1]=4 9099 B13R1.674 Cc1cnccc1C(=O)NCCBr Amb27188755 [0,2,0,0,0,0|2,0,0]=4 9100 B13R1.674 Cc1ncccc1C(=O)NCCCl Amb27816059 [0,2,0,0,0,0|2,0,0]=4 9101 B13R1.674 Cc1ncccc1C(=O)NCCF Amb28292074 [0,2,0,0,0,0|2,0,0]=4 9102 B13R1.674 Cc1ncccc1C(=O)NCCO Amb27816060 [0,2,0,0,0,0|2,0,0]=4 9103 B13R1.674 Cc1ncccc1C(=O)OCC#N Amb27485855 [0,2,0,0,0,0|1,0,1]=4 9104 B13R1.674 N#CCCC(=O)c1ccccc1Br Amb3941058 [0,2,0,0,0,0|1,0,1]=4 9105 B13R1.674 N#CCCC(=O)c1ccccc1F Amb6301819 [0,2,0,0,0,0|1,0,1]=4 9106 B13R1.674 N#CCCC(=O)c1ccccc1I Amb6301853 [0,2,0,0,0,0|1,0,1]=4 9107 B13R1.674 N#CCNC(=O)c1ccccc1Br Amb6347207 [0,2,0,0,0,0|1,0,1]=4 9108 B13R1.674 N#CCNC(=O)c1ccccc1F Amb6347609 [0,2,0,0,0,0|1,0,1]=4 9109 B13R1.674 N#CCNC(=O)c1ccccc1I Amb6845408 [0,2,0,0,0,0|1,0,1]=4 9110 B13R1.674 N#CCNC(=O)c1ccccc1N Amb18952089 [0,2,0,0,0,0|1,0,1]=4 9111 B13R1.674 N#CCOC(=O)c1ccccc1F Amb27765755 [0,2,0,0,0,0|0,0,1]=3 9112 B13R1.674 N#CCOC(=O)c1ccccc1O Amb26626093 [0,2,0,0,0,0|0,0,1]=3 9113 B13R1.674 N#CCOC(=O)c1cccnc1O Amb28281416 [0,2,0,0,0,0|1,0,1]=4 9114 B13R1.674 N#CCOC(=O)c1ccncc1F Amb27455943 [0,2,0,0,0,0|1,0,1]=4 9115 B13R1.674 N#CCOC(=O)c1ncccc1Br Amb27836437 [0,2,0,0,0,0|1,0,1]=4 9116 B13R1.674 N#CCOC(=O)c1ncccc1O Amb27196668 [0,2,0,0,0,0|1,0,1]=4 9117 B13R1.674 N=C(NCCO)c1ccccc1O Amb18648357 [0,2,0,0,0,0|2,0,0]=4 9118 B13R1.674 NCCCC(=O)c1ccccc1Br Amb18727416 [0,2,0,0,0,0|1,0,0]=3 9119 B13R1.674 NCCNC(=O)C1=CNC=CC1=O Amb27794123 [0,2,0,0,0,0|2,0,0]=4 9120 B13R1.674 NCCNC(=O)c1cccc[n+]1[O-] Amb27946644 [0,2,0,0,0,0|2,0,0]=4 9121 B13R1.674 NCCNC(=O)c1ccccc1Br Amb1127696 [0,2,0,0,0,0|1,0,0]=3 9122 B13R1.674 NCCNC(=O)c1ccccc1Cl Amb1132937 [0,2,0,0,0,0|1,0,0]=3 9123 B13R1.674 NCCNC(=O)c1ccccc1Cl Amb7969416 [0,2,0,0,0,0|1,0,0]=3 9124 B13R1.674 NCCNC(=O)c1ccccc1F Amb1135711 [0,2,0,0,0,0|1,0,0]=3 9125 B13R1.674 NCCNC(=O)c1ccccc1F Amb20668348 [0,2,0,0,0,0|1,0,0]=3 9126 B13R1.674 NCCNC(=O)c1ccccc1N Amb18290739 [0,2,0,0,0,0|1,0,0]=3 9127 B13R1.674 NCCNC(=O)c1ccccc1O Amb1133042 [0,2,0,0,0,0|1,0,0]=3 9128 B13R1.674 NCCNC(=O)c1ccccc1O Amb32413934 [0,2,0,0,0,0|1,0,0]=3 9129 B13R1.674 NCCNC(=O)c1cccnc1Br Amb27836963 [0,2,0,0,0,0|2,0,0]=4 9130 B13R1.674 NCCNC(=O)c1cccnc1N Amb35671698 [0,2,0,0,0,0|2,0,0]=4 9131 B13R1.674 NCCNC(=O)c1ccncc1F Amb27163368 [0,2,0,0,0,0|2,0,0]=4 9132 B13R1.674 NCCNC(=O)c1ncccc1Br Amb28322440 [0,2,0,0,0,0|2,0,0]=4 9133 B13R1.674 NCCNC(=O)c1ncccc1O Amb18970478 [0,2,0,0,0,0|2,0,0]=4 9134 B13R1.674 NCCNC(=O)c1ncccc1O Amb19515043 [0,2,0,0,0,0|2,0,0]=4 9135 B13R1.674 Nc1ccccc1C(=O)NCCO Amb19373399 [0,2,0,0,0,0|1,0,0]=3 9136 B13R1.674 Nc1ccccc1C(=O)NCCO Amb8997250 [0,2,0,0,0,0|1,0,0]=3 9137 B13R1.674 Nc1ccncc1C(=O)NCCO Amb32641728 [0,2,0,0,0,0|2,0,0]=4 9138 B13R1.674 Nc1ncccc1C(=O)NCCO Amb18271382 [0,2,0,0,0,0|2,0,0]=4 9139 B13R1.674 O=C(CCCCl)c1ccccc1F Amb6301805 [0,2,0,0,0,0|1,0,0]=3 9140 B13R1.674 O=C(NCCBr)c1ccccc1Br Amb4311475 [0,2,0,0,0,0|1,0,0]=3 9141 B13R1.674 O=C(NCCBr)c1ccccc1F Amb4311497 [0,2,0,0,0,0|1,0,0]=3 9142 B13R1.674 O=C(NCCBr)c1ccccc1I Amb4311513 [0,2,0,0,0,0|1,0,0]=3 9143 B13R1.674 O=C(NCCBr)c1ncccc1Br Amb27259976 [0,2,0,0,0,0|2,0,0]=4 9144 B13R1.674 O=C(NCCCl)c1ccccc1Br Amb17103204 [0,2,0,0,0,0|1,0,0]=3 9145 B13R1.674 O=C(NCCCl)c1ccccc1Cl Amb17103232 [0,2,0,0,0,0|1,0,0]=3 9146 B13R1.674 O=C(NCCCl)c1ccccc1F Amb17103201 [0,2,0,0,0,0|1,0,0]=3 9147 B13R1.674 O=C(NCCCl)c1ccncc1Cl Amb27464115 [0,2,0,0,0,0|2,0,0]=4 9148 B13R1.674 O=C(NCCCl)c1ccncc1F Amb27870610 [0,2,0,0,0,0|2,0,0]=4 9149 B13R1.674 O=C(NCCF)c1cccc[n+]1[O-] Amb27632683 [0,2,0,0,0,0|2,0,0]=4 9150 B13R1.674 O=C(NCCF)c1ccccc1O Amb27391560 [0,2,0,0,0,0|1,0,0]=3 9151 B13R1.674 O=C(NCCF)c1ccccc1S Amb28290162 [0,2,0,0,0,0|1,0,0]=3 9152 B13R1.674 O=C(NCCF)c1cccnc1O Amb28204828 [0,2,0,0,0,0|2,0,0]=4 9153 B13R1.674 O=C(NCCF)c1ncccc1O Amb27188064 [0,2,0,0,0,0|2,0,0]=4 9154 B13R1.674 O=C(NCCI)c1ccccc1Cl Amb28370226 [0,2,0,0,0,0|1,0,0]=3 9155 B13R1.674 O=C(NCCI)c1ccncc1Br Amb28458667 [0,2,0,0,0,0|2,0,0]=4 9156 B13R1.674 O=C(NCCI)c1ncccc1Br Amb28317101 [0,2,0,0,0,0|2,0,0]=4 9157 B13R1.674 O=C(NCCO)C1=CC=CNC1=S Amb26014394 [0,2,0,0,0,0|2,0,0]=4 9158 B13R1.674 O=C(NCCO)c1ccccc1Br Amb5798984 [0,2,0,0,0,0|1,0,0]=3 9159 B13R1.674 O=C(NCCO)c1ccccc1Cl Amb5798846 [0,2,0,0,0,0|1,0,0]=3 9160 B13R1.674 O=C(NCCO)c1ccccc1F Amb5798810 [0,2,0,0,0,0|1,0,0]=3 9161 B13R1.674 O=C(NCCO)c1ccccc1O Amb2445040 [0,2,0,0,0,0|1,0,0]=3 9162 B13R1.674 O=C(NCCO)c1cccnc1Br Amb27451445 [0,2,0,0,0,0|2,0,0]=4 9163 B13R1.674 O=C(NCCO)c1cccnc1Cl Amb18333894 [0,2,0,0,0,0|2,0,0]=4 9164 B13R1.674 O=C(NCCO)c1ccncc1Br Amb27388323 [0,2,0,0,0,0|2,0,0]=4 9165 B13R1.674 O=C(NCCO)c1cnccc1Cl Amb27656212 [0,2,0,0,0,0|2,0,0]=4 9166 B13R1.674 O=C(NCCO)c1ncccc1Br Amb28240656 [0,2,0,0,0,0|2,0,0]=4 9167 B13R1.674 O=C(NCCO)c1ncccc1Cl Amb28142788 [0,2,0,0,0,0|2,0,0]=4 9168 B13R1.674 O=C(NCCO)c1ncccc1O Amb18181544 [0,2,0,0,0,0|2,0,0]=4 9169 B13R1.674 O=C(NCCS)c1ccccc1F Amb28256530 [0,2,0,0,0,0|1,0,0]=3 9170 B13R1.674 O=CCNC(=O)c1ccccc1Br Amb17102072 [0,2,0,0,0,0|1,0,1]=4 9171 B13R1.674 O=CCNC(=O)c1ccccc1Cl Amb17102103 [0,2,0,0,0,0|1,0,1]=4 9172 B13R1.674 O=CCNC(=O)c1ccccc1F Amb17102069 [0,2,0,0,0,0|1,0,1]=4 9173 B13R1.86 CCC(C#N)C(=O)c1ccccc1 Amb9535906 [0,2,0,0,0,0|1,0,0]=3 9174 B13R1.86 CCC(C#N)C(=O)c1ccncc1 Amb9535902 [0,2,0,0,0,0|2,0,0]=4 9175 B13R1.86 CCC(NC)C(=O)c1ccccc1 Amb17621424 [0,2,0,0,0,0|1,0,0]=3 9176 B13R1.86 CCC(SC)C(=O)c1ccccc1 Amb19051956 [0,2,0,0,0,0|1,0,0]=3 9177 B13R1.86 CCN(CC)C(=O)c1ccccc1 Amb6357778 [0,2,0,0,0,0|1,0,0]=3 9178 B13R1.86 CCN(CC)C(=O)c1cccnc1 Amb3583996 [0,2,0,0,0,0|2,0,0]=4 9179 B13R1.86 CC\C(=C/O)C(=O)c1ccccc1 Amb27954228 [0,2,0,0,0,0|1,0,0]=3 9180 B13R1.86 CC\C(=C\Cl)C(=O)c1ccccc1 Amb27974273 [0,2,0,0,0,0|1,0,0]=3 9181 B13R1.86 CC\C(C#N)=C(\N)c1ccccc1 Amb27607709 [0,2,0,0,0,0|2,0,0]=4 9182 B13R1.86 CC\C(C=O)=C(\C)c1ccccc1 Amb18127296 [0,2,0,0,0,0|2,0,0]=4 9183 B13R1.86 CC\C(C=O)=C(\Cl)c1ccccc1 Amb26030945 [0,2,0,0,0,0|2,0,0]=4 9184 B13R1.86 CC\C(CCl)=C(/Cl)c1ccccc1 Amb27258991 [0,2,0,0,0,0|2,0,0]=4 9185 B13R1.86 CC\C(CCl)=C(\Cl)c1ccccc1 Amb28248077 [0,2,0,0,0,0|2,0,0]=4 9186 B13R1.86 CC\C(CO)=C(\C)c1ccccc1 Amb27588987 [0,2,0,0,0,0|2,0,0]=4 9187 B13R1.86 COC(OC)C(=O)c1ccccc1 Amb10559989 [0,2,0,0,0,0|2,0,0]=4 9188 B13R1.86 COP(OC)C(=O)c1ccccc1 Amb17778335 [0,2,0,0,0,0|2,0,0]=4 9189 B13R1.86 C\C=C(/C#N)C(=O)c1ccccc1 Amb28144127 [0,2,0,0,0,0|1,0,1]=4 9190 B13R1.86 C\C=C(/CC)C(=O)c1ccccc1 Amb28322030 [0,2,0,0,0,0|1,0,0]=3 9191 B13R1.86 O=C(c1ccccc1)C(CCl)CCl Amb8477439 [0,2,0,0,0,0|2,0,0]=4 9192 B13R1.152 C=C(C(C)=O)C(=O)c1ccccc1 Amb17594383 [0,2,0,0,0,0|1,0,1]=4 9193 B13R1.152 C=C(C(C)O)S(=O)c1ccccc1 Amb25873903 [0,2,0,0,0,0|2,0,0]=4 9194 B13R1.152 C=C(c1ccccc1)C(Cl)C(C)C Amb27657545 [0,2,0,0,0,0|2,0,0]=4 9195 B13R1.152 CC(=O)C(Br)C(=O)c1ccccc1 Amb28317159 [0,2,0,0,0,0|1,0,1]=4 9196 B13R1.152 CC(=O)C(C)C(=O)c1ccccc1 Amb8394273 [0,2,0,0,0,0|1,0,1]=4 9197 B13R1.152 CC(C(=O)c1ccccc1)N(C)C Amb8384821 [0,2,0,0,0,0|2,0,0]=4 9198 B13R1.152 CC(C)=C(C)C(=O)c1ccccc1 Amb27972933 [0,2,0,0,0,0|1,0,1]=4 9199 B13R1.152 CC(C)C(=O)C(=O)c1ccccc1 Amb17400548 [0,2,0,0,0,0|1,0,0]=3 9200 B13R1.152 CC(C)C(=O)C(=O)c1ccccn1 Amb25099022 [0,2,0,0,0,0|2,0,0]=4 9201 B13R1.152 CC(C)C(=O)C(=O)c1cccnc1 Amb25689081 [0,2,0,0,0,0|2,0,0]=4 9202 B13R1.152 CC(C)C(=O)C(=O)c1ccncc1 Amb27610355 [0,2,0,0,0,0|2,0,0]=4 9203 B13R1.152 CC(C)C(Br)C(=O)c1ccccc1 Amb6673866 [0,2,0,0,0,0|1,0,0]=3 9204 B13R1.152 CC(C)C(Cl)C(=O)c1ccccc1 Amb18330794 [0,2,0,0,0,0|1,0,0]=3 9205 B13R1.152 CC(C)C(N)C(=O)c1ccccc1 Amb17138821 [0,2,0,0,0,0|1,0,0]=3 9206 B13R1.152 CC(C)C(N)C(=O)c1ccccc1 Amb33483462 [0,2,0,0,0,0|1,0,0]=3 9207 B13R1.152 CC(C)C(N)C(=O)c1ccccn1 Amb18065775 [0,2,0,0,0,0|2,0,0]=4 9208 B13R1.152 CC(C)C(N)C(=O)c1cccnc1 Amb18065778 [0,2,0,0,0,0|2,0,0]=4 9209 B13R1.152 CC(C)C(N)C(=O)c1ccncc1 Amb18065781 [0,2,0,0,0,0|2,0,0]=4 9210 B13R1.152 CC(C)N(C)C(=O)c1ccncc1 Amb28349998 [0,2,0,0,0,0|2,0,0]=4 9211 B13R1.152 CC(C)N(N)C(=O)c1ccccc1 Amb33191564 [0,2,0,0,0,0|1,0,0]=3 9212 B13R1.152 CC(C)[C@@H](N)C(=O)c1ccccc1 Amb27870709 [0,2,0,0,0,0|1,0,0]=3 9213 B13R1.152 CC(C)[C@@H](N)C(=O)c1cccnc1 Amb35623960 [0,2,0,0,0,0|2,0,0]=4 9214 B13R1.152 CC(C)[C@@H](O)C(=O)c1ccccc1 Amb27164716 [0,2,0,0,0,0|1,0,0]=3 9215 B13R1.152 CC(C)[C@H](N)C(=O)c1ccccn1 Amb27402523 [0,2,0,0,0,0|2,0,0]=4 9216 B13R1.152 CC(C)[C@H](N)C(=O)c1cccnc1 Amb35737381 [0,2,0,0,0,0|2,0,0]=4 9217 B13R1.152 CC(Cl)N(C)C(=O)c1ccccc1 Amb27179100 [0,2,0,0,0,0|1,0,0]=3 9218 B13R1.152 CC(N)C(C)C(=O)c1cccnc1 Amb27593692 [0,2,0,0,0,0|2,0,0]=4 9219 B13R1.152 CC(O)C(F)C(=O)c1ccccc1 Amb26065386 [0,2,0,0,0,0|1,0,0]=3 9220 B13R1.152 CN(C)C(=O)C(=O)c1ccccc1 Amb17335166 [0,2,0,0,0,0|2,0,0]=4 9221 B13R1.152 CN(C)C(O)C(=O)c1ccccc1 Amb27599342 [0,2,0,0,0,0|2,0,0]=4 9222 B13R1.152 CN(O)C(=O)C(=O)c1ccccc1 Amb28074665 [0,2,0,0,0,0|2,0,0]=4 9223 B13R1.152 C[C@@H](C(=O)c1ccccc1)N(C)C Amb27861373 [0,2,0,0,0,0|2,0,0]=4 9224 B13R1.152 C[C@@H](C(=O)c1ccccc1)[C@@H](C)Cl Amb28325714 [0,2,0,0,0,0|1,0,0]=3 9225 B13R1.152 C[C@@H](O)[C@@H](C)C(=O)c1ccccc1 Amb28321937 [0,2,0,0,0,0|1,0,0]=3 9226 B13R1.152 C[C@@H]([C@@H](C)O)S(=O)c1ccccc1 Amb28401032 [0,2,0,0,0,0|2,0,0]=4 9227 B13R1.152 C[C@H](Cl)[C@@H](C)C(=O)c1ccccc1 Amb27179287 [0,2,0,0,0,0|1,0,0]=3 9228 B13R1.152 C[C@H](O)[C@H](C)S(=O)c1ccccc1 Amb27660942 [0,2,0,0,0,0|2,0,0]=4 9229 B13R1.152 C\C(=C(/C)C(C)O)c1ccccc1 Amb28292145 [0,2,0,0,0,0|2,0,0]=4 9230 B13R1.152 C\C(F)=C(\F)C(=O)c1ccccc1 Amb27803645 [0,2,0,0,0,0|1,0,1]=4 9231 B13R1.152 C\C(N)=C(\C)C(=O)c1ccccc1 Amb28071213 [0,2,0,0,0,0|1,0,1]=4 9232 B13R1.152 C\C(O)=C(\C)C(=O)c1ccccc1 Amb24378973 [0,2,0,0,0,0|1,0,1]=4 9233 B13R1.263 CC(O)(CCl)C(=O)c1ccccc1 Amb27833829 [0,2,0,0,0,0|2,0,0]=4 9234 B13R1.263 CCC(C)(C)C(=O)c1ccccc1 Amb2780702 [0,2,0,0,0,0|1,0,0]=3 9235 B13R1.263 CCC(C)(C)C(=O)c1cccnc1 Amb27599926 [0,2,0,0,0,0|2,0,0]=4 9236 B13R1.263 CCC(C)(O)C(=O)c1cccnc1 Amb28242415 [0,2,0,0,0,0|2,0,0]=4 9237 B13R1.263 CCC(F)(F)C(=O)c1ccccc1 Amb26438039 [0,2,0,0,0,0|1,0,0]=3 9238 B13R1.263 CCC(F)(F)C(=O)c1cccnc1 Amb35629278 [0,2,0,0,0,0|2,0,0]=4 9239 B13R1.263 CC[C@@](C)(N)C(=O)c1ccccc1 Amb27471762 [0,2,0,0,0,0|1,0,0]=3 9240 B13R1.263 COP(C)(=O)C(=O)c1ccccc1 Amb28324474 [0,2,0,0,0,0|2,0,0]=4 9241 B13R1.263 CSC(F)(F)C(=O)c1ccccc1 Amb26483009 [0,2,0,0,0,0|2,0,0]=4 9242 B13R1.263 O=C(c1ccccc1)C(Cl)(Cl)CO Amb24531904 [0,2,0,0,0,0|2,0,0]=4 9243 B13R1.696 CC(CN)C(=O)c1ccccc1F Amb27391342 [0,2,0,0,0,0|2,0,0]=4 9244 B13R1.696 CCC(=O)C(=O)c1ccccc1C Amb25936681 [0,2,0,0,0,0|1,0,0]=3 9245 B13R1.696 CCC(=O)C(=O)c1ccccc1F Amb27143508 [0,2,0,0,0,0|1,0,0]=3 9246 B13R1.696 CCC(C)C(=O)c1ccccc1F Amb27171035 [0,2,0,0,0,0|1,0,0]=3 9247 B13R1.696 CCC(C)C(=O)c1cccnc1C Amb27608028 [0,2,0,0,0,0|2,0,0]=4 9248 B13R1.696 CCC(C)C(=O)c1cccnc1N Amb27624295 [0,2,0,0,0,0|2,0,0]=4 9249 B13R1.696 CCC(C)C(=O)c1ccncc1Cl Amb28317064 [0,2,0,0,0,0|2,0,0]=4 9250 B13R1.696 CCC(C)C(=O)c1ncccc1F Amb28349390 [0,2,0,0,0,0|2,0,0]=4 9251 B13R1.696 CCC(C)C(=O)c1ncccc1N Amb27760185 [0,2,0,0,0,0|2,0,0]=4 9252 B13R1.696 CCC(C)S(=O)c1ccccc1F Amb27412800 [0,2,0,0,0,0|2,0,0]=4 9253 B13R1.696 CCC(C)S(=O)c1ccccc1N Amb18977317 [0,2,0,0,0,0|2,0,0]=4 9254 B13R1.696 CCC(Cl)C(=O)c1ccccc1O Amb27179280 [0,2,0,0,0,0|1,0,0]=3 9255 B13R1.696 CCC(N)C(=O)c1ccccc1Br Amb18156123 [0,2,0,0,0,0|1,0,0]=3 9256 B13R1.696 CCC(N)C(=O)c1ccccc1C Amb18195821 [0,2,0,0,0,0|1,0,0]=3 9257 B13R1.696 CCC(N)C(=O)c1cccnc1N Amb27468384 [0,2,0,0,0,0|2,0,0]=4 9258 B13R1.696 CCC(N)C(=O)c1cnccc1C Amb27190855 [0,2,0,0,0,0|2,0,0]=4 9259 B13R1.696 CCC(O)C(=O)c1ccccc1C Amb27947071 [0,2,0,0,0,0|1,0,0]=3 9260 B13R1.696 CCC(O)C(=O)c1ccncc1F Amb27882532 [0,2,0,0,0,0|2,0,0]=4 9261 B13R1.696 CCC(O)C(=O)c1cnccc1C Amb27639144 [0,2,0,0,0,0|2,0,0]=4 9262 B13R1.696 CCN(C)C(=O)C1=CC=CNC1=S Amb28051156 [0,2,0,0,0,0|2,0,0]=4 9263 B13R1.696 CCN(C)C(=O)c1cccc[n+]1[O-] Amb27833505 [0,2,0,0,0,0|2,0,0]=4 9264 B13R1.696 CCN(C)C(=O)c1ccccc1F Amb18179018 [0,2,0,0,0,0|1,0,0]=3 9265 B13R1.696 CCN(C)C(=O)c1ccccc1I Amb27865893 [0,2,0,0,0,0|1,0,0]=3 9266 B13R1.696 CCN(C)C(=O)c1ccccc1N Amb8890266 [0,2,0,0,0,0|1,0,0]=3 9267 B13R1.696 CCN(C)C(=O)c1cccnc1C Amb27456347 [0,2,0,0,0,0|2,0,0]=4 9268 B13R1.696 CCN(C)C(=O)c1cccnc1Cl Amb8873972 [0,2,0,0,0,0|2,0,0]=4 9269 B13R1.696 CCN(C)C(=O)c1cccnc1F Amb27659611 [0,2,0,0,0,0|2,0,0]=4 9270 B13R1.696 CCN(C)C(=O)c1ccncc1F Amb27207506 [0,2,0,0,0,0|2,0,0]=4 9271 B13R1.696 CCN(C)C(=O)c1ccncc1I Amb28051176 [0,2,0,0,0,0|2,0,0]=4 9272 B13R1.696 CCN(C)C(=O)c1ccncc1N Amb27808279 [0,2,0,0,0,0|2,0,0]=4 9273 B13R1.696 CCN(C)C(=O)c1ccncc1O Amb27609191 [0,2,0,0,0,0|2,0,0]=4 9274 B13R1.696 CCN(C)C(=O)c1cnccc1C Amb27764667 [0,2,0,0,0,0|2,0,0]=4 9275 B13R1.696 CCN(C)C(=O)c1cnccc1N Amb27608857 [0,2,0,0,0,0|2,0,0]=4 9276 B13R1.696 CCN(C)C(=O)c1ncccc1Br Amb28316794 [0,2,0,0,0,0|2,0,0]=4 9277 B13R1.696 CCN(C)C(=O)c1ncccc1C Amb28070437 [0,2,0,0,0,0|2,0,0]=4 9278 B13R1.696 CCN(O)C(=O)c1ccccc1F Amb28247781 [0,2,0,0,0,0|1,0,0]=3 9279 B13R1.696 CCN(O)C(=O)c1ccccc1N Amb27655757 [0,2,0,0,0,0|1,0,0]=3 9280 B13R1.696 CCN(O)C(=O)c1cccnc1Br Amb27216866 [0,2,0,0,0,0|2,0,0]=4 9281 B13R1.696 CCN(O)C(=O)c1cccnc1N Amb29857913 [0,2,0,0,0,0|2,0,0]=4 9282 B13R1.696 CCN(O)C(=O)c1ccncc1Cl Amb28347075 [0,2,0,0,0,0|2,0,0]=4 9283 B13R1.696 CCN(O)C(=O)c1ccncc1F Amb27620123 [0,2,0,0,0,0|2,0,0]=4 9284 B13R1.696 CCN(O)C(=O)c1ncccc1N Amb27811006 [0,2,0,0,0,0|2,0,0]=4 9285 B13R1.696 CC[C@@H](N)C(=O)c1ccccc1C Amb30024580 [0,2,0,0,0,0|1,0,0]=3 9286 B13R1.696 CC[C@@H](N)C(=O)c1ccccc1Cl Amb35602687 [0,2,0,0,0,0|1,0,0]=3 9287 B13R1.696 CC[C@@H](N)C(=O)c1ccccc1F Amb30024587 [0,2,0,0,0,0|1,0,0]=3 9288 B13R1.696 CC[C@@H](N)C(=O)c1cccnc1N Amb30024586 [0,2,0,0,0,0|2,0,0]=4 9289 B13R1.696 CC[C@@H](N)C(=O)c1ccncc1F Amb35602681 [0,2,0,0,0,0|2,0,0]=4 9290 B13R1.696 CC[C@@H](N)C(=O)c1cnccc1C Amb30024582 [0,2,0,0,0,0|2,0,0]=4 9291 B13R1.696 CC[C@@H](N)C(=O)c1cnccc1N Amb30024585 [0,2,0,0,0,0|2,0,0]=4 9292 B13R1.696 CC[C@H](N)C(=O)c1ccccc1C Amb35599744 [0,2,0,0,0,0|1,0,0]=3 9293 B13R1.696 CC[C@H](N)C(=O)c1ccccc1Cl Amb35659360 [0,2,0,0,0,0|1,0,0]=3 9294 B13R1.696 CC[C@H](N)C(=O)c1ccccc1F Amb35600734 [0,2,0,0,0,0|1,0,0]=3 9295 B13R1.696 CC[C@H](N)C(=O)c1cccnc1N Amb35600743 [0,2,0,0,0,0|2,0,0]=4 9296 B13R1.696 CC[C@H](N)C(=O)c1ccncc1F Amb35600753 [0,2,0,0,0,0|2,0,0]=4 9297 B13R1.696 CC[C@H](N)C(=O)c1cnccc1C Amb35596826 [0,2,0,0,0,0|2,0,0]=4 9298 B13R1.696 CC[C@H](N)C(=O)c1cnccc1N Amb35600742 [0,2,0,0,0,0|2,0,0]=4 9299 B13R1.696 CNC(=O)C(=O)c1ccccc1C Amb19650933 [0,2,0,0,0,0|2,0,0]=4 9300 B13R1.696 CNC(=O)C(=O)c1ccccc1F Amb27879512 [0,2,0,0,0,0|2,0,0]=4 9301 B13R1.696 CNC(C)C(=O)c1ccccc1Br Amb26514902 [0,2,0,0,0,0|2,0,0]=4 9302 B13R1.696 CNC(C)C(=O)c1ccccc1C Amb25836669 [0,2,0,0,0,0|2,0,0]=4 9303 B13R1.696 CNC(C)C(=O)c1ccccc1F Amb25228402 [0,2,0,0,0,0|2,0,0]=4 9304 B13R1.696 CN[C@@H](C)C(=O)c1ccccc1C Amb35659960 [0,2,0,0,0,0|2,0,0]=4 9305 B13R1.696 CN[C@@H](C)C(=O)c1ccccc1Cl Amb29891464 [0,2,0,0,0,0|2,0,0]=4 9306 B13R1.696 CN[C@@H](C)C(=O)c1ccccc1F Amb35659965 [0,2,0,0,0,0|2,0,0]=4 9307 B13R1.696 COC(=O)C(=O)c1ccccc1Br Amb22498290 [0,2,0,0,0,0|2,0,0]=4 9308 B13R1.696 COC(=O)C(=O)c1ccccc1C Amb10562342 [0,2,0,0,0,0|2,0,0]=4 9309 B13R1.696 COC(=O)C(=O)c1ccccc1Cl Amb24054285 [0,2,0,0,0,0|2,0,0]=4 9310 B13R1.696 COC(=O)C(=O)c1ccccc1F Amb27240861 [0,2,0,0,0,0|2,0,0]=4 9311 B13R1.696 COC(=O)C(=O)c1ccccc1N Amb23412038 [0,2,0,0,0,0|2,0,0]=4 9312 B13R1.696 CON(C)C(=O)c1ccccc1Br Amb20673759 [0,2,0,0,0,0|2,0,0]=4 9313 B13R1.696 CON(C)C(=O)c1ccccc1C Amb8387596 [0,2,0,0,0,0|2,0,0]=4 9314 B13R1.696 CON(C)C(=O)c1ccccc1Cl Amb8387493 [0,2,0,0,0,0|2,0,0]=4 9315 B13R1.696 CON(C)C(=O)c1ccccc1F Amb8387609 [0,2,0,0,0,0|2,0,0]=4 9316 B13R1.696 CON(C)C(=O)c1ccccc1I Amb20684718 [0,2,0,0,0,0|2,0,0]=4 9317 B13R1.696 CON(C)C(=O)c1ccccc1N Amb9492083 [0,2,0,0,0,0|2,0,0]=4 9318 B13R1.696 CON(C)C(=O)c1ccccc1O Amb13994033 [0,2,0,0,0,0|2,0,0]=4 9319 B13R1.696 C\C=C(/C)C(=O)c1ccccc1C Amb28324416 [0,2,0,0,0,0|1,0,1]=4 9320 B13R1.696 Cc1ccccc1C(=O)C(Br)CBr Amb27792463 [0,2,0,0,0,0|2,0,0]=4 9321 B13R1.696 O=C(CBr)C(=O)c1ccccc1Cl Amb26359301 [0,2,0,0,0,0|2,0,0]=4 9322 B13R1.708 CCC(C)S(=O)(=O)c1ccccc1 Amb27804676 [0,2,0,0,0,0|2,0,0]=4 9323 B13R1.708 CCN(C)S(=O)(=O)c1ccccc1 Amb24715287 [0,2,0,0,0,0|2,0,0]=4 9324 B13R1.708 CCN(O)S(=O)(=O)c1ccccc1 Amb27817977 [0,2,0,0,0,0|2,0,0]=4 9325 B13R1.347 CC(C)NS(=O)(=O)c1ccccc1 Amb3359963 [0,2,0,0,0,0|2,0,0]=4 9326 B13R1.347 CC(C)OS(=O)(=O)c1ccccc1 Amb17616224 [0,2,0,0,0,0|1,0,0]=3 9327 B13R1.347 CC(N)CS(=O)(=O)c1ccccc1 Amb18302093 [0,2,0,0,0,0|2,0,0]=4 9328 B13R1.347 CC(O)CS(=O)(=O)c1ccccc1 Amb18316904 [0,2,0,0,0,0|2,0,0]=4 9329 B13R1.2819 CCCS(=O)(=O)c1ccccc1Br Amb19375513 [0,2,0,0,0,0|2,0,0]=4 9330 B13R1.2819 CCCS(=O)(=O)c1ccccc1C Amb19375509 [0,2,0,0,0,0|2,0,0]=4 9331 B13R1.2819 CCCS(=O)(=O)c1ccccc1Cl Amb19149228 [0,2,0,0,0,0|2,0,0]=4 9332 B13R1.2819 CCCS(=O)(=O)c1ccccc1N Amb34158645 [0,2,0,0,0,0|2,0,0]=4 9333 B13R1.2819 CCCS(=O)(=O)c1ccccc1N Amb6256494 [0,2,0,0,0,0|2,0,0]=4 9334 B13R1.2819 CCNS(=O)(=O)c1ccccc1Br Amb142318 [0,2,0,0,0,0|2,0,0]=4 9335 B13R1.2819 CCNS(=O)(=O)c1ccccc1C Amb17942846 [0,2,0,0,0,0|2,0,0]=4 9336 B13R1.2819 CCNS(=O)(=O)c1ccccc1Cl Amb8872745 [0,2,0,0,0,0|2,0,0]=4 9337 B13R1.2819 CCNS(=O)(=O)c1ccccc1F Amb8872725 [0,2,0,0,0,0|2,0,0]=4 9338 B13R1.2819 CCNS(=O)(=O)c1ccccc1I Amb2754593 [0,2,0,0,0,0|2,0,0]=4 9339 B13R1.2819 CCNS(=O)(=O)c1ccccc1N Amb1129880 [0,2,0,0,0,0|2,0,0]=4 9340 B13R1.2819 CCNS(=O)(=O)c1ccccc1O Amb18566359 [0,2,0,0,0,0|2,0,0]=4 9341 B13R1.2819 CCOP(=O)(O)c1ccccc1O Amb28199963 [0,2,0,0,0,0|1,0,0]=3 9342 B13R1.2819 CCOS(=O)(=O)c1ccccc1Br Amb22044869 [0,2,0,0,0,0|1,0,0]=3 9343 B13R1.2819 CCOS(=O)(=O)c1ccccc1C Amb25893986 [0,2,0,0,0,0|1,0,0]=3 9344 B13R1.2819 CCOS(=O)(=O)c1ccccc1N Amb8426902 [0,2,0,0,0,0|1,0,0]=3 9345 B13R1.2819 CCOS(=O)(=O)c1ncccc1N Amb32669058 [0,2,0,0,0,0|2,0,0]=4 9346 B13R1.2819 CCO[Si](C)(C)c1ccccc1O Amb27227183 [0,2,0,0,0,0|1,1,0]=4 9347 B13R1.201 C=C(C)CC(=O)c1ccccc1Br Amb18071275 [0,2,0,0,0,0|1,0,1]=4 9348 B13R1.201 C=C(C)CC(=O)c1ccccc1C Amb18065522 [0,2,0,0,0,0|1,0,1]=4 9349 B13R1.201 C=C(C)CC(=O)c1ccccc1Cl Amb18066344 [0,2,0,0,0,0|1,0,1]=4 9350 B13R1.201 C=C(C)CC(=O)c1ccccc1F Amb18065744 [0,2,0,0,0,0|1,0,1]=4 9351 B13R1.201 C=C(SC(C)C)c1ccccc1N Amb27179273 [0,2,0,0,0,0|1,1,0]=4 9352 B13R1.201 CC(=O)CC(=O)c1ccccc1Br Amb7766265 [0,2,0,0,0,0|1,0,1]=4 9353 B13R1.201 CC(=O)CC(=O)c1ccccc1C Amb7766350 [0,2,0,0,0,0|1,0,1]=4 9354 B13R1.201 CC(=O)CC(=O)c1ccccc1Cl Amb7762485 [0,2,0,0,0,0|1,0,1]=4 9355 B13R1.201 CC(=O)CC(=O)c1ccccc1F Amb7762489 [0,2,0,0,0,0|1,0,1]=4 9356 B13R1.201 CC(=O)CC(=O)c1ccccc1I Amb27177275 [0,2,0,0,0,0|1,0,1]=4 9357 B13R1.201 CC(=O)CC(=O)c1ccccc1O Amb2720828 [0,2,0,0,0,0|1,0,1]=4 9358 B13R1.201 CC(=O)NC(=O)c1ccccc1O Amb1983211 [0,2,0,0,0,0|1,0,1]=4 9359 B13R1.201 CC(C)=CC(=O)c1ccccc1Br Amb27618123 [0,2,0,0,0,0|1,0,1]=4 9360 B13R1.201 CC(C)CC(=O)c1ccccc1Br Amb17348647 [0,2,0,0,0,0|1,0,0]=3 9361 B13R1.201 CC(C)CC(=O)c1ccccc1Cl Amb17198753 [0,2,0,0,0,0|1,0,0]=3 9362 B13R1.201 CC(C)CC(=O)c1ccccc1F Amb17198742 [0,2,0,0,0,0|1,0,0]=3 9363 B13R1.201 CC(C)CC(=O)c1ccccc1I Amb27397914 [0,2,0,0,0,0|1,0,0]=3 9364 B13R1.201 CC(C)CC(=O)c1ccccc1O Amb17233429 [0,2,0,0,0,0|1,0,0]=3 9365 B13R1.201 CC(C)CC(=O)c1ccncc1Br Amb27232187 [0,2,0,0,0,0|2,0,0]=4 9366 B13R1.201 CC(C)CC(=O)c1ncccc1N Amb27866593 [0,2,0,0,0,0|2,0,0]=4 9367 B13R1.201 CC(C)CS(=O)c1ccccc1N Amb18987643 [0,2,0,0,0,0|2,0,0]=4 9368 B13R1.201 CC(C)NC(=N)c1ccccc1Cl Amb27179026 [0,2,0,0,0,0|2,0,0]=4 9369 B13R1.201 CC(C)NC(=O)c1ccccc1Br Amb6542592 [0,2,0,0,0,0|1,0,0]=3 9370 B13R1.201 CC(C)NC(=O)c1ccccc1I Amb6391056 [0,2,0,0,0,0|1,0,0]=3 9371 B13R1.201 CC(C)NC(=O)c1ccccc1N Amb6315940 [0,2,0,0,0,0|1,0,0]=3 9372 B13R1.201 CC(C)NC(=O)c1ccccc1O Amb5798541 [0,2,0,0,0,0|1,0,0]=3 9373 B13R1.201 CC(C)NC(=O)c1cccnc1Br Amb27398841 [0,2,0,0,0,0|2,0,0]=4 9374 B13R1.201 CC(C)NC(=O)c1cccnc1Cl Amb2612053 [0,2,0,0,0,0|2,0,0]=4 9375 B13R1.201 CC(C)NC(=O)c1cccnc1F Amb28382802 [0,2,0,0,0,0|2,0,0]=4 9376 B13R1.201 CC(C)NC(=O)c1cccnc1N Amb18965358 [0,2,0,0,0,0|2,0,0]=4 9377 B13R1.201 CC(C)NC(=O)c1ccncc1N Amb23571477 [0,2,0,0,0,0|2,0,0]=4 9378 B13R1.201 CC(C)NC(=O)c1ncccc1O Amb18181063 [0,2,0,0,0,0|2,0,0]=4 9379 B13R1.201 CC(C)OC(=O)C1=CNC=CC1=O Amb26847866 [0,2,0,0,0,0|1,0,0]=3 9380 B13R1.201 CC(C)OC(=O)c1ccccc1Br Amb2725119 [0,2,0,0,0,0|0,0,0]=2 9381 B13R1.201 CC(C)OC(=O)c1ccccc1Cl Amb27870599 [0,2,0,0,0,0|0,0,0]=2 9382 B13R1.201 CC(C)OC(=O)c1ccccc1F Amb20236881 [0,2,0,0,0,0|0,0,0]=2 9383 B13R1.201 CC(C)OC(=O)c1ccccc1N Amb2688998 [0,2,0,0,0,0|0,0,0]=2 9384 B13R1.201 CC(C)OC(=O)c1ccccc1O Amb4021578 [0,2,0,0,0,0|0,0,0]=2 9385 B13R1.201 CC(C)OC(=O)c1cccnc1Br Amb27618963 [0,2,0,0,0,0|1,0,0]=3 9386 B13R1.201 CC(C)OC(=O)c1cccnc1Cl Amb26066378 [0,2,0,0,0,0|1,0,0]=3 9387 B13R1.201 CC(C)OC(=O)c1cccnc1N Amb27254731 [0,2,0,0,0,0|1,0,0]=3 9388 B13R1.201 CC(C)OC(=O)c1cccnc1S Amb26376298 [0,2,0,0,0,0|1,0,0]=3 9389 B13R1.201 CC(C)OC(=O)c1ccncc1Br Amb26061544 [0,2,0,0,0,0|1,0,0]=3 9390 B13R1.201 CC(C)OC(=O)c1ccncc1Cl Amb26007860 [0,2,0,0,0,0|1,0,0]=3 9391 B13R1.201 CC(C)OC(=O)c1ccncc1I Amb25822264 [0,2,0,0,0,0|1,0,0]=3 9392 B13R1.201 CC(C)OC(=O)c1cnccc1Cl Amb24401290 [0,2,0,0,0,0|1,0,0]=3 9393 B13R1.201 CC(C)OC(=O)c1cnccc1N Amb26903542 [0,2,0,0,0,0|1,0,0]=3 9394 B13R1.201 CC(C)OC(=O)c1ncccc1Br Amb27403749 [0,2,0,0,0,0|1,0,0]=3 9395 B13R1.201 CC(C)OC(=O)c1ncccc1Cl Amb25838467 [0,2,0,0,0,0|1,0,0]=3 9396 B13R1.201 CC(C)OC(=O)c1ncccc1N Amb27458218 [0,2,0,0,0,0|1,0,0]=3 9397 B13R1.201 CC(C)OC(=O)c1ncccc1O Amb26453896 [0,2,0,0,0,0|1,0,0]=3 9398 B13R1.201 CC(C)OC(=O)c1ncncc1Br Amb25848995 [0,2,0,0,0,0|2,0,0]=4 9399 B13R1.201 CC(C)OC(=O)c1ncncc1Cl Amb27802040 [0,2,0,0,0,0|2,0,0]=4 9400 B13R1.201 CC(C)OC(C)c1ccccc1O Amb27256530 [0,2,0,0,0,0|1,0,1]=4 9401 B13R1.201 CC(N)CC(=O)c1ccncc1F Amb27831752 [0,2,0,0,0,0|2,0,0]=4 9402 B13R1.201 CC(O)CC(=O)c1ccccc1O Amb28144189 [0,2,0,0,0,0|1,0,0]=3 9403 B13R1.201 CC(O)NC(=O)c1ccccc1O Amb27413615 [0,2,0,0,0,0|1,0,0]=3 9404 B13R1.201 CC(O)OC(=O)c1ccccc1O Amb28122420 [0,2,0,0,0,0|0,0,0]=2 9405 B13R1.201 CN(C)CC(=O)c1ccccc1N Amb27954261 [0,2,0,0,0,0|2,0,0]=4 9406 B13R1.201 CN(C)NC(=O)c1ccccc1Cl Amb28063499 [0,2,0,0,0,0|2,0,0]=4 9407 B13R1.201 CN(C)NC(=O)c1ccccc1O Amb6332074 [0,2,0,0,0,0|2,0,0]=4 9408 B13R1.201 CS(=O)CC(=O)c1ccccc1F Amb28123329 [0,2,0,0,0,0|2,0,0]=4 9409 B13R1.201 CS(=O)CC(=O)c1ccccc1O Amb9871276 [0,2,0,0,0,0|2,0,0]=4 9410 B13R1.201 C[SiH](C)OC(=O)c1ccccc1N Amb27472027 [0,2,0,0,0,0|0,1,0]=3 9411 B13R1.201 C\C(=C/C(C)C)c1ccccc1O Amb27828818 [0,2,0,0,0,0|2,0,0]=4 9412 B13R1.201 C\C(=C\C(C)O)c1ccccc1C Amb27772444 [0,2,0,0,0,0|2,0,0]=4 9413 B13R1.201 C\C(=C\C(C)O)c1ccccc1F Amb28293411 [0,2,0,0,0,0|2,0,0]=4 9414 B13R1.201 C\C(=N\C(C)C)c1ccccc1O Amb28052484 [0,2,0,0,0,0|2,0,0]=4 9415 B13R1.201 C\C(N)=C\C(=O)c1ccccc1Cl Amb27415535 [0,2,0,0,0,0|1,0,1]=4 9416 B13R1.201 C\C(O)=C\C(=O)c1ccccc1O Amb26437654 [0,2,0,0,0,0|1,0,1]=4 9417 B13R1.201 Cc1ccccc1C(=O)CC(C)C Amb17198736 [0,2,0,0,0,0|1,0,0]=3 9418 B13R1.201 Cc1ccccc1C(=O)CC(C)N Amb28350743 [0,2,0,0,0,0|1,0,0]=3 9419 B13R1.201 Cc1ccccc1C(=O)NC(C)C Amb2678645 [0,2,0,0,0,0|1,0,0]=3 9420 B13R1.201 Cc1cccnc1C(=O)NC(C)C Amb5721892 [0,2,0,0,0,0|2,0,0]=4 9421 B13R1.201 Cc1ccncc1C(=O)CC(C)N Amb27253799 [0,2,0,0,0,0|2,0,0]=4 9422 B13R1.201 Cc1ccncc1C(=O)NC(C)C Amb28065446 [0,2,0,0,0,0|2,0,0]=4 9423 B13R1.201 Cc1ccncc1C(=O)OC(C)C Amb28345241 [0,2,0,0,0,0|1,0,0]=3 9424 B13R1.352 CC(C)(C)CC(=O)c1ccccc1 Amb6302036 [0,2,0,0,0,0|1,0,0]=3 9425 B13R1.352 CC(C)(C)NC(=N)c1ccccc1 Amb27458408 [0,2,0,0,0,0|2,0,0]=4 9426 B13R1.352 CC(C)(C)NC(=O)c1ccccc1 Amb17730892 [0,2,0,0,0,0|1,0,0]=3 9427 B13R1.352 CC(C)(C)NC(=O)c1ccccn1 Amb28204086 [0,2,0,0,0,0|2,0,0]=4 9428 B13R1.352 CC(C)(C)NC(=O)c1cccnc1 Amb3093773 [0,2,0,0,0,0|2,0,0]=4 9429 B13R1.352 CC(C)(C)NC(=O)c1ccncc1 Amb3374376 [0,2,0,0,0,0|2,0,0]=4 9430 B13R1.352 CC(C)(C)NS(=O)c1ccccc1 Amb27471116 [0,2,0,0,0,0|2,0,0]=4 9431 B13R1.352 CC(C)(C)OC(=O)N1C=CC=CC1 Amb26040646 [0,2,0,0,0,0|1,0,1]=4 9432 B13R1.352 CC(C)(C)OC(=O)[n+]1ccccc1 Amb28346652 [0,2,0,0,0,0|1,0,0]=3 9433 B13R1.352 CC(C)(C)OC(=O)c1ccccc1 Amb22735143 [0,2,0,0,0,0|0,0,0]=2 9434 B13R1.352 CC(C)(C)OC(=O)c1ccccn1 Amb26515383 [0,2,0,0,0,0|1,0,0]=3 9435 B13R1.352 CC(C)(C)OC(=O)c1cccnc1 Amb10573247 [0,2,0,0,0,0|1,0,0]=3 9436 B13R1.352 CC(C)(C)OC(=O)c1ccncc1 Amb26941128 [0,2,0,0,0,0|1,0,0]=3 9437 B13R1.352 CC(C)(C)OC(=O)c1ccncn1 Amb24679178 [0,2,0,0,0,0|2,0,0]=4 9438 B13R1.352 CC(C)(C)OC(=O)c1ccnnc1 Amb23403524 [0,2,0,0,0,0|2,0,0]=4 9439 B13R1.352 CC(C)(C)OC(=O)c1cnccn1 Amb26347682 [0,2,0,0,0,0|2,0,0]=4 9440 B13R1.352 CC(C)(C)OC(=O)c1cncnc1 Amb28256810 [0,2,0,0,0,0|2,0,0]=4 9441 B13R1.352 CC(C)(C)SC(=O)c1ccccn1 Amb27617858 [0,2,0,0,0,0|1,1,0]=4 9442 B13R1.352 CC(C)(N)CS(=O)c1ccccc1 Amb28062613 [0,2,0,0,0,0|2,0,0]=4 9443 B13R1.352 CS(=O)(=O)CC(=O)c1ccccc1 Amb4018025 [0,2,0,0,0,0|2,0,0]=4 9444 B13R1.352 CS(=O)(=O)NC(=O)c1ccccc1 Amb2568897 [0,2,0,0,0,0|2,0,0]=4 9445 B13R1.352 C[N+](C)(C)[N-]C(=O)c1ccccc1 Amb20659748 [0,2,0,0,0,0|2,0,0]=4 9446 B13R1.352 C[Si](C)(C)CC(=O)c1ccccc1 Amb28125657 [0,2,0,0,0,0|1,1,0]=4 9447 B13R1.352 C[Si](C)(C)NC(=O)c1ccccc1 Amb10562259 [0,2,0,0,0,0|1,1,0]=4 9448 B13R1.352 C[Si](C)(C)OC(=O)c1ccccn1 Amb27953159 [0,2,0,0,0,0|1,1,0]=4 9449 B13R1.352 O=C(CC(F)(F)F)c1ccccc1 Amb8850440 [0,2,0,0,0,0|2,0,0]=4 9450 B13R1.352 O=C(NC(F)(F)F)c1ccccc1 Amb27268435 [0,2,0,0,0,0|2,0,0]=4 9451 B13R1.352 O=C(OS(=O)(=O)Cl)c1ccccc1 Amb27255592 [0,2,0,0,0,0|2,0,0]=4 9452 B13R1.464 C#Cc1ccccc1C(=O)CCN Amb33314760 [0,2,0,0,0,0|2,0,0]=4 9453 B13R1.464 C#Cc1ccccc1C(=O)CNC Amb33204325 [0,2,0,0,0,0|2,0,0]=4 9454 B13R1.464 C#Cc1ccccc1C(=O)OCC Amb26618200 [0,2,0,0,0,0|0,0,0]=2 9455 B13R1.464 C=C(OCC)c1ccccc1C=O Amb33136306 [0,2,0,0,0,0|1,0,0]=3 9456 B13R1.464 C=C(OCC)c1ccccc1CN Amb33136170 [0,2,0,0,0,0|1,0,0]=3 9457 B13R1.464 C=C(OCC)c1cnccc1C=O Amb33136023 [0,2,0,0,0,0|2,0,0]=4 9458 B13R1.464 C=C(OCC)c1cnccc1CN Amb33136181 [0,2,0,0,0,0|2,0,0]=4 9459 B13R1.464 C=C(OCC)c1ncccc1C=O Amb33135799 [0,2,0,0,0,0|2,0,0]=4 9460 B13R1.464 C=C(OCC)c1ncccc1CN Amb33136258 [0,2,0,0,0,0|2,0,0]=4 9461 B13R1.464 C=Cc1ccccc1C(=O)NCC Amb28195206 [0,2,0,0,0,0|1,0,0]=3 9462 B13R1.464 C=Cc1ccccc1C(=O)OCC Amb8394028 [0,2,0,0,0,0|0,0,0]=2 9463 B13R1.464 CCCC(=O)c1ccccc1OC Amb17198738 [0,2,0,0,0,0|1,0,0]=3 9464 B13R1.464 CCNC(=O)c1ccccc1C=O Amb25305984 [0,2,0,0,0,0|1,0,0]=3 9465 B13R1.464 CCNC(=O)c1ccccc1CBr Amb17326866 [0,2,0,0,0,0|1,0,0]=3 9466 B13R1.464 CCNC(=O)c1ccccc1CC Amb27401743 [0,2,0,0,0,0|1,0,0]=3 9467 B13R1.464 CCNC(=O)c1ccccc1CN Amb18909060 [0,2,0,0,0,0|1,0,0]=3 9468 B13R1.464 CCNC(=O)c1ccccc1NC Amb18976972 [0,2,0,0,0,0|1,0,0]=3 9469 B13R1.464 CCNC(=O)c1ccccc1SC Amb3651712 [0,2,0,0,0,0|1,0,0]=3 9470 B13R1.464 CCNC(=O)c1cccnc1CO Amb28345234 [0,2,0,0,0,0|2,0,0]=4 9471 B13R1.464 CCNC(=O)c1cccnc1NC Amb18986988 [0,2,0,0,0,0|2,0,0]=4 9472 B13R1.464 CCNC(=O)c1cccnc1SC Amb27260837 [0,2,0,0,0,0|2,0,0]=4 9473 B13R1.464 CCNC(=O)c1ccncc1NC Amb27617756 [0,2,0,0,0,0|2,0,0]=4 9474 B13R1.464 CCNC(=O)c1cnccc1C#N Amb27467228 [0,2,0,0,0,0|2,0,0]=4 9475 B13R1.464 CCOC(=O)C1=CC=CN\C1=N/C Amb20626576 [0,2,0,0,0,0|1,0,0]=3 9476 B13R1.464 CCOC(=O)c1ccccc1C#N Amb16230819 [0,2,0,0,0,0|0,0,0]=2 9477 B13R1.464 CCOC(=O)c1ccccc1C=O Amb8396096 [0,2,0,0,0,0|0,0,0]=2 9478 B13R1.464 CCOC(=O)c1ccccc1CBr Amb10071455 [0,2,0,0,0,0|0,0,0]=2 9479 B13R1.464 CCOC(=O)c1ccccc1CCl Amb8384485 [0,2,0,0,0,0|0,0,0]=2 9480 B13R1.464 CCOC(=O)c1ccccc1CI Amb24061261 [0,2,0,0,0,0|0,0,0]=2 9481 B13R1.464 CCOC(=O)c1ccccc1CN Amb33737666 [0,2,0,0,0,0|0,0,0]=2 9482 B13R1.464 CCOC(=O)c1ccccc1NC Amb7755235 [0,2,0,0,0,0|0,0,0]=2 9483 B13R1.464 CCOC(=O)c1ccccc1NN Amb24359843 [0,2,0,0,0,0|0,0,0]=2 9484 B13R1.464 CCOC(=O)c1ccccc1OC Amb6357479 [0,2,0,0,0,0|0,0,0]=2 9485 B13R1.464 CCOC(=O)c1ccccc1[Zn]Br Amb6300104 [0,2,0,0,0,0|0,0,0]=2 9486 B13R1.464 CCOC(=O)c1cccnc1C#N Amb8386618 [0,2,0,0,0,0|1,0,0]=3 9487 B13R1.464 CCOC(=O)c1cccnc1CBr Amb22233963 [0,2,0,0,0,0|1,0,0]=3 9488 B13R1.464 CCOC(=O)c1cccnc1CBr Amb22370833 [0,2,0,0,0,0|1,0,0]=3 9489 B13R1.464 CCOC(=O)c1cccnc1CC Amb24102550 [0,2,0,0,0,0|1,0,0]=3 9490 B13R1.464 CCOC(=O)c1cccnc1CCl Amb22496538 [0,2,0,0,0,0|1,0,0]=3 9491 B13R1.464 CCOC(=O)c1cccnc1CN Amb22728821 [0,2,0,0,0,0|1,0,0]=3 9492 B13R1.464 CCOC(=O)c1cccnc1NC Amb6631682 [0,2,0,0,0,0|1,0,0]=3 9493 B13R1.464 CCOC(=O)c1cccnc1NN Amb19651456 [0,2,0,0,0,0|1,0,0]=3 9494 B13R1.464 CCOC(=O)c1cccnc1NN Amb32412698 [0,2,0,0,0,0|1,0,0]=3 9495 B13R1.464 CCOC(=O)c1ccncc1C#N Amb18127619 [0,2,0,0,0,0|1,0,0]=3 9496 B13R1.464 CCOC(=O)c1cnccc1CBr Amb22276052 [0,2,0,0,0,0|1,0,0]=3 9497 B13R1.464 CCOC(=O)c1cnccc1CO Amb23559758 [0,2,0,0,0,0|1,0,0]=3 9498 B13R1.464 CCOC(=O)c1cnccc1NC Amb27477968 [0,2,0,0,0,0|1,0,0]=3 9499 B13R1.464 CCOC(=O)c1cncnc1CC Amb10605042 [0,2,0,0,0,0|2,0,0]=4 9500 B13R1.464 CCOC(=O)c1cncnc1CCl Amb32758776 [0,2,0,0,0,0|2,0,0]=4 9501 B13R1.464 CCOC(=O)c1ncccc1C#N Amb6384298 [0,2,0,0,0,0|1,0,0]=3 9502 B13R1.464 CCOC(=O)c1ncccc1C=O Amb15695355 [0,2,0,0,0,0|1,0,0]=3 9503 B13R1.464 CCOC(=O)c1ncccc1CO Amb23559757 [0,2,0,0,0,0|1,0,0]=3 9504 B13R1.464 CCOC(=O)c1nccnc1C#N Amb18196430 [0,2,0,0,0,0|2,0,0]=4 9505 B13R1.464 CCOC(=O)c1ncncc1SC Amb22499289 [0,2,0,0,0,0|2,0,0]=4 9506 B13R1.464 CCc1ccccc1C(=O)CCN Amb33450143 [0,2,0,0,0,0|2,0,0]=4 9507 B13R1.464 CCc1ccccc1C(=O)CNC Amb33449013 [0,2,0,0,0,0|2,0,0]=4 9508 B13R1.464 CNCC(=O)c1ccccc1C#N Amb26444206 [0,2,0,0,0,0|2,0,0]=4 9509 B13R1.464 CNCC(=O)c1ccccc1OC Amb17233535 [0,2,0,0,0,0|2,0,0]=4 9510 B13R1.464 CNCC(=O)c1ccccc1SC Amb33448730 [0,2,0,0,0,0|2,0,0]=4 9511 B13R1.464 CONC(=O)c1ccccc1C#N Amb28051405 [0,2,0,0,0,0|2,0,0]=4 9512 B13R1.464 CONC(=O)c1ccccc1C=O Amb28051406 [0,2,0,0,0,0|2,0,0]=4 9513 B13R1.464 CONC(=O)c1ccccc1OC Amb10704494 [0,2,0,0,0,0|2,0,0]=4 9514 B13R1.464 COc1ccccc1C(=O)CCCl Amb17139722 [0,2,0,0,0,0|2,0,0]=4 9515 B13R1.464 COc1ccccc1C(=O)CCN Amb18065830 [0,2,0,0,0,0|2,0,0]=4 9516 B13R1.464 COc1ccccc1C(=O)CCO Amb18564123 [0,2,0,0,0,0|2,0,0]=4 9517 B13R1.464 COc1ccccc1C(=O)CCS Amb17402130 [0,2,0,0,0,0|2,0,0]=4 9518 B13R1.464 COc1ccccc1C(=O)CSC Amb18321461 [0,2,0,0,0,0|2,0,0]=4 9519 B13R1.464 CSc1ccccc1C(=O)CCN Amb33266983 [0,2,0,0,0,0|2,0,0]=4 9520 B13R1.464 C\C=C\C(=O)c1ccccc1C#N Amb27588243 [0,2,0,0,0,0|1,0,1]=4 9521 B13R1.464 C\C=C\C(=O)c1ccccc1C=O Amb25208969 [0,2,0,0,0,0|1,0,1]=4 9522 B13R1.464 C\C=C\C(=O)c1ccccc1OC Amb27439101 [0,2,0,0,0,0|1,0,1]=4 9523 B13R1.464 N#Cc1ccccc1C(=O)CCBr Amb24698662 [0,2,0,0,0,0|2,0,0]=4 9524 B13R1.464 N#Cc1ccccc1C(=O)CCCl Amb27594784 [0,2,0,0,0,0|2,0,0]=4 9525 B13R1.464 N#Cc1ccccc1C(=O)CCN Amb33314710 [0,2,0,0,0,0|2,0,0]=4 9526 B13R1.464 [C-]#[N+]c1ccccc1C(=O)OCC Amb19928641 [0,2,0,0,0,0|0,0,0]=2 9527 B13R1.464 [C-]#[N+]c1ncccc1C(=O)OCC Amb33728426 [0,2,0,0,0,0|1,0,0]=3 9528 B13R1.1546 CCOC(=O)C1(O)C=CC=CC1O Amb28294224 [0,2,0,0,0,0|0,0,2]=4 9529 B13R1.4453 CCCC(=O)c1c(Cl)cccc1Br Amb27810732 [0,2,0,0,0,0|1,0,0]=3 9530 B13R1.4453 CCCC(=O)c1c(Cl)cccc1Cl Amb27641035 [0,2,0,0,0,0|1,0,0]=3 9531 B13R1.4453 CCCC(=O)c1c(F)cccc1Br Amb28141461 [0,2,0,0,0,0|1,0,0]=3 9532 B13R1.4453 CCCC(=O)c1c(F)cccc1Cl Amb17198757 [0,2,0,0,0,0|1,0,0]=3 9533 B13R1.4453 CCCC(=O)c1c(F)cccc1F Amb2724207 [0,2,0,0,0,0|1,0,0]=3 9534 B13R1.4453 CCCC(=O)c1c(F)cncc1F Amb35630161 [0,2,0,0,0,0|2,0,0]=4 9535 B13R1.4453 CCCC(=O)c1c(O)cccc1Cl Amb28199962 [0,2,0,0,0,0|1,0,0]=3 9536 B13R1.4453 CCCC(=O)c1c(O)cccc1O Amb4025604 [0,2,0,0,0,0|1,0,0]=3 9537 B13R1.4453 CCCS(=O)c1c(N)cccc1Cl Amb28132560 [0,2,0,0,0,0|2,0,0]=4 9538 B13R1.4453 CCNC(=O)c1c(C)cccc1N Amb1131711 [0,2,0,0,0,0|1,0,0]=3 9539 B13R1.4453 CCNC(=O)c1c(C)cncc1C Amb27827178 [0,2,0,0,0,0|2,0,0]=4 9540 B13R1.4453 CCNC(=O)c1c(Cl)cccc1I Amb28281643 [0,2,0,0,0,0|1,0,0]=3 9541 B13R1.4453 CCNC(=O)c1c(Cl)cncc1Cl Amb27632641 [0,2,0,0,0,0|2,0,0]=4 9542 B13R1.4453 CCNC(=O)c1c(F)cccc1Br Amb27749864 [0,2,0,0,0,0|1,0,0]=3 9543 B13R1.4453 CCNC(=O)c1c(F)cccc1F Amb9818932 [0,2,0,0,0,0|1,0,0]=3 9544 B13R1.4453 CCNC(=O)c1c(O)cccc1Cl Amb27456216 [0,2,0,0,0,0|1,0,0]=3 9545 B13R1.4453 CCOC(=N)c1c(Cl)cccc1Cl Amb27454721 [0,2,0,0,0,0|1,0,0]=3 9546 B13R1.4453 CCOC(=N)c1c(F)cccc1Br Amb28410851 [0,2,0,0,0,0|1,0,0]=3 9547 B13R1.4453 CCOC(=N)c1c(F)cccc1F Amb24761324 [0,2,0,0,0,0|1,0,0]=3 9548 B13R1.4453 CCOC(=O)C1=C(C)N=CNC1=O Amb24724527 [0,2,0,0,0,0|2,0,0]=4 9549 B13R1.4453 CCOC(=O)C1=C(C)NC=CC1=O Amb22736652 [0,2,0,0,0,0|1,0,0]=3 9550 B13R1.4453 CCOC(=O)c1c(Br)cccc1I Amb27661855 [0,2,0,0,0,0|0,0,0]=2 9551 B13R1.4453 CCOC(=O)c1c(Br)ccnc1Br Amb23412239 [0,2,0,0,0,0|1,0,0]=3 9552 B13R1.4453 CCOC(=O)c1c(Br)ccnc1Cl Amb22752627 [0,2,0,0,0,0|1,0,0]=3 9553 B13R1.4453 CCOC(=O)c1c(Br)ccnc1O Amb27861058 [0,2,0,0,0,0|1,0,0]=3 9554 B13R1.4453 CCOC(=O)c1c(Br)cncc1Br Amb21964000 [0,2,0,0,0,0|1,0,0]=3 9555 B13R1.4453 CCOC(=O)c1c(C)cccc1Br Amb23437315 [0,2,0,0,0,0|0,0,0]=2 9556 B13R1.4453 CCOC(=O)c1c(C)cccc1C Amb6357768 [0,2,0,0,0,0|0,0,0]=2 9557 B13R1.4453 CCOC(=O)c1c(C)cccc1Cl Amb24743186 [0,2,0,0,0,0|0,0,0]=2 9558 B13R1.4453 CCOC(=O)c1c(C)cccc1F Amb22500699 [0,2,0,0,0,0|0,0,0]=2 9559 B13R1.4453 CCOC(=O)c1c(C)cccc1I Amb25364178 [0,2,0,0,0,0|0,0,0]=2 9560 B13R1.4453 CCOC(=O)c1c(C)cccc1N Amb18976379 [0,2,0,0,0,0|0,0,0]=2 9561 B13R1.4453 CCOC(=O)c1c(C)cccc1O Amb6298570 [0,2,0,0,0,0|0,0,0]=2 9562 B13R1.4453 CCOC(=O)c1c(C)ccnc1Br Amb17621485 [0,2,0,0,0,0|1,0,0]=3 9563 B13R1.4453 CCOC(=O)c1c(C)ccnc1C Amb2695353 [0,2,0,0,0,0|1,0,0]=3 9564 B13R1.4453 CCOC(=O)c1c(C)ccnc1Cl Amb10604399 [0,2,0,0,0,0|1,0,0]=3 9565 B13R1.4453 CCOC(=O)c1c(C)ccnc1N Amb23438885 [0,2,0,0,0,0|1,0,0]=3 9566 B13R1.4453 CCOC(=O)c1c(C)ccnc1O Amb20247540 [0,2,0,0,0,0|1,0,0]=3 9567 B13R1.4453 CCOC(=O)c1c(C)cncc1C Amb27796520 [0,2,0,0,0,0|1,0,0]=3 9568 B13R1.4453 CCOC(=O)c1c(C)cncc1F Amb24737884 [0,2,0,0,0,0|1,0,0]=3 9569 B13R1.4453 CCOC(=O)c1c(C)cncc1N Amb25122081 [0,2,0,0,0,0|1,0,0]=3 9570 B13R1.4453 CCOC(=O)c1c(C)cncc1O Amb26076099 [0,2,0,0,0,0|1,0,0]=3 9571 B13R1.4453 CCOC(=O)c1c(C)ncnc1C Amb10071081 [0,2,0,0,0,0|2,0,0]=4 9572 B13R1.4453 CCOC(=O)c1c(C)ncnc1Cl Amb22899723 [0,2,0,0,0,0|2,0,0]=4 9573 B13R1.4453 CCOC(=O)c1c(Cl)cccc1Cl Amb4477463 [0,2,0,0,0,0|0,0,0]=2 9574 B13R1.4453 CCOC(=O)c1c(Cl)cccc1I Amb22491455 [0,2,0,0,0,0|0,0,0]=2 9575 B13R1.4453 CCOC(=O)c1c(Cl)ccnc1Br Amb22752625 [0,2,0,0,0,0|1,0,0]=3 9576 B13R1.4453 CCOC(=O)c1c(Cl)ccnc1C Amb22728567 [0,2,0,0,0,0|1,0,0]=3 9577 B13R1.4453 CCOC(=O)c1c(Cl)ccnc1Cl Amb10975538 [0,2,0,0,0,0|1,0,0]=3 9578 B13R1.4453 CCOC(=O)c1c(Cl)ccnc1N Amb27443146 [0,2,0,0,0,0|1,0,0]=3 9579 B13R1.4453 CCOC(=O)c1c(Cl)cncc1Br Amb22752626 [0,2,0,0,0,0|1,0,0]=3 9580 B13R1.4453 CCOC(=O)c1c(Cl)cncc1Cl Amb26348422 [0,2,0,0,0,0|1,0,0]=3 9581 B13R1.4453 CCOC(=O)c1c(Cl)ncnc1Cl Amb19958012 [0,2,0,0,0,0|2,0,0]=4 9582 B13R1.4453 CCOC(=O)c1c(F)cccc1Br Amb21964734 [0,2,0,0,0,0|0,0,0]=2 9583 B13R1.4453 CCOC(=O)c1c(F)cccc1Cl Amb9242875 [0,2,0,0,0,0|0,0,0]=2 9584 B13R1.4453 CCOC(=O)c1c(F)cccc1F Amb9242927 [0,2,0,0,0,0|0,0,0]=2 9585 B13R1.4453 CCOC(=O)c1c(F)cccc1I Amb27230469 [0,2,0,0,0,0|0,0,0]=2 9586 B13R1.4453 CCOC(=O)c1c(F)ccnc1Br Amb27208567 [0,2,0,0,0,0|1,0,0]=3 9587 B13R1.4453 CCOC(=O)c1c(F)ccnc1C Amb24601314 [0,2,0,0,0,0|1,0,0]=3 9588 B13R1.4453 CCOC(=O)c1c(F)ccnc1Cl Amb28135568 [0,2,0,0,0,0|1,0,0]=3 9589 B13R1.4453 CCOC(=O)c1c(F)ccnc1I Amb27636415 [0,2,0,0,0,0|1,0,0]=3 9590 B13R1.4453 CCOC(=O)c1c(F)ccnc1N Amb28132923 [0,2,0,0,0,0|1,0,0]=3 9591 B13R1.4453 CCOC(=O)c1c(F)ccnc1O Amb25942754 [0,2,0,0,0,0|1,0,0]=3 9592 B13R1.4453 CCOC(=O)c1c(F)cncc1Br Amb22233967 [0,2,0,0,0,0|1,0,0]=3 9593 B13R1.4453 CCOC(=O)c1c(F)cncc1F Amb27834298 [0,2,0,0,0,0|1,0,0]=3 9594 B13R1.4453 CCOC(=O)c1c(F)cncc1I Amb27616182 [0,2,0,0,0,0|1,0,0]=3 9595 B13R1.4453 CCOC(=O)c1c(N)cccc1Br Amb21857589 [0,2,0,0,0,0|0,0,0]=2 9596 B13R1.4453 CCOC(=O)c1c(N)cccc1Cl Amb22500214 [0,2,0,0,0,0|0,0,0]=2 9597 B13R1.4453 CCOC(=O)c1c(N)cccc1F Amb32941824 [0,2,0,0,0,0|0,0,0]=2 9598 B13R1.4453 CCOC(=O)c1c(N)cccc1F Amb9301978 [0,2,0,0,0,0|0,0,0]=2 9599 B13R1.4453 CCOC(=O)c1c(N)cccc1I Amb24670229 [0,2,0,0,0,0|0,0,0]=2 9600 B13R1.4453 CCOC(=O)c1c(N)cccc1N Amb26966905 [0,2,0,0,0,0|0,0,0]=2 9601 B13R1.4453 CCOC(=O)c1c(N)ccnc1Br Amb25686101 [0,2,0,0,0,0|1,0,0]=3 9602 B13R1.4453 CCOC(=O)c1c(N)ccnc1Cl Amb23401937 [0,2,0,0,0,0|1,0,0]=3 9603 B13R1.4453 CCOC(=O)c1c(N)ccnc1F Amb28455748 [0,2,0,0,0,0|1,0,0]=3 9604 B13R1.4453 CCOC(=O)c1c(N)cncc1Br Amb16185775 [0,2,0,0,0,0|1,0,0]=3 9605 B13R1.4453 CCOC(=O)c1c(N)cncc1F Amb27194052 [0,2,0,0,0,0|1,0,0]=3 9606 B13R1.4453 CCOC(=O)c1c(O)cccc1Br Amb27608375 [0,2,0,0,0,0|0,0,0]=2 9607 B13R1.4453 CCOC(=O)c1c(O)cccc1Cl Amb18653408 [0,2,0,0,0,0|0,0,0]=2 9608 B13R1.4453 CCOC(=O)c1c(O)cccc1F Amb25039389 [0,2,0,0,0,0|0,0,0]=2 9609 B13R1.4453 CCOC(=O)c1c(O)cccc1I Amb24717069 [0,2,0,0,0,0|0,0,0]=2 9610 B13R1.4453 CCOC(=O)c1c(O)cccc1O Amb22351985 [0,2,0,0,0,0|0,0,0]=2 9611 B13R1.4453 CCOC(=O)c1c(O)ccnc1Br Amb26381303 [0,2,0,0,0,0|1,0,0]=3 9612 B13R1.4453 CCOC(=O)c1c(O)ccnc1Cl Amb26005119 [0,2,0,0,0,0|1,0,0]=3 9613 B13R1.4453 CCOC(=O)c1c(O)ccnc1F Amb27462530 [0,2,0,0,0,0|1,0,0]=3 9614 B13R1.4453 CCOC(=O)c1c(O)cncc1Cl Amb26065819 [0,2,0,0,0,0|1,0,0]=3 9615 B13R1.4453 CCOC(=O)c1c(O)cncc1F Amb27638808 [0,2,0,0,0,0|1,0,0]=3 9616 B13R1.4453 CCON(C)c1c(N)cccc1Br Amb35645952 [0,2,0,0,0,0|2,0,0]=4 9617 B13R1.4453 CNCC(=O)c1c(C)cccc1C Amb32727957 [0,2,0,0,0,0|2,0,0]=4 9618 B13R1.4453 CNCC(=O)c1c(C)cccc1Cl Amb33259444 [0,2,0,0,0,0|2,0,0]=4 9619 B13R1.4453 CNCC(=O)c1c(C)cccc1F Amb24578587 [0,2,0,0,0,0|2,0,0]=4 9620 B13R1.4453 CNCC(=O)c1c(Cl)cccc1Br Amb25845605 [0,2,0,0,0,0|2,0,0]=4 9621 B13R1.4453 CNCC(=O)c1c(Cl)cccc1Cl Amb33256482 [0,2,0,0,0,0|2,0,0]=4 9622 B13R1.4453 CNCC(=O)c1c(F)cccc1Br Amb33452256 [0,2,0,0,0,0|2,0,0]=4 9623 B13R1.4453 CNCC(=O)c1c(F)cccc1Cl Amb25381392 [0,2,0,0,0,0|2,0,0]=4 9624 B13R1.4453 CNCC(=O)c1c(F)cccc1F Amb27760183 [0,2,0,0,0,0|2,0,0]=4 9625 B13R1.4453 CNCC(=O)c1c(O)cccc1Br Amb33331539 [0,2,0,0,0,0|2,0,0]=4 9626 B13R1.4453 CNCC(=O)c1c(O)cccc1Cl Amb33260738 [0,2,0,0,0,0|2,0,0]=4 9627 B13R1.4453 COCC(=O)c1c(C)cccc1Cl Amb27836008 [0,2,0,0,0,0|2,0,0]=4 9628 B13R1.4453 COCC(=O)c1c(F)cccc1Cl Amb27390503 [0,2,0,0,0,0|2,0,0]=4 9629 B13R1.4453 CONC(=O)c1c(C)cccc1Br Amb27242324 [0,2,0,0,0,0|2,0,0]=4 9630 B13R1.4453 CONC(=O)c1c(C)cccc1F Amb28047787 [0,2,0,0,0,0|2,0,0]=4 9631 B13R1.4453 CONC(=O)c1c(C)cccc1I Amb28410739 [0,2,0,0,0,0|2,0,0]=4 9632 B13R1.4453 CONC(=O)c1c(Cl)cccc1Cl Amb27618367 [0,2,0,0,0,0|2,0,0]=4 9633 B13R1.4453 CONC(=O)c1c(F)cccc1Cl Amb16969947 [0,2,0,0,0,0|2,0,0]=4 9634 B13R1.4453 CSCC(=O)c1c(Cl)cccc1Cl Amb27436482 [0,2,0,0,0,0|2,0,0]=4 9635 B13R1.4453 CSCC(=O)c1c(F)cccc1F Amb28077700 [0,2,0,0,0,0|2,0,0]=4 9636 B13R1.4453 Cc1cccc(Br)c1C(=O)CCCl Amb26532701 [0,2,0,0,0,0|2,0,0]=4 9637 B13R1.4453 Cc1cccc(C)c1C(=O)CCBr Amb26575419 [0,2,0,0,0,0|2,0,0]=4 9638 B13R1.4453 Cc1cccc(C)c1C(=O)CCCl Amb26570315 [0,2,0,0,0,0|2,0,0]=4 9639 B13R1.4453 Cc1cccc(C)c1C(=O)CCN Amb32727960 [0,2,0,0,0,0|2,0,0]=4 9640 B13R1.4453 Cc1cccc(C)c1C(=O)NCO Amb28292667 [0,2,0,0,0,0|2,0,0]=4 9641 B13R1.4453 Cc1cccc(Cl)c1C(=O)CCBr Amb27807958 [0,2,0,0,0,0|2,0,0]=4 9642 B13R1.4453 Cc1cccc(Cl)c1C(=O)CCCl Amb24741600 [0,2,0,0,0,0|2,0,0]=4 9643 B13R1.4453 Cc1cccc(Cl)c1C(=O)CCN Amb33259417 [0,2,0,0,0,0|2,0,0]=4 9644 B13R1.4453 Cc1cccc(F)c1C(=O)CCBr Amb27234193 [0,2,0,0,0,0|2,0,0]=4 9645 B13R1.4453 Cc1cccc(F)c1C(=O)CCCl Amb26335446 [0,2,0,0,0,0|2,0,0]=4 9646 B13R1.4453 Cc1cccc(F)c1C(=O)CCN Amb27481777 [0,2,0,0,0,0|2,0,0]=4 9647 B13R1.4453 Cc1cccc(I)c1C(=O)CCBr Amb27394191 [0,2,0,0,0,0|2,0,0]=4 9648 B13R1.4453 Cc1cccc(I)c1C(=O)CCCl Amb25347652 [0,2,0,0,0,0|2,0,0]=4 9649 B13R1.4453 Cc1cccc(S)c1C(=O)CCCl Amb27624161 [0,2,0,0,0,0|2,0,0]=4 9650 B13R1.4453 NCCC(=O)c1c(Cl)cccc1Br Amb27594172 [0,2,0,0,0,0|2,0,0]=4 9651 B13R1.4453 NCCC(=O)c1c(Cl)cccc1Cl Amb33256471 [0,2,0,0,0,0|2,0,0]=4 9652 B13R1.4453 NCCC(=O)c1c(F)cccc1Br Amb33430021 [0,2,0,0,0,0|2,0,0]=4 9653 B13R1.4453 NCCC(=O)c1c(F)cccc1Cl Amb28317165 [0,2,0,0,0,0|2,0,0]=4 9654 B13R1.4453 NCCC(=O)c1c(F)cccc1F Amb24460455 [0,2,0,0,0,0|2,0,0]=4 9655 B13R1.4453 NCCC(=O)c1c(O)cccc1Br Amb33331526 [0,2,0,0,0,0|2,0,0]=4 9656 B13R1.4453 NCCC(=O)c1c(O)cccc1Cl Amb33260718 [0,2,0,0,0,0|2,0,0]=4 9657 B13R1.4453 Nc1cccc(Br)c1C(=O)CCBr Amb27615939 [0,2,0,0,0,0|2,0,0]=4 9658 B13R1.4453 Nc1cccc(F)c1C(=O)CCBr Amb27797465 [0,2,0,0,0,0|2,0,0]=4 9659 B13R1.4453 Nc1cccc(F)c1C(=O)CCCl Amb27877121 [0,2,0,0,0,0|2,0,0]=4 9660 B13R1.4453 Nc1cccc(N)c1C(=O)CCBr Amb27847266 [0,2,0,0,0,0|2,0,0]=4 9661 B13R1.4453 O=C(CCBr)c1c(Br)cccc1Br Amb25293951 [0,2,0,0,0,0|2,0,0]=4 9662 B13R1.4453 O=C(CCBr)c1c(Cl)cccc1Cl Amb27626006 [0,2,0,0,0,0|2,0,0]=4 9663 B13R1.4453 O=C(CCBr)c1c(Cl)cccc1I Amb25212335 [0,2,0,0,0,0|2,0,0]=4 9664 B13R1.4453 O=C(CCBr)c1c(F)cccc1Br Amb26331522 [0,2,0,0,0,0|2,0,0]=4 9665 B13R1.4453 O=C(CCBr)c1c(F)cccc1Cl Amb26343916 [0,2,0,0,0,0|2,0,0]=4 9666 B13R1.4453 O=C(CCBr)c1c(F)cccc1F Amb27177148 [0,2,0,0,0,0|2,0,0]=4 9667 B13R1.4453 O=C(CCBr)c1c(F)cccc1I Amb25081501 [0,2,0,0,0,0|2,0,0]=4 9668 B13R1.4453 O=C(CCBr)c1c(F)cccc1S Amb27669905 [0,2,0,0,0,0|2,0,0]=4 9669 B13R1.4453 O=C(CCBr)c1c(O)cccc1Cl Amb26855044 [0,2,0,0,0,0|2,0,0]=4 9670 B13R1.4453 O=C(CCBr)c1c(O)cccc1F Amb28048827 [0,2,0,0,0,0|2,0,0]=4 9671 B13R1.4453 O=C(CCBr)c1c(O)cccc1I Amb27181197 [0,2,0,0,0,0|2,0,0]=4 9672 B13R1.4453 O=C(CCCl)c1c(Br)cccc1Br Amb25771928 [0,2,0,0,0,0|2,0,0]=4 9673 B13R1.4453 O=C(CCCl)c1c(Br)cccc1I Amb27636531 [0,2,0,0,0,0|2,0,0]=4 9674 B13R1.4453 O=C(CCCl)c1c(Cl)cccc1Br Amb26567848 [0,2,0,0,0,0|2,0,0]=4 9675 B13R1.4453 O=C(CCCl)c1c(F)cccc1Cl Amb28185869 [0,2,0,0,0,0|2,0,0]=4 9676 B13R1.4453 O=C(CCCl)c1c(F)cccc1F Amb24378546 [0,2,0,0,0,0|2,0,0]=4 9677 B13R1.4453 O=C(CCCl)c1c(F)cccc1I Amb24435517 [0,2,0,0,0,0|2,0,0]=4 9678 B13R1.4453 O=C(CCCl)c1c(I)cccc1I Amb27670293 [0,2,0,0,0,0|2,0,0]=4 9679 B13R1.4453 O=C(CCCl)c1c(O)cccc1Br Amb27442108 [0,2,0,0,0,0|2,0,0]=4 9680 B13R1.4453 O=C(CCCl)c1c(O)cccc1Cl Amb25696441 [0,2,0,0,0,0|2,0,0]=4 9681 B13R1.4453 O=C(CCCl)c1c(O)cccc1F Amb28251273 [0,2,0,0,0,0|2,0,0]=4 9682 B13R1.4453 O=C(CCCl)c1c(S)cccc1Br Amb26917374 [0,2,0,0,0,0|2,0,0]=4 9683 B11R1.26 CCC1C=CC=CC=CC1=O Amb27474579 [0,0,1,1,0,0|1,0,0]=3 9684 B11R1.30 CCOC(=O)Cc1ccco1 Amb27266773 [0,0,1,1,0,0|1,0,1]=4 9685 B11R1.30 CCOC(=O)Cc1cccs1 Amb2687957 [0,0,1,1,0,0|1,0,1]=4 9686 B11R1.30 CCOC(=O)Cc1ccoc1 Amb27266772 [0,0,1,1,0,0|1,0,1]=4 9687 B11R1.30 CCOC(=O)Cc1ccsc1 Amb33531521 [0,0,1,1,0,0|1,0,1]=4 9688 B11R1.30 CCOC(=O)Cn1cccc1 Amb2236263 [0,0,1,1,0,0|1,0,1]=4 9689 B11R1.30 CCOC(=O)Nc1ccco1 Amb24744539 [0,0,1,1,0,0|2,0,0]=4 9690 B11R1.180 C=CCN\C=C1\CCOC1=O Amb27668936 [0,0,1,1,0,0|1,0,1]=4 9691 B11R1.189 C=Cc1cccc(CCC)n1 Amb25151665 [0,0,1,1,0,0|2,0,0]=4 9692 B11R1.189 C=Cc1cccc(OCC)c1 Amb25151360 [0,0,1,1,0,0|1,0,0]=3 9693 B11R1.189 C=Cc1cccc(OCC)n1 Amb24487079 [0,0,1,1,0,0|1,0,0]=3 9694 B11R1.189 CCOc1cccc(C=O)c1 Amb2589522 [0,0,1,1,0,0|2,0,0]=4 9695 B11R1.189 CCOc1cccc(C=O)n1 Amb20669383 [0,0,1,1,0,0|2,0,0]=4 9696 B11R1.230 O=C\C=C\C1=CC(=O)OC1O Amb28457571 [0,0,1,1,0,0|2,0,0]=4 9697 B11R1.381 CCC1=CC=CC=C(O)C1=O Amb28254535 [0,0,1,1,0,0|2,0,0]=4 9698 B11R1.41 C=Cc1ccccc1OCC Amb26635795 [0,0,1,1,0,0|1,0,0]=3 9699 B11R1.41 C=Cc1cccnc1NCC Amb25676251 [0,0,1,1,0,0|2,0,0]=4 9700 B11R1.41 C=Cc1ccncc1OCC Amb27157027 [0,0,1,1,0,0|2,0,0]=4 9701 B11R1.41 C=Cc1ncccc1OCC Amb25341392 [0,0,1,1,0,0|2,0,0]=4 9702 B11R1.41 CCOc1ccccc1C=O Amb845365 [0,0,1,1,0,0|2,0,0]=4 9703 B11R1.41 CCOc1ncccc1C=O Amb4561136 [0,0,1,1,0,0|2,0,0]=4 9704 B11R1.267 C=Cc1cccc(CC)c1N Amb27595536 [0,0,1,1,0,0|2,0,0]=4 9705 B11R1.425 C=C[C@H]1\C(=C\Cl)C(=O)O[C@H]1C Amb28244863 [0,0,1,1,0,0|1,0,1]=4 9706 B11R1.820 C=C1CC(C(=O)OCC)C1=C Amb24741031 [0,0,1,1,0,0|0,0,2]=4 9707 B11R1.820 C=C1C[C@@H](C(=O)OCC)C1=C Amb26880297 [0,0,1,1,0,0|0,0,2]=4 9708 B11R2.1 BrC1=CCc2ccccc21 Amb26318514 [1,0,0,1,0,0|1,0,1]=4 9709 B11R2.1 BrC1CCc2ccccc21 Amb33528718 [1,0,0,1,0,0|1,0,1]=4 9710 B11R2.1 C=C1CCc2ccccc21 Amb24458532 [1,0,0,1,0,0|1,0,0]=3 9711 B11R2.1 C=C1CCc2cccnc21 Amb28289851 [1,0,0,1,0,0|2,0,0]=4 9712 B11R2.1 C=C1CNc2ccccc21 Amb27203251 [1,0,0,1,0,0|2,0,0]=4 9713 B11R2.1 CC1=CCc2ccccc21 Amb17778909 [1,0,0,1,0,0|1,0,1]=4 9714 B11R2.1 CC1CCc2ccccc21 Amb28050187 [1,0,0,1,0,0|1,0,1]=4 9715 B11R2.1 CC1OCc2ccccc21 Amb25913589 [1,0,0,1,0,0|1,0,1]=4 9716 B11R2.1 CN1CCc2ccccc21 Amb15691717 [1,0,0,1,0,0|2,0,0]=4 9717 B11R2.1 Cc1onc2ccccc12 Amb4120114 [1,0,0,1,0,0|2,0,0]=4 9718 B11R2.1 ClC1CCc2ccccc21 Amb8630739 [1,0,0,1,0,0|1,0,1]=4 9719 B11R2.1 N=C1NCc2ccccc21 Amb7174277 [1,0,0,1,0,0|2,0,0]=4 9720 B11R2.1 NC1=NCc2ccccc21 Amb534105 [1,0,0,1,0,0|2,0,0]=4 9721 B11R2.1 NC1CCc2ccccc21 Amb1158023 [1,0,0,1,0,0|1,0,1]=4 9722 B11R2.1 NC1CCc2ccccc21 Amb16233857 [1,0,0,1,0,0|1,0,1]=4 9723 B11R2.1 NC1CCc2ccccc21 Amb24078253 [1,0,0,1,0,0|1,0,1]=4 9724 B11R2.1 NC1CCc2ccccc21 Amb9677422 [1,0,0,1,0,0|1,0,1]=4 9725 B11R2.1 NN1CCc2ccccc21 Amb2691266 [1,0,0,1,0,0|2,0,0]=4 9726 B11R2.1 NN1CCc2ccccc21 Amb836793 [1,0,0,1,0,0|2,0,0]=4 9727 B11R2.1 N[C@@H]1CCc2ccccc21 Amb16233854 [1,0,0,1,0,0|1,0,1]=4 9728 B11R2.1 N[C@@H]1CCc2ccccc21 Amb3940189 [1,0,0,1,0,0|1,0,1]=4 9729 B11R2.1 N[C@H]1CCc2ccccc21 Amb20242239 [1,0,0,1,0,0|1,0,1]=4 9730 B11R2.1 N[C@H]1CCc2ccccc21 Amb3940190 [1,0,0,1,0,0|1,0,1]=4 9731 B11R2.1 Nc1onc2ccccc12 Amb21857107 [1,0,0,1,0,0|2,0,0]=4 9732 B11R2.1 O=C1C=Cc2ccccc21 Amb10603436 [1,0,0,1,0,0|0,0,2]=4 9733 B11R2.1 O=C1CCc2ccccc21 Amb6458950 [1,0,0,1,0,0|0,0,0]=2 9734 B11R2.1 O=C1CCc2cccnc21 Amb10602809 [1,0,0,1,0,0|1,0,0]=3 9735 B11R2.1 O=C1CCc2ccncc21 Amb22491415 [1,0,0,1,0,0|1,0,0]=3 9736 B11R2.1 O=C1CCc2ccncc21 Amb5719663 [1,0,0,1,0,0|1,0,0]=3 9737 B11R2.1 O=C1CCc2cnccc21 Amb22235532 [1,0,0,1,0,0|1,0,0]=3 9738 B11R2.1 O=C1CCc2cnccc21 Amb5719882 [1,0,0,1,0,0|1,0,0]=3 9739 B11R2.1 O=C1CCc2ncccc21 Amb22275948 [1,0,0,1,0,0|1,0,0]=3 9740 B11R2.1 O=C1CCc2ncccc21 Amb2695094 [1,0,0,1,0,0|1,0,0]=3 9741 B11R2.1 O=C1CCc2ncncc21 Amb18832515 [1,0,0,1,0,0|2,0,0]=4 9742 B11R2.1 O=C1CN=C2NC=CC=C12 Amb22491902 [1,0,0,1,0,0|2,0,0]=4 9743 B11R2.1 O=C1CNc2cccc[n+]21 Amb32664845 [1,0,0,1,0,0|2,0,0]=4 9744 B11R2.1 O=C1CNc2ccccc21 Amb17593399 [1,0,0,1,0,0|1,0,0]=3 9745 B11R2.1 O=C1COc2ccccc21 Amb33534383 [1,0,0,1,0,0|1,0,0]=3 9746 B11R2.1 O=C1COc2cccnc21 Amb22372216 [1,0,0,1,0,0|2,0,0]=4 9747 B11R2.1 O=C1COc2cnccc21 Amb20242099 [1,0,0,1,0,0|2,0,0]=4 9748 B11R2.1 O=C1COc2cnccc21 Amb22728783 [1,0,0,1,0,0|2,0,0]=4 9749 B11R2.1 O=C1COc2ncccc21 Amb20242022 [1,0,0,1,0,0|2,0,0]=4 9750 B11R2.1 O=C1CSc2ccccc21 Amb4062421 [1,0,0,1,0,0|1,0,0]=3 9751 B11R2.1 O=C1CSc2cnccc21 Amb27265724 [1,0,0,1,0,0|2,0,0]=4 9752 B11R2.1 O=C1CSc2ncccc21 Amb27153117 [1,0,0,1,0,0|2,0,0]=4 9753 B11R2.1 O=C1N=Cc2ccccc21 Amb25265062 [1,0,0,1,0,0|1,0,1]=4 9754 B11R2.1 O=C1NCc2ccccc21 Amb773532 [1,0,0,1,0,0|1,0,0]=3 9755 B11R2.1 O=C1NCc2cccnc21 Amb22276754 [1,0,0,1,0,0|2,0,0]=4 9756 B11R2.1 O=C1NCc2ccncc21 Amb22388464 [1,0,0,1,0,0|2,0,0]=4 9757 B11R2.1 O=C1NCc2ccncc21 Amb32675690 [1,0,0,1,0,0|2,0,0]=4 9758 B11R2.1 O=C1NCc2cnccc21 Amb23455305 [1,0,0,1,0,0|2,0,0]=4 9759 B11R2.1 O=C1NCc2ncccc21 Amb33530547 [1,0,0,1,0,0|2,0,0]=4 9760 B11R2.1 O=C1NNc2ccccc21 Amb19514505 [1,0,0,1,0,0|2,0,0]=4 9761 B11R2.1 O=C1NSc2ccccc21 Amb17933279 [1,0,0,1,0,0|2,0,0]=4 9762 B11R2.1 O=C1OCc2ccccc21 Amb2610613 [1,0,0,1,0,0|0,0,0]=2 9763 B11R2.1 O=C1OCc2cccnc21 Amb24081817 [1,0,0,1,0,0|1,0,0]=3 9764 B11R2.1 O=C1OCc2ccncc21 Amb22732365 [1,0,0,1,0,0|1,0,0]=3 9765 B11R2.1 O=C1OCc2ncccc21 Amb2612059 [1,0,0,1,0,0|1,0,0]=3 9766 B11R2.1 O=C1ONc2ccccc21 Amb26994489 [1,0,0,1,0,0|1,0,0]=3 9767 B11R2.1 O=C1SCc2ccccc21 Amb2421358 [1,0,0,1,0,0|0,1,0]=3 9768 B11R2.1 O=C1SNc2ccccc21 Amb19416440 [1,0,0,1,0,0|1,1,0]=4 9769 B11R2.1 OB1OCc2ccccc21 Amb1027843 [1,0,0,1,0,0|1,0,1]=4 9770 B11R2.1 OC1CCc2ccccc21 Amb9703194 [1,0,0,1,0,0|0,0,2]=4 9771 B11R2.1 OC1OCc2ccccc21 Amb21858794 [1,0,0,1,0,0|0,0,2]=4 9772 B11R2.1 O[C@@H]1CCc2ccccc21 Amb13953023 [1,0,0,1,0,0|0,0,2]=4 9773 B11R2.1 O[C@H]1CCc2ccccc21 Amb13953022 [1,0,0,1,0,0|0,0,2]=4 9774 B11R2.1 S=C1CNc2ccccc21 Amb27791107 [1,0,0,1,0,0|1,1,0]=4 9775 B11R2.1 SC1CCc2ccccc21 Amb9208023 [1,0,0,1,0,0|0,1,1]=4 9776 B11R2.1 [NH3+]C1=NCc2ccccc21 Amb4239931 [1,0,0,1,0,0|2,0,0]=4 9777 B11R2.4 CC1=C(c2ccccc2)N1 Amb28194853 [1,0,0,1,0,0|1,0,1]=4 9778 B11R2.4 CC1OC1c2ccccc2 Amb1129298 [1,0,0,1,0,0|0,0,2]=4 9779 B11R2.4 C[C@@H]1O[C@H]1c2ccccc2 Amb22367029 [1,0,0,1,0,0|0,0,2]=4 9780 B11R2.4 C[C@H]1O[C@@H]1c2ccccc2 Amb22224838 [1,0,0,1,0,0|0,0,2]=4 9781 B11R2.40 BrC1(c2ccccc2)CC1 Amb24743023 [1,0,0,1,0,0|1,0,1]=4 9782 B11R2.40 CC1(c2ccccc2)CC1 Amb24613075 [1,0,0,1,0,0|1,0,1]=4 9783 B11R2.40 CC1(c2ccccc2)CO1 Amb7094910 [1,0,0,1,0,0|1,0,1]=4 9784 B11R2.40 ClC1(c2ccccc2)CC1 Amb17872674 [1,0,0,1,0,0|1,0,1]=4 9785 B11R2.40 ClC1(c2ccccc2)CO1 Amb27210141 [1,0,0,1,0,0|1,0,1]=4 9786 B11R2.40 NC1(c2ccccc2)CC1 Amb1095038 [1,0,0,1,0,0|1,0,1]=4 9787 B11R2.40 NC1(c2ccccc2)CC1 Amb2721355 [1,0,0,1,0,0|1,0,1]=4 9788 B11R2.40 OC1(c2ccccc2)CC1 Amb19374887 [1,0,0,1,0,0|0,0,2]=4 9789 B11R2.40 SC1(c2ccccc2)CC1 Amb33081559 [1,0,0,1,0,0|0,1,1]=4 9790 B11R2.54 CC1C(=O)c2ccccc21 Amb27602983 [1,0,0,1,0,0|0,0,0]=2 9791 B11R2.54 C[C@H]1c2ccccc2[C@@H]1O Amb27484595 [1,0,0,1,0,0|0,0,2]=4 9792 B11R2.54 O=C1C(=O)c2ccccc21 Amb18048412 [1,0,0,1,0,0|1,0,1]=4 9793 B11R2.54 O=C1c2ccccc2C1Cl Amb21948336 [1,0,0,1,0,0|1,0,0]=3 9794 B11R2.54 O=C1c2ccccc2C1O Amb27164695 [1,0,0,1,0,0|1,0,0]=3 9795 B11R2.239 C1=C(c2cccnc2)CC1 Amb32668896 [1,0,0,1,0,0|2,0,0]=4 9796 B11R2.239 c1ccc(C2CCC2)cc1 Amb27466141 [1,0,0,1,0,0|1,0,1]=4 9797 B11R2.239 c1ccc(C2CCN2)cc1 Amb34912959 [1,0,0,1,0,0|1,0,1]=4 9798 B11R2.239 c1ccc(C2CCN2)cc1 Amb6893889 [1,0,0,1,0,0|1,0,1]=4 9799 B11R2.239 c1ccc(C2CCS2)cc1 Amb27839415 [1,0,0,1,0,0|0,1,1]=4 9800 B11R2.239 c1ccc([C@@H]2CCO2)cc1 Amb25721124 [1,0,0,1,0,0|0,0,2]=4 9801 B11R2.239 c1ccc([C@H]2CCN2)cc1 Amb27874787 [1,0,0,1,0,0|1,0,1]=4 9802 B11R2.988 CCC1=Cc2ccccc21 Amb27641412 [1,0,0,1,0,0|1,0,0]=3 9803 B11R2.988 CCC1Cc2ccccc21 Amb24647895 [1,0,0,1,0,0|1,0,1]=4 9804 B11R2.988 COC1=Cc2ccccc21 Amb27267205 [1,0,0,1,0,0|1,0,0]=3 9805 B11R2.988 COC1Cc2ccccc21 Amb24455687 [1,0,0,1,0,0|1,0,1]=4 9806 B11R2.20 C1=CC2=COCN=C2C=N1 Amb27597990 [1,0,0,1,0,0|2,0,0]=4 9807 B11R2.20 C1=CC2=COCN=C2N=C1 Amb27948434 [1,0,0,1,0,0|2,0,0]=4 9808 B11R2.20 C1=Cc2ccccc2CC1 Amb1162229 [1,0,0,1,0,0|1,0,0]=3 9809 B11R2.20 C1=Cc2ccccc2CN1 Amb25999205 [1,0,0,1,0,0|2,0,0]=4 9810 B11R2.20 C1=Cc2ccccc2CO1 Amb27473263 [1,0,0,1,0,0|2,0,0]=4 9811 B11R2.20 C1=Cc2ccccc2NC1 Amb17593383 [1,0,0,1,0,0|2,0,0]=4 9812 B11R2.20 C1=Cc2ccccc2OC1 Amb17844055 [1,0,0,1,0,0|2,0,0]=4 9813 B11R2.20 C1=Cc2ccccc2SC1 Amb27494059 [1,0,0,1,0,0|2,0,0]=4 9814 B11R2.20 C1=NCCc2ccccc21 Amb10603654 [1,0,0,1,0,0|1,0,0]=3 9815 B11R2.20 c1cc2c(cn1)CCOC2 Amb26845927 [1,0,0,1,0,0|1,0,1]=4 9816 B11R2.20 c1cc2c(cn1)COCC2 Amb28255495 [1,0,0,1,0,0|1,0,1]=4 9817 B11R2.20 c1ccc2c(c1)CCCC2 Amb6608921 [1,0,0,1,0,0|1,0,1]=4 9818 B11R2.20 c1ccc2c(c1)CCCN2 Amb1869492 [1,0,0,1,0,0|2,0,0]=4 9819 B11R2.20 c1ccc2c(c1)CCCO2 Amb9677672 [1,0,0,1,0,0|2,0,0]=4 9820 B11R2.20 c1ccc2c(c1)CCNC2 Amb2383348 [1,0,0,1,0,0|1,0,1]=4 9821 B11R2.20 c1ccc2c(c1)CCNC2 Amb2720224 [1,0,0,1,0,0|1,0,1]=4 9822 B11R2.20 c1ccc2c(c1)CCNS2 Amb27421368 [1,0,0,1,0,0|2,0,0]=4 9823 B11R2.20 c1ccc2c(c1)CCOC2 Amb2725513 [1,0,0,1,0,0|0,0,1]=3 9824 B11R2.20 c1ccc2c(c1)CCSO2 Amb27965466 [1,0,0,1,0,0|1,1,0]=4 9825 B11R2.20 c1ccc2c(c1)CNOC2 Amb25997729 [1,0,0,1,0,0|1,0,1]=4 9826 B11R2.20 c1ccc2c(c1)CNOC2 Amb28555648 [1,0,0,1,0,0|1,0,1]=4 9827 B11R2.238 C(=C1CC1)c2ccccc2 Amb19515480 [1,0,0,1,0,0|1,0,0]=3 9828 B11R2.238 c1ccc(CC2CC2)cc1 Amb22490220 [1,0,0,1,0,0|1,0,1]=4 9829 B11R2.238 c1ccc(NC2CC2)cc1 Amb18270529 [1,0,0,1,0,0|2,0,0]=4 9830 B11R2.238 c1ccc(NC2CC2)cc1 Amb32663098 [1,0,0,1,0,0|2,0,0]=4 9831 B11R2.238 c1ccc(SC2CC2)cc1 Amb8514420 [1,0,0,1,0,0|2,0,0]=4 9832 B11R2.106 O=C1CCCc2ccsc21 Amb18831190 [0,0,0,1,1,0|2,0,0]=4 9833 B11R2.106 O=C1CCCc2cscc21 Amb18201211 [0,0,0,1,1,0|2,0,0]=4 9834 B11R2.106 O=C1CCCc2occc21 Amb2427525 [0,0,0,1,1,0|2,0,0]=4 9835 B11R2.106 O=C1CCCc2sccc21 Amb2792478 [0,0,0,1,1,0|2,0,0]=4 9836 B11R2.106 O=C1CCCn2cccc21 Amb22372247 [0,0,0,1,1,0|2,0,0]=4 9837 B11R2.106 O=C1NCCc2ccoc21 Amb18832406 [0,0,0,1,1,0|2,0,0]=4 9838 B11R2.106 O=C1NCCc2ccsc21 Amb18831122 [0,0,0,1,1,0|2,0,0]=4 9839 B11R2.106 O=C1NCCc2cscc21 Amb18831115 [0,0,0,1,1,0|2,0,0]=4 9840 B11R2.106 O=C1NCCc2occc21 Amb23585450 [0,0,0,1,1,0|2,0,0]=4 9841 B11R2.106 O=C1NCCc2sccc21 Amb24410984 [0,0,0,1,1,0|2,0,0]=4 9842 B11R2.106 O=C1NCCn2cccc21 Amb19957767 [0,0,0,1,1,0|2,0,0]=4 9843 B11R2.106 O=C1OCCc2cccn21 Amb27786467 [0,0,0,1,1,0|1,0,0]=3 9844 B11R2.106 O=C1OCCc2ccsc21 Amb26050428 [0,0,0,1,1,0|1,0,0]=3 9845 B11R2.202 CC1CC(=O)c2cccn21 Amb25713030 [0,0,0,1,1,0|2,0,0]=4 9846 B11R2.202 CC1CC(=O)n2cccc21 Amb27667117 [0,0,0,1,1,0|2,0,0]=4 9847 B11R2.202 CC1OC(=O)c2sccc21 Amb27481075 [0,0,0,1,1,0|1,0,0]=3 9848 B11R2.1031 O=C(c1ccco1)C2CC2 Amb17231892 [0,0,0,1,1,0|2,0,0]=4 9849 B11R2.1031 O=C(c1cccs1)C2CC2 Amb2719645 [0,0,0,1,1,0|2,0,0]=4 9850 B11R2.1031 O=C(c1ccoc1)N2CC2 Amb27632703 [0,0,0,1,1,0|2,0,0]=4 9851 B13R2.15 N=C1CCCN1c2ccccc2 Amb7764355 [0,0,0,1,0,1|2,0,0]=4 9852 B13R2.15 N=C1NCCC1c2ccccc2 Amb27791860 [0,0,0,1,0,1|2,0,0]=4 9853 B13R2.15 NC1=NCCN1c2ccccc2 Amb4436538 [0,0,0,1,0,1|2,0,0]=4 9854 B13R2.15 O=C1CCC=C1c2ccccc2 Amb24099094 [0,0,0,1,0,1|1,0,1]=4 9855 B13R2.15 O=C1CCCC1c2ccccc2 Amb17940271 [0,0,0,1,0,1|1,0,0]=3 9856 B13R2.15 O=C1CCCC1c2ccccn2 Amb2793693 [0,0,0,1,0,1|2,0,0]=4 9857 B13R2.15 O=C1CCCC1c2ccccn2 Amb32652718 [0,0,0,1,0,1|2,0,0]=4 9858 B13R2.15 O=C1CCCC1c2cccnc2 Amb18797977 [0,0,0,1,0,1|2,0,0]=4 9859 B13R2.15 O=C1CCCN1c2ccccc2 Amb6357467 [0,0,0,1,0,1|1,0,0]=3 9860 B13R2.15 O=C1CCC[C@H]1c2ccccc2 Amb27175855 [0,0,0,1,0,1|1,0,0]=3 9861 B13R2.15 O=C1CCNC1c2ccccc2 Amb18829957 [0,0,0,1,0,1|2,0,0]=4 9862 B13R2.15 O=C1CCNC1c2ccccc2 Amb22901061 [0,0,0,1,0,1|2,0,0]=4 9863 B13R2.15 O=C1CCNN1c2ccccc2 Amb24621860 [0,0,0,1,0,1|2,0,0]=4 9864 B13R2.15 O=C1CCOC1c2ccccc2 Amb27177705 [0,0,0,1,0,1|2,0,0]=4 9865 B13R2.15 O=C1CNCN1c2ccccc2 Amb24664160 [0,0,0,1,0,1|2,0,0]=4 9866 B13R2.15 O=C1COCC1c2ccccc2 Amb23590154 [0,0,0,1,0,1|2,0,0]=4 9867 B13R2.15 O=C1NCCC1c2ccccc2 Amb17400090 [0,0,0,1,0,1|1,0,0]=3 9868 B13R2.15 O=C1NCCN1c2ccccc2 Amb2695649 [0,0,0,1,0,1|1,0,0]=3 9869 B13R2.15 O=C1NCCN1c2ccccn2 Amb2694446 [0,0,0,1,0,1|2,0,0]=4 9870 B13R2.15 O=C1NCCN1c2cccnc2 Amb9678075 [0,0,0,1,0,1|2,0,0]=4 9871 B13R2.15 O=C1NCCN1c2ccncc2 Amb2446308 [0,0,0,1,0,1|2,0,0]=4 9872 B13R2.15 O=C1NCC[C@@H]1c2ccccc2 Amb28316759 [0,0,0,1,0,1|1,0,0]=3 9873 B13R2.15 O=C1NCC[C@H]1c2ccccc2 Amb27852446 [0,0,0,1,0,1|1,0,0]=3 9874 B13R2.15 O=C1NCOC1c2ccccc2 Amb28243816 [0,0,0,1,0,1|2,0,0]=4 9875 B13R2.15 O=C1OCCC1c2ccccc2 Amb10606603 [0,0,0,1,0,1|0,0,0]=2 9876 B13R2.15 O=C1OCCC1c2ccccn2 Amb22757402 [0,0,0,1,0,1|1,0,0]=3 9877 B13R2.15 O=C1OCCC1c2cccnc2 Amb22757403 [0,0,0,1,0,1|1,0,0]=3 9878 B13R2.15 O=C1OCCC1c2ccncc2 Amb22757401 [0,0,0,1,0,1|1,0,0]=3 9879 B13R2.15 O=C1OCCN1c2ccccc2 Amb2721031 [0,0,0,1,0,1|0,0,0]=2 9880 B13R2.15 O=C1OCCN1c2ncccn2 Amb27462664 [0,0,0,1,0,1|2,0,0]=4 9881 B13R2.15 O=C1ON=CC1c2ccccc2 Amb25891987 [0,0,0,1,0,1|1,0,1]=4 9882 B13R2.15 O=C1ONC=C1c2ccccc2 Amb27843526 [0,0,0,1,0,1|1,0,1]=4 9883 B13R2.15 OC1OCCC1c2ccccc2 Amb22752503 [0,0,0,1,0,1|0,0,2]=4 9884 B13R2.15 S=C1NCCN1c2ccccc2 Amb16192448 [0,0,0,1,0,1|1,1,0]=4 9885 B13R2.15 S=C1SCCN1c2ccccc2 Amb26075076 [0,0,0,1,0,1|0,2,0]=4 9886 B13R2.26 CCCC1=Cc2ccccc2C1 Amb15692407 [0,0,0,1,0,1|2,0,0]=4 9887 B13R2.26 CCCc1cc2ccccc2o1 Amb8503548 [0,0,0,1,0,1|1,0,1]=4 9888 B13R2.26 CCCc1cc2ccccc2s1 Amb27980510 [0,0,0,1,0,1|1,1,0]=4 9889 B13R2.26 CCCc1nc2ccccc2o1 Amb17570040 [0,0,0,1,0,1|1,0,1]=4 9890 B13R2.26 CCNc1nc2ccccc2s1 Amb1106057 [0,0,0,1,0,1|1,1,0]=4 9891 B13R2.26 CCOC1Nc2ccccc2N1 Amb25700310 [0,0,0,1,0,1|1,0,1]=4 9892 B13R2.26 CCOc1nc2cnccc2s1 Amb27789077 [0,0,0,1,0,1|1,1,0]=4 9893 B13R2.26 CCSC1=Nc2ccccc2C1 Amb28243039 [0,0,0,1,0,1|1,1,0]=4 9894 B13R2.26 CCSc1cc2ccccc2s1 Amb28130052 [0,0,0,1,0,1|0,2,0]=4 9895 B13R2.30 CC1NC(=O)C1c2ccccc2 Amb26968702 [0,0,0,1,0,1|1,0,0]=3 9896 B13R2.64 C(=C1/CCCN1)/c2ccccc2 Amb27814288 [0,0,0,1,0,1|2,0,0]=4 9897 B13R2.64 C(=C1CCCC1)c2ccccc2 Amb10606582 [0,0,0,1,0,1|2,0,0]=4 9898 B13R2.64 C1=C(Cc2ccccc2)NCC1 Amb17938862 [0,0,0,1,0,1|2,0,0]=4 9899 B13R2.64 c1ccc(CC2=NCCC2)cc1 Amb24053775 [0,0,0,1,0,1|2,0,0]=4 9900 B13R2.64 c1ccc(CC2=NCCN2)cc1 Amb6334870 [0,0,0,1,0,1|2,0,0]=4 9901 B13R2.64 c1ccc(CC2=NCCN2)cc1 Amb749611 [0,0,0,1,0,1|2,0,0]=4 9902 B13R2.64 c1ccc(CC2=NCCO2)cc1 Amb2429421 [0,0,0,1,0,1|1,0,0]=3 9903 B13R2.64 c1ccc(CC2=NCCS2)cc1 Amb28369846 [0,0,0,1,0,1|1,1,0]=4 9904 B13R2.64 c1ccc(CC2NCCO2)cc1 Amb17506176 [0,0,0,1,0,1|1,0,1]=4 9905 B13R2.64 c1ccc(CC2OCCO2)cc1 Amb8517494 [0,0,0,1,0,1|0,0,2]=4 9906 B13R2.64 c1ccc(N=C2CCCC2)cc1 Amb27986023 [0,0,0,1,0,1|2,0,0]=4 9907 B13R2.64 c1ccc(NC2=NCCC2)cc1 Amb1286041 [0,0,0,1,0,1|2,0,0]=4 9908 B13R2.64 c1ccc(NC2=NCCO2)cc1 Amb25929780 [0,0,0,1,0,1|1,0,0]=3 9909 B13R2.64 c1ccc(NC2=NCCS2)cc1 Amb6599638 [0,0,0,1,0,1|1,1,0]=4 9910 B13R2.64 c1ccc(NC2CCCO2)cc1 Amb27614715 [0,0,0,1,0,1|1,0,1]=4 9911 B13R2.64 c1ccc(OC2CCCO2)cc1 Amb22752483 [0,0,0,1,0,1|1,0,1]=4 9912 B13R2.64 c1ccc(SC2=NCCN2)cc1 Amb27975177 [0,0,0,1,0,1|2,0,0]=4 9913 B13R2.64 c1ccc(SC2CCCO2)cc1 Amb28042934 [0,0,0,1,0,1|1,0,1]=4 9914 B13R2.64 c1cncc(NC2=NCCO2)c1 Amb24442387 [0,0,0,1,0,1|2,0,0]=4 9915 B13R2.135 CCC1C(=O)Cc2ccccc21 Amb28074726 [0,0,0,1,0,1|1,0,0]=3 9916 B13R2.135 CCC1C(=O)Nc2ccccc21 Amb33544575 [0,0,0,1,0,1|1,0,0]=3 9917 B13R2.135 CCC1C(=O)Sc2ccccc21 Amb28385109 [0,0,0,1,0,1|1,0,0]=3 9918 B13R2.135 CCN1=C(C)Sc2ccccc21 Amb17770096 [0,0,0,1,0,1|2,0,0]=4 9919 B13R2.135 CCN1C(=N)Sc2ccccc21 Amb28991077 [0,0,0,1,0,1|2,0,0]=4 9920 B13R2.135 CCN1C(=O)Cc2ccccc21 Amb2416954 [0,0,0,1,0,1|1,0,0]=3 9921 B13R2.135 CCN1C(=O)Cc2cccnc21 Amb28435214 [0,0,0,1,0,1|2,0,0]=4 9922 B13R2.135 CCN1C(=O)Nc2ccccc21 Amb18034265 [0,0,0,1,0,1|1,0,0]=3 9923 B13R2.135 CCN1C(=O)Nc2cnccc21 Amb23454816 [0,0,0,1,0,1|2,0,0]=4 9924 B13R2.135 CCN1C(=O)Nc2ncccc21 Amb27265929 [0,0,0,1,0,1|2,0,0]=4 9925 B13R2.135 CCN1C(=O)Oc2ccccc21 Amb17992087 [0,0,0,1,0,1|1,0,0]=3 9926 B13R2.135 CCN1C(=O)Oc2cccnc21 Amb18407345 [0,0,0,1,0,1|2,0,0]=4 9927 B13R2.135 CCN1C(=S)Nc2ccccc21 Amb19866712 [0,0,0,1,0,1|1,1,0]=4 9928 B13R2.135 CCN1C(=S)Oc2ccccc21 Amb27953596 [0,0,0,1,0,1|1,1,0]=4 9929 B13R2.135 CC[n+]1c(C)oc2ccccc21 Amb4019873 [0,0,0,1,0,1|2,0,0]=4 9930 B13R2.135 CC[n+]1c(C)sc2ccccc21 Amb4322943 [0,0,0,1,0,1|2,0,0]=4 9931 B13R2.135 CC[n+]1c(C)sc2ccccc21 Amb616049 [0,0,0,1,0,1|2,0,0]=4 9932 B13R2.135 CC[n+]1c(Cl)oc2ccccc21 Amb6365024 [0,0,0,1,0,1|2,0,0]=4 9933 B13R2.135 CCc1c(Br)oc2ccccc12 Amb18754591 [0,0,0,1,0,1|2,0,0]=4 9934 B13R2.135 CCc1c(C)sc2ccccc12 Amb27962459 [0,0,0,1,0,1|2,0,0]=4 9935 B13R2.135 CCc1c(S)sc2ccccc12 Amb27200139 [0,0,0,1,0,1|1,1,0]=4 9936 B13R2.135 CCn1c(C)cc2ccccc21 Amb6773014 [0,0,0,1,0,1|2,0,0]=4 9937 B13R2.135 CCn1c(Cl)nc2ccccc21 Amb8485511 [0,0,0,1,0,1|2,0,0]=4 9938 B13R2.135 CCn1c(F)nc2ccccc21 Amb33495919 [0,0,0,1,0,1|2,0,0]=4 9939 B13R2.135 CCn1c(I)nc2ccccc21 Amb10563867 [0,0,0,1,0,1|2,0,0]=4 9940 B13R2.135 CCn1c(N)nc2ccccc21 Amb6322322 [0,0,0,1,0,1|2,0,0]=4 9941 B13R2.135 CCn1c(S)nc2ccccc21 Amb1104433 [0,0,0,1,0,1|1,1,0]=4 9942 B13R2.135 CNC1C(=O)Nc2ccccc21 Amb1113865 [0,0,0,1,0,1|2,0,0]=4 9943 B13R2.135 CNC1C(=O)Oc2ccccc21 Amb2795868 [0,0,0,1,0,1|2,0,0]=4 9944 B13R2.135 CNN1C(=O)Cc2ccccc21 Amb27774884 [0,0,0,1,0,1|2,0,0]=4 9945 B13R2.135 CNN1C(=O)Nc2ccccc21 Amb27640738 [0,0,0,1,0,1|2,0,0]=4 9946 B13R2.135 COC1C(=O)Cc2ccccc21 Amb28246573 [0,0,0,1,0,1|2,0,0]=4 9947 B13R2.135 CO[C@H]1C(=O)Nc2ccccc21 Amb28396684 [0,0,0,1,0,1|2,0,0]=4 9948 B13R2.135 C\C=C1\C(=O)Oc2ccccc21 Amb27816657 [0,0,0,1,0,1|1,0,1]=4 9949 B13R2.135 NCC1C(=O)Nc2ccccc21 Amb22001506 [0,0,0,1,0,1|2,0,0]=4 9950 B13R2.135 NCC1C(=O)Nc2ccccc21 Amb3941289 [0,0,0,1,0,1|2,0,0]=4 9951 B13R2.135 O=C1Cc2ccccc2N1CO Amb2720626 [0,0,0,1,0,1|2,0,0]=4 9952 B13R2.135 O=C1Oc2ccccc2N1CCl Amb19773104 [0,0,0,1,0,1|2,0,0]=4 9953 B13R2.135 O=C1Sc2ccccc2N1CO Amb21961868 [0,0,0,1,0,1|2,0,0]=4 9954 B13R2.138 CCC1=C(c2ccccc2)C1=O Amb27176039 [0,0,0,1,0,1|1,0,0]=3 9955 B13R2.138 COC1=C(c2ccccc2)C1=O Amb27748603 [0,0,0,1,0,1|2,0,0]=4 9956 B13R2.163 N=C1CCCc2ccccc2N1 Amb8507493 [0,0,0,1,0,1|2,0,0]=4 9957 B13R2.163 O=C1CCCc2ccccc2C1 Amb6360022 [0,0,0,1,0,1|1,0,0]=3 9958 B13R2.163 O=C1CCCc2ccccc2N1 Amb1077569 [0,0,0,1,0,1|1,0,0]=3 9959 B13R2.163 O=C1CCCc2ccccc2O1 Amb22900954 [0,0,0,1,0,1|1,0,0]=3 9960 B13R2.163 O=C1CCCc2cccnc2N1 Amb21962431 [0,0,0,1,0,1|2,0,0]=4 9961 B13R2.163 O=C1CCCc2ccncc2N1 Amb28074006 [0,0,0,1,0,1|2,0,0]=4 9962 B13R2.163 O=C1CCCc2ncccc2N1 Amb28319382 [0,0,0,1,0,1|2,0,0]=4 9963 B13R2.163 O=C1CCNc2ccccc2C1 Amb18829955 [0,0,0,1,0,1|2,0,0]=4 9964 B13R2.163 O=C1CCNc2ccccc2N1 Amb1666975 [0,0,0,1,0,1|2,0,0]=4 9965 B13R2.163 O=C1CCOc2ccccc2C1 Amb24352115 [0,0,0,1,0,1|2,0,0]=4 9966 B13R2.163 O=C1CCOc2ccccc2N1 Amb10608982 [0,0,0,1,0,1|2,0,0]=4 9967 B13R2.163 O=C1CCSc2ccccc2C1 Amb25878594 [0,0,0,1,0,1|2,0,0]=4 9968 B13R2.163 O=C1CCSc2ccccc2N1 Amb1154582 [0,0,0,1,0,1|2,0,0]=4 9969 B13R2.163 O=C1CNCc2ccccc2N1 Amb17606145 [0,0,0,1,0,1|2,0,0]=4 9970 B13R2.163 O=C1CNCc2ccccc2N1 Amb28872408 [0,0,0,1,0,1|2,0,0]=4 9971 B13R2.163 O=C1COCc2ccccc2N1 Amb19516346 [0,0,0,1,0,1|2,0,0]=4 9972 B13R2.163 O=C1Cc2ccccc2CCN1 Amb16203437 [0,0,0,1,0,1|1,0,0]=3 9973 B13R2.163 O=C1NCCc2ccccc2N1 Amb25869873 [0,0,0,1,0,1|1,0,0]=3 9974 B13R2.163 O=C1Nc2ccccc2C=NO1 Amb28255633 [0,0,0,1,0,1|1,0,1]=4 9975 B13R2.163 O=C1OC=Nc2ccccc2O1 Amb24376626 [0,0,0,1,0,1|1,0,1]=4 9976 B13R2.328 C=C1OC(=O)Nc2ccccc21 Amb24497158 [0,0,0,1,0,1|0,0,2]=4 9977 B13R2.328 CC1=C2C=CC=CC2=CC(=O)N1 Amb22371049 [0,0,0,1,0,1|1,0,1]=4 9978 B13R2.328 CC1=C2C=CC=CC2=NC(=O)N1 Amb22493795 [0,0,0,1,0,1|1,0,1]=4 9979 B13R2.328 CC1=CC(=O)Cc2ccccc21 Amb28287006 [0,0,0,1,0,1|1,0,1]=4 9980 B13R2.328 CC1=CC(=O)Nc2ccccc21 Amb19654011 [0,0,0,1,0,1|1,0,1]=4 9981 B13R2.328 CC1=CC(=O)Oc2ccccc21 Amb20001467 [0,0,0,1,0,1|1,0,1]=4 9982 B13R2.328 CC1CC(=O)Cc2ccccc21 Amb17594002 [0,0,0,1,0,1|1,0,0]=3 9983 B13R2.328 CC1CC(=O)Nc2ccccc21 Amb17836212 [0,0,0,1,0,1|1,0,0]=3 9984 B13R2.328 CC1CC(Br)=Cc2ccccc21 Amb27770920 [0,0,0,1,0,1|2,0,0]=4 9985 B13R2.328 CC1NC(=O)Cc2ccccc21 Amb23454628 [0,0,0,1,0,1|1,0,0]=3 9986 B13R2.328 CC1NC(=O)Nc2ccccc21 Amb22756019 [0,0,0,1,0,1|1,0,0]=3 9987 B13R2.328 CC1OC(=O)Nc2nnccc21 Amb27752087 [0,0,0,1,0,1|2,0,0]=4 9988 B13R2.328 CC1SC(N)=Nc2ccccc21 Amb27668842 [0,0,0,1,0,1|1,1,0]=4 9989 B13R2.328 CN1CC(=O)Nc2ccccc21 Amb21864918 [0,0,0,1,0,1|2,0,0]=4 9990 B13R2.328 NC1CC(=O)Nc2ccccc21 Amb10607650 [0,0,0,1,0,1|2,0,0]=4 9991 B13R2.328 NC1CC(=O)Nc2ccccc21 Amb22586933 [0,0,0,1,0,1|2,0,0]=4 9992 B13R2.328 O=C1CC(O)c2ccccc2N1 Amb27592921 [0,0,0,1,0,1|2,0,0]=4 9993 B13R2.328 O=C1CC(O)c2ccccc2O1 Amb8385084 [0,0,0,1,0,1|2,0,0]=4 9994 B13R2.328 O=C1Cc2ccccc2C(=O)O1 Amb1157145 [0,0,0,1,0,1|1,0,1]=4 9995 B13R2.328 O=C1Nc2ccccc2C(=O)O1 Amb18183505 [0,0,0,1,0,1|1,0,1]=4 9996 B13R2.444 O=C(C[n+]1ccccc1)C2CC2 Amb32455761 [0,0,0,1,0,1|2,0,0]=4 9997 B13R2.444 O=C(C[n+]1ccccc1)C2CC2 Amb6344352 [0,0,0,1,0,1|2,0,0]=4 9998 B13R2.444 O=C(Cc1ccccc1)C2CC2 Amb18034012 [0,0,0,1,0,1|1,0,0]=3 9999 B13R2.444 O=C(Cc1ccccn1)C2CC2 Amb9205932 [0,0,0,1,0,1|2,0,0]=4 10000 B13R2.444 O=C(Cc1cccnc1)C2CC2 Amb24717716 [0,0,0,1,0,1|2,0,0]=4 10001 B13R2.444 O=C(Nc1ccccc1)C2CC2 Amb3108112 [0,0,0,1,0,1|1,0,0]=3 10002 B13R2.444 O=C(Nc1ccccc1)C2CO2 Amb24377141 [0,0,0,1,0,1|2,0,0]=4 10003 B13R2.444 O=C(Oc1ccccc1)C2CC2 Amb27178730 [0,0,0,1,0,1|1,0,0]=3 10004 B13R2.444 O=C(Oc1cccnc1)C2CC2 Amb27437128 [0,0,0,1,0,1|2,0,0]=4 10005 B13R2.444 O=C(Oc1ccncc1)C2CC2 Amb27946657 [0,0,0,1,0,1|2,0,0]=4 10006 B13R2.2283 O=C(C1C=CC=CC=C1)C2CC2 Amb28126583 [0,0,0,1,0,1|1,0,1]=4 10007 B13R2.4023 CC1=CC(=O)C2=CC=CC=CN12 Amb27781074 [0,0,0,1,0,1|1,0,1]=4 10008 B13R2.1 CCCc1noc2ccccc12 Amb27225179 [0,1,0,1,0,0|1,0,1]=4 10009 B13R2.1 CCNc1coc2ccccc12 Amb25119969 [0,1,0,1,0,0|1,0,1]=4 10010 B13R2.1 CCNc1csc2ccccc12 Amb25820242 [0,1,0,1,0,0|1,1,0]=4 10011 B13R2.1 CCNc1noc2ccccc12 Amb27454266 [0,1,0,1,0,0|1,0,1]=4 10012 B13R2.1 CCNc1nsc2ccccc12 Amb24066790 [0,1,0,1,0,0|1,1,0]=4 10013 B13R2.1 CCNc1nsc2ccccc12 Amb24488581 [0,1,0,1,0,0|1,1,0]=4 10014 B13R2.1 CCOc1coc2cccnc12 Amb27954718 [0,1,0,1,0,0|1,0,1]=4 10015 B13R2.1 CCOc1nsc2ccccc12 Amb27962492 [0,1,0,1,0,0|0,1,0]=3 10016 B13R2.1 CCSc1snc2ccccc12 Amb28436328 [0,1,0,1,0,0|0,2,0]=4 10017 B13R2.3 C1=C(c2ccccc2)CCCC1 Amb8513291 [0,1,0,1,0,0|2,0,0]=4 10018 B13R2.3 C1=C(c2ccccc2)CCNC1 Amb1153094 [0,1,0,1,0,0|2,0,0]=4 10019 B13R2.3 C1=C(c2ccccc2)CCNC1 Amb535503 [0,1,0,1,0,0|2,0,0]=4 10020 B13R2.3 C1=C(c2ccccc2)CCOC1 Amb21960770 [0,1,0,1,0,0|2,0,0]=4 10021 B13R2.3 C1=C(c2ccccc2)CNCC1 Amb18645223 [0,1,0,1,0,0|2,0,0]=4 10022 B13R2.3 C1=C(c2ccccc2)CNCC1 Amb28600223 [0,1,0,1,0,0|2,0,0]=4 10023 B13R2.3 C1=C(c2ccncc2)CCCO1 Amb24669868 [0,1,0,1,0,0|2,0,0]=4 10024 B13R2.3 c1ccc(B2OCCCO2)cc1 Amb3939182 [0,1,0,1,0,0|1,0,1]=4 10025 B13R2.3 c1ccc(C2=NCCCN2)cc1 Amb423875 [0,1,0,1,0,0|2,0,0]=4 10026 B13R2.3 c1ccc(C2=NCOCS2)cc1 Amb28385443 [0,1,0,1,0,0|1,1,0]=4 10027 B13R2.3 c1ccc(C2=NNCCO2)cc1 Amb27808595 [0,1,0,1,0,0|1,0,0]=3 10028 B13R2.3 c1ccc(C2=[S+]CCCS2)cc1 Amb28294166 [0,1,0,1,0,0|0,2,0]=4 10029 B13R2.3 c1ccc(C2CCNCO2)cc1 Amb26517864 [0,1,0,1,0,0|1,0,1]=4 10030 B13R2.3 c1ccc(C2CCOCO2)cc1 Amb6357160 [0,1,0,1,0,0|1,0,1]=4 10031 B13R2.3 c1ccc(C2CNCCO2)cc1 Amb1782012 [0,1,0,1,0,0|1,0,1]=4 10032 B13R2.3 c1ccc(C2CNCCO2)cc1 Amb7085744 [0,1,0,1,0,0|1,0,1]=4 10033 B13R2.3 c1ccc(C2COCCN2)cc1 Amb10068848 [0,1,0,1,0,0|1,0,1]=4 10034 B13R2.3 c1ccc(C2COCCN2)cc1 Amb18528726 [0,1,0,1,0,0|1,0,1]=4 10035 B13R2.3 c1ccc(C2COCCN2)cc1 Amb5750999 [0,1,0,1,0,0|1,0,1]=4 10036 B13R2.3 c1ccc(C2NCCCO2)cc1 Amb17334580 [0,1,0,1,0,0|1,0,1]=4 10037 B13R2.3 c1ccc(C2NCCCO2)cc1 Amb22901047 [0,1,0,1,0,0|1,0,1]=4 10038 B13R2.3 c1ccc(C2OCCCO2)cc1 Amb9787462 [0,1,0,1,0,0|0,0,2]=4 10039 B13R2.3 c1ccc(C2OCCCS2)cc1 Amb26967490 [0,1,0,1,0,0|0,1,1]=4 10040 B13R2.3 c1ccc(N2OCCCO2)cc1 Amb2612718 [0,1,0,1,0,0|1,0,1]=4 10041 B13R2.3 c1ccc([C@@H]2CCOCO2)cc1 Amb22226715 [0,1,0,1,0,0|1,0,1]=4 10042 B13R2.3 c1ccc([C@@H]2CNCCO2)cc1 Amb19889425 [0,1,0,1,0,0|1,0,1]=4 10043 B13R2.3 c1ccc([C@@H]2CNCCO2)cc1 Amb22899094 [0,1,0,1,0,0|1,0,1]=4 10044 B13R2.3 c1ccc([C@@H]2COCCN2)cc1 Amb20242902 [0,1,0,1,0,0|1,0,1]=4 10045 B13R2.3 c1ccc([C@@H]2COCCN2)cc1 Amb22274558 [0,1,0,1,0,0|1,0,1]=4 10046 B13R2.3 c1ccc([C@H]2CCOCO2)cc1 Amb27425306 [0,1,0,1,0,0|1,0,1]=4 10047 B13R2.3 c1ccc([C@H]2CNCCO2)cc1 Amb27809067 [0,1,0,1,0,0|1,0,1]=4 10048 B13R2.3 c1ccc([C@H]2CNCCO2)cc1 Amb34913338 [0,1,0,1,0,0|1,0,1]=4 10049 B13R2.3 c1ccc([C@H]2COCCN2)cc1 Amb20242901 [0,1,0,1,0,0|1,0,1]=4 10050 B13R2.3 c1ccc([C@H]2COCCN2)cc1 Amb24077482 [0,1,0,1,0,0|1,0,1]=4 10051 B13R2.10 CC1C=C(c2ccccc2)N=N1 Amb21952771 [0,1,0,1,0,0|2,0,0]=4 10052 B13R2.10 CC1CNC(c2ccccc2)=N1 Amb26995716 [0,1,0,1,0,0|2,0,0]=4 10053 B13R2.10 CC1COC(c2ccccc2)O1 Amb576780 [0,1,0,1,0,0|0,0,2]=4 10054 B13R2.10 CC1COC(c2ccccn2)=N1 Amb27441308 [0,1,0,1,0,0|2,0,0]=4 10055 B13R2.10 CC1NC(c2ccccc2)CO1 Amb27790805 [0,1,0,1,0,0|1,0,1]=4 10056 B13R2.10 CN1CC=C(c2ccccc2)C1 Amb22235338 [0,1,0,1,0,0|2,0,0]=4 10057 B13R2.10 C[C@H]1CO[C@@H](c2ccccc2)N1 Amb28399456 [0,1,0,1,0,0|1,0,1]=4 10058 B13R2.10 Cc1cc(-c2ccccc2)no1 Amb10553849 [0,1,0,1,0,0|1,0,1]=4 10059 B13R2.10 Cc1cc(-c2ccccc2)on1 Amb1893875 [0,1,0,1,0,0|1,0,1]=4 10060 B13R2.10 Cc1coc(-c2ccccc2)n1 Amb7990046 [0,1,0,1,0,0|1,0,1]=4 10061 B13R2.10 Cc1nc(-c2ccccc2)co1 Amb17400054 [0,1,0,1,0,0|1,0,1]=4 10062 B13R2.10 Cc1nc(-c2ccccc2)no1 Amb2766523 [0,1,0,1,0,0|1,0,1]=4 10063 B13R2.10 Cc1ncc(-c2ccccc2)o1 Amb4139870 [0,1,0,1,0,0|1,0,1]=4 10064 B13R2.10 Cc1noc(-c2ccccc2)n1 Amb2610736 [0,1,0,1,0,0|1,0,1]=4 10065 B13R2.10 ClC1COC(c2ccccc2)C1 Amb27770148 [0,1,0,1,0,0|1,0,1]=4 10066 B13R2.10 Cl[C@@H]1CO[C@@H](c2ccccc2)C1 Amb27478037 [0,1,0,1,0,0|1,0,1]=4 10067 B13R2.10 Cl[C@@H]1CO[C@H](c2ccccc2)C1 Amb28458554 [0,1,0,1,0,0|1,0,1]=4 10068 B13R2.10 NC1C=C(c2ccccc2)CC1 Amb27642483 [0,1,0,1,0,0|2,0,0]=4 10069 B13R2.10 O=C1CN=C(c2ccccc2)O1 Amb3987291 [0,1,0,1,0,0|1,0,1]=4 10070 B13R2.10 O=C1COC(c2ccccc2)=N1 Amb27606825 [0,1,0,1,0,0|1,0,1]=4 10071 B13R2.10 OC1CCC(c2ccccc2)O1 Amb22752551 [0,1,0,1,0,0|1,0,1]=4 10072 B13R2.10 OC1CC[C@@H](c2ccccc2)O1 Amb26320377 [0,1,0,1,0,0|1,0,1]=4 10073 B13R2.10 OC1COC(c2ccccc2)C1 Amb27951078 [0,1,0,1,0,0|1,0,1]=4 10074 B13R2.10 OC1CO[C@H](c2ccccc2)C1 Amb27983221 [0,1,0,1,0,0|1,0,1]=4 10075 B13R2.10 OC1CSC(c2ccccc2)=N1 Amb28321501 [0,1,0,1,0,0|1,1,0]=4 10076 B13R2.679 O=CC(=C1CC1)c2ccccc2 Amb27798262 [0,1,0,1,0,0|1,0,0]=3 10077 B13R2.679 O=CC(c1ccccc1)C2CC2 Amb17232322 [0,1,0,1,0,0|1,0,1]=4 10078 B13R2.679 O\N=C(/c1ccccc1)C2CC2 Amb6893026 [0,1,0,1,0,0|1,0,1]=4 10079 B13R2.679 O\N=C(\c1ccccc1)C2CC2 Amb10606515 [0,1,0,1,0,0|1,0,1]=4 10080 B13R2.1613 BrCC1=CCCc2ccccc21 Amb27178526 [0,1,0,1,0,0|2,0,0]=4 10081 B13R2.1613 BrCC1OCCc2ccccc21 Amb19373964 [0,1,0,1,0,0|1,0,1]=4 10082 B13R2.1613 CCC1=NCCc2ccccc21 Amb25035624 [0,1,0,1,0,0|2,0,0]=4 10083 B13R2.1613 CNC1=NCCc2ccccc21 Amb28240971 [0,1,0,1,0,0|2,0,0]=4 10084 B13R2.1613 CNC1OCCc2ccccc21 Amb27462176 [0,1,0,1,0,0|1,0,1]=4 10085 B13R2.1613 COC1=CCCc2ccccc21 Amb8392114 [0,1,0,1,0,0|1,0,1]=4 10086 B13R2.1613 COC1=NCCc2ccccc21 Amb24665738 [0,1,0,1,0,0|1,0,1]=4 10087 B13R2.1613 COC1OCCc2ccccc21 Amb22284603 [0,1,0,1,0,0|0,0,2]=4 10088 B13R2.1613 ClCC1=CCCc2ccccc21 Amb28423479 [0,1,0,1,0,0|2,0,0]=4 10089 B13R2.1613 ClCC1=NCCc2ccccc21 Amb17506200 [0,1,0,1,0,0|2,0,0]=4 10090 B13R2.1613 ClCC1=NCCc2ccccc21 Amb506434 [0,1,0,1,0,0|2,0,0]=4 10091 B13R2.1613 ClCC1OCCc2ccccc21 Amb25238351 [0,1,0,1,0,0|1,0,1]=4 10092 B13R2.1613 ICC1OCCc2ccccc21 Amb27769994 [0,1,0,1,0,0|1,0,1]=4 10093 B13R2.1613 N#CC1=CCCc2ccccc21 Amb17232153 [0,1,0,1,0,0|2,0,0]=4 10094 B13R2.1613 N#CC1OCCc2ccccc21 Amb4084976 [0,1,0,1,0,0|1,0,1]=4 10095 B13R2.1613 NCC1=CCCc2ccccc21 Amb2699521 [0,1,0,1,0,0|2,0,0]=4 10096 B13R2.1613 NCC1=NCCc2ccccc21 Amb29848147 [0,1,0,1,0,0|2,0,0]=4 10097 B13R2.1613 NCC1OCCc2ccccc21 Amb4241964 [0,1,0,1,0,0|1,0,1]=4 10098 B13R2.1613 NCC1OCCc2ccccc21 Amb6565445 [0,1,0,1,0,0|1,0,1]=4 10099 B13R2.1613 NNC1=NCCc2ccccc21 Amb18126292 [0,1,0,1,0,0|2,0,0]=4 10100 B13R2.1613 N\N=C1\CCCc2ccccc21 Amb27664746 [0,1,0,1,0,0|2,0,0]=4 10101 B13R2.1613 O=CC1=CCCc2ccccc21 Amb18645053 [0,1,0,1,0,0|1,0,0]=3 10102 B13R2.1613 O=CC1CCCc2ccccc21 Amb18787961 [0,1,0,1,0,0|1,0,1]=4 10103 B13R2.1613 O=CC1NCCc2ccccc21 Amb28125733 [0,1,0,1,0,0|1,0,1]=4 10104 B13R2.1613 O=CC1OCCc2ccccc21 Amb18645642 [0,1,0,1,0,0|0,0,1]=3 10105 B13R2.1613 O=CN1CCCc2ccccc21 Amb2701277 [0,1,0,1,0,0|2,0,0]=4 10106 B13R2.1613 O=C[C@H]1OCCc2ccccc21 Amb28144164 [0,1,0,1,0,0|0,0,1]=3 10107 B13R2.1613 OCC1OCCc2ccccc21 Amb1094003 [0,1,0,1,0,0|0,0,2]=4 10108 B13R2.1613 O\N=C1/CCCc2ccccc21 Amb22727930 [0,1,0,1,0,0|1,0,1]=4 10109 B13R2.1613 O\N=C1\CCCc2ccccc21 Amb6296018 [0,1,0,1,0,0|1,0,1]=4 10110 B13R2.1613 SCC1OCCc2ccccc21 Amb25152461 [0,1,0,1,0,0|0,1,1]=4 10111 B13R2.1613 [NH3+]CC1OCCc2ccccc21 Amb5363177 [0,1,0,1,0,0|1,0,1]=4 10112 B13R2.2532 CC1OC1(C=O)c2ccccc2 Amb28202228 [0,1,0,1,0,0|0,0,1]=3 10113 B13R2.2539 N#CC1(c2ccccc2)CCO1 Amb22497350 [0,1,0,1,0,0|1,0,1]=4 10114 B13R2.2539 NCC1(c2ccccc2)CCO1 Amb32680389 [0,1,0,1,0,0|1,0,1]=4 10115 B13R2.2539 O=CC1(c2ccccc2)CCC1 Amb17594006 [0,1,0,1,0,0|1,0,1]=4 10116 B13R2.2931 C=C1OC(CN)c2ccccc21 Amb28240872 [0,1,0,1,0,0|1,0,0]=3 10117 B13R2.2931 CC1C=C(C#N)c2ccccc21 Amb17232154 [0,1,0,1,0,0|2,0,0]=4 10118 B13R2.2931 CCC1CC(=O)c2ccccc21 Amb17232326 [0,1,0,1,0,0|1,0,0]=3 10119 B13R2.2931 CCC1NC(=O)c2ccccc21 Amb27785371 [0,1,0,1,0,0|1,0,0]=3 10120 B13R2.2931 CCC1NC(=S)c2ccccc21 Amb28435590 [0,1,0,1,0,0|1,1,0]=4 10121 B13R2.2931 CCN1NC(=O)c2cccnc21 Amb27796572 [0,1,0,1,0,0|2,0,0]=4 10122 B13R2.2931 CC[C@H]1OC(O)c2ccccc21 Amb27805063 [0,1,0,1,0,0|0,0,2]=4 10123 B13R2.2931 CCn1cc(C)c2ccccc21 Amb17672668 [0,1,0,1,0,0|2,0,0]=4 10124 B13R2.2931 CCn1cc(N)c2ccccc21 Amb32698532 [0,1,0,1,0,0|2,0,0]=4 10125 B13R2.2931 CCn1nc(Br)c2ccccc21 Amb22751457 [0,1,0,1,0,0|2,0,0]=4 10126 B13R2.2931 CCn1nc(C)c2ccccc21 Amb27201266 [0,1,0,1,0,0|2,0,0]=4 10127 B13R2.2931 CCn1nc(N)c2ccccc21 Amb10608066 [0,1,0,1,0,0|2,0,0]=4 10128 B13R2.2931 CNC1=NC(=O)c2ccccc21 Amb25295230 [0,1,0,1,0,0|1,0,1]=4 10129 B13R2.2931 COC1=CC(C)c2ccccc21 Amb17778898 [0,1,0,1,0,0|1,0,1]=4 10130 B13R2.2931 COC1C=C(C)c2ccccc21 Amb17844048 [0,1,0,1,0,0|2,0,0]=4 10131 B13R2.2931 COC1CC(=O)c2ccccc21 Amb26625933 [0,1,0,1,0,0|1,0,0]=3 10132 B13R2.2931 COC1OC(=O)c2ccccc21 Amb2611631 [0,1,0,1,0,0|0,0,0]=2 10133 B13R2.2931 CO[IH2]1OC(=O)c2ccccc21 Amb27393085 [0,1,0,1,0,0|1,0,0]=3 10134 B13R2.2931 C\C=C1/NC(=O)c2ccccc21 Amb27770785 [0,1,0,1,0,0|1,0,1]=4 10135 B13R2.2931 C\C=C1\NC(=O)c2ccccc21 Amb28052972 [0,1,0,1,0,0|1,0,1]=4 10136 B13R2.2931 Cn1cc(C=O)c2ccccc21 Amb1147112 [0,1,0,1,0,0|2,0,0]=4 10137 B13R2.2931 Cn1nc(C=O)c2ccccc21 Amb2723099 [0,1,0,1,0,0|2,0,0]=4 10138 B13R2.2931 N#CC1CC(=O)c2ccccc21 Amb17400022 [0,1,0,1,0,0|1,0,1]=4 10139 B13R2.2931 N#CC1OC(=O)c2ccccc21 Amb19889006 [0,1,0,1,0,0|0,0,1]=3 10140 B13R2.2931 N#C[IH2]1OC(=O)c2ccccc21 Amb10071693 [0,1,0,1,0,0|1,0,1]=4 10141 B13R2.2931 NCC1CC(=O)c2ccccc21 Amb17400089 [0,1,0,1,0,0|1,0,0]=3 10142 B13R2.2931 NCC1OB(O)c2ccccc21 Amb26919312 [0,1,0,1,0,0|1,0,1]=4 10143 B13R2.2931 NCC1OB(O)c2ccccc21 Amb28653081 [0,1,0,1,0,0|1,0,1]=4 10144 B13R2.2931 NCC1OC(=O)c2ccccc21 Amb27601246 [0,1,0,1,0,0|0,0,0]=2 10145 B13R2.2931 NC[C@@H]1OB(O)c2ccccc21 Amb27254271 [0,1,0,1,0,0|1,0,1]=4 10146 B13R2.2931 O=C1CC(CBr)c2ccccc21 Amb22489708 [0,1,0,1,0,0|1,0,0]=3 10147 B13R2.2931 O=C1C[C@H](CO)c2ccccc21 Amb27199082 [0,1,0,1,0,0|1,0,0]=3 10148 B13R2.2931 O=C1OC(CI)c2ccccc21 Amb28188727 [0,1,0,1,0,0|0,0,0]=2 10149 B13R2.2931 O=C1OC(CO)c2ccccc21 Amb27175627 [0,1,0,1,0,0|0,0,0]=2 10150 B13R2.2931 O=C1ON(CO)c2ccccc21 Amb27178555 [0,1,0,1,0,0|1,0,0]=3 10151 B13R2.2956 CCOC1C(=O)c2ccccc21 Amb28253679 [0,1,0,1,0,0|0,0,0]=2 10152 B13R2.12 Brc1ccc(C2=CCCC2)cc1 Amb22227905 [0,1,0,1,0,0|2,0,0]=4 10153 B13R2.12 Brc1ccc(C2=NCCC2)cc1 Amb8394087 [0,1,0,1,0,0|2,0,0]=4 10154 B13R2.12 Brc1ccc(C2=NCCN2)cc1 Amb8480356 [0,1,0,1,0,0|2,0,0]=4 10155 B13R2.12 Brc1ccc(C2=NCCO2)cc1 Amb8512154 [0,1,0,1,0,0|1,0,0]=3 10156 B13R2.12 Brc1ccc(C2=NCCS2)cc1 Amb4032685 [0,1,0,1,0,0|1,1,0]=4 10157 B13R2.12 Brc1ccc(C2CCCO2)cc1 Amb17343724 [0,1,0,1,0,0|1,0,1]=4 10158 B13R2.12 Brc1ccc(C2NCCO2)cc1 Amb17344018 [0,1,0,1,0,0|1,0,1]=4 10159 B13R2.12 Brc1ccc(C2OCCO2)cc1 Amb3939647 [0,1,0,1,0,0|0,0,2]=4 10160 B13R2.12 Cc1ccc(B2OCCO2)cc1 Amb7365416 [0,1,0,1,0,0|1,0,1]=4 10161 B13R2.12 Cc1ccc(C2=CCCC2)cc1 Amb27162066 [0,1,0,1,0,0|2,0,0]=4 10162 B13R2.12 Cc1ccc(C2=NCCC2)cc1 Amb24053769 [0,1,0,1,0,0|2,0,0]=4 10163 B13R2.12 Cc1ccc(C2=NCCN2)cc1 Amb6751795 [0,1,0,1,0,0|2,0,0]=4 10164 B13R2.12 Cc1ccc(C2=NCCS2)cc1 Amb4032846 [0,1,0,1,0,0|1,1,0]=4 10165 B13R2.12 Cc1ccc(C2CCCO2)cc1 Amb17334569 [0,1,0,1,0,0|1,0,1]=4 10166 B13R2.12 Cc1ccc(C2NCCO2)cc1 Amb17334583 [0,1,0,1,0,0|1,0,1]=4 10167 B13R2.12 Cc1ccc(C2OCCO2)cc1 Amb17334608 [0,1,0,1,0,0|0,0,2]=4 10168 B13R2.12 Cc1ccc(C2OCCS2)cc1 Amb27398141 [0,1,0,1,0,0|0,1,1]=4 10169 B13R2.12 Clc1ccc(C2=CCCC2)cc1 Amb28385450 [0,1,0,1,0,0|2,0,0]=4 10170 B13R2.12 Clc1ccc(C2=NCCC2)cc1 Amb8394086 [0,1,0,1,0,0|2,0,0]=4 10171 B13R2.12 Clc1ccc(C2=NCCN2)cc1 Amb6892256 [0,1,0,1,0,0|2,0,0]=4 10172 B13R2.12 Clc1ccc(C2=NCCO2)cc1 Amb2613770 [0,1,0,1,0,0|1,0,0]=3 10173 B13R2.12 Clc1ccc(C2=[SH]CCN2)cc1 Amb33513303 [0,1,0,1,0,0|1,1,0]=4 10174 B13R2.12 Clc1ccc(C2CCCO2)cc1 Amb17335592 [0,1,0,1,0,0|1,0,1]=4 10175 B13R2.12 Clc1ccc(C2NCCO2)cc1 Amb17335657 [0,1,0,1,0,0|1,0,1]=4 10176 B13R2.12 Clc1ccc(C2OCCO2)cc1 Amb10569622 [0,1,0,1,0,0|0,0,2]=4 10177 B13R2.12 Fc1ccc(B2OCCO2)cc1 Amb7365397 [0,1,0,1,0,0|1,0,1]=4 10178 B13R2.12 Fc1ccc(C2=NCCC2)cc1 Amb23578424 [0,1,0,1,0,0|2,0,0]=4 10179 B13R2.12 Fc1ccc(C2=NCCN2)cc1 Amb18563604 [0,1,0,1,0,0|2,0,0]=4 10180 B13R2.12 Fc1ccc(C2CCCO2)cc1 Amb17334671 [0,1,0,1,0,0|1,0,1]=4 10181 B13R2.12 Fc1ccc(C2NCCO2)cc1 Amb17334700 [0,1,0,1,0,0|1,0,1]=4 10182 B13R2.12 Fc1ccc(C2OCCO2)cc1 Amb4036335 [0,1,0,1,0,0|0,0,2]=4 10183 B13R2.12 Ic1ccc(C2=NCCC2)cc1 Amb24727205 [0,1,0,1,0,0|2,0,0]=4 10184 B13R2.12 Ic1ccc(C2OCCO2)cc1 Amb27259403 [0,1,0,1,0,0|0,0,2]=4 10185 B13R2.12 Nc1ccc(B2OCCO2)cc1 Amb27647544 [0,1,0,1,0,0|1,0,1]=4 10186 B13R2.12 Nc1ccc(C2=NCCN2)cc1 Amb30982112 [0,1,0,1,0,0|2,0,0]=4 10187 B13R2.12 Nc1ccc(C2=NCCN2)cc1 Amb8480185 [0,1,0,1,0,0|2,0,0]=4 10188 B13R2.12 Nc1ccc(C2=NCCO2)cc1 Amb2687301 [0,1,0,1,0,0|1,0,0]=3 10189 B13R2.12 Nc1ccc(C2CCCO2)cc1 Amb17334584 [0,1,0,1,0,0|1,0,1]=4 10190 B13R2.12 Nc1ccc(C2OCCO2)cc1 Amb16230379 [0,1,0,1,0,0|0,0,2]=4 10191 B13R2.12 Nc1ccc(N2CCCO2)cc1 Amb27972705 [0,1,0,1,0,0|2,0,0]=4 10192 B13R2.12 Oc1ccc(C2=CCCC2)cc1 Amb18645357 [0,1,0,1,0,0|2,0,0]=4 10193 B13R2.12 Oc1ccc(C2=NCCN2)cc1 Amb10070817 [0,1,0,1,0,0|2,0,0]=4 10194 B13R2.12 Oc1ccc(C2=NCCO2)cc1 Amb18645792 [0,1,0,1,0,0|1,0,0]=3 10195 B13R2.12 Oc1ccc(C2=NCCS2)cc1 Amb18648260 [0,1,0,1,0,0|1,1,0]=4 10196 B13R2.12 Oc1ccc(C2CCCO2)cc1 Amb8439670 [0,1,0,1,0,0|1,0,1]=4 10197 B13R2.12 Oc1ccc(C2NCCO2)cc1 Amb2608924 [0,1,0,1,0,0|1,0,1]=4 10198 B13R2.12 Oc1ccc(C2OCCO2)cc1 Amb17334663 [0,1,0,1,0,0|0,0,2]=4 10199 B13R2.520 C=C(c1ccc(Br)cc1)C2CC2 Amb22751350 [0,1,0,1,0,0|2,0,0]=4 10200 B13R2.520 Cc1ccc(C(=O)C2CC2)cc1 Amb1660781 [0,1,0,1,0,0|1,0,0]=3 10201 B13R2.520 Cc1ccc(C(=O)C2CO2)cc1 Amb27176160 [0,1,0,1,0,0|2,0,0]=4 10202 B13R2.520 Nc1ccc(C(=O)C2CC2)cc1 Amb17138525 [0,1,0,1,0,0|1,0,0]=3 10203 B13R2.520 Nc1ccc(C(=O)C2CC2)cc1 Amb33548981 [0,1,0,1,0,0|1,0,0]=3 10204 B13R2.520 O=C(c1ccc(Br)cc1)C2CC2 Amb2420176 [0,1,0,1,0,0|1,0,0]=3 10205 B13R2.520 O=C(c1ccc(Br)cn1)C2CC2 Amb23454994 [0,1,0,1,0,0|2,0,0]=4 10206 B13R2.520 O=C(c1ccc(Cl)cc1)C2CC2 Amb6365762 [0,1,0,1,0,0|1,0,0]=3 10207 B13R2.520 O=C(c1ccc(Cl)cn1)C2CC2 Amb23454991 [0,1,0,1,0,0|2,0,0]=4 10208 B13R2.520 O=C(c1ccc(F)cc1)C2CC2 Amb2582736 [0,1,0,1,0,0|1,0,0]=3 10209 B13R2.520 O=C(c1ccc(F)cc1)C2CO2 Amb28324368 [0,1,0,1,0,0|2,0,0]=4 10210 B13R2.520 O=C(c1ccc(F)cn1)C2CC2 Amb27853326 [0,1,0,1,0,0|2,0,0]=4 10211 B13R2.520 O=C(c1ccc(O)cc1)C2CC2 Amb2612556 [0,1,0,1,0,0|1,0,0]=3 10212 B13R2.2986 CC1(c2ccc(Br)cc2)CCO1 Amb25292728 [0,1,0,1,0,0|1,0,1]=4 10213 B13R2.2986 CC1(c2ccc(Cl)cc2)CCO1 Amb32946040 [0,1,0,1,0,0|1,0,1]=4 10214 B13R2.2986 CC1(c2ccc(F)cc2)CCO1 Amb32642027 [0,1,0,1,0,0|1,0,1]=4 10215 B13R2.5179 Cc1cc2c(cn1)C(=O)CCC2 Amb27764754 [0,1,0,1,0,0|2,0,0]=4 10216 B13R2.5179 Cc1cc2c(cn1)C(=O)CCC2 Amb32670889 [0,1,0,1,0,0|2,0,0]=4 10217 B13R2.5179 Cc1ccc2c(c1)CCCC2=O Amb2695340 [0,1,0,1,0,0|1,0,0]=3 10218 B13R2.5179 Cc1ccc2c(c1)CCNC2=O Amb18065088 [0,1,0,1,0,0|1,0,0]=3 10219 B13R2.5179 Cc1ccc2c(c1)CCOC2=O Amb28137661 [0,1,0,1,0,0|0,0,0]=2 10220 B13R2.5179 Cc1ccc2c(c1)CNCC2=O Amb28130056 [0,1,0,1,0,0|2,0,0]=4 10221 B13R2.5179 Cc1ccc2c(c1)NCCC2=O Amb18560043 [0,1,0,1,0,0|2,0,0]=4 10222 B13R2.5179 Cc1ccc2c(c1)OCCC2=O Amb2779797 [0,1,0,1,0,0|2,0,0]=4 10223 B13R2.5179 Cc1ccc2c(c1)SCCC2=O Amb18824839 [0,1,0,1,0,0|2,0,0]=4 10224 B13R2.5179 Cc1ccc2c(n1)CCCC2=O Amb18829940 [0,1,0,1,0,0|2,0,0]=4 10225 B13R2.5179 Cc1cnc2c(c1)CCCC2=O Amb27175522 [0,1,0,1,0,0|2,0,0]=4 10226 B13R2.5179 Nc1ccc2c(c1)C=NOC2=O Amb27268345 [0,1,0,1,0,0|1,0,1]=4 10227 B13R2.5179 Nc1ccc2c(c1)CCCC2=O Amb2725074 [0,1,0,1,0,0|1,0,0]=3 10228 B13R2.5179 Nc1ccc2c(c1)CCNC2=O Amb18064562 [0,1,0,1,0,0|1,0,0]=3 10229 B13R2.5179 Nc1ccc2c(c1)CCOC2=O Amb28368175 [0,1,0,1,0,0|0,0,0]=2 10230 B13R2.5179 Nc1ccc2c(c1)OCCC2=O Amb17191612 [0,1,0,1,0,0|2,0,0]=4 10231 B13R2.5179 Nc1ccc2c(n1)CCCC2=O Amb23592276 [0,1,0,1,0,0|2,0,0]=4 10232 B13R2.5179 O=C1C=CC2=C(CCCC2=O)N1 Amb17933811 [0,1,0,1,0,0|2,0,0]=4 10233 B13R2.5179 O=C1CCCc2cc(Br)ccc21 Amb10603037 [0,1,0,1,0,0|1,0,0]=3 10234 B13R2.5179 O=C1CCCc2cc(Br)cnc21 Amb24350538 [0,1,0,1,0,0|2,0,0]=4 10235 B13R2.5179 O=C1CCCc2cc(Cl)ccc21 Amb8390916 [0,1,0,1,0,0|1,0,0]=3 10236 B13R2.5179 O=C1CCCc2cc(Cl)ncc21 Amb27160676 [0,1,0,1,0,0|2,0,0]=4 10237 B13R2.5179 O=C1CCCc2cc(F)ccc21 Amb8390915 [0,1,0,1,0,0|1,0,0]=3 10238 B13R2.5179 O=C1CCCc2cc(I)ccc21 Amb16233083 [0,1,0,1,0,0|1,0,0]=3 10239 B13R2.5179 O=C1CCCc2cc(O)ccc21 Amb2445422 [0,1,0,1,0,0|1,0,0]=3 10240 B13R2.5179 O=C1CCCc2cc(O)ncc21 Amb18645807 [0,1,0,1,0,0|2,0,0]=4 10241 B13R2.5179 O=C1CCCc2cc(S)ccc21 Amb27621292 [0,1,0,1,0,0|1,0,0]=3 10242 B13R2.5179 O=C1CCCc2nc(Br)ccc21 Amb27755514 [0,1,0,1,0,0|2,0,0]=4 10243 B13R2.5179 O=C1CCCc2nc(Cl)ccc21 Amb3319373 [0,1,0,1,0,0|2,0,0]=4 10244 B13R2.5179 O=C1CCCc2nc(O)ccc21 Amb18645806 [0,1,0,1,0,0|2,0,0]=4 10245 B13R2.5179 O=C1CCCc2nc(S)ccc21 Amb28240543 [0,1,0,1,0,0|2,0,0]=4 10246 B13R2.5179 O=C1CCNc2cc(Br)ccc21 Amb16192033 [0,1,0,1,0,0|2,0,0]=4 10247 B13R2.5179 O=C1CCNc2cc(Cl)ccc21 Amb4033035 [0,1,0,1,0,0|2,0,0]=4 10248 B13R2.5179 O=C1CCNc2cc(F)ccc21 Amb18828470 [0,1,0,1,0,0|2,0,0]=4 10249 B13R2.5179 O=C1CCNc2cc(I)ccc21 Amb24493218 [0,1,0,1,0,0|2,0,0]=4 10250 B13R2.5179 O=C1CCOc2cc(Br)ccc21 Amb10603907 [0,1,0,1,0,0|2,0,0]=4 10251 B13R2.5179 O=C1CCOc2cc(Cl)ccc21 Amb10603919 [0,1,0,1,0,0|2,0,0]=4 10252 B13R2.5179 O=C1CCOc2cc(F)ccc21 Amb16233074 [0,1,0,1,0,0|2,0,0]=4 10253 B13R2.5179 O=C1CCOc2cc(O)ccc21 Amb10603782 [0,1,0,1,0,0|2,0,0]=4 10254 B13R2.5179 O=C1CCSc2cc(Br)ccc21 Amb28197256 [0,1,0,1,0,0|2,0,0]=4 10255 B13R2.5179 O=C1CCSc2cc(Cl)ccc21 Amb18187822 [0,1,0,1,0,0|2,0,0]=4 10256 B13R2.5179 O=C1CCSc2cc(F)ccc21 Amb27600804 [0,1,0,1,0,0|2,0,0]=4 10257 B13R2.5179 O=C1CCSc2cc(I)ccc21 Amb26318829 [0,1,0,1,0,0|2,0,0]=4 10258 B13R2.5179 O=C1COCc2cc(Br)ccc21 Amb21963284 [0,1,0,1,0,0|2,0,0]=4 10259 B13R2.5179 O=C1COCc2cc(Cl)ccc21 Amb25348823 [0,1,0,1,0,0|2,0,0]=4 10260 B13R2.5179 O=C1COCc2cc(F)ccc21 Amb27470960 [0,1,0,1,0,0|2,0,0]=4 10261 B13R2.5179 O=C1N=CCc2cc(Br)ccc21 Amb27790975 [0,1,0,1,0,0|1,0,1]=4 10262 B13R2.5179 O=C1N=NCc2cc(Br)ccc21 Amb28129305 [0,1,0,1,0,0|2,0,0]=4 10263 B13R2.5179 O=C1NCCc2cc(Br)ccc21 Amb10603016 [0,1,0,1,0,0|1,0,0]=3 10264 B13R2.5179 O=C1NCCc2cc(Br)ncc21 Amb22754598 [0,1,0,1,0,0|2,0,0]=4 10265 B13R2.5179 O=C1NCCc2cc(Cl)ccc21 Amb18065092 [0,1,0,1,0,0|1,0,0]=3 10266 B13R2.5179 O=C1NCCc2cc(Cl)ncc21 Amb22754595 [0,1,0,1,0,0|2,0,0]=4 10267 B13R2.5179 O=C1NCCc2cc(F)ccc21 Amb18065091 [0,1,0,1,0,0|1,0,0]=3 10268 B13R2.5179 O=C1NCCc2cc(I)ccc21 Amb25340206 [0,1,0,1,0,0|1,0,0]=3 10269 B13R2.5179 O=C1NCCc2cc(O)ccc21 Amb6308387 [0,1,0,1,0,0|1,0,0]=3 10270 B13R2.5179 O=C1NCCc2nc(Cl)ccc21 Amb22584107 [0,1,0,1,0,0|2,0,0]=4 10271 B13R2.5179 O=C1NCCc2nc(F)ccc21 Amb28399330 [0,1,0,1,0,0|2,0,0]=4 10272 B13R2.5179 O=C1NCCc2nc(O)ccc21 Amb22499176 [0,1,0,1,0,0|2,0,0]=4 10273 B13R2.5179 O=C1OC=Cc2cc(Br)ccc21 Amb26079563 [0,1,0,1,0,0|0,0,2]=4 10274 B13R2.5179 O=C1OC=Nc2cc(Br)ccc21 Amb33719134 [0,1,0,1,0,0|1,0,1]=4 10275 B13R2.5179 O=C1OCCc2cc(Br)ccc21 Amb22284657 [0,1,0,1,0,0|0,0,0]=2 10276 B13R2.5179 O=C1OCCc2cc(F)ccc21 Amb27603454 [0,1,0,1,0,0|0,0,0]=2 10277 B13R2.5179 O=C1OCCc2cc(I)ccc21 Amb28125767 [0,1,0,1,0,0|0,0,0]=2 10278 B13R2.5179 O=C1OCCc2cc(O)ccc21 Amb27854073 [0,1,0,1,0,0|0,0,0]=2 10279 B13R2.5179 OB1OCCc2cc(F)ccc21 Amb26374259 [0,1,0,1,0,0|1,0,1]=4 10280 B13R2.5179 S=C1NCCc2cc(Cl)ccc21 Amb27401972 [0,1,0,1,0,0|1,1,0]=4 10281 B13R2.5187 CC1CC(=O)c2cc(Br)ccc21 Amb6705554 [0,1,0,1,0,0|1,0,0]=3 10282 B13R2.5187 CC1CC(=O)c2cc(Cl)ccc21 Amb6705553 [0,1,0,1,0,0|1,0,0]=3 10283 B13R2.5187 CC1CC(=O)c2cc(F)ccc21 Amb6705552 [0,1,0,1,0,0|1,0,0]=3 10284 B13R2.5187 CC1CC(=O)c2ccc(Cl)cc21 Amb22753082 [0,1,0,1,0,0|1,0,0]=3 10285 B13R2.5187 CC1CC(=O)c2ccc(F)cc21 Amb25698030 [0,1,0,1,0,0|1,0,0]=3 10286 B13R2.5187 CC1CC(=O)c2ccc(O)cc21 Amb2811362 [0,1,0,1,0,0|1,0,0]=3 10287 B13R2.5187 CC1NC(=O)c2cc(Br)ccc21 Amb33716192 [0,1,0,1,0,0|1,0,0]=3 10288 B13R2.5187 CC1NC(=O)c2cc(Cl)ccc21 Amb27813355 [0,1,0,1,0,0|1,0,0]=3 10289 B13R2.5187 CC1NC(=O)c2cc(F)ccc21 Amb27777625 [0,1,0,1,0,0|1,0,0]=3 10290 B13R2.5187 CC1NC(=O)c2cc(N)ccc21 Amb28067805 [0,1,0,1,0,0|1,0,0]=3 10291 B13R2.5187 CC1NC(=O)c2ccc(Cl)cc21 Amb26559218 [0,1,0,1,0,0|1,0,0]=3 10292 B13R2.5187 CC1NC(=O)c2ccc(F)cc21 Amb28246003 [0,1,0,1,0,0|1,0,0]=3 10293 B13R2.5187 CC1OB(O)c2ccc(F)cc21 Amb27770942 [0,1,0,1,0,0|1,0,1]=4 10294 B13R2.5187 CC1OC(=O)c2cc(Br)ccc21 Amb18159717 [0,1,0,1,0,0|0,0,0]=2 10295 B13R2.5187 CC1OC(=O)c2cc(O)ccc21 Amb28351484 [0,1,0,1,0,0|0,0,0]=2 10296 B13R2.5187 CC1OC(=O)c2ccc(Br)cc21 Amb25871714 [0,1,0,1,0,0|0,0,0]=2 10297 B13R2.5187 CN1CC(=O)c2cc(Br)ccc21 Amb18160225 [0,1,0,1,0,0|2,0,0]=4 10298 B13R2.5187 CN1CC(=O)c2cc(N)ccc21 Amb18829714 [0,1,0,1,0,0|2,0,0]=4 10299 B13R2.5187 CN1SC(=O)c2cc(N)ccc21 Amb28398179 [0,1,0,1,0,0|1,1,0]=4 10300 B13R2.5187 C[C@H]1CC(=O)c2cc(O)ccc21 Amb27781977 [0,1,0,1,0,0|1,0,0]=3 10301 B13R2.5187 C[C@H]1NC(=O)c2cc(N)ccc21 Amb27178087 [0,1,0,1,0,0|1,0,0]=3 10302 B13R2.5187 Cc1ccc2c(c1)C(=O)CC2C Amb6705551 [0,1,0,1,0,0|1,0,0]=3 10303 B13R2.5187 Cc1ccc2c(c1)C(=O)CC2N Amb17470419 [0,1,0,1,0,0|2,0,0]=4 10304 B13R2.5187 Cc1ccc2c(c1)C(=O)C[C@H]2N Amb27405716 [0,1,0,1,0,0|2,0,0]=4 10305 B13R2.5187 Cc1ccc2c(c1)C(=O)OC2=O Amb6297275 [0,1,0,1,0,0|1,0,1]=4 10306 B13R2.5187 Cc1ccc2c(c1)C(=O)OC2F Amb27614542 [0,1,0,1,0,0|1,0,0]=3 10307 B13R2.5187 Cc1ccc2c(c1)C(C)CC2=O Amb2697081 [0,1,0,1,0,0|1,0,0]=3 10308 B13R2.5187 Cc1ccc2c(c1)C(N)CC2=O Amb17470421 [0,1,0,1,0,0|2,0,0]=4 10309 B13R2.5187 Cc1ccc2c(c1)C(O)OC2=O Amb18936180 [0,1,0,1,0,0|1,0,0]=3 10310 B13R2.5187 Cc1ccc2c(c1)[C@@H](N)CC2=O Amb27748435 [0,1,0,1,0,0|2,0,0]=4 10311 B13R2.5187 NC1CC(=O)c2cc(Br)ccc21 Amb17472099 [0,1,0,1,0,0|2,0,0]=4 10312 B13R2.5187 NC1CC(=O)c2cc(Cl)ccc21 Amb17470645 [0,1,0,1,0,0|2,0,0]=4 10313 B13R2.5187 NC1CC(=O)c2cc(F)ccc21 Amb17470454 [0,1,0,1,0,0|2,0,0]=4 10314 B13R2.5187 NC1CC(=O)c2cc(I)ccc21 Amb28045730 [0,1,0,1,0,0|2,0,0]=4 10315 B13R2.5187 NC1CC(=O)c2ccc(Br)cc21 Amb17472097 [0,1,0,1,0,0|2,0,0]=4 10316 B13R2.5187 NC1CC(=O)c2ccc(Cl)cc21 Amb26637695 [0,1,0,1,0,0|2,0,0]=4 10317 B13R2.5187 NC1CC(=O)c2ccc(F)cc21 Amb17470456 [0,1,0,1,0,0|2,0,0]=4 10318 B13R2.5187 NC1CC(=O)c2ccc(O)cc21 Amb27408446 [0,1,0,1,0,0|2,0,0]=4 10319 B13R2.5187 NC1NC(=O)c2cc(Br)ccc21 Amb27223152 [0,1,0,1,0,0|2,0,0]=4 10320 B13R2.5187 N[C@@H]1CC(=O)c2cc(I)ccc21 Amb27461157 [0,1,0,1,0,0|2,0,0]=4 10321 B13R2.5187 N[C@@H]1CC(=O)c2ccc(F)cc21 Amb27459698 [0,1,0,1,0,0|2,0,0]=4 10322 B13R2.5187 N[C@H]1CC(=O)c2cc(Br)ccc21 Amb27950534 [0,1,0,1,0,0|2,0,0]=4 10323 B13R2.5187 N[C@H]1CC(=O)c2ccc(F)cc21 Amb27770626 [0,1,0,1,0,0|2,0,0]=4 10324 B13R2.5187 Nc1ccc2c(c1)C(=O)OC2=O Amb25256881 [0,1,0,1,0,0|1,0,1]=4 10325 B13R2.5187 Nc1ccc2c(c1)C(=O)OC2Br Amb23590103 [0,1,0,1,0,0|1,0,0]=3 10326 B13R2.5187 O=C1NC(O)c2ccc(Cl)cc21 Amb28205944 [0,1,0,1,0,0|2,0,0]=4 10327 B13R2.5187 O=C1OC(=O)c2cc(Br)ccc21 Amb2685475 [0,1,0,1,0,0|1,0,1]=4 10328 B13R2.5187 O=C1OC(=O)c2cc(Cl)ccc21 Amb2686431 [0,1,0,1,0,0|1,0,1]=4 10329 B13R2.5187 O=C1OC(=O)c2cc(F)ccc21 Amb2236183 [0,1,0,1,0,0|1,0,1]=4 10330 B13R2.5187 O=C1OC(=O)c2cc(I)ccc21 Amb28293207 [0,1,0,1,0,0|1,0,1]=4 10331 B13R2.5187 O=C1OC(=O)c2cc(O)ccc21 Amb2823283 [0,1,0,1,0,0|1,0,1]=4 10332 B13R2.5187 O=C1OC(Br)c2cc(Br)ccc21 Amb24056792 [0,1,0,1,0,0|1,0,0]=3 10333 B13R2.5187 O=C1OC(Br)c2cc(Cl)ccc21 Amb27667904 [0,1,0,1,0,0|1,0,0]=3 10334 B13R2.5187 O=C1OC(Br)c2cc(F)ccc21 Amb24056808 [0,1,0,1,0,0|1,0,0]=3 10335 B13R2.5187 O=C1OC(Br)c2cc(I)ccc21 Amb27753873 [0,1,0,1,0,0|1,0,0]=3 10336 B13R2.5187 O=C1OC(Br)c2ccc(Br)cc21 Amb23590102 [0,1,0,1,0,0|1,0,0]=3 10337 B13R2.5187 O=C1OC(Br)c2ccc(F)cc21 Amb24056817 [0,1,0,1,0,0|1,0,0]=3 10338 B13R2.5187 O=C1OC(O)c2cc(Br)ccc21 Amb5722412 [0,1,0,1,0,0|1,0,0]=3 10339 B13R2.5187 O=C1OC(O)c2cc(Cl)ccc21 Amb18936147 [0,1,0,1,0,0|1,0,0]=3 10340 B13R2.5187 O=C1OC(O)c2cc(O)ccc21 Amb18272023 [0,1,0,1,0,0|1,0,0]=3 10341 B13R2.5187 O=C1OC(O)c2ccc(Br)cc21 Amb26608983 [0,1,0,1,0,0|1,0,0]=3 10342 B13R2.5187 O=C1OC(O)c2ccc(F)cc21 Amb26932757 [0,1,0,1,0,0|1,0,0]=3 10343 B13R2.13 Brc1cccc(C2=CCCC2)c1 Amb22227898 [0,1,0,1,0,0|2,0,0]=4 10344 B13R2.13 Brc1cccc(C2=NCCC2)c1 Amb8394088 [0,1,0,1,0,0|2,0,0]=4 10345 B13R2.13 Brc1cccc(C2=NCCN2)c1 Amb18068030 [0,1,0,1,0,0|2,0,0]=4 10346 B13R2.13 Brc1cccc(C2=NCCO2)c1 Amb18561899 [0,1,0,1,0,0|1,0,0]=3 10347 B13R2.13 Brc1cccc(C2NCCO2)c1 Amb17344017 [0,1,0,1,0,0|1,0,1]=4 10348 B13R2.13 Brc1cccc(C2OCCO2)c1 Amb2782809 [0,1,0,1,0,0|0,0,2]=4 10349 B13R2.13 Cc1cccc(C2=NCCC2)c1 Amb24053770 [0,1,0,1,0,0|2,0,0]=4 10350 B13R2.13 Cc1cccc(C2=NCCN2)c1 Amb6892245 [0,1,0,1,0,0|2,0,0]=4 10351 B13R2.13 Cc1cccc(C2NCCO2)c1 Amb17334582 [0,1,0,1,0,0|1,0,1]=4 10352 B13R2.13 Cc1cccc(C2OCCO2)c1 Amb17334607 [0,1,0,1,0,0|0,0,2]=4 10353 B13R2.13 Clc1cccc(C2=NCCC2)c1 Amb22285357 [0,1,0,1,0,0|2,0,0]=4 10354 B13R2.13 Clc1cccc(C2=NCCN2)c1 Amb8480180 [0,1,0,1,0,0|2,0,0]=4 10355 B13R2.13 Clc1cccc(C2NCCO2)c1 Amb17335656 [0,1,0,1,0,0|1,0,1]=4 10356 B13R2.13 Clc1cccc(C2OCCO2)c1 Amb17335723 [0,1,0,1,0,0|0,0,2]=4 10357 B13R2.13 Clc1ccnc(C2=NCCO2)c1 Amb25674410 [0,1,0,1,0,0|2,0,0]=4 10358 B13R2.13 Fc1cccc(C2=CCCC2)c1 Amb27465544 [0,1,0,1,0,0|2,0,0]=4 10359 B13R2.13 Fc1cccc(C2=NCCC2)c1 Amb24053772 [0,1,0,1,0,0|2,0,0]=4 10360 B13R2.13 Fc1cccc(C2=NCCN2)c1 Amb17578184 [0,1,0,1,0,0|2,0,0]=4 10361 B13R2.13 Fc1cccc(C2NCCO2)c1 Amb18563793 [0,1,0,1,0,0|1,0,1]=4 10362 B13R2.13 Fc1cccc(C2OCCO2)c1 Amb25891263 [0,1,0,1,0,0|0,0,2]=4 10363 B13R2.13 Nc1cccc(C2=CCCC2)c1 Amb17107089 [0,1,0,1,0,0|2,0,0]=4 10364 B13R2.13 Nc1cccc(C2=NCCO2)c1 Amb18063924 [0,1,0,1,0,0|1,0,0]=3 10365 B13R2.13 Nc1cccc(C2CCCO2)c1 Amb17334585 [0,1,0,1,0,0|1,0,1]=4 10366 B13R2.13 Nc1cccc(C2OCCO2)c1 Amb6358188 [0,1,0,1,0,0|0,0,2]=4 10367 B13R2.13 Oc1cccc(C2=NCCN2)c1 Amb10070818 [0,1,0,1,0,0|2,0,0]=4 10368 B13R2.13 Oc1cccc(C2NCCO2)c1 Amb17334631 [0,1,0,1,0,0|1,0,1]=4 10369 B13R2.13 Oc1cccc(C2OCCO2)c1 Amb17334664 [0,1,0,1,0,0|0,0,2]=4 10370 B13R2.162 CC1=CCCc2ccc(Br)cc21 Amb27858312 [0,1,0,1,0,0|2,0,0]=4 10371 B13R2.162 CC1=NCCc2ccc(Cl)cc21 Amb28250046 [0,1,0,1,0,0|2,0,0]=4 10372 B13R2.162 Cc1ccc2c(c1)C(=O)CCC2 Amb6360442 [0,1,0,1,0,0|1,0,0]=3 10373 B13R2.162 Cc1ccc2c(c1)C(=O)CCN2 Amb10811774 [0,1,0,1,0,0|2,0,0]=4 10374 B13R2.162 Cc1ccc2c(c1)C(=O)CCO2 Amb6356968 [0,1,0,1,0,0|2,0,0]=4 10375 B13R2.162 Cc1ccc2c(c1)C(=O)CCS2 Amb2438157 [0,1,0,1,0,0|2,0,0]=4 10376 B13R2.162 Cc1ccc2c(c1)C(=O)CNC2 Amb17194297 [0,1,0,1,0,0|2,0,0]=4 10377 B13R2.162 Cc1ccc2c(c1)C(=O)NCC2 Amb33543430 [0,1,0,1,0,0|1,0,0]=3 10378 B13R2.162 Nc1ccc2c(c1)B(O)OCC2 Amb26347379 [0,1,0,1,0,0|1,0,1]=4 10379 B13R2.162 Nc1ccc2c(c1)C(=O)CCC2 Amb8631280 [0,1,0,1,0,0|1,0,0]=3 10380 B13R2.162 Nc1ccc2c(c1)C(=O)CCN2 Amb19929523 [0,1,0,1,0,0|2,0,0]=4 10381 B13R2.162 Nc1ccc2c(c1)C(=O)CCO2 Amb17191578 [0,1,0,1,0,0|2,0,0]=4 10382 B13R2.162 Nc1ccc2c(c1)C(=O)CCS2 Amb18194419 [0,1,0,1,0,0|2,0,0]=4 10383 B13R2.162 Nc1ccc2c(c1)C(=O)NCC2 Amb17400107 [0,1,0,1,0,0|1,0,0]=3 10384 B13R2.162 Nc1ccc2c(c1)C(=O)NCC2 Amb19334962 [0,1,0,1,0,0|1,0,0]=3 10385 B13R2.162 Nc1ccc2c(c1)C(=O)NOC2 Amb28291594 [0,1,0,1,0,0|2,0,0]=4 10386 B13R2.162 Nc1ccc2c(c1)C(=O)OCC2 Amb18126361 [0,1,0,1,0,0|0,0,0]=2 10387 B13R2.162 Nc1ccc2c(c1)C(=S)NCC2 Amb28292492 [0,1,0,1,0,0|1,1,0]=4 10388 B13R2.162 Nc1cnc2c(c1)C(=O)CCC2 Amb18829717 [0,1,0,1,0,0|2,0,0]=4 10389 B13R2.162 Nc1cnc2c(c1)C(=O)NCC2 Amb27842415 [0,1,0,1,0,0|2,0,0]=4 10390 B13R2.162 O=C1C=CC2=C(N1)C(=O)CCC2 Amb27392976 [0,1,0,1,0,0|2,0,0]=4 10391 B13R2.162 O=C1C=CN2CCNC(=O)C2=C1 Amb20648791 [0,1,0,1,0,0|2,0,0]=4 10392 B13R2.162 O=C1CCCc2ccc(Br)cc21 Amb2383551 [0,1,0,1,0,0|1,0,0]=3 10393 B13R2.162 O=C1CCCc2ccc(Br)nc21 Amb24727125 [0,1,0,1,0,0|2,0,0]=4 10394 B13R2.162 O=C1CCCc2ccc(Cl)cc21 Amb2383549 [0,1,0,1,0,0|1,0,0]=3 10395 B13R2.162 O=C1CCCc2ccc(Cl)nc21 Amb23399670 [0,1,0,1,0,0|2,0,0]=4 10396 B13R2.162 O=C1CCCc2ccc(F)cc21 Amb2383550 [0,1,0,1,0,0|1,0,0]=3 10397 B13R2.162 O=C1CCCc2ccc(I)cc21 Amb16232420 [0,1,0,1,0,0|1,0,0]=3 10398 B13R2.162 O=C1CCCc2ccc(O)cc21 Amb4451329 [0,1,0,1,0,0|1,0,0]=3 10399 B13R2.162 O=C1CCCc2ccc(S)cc21 Amb27951853 [0,1,0,1,0,0|1,0,0]=3 10400 B13R2.162 O=C1CCCc2cnc(Cl)cc21 Amb25759478 [0,1,0,1,0,0|2,0,0]=4 10401 B13R2.162 O=C1CCCc2ncc(Br)cc21 Amb25857003 [0,1,0,1,0,0|2,0,0]=4 10402 B13R2.162 O=C1CCCc2ncc(Br)cc21 Amb32682525 [0,1,0,1,0,0|2,0,0]=4 10403 B13R2.162 O=C1CCCc2ncc(Cl)cc21 Amb19959211 [0,1,0,1,0,0|2,0,0]=4 10404 B13R2.162 O=C1CCCc2ncc(F)cc21 Amb28247930 [0,1,0,1,0,0|2,0,0]=4 10405 B13R2.162 O=C1CCCc2ncc(O)cc21 Amb27589933 [0,1,0,1,0,0|2,0,0]=4 10406 B13R2.162 O=C1CCNc2ccc(Br)cc21 Amb33548928 [0,1,0,1,0,0|2,0,0]=4 10407 B13R2.162 O=C1CCNc2ccc(Cl)cc21 Amb16231038 [0,1,0,1,0,0|2,0,0]=4 10408 B13R2.162 O=C1CCNc2ccc(F)cc21 Amb18062524 [0,1,0,1,0,0|2,0,0]=4 10409 B13R2.162 O=C1CCNc2ccc(I)cc21 Amb24680680 [0,1,0,1,0,0|2,0,0]=4 10410 B13R2.162 O=C1CCNc2ccc(O)cc21 Amb25068896 [0,1,0,1,0,0|2,0,0]=4 10411 B13R2.162 O=C1CCNc2ccc(O)cc21 Amb32665518 [0,1,0,1,0,0|2,0,0]=4 10412 B13R2.162 O=C1CCOc2ccc(Br)cc21 Amb1159443 [0,1,0,1,0,0|2,0,0]=4 10413 B13R2.162 O=C1CCOc2ccc(Cl)cc21 Amb2612668 [0,1,0,1,0,0|2,0,0]=4 10414 B13R2.162 O=C1CCOc2ccc(F)cc21 Amb22274866 [0,1,0,1,0,0|2,0,0]=4 10415 B13R2.162 O=C1CCOc2ccc(F)cc21 Amb2688080 [0,1,0,1,0,0|2,0,0]=4 10416 B13R2.162 O=C1CCOc2ccc(I)cc21 Amb2447108 [0,1,0,1,0,0|2,0,0]=4 10417 B13R2.162 O=C1CCOc2ccc(O)cc21 Amb2612807 [0,1,0,1,0,0|2,0,0]=4 10418 B13R2.162 O=C1CCSc2ccc(Br)cc21 Amb33545949 [0,1,0,1,0,0|2,0,0]=4 10419 B13R2.162 O=C1CCSc2ccc(Cl)cc21 Amb1156672 [0,1,0,1,0,0|2,0,0]=4 10420 B13R2.162 O=C1CCSc2ccc(F)cc21 Amb1154161 [0,1,0,1,0,0|2,0,0]=4 10421 B13R2.162 O=C1CCSc2ccc(I)cc21 Amb27398205 [0,1,0,1,0,0|2,0,0]=4 10422 B13R2.162 O=C1CCSc2ccc(O)cc21 Amb2612983 [0,1,0,1,0,0|2,0,0]=4 10423 B13R2.162 O=C1CNCc2ccc(Cl)cc21 Amb17194299 [0,1,0,1,0,0|2,0,0]=4 10424 B13R2.162 O=C1CNCc2ccc(Cl)cc21 Amb31291117 [0,1,0,1,0,0|2,0,0]=4 10425 B13R2.162 O=C1CNCc2ccc(F)cc21 Amb17194298 [0,1,0,1,0,0|2,0,0]=4 10426 B13R2.162 O=C1CNCc2ccc(O)cc21 Amb27598011 [0,1,0,1,0,0|2,0,0]=4 10427 B13R2.162 O=C1COCc2ccc(Br)cc21 Amb16233090 [0,1,0,1,0,0|2,0,0]=4 10428 B13R2.162 O=C1COCc2ccc(F)cc21 Amb24623435 [0,1,0,1,0,0|2,0,0]=4 10429 B13R2.162 O=C1CSCc2ccc(Br)cc21 Amb25982168 [0,1,0,1,0,0|2,0,0]=4 10430 B13R2.162 O=C1NCCc2ccc(Br)cc21 Amb10603904 [0,1,0,1,0,0|1,0,0]=3 10431 B13R2.162 O=C1NCCc2ccc(Cl)cc21 Amb17205801 [0,1,0,1,0,0|1,0,0]=3 10432 B13R2.162 O=C1NCCc2ccc(F)cc21 Amb17205808 [0,1,0,1,0,0|1,0,0]=3 10433 B13R2.162 O=C1NCCc2ccc(O)cc21 Amb18061676 [0,1,0,1,0,0|1,0,0]=3 10434 B13R2.162 O=C1NCCc2cnc(Br)cc21 Amb27395982 [0,1,0,1,0,0|2,0,0]=4 10435 B13R2.162 O=C1NCCc2cnc(Cl)cc21 Amb25291792 [0,1,0,1,0,0|2,0,0]=4 10436 B13R2.162 O=C1NCCc2ncc(Br)cc21 Amb27649658 [0,1,0,1,0,0|2,0,0]=4 10437 B13R2.162 O=C1NCCc2ncc(F)cc21 Amb27389153 [0,1,0,1,0,0|2,0,0]=4 10438 B13R2.162 O=C1OC=Cc2ccc(Br)cc21 Amb34913437 [0,1,0,1,0,0|0,0,2]=4 10439 B13R2.162 O=C1OC=Nc2ccc(Br)cc21 Amb19957642 [0,1,0,1,0,0|1,0,1]=4 10440 B13R2.162 O=C1OCCc2ccc(Br)cc21 Amb25316175 [0,1,0,1,0,0|0,0,0]=2 10441 B13R2.162 O=C1OCCc2ccc(Cl)cc21 Amb25925779 [0,1,0,1,0,0|0,0,0]=2 10442 B13R2.162 O=C1OCCc2ccc(F)cc21 Amb28256708 [0,1,0,1,0,0|0,0,0]=2 10443 B13R2.162 O=C1OCCc2ccc(O)cc21 Amb18645961 [0,1,0,1,0,0|0,0,0]=2 10444 B13R2.162 O=C1OCOc2ccc(Br)cc21 Amb24077633 [0,1,0,1,0,0|1,0,0]=3 10445 B13R2.162 O=C1OCOc2ccc(F)cc21 Amb24077629 [0,1,0,1,0,0|1,0,0]=3 10446 B13R2.162 S=C1NCCc2ccc(Br)cc21 Amb27635906 [0,1,0,1,0,0|1,1,0]=4 10447 B13R2.162 S=C1NCCc2ccc(Cl)cc21 Amb24341849 [0,1,0,1,0,0|1,1,0]=4 10448 B13R2.342 C=C1CCCc2c(O)cccc21 Amb27802622 [0,1,0,1,0,0|2,0,0]=4 10449 B13R2.342 Cc1cccc2c1CCCC2=O Amb17087874 [0,1,0,1,0,0|1,0,0]=3 10450 B13R2.342 Cc1cccc2c1CCNC2=O Amb17400086 [0,1,0,1,0,0|1,0,0]=3 10451 B13R2.342 Cc1cccc2c1NCCC2=O Amb18062582 [0,1,0,1,0,0|2,0,0]=4 10452 B13R2.342 Cc1cccc2c1NCOC2=O Amb27462047 [0,1,0,1,0,0|1,0,0]=3 10453 B13R2.342 Cc1cccc2c1OCCC2=O Amb33552806 [0,1,0,1,0,0|2,0,0]=4 10454 B13R2.342 Cc1cccc2c1SCCC2=O Amb18180837 [0,1,0,1,0,0|2,0,0]=4 10455 B13R2.342 N=C1CCCc2c(N)cccc21 Amb27393584 [0,1,0,1,0,0|2,0,0]=4 10456 B13R2.342 Nc1cccc2c1C=COC2=O Amb18645434 [0,1,0,1,0,0|0,0,2]=4 10457 B13R2.342 Nc1cccc2c1CCNC2=O Amb22496660 [0,1,0,1,0,0|1,0,0]=3 10458 B13R2.342 Nc1cccc2c1CCNC2=O Amb27597949 [0,1,0,1,0,0|1,0,0]=3 10459 B13R2.342 Nc1cccc2c1CCOC2=O Amb24089240 [0,1,0,1,0,0|0,0,0]=2 10460 B13R2.342 Nc1cccc2c1OCCC2=O Amb17570075 [0,1,0,1,0,0|2,0,0]=4 10461 B13R2.342 Nc1cccc2c1SCCC2=O Amb18194418 [0,1,0,1,0,0|2,0,0]=4 10462 B13R2.342 Nc1cncc2c1CCNC2=O Amb35746342 [0,1,0,1,0,0|2,0,0]=4 10463 B13R2.342 Nc1cncc2c1CCNC2=O Amb35747091 [0,1,0,1,0,0|2,0,0]=4 10464 B13R2.342 O=C1CCCc2c(Br)cccc21 Amb7101506 [0,1,0,1,0,0|1,0,0]=3 10465 B13R2.342 O=C1CCCc2c(Br)cncc21 Amb27162368 [0,1,0,1,0,0|2,0,0]=4 10466 B13R2.342 O=C1CCCc2c(Cl)cccc21 Amb2383554 [0,1,0,1,0,0|1,0,0]=3 10467 B13R2.342 O=C1CCCc2c(Cl)ccnc21 Amb22754632 [0,1,0,1,0,0|2,0,0]=4 10468 B13R2.342 O=C1CCCc2c(F)cccc21 Amb2383555 [0,1,0,1,0,0|1,0,0]=3 10469 B13R2.342 O=C1CCCc2c(I)cccc21 Amb16233081 [0,1,0,1,0,0|1,0,0]=3 10470 B13R2.342 O=C1CCCc2c(O)cccc21 Amb2779886 [0,1,0,1,0,0|1,0,0]=3 10471 B13R2.342 O=C1CCCc2c(O)cncc21 Amb27977713 [0,1,0,1,0,0|2,0,0]=4 10472 B13R2.342 O=C1CCNc2c(Br)cccc21 Amb18753478 [0,1,0,1,0,0|2,0,0]=4 10473 B13R2.342 O=C1CCNc2c(Cl)cccc21 Amb1773286 [0,1,0,1,0,0|2,0,0]=4 10474 B13R2.342 O=C1CCNc2c(F)cccc21 Amb8630008 [0,1,0,1,0,0|2,0,0]=4 10475 B13R2.342 O=C1CCNc2c(I)cccc21 Amb27813318 [0,1,0,1,0,0|2,0,0]=4 10476 B13R2.342 O=C1CCOc2c(Br)cccc21 Amb8843607 [0,1,0,1,0,0|2,0,0]=4 10477 B13R2.342 O=C1CCOc2c(Cl)cccc21 Amb8843606 [0,1,0,1,0,0|2,0,0]=4 10478 B13R2.342 O=C1CCOc2c(F)cccc21 Amb33552655 [0,1,0,1,0,0|2,0,0]=4 10479 B13R2.342 O=C1CCSc2c(Br)cccc21 Amb8996650 [0,1,0,1,0,0|2,0,0]=4 10480 B13R2.342 O=C1CCSc2c(Cl)cccc21 Amb33529314 [0,1,0,1,0,0|2,0,0]=4 10481 B13R2.342 O=C1CCSc2c(F)cccc21 Amb483268 [0,1,0,1,0,0|2,0,0]=4 10482 B13R2.342 O=C1CCSc2c(I)cccc21 Amb25875081 [0,1,0,1,0,0|2,0,0]=4 10483 B13R2.342 O=C1CCSc2c(O)cccc21 Amb27982292 [0,1,0,1,0,0|2,0,0]=4 10484 B13R2.342 O=C1CSCc2c(F)cccc21 Amb22157287 [0,1,0,1,0,0|2,0,0]=4 10485 B13R2.342 O=C1NCCN2C(=O)C=CC=C12 Amb27446666 [0,1,0,1,0,0|2,0,0]=4 10486 B13R2.342 O=C1NCCc2c(Br)cccc21 Amb22002114 [0,1,0,1,0,0|1,0,0]=3 10487 B13R2.342 O=C1NCCc2c(Br)cncc21 Amb24058272 [0,1,0,1,0,0|2,0,0]=4 10488 B13R2.342 O=C1NCCc2c(Cl)cccc21 Amb6308386 [0,1,0,1,0,0|1,0,0]=3 10489 B13R2.342 O=C1NCCc2c(Cl)cncc21 Amb27267896 [0,1,0,1,0,0|2,0,0]=4 10490 B13R2.342 O=C1NCCc2c(F)cccc21 Amb6308385 [0,1,0,1,0,0|1,0,0]=3 10491 B13R2.342 O=C1NCCc2c(I)cccc21 Amb24330771 [0,1,0,1,0,0|1,0,0]=3 10492 B13R2.342 O=C1NCCc2c(O)cccc21 Amb6306668 [0,1,0,1,0,0|1,0,0]=3 10493 B13R2.342 O=C1NCCc2c1ccnc2Cl Amb28410167 [0,1,0,1,0,0|2,0,0]=4 10494 B13R2.342 O=C1OCCc2c(I)cccc21 Amb28243036 [0,1,0,1,0,0|0,0,0]=2 10495 B13R2.342 O=C1OCNc2c(F)cccc21 Amb27791861 [0,1,0,1,0,0|1,0,0]=3 10496 B13R2.342 O=C1OCOc2c(Br)cccc21 Amb24077635 [0,1,0,1,0,0|1,0,0]=3 10497 B13R2.342 O=C1OCOc2c(F)cccc21 Amb24077631 [0,1,0,1,0,0|1,0,0]=3 10498 B13R2.342 S=C1NCCc2c(Br)cccc21 Amb27393786 [0,1,0,1,0,0|1,1,0]=4 10499 B13R2.3018 CC1(c2cccc(Br)c2)CCO1 Amb10975946 [0,1,0,1,0,0|1,0,1]=4 10500 B13R2.3018 CC1(c2cccc(Cl)c2)CCO1 Amb32946045 [0,1,0,1,0,0|1,0,1]=4 10501 B13R2.3018 CC1(c2cccc(F)c2)CCO1 Amb32642030 [0,1,0,1,0,0|1,0,1]=4 10502 B13R2.4857 CC1CC(=O)c2cccc(Br)c21 Amb9748160 [0,1,0,1,0,0|1,0,0]=3 10503 B13R2.4857 CC1NC(=O)c2c(F)cccc21 Amb28071561 [0,1,0,1,0,0|1,0,0]=3 10504 B13R2.4857 CC1NC(=O)c2cccc(F)c21 Amb27876878 [0,1,0,1,0,0|1,0,0]=3 10505 B13R2.4857 CC1OB(O)c2c(F)cccc21 Amb27946776 [0,1,0,1,0,0|1,0,1]=4 10506 B13R2.4857 CC1OC(=O)c2cccc(N)c21 Amb26583091 [0,1,0,1,0,0|0,0,0]=2 10507 B13R2.4857 CN1CC(=O)c2cccc(Br)c21 Amb18160222 [0,1,0,1,0,0|2,0,0]=4 10508 B13R2.4857 CN1CC(=O)c2cccc(N)c21 Amb18829719 [0,1,0,1,0,0|2,0,0]=4 10509 B13R2.4857 CN1NC(=O)c2c(Br)cccc21 Amb28366293 [0,1,0,1,0,0|2,0,0]=4 10510 B13R2.4857 CN1NC(=O)c2c(N)cccc21 Amb24564482 [0,1,0,1,0,0|2,0,0]=4 10511 B13R2.4857 C[C@H]1OC(=O)c2c(O)cccc21 Amb28243799 [0,1,0,1,0,0|0,0,0]=2 10512 B13R2.4857 Cc1cccc2c1C(=O)CC2N Amb27841742 [0,1,0,1,0,0|2,0,0]=4 10513 B13R2.4857 Cc1cccc2c1C(=O)NC2C Amb27804198 [0,1,0,1,0,0|1,0,0]=3 10514 B13R2.4857 Cc1cccc2c1C(=O)OC2=O Amb8516710 [0,1,0,1,0,0|1,0,1]=4 10515 B13R2.4857 Cc1cccc2c1C(=O)OC2O Amb17843912 [0,1,0,1,0,0|1,0,0]=3 10516 B13R2.4857 Cc1cccc2c1C(C)CC2=O Amb6705556 [0,1,0,1,0,0|1,0,0]=3 10517 B13R2.4857 Cc1cccc2c1C(N)CC2=O Amb17470420 [0,1,0,1,0,0|2,0,0]=4 10518 B13R2.4857 Cc1cccc2c1C(O)NC2=O Amb28290402 [0,1,0,1,0,0|2,0,0]=4 10519 B13R2.4857 Cc1cccc2c1[C@@H](N)CC2=O Amb28346785 [0,1,0,1,0,0|2,0,0]=4 10520 B13R2.4857 Cc1cccc2c1[C@H](N)CC2=O Amb27467470 [0,1,0,1,0,0|2,0,0]=4 10521 B13R2.4857 NC1CC(=O)c2c(O)cccc21 Amb28290472 [0,1,0,1,0,0|2,0,0]=4 10522 B13R2.4857 NC1CC(=O)c2cccc(Br)c21 Amb17472098 [0,1,0,1,0,0|2,0,0]=4 10523 B13R2.4857 NC1CC(=O)c2cccc(Cl)c21 Amb17470646 [0,1,0,1,0,0|2,0,0]=4 10524 B13R2.4857 NC1CC(=O)c2cccc(F)c21 Amb17470455 [0,1,0,1,0,0|2,0,0]=4 10525 B13R2.4857 NC1CC(=O)c2cccc(I)c21 Amb27178265 [0,1,0,1,0,0|2,0,0]=4 10526 B13R2.4857 N[C@@H]1CC(=O)c2cccc(Br)c21 Amb27439593 [0,1,0,1,0,0|2,0,0]=4 10527 B13R2.4857 N[C@@H]1CC(=O)c2cccc(F)c21 Amb27439654 [0,1,0,1,0,0|2,0,0]=4 10528 B13R2.4857 N[C@@H]1CC(=O)c2cccc(O)c21 Amb27830631 [0,1,0,1,0,0|2,0,0]=4 10529 B13R2.4857 N[C@H]1CC(=O)c2c(I)cccc21 Amb27800835 [0,1,0,1,0,0|2,0,0]=4 10530 B13R2.4857 N[C@H]1CC(=O)c2c(O)cccc21 Amb27799991 [0,1,0,1,0,0|2,0,0]=4 10531 B13R2.4857 N[C@H]1CC(=O)c2cccc(Br)c21 Amb27623954 [0,1,0,1,0,0|2,0,0]=4 10532 B13R2.4857 N[C@H]1CC(=O)c2cccc(F)c21 Amb27950054 [0,1,0,1,0,0|2,0,0]=4 10533 B13R2.4857 Nc1cccc2c1C(=O)CC2O Amb10975543 [0,1,0,1,0,0|2,0,0]=4 10534 B13R2.4857 Nc1cccc2c1C(=O)C[C@H]2N Amb27871389 [0,1,0,1,0,0|2,0,0]=4 10535 B13R2.4857 Nc1cccc2c1C(=O)OC2=O Amb22233088 [0,1,0,1,0,0|1,0,1]=4 10536 B13R2.4857 Nc1cccc2c1C(O)NC2=O Amb27759911 [0,1,0,1,0,0|2,0,0]=4 10537 B13R2.4857 Nc1cccc2c1[C@H](N)CC2=O Amb27459771 [0,1,0,1,0,0|2,0,0]=4 10538 B13R2.4857 O=C1NC(O)c2c(Br)cccc21 Amb25802010 [0,1,0,1,0,0|2,0,0]=4 10539 B13R2.4857 O=C1NC(O)c2c(Cl)cccc21 Amb28118483 [0,1,0,1,0,0|2,0,0]=4 10540 B13R2.4857 O=C1NC(O)c2cccc(Br)c21 Amb26065721 [0,1,0,1,0,0|2,0,0]=4 10541 B13R2.4857 O=C1OC(=O)c2c(Br)cccc21 Amb8631528 [0,1,0,1,0,0|1,0,1]=4 10542 B13R2.4857 O=C1OC(=O)c2c(Cl)cccc21 Amb2684170 [0,1,0,1,0,0|1,0,1]=4 10543 B13R2.4857 O=C1OC(=O)c2c(F)cccc21 Amb2688403 [0,1,0,1,0,0|1,0,1]=4 10544 B13R2.4857 O=C1OC(=O)c2c(I)cccc21 Amb19886550 [0,1,0,1,0,0|1,0,1]=4 10545 B13R2.4857 O=C1OC(=O)c2c(O)cccc21 Amb3941657 [0,1,0,1,0,0|1,0,1]=4 10546 B13R2.4857 O=C1OC(Br)c2c(Br)cccc21 Amb8391573 [0,1,0,1,0,0|1,0,0]=3 10547 B13R2.4857 O=C1OC(Br)c2c(I)cccc21 Amb27642530 [0,1,0,1,0,0|1,0,0]=3 10548 B13R2.4857 O=C1OC(Br)c2cccc(Br)c21 Amb24056796 [0,1,0,1,0,0|1,0,0]=3 10549 B13R2.4857 O=C1OC(Br)c2cccc(F)c21 Amb24056819 [0,1,0,1,0,0|1,0,0]=3 10550 B13R2.4857 O=C1OC(O)c2c(I)cccc21 Amb28187003 [0,1,0,1,0,0|1,0,0]=3 10551 B13R2.4857 O=C1OC(O)c2cccc(Br)c21 Amb27394131 [0,1,0,1,0,0|1,0,0]=3 10552 B13R2.4857 O=C1OC(O)c2cccc(Cl)c21 Amb18935869 [0,1,0,1,0,0|1,0,0]=3 10553 B13R2.4857 O=C1OC(O)c2cccc(F)c21 Amb18936162 [0,1,0,1,0,0|1,0,0]=3 10554 B13R2.4857 O=C1OC(O)c2ccnc(Cl)c21 Amb33713448 [0,1,0,1,0,0|2,0,0]=4 10555 B13R2.5324 Cc1cc(C(=O)C2CC2)ccn1 Amb22730046 [0,1,0,1,0,0|2,0,0]=4 10556 B13R2.5324 Cc1cccc(C(=O)C2CC2)c1 Amb6302168 [0,1,0,1,0,0|1,0,0]=3 10557 B13R2.5324 Cc1cccc(C(=O)N2CC2)n1 Amb27982563 [0,1,0,1,0,0|2,0,0]=4 10558 B13R2.5324 Nc1cccc(C(=O)C2CC2)c1 Amb17138520 [0,1,0,1,0,0|1,0,0]=3 10559 B13R2.5324 O=C(c1ccc[n+]([O-])c1)N2CC2 Amb28045552 [0,1,0,1,0,0|2,0,0]=4 10560 B13R2.5324 O=C(c1cccc(Br)c1)C2CC2 Amb6302179 [0,1,0,1,0,0|1,0,0]=3 10561 B13R2.5324 O=C(c1cccc(Br)n1)C2CC2 Amb19892364 [0,1,0,1,0,0|2,0,0]=4 10562 B13R2.5324 O=C(c1cccc(Cl)c1)C2CC2 Amb6302180 [0,1,0,1,0,0|1,0,0]=3 10563 B13R2.5324 O=C(c1cccc(Cl)n1)N2CC2 Amb27762195 [0,1,0,1,0,0|2,0,0]=4 10564 B13R2.5324 O=C(c1cccc(F)c1)C2CC2 Amb6302181 [0,1,0,1,0,0|1,0,0]=3 10565 B13R2.5324 O=C(c1cccc(O)c1)C2CC2 Amb28253989 [0,1,0,1,0,0|1,0,0]=3 10566 B13R2.5324 O=C(c1cccc(O)c1)C2CO2 Amb27235492 [0,1,0,1,0,0|2,0,0]=4 10567 B13R2.5324 O=C(c1ccnc(Br)c1)C2CC2 Amb23455125 [0,1,0,1,0,0|2,0,0]=4 10568 B13R2.5324 O=C(c1cncc(Br)c1)C2CC2 Amb23455627 [0,1,0,1,0,0|2,0,0]=4 10569 B13R2.5324 O=C(c1cncc(F)c1)C2CC2 Amb18792620 [0,1,0,1,0,0|2,0,0]=4 10570 B13R2.5324 O=C(c1cncc(F)c1)N2CC2 Amb27664835 [0,1,0,1,0,0|2,0,0]=4 10571 B13R2.5324 O=C(c1cncc(I)c1)N2CC2 Amb27946666 [0,1,0,1,0,0|2,0,0]=4 10572 B13R2.52 OCC1CC(c2ccccc2)O1 Amb27653106 [0,1,0,1,0,0|1,0,1]=4 10573 B13R2.223 CC1(c2ccccc2)CNCO1 Amb27793552 [0,1,0,1,0,0|1,0,1]=4 10574 B13R2.223 CC1(c2ccccc2)OCCO1 Amb9787463 [0,1,0,1,0,0|0,0,2]=4 10575 B13R2.223 NC1(c2ccccc2)CCOC1 Amb24120651 [0,1,0,1,0,0|1,0,1]=4 10576 B13R2.223 NC1(c2ccccc2)CCOC1 Amb33483802 [0,1,0,1,0,0|1,0,1]=4 10577 B13R2.223 O=P1(c2ccccc2)C=CCC1 Amb348009 [0,1,0,1,0,0|2,0,0]=4 10578 B13R2.223 O=P1(c2ccccc2)CCCC1 Amb25833532 [0,1,0,1,0,0|2,0,0]=4 10579 B13R2.223 OC1(c2ccccc2)CCCO1 Amb22752498 [0,1,0,1,0,0|0,0,2]=4 10580 B13R2.223 OC1(c2ccccc2)CCOC1 Amb26079256 [0,1,0,1,0,0|0,0,2]=4 10581 B13R2.371 C=C1CCC(C)c2ccccc21 Amb27254513 [0,1,0,1,0,0|2,0,0]=4 10582 B13R2.371 CC1=CCC(C)c2ccccc21 Amb27800693 [0,1,0,1,0,0|2,0,0]=4 10583 B13R2.371 CC1=NCC(C)c2ccccc21 Amb8384389 [0,1,0,1,0,0|2,0,0]=4 10584 B13R2.371 CC1=NNC(=O)c2ccccc21 Amb19132657 [0,1,0,1,0,0|1,0,1]=4 10585 B13R2.371 CC1=NOC(=O)c2ccccc21 Amb21927595 [0,1,0,1,0,0|0,0,1]=3 10586 B13R2.371 CC1CCC(=O)c2ccccc21 Amb2721256 [0,1,0,1,0,0|1,0,0]=3 10587 B13R2.371 CC1CCC(=O)c2ccncc21 Amb27265836 [0,1,0,1,0,0|2,0,0]=4 10588 B13R2.371 CC1CCC(=O)c2cnccc21 Amb27470815 [0,1,0,1,0,0|2,0,0]=4 10589 B13R2.371 CC1CNC(=O)c2ccccc21 Amb17400088 [0,1,0,1,0,0|1,0,0]=3 10590 B13R2.371 CC1COB(O)c2ccccc21 Amb27435966 [0,1,0,1,0,0|1,0,1]=4 10591 B13R2.371 CC1SCC(=O)c2ccccc21 Amb28285936 [0,1,0,1,0,0|0,1,0]=3 10592 B13R2.371 CN1C=CC(=O)c2ccccc21 Amb18048473 [0,1,0,1,0,0|1,0,1]=4 10593 B13R2.371 CN1C=NC(=O)c2ccccc21 Amb22752698 [0,1,0,1,0,0|1,0,1]=4 10594 B13R2.371 CN1CCC(=O)c2ccccc21 Amb18560299 [0,1,0,1,0,0|1,0,0]=3 10595 B13R2.371 CN1CNC(=O)c2ccccc21 Amb27754082 [0,1,0,1,0,0|1,0,0]=3 10596 B13R2.371 CN1N=CC(=O)c2ccccc21 Amb26626061 [0,1,0,1,0,0|2,0,0]=4 10597 B13R2.371 CN1NCC(=O)c2ccccc21 Amb27177499 [0,1,0,1,0,0|2,0,0]=4 10598 B13R2.371 C[C@@H]1CCC(=O)c2ccccc21 Amb27974633 [0,1,0,1,0,0|1,0,0]=3 10599 B13R2.371 C[C@@H]1CCC(=O)c2ncccc21 Amb27974090 [0,1,0,1,0,0|2,0,0]=4 10600 B13R2.371 C[C@@H]1SCC(=O)c2ccccc21 Amb28202184 [0,1,0,1,0,0|0,1,0]=3 10601 B13R2.371 Cn1ccc(=O)c2ccccc21 Amb4009128 [0,1,0,1,0,0|1,0,1]=4 10602 B13R2.371 NC1CCC(=O)c2ccccc21 Amb20624438 [0,1,0,1,0,0|1,0,0]=3 10603 B13R2.371 NC1CCC(=O)c2ccccc21 Amb9782218 [0,1,0,1,0,0|1,0,0]=3 10604 B13R2.371 NC1CNC(=O)c2ncccc21 Amb18829367 [0,1,0,1,0,0|2,0,0]=4 10605 B13R2.371 N[C@@H]1CCC(=O)c2ccccc21 Amb27634837 [0,1,0,1,0,0|1,0,0]=3 10606 B13R2.371 O=C1CCC(=O)c2ccccc21 Amb24054332 [0,1,0,1,0,0|1,0,1]=4 10607 B13R2.371 O=C1CCC(O)c2ccccc21 Amb22170418 [0,1,0,1,0,0|1,0,0]=3 10608 B13R2.371 O=C1CC[C@H](O)c2ccccc21 Amb24690507 [0,1,0,1,0,0|1,0,0]=3 10609 B13R2.371 O=C1CNC(=O)c2ccccc21 Amb22372293 [0,1,0,1,0,0|1,0,1]=4 10610 B13R2.371 O=C1COC(=O)c2ccccc21 Amb24078409 [0,1,0,1,0,0|0,0,1]=3 10611 B13R2.371 O=C1COC(O)c2ccccc21 Amb27948576 [0,1,0,1,0,0|1,0,0]=3 10612 B13R2.371 O=C1CSC(Cl)c2ccccc21 Amb18636498 [0,1,0,1,0,0|1,1,0]=4 10613 B13R2.371 O=C1NCC(Br)c2ccccc21 Amb32658887 [0,1,0,1,0,0|1,0,0]=3 10614 B13R2.371 O=C1NCC(Cl)c2ccccc21 Amb25992409 [0,1,0,1,0,0|1,0,0]=3 10615 B13R2.371 O=C1NCC(O)c2ccccc21 Amb17615447 [0,1,0,1,0,0|1,0,0]=3 10616 B13R2.371 O=C1OCC(Cl)c2ccccc21 Amb27165775 [0,1,0,1,0,0|0,0,0]=2 10617 B13R2.371 O=C1OCC(O)c2ccccc21 Amb27978275 [0,1,0,1,0,0|0,0,0]=2 10618 B13R2.371 O=S1CC[C@H](O)c2ccccc21 Amb28292126 [0,1,0,1,0,0|2,0,0]=4 10619 B13R2.382 C=C1CC1C(=O)c2ccccc2 Amb27177712 [0,1,0,1,0,0|1,0,1]=4 10620 B13R2.382 CC1CC1C(=O)c2cccnc2 Amb27948457 [0,1,0,1,0,0|2,0,0]=4 10621 B13R2.382 CC1OC1C(=O)c2ccccc2 Amb27447218 [0,1,0,1,0,0|0,0,0]=2 10622 B13R2.382 CC1OC1C(O)c2ccccc2 Amb27416827 [0,1,0,1,0,0|0,0,2]=4 10623 B13R2.382 C[C@H]1C[C@H]1C(=O)c2ccccc2 Amb27782003 [0,1,0,1,0,0|1,0,0]=3 10624 B13R2.382 C[C@H]1O[C@@H]1C(=O)c2ccccc2 Amb27854688 [0,1,0,1,0,0|0,0,0]=2 10625 B13R2.382 C[C@H]1O[C@@H]1[C@@H](O)c2ccccc2 Amb27788493 [0,1,0,1,0,0|0,0,2]=4 10626 B13R2.382 O=C(c1ccccc1)[C@H]2C[C@H]2Cl Amb27777186 [0,1,0,1,0,0|1,0,0]=3 10627 B13R2.633 CC1(c2ccccc2)OC1CN Amb25148602 [0,1,0,1,0,0|1,0,1]=4 10628 B13R2.633 C[C@]1(c2ccccc2)O[C@@H]1CO Amb28344619 [0,1,0,1,0,0|1,0,1]=4 10629 B13R2.690 Cl\C(=N/C1CC1)c2ccccc2 Amb445473 [0,1,0,1,0,0|2,0,0]=4 10630 B13R2.690 N=C(NC1CC1)c2ccccc2 Amb25148469 [0,1,0,1,0,0|2,0,0]=4 10631 B13R2.690 O=C(CC1CC1)c2ccccc2 Amb18792232 [0,1,0,1,0,0|1,0,0]=3 10632 B13R2.690 O=C(CC1CC1)c2ccccn2 Amb27668170 [0,1,0,1,0,0|2,0,0]=4 10633 B13R2.690 O=C(CN1CC1)c2ccccc2 Amb17400091 [0,1,0,1,0,0|1,0,0]=3 10634 B13R2.690 O=C(NC1CC1)c2ccccc2 Amb6531831 [0,1,0,1,0,0|1,0,0]=3 10635 B13R2.690 O=C(NC1CC1)c2ccccn2 Amb8330948 [0,1,0,1,0,0|2,0,0]=4 10636 B13R2.690 O=C(NC1CC1)c2ccncc2 Amb3367754 [0,1,0,1,0,0|2,0,0]=4 10637 B13R2.690 O=C(OC1CC1)c2ccccc2 Amb28243122 [0,1,0,1,0,0|0,0,0]=2 10638 B13R2.690 O=C(OC1CC1)c2ccncc2 Amb27178611 [0,1,0,1,0,0|1,0,0]=3 10639 B13R2.690 O=S(CC1CO1)c2ccccc2 Amb27754164 [0,1,0,1,0,0|2,0,0]=4 10640 B13R2.1028 OCCOC1Cc2ccccc21 Amb27587566 [0,1,0,1,0,0|1,0,1]=4 10641 B13R2.1028 OCC\C=C1\Cc2ccccc21 Amb27833650 [0,1,0,1,0,0|2,0,0]=4 10642 B13R2.5252 BrC1=CCCOc2ccccc21 Amb27649074 [0,1,0,1,0,0|2,0,0]=4 10643 B13R2.5252 C=C1CCCCc2ccccc21 Amb23400875 [0,1,0,1,0,0|2,0,0]=4 10644 B13R2.5252 C=C1CCCOc2ccccc21 Amb19316319 [0,1,0,1,0,0|2,0,0]=4 10645 B13R2.5252 CC1=CCCCc2ccccc21 Amb27986008 [0,1,0,1,0,0|2,0,0]=4 10646 B13R2.5252 CC1=CCCNc2ccccc21 Amb28077152 [0,1,0,1,0,0|2,0,0]=4 10647 B13R2.5252 O=C1CCC=Cc2ccccc21 Amb27802729 [0,1,0,1,0,0|1,0,1]=4 10648 B13R2.5252 O=C1CCCCc2ccccc21 Amb1208402 [0,1,0,1,0,0|1,0,0]=3 10649 B13R2.5252 O=C1CCCNc2ccccc21 Amb2690546 [0,1,0,1,0,0|1,0,0]=3 10650 B13R2.5252 O=C1CCCNc2ncccc21 Amb24664337 [0,1,0,1,0,0|2,0,0]=4 10651 B13R2.5252 O=C1CCCOc2ccccc21 Amb33545871 [0,1,0,1,0,0|1,0,0]=3 10652 B13R2.5252 O=C1CCCSc2ccccc21 Amb33545887 [0,1,0,1,0,0|1,0,0]=3 10653 B13R2.5252 O=C1CCNCc2ccccc21 Amb22499160 [0,1,0,1,0,0|1,0,0]=3 10654 B13R2.5252 O=C1CCNCc2ccccc21 Amb32405167 [0,1,0,1,0,0|1,0,0]=3 10655 B13R2.5252 O=C1CCSCc2ccccc21 Amb27177930 [0,1,0,1,0,0|1,0,0]=3 10656 B13R2.5252 O=C1CNCCc2ccccc21 Amb27389469 [0,1,0,1,0,0|1,0,0]=3 10657 B13R2.5252 O=C1CSCCc2ccccc21 Amb20668935 [0,1,0,1,0,0|0,1,0]=3 10658 B13R2.5252 O=C1N=CCOc2ccccc21 Amb27481084 [0,1,0,1,0,0|1,0,1]=4 10659 B13R2.5252 O=C1NCC=Nc2ccccc21 Amb23592207 [0,1,0,1,0,0|1,0,1]=4 10660 B13R2.5252 O=C1NCCCc2ccccc21 Amb33544472 [0,1,0,1,0,0|1,0,0]=3 10661 B13R2.5252 O=C1NCCCc2cnccc21 Amb27755727 [0,1,0,1,0,0|2,0,0]=4 10662 B13R2.5252 O=C1NCCNc2ccccc21 Amb19958708 [0,1,0,1,0,0|1,0,0]=3 10663 B13R2.5252 O=C1NCCNc2cnccc21 Amb27208710 [0,1,0,1,0,0|2,0,0]=4 10664 B13R2.5252 O=C1NCCOc2ccccc21 Amb2445337 [0,1,0,1,0,0|1,0,0]=3 10665 B13R2.5252 O=C1NCCSc2ccccc21 Amb6360540 [0,1,0,1,0,0|1,0,0]=3 10666 B13R2.5252 O=C1OCCNc2ccncc21 Amb27770034 [0,1,0,1,0,0|1,0,0]=3 10667 B13R2.5252 O=S1CCCNc2ccccc21 Amb19337771 [0,1,0,1,0,0|2,0,0]=4 10668 B13R2.8137 N=C(c1ccccc1)N2CCC2 Amb27870305 [0,1,0,1,0,0|2,0,0]=4 10669 B13R2.8137 O=C(c1ccccc1)C2CCC2 Amb2686621 [0,1,0,1,0,0|1,0,0]=3 10670 B13R2.8137 O=C(c1ccccc1)C2CCN2 Amb27427543 [0,1,0,1,0,0|1,0,0]=3 10671 B13R2.8137 O=C(c1ccccc1)C2CNC2 Amb26605769 [0,1,0,1,0,0|1,0,0]=3 10672 B13R2.8137 O=C(c1ccccc1)C2CSC2 Amb35715970 [0,1,0,1,0,0|1,0,0]=3 10673 B13R2.8137 O=C(c1ccccc1)N2C=CC2 Amb26848824 [0,1,0,1,0,0|1,0,1]=4 10674 B13R2.8137 O=C(c1ccccn1)C2CCC2 Amb6301485 [0,1,0,1,0,0|2,0,0]=4 10675 B13R2.8137 O=C(c1ccccn1)C2CNC2 Amb23598776 [0,1,0,1,0,0|2,0,0]=4 10676 B13R2.8137 O=C(c1ccccn1)C2CNC2 Amb31201521 [0,1,0,1,0,0|2,0,0]=4 10677 B13R2.8137 O=C(c1ccccn1)C2CNC2 Amb32662035 [0,1,0,1,0,0|2,0,0]=4 10678 B13R2.8137 O=C(c1cccnc1)C2CCC2 Amb23455035 [0,1,0,1,0,0|2,0,0]=4 10679 B13R2.8137 O=C(c1cccnc1)C2CNC2 Amb23598775 [0,1,0,1,0,0|2,0,0]=4 10680 B13R2.8137 O=C(c1cccnc1)C2CNC2 Amb32662034 [0,1,0,1,0,0|2,0,0]=4 10681 B13R2.8137 O=C(c1cccnc1)C2CSC2 Amb35715971 [0,1,0,1,0,0|2,0,0]=4 10682 B13R2.8137 O=C(c1cccnc1)N2CCC2 Amb8343964 [0,1,0,1,0,0|2,0,0]=4 10683 B13R2.8137 O=C(c1ccncc1)C2CNC2 Amb23598774 [0,1,0,1,0,0|2,0,0]=4 10684 B13R2.8137 O=C(c1ccncc1)C2CNC2 Amb32662033 [0,1,0,1,0,0|2,0,0]=4 10685 B13R2.8137 O=C(c1ccncc1)N2CCC2 Amb8344348 [0,1,0,1,0,0|2,0,0]=4 10686 B13R2.8137 S=C(c1ccccc1)C2CCC2 Amb27490795 [0,1,0,1,0,0|1,1,0]=4 10687 B13R2.32 C=C1CCc2ccccc2C1=O Amb18561613 [0,1,0,1,0,0|1,0,0]=3 10688 B13R2.32 C=C1COc2ccccc2C1=O Amb18063792 [0,1,0,1,0,0|2,0,0]=4 10689 B13R2.32 C=C1c2ccccc2CCN1C Amb25111593 [0,1,0,1,0,0|2,0,0]=4 10690 B13R2.32 CC1=C(C)c2ccccc2CC1 Amb31292547 [0,1,0,1,0,0|2,0,0]=4 10691 B13R2.32 CC1=[N+]([O-])CCc2ccccc21 Amb27860350 [0,1,0,1,0,0|2,0,0]=4 10692 B13R2.32 CC1CCc2ccccc2C1=O Amb6357464 [0,1,0,1,0,0|1,0,0]=3 10693 B13R2.32 CC1CNc2ccccc2C1=O Amb18062583 [0,1,0,1,0,0|2,0,0]=4 10694 B13R2.32 CC1COc2ccccc2C1=O Amb9783173 [0,1,0,1,0,0|2,0,0]=4 10695 B13R2.32 CC1CSc2ccccc2C1=O Amb9400184 [0,1,0,1,0,0|2,0,0]=4 10696 B13R2.32 CN1CCc2ccccc2C1=O Amb27958468 [0,1,0,1,0,0|1,0,0]=3 10697 B13R2.32 CN1CCc2ccccc2C1=S Amb27190769 [0,1,0,1,0,0|1,1,0]=4 10698 B13R2.32 CN1CCc2ncccc2C1=O Amb27649099 [0,1,0,1,0,0|2,0,0]=4 10699 B13R2.32 CN1NCc2ccccc2C1=O Amb24556524 [0,1,0,1,0,0|2,0,0]=4 10700 B13R2.32 CN1NCc2ccccc2C1=O Amb32652549 [0,1,0,1,0,0|2,0,0]=4 10701 B13R2.32 N=C1COc2ccccc2C1=O Amb27186345 [0,1,0,1,0,0|2,0,0]=4 10702 B13R2.32 NC1CCc2ccccc2C1=O Amb19514850 [0,1,0,1,0,0|1,0,0]=3 10703 B13R2.32 NC1CCc2ccccc2C1=O Amb9782219 [0,1,0,1,0,0|1,0,0]=3 10704 B13R2.32 NC1COc2ccccc2C1=O Amb22049784 [0,1,0,1,0,0|2,0,0]=4 10705 B13R2.32 NC1COc2ccccc2C1=O Amb8439513 [0,1,0,1,0,0|2,0,0]=4 10706 B13R2.32 NN1CCc2ccccc2C1=O Amb18118349 [0,1,0,1,0,0|1,0,0]=3 10707 B13R2.32 NN1CNc2ccccc2C1=O Amb22524841 [0,1,0,1,0,0|2,0,0]=4 10708 B13R2.32 O=C1CCc2ccccc2C1=O Amb28200177 [0,1,0,1,0,0|1,0,0]=3 10709 B13R2.32 O=C1OCc2ccccc2C1=O Amb24633619 [0,1,0,1,0,0|2,0,0]=4 10710 B13R2.32 O=C1c2ccccc2CCC1Br Amb16232578 [0,1,0,1,0,0|1,0,0]=3 10711 B13R2.32 O=C1c2ccccc2CCC1Cl Amb18805198 [0,1,0,1,0,0|1,0,0]=3 10712 B13R2.32 O=C1c2ccccc2CCC1F Amb21965076 [0,1,0,1,0,0|1,0,0]=3 10713 B13R2.32 O=C1c2ccccc2CCC1O Amb24455195 [0,1,0,1,0,0|1,0,0]=3 10714 B13R2.32 O=C1c2ccccc2CCN1O Amb27165147 [0,1,0,1,0,0|1,0,0]=3 10715 B13R2.32 O=C1c2ccccc2CC[C@H]1Cl Amb28458356 [0,1,0,1,0,0|1,0,0]=3 10716 B13R2.32 O=C1c2ccccc2CC[C@H]1F Amb27176059 [0,1,0,1,0,0|1,0,0]=3 10717 B13R2.32 O=C1c2ccccc2OCC1Br Amb22549365 [0,1,0,1,0,0|2,0,0]=4 10718 B13R2.32 O=C1c2ccccc2OCC1F Amb21965068 [0,1,0,1,0,0|2,0,0]=4 10719 B13R2.32 O=C1c2ccccc2OCC1O Amb26593098 [0,1,0,1,0,0|2,0,0]=4 10720 B13R2.45 CCC1=Cc2ccccc2C1=O Amb27177754 [0,1,0,1,0,0|1,0,0]=3 10721 B13R2.45 CCC1Cc2ccccc2C1=O Amb4605959 [0,1,0,1,0,0|1,0,0]=3 10722 B13R2.45 CCC1Cc2cccnc2C1=O Amb22750354 [0,1,0,1,0,0|2,0,0]=4 10723 B13R2.45 CCC1Nc2ccccc2C1=O Amb17594018 [0,1,0,1,0,0|1,0,0]=3 10724 B13R2.45 CCC1Oc2ccccc2C1=O Amb24061517 [0,1,0,1,0,0|1,0,0]=3 10725 B13R2.45 CCC1Sc2ccccc2C1=O Amb27612959 [0,1,0,1,0,0|1,0,0]=3 10726 B13R2.45 CCN1Cc2ccccc2C1=O Amb27400274 [0,1,0,1,0,0|1,0,0]=3 10727 B13R2.45 CCN1Cc2ccncc2C1=O Amb27228910 [0,1,0,1,0,0|2,0,0]=4 10728 B13R2.45 CCN1Nc2ccccc2C1=O Amb26871870 [0,1,0,1,0,0|1,0,0]=3 10729 B13R2.45 CCN1Sc2ccccc2C1=O Amb27977546 [0,1,0,1,0,0|1,0,0]=3 10730 B13R2.45 CC[C@@H]1Cc2ccccc2C1=O Amb27262889 [0,1,0,1,0,0|1,0,0]=3 10731 B13R2.45 CCc1oc2ccccc2c1Br Amb10569511 [0,1,0,1,0,0|2,0,0]=4 10732 B13R2.45 CCc1sc2ccccc2c1C Amb27186788 [0,1,0,1,0,0|2,0,0]=4 10733 B13R2.45 CCn1nc2ccccc2c1C Amb27445629 [0,1,0,1,0,0|2,0,0]=4 10734 B13R2.45 CCn1nc2ccccc2c1I Amb26432397 [0,1,0,1,0,0|2,0,0]=4 10735 B13R2.45 CCn1nc2ccccc2c1N Amb27842296 [0,1,0,1,0,0|2,0,0]=4 10736 B13R2.45 COC1=Nc2ccccc2C1=O Amb28122389 [0,1,0,1,0,0|2,0,0]=4 10737 B13R2.45 COC1Cc2ccccc2C1=O Amb24532698 [0,1,0,1,0,0|2,0,0]=4 10738 B13R2.45 CSC1Cc2ccccc2C1=O Amb28054308 [0,1,0,1,0,0|2,0,0]=4 10739 B13R2.45 C\C=C1/Cc2ccccc2C1=O Amb28076573 [0,1,0,1,0,0|1,0,1]=4 10740 B13R2.45 NCC1=Cc2ccccc2C1=O Amb27466253 [0,1,0,1,0,0|2,0,0]=4 10741 B13R2.45 NCC1Cc2ccccc2C1=O Amb27857480 [0,1,0,1,0,0|2,0,0]=4 10742 B13R2.45 O=C1C(CO)=Cc2ccccc21 Amb27805332 [0,1,0,1,0,0|2,0,0]=4 10743 B13R2.45 O=C1c2ccccc2CN1CO Amb28188217 [0,1,0,1,0,0|2,0,0]=4 10744 B13R2.3085 CC1=C(C)c2ccccc2C1=O Amb27177578 [0,1,0,1,0,0|1,0,1]=4 10745 B13R2.3085 CC1C(=O)c2ccccc2C1Cl Amb27865661 [0,1,0,1,0,0|2,0,0]=4 10746 B13R2.3085 CC1c2ccccc2C(=O)C1O Amb27770302 [0,1,0,1,0,0|1,0,0]=3 10747 B13R2.3085 CN1C(=O)C(=O)c2ccccc21 Amb6335574 [0,1,0,1,0,0|2,0,0]=4 10748 B13R2.3085 CN1C(=O)c2ccccc2C1O Amb1155091 [0,1,0,1,0,0|2,0,0]=4 10749 B13R2.3085 CN1c2ccccc2C(=O)C1O Amb27164622 [0,1,0,1,0,0|2,0,0]=4 10750 B13R2.3085 C[C@@H]1C(=O)c2ccccc2[C@H]1C Amb27195793 [0,1,0,1,0,0|1,0,0]=3 10751 B13R2.3085 NC1C(=O)c2ccccc2C1O Amb25700423 [0,1,0,1,0,0|2,0,0]=4 10752 B13R2.3085 NC1c2ccccc2C(=O)C1Cl Amb27856270 [0,1,0,1,0,0|2,0,0]=4 10753 B13R2.3085 NC1c2ccccc2C(=O)C1O Amb28293154 [0,1,0,1,0,0|2,0,0]=4 10754 B13R2.3085 N[C@H]1c2ccccc2C(=O)[C@@H]1Br Amb27626955 [0,1,0,1,0,0|2,0,0]=4 10755 B13R2.8138 CC1(C(=O)c2ccccc2)CC1 Amb18563491 [0,1,0,1,0,0|1,0,0]=3 10756 B13R2.8138 CC1(C(=O)c2ccccc2)CO1 Amb27175984 [0,1,0,1,0,0|2,0,0]=4 10757 B13R2.8138 NC1(C(=O)c2ccccc2)CC1 Amb33038462 [0,1,0,1,0,0|1,0,0]=3 10758 B13R2.8138 NC1(C(=O)c2ccccc2)CC1 Amb5739584 [0,1,0,1,0,0|1,0,0]=3 10759 B13R2.8138 NC1(C(=O)c2cccnc2)CC1 Amb28423122 [0,1,0,1,0,0|2,0,0]=4 10760 B13R2.8138 O=S(c1ccccc1)C2(Cl)CC2 Amb24183980 [0,1,0,1,0,0|2,0,0]=4 10761 B13R2.3063 O=S(=O)(c1ccccc1)N2CC2 Amb3987174 [0,1,0,1,0,0|2,0,0]=4 10762 B13R2.12159 CC1(C)CC(=O)c2ccccc21 Amb6739860 [0,1,0,1,0,0|1,0,0]=3 10763 B13R2.12159 CC1(C)NC(=O)c2ccccc21 Amb22899742 [0,1,0,1,0,0|1,0,0]=3 10764 B13R2.12159 CC1(C)OB(O)c2ccccc21 Amb16233581 [0,1,0,1,0,0|1,0,1]=4 10765 B13R2.12159 CC1(C)OC(=O)c2ccccc21 Amb17778630 [0,1,0,1,0,0|0,0,0]=2 10766 B13R2.12159 CC1(C)O[IH2](Cl)c2ccccc21 Amb21961271 [0,1,0,1,0,0|2,0,0]=4 10767 B13R2.12159 CC1(C)O[IH2](F)c2ccccc21 Amb24324964 [0,1,0,1,0,0|2,0,0]=4 10768 B13R2.12159 CC1(C)O[IH2](O)c2ccccc21 Amb26638216 [0,1,0,1,0,0|1,0,1]=4 10769 B13R2.12159 CC1(O)CC(=O)c2ncccc21 Amb22750340 [0,1,0,1,0,0|2,0,0]=4 10770 B13R2.12159 CC1(O)OC(=O)c2cccnc21 Amb26433704 [0,1,0,1,0,0|1,0,0]=3 10771 B13R2.12159 CC1=CC(C)(O)c2ccccc21 Amb17778887 [0,1,0,1,0,0|2,0,0]=4 10772 B13R2.12159 CC1NS(=O)(=O)c2ccccc21 Amb22497137 [0,1,0,1,0,0|2,0,0]=4 10773 B13R2.12159 CS1(=O)=NC(=O)c2ccccc21 Amb31251514 [0,1,0,1,0,0|2,0,0]=4 10774 B13R2.12159 O=C1CC(F)(F)c2ccccc21 Amb28070042 [0,1,0,1,0,0|2,0,0]=4 10775 B13R2.12159 O=C1OC(Cl)(Cl)c2ccccc21 Amb16233588 [0,1,0,1,0,0|1,0,0]=3 10776 B13R2.12159 O=C1OI(=O)(O)c2ccccc21 Amb3358706 [0,1,0,1,0,0|2,0,0]=4 10777 B13R2.12159 O=C1OS(=O)(=O)c2ccccc21 Amb2700804 [0,1,0,1,0,0|2,0,0]=4 10778 B13R2.12159 O=S1(=O)OC(Cl)c2ccccc21 Amb6365032 [0,1,0,1,0,0|2,0,0]=4 10779 B13R2.18 Brc1ccccc1C2=NCCN2 Amb18069920 [0,1,0,1,0,0|2,0,0]=4 10780 B13R2.18 Brc1ccccc1C2=NCCO2 Amb18063906 [0,1,0,1,0,0|1,0,0]=3 10781 B13R2.18 Brc1ccccc1C2NCCO2 Amb18571581 [0,1,0,1,0,0|1,0,1]=4 10782 B13R2.18 Brc1ccccc1C2OCCO2 Amb3939651 [0,1,0,1,0,0|0,0,2]=4 10783 B13R2.18 Cc1ccccc1C2=NCCC2 Amb26420612 [0,1,0,1,0,0|2,0,0]=4 10784 B13R2.18 Cc1ccccc1C2=NCCN2 Amb18563497 [0,1,0,1,0,0|2,0,0]=4 10785 B13R2.18 Cc1ccccc1C2NCCO2 Amb17334581 [0,1,0,1,0,0|1,0,1]=4 10786 B13R2.18 Cc1ccccc1C2OCCO2 Amb17334606 [0,1,0,1,0,0|0,0,2]=4 10787 B13R2.18 Clc1ccccc1C2=NCCC2 Amb22285378 [0,1,0,1,0,0|2,0,0]=4 10788 B13R2.18 Clc1ccccc1C2=NCCN2 Amb8487312 [0,1,0,1,0,0|2,0,0]=4 10789 B13R2.18 Clc1ccccc1C2=NCCS2 Amb10573095 [0,1,0,1,0,0|1,1,0]=4 10790 B13R2.18 Clc1ccccc1C2NCCO2 Amb17335655 [0,1,0,1,0,0|1,0,1]=4 10791 B13R2.18 Clc1ccccc1C2OCCO2 Amb4018444 [0,1,0,1,0,0|0,0,2]=4 10792 B13R2.18 Fc1ccccc1C2=CCCC2 Amb26360444 [0,1,0,1,0,0|2,0,0]=4 10793 B13R2.18 Fc1ccccc1C2=NCCC2 Amb28137768 [0,1,0,1,0,0|2,0,0]=4 10794 B13R2.18 Fc1ccccc1C2=NCCN2 Amb17578183 [0,1,0,1,0,0|2,0,0]=4 10795 B13R2.18 Fc1ccccc1C2=NCCO2 Amb27780524 [0,1,0,1,0,0|1,0,0]=3 10796 B13R2.18 Fc1ccccc1C2NCCO2 Amb17334699 [0,1,0,1,0,0|1,0,1]=4 10797 B13R2.18 Fc1ccccc1C2OCCO2 Amb17334709 [0,1,0,1,0,0|0,0,2]=4 10798 B13R2.18 Ic1ccccc1C2=NCCC2 Amb28435190 [0,1,0,1,0,0|2,0,0]=4 10799 B13R2.18 Ic1ccccc1C2OCCO2 Amb25669556 [0,1,0,1,0,0|0,0,2]=4 10800 B13R2.18 Nc1ccccc1C2=CCCO2 Amb27406595 [0,1,0,1,0,0|1,0,0]=3 10801 B13R2.18 Nc1ccccc1C2=NCCN2 Amb6739917 [0,1,0,1,0,0|2,0,0]=4 10802 B13R2.18 Nc1ccccc1C2=NCCO2 Amb18063926 [0,1,0,1,0,0|1,0,0]=3 10803 B13R2.18 Nc1ccccc1C2OCCO2 Amb17334637 [0,1,0,1,0,0|0,0,2]=4 10804 B13R2.18 Oc1ccccc1C2=NCCN2 Amb4027022 [0,1,0,1,0,0|2,0,0]=4 10805 B13R2.18 Oc1ccccc1C2=NCCO2 Amb18645804 [0,1,0,1,0,0|1,0,0]=3 10806 B13R2.18 Oc1ccccc1C2CCCO2 Amb18646054 [0,1,0,1,0,0|1,0,1]=4 10807 B13R2.18 Sc1ccccc1C2=CCCN2 Amb22363566 [0,1,0,1,0,0|2,0,0]=4 10808 B13R2.18 Sc1ccccc1C2=NCCN2 Amb2425856 [0,1,0,1,0,0|2,0,0]=4 10809 B13R2.3097 CC(=C1CC1)c2ccccc2N Amb27845534 [0,1,0,1,0,0|2,0,0]=4 10810 B13R2.3097 Cc1ccccc1C(=O)C2CC2 Amb6302167 [0,1,0,1,0,0|1,0,0]=3 10811 B13R2.3097 Cc1cccnc1C(=O)C2CC2 Amb27879425 [0,1,0,1,0,0|2,0,0]=4 10812 B13R2.3097 Cc1cccnc1C(=O)N2CC2 Amb28283549 [0,1,0,1,0,0|2,0,0]=4 10813 B13R2.3097 Nc1cccnc1C(=O)C2CC2 Amb23455060 [0,1,0,1,0,0|2,0,0]=4 10814 B13R2.3097 Nc1ccncc1C(=O)C2CC2 Amb23455059 [0,1,0,1,0,0|2,0,0]=4 10815 B13R2.3097 Nc1ccncc1C(=O)C2CC2 Amb30584864 [0,1,0,1,0,0|2,0,0]=4 10816 B13R2.3097 O=C(c1cccc[n+]1[O-])N2CC2 Amb28369618 [0,1,0,1,0,0|2,0,0]=4 10817 B13R2.3097 O=C(c1ccccc1Br)C2CC2 Amb17343204 [0,1,0,1,0,0|1,0,0]=3 10818 B13R2.3097 O=C(c1ccccc1Br)N2CC2 Amb27391551 [0,1,0,1,0,0|1,0,0]=3 10819 B13R2.3097 O=C(c1ccccc1Cl)C2CC2 Amb6302188 [0,1,0,1,0,0|1,0,0]=3 10820 B13R2.3097 O=C(c1ccccc1F)C2CC2 Amb6302189 [0,1,0,1,0,0|1,0,0]=3 10821 B13R2.3097 O=C(c1ccccc1I)C2CC2 Amb27840828 [0,1,0,1,0,0|1,0,0]=3 10822 B13R2.3097 O=C(c1ccccc1I)N2CC2 Amb28125422 [0,1,0,1,0,0|1,0,0]=3 10823 B13R2.3097 O=C(c1ccccc1O)C2CC2 Amb26936432 [0,1,0,1,0,0|1,0,0]=3 10824 B13R2.3097 O=C(c1cccnc1Cl)C2CC2 Amb23454979 [0,1,0,1,0,0|2,0,0]=4 10825 B13R2.3097 O=C(c1cccnc1Cl)N2CC2 Amb28366306 [0,1,0,1,0,0|2,0,0]=4 10826 B13R2.3097 O=C(c1cccnc1O)N2CC2 Amb27980073 [0,1,0,1,0,0|2,0,0]=4 10827 B13R2.3097 O=C(c1ccncc1Br)C2CC2 Amb23455124 [0,1,0,1,0,0|2,0,0]=4 10828 B13R2.3097 O=C(c1ccncc1F)C2CC2 Amb23455230 [0,1,0,1,0,0|2,0,0]=4 10829 B13R2.3097 O=C(c1ccncc1I)N2CC2 Amb27649760 [0,1,0,1,0,0|2,0,0]=4 10830 B13R2.3097 O=C(c1cnccc1Cl)C2CC2 Amb23455118 [0,1,0,1,0,0|2,0,0]=4 10831 B13R2.3569 CC1(c2ccccc2Br)CCO1 Amb26908669 [0,1,0,1,0,0|1,0,1]=4 10832 B13R2.3569 CC1(c2ccccc2F)CCO1 Amb32946043 [0,1,0,1,0,0|1,0,1]=4 10833 B13R2.4818 Cc1cccc2c1C(=O)CCC2 Amb22230186 [0,1,0,1,0,0|1,0,0]=3 10834 B13R2.4818 Cc1cccc2c1C(=O)CCN2 Amb18829956 [0,1,0,1,0,0|2,0,0]=4 10835 B13R2.4818 Cc1cccc2c1C(=O)CCO2 Amb18829762 [0,1,0,1,0,0|2,0,0]=4 10836 B13R2.4818 Cc1cccc2c1C(=O)CCS2 Amb18824838 [0,1,0,1,0,0|2,0,0]=4 10837 B13R2.4818 Cc1cccc2c1C(=O)NCC2 Amb18563086 [0,1,0,1,0,0|1,0,0]=3 10838 B13R2.4818 Cc1ccnc2c1C(=O)CCC2 Amb18829937 [0,1,0,1,0,0|2,0,0]=4 10839 B13R2.4818 Nc1cccc2c1C(=O)CCC2 Amb22491494 [0,1,0,1,0,0|1,0,0]=3 10840 B13R2.4818 Nc1cccc2c1C(=O)CCN2 Amb27950978 [0,1,0,1,0,0|2,0,0]=4 10841 B13R2.4818 Nc1cccc2c1C(=O)NCC2 Amb18064242 [0,1,0,1,0,0|1,0,0]=3 10842 B13R2.4818 O=C1C=CNC2=C1C(=O)CCC2 Amb24513619 [0,1,0,1,0,0|2,0,0]=4 10843 B13R2.4818 O=C1CCCc2cccc(Br)c21 Amb8388747 [0,1,0,1,0,0|1,0,0]=3 10844 B13R2.4818 O=C1CCCc2cccc(Cl)c21 Amb13883634 [0,1,0,1,0,0|1,0,0]=3 10845 B13R2.4818 O=C1CCCc2cccc(F)c21 Amb10603941 [0,1,0,1,0,0|1,0,0]=3 10846 B13R2.4818 O=C1CCCc2cccc(I)c21 Amb16233089 [0,1,0,1,0,0|1,0,0]=3 10847 B13R2.4818 O=C1CCCc2cccc(O)c21 Amb18645630 [0,1,0,1,0,0|1,0,0]=3 10848 B13R2.4818 O=C1CCCc2cccc(S)c21 Amb28145964 [0,1,0,1,0,0|1,0,0]=3 10849 B13R2.4818 O=C1CCNc2cccc(Br)c21 Amb18753485 [0,1,0,1,0,0|2,0,0]=4 10850 B13R2.4818 O=C1CCNc2cccc(Cl)c21 Amb18823866 [0,1,0,1,0,0|2,0,0]=4 10851 B13R2.4818 O=C1CCNc2cccc(F)c21 Amb28072837 [0,1,0,1,0,0|2,0,0]=4 10852 B13R2.4818 O=C1CCNc2cccc(I)c21 Amb25716066 [0,1,0,1,0,0|2,0,0]=4 10853 B13R2.4818 O=C1CCOc2cccc(Br)c21 Amb16233097 [0,1,0,1,0,0|2,0,0]=4 10854 B13R2.4818 O=C1CCOc2cccc(Cl)c21 Amb16233096 [0,1,0,1,0,0|2,0,0]=4 10855 B13R2.4818 O=C1CCOc2cccc(F)c21 Amb16233077 [0,1,0,1,0,0|2,0,0]=4 10856 B13R2.4818 O=C1CCOc2cccc(O)c21 Amb27855395 [0,1,0,1,0,0|2,0,0]=4 10857 B13R2.4818 O=C1CCOc2cccc(S)c21 Amb27815330 [0,1,0,1,0,0|2,0,0]=4 10858 B13R2.4818 O=C1CCSc2cccc(Br)c21 Amb25121325 [0,1,0,1,0,0|2,0,0]=4 10859 B13R2.4818 O=C1CCSc2cccc(Cl)c21 Amb18811413 [0,1,0,1,0,0|2,0,0]=4 10860 B13R2.4818 O=C1CCSc2cccc(F)c21 Amb24183291 [0,1,0,1,0,0|2,0,0]=4 10861 B13R2.4818 O=C1CCSc2cccc(I)c21 Amb25315433 [0,1,0,1,0,0|2,0,0]=4 10862 B13R2.4818 O=C1COCc2cccc(Cl)c21 Amb24081478 [0,1,0,1,0,0|2,0,0]=4 10863 B13R2.4818 O=C1COCc2cccc(I)c21 Amb25096376 [0,1,0,1,0,0|2,0,0]=4 10864 B13R2.4818 O=C1COCc2cccc(O)c21 Amb28388764 [0,1,0,1,0,0|2,0,0]=4 10865 B13R2.4818 O=C1NCCc2cccc(Br)c21 Amb18065023 [0,1,0,1,0,0|1,0,0]=3 10866 B13R2.4818 O=C1NCCc2cccc(Cl)c21 Amb18563088 [0,1,0,1,0,0|1,0,0]=3 10867 B13R2.4818 O=C1NCCc2cccc(F)c21 Amb18563087 [0,1,0,1,0,0|1,0,0]=3 10868 B13R2.4818 O=C1NCCc2cccc(O)c21 Amb22754565 [0,1,0,1,0,0|1,0,0]=3 10869 B13R2.4818 O=C1NCCc2ccnc(Cl)c21 Amb18823459 [0,1,0,1,0,0|2,0,0]=4 10870 B13R2.4818 O=C1OCCc2cccc(Br)c21 Amb28139703 [0,1,0,1,0,0|0,0,0]=2 10871 B13R2.4818 O=C1OCCc2cccc(I)c21 Amb28125794 [0,1,0,1,0,0|0,0,0]=2 10872 B13R2.4818 O=C1OCCc2cccc(O)c21 Amb10604225 [0,1,0,1,0,0|0,0,0]=2 10873 B13R2.4818 O=C1OCOc2cccc(Br)c21 Amb24077632 [0,1,0,1,0,0|1,0,0]=3 10874 B13R2.4818 O=C1OCOc2cccc(F)c21 Amb24077628 [0,1,0,1,0,0|1,0,0]=3 10875 B13R3.1962 c1ccc2c(c1)[C@@H]3CC[C@H]2O3 Amb25679044 [0,0,0,2,0,0|1,0,1]=4 10876 B13R3.274 O=C1c2ccccc2C3CC13 Amb24533047 [0,0,0,2,0,0|1,0,0]=3 10877 B9R1.11 C=C(CC)c1ccco1 Amb28119044 [1,0,0,0,1,0|2,0,0]=4 10878 B9R1.11 C=C(CC)c1cccs1 Amb27494295 [1,0,0,0,1,0|2,0,0]=4 10879 B9R1.11 CC(CO)=C1C=CC=C1 Amb27981717 [1,0,0,0,1,0|2,0,0]=4 10880 B9R1.11 CCC(=O)c1ccco1 Amb844124 [1,0,0,0,1,0|1,0,0]=3 10881 B9R1.11 CCC(=O)c1cccs1 Amb2690591 [1,0,0,0,1,0|1,0,0]=3 10882 B9R1.11 CCC(=O)c1ccoc1 Amb27196907 [1,0,0,0,1,0|1,0,0]=3 10883 B9R1.11 CCC(=O)c1ccsc1 Amb6298062 [1,0,0,0,1,0|1,0,0]=3 10884 B9R1.11 CCC(=O)c1cnco1 Amb33328540 [1,0,0,0,1,0|2,0,0]=4 10885 B9R1.11 CCC(=O)c1cnsc1 Amb35716779 [1,0,0,0,1,0|2,0,0]=4 10886 B9R1.11 CCC(=O)c1cscn1 Amb24384180 [1,0,0,0,1,0|2,0,0]=4 10887 B9R1.11 CCC(=O)c1nccs1 Amb2592102 [1,0,0,0,1,0|2,0,0]=4 10888 B9R1.11 CCC(=O)n1ccnc1 Amb2690402 [1,0,0,0,1,0|2,0,0]=4 10889 B9R1.11 CCS(=O)c1cccs1 Amb27590898 [1,0,0,0,1,0|2,0,0]=4 10890 B9R1.11 CNC(=O)c1ccco1 Amb2612183 [1,0,0,0,1,0|2,0,0]=4 10891 B9R1.11 CNC(=O)c1cccs1 Amb2612184 [1,0,0,0,1,0|2,0,0]=4 10892 B9R1.11 CNC(=O)c1ccsc1 Amb2612185 [1,0,0,0,1,0|2,0,0]=4 10893 B9R1.11 COC(=N)c1cccs1 Amb17621680 [1,0,0,0,1,0|2,0,0]=4 10894 B9R1.11 COC(=N)c1ccoc1 Amb27837467 [1,0,0,0,1,0|2,0,0]=4 10895 B9R1.11 COC(=O)c1ccco1 Amb4302709 [1,0,0,0,1,0|1,0,0]=3 10896 B9R1.11 COC(=O)c1cccs1 Amb1911537 [1,0,0,0,1,0|1,0,0]=3 10897 B9R1.11 COC(=O)c1ccno1 Amb4450531 [1,0,0,0,1,0|2,0,0]=4 10898 B9R1.11 COC(=O)c1ccns1 Amb13883507 [1,0,0,0,1,0|2,0,0]=4 10899 B9R1.11 COC(=O)c1ccoc1 Amb33531546 [1,0,0,0,1,0|1,0,0]=3 10900 B9R1.11 COC(=O)c1ccsc1 Amb9245220 [1,0,0,0,1,0|1,0,0]=3 10901 B9R1.11 COC(=O)c1cnco1 Amb21520455 [1,0,0,0,1,0|2,0,0]=4 10902 B9R1.11 COC(=O)c1cncs1 Amb2455728 [1,0,0,0,1,0|2,0,0]=4 10903 B9R1.11 COC(=O)c1cnoc1 Amb22754239 [1,0,0,0,1,0|2,0,0]=4 10904 B9R1.11 COC(=O)c1cnsc1 Amb25705771 [1,0,0,0,1,0|2,0,0]=4 10905 B9R1.11 COC(=O)c1cocn1 Amb21857674 [1,0,0,0,1,0|2,0,0]=4 10906 B9R1.11 COC(=O)c1cscn1 Amb10067320 [1,0,0,0,1,0|2,0,0]=4 10907 B9R1.11 COC(=O)c1ncco1 Amb22001762 [1,0,0,0,1,0|2,0,0]=4 10908 B9R1.11 COC(=O)c1nccs1 Amb10807389 [1,0,0,0,1,0|2,0,0]=4 10909 B9R1.11 COC(=O)n1cccc1 Amb4477192 [1,0,0,0,1,0|1,0,0]=3 10910 B9R1.11 COC(=O)n1cccn1 Amb3373376 [1,0,0,0,1,0|2,0,0]=4 10911 B9R1.11 COC(=S)c1cccs1 Amb27782424 [1,0,0,0,1,0|1,1,0]=4 10912 B9R1.11 COC(=S)c1ccsc1 Amb27633360 [1,0,0,0,1,0|1,1,0]=4 10913 B9R1.11 NCC(=O)c1ccco1 Amb18642269 [1,0,0,0,1,0|2,0,0]=4 10914 B9R1.11 NCC(=O)c1ccco1 Amb19373982 [1,0,0,0,1,0|2,0,0]=4 10915 B9R1.11 NCC(=O)c1cccs1 Amb1286169 [1,0,0,0,1,0|2,0,0]=4 10916 B9R1.11 NCC(=O)c1cccs1 Amb5739529 [1,0,0,0,1,0|2,0,0]=4 10917 B9R1.11 NCC(=O)c1ccoc1 Amb18642270 [1,0,0,0,1,0|2,0,0]=4 10918 B9R1.11 NCC(=O)c1ccsc1 Amb18643742 [1,0,0,0,1,0|2,0,0]=4 10919 B9R1.11 O=C(CBr)c1ccco1 Amb2721798 [1,0,0,0,1,0|2,0,0]=4 10920 B9R1.11 O=C(CBr)c1cccs1 Amb2720497 [1,0,0,0,1,0|2,0,0]=4 10921 B9R1.11 O=C(CBr)c1ccsc1 Amb2723197 [1,0,0,0,1,0|2,0,0]=4 10922 B9R1.11 O=C(CBr)n1cccc1 Amb27244789 [1,0,0,0,1,0|2,0,0]=4 10923 B9R1.11 O=C(CCl)c1ccco1 Amb17138398 [1,0,0,0,1,0|2,0,0]=4 10924 B9R1.11 O=C(CCl)c1cccs1 Amb2686490 [1,0,0,0,1,0|2,0,0]=4 10925 B9R1.11 O=C(CCl)c1ccoc1 Amb22395346 [1,0,0,0,1,0|2,0,0]=4 10926 B9R1.11 O=C(CCl)c1ccsc1 Amb25727715 [1,0,0,0,1,0|2,0,0]=4 10927 B9R1.11 O=C(CF)c1cccs1 Amb21964939 [1,0,0,0,1,0|2,0,0]=4 10928 B9R1.11 O=C(CI)c1cccs1 Amb28368856 [1,0,0,0,1,0|2,0,0]=4 10929 B9R1.11 O=C(CI)c1ccoc1 Amb27647081 [1,0,0,0,1,0|2,0,0]=4 10930 B9R1.11 O=C(CO)c1ccco1 Amb17689139 [1,0,0,0,1,0|2,0,0]=4 10931 B9R1.11 O=C(CO)c1cccs1 Amb25742219 [1,0,0,0,1,0|2,0,0]=4 10932 B9R1.11 O=C(CS)c1cccs1 Amb17400035 [1,0,0,0,1,0|2,0,0]=4 10933 B9R1.11 O=C(O[Cu])c1cccs1 Amb13890298 [1,0,0,0,1,0|2,0,0]=4 10934 B9R1.11 O=C(O[Na])c1cccs1 Amb3150403 [1,0,0,0,1,0|2,0,0]=4 10935 B9R1.11 [NH3+]CC(=O)c1cccs1 Amb17848802 [1,0,0,0,1,0|2,0,0]=4 10936 B9R1.12 CCOCc1ccco1 Amb22234292 [1,0,0,0,1,0|1,0,1]=4 10937 B9R1.12 CCOCn1cccc1 Amb27954704 [1,0,0,0,1,0|1,0,1]=4 10938 B9R1.12 CC\N=C\c1ccco1 Amb27443134 [1,0,0,0,1,0|2,0,0]=4 10939 B9R1.73 CCOC(=O)C1=CCC1 Amb25317027 [0,0,0,0,2,0|0,0,2]=4 10940 B11R1.852 C=CC(=O)C1=CC=CC=CC1 Amb27854918 [1,0,0,0,0,1|0,0,2]=4 10941 B11R1.852 COC(=O)C1=C=NC=CC=C1 Amb24736682 [1,0,0,0,0,1|0,0,1]=3 10942 B11R1.852 COC(=O)C1=CC=C=CC=C1 Amb24060625 [1,0,0,0,0,1|0,0,0]=2 10943 B11R1.852 COC(=O)C1=CC=CC=CC1 Amb27229360 [1,0,0,0,0,1|0,0,0]=2 10944 B11R1.852 COC(=O)C1=CC=CC=CO1 Amb27227839 [1,0,0,0,0,1|0,0,0]=2 10945 B11R1.852 COC(=O)C1=CCC=CC=C1 Amb28315041 [1,0,0,0,0,1|0,0,0]=2 10946 B11R1.852 COC(=O)C1C=CC=CCC1 Amb26475872 [1,0,0,0,0,1|0,0,2]=4 10947 B11R1.852 COC(=O)N1C=CC=CC=N1 Amb24422879 [1,0,0,0,0,1|1,0,0]=3 10948 B11R1.852 COC(=O)N1C=CC=CCC1 Amb27476140 [1,0,0,0,0,1|1,0,1]=4 10949 B11R1.852 COC(=O)N1C=CCCC=C1 Amb27658838 [1,0,0,0,0,1|1,0,1]=4 10950 B11R1.852 O=C(NO)C1=CC=CC=CC1 Amb25225570 [1,0,0,0,0,1|2,0,0]=4 10951 B13R1.42 C=COC(=O)CCc1ccccc1 Amb21858909 [0,0,0,0,0,2|0,0,2]=4 10952 B13R1.42 C=COC(=O)OCc1ccccc1 Amb8471025 [0,0,0,0,0,2|0,0,2]=4 10953 B13R1.42 CC#CC(=O)C#Cc1ccccc1 Amb27476271 [0,0,0,0,0,2|1,0,1]=4 10954 B13R1.42 CC#CC(=O)CCc1ccccc1 Amb17619342 [0,0,0,0,0,2|1,0,1]=4 10955 B13R1.42 CC#CC(=O)NNc1ccccc1 Amb27218830 [0,0,0,0,0,2|1,0,1]=4 10956 B13R1.42 CCCC(=N)NCc1ccccc1 Amb27973328 [0,0,0,0,0,2|2,0,0]=4 10957 B13R1.42 CCCC(=O)C#Cc1ccccc1 Amb17594320 [0,0,0,0,0,2|1,0,0]=3 10958 B13R1.42 CCCC(=O)CCc1ccccc1 Amb9031589 [0,0,0,0,0,2|1,0,0]=3 10959 B13R1.42 CCCC(=O)CSc1ccccc1 Amb18330492 [0,0,0,0,0,2|1,0,0]=3 10960 B13R1.42 CCCC(=O)NCc1ccccc1 Amb2701481 [0,0,0,0,0,2|1,0,0]=3 10961 B13R1.42 CCCC(=O)NNc1ccccc1 Amb4081014 [0,0,0,0,0,2|1,0,0]=3 10962 B13R1.42 CCCC(=O)NNc1ccncc1 Amb28051157 [0,0,0,0,0,2|2,0,0]=4 10963 B13R1.42 CCCC(=O)OCc1ccccc1 Amb6357333 [0,0,0,0,0,2|1,0,0]=3 10964 B13R1.42 CCC\C(C)=N\Nc1ccccc1 Amb27806061 [0,0,0,0,0,2|2,0,0]=4 10965 B13R1.42 CCC\C(N)=N\Nc1ccccc1 Amb27180324 [0,0,0,0,0,2|2,0,0]=4 10966 B13R1.42 CCNC(=N)NCc1ccccc1 Amb18804667 [0,0,0,0,0,2|2,0,0]=4 10967 B13R1.42 CCNC(=O)C#Cc1ccccc1 Amb27230535 [0,0,0,0,0,2|1,0,0]=3 10968 B13R1.42 CCNC(=O)CCc1ccccc1 Amb6542498 [0,0,0,0,0,2|1,0,0]=3 10969 B13R1.42 CCNC(=O)CNc1ccccc1 Amb6477739 [0,0,0,0,0,2|1,0,0]=3 10970 B13R1.42 CCNC(=O)CNc1ccccn1 Amb9253323 [0,0,0,0,0,2|2,0,0]=4 10971 B13R1.42 CCNC(=O)NCc1ccncc1 Amb24383174 [0,0,0,0,0,2|2,0,0]=4 10972 B13R1.42 CCNC(=O)NNc1ccccc1 Amb24710661 [0,0,0,0,0,2|1,0,0]=3 10973 B13R1.42 CCNC(=O)NNc1ccccn1 Amb27809493 [0,0,0,0,0,2|2,0,0]=4 10974 B13R1.42 CCNC(=O)OCc1ccccc1 Amb24375743 [0,0,0,0,0,2|1,0,0]=3 10975 B13R1.42 CCNC(=O)\C=C\c1ccccc1 Amb3358403 [0,0,0,0,0,2|1,0,0]=3 10976 B13R1.42 CCNC(=S)NNc1ccccc1 Amb2762753 [0,0,0,0,0,2|1,1,0]=4 10977 B13R1.42 CCOC(=N)CCc1ccccn1 Amb24094195 [0,0,0,0,0,2|2,0,0]=4 10978 B13R1.42 CCOC(=N)CCc1ccncc1 Amb24094201 [0,0,0,0,0,2|2,0,0]=4 10979 B13R1.42 CCOC(=O)C#Cc1ccccc1 Amb2721509 [0,0,0,0,0,2|0,0,0]=2 10980 B13R1.42 CCOC(=O)C#Cc1ccccn1 Amb24494363 [0,0,0,0,0,2|1,0,0]=3 10981 B13R1.42 CCOC(=O)C#Cc1cccnc1 Amb27259063 [0,0,0,0,0,2|1,0,0]=3 10982 B13R1.42 CCOC(=O)C#Cc1cccnn1 Amb33168725 [0,0,0,0,0,2|2,0,0]=4 10983 B13R1.42 CCOC(=O)C#Cc1ccncc1 Amb26471725 [0,0,0,0,0,2|1,0,0]=3 10984 B13R1.42 CCOC(=O)C#Cc1ccncn1 Amb33168720 [0,0,0,0,0,2|2,0,0]=4 10985 B13R1.42 CCOC(=O)C#Cc1ccnnc1 Amb33168671 [0,0,0,0,0,2|2,0,0]=4 10986 B13R1.42 CCOC(=O)C#Cc1cnccn1 Amb27167525 [0,0,0,0,0,2|2,0,0]=4 10987 B13R1.42 CCOC(=O)C#Cc1cncnc1 Amb24668597 [0,0,0,0,0,2|2,0,0]=4 10988 B13R1.42 CCOC(=O)C#Cc1ncccn1 Amb33168722 [0,0,0,0,0,2|2,0,0]=4 10989 B13R1.42 CCOC(=O)CCc1ccccc1 Amb3940133 [0,0,0,0,0,2|0,0,0]=2 10990 B13R1.42 CCOC(=O)CCc1ccccn1 Amb5721889 [0,0,0,0,0,2|1,0,0]=3 10991 B13R1.42 CCOC(=O)CCc1ncccn1 Amb24061350 [0,0,0,0,0,2|2,0,0]=4 10992 B13R1.42 CCOC(=O)CNc1ccccc1 Amb1025527 [0,0,0,0,0,2|0,0,0]=2 10993 B13R1.42 CCOC(=O)CNc1ccccc1 Amb21961619 [0,0,0,0,0,2|0,0,0]=2 10994 B13R1.42 CCOC(=O)CNc1ccccn1 Amb18181060 [0,0,0,0,0,2|1,0,0]=3 10995 B13R1.42 CCOC(=O)CNc1cccnc1 Amb24180824 [0,0,0,0,0,2|1,0,0]=3 10996 B13R1.42 CCOC(=O)CNc1ccncc1 Amb18181061 [0,0,0,0,0,2|1,0,0]=3 10997 B13R1.42 CCOC(=O)CNc1ncccn1 Amb18181292 [0,0,0,0,0,2|2,0,0]=4 10998 B13R1.42 CCOC(=O)COc1ccccc1 Amb2687923 [0,0,0,0,0,2|0,0,0]=2 10999 B13R1.42 CCOC(=O)COc1ccccn1 Amb22493952 [0,0,0,0,0,2|1,0,0]=3 11000 B13R1.42 CCOC(=O)COc1cccnc1 Amb836907 [0,0,0,0,0,2|1,0,0]=3 11001 B13R1.42 CCOC(=O)CSc1ccccc1 Amb2408276 [0,0,0,0,0,2|0,0,0]=2 11002 B13R1.42 CCOC(=O)CSc1ccccn1 Amb6504909 [0,0,0,0,0,2|1,0,0]=3 11003 B13R1.42 CCOC(=O)CSc1cccnc1 Amb24103483 [0,0,0,0,0,2|1,0,0]=3 11004 B13R1.42 CCOC(=O)NCc1ccccc1 Amb2736961 [0,0,0,0,0,2|0,0,0]=2 11005 B13R1.42 CCOC(=O)NCc1cnccn1 Amb24103463 [0,0,0,0,0,2|2,0,0]=4 11006 B13R1.42 CCOC(=O)NNc1cccnn1 Amb28051308 [0,0,0,0,0,2|2,0,0]=4 11007 B13R1.42 CCOC(=O)NNc1ncccn1 Amb28051309 [0,0,0,0,0,2|2,0,0]=4 11008 B13R1.42 CCOC(=O)NSc1ccccn1 Amb24103464 [0,0,0,0,0,2|1,0,0]=3 11009 B13R1.42 CCOC(=O)OCc1ccccc1 Amb27166327 [0,0,0,0,0,2|0,0,0]=2 11010 B13R1.42 CCOC(=O)\C=C\c1ccccc1 Amb6296621 [0,0,0,0,0,2|0,0,0]=2 11011 B13R1.42 CCOC(=O)\C=C\c1ccccn1 Amb33996583 [0,0,0,0,0,2|1,0,0]=3 11012 B13R1.42 CCOC(=O)\C=C\c1cccnc1 Amb15695192 [0,0,0,0,0,2|1,0,0]=3 11013 B13R1.42 CCOC(=O)\C=C\c1ccncc1 Amb33870677 [0,0,0,0,0,2|1,0,0]=3 11014 B13R1.42 CCOC(=O)\C=N\c1ccccc1 Amb2609189 [0,0,0,0,0,2|0,0,0]=2 11015 B13R1.42 CCOC(C)OCc1ccccc1 Amb28247923 [0,0,0,0,0,2|1,0,1]=4 11016 B13R1.42 CCSC(=N)NCc1ccccc1 Amb24399348 [0,0,0,0,0,2|1,1,0]=4 11017 B13R1.42 CCSC(=S)NNc1ccccc1 Amb25218192 [0,0,0,0,0,2|0,2,0]=4 11018 B13R1.42 CNCC(=O)NCc1ccccc1 Amb21959039 [0,0,0,0,0,2|2,0,0]=4 11019 B13R1.42 CNCC(=O)NCc1ccccc1 Amb6276572 [0,0,0,0,0,2|2,0,0]=4 11020 B13R1.42 CNCC(=O)OCc1ccccc1 Amb18809175 [0,0,0,0,0,2|2,0,0]=4 11021 B13R1.42 CNCC(=O)OCc1ccccc1 Amb21929370 [0,0,0,0,0,2|2,0,0]=4 11022 B13R1.42 CNCC(=O)OCc1ccccc1 Amb22002169 [0,0,0,0,0,2|2,0,0]=4 11023 B13R1.42 CNCC(=O)\C=C\c1ccccc1 Amb33081764 [0,0,0,0,0,2|2,0,0]=4 11024 B13R1.42 CNNC(=O)NCc1ccccc1 Amb26951702 [0,0,0,0,0,2|2,0,0]=4 11025 B13R1.42 CNNC(=O)OCc1ccccc1 Amb27441289 [0,0,0,0,0,2|2,0,0]=4 11026 B13R1.42 CNNC(=O)OCc1ccccc1 Amb32668702 [0,0,0,0,0,2|2,0,0]=4 11027 B13R1.42 COCC(=O)C#Cc1ccccc1 Amb28199861 [0,0,0,0,0,2|2,0,0]=4 11028 B13R1.42 COCC(=O)CSc1ccccc1 Amb32683206 [0,0,0,0,0,2|2,0,0]=4 11029 B13R1.42 COCC(=O)NCc1ccccc1 Amb2661100 [0,0,0,0,0,2|2,0,0]=4 11030 B13R1.42 CONC(=O)C#Cc1ccccc1 Amb27804951 [0,0,0,0,0,2|2,0,0]=4 11031 B13R1.42 CONC(=O)CNc1ccccc1 Amb28188422 [0,0,0,0,0,2|2,0,0]=4 11032 B13R1.42 CONC(=O)OCc1ccccc1 Amb16969956 [0,0,0,0,0,2|2,0,0]=4 11033 B13R1.42 CONC(=O)\C=C\c1ccccc1 Amb28064704 [0,0,0,0,0,2|2,0,0]=4 11034 B13R1.42 CSCC(=O)NCc1ccccc1 Amb19382179 [0,0,0,0,0,2|2,0,0]=4 11035 B13R1.42 CSCC(=O)OCc1ccccc1 Amb27769587 [0,0,0,0,0,2|2,0,0]=4 11036 B13R1.42 C\C=C\C(=O)NCc1ccccc1 Amb1196143 [0,0,0,0,0,2|1,0,1]=4 11037 B13R1.42 C\C=C\C(=O)NNc1ccccc1 Amb17777823 [0,0,0,0,0,2|1,0,1]=4 11038 B13R1.42 C\C=C\C(=O)OCc1ccccc1 Amb10572342 [0,0,0,0,0,2|1,0,1]=4 11039 B13R1.42 C\C=C\C(=O)\C=C\c1ccccc1 Amb28074660 [0,0,0,0,0,2|1,0,1]=4 11040 B13R1.42 NCCC(=O)NCc1ccccc1 Amb15740949 [0,0,0,0,0,2|2,0,0]=4 11041 B13R1.42 NCCC(=O)NCc1ccccc1 Amb5784981 [0,0,0,0,0,2|2,0,0]=4 11042 B13R1.42 NCCC(=O)OCc1ccccc1 Amb33549621 [0,0,0,0,0,2|2,0,0]=4 11043 B13R1.42 NCCC(=O)OCc1ccccc1 Amb6740279 [0,0,0,0,0,2|2,0,0]=4 11044 B13R1.42 NCCC(=O)\C=C\c1ccccc1 Amb33081763 [0,0,0,0,0,2|2,0,0]=4 11045 B13R1.42 NCNC(=O)OCc1ccccc1 Amb27983552 [0,0,0,0,0,2|2,0,0]=4 11046 B13R1.42 O=C(CCBr)OCc1ccccc1 Amb22232000 [0,0,0,0,0,2|2,0,0]=4 11047 B13R1.42 O=C(CCCl)NCc1ccccc1 Amb1931859 [0,0,0,0,0,2|2,0,0]=4 11048 B13R1.42 O=C(CCCl)OCc1ccccc1 Amb26951432 [0,0,0,0,0,2|2,0,0]=4 11049 B13R1.42 O=C(CCF)OCc1ccccc1 Amb22497154 [0,0,0,0,0,2|2,0,0]=4 11050 B13R1.42 O=C(CCO)NCc1ccccc1 Amb17335299 [0,0,0,0,0,2|2,0,0]=4 11051 B13R1.42 O=C(CCO)NNc1ccccc1 Amb27180414 [0,0,0,0,0,2|2,0,0]=4 11052 B13R1.42 O=C(CCO)OCc1ccccc1 Amb17609079 [0,0,0,0,0,2|2,0,0]=4 11053 B13R1.42 O=C(CCS)NCc1ccccc1 Amb27947419 [0,0,0,0,0,2|2,0,0]=4 11054 B13R1.42 O=C(CCS)OCc1ccccc1 Amb24495479 [0,0,0,0,0,2|2,0,0]=4 11055 B13R1.42 O=C(NCO)OCc1ccccc1 Amb10066979 [0,0,0,0,0,2|2,0,0]=4