0 B11R1.16 BrCCC(Br)c1ccccc1 Amb23456167 [0,0,0,0,0,0|3,0,0]=3 1 B11R1.16 C#CCC(=O)c1ccccc1 Amb27794052 [0,0,0,0,0,0|2,0,2]=4 2 B11R1.16 C#CCC(Br)c1ccccc1 Amb27841700 [0,0,0,0,0,0|2,0,1]=3 3 B11R1.16 C#CCC(C)c1ccccc1 Amb18117214 [0,0,0,0,0,0|1,0,1]=2 4 B11R1.16 C#CCC(N)c1ccccc1 Amb18959773 [0,0,0,0,0,0|2,0,1]=3 5 B11R1.16 C#CCC(N)c1ccccc1 Amb6752054 [0,0,0,0,0,0|2,0,1]=3 6 B11R1.16 C#CCC(O)c1ccccc1 Amb2721611 [0,0,0,0,0,0|2,0,1]=3 7 B11R1.16 C#CCC(O)c1ccccn1 Amb19373060 [0,0,0,0,0,0|3,0,1]=4 8 B11R1.16 C#CCC(O)c1cccnc1 Amb22756005 [0,0,0,0,0,0|3,0,1]=4 9 B11R1.16 C#CCC(O)c1ccncc1 Amb27402292 [0,0,0,0,0,0|3,0,1]=4 10 B11R1.16 C#CCN(C)c1ccccc1 Amb19514873 [0,0,0,0,0,0|2,0,1]=3 11 B11R1.16 C#CC[C@@H](N)c1ccccc1 Amb28423448 [0,0,0,0,0,0|2,0,1]=3 12 B11R1.16 C#CC[C@@H](O)c1ccccn1 Amb27658831 [0,0,0,0,0,0|3,0,1]=4 13 B11R1.16 C#CC[C@H](N)c1ccccc1 Amb33871477 [0,0,0,0,0,0|2,0,1]=3 14 B11R1.16 C=C(CCBr)c1ccccc1 Amb27646402 [0,0,0,0,0,0|2,0,2]=4 15 B11R1.16 C=C(CCC)c1ccccc1 Amb24669524 [0,0,0,0,0,0|1,0,2]=3 16 B11R1.16 C=C(CCCl)c1ccccc1 Amb28120007 [0,0,0,0,0,0|2,0,2]=4 17 B11R1.16 C=C(CCN)c1ccccc1 Amb32953172 [0,0,0,0,0,0|2,0,2]=4 18 B11R1.16 C=C(CNN)c1ccccc1 Amb27956116 [0,0,0,0,0,0|1,0,2]=3 19 B11R1.16 C=C(COC)c1ccccc1 Amb28188323 [0,0,0,0,0,0|1,0,2]=3 20 B11R1.16 C=C=C[C@@H](N)c1ccccc1 Amb28241475 [0,0,0,0,0,0|2,0,2]=4 21 B11R1.16 C=C=C[C@H](O)c1ccccc1 Amb27207074 [0,0,0,0,0,0|2,0,2]=4 22 B11R1.16 C=CCC(=O)c1ccccc1 Amb17334260 [0,0,0,0,0,0|2,0,2]=4 23 B11R1.16 C=CCC(Cl)c1ccccc1 Amb27232993 [0,0,0,0,0,0|2,0,1]=3 24 B11R1.16 C=CCC(N)c1ccccc1 Amb17226687 [0,0,0,0,0,0|2,0,1]=3 25 B11R1.16 C=CCC(N)c1ccccn1 Amb18977590 [0,0,0,0,0,0|3,0,1]=4 26 B11R1.16 C=CCC(N)c1ccncc1 Amb18292093 [0,0,0,0,0,0|3,0,1]=4 27 B11R1.16 C=CCC(N)c1ccncc1 Amb33545929 [0,0,0,0,0,0|3,0,1]=4 28 B11R1.16 C=CCC(O)c1ccccc1 Amb2389146 [0,0,0,0,0,0|2,0,1]=3 29 B11R1.16 C=CCC(O)c1ccccn1 Amb25735233 [0,0,0,0,0,0|3,0,1]=4 30 B11R1.16 C=CCN(C)c1ccncc1 Amb26358329 [0,0,0,0,0,0|3,0,1]=4 31 B11R1.16 C=CCS(=O)c1ccccc1 Amb17933936 [0,0,0,0,0,0|3,0,1]=4 32 B11R1.16 C=CC[C@@H](N)c1ccccc1 Amb22829899 [0,0,0,0,0,0|2,0,1]=3 33 B11R1.16 C=CC[C@@H](N)c1ccccc1 Amb22831832 [0,0,0,0,0,0|2,0,1]=3 34 B11R1.16 C=CC[C@@H](N)c1ccccn1 Amb25844369 [0,0,0,0,0,0|3,0,1]=4 35 B11R1.16 C=CC[C@@H](N)c1cccnc1 Amb24487504 [0,0,0,0,0,0|3,0,1]=4 36 B11R1.16 C=CC[C@@H](O)c1ccccc1 Amb24726216 [0,0,0,0,0,0|2,0,1]=3 37 B11R1.16 C=CC[C@@H](O)c1cccnc1 Amb26978853 [0,0,0,0,0,0|3,0,1]=4 38 B11R1.16 C=CC[C@@H](O)c1ccncc1 Amb27645293 [0,0,0,0,0,0|3,0,1]=4 39 B11R1.16 C=CC[C@H](N)c1ccccc1 Amb27253729 [0,0,0,0,0,0|2,0,1]=3 40 B11R1.16 C=CC[C@H](N)c1ccccn1 Amb25117558 [0,0,0,0,0,0|3,0,1]=4 41 B11R1.16 C=CC[C@H](O)c1ccccc1 Amb8392356 [0,0,0,0,0,0|2,0,1]=3 42 B11R1.16 C=CC[C@H](O)c1ccccn1 Amb28139402 [0,0,0,0,0,0|3,0,1]=4 43 B11R1.16 C=CC[C@H](O)c1cccnc1 Amb25724316 [0,0,0,0,0,0|3,0,1]=4 44 B11R1.16 C=CC[C@H](O)c1ccncc1 Amb25854958 [0,0,0,0,0,0|3,0,1]=4 45 B11R1.16 C=CNC(C)c1ccccc1 Amb27455084 [0,0,0,0,0,0|2,0,1]=3 46 B11R1.16 C=COC(C)c1ccccc1 Amb22522122 [0,0,0,0,0,0|2,0,1]=3 47 B11R1.16 CC#CC(=O)c1ccccc1 Amb17593622 [0,0,0,0,0,0|2,0,2]=4 48 B11R1.16 CC#CC(Cl)c1ccccc1 Amb28365466 [0,0,0,0,0,0|2,0,1]=3 49 B11R1.16 CC#C[C@@H](N)c1ccccn1 Amb27839901 [0,0,0,0,0,0|3,0,1]=4 50 B11R1.16 CC#C[C@H](O)c1ccccc1 Amb27981913 [0,0,0,0,0,0|2,0,1]=3 51 B11R1.16 CC(CC#N)c1ccccc1 Amb17593643 [0,0,0,0,0,0|2,0,0]=2 52 B11R1.16 CC(CC=O)c1ccccc1 Amb3372078 [0,0,0,0,0,0|2,0,0]=2 53 B11R1.16 CC(CC=O)c1ccccn1 Amb27965829 [0,0,0,0,0,0|3,0,0]=3 54 B11R1.16 CC(CCBr)c1ccccc1 Amb857802 [0,0,0,0,0,0|2,0,0]=2 55 B11R1.16 CC(CCCl)c1ccccc1 Amb17232691 [0,0,0,0,0,0|2,0,0]=2 56 B11R1.16 CC(CCN)c1ccccc1 Amb17991256 [0,0,0,0,0,0|2,0,0]=2 57 B11R1.16 CC(CCN)c1ccccc1 Amb5739006 [0,0,0,0,0,0|2,0,0]=2 58 B11R1.16 CC(CCN)c1ccccn1 Amb18981390 [0,0,0,0,0,0|3,0,0]=3 59 B11R1.16 CC(CCN)c1cccnc1 Amb18293554 [0,0,0,0,0,0|3,0,0]=3 60 B11R1.16 CC(CCN)c1ccncc1 Amb18293553 [0,0,0,0,0,0|3,0,0]=3 61 B11R1.16 CC(CCN)c1ccncc1 Amb32652118 [0,0,0,0,0,0|3,0,0]=3 62 B11R1.16 CC(CCN)c1ccncn1 Amb25982922 [0,0,0,0,0,0|4,0,0]=4 63 B11R1.16 CC(CCN)c1cnccn1 Amb27751261 [0,0,0,0,0,0|4,0,0]=4 64 B11R1.16 CC(CCN)c1cncnc1 Amb24467901 [0,0,0,0,0,0|4,0,0]=4 65 B11R1.16 CC(CCN)c1ncccn1 Amb33270695 [0,0,0,0,0,0|4,0,0]=4 66 B11R1.16 CC(CCO)c1ccccc1 Amb3938966 [0,0,0,0,0,0|2,0,0]=2 67 B11R1.16 CC(CCO)c1ccncc1 Amb2694520 [0,0,0,0,0,0|3,0,0]=3 68 B11R1.16 CC(CCS)c1ccccc1 Amb25866017 [0,0,0,0,0,0|2,0,0]=2 69 B11R1.16 CC(CNN)c1ccccc1 Amb18791463 [0,0,0,0,0,0|1,0,0]=1 70 B11R1.16 CC(CNN)c1ccccn1 Amb30010191 [0,0,0,0,0,0|2,0,0]=2 71 B11R1.16 CC(CNO)c1ccccc1 Amb26657287 [0,0,0,0,0,0|1,0,0]=1 72 B11R1.16 CC(CON)c1ccccc1 Amb28144909 [0,0,0,0,0,0|2,0,0]=2 73 B11R1.16 CC(CON)c1ccccn1 Amb33360778 [0,0,0,0,0,0|3,0,0]=3 74 B11R1.16 CC(CON)c1cccnc1 Amb33360042 [0,0,0,0,0,0|3,0,0]=3 75 B11R1.16 CC(CON)c1ccncc1 Amb33380656 [0,0,0,0,0,0|3,0,0]=3 76 B11R1.16 CC(CON)c1ccncn1 Amb33268674 [0,0,0,0,0,0|4,0,0]=4 77 B11R1.16 CC(CON)c1cnccn1 Amb33359984 [0,0,0,0,0,0|4,0,0]=4 78 B11R1.16 CC(CON)c1cncnc1 Amb33149195 [0,0,0,0,0,0|4,0,0]=4 79 B11R1.16 CC(CON)c1ncccn1 Amb33269777 [0,0,0,0,0,0|4,0,0]=4 80 B11R1.16 CC(N=C=O)c1ccccc1 Amb2092860 [0,0,0,0,0,0|3,0,0]=3 81 B11R1.16 CC(N=C=O)c1ccccn1 Amb31099539 [0,0,0,0,0,0|4,0,0]=4 82 B11R1.16 CC(N=C=O)c1cccnc1 Amb31099540 [0,0,0,0,0,0|4,0,0]=4 83 B11R1.16 CC(N=C=O)c1ccncc1 Amb31099541 [0,0,0,0,0,0|4,0,0]=4 84 B11R1.16 CC(N=C=S)c1ccccc1 Amb9701921 [0,0,0,0,0,0|3,0,0]=3 85 B11R1.16 CC(N=C=S)c1ccccn1 Amb9385734 [0,0,0,0,0,0|4,0,0]=4 86 B11R1.16 CC(N=C=S)c1cccnc1 Amb9385054 [0,0,0,0,0,0|4,0,0]=4 87 B11R1.16 CC(N=C=S)c1ccncc1 Amb9385414 [0,0,0,0,0,0|4,0,0]=4 88 B11R1.16 CC(N=[N+]=[N-])c1ccccc1 Amb18632995 [0,0,0,0,0,0|2,0,1]=3 89 B11R1.16 CC(N=[N+]=[N-])c1ccccn1 Amb27839745 [0,0,0,0,0,0|3,0,1]=4 90 B11R1.16 CC(N=[N+]=[N-])c1cccnc1 Amb27768504 [0,0,0,0,0,0|3,0,1]=4 91 B11R1.16 CC(NC#N)c1ccccc1 Amb27406316 [0,0,0,0,0,0|3,0,0]=3 92 B11R1.16 CC(NC#N)c1ccccn1 Amb28059121 [0,0,0,0,0,0|4,0,0]=4 93 B11R1.16 CC(NC=O)c1ccccc1 Amb4020107 [0,0,0,0,0,0|3,0,0]=3 94 B11R1.16 CC(NC=O)c1ccccn1 Amb10070157 [0,0,0,0,0,0|4,0,0]=4 95 B11R1.16 CC(NC=O)c1cccnc1 Amb10070156 [0,0,0,0,0,0|4,0,0]=4 96 B11R1.16 CC(NC=O)c1ccncc1 Amb10070155 [0,0,0,0,0,0|4,0,0]=4 97 B11R1.16 CC(NCO)c1ccccc1 Amb27403352 [0,0,0,0,0,0|3,0,0]=3 98 B11R1.16 CC(NN=O)c1ccccc1 Amb24392128 [0,0,0,0,0,0|2,0,1]=3 99 B11R1.16 CC(OC=O)c1ccccc1 Amb22735162 [0,0,0,0,0,0|3,0,0]=3 100 B11R1.16 CC(OCCl)c1ccccc1 Amb27852517 [0,0,0,0,0,0|3,0,0]=3 101 B11R1.16 CC(\C=C\Br)c1ccccc1 Amb33134868 [0,0,0,0,0,0|2,0,1]=3 102 B11R1.16 CC(\C=N\O)c1ccccc1 Amb4018201 [0,0,0,0,0,0|1,0,2]=3 103 B11R1.16 CCCC(=O)c1ccccc1 Amb4605997 [0,0,0,0,0,0|2,0,1]=3 104 B11R1.16 CCCC(=O)c1ccccn1 Amb6301471 [0,0,0,0,0,0|3,0,1]=4 105 B11R1.16 CCCC(=O)c1cccnc1 Amb17232054 [0,0,0,0,0,0|3,0,1]=4 106 B11R1.16 CCCC(=O)c1ccncc1 Amb22235246 [0,0,0,0,0,0|3,0,1]=4 107 B11R1.16 CCCC(Br)c1ccccc1 Amb8835450 [0,0,0,0,0,0|2,0,0]=2 108 B11R1.16 CCCC(Br)c1ccccn1 Amb25675709 [0,0,0,0,0,0|3,0,0]=3 109 B11R1.16 CCCC(C)c1ccccc1 Amb4017935 [0,0,0,0,0,0|1,0,0]=1 110 B11R1.16 CCCC(Cl)c1ccccc1 Amb7766848 [0,0,0,0,0,0|2,0,0]=2 111 B11R1.16 CCCC(N)c1ccccc1 Amb8503301 [0,0,0,0,0,0|2,0,0]=2 112 B11R1.16 CCCC(N)c1ccccc1 Amb9729508 [0,0,0,0,0,0|2,0,0]=2 113 B11R1.16 CCCC(N)c1ccccn1 Amb18984959 [0,0,0,0,0,0|3,0,0]=3 114 B11R1.16 CCCC(N)c1cccnc1 Amb18984960 [0,0,0,0,0,0|3,0,0]=3 115 B11R1.16 CCCC(N)c1ccncc1 Amb18984961 [0,0,0,0,0,0|3,0,0]=3 116 B11R1.16 CCCC(N)c1ccncc1 Amb30982091 [0,0,0,0,0,0|3,0,0]=3 117 B11R1.16 CCCC(N)c1ccnnc1 Amb27879506 [0,0,0,0,0,0|4,0,0]=4 118 B11R1.16 CCCC(N)c1ncccn1 Amb18984962 [0,0,0,0,0,0|4,0,0]=4 119 B11R1.16 CCCC(O)c1ccccc1 Amb9748221 [0,0,0,0,0,0|2,0,0]=2 120 B11R1.16 CCCC(O)c1ccccn1 Amb18179397 [0,0,0,0,0,0|3,0,0]=3 121 B11R1.16 CCCC(O)c1cccnc1 Amb17232090 [0,0,0,0,0,0|3,0,0]=3 122 B11R1.16 CCCC(O)c1ccnnc1 Amb27210620 [0,0,0,0,0,0|4,0,0]=4 123 B11R1.16 CCCC(S)c1ccccc1 Amb9208055 [0,0,0,0,0,0|2,0,0]=2 124 B11R1.16 CCCN(C)c1ccccc1 Amb27176635 [0,0,0,0,0,0|2,0,0]=2 125 B11R1.16 CCCN(C)c1ccncc1 Amb27176636 [0,0,0,0,0,0|3,0,0]=3 126 B11R1.16 CCCS(=O)c1ccccc1 Amb4013577 [0,0,0,0,0,0|3,0,0]=3 127 B11R1.16 CCC[C@@H](N)c1ccccc1 Amb16233791 [0,0,0,0,0,0|2,0,0]=2 128 B11R1.16 CCC[C@@H](N)c1ccccc1 Amb22388605 [0,0,0,0,0,0|2,0,0]=2 129 B11R1.16 CCC[C@@H](N)c1ncccn1 Amb26319538 [0,0,0,0,0,0|4,0,0]=4 130 B11R1.16 CCC[C@@H](O)c1cccnc1 Amb28069903 [0,0,0,0,0,0|3,0,0]=3 131 B11R1.16 CCC[C@@H](O)c1ccncn1 Amb28285021 [0,0,0,0,0,0|4,0,0]=4 132 B11R1.16 CCC[C@@H](O)c1cnccn1 Amb27972763 [0,0,0,0,0,0|4,0,0]=4 133 B11R1.16 CCC[C@@H](O)c1ncccn1 Amb27196897 [0,0,0,0,0,0|4,0,0]=4 134 B11R1.16 CCC[C@H](N)c1ccccc1 Amb20241164 [0,0,0,0,0,0|2,0,0]=2 135 B11R1.16 CCC[C@H](N)c1ccccc1 Amb23385315 [0,0,0,0,0,0|2,0,0]=2 136 B11R1.16 CCC[C@H](N)c1cncnc1 Amb28346077 [0,0,0,0,0,0|4,0,0]=4 137 B11R1.16 CCC[C@H](N)c1ncccn1 Amb26038672 [0,0,0,0,0,0|4,0,0]=4 138 B11R1.16 CCC[C@H](O)c1ccccc1 Amb22338698 [0,0,0,0,0,0|2,0,0]=2 139 B11R1.16 CCC[C@H](O)c1ccncn1 Amb27170118 [0,0,0,0,0,0|4,0,0]=4 140 B11R1.16 CCC[C@H](O)c1cnccn1 Amb27206223 [0,0,0,0,0,0|4,0,0]=4 141 B11R1.16 CCNC(=O)c1ccccc1 Amb6871002 [0,0,0,0,0,0|3,0,1]=4 142 B11R1.16 CCNC(=S)c1ccccc1 Amb27848073 [0,0,0,0,0,0|3,0,1]=4 143 B11R1.16 CCNC(C)c1ccccc1 Amb1771733 [0,0,0,0,0,0|2,0,0]=2 144 B11R1.16 CCNC(C)c1ccccc1 Amb6537886 [0,0,0,0,0,0|2,0,0]=2 145 B11R1.16 CCNC(C)c1cccnc1 Amb9726977 [0,0,0,0,0,0|3,0,0]=3 146 B11R1.16 CCNC(C)c1ccncc1 Amb33548282 [0,0,0,0,0,0|3,0,0]=3 147 B11R1.16 CCNC(C)c1ccncc1 Amb6272006 [0,0,0,0,0,0|3,0,0]=3 148 B11R1.16 CCNC(C)c1cnccn1 Amb18968355 [0,0,0,0,0,0|4,0,0]=4 149 B11R1.16 CCNS(=O)c1ccccc1 Amb27261568 [0,0,0,0,0,0|4,0,0]=4 150 B11R1.16 CCN[C@@H](C)c1ccccc1 Amb27175162 [0,0,0,0,0,0|2,0,0]=2 151 B11R1.16 CCN[C@H](C)c1ccccn1 Amb28249175 [0,0,0,0,0,0|3,0,0]=3 152 B11R1.16 CCOC(=N)c1ccccc1 Amb17666955 [0,0,0,0,0,0|3,0,1]=4 153 B11R1.16 CCOC(=N)c1ccccc1 Amb33527262 [0,0,0,0,0,0|3,0,1]=4 154 B11R1.16 CCOC(=O)c1ccccc1 Amb4302705 [0,0,0,0,0,0|3,0,1]=4 155 B11R1.16 CCOC(=[NH2+])c1ccccc1 Amb5720188 [0,0,0,0,0,0|3,0,1]=4 156 B11R1.16 CCOC(C)c1ccccc1 Amb17940188 [0,0,0,0,0,0|2,0,0]=2 157 B11R1.16 CCOC(O)c1ccccc1 Amb27399654 [0,0,0,0,0,0|3,0,0]=3 158 B11R1.16 CCOC(O)c1ccncc1 Amb28321304 [0,0,0,0,0,0|4,0,0]=4 159 B11R1.16 CCON(C)c1ccccc1 Amb27234596 [0,0,0,0,0,0|3,0,0]=3 160 B11R1.16 CCO[PH](=O)c1ccccc1 Amb10601587 [0,0,0,0,0,0|4,0,0]=4 161 B11R1.16 CCSC(=O)c1ccccc1 Amb27828652 [0,0,0,0,0,0|3,0,1]=4 162 B11R1.16 CCSC(C)c1ccccc1 Amb28145240 [0,0,0,0,0,0|2,0,0]=2 163 B11R1.16 CCSC(C)c1cnccn1 Amb27854027 [0,0,0,0,0,0|4,0,0]=4 164 B11R1.16 CC\C=C(/C)c1ccccc1 Amb25151168 [0,0,0,0,0,0|1,0,2]=3 165 B11R1.16 CC\C=C(\C)c1ccccc1 Amb27445109 [0,0,0,0,0,0|1,0,2]=3 166 B11R1.16 CC\[S+]=C(/N)c1ccccc1 Amb27236829 [0,0,0,0,0,0|3,0,1]=4 167 B11R1.16 CN(CC#N)c1ccccc1 Amb5781397 [0,0,0,0,0,0|3,0,0]=3 168 B11R1.16 CN(CCBr)c1ccccc1 Amb24477466 [0,0,0,0,0,0|3,0,0]=3 169 B11R1.16 CN(CCBr)c1ccncc1 Amb28240010 [0,0,0,0,0,0|4,0,0]=4 170 B11R1.16 CN(CCCl)c1ccccc1 Amb17334788 [0,0,0,0,0,0|3,0,0]=3 171 B11R1.16 CN(CCI)c1ccccc1 Amb28138218 [0,0,0,0,0,0|3,0,0]=3 172 B11R1.16 CN(CCN)c1ccccc1 Amb13949227 [0,0,0,0,0,0|3,0,0]=3 173 B11R1.16 CN(CCN)c1ccccc1 Amb2371516 [0,0,0,0,0,0|3,0,0]=3 174 B11R1.16 CN(CCN)c1ccccc1 Amb59983 [0,0,0,0,0,0|3,0,0]=3 175 B11R1.16 CN(CCN)c1ccccn1 Amb18302344 [0,0,0,0,0,0|4,0,0]=4 176 B11R1.16 CN(CCN)c1ccccn1 Amb31188270 [0,0,0,0,0,0|4,0,0]=4 177 B11R1.16 CN(CCO)c1cccc[nH+]1 Amb33512959 [0,0,0,0,0,0|4,0,0]=4 178 B11R1.16 CN(CCO)c1ccccc1 Amb2720819 [0,0,0,0,0,0|3,0,0]=3 179 B11R1.16 CN(CCO)c1ccccn1 Amb2445428 [0,0,0,0,0,0|4,0,0]=4 180 B11R1.16 CN(CCO)c1ccncc1 Amb18179433 [0,0,0,0,0,0|4,0,0]=4 181 B11R1.16 CN(CCO)c1ccncc1 Amb19373596 [0,0,0,0,0,0|4,0,0]=4 182 B11R1.16 CN(CCS)c1ccccc1 Amb13881732 [0,0,0,0,0,0|3,0,0]=3 183 B11R1.16 CN(NC=O)c1ccccc1 Amb17778798 [0,0,0,0,0,0|4,0,0]=4 184 B11R1.16 CNCC(=O)c1ccccc1 Amb577810 [0,0,0,0,0,0|1,0,1]=2 185 B11R1.16 CNCC(=O)c1ccccn1 Amb31094252 [0,0,0,0,0,0|2,0,1]=3 186 B11R1.16 CNCC(=O)c1cccnc1 Amb27146952 [0,0,0,0,0,0|2,0,1]=3 187 B11R1.16 CNCC(=O)c1ccncc1 Amb31094250 [0,0,0,0,0,0|2,0,1]=3 188 B11R1.16 CNCC(=O)c1ccncn1 Amb33269066 [0,0,0,0,0,0|3,0,1]=4 189 B11R1.16 CNCC(=O)c1cnccn1 Amb21862013 [0,0,0,0,0,0|3,0,1]=4 190 B11R1.16 CNCC(=O)c1cncnc1 Amb26505058 [0,0,0,0,0,0|3,0,1]=4 191 B11R1.16 CNCC(=O)c1ncccn1 Amb18201675 [0,0,0,0,0,0|3,0,1]=4 192 B11R1.16 CNCC(C)c1ccccc1 Amb17619365 [0,0,0,0,0,0|0,0,0]=0 193 B11R1.16 CNCC(C)c1ccccc1 Amb6355911 [0,0,0,0,0,0|0,0,0]=0 194 B11R1.16 CNCC(C)c1ccncc1 Amb27199701 [0,0,0,0,0,0|1,0,0]=1 195 B11R1.16 CNCC(F)c1ccccc1 Amb24710254 [0,0,0,0,0,0|1,0,0]=1 196 B11R1.16 CNCC(N)c1ccccc1 Amb18290185 [0,0,0,0,0,0|1,0,0]=1 197 B11R1.16 CNCC(O)c1ccccc1 Amb32405137 [0,0,0,0,0,0|1,0,0]=1 198 B11R1.16 CNCC(O)c1ccccc1 Amb3939362 [0,0,0,0,0,0|1,0,0]=1 199 B11R1.16 CNCC(O)c1ccccn1 Amb17138440 [0,0,0,0,0,0|2,0,0]=2 200 B11R1.16 CNCC(O)c1cccnc1 Amb17138441 [0,0,0,0,0,0|2,0,0]=2 201 B11R1.16 CNCC(O)c1cccnc1 Amb19515701 [0,0,0,0,0,0|2,0,0]=2 202 B11R1.16 CNCC(O)c1ccncc1 Amb17138442 [0,0,0,0,0,0|2,0,0]=2 203 B11R1.16 CNCC(O)c1ccncn1 Amb33269068 [0,0,0,0,0,0|3,0,0]=3 204 B11R1.16 CNCC(O)c1cnccn1 Amb26476252 [0,0,0,0,0,0|3,0,0]=3 205 B11R1.16 CNCC(O)c1cncnc1 Amb25141262 [0,0,0,0,0,0|3,0,0]=3 206 B11R1.16 CNCC(O)c1ncccn1 Amb27199745 [0,0,0,0,0,0|3,0,0]=3 207 B11R1.16 CNC[C@@H](C)c1ccccc1 Amb27253876 [0,0,0,0,0,0|0,0,0]=0 208 B11R1.16 CNC[C@@H](O)c1ccccn1 Amb28119961 [0,0,0,0,0,0|2,0,0]=2 209 B11R1.16 CNC[C@@H](O)c1cccnc1 Amb28067718 [0,0,0,0,0,0|2,0,0]=2 210 B11R1.16 CNNC(=N)c1cccnc1 Amb25690466 [0,0,0,0,0,0|3,0,1]=4 211 B11R1.16 CNNC(=O)c1ccncc1 Amb28434923 [0,0,0,0,0,0|3,0,1]=4 212 B11R1.16 CNOC(=O)c1ccccc1 Amb25240574 [0,0,0,0,0,0|2,0,1]=3 213 B11R1.16 CN\C=C(\C)c1ccccc1 Amb27468700 [0,0,0,0,0,0|0,0,2]=2 214 B11R1.16 CN\N=C(/N)c1ccccc1 Amb20623020 [0,0,0,0,0,0|2,0,1]=3 215 B11R1.16 CN\N=C(\C)c1ccncc1 Amb25129259 [0,0,0,0,0,0|2,0,1]=3 216 B11R1.16 COCC(=O)c1ccccc1 Amb4605981 [0,0,0,0,0,0|2,0,1]=3 217 B11R1.16 COCC(=O)c1ccccn1 Amb10607921 [0,0,0,0,0,0|3,0,1]=4 218 B11R1.16 COCC(Br)c1ccccc1 Amb27797279 [0,0,0,0,0,0|2,0,0]=2 219 B11R1.16 COCC(N)c1ccccc1 Amb1134749 [0,0,0,0,0,0|2,0,0]=2 220 B11R1.16 COCC(N)c1ccccc1 Amb13952604 [0,0,0,0,0,0|2,0,0]=2 221 B11R1.16 COCC(N)c1ccccn1 Amb10607922 [0,0,0,0,0,0|3,0,0]=3 222 B11R1.16 COCC(N)c1ccccn1 Amb13949181 [0,0,0,0,0,0|3,0,0]=3 223 B11R1.16 COCC(N)c1cccnn1 Amb28348139 [0,0,0,0,0,0|4,0,0]=4 224 B11R1.16 COCC(N)c1ccncc1 Amb27168231 [0,0,0,0,0,0|3,0,0]=3 225 B11R1.16 COCC(N)c1ccnnc1 Amb28047369 [0,0,0,0,0,0|4,0,0]=4 226 B11R1.16 COCC(N)c1ncccn1 Amb27871874 [0,0,0,0,0,0|4,0,0]=4 227 B11R1.16 COCC(O)c1ccccc1 Amb18791504 [0,0,0,0,0,0|2,0,0]=2 228 B11R1.16 COCC(O)c1ccccn1 Amb27165137 [0,0,0,0,0,0|3,0,0]=3 229 B11R1.16 COCC(O)c1ccncn1 Amb27210130 [0,0,0,0,0,0|4,0,0]=4 230 B11R1.16 COCC(O)c1ccnnc1 Amb27196895 [0,0,0,0,0,0|4,0,0]=4 231 B11R1.16 COCC(O)c1cnccn1 Amb28122566 [0,0,0,0,0,0|4,0,0]=4 232 B11R1.16 COCC(S)c1ccccc1 Amb25698414 [0,0,0,0,0,0|2,0,0]=2 233 B11R1.16 COC[C@@H](N)c1ccccc1 Amb17061641 [0,0,0,0,0,0|2,0,0]=2 234 B11R1.16 COC[C@@H](N)c1ccccn1 Amb25104762 [0,0,0,0,0,0|3,0,0]=3 235 B11R1.16 COC[C@@H](N)c1ccccn1 Amb33620942 [0,0,0,0,0,0|3,0,0]=3 236 B11R1.16 COC[C@@H](N)c1cccnc1 Amb24351094 [0,0,0,0,0,0|3,0,0]=3 237 B11R1.16 COC[C@@H](N)c1cccnc1 Amb33804039 [0,0,0,0,0,0|3,0,0]=3 238 B11R1.16 COC[C@@H](N)c1cccnn1 Amb28186989 [0,0,0,0,0,0|4,0,0]=4 239 B11R1.16 COC[C@@H](N)c1cnccn1 Amb27881556 [0,0,0,0,0,0|4,0,0]=4 240 B11R1.16 COC[C@@H](N)c1cncnc1 Amb27640248 [0,0,0,0,0,0|4,0,0]=4 241 B11R1.16 COC[C@H](N)c1ccccc1 Amb22737495 [0,0,0,0,0,0|2,0,0]=2 242 B11R1.16 COC[C@H](N)c1ccccn1 Amb27493999 [0,0,0,0,0,0|3,0,0]=3 243 B11R1.16 COC[C@H](N)c1cccnc1 Amb24533043 [0,0,0,0,0,0|3,0,0]=3 244 B11R1.16 COC[C@H](N)c1cccnc1 Amb33803139 [0,0,0,0,0,0|3,0,0]=3 245 B11R1.16 COC[C@H](N)c1ccncc1 Amb28250847 [0,0,0,0,0,0|3,0,0]=3 246 B11R1.16 COC[C@H](N)c1ncccn1 Amb27630338 [0,0,0,0,0,0|4,0,0]=4 247 B11R1.16 COC[C@H](O)c1ccccc1 Amb27410269 [0,0,0,0,0,0|2,0,0]=2 248 B11R1.16 CONC(=O)c1ccccc1 Amb16969913 [0,0,0,0,0,0|3,0,1]=4 249 B11R1.16 CONC(C)c1ccccc1 Amb22896960 [0,0,0,0,0,0|2,0,0]=2 250 B11R1.16 CO\N=C(/N)c1ccccc1 Amb18224270 [0,0,0,0,0,0|3,0,1]=4 251 B11R1.16 CP(CC=O)c1ccccc1 Amb28241337 [0,0,0,0,0,0|3,0,0]=3 252 B11R1.16 CP(CCCl)c1ccccc1 Amb28239778 [0,0,0,0,0,0|3,0,0]=3 253 B11R1.16 CSCC(=O)c1ccccc1 Amb4034487 [0,0,0,0,0,0|2,0,1]=3 254 B11R1.16 CSCC(Cl)c1ccccc1 Amb27272993 [0,0,0,0,0,0|2,0,0]=2 255 B11R1.16 CSCC(N)c1ccccc1 Amb18300065 [0,0,0,0,0,0|2,0,0]=2 256 B11R1.16 CSCC(N)c1ncccn1 Amb32716231 [0,0,0,0,0,0|4,0,0]=4 257 B11R1.16 CSCC(O)c1ccccc1 Amb18793198 [0,0,0,0,0,0|2,0,0]=2 258 B11R1.16 CSC[C@H](N)c1ccccc1 Amb28397956 [0,0,0,0,0,0|2,0,0]=2 259 B11R1.16 CSC[C@H](O)c1ccccc1 Amb28077783 [0,0,0,0,0,0|2,0,0]=2 260 B11R1.16 CS\N=C(\N)c1ccccc1 Amb28365468 [0,0,0,0,0,0|3,0,1]=4 261 B11R1.16 C[C@@H](CC=O)c1ccccc1 Amb27661808 [0,0,0,0,0,0|2,0,0]=2 262 B11R1.16 C[C@@H](CCN)c1ccccc1 Amb28285355 [0,0,0,0,0,0|2,0,0]=2 263 B11R1.16 C[C@@H](N=C=O)c1ccccc1 Amb3939766 [0,0,0,0,0,0|3,0,0]=3 264 B11R1.16 C[C@@H](N=[N+]=[N-])c1ccccn1 Amb27635244 [0,0,0,0,0,0|3,0,1]=4 265 B11R1.16 C[C@@H](N=[N+]=[N-])c1cccnc1 Amb25107225 [0,0,0,0,0,0|3,0,1]=4 266 B11R1.16 C[C@@H](N=[N+]=[N-])c1ccncc1 Amb26045151 [0,0,0,0,0,0|3,0,1]=4 267 B11R1.16 C[C@@H](NC#N)c1ccncc1 Amb28185266 [0,0,0,0,0,0|4,0,0]=4 268 B11R1.16 C[C@@H](NC=S)c1ccccc1 Amb27229087 [0,0,0,0,0,0|3,0,0]=3 269 B11R1.16 C[C@@H](NN=O)c1ccccc1 Amb27249670 [0,0,0,0,0,0|2,0,1]=3 270 B11R1.16 C[C@H](CCO)c1ccccc1 Amb24371178 [0,0,0,0,0,0|2,0,0]=2 271 B11R1.16 C[C@H](N=C=O)c1ccccc1 Amb2689348 [0,0,0,0,0,0|3,0,0]=3 272 B11R1.16 C[C@H](N=C=S)c1ccccc1 Amb2689354 [0,0,0,0,0,0|3,0,0]=3 273 B11R1.16 C[C@H](N=[N+]=[N-])c1ccccn1 Amb24509550 [0,0,0,0,0,0|3,0,1]=4 274 B11R1.16 C[C@H](N=[N+]=[N-])c1cccnc1 Amb24476074 [0,0,0,0,0,0|3,0,1]=4 275 B11R1.16 C[C@H](NC#N)c1ccccn1 Amb28365506 [0,0,0,0,0,0|4,0,0]=4 276 B11R1.16 C[C@H](NC#N)c1cccnc1 Amb27760812 [0,0,0,0,0,0|4,0,0]=4 277 B11R1.16 C[C@H](NC=S)c1ccccc1 Amb28071285 [0,0,0,0,0,0|3,0,0]=3 278 B11R1.16 C\C(=C/C#N)c1ccccc1 Amb32941900 [0,0,0,0,0,0|2,0,2]=4 279 B11R1.16 C\C(=C/C=O)c1ccccc1 Amb17593660 [0,0,0,0,0,0|2,0,2]=4 280 B11R1.16 C\C(=C/CBr)c1ccccc1 Amb28384582 [0,0,0,0,0,0|2,0,2]=4 281 B11R1.16 C\C(=C/CN)c1ccccc1 Amb23555622 [0,0,0,0,0,0|2,0,2]=4 282 B11R1.16 C\C(=C/CO)c1ccccc1 Amb8392366 [0,0,0,0,0,0|2,0,2]=4 283 B11R1.16 C\C=C\C(=O)c1ccccc1 Amb10574126 [0,0,0,0,0,0|2,0,2]=4 284 B11R1.16 C\C=C\C(O)c1ccccc1 Amb25887104 [0,0,0,0,0,0|2,0,1]=3 285 B11R1.16 C\C=C\[C@H](N)c1ccccc1 Amb27163147 [0,0,0,0,0,0|2,0,1]=3 286 B11R1.16 ClCCC(Br)c1ccccc1 Amb21856734 [0,0,0,0,0,0|3,0,0]=3 287 B11R1.16 ClCCC(Cl)c1ccccc1 Amb17872667 [0,0,0,0,0,0|3,0,0]=3 288 B11R1.16 N#CCC(=O)c1ccccc1 Amb1644485 [0,0,0,0,0,0|3,0,1]=4 289 B11R1.16 N#CCC(N)c1ccccc1 Amb18964887 [0,0,0,0,0,0|3,0,0]=3 290 B11R1.16 N#CCC(N)c1ccccc1 Amb20632783 [0,0,0,0,0,0|3,0,0]=3 291 B11R1.16 N#CCC(N)c1ccccc1 Amb33068991 [0,0,0,0,0,0|3,0,0]=3 292 B11R1.16 N#CCC(N)c1ccccn1 Amb18064993 [0,0,0,0,0,0|4,0,0]=4 293 B11R1.16 N#CCC(N)c1cccnc1 Amb18064998 [0,0,0,0,0,0|4,0,0]=4 294 B11R1.16 N#CCC(N)c1ccncc1 Amb18065148 [0,0,0,0,0,0|4,0,0]=4 295 B11R1.16 N#CCC(O)c1ccccc1 Amb4407013 [0,0,0,0,0,0|3,0,0]=3 296 B11R1.16 N#CCC(O)c1cccnc1 Amb24062545 [0,0,0,0,0,0|4,0,0]=4 297 B11R1.16 N#CCC(O)c1ccncc1 Amb25998513 [0,0,0,0,0,0|4,0,0]=4 298 B11R1.16 N#CCS(=O)c1ccccc1 Amb22505329 [0,0,0,0,0,0|4,0,0]=4 299 B11R1.16 N#CC[C@@H](N)c1ccccc1 Amb26346763 [0,0,0,0,0,0|3,0,0]=3 300 B11R1.16 N#CC[C@@H](N)c1ccccc1 Amb32653409 [0,0,0,0,0,0|3,0,0]=3 301 B11R1.16 N#CC[C@@H](N)c1ccccc1 Amb33212393 [0,0,0,0,0,0|3,0,0]=3 302 B11R1.16 N#CC[C@@H](O)c1ccccc1 Amb25680039 [0,0,0,0,0,0|3,0,0]=3 303 B11R1.16 N#CC[C@@H](O)c1ccncc1 Amb27456747 [0,0,0,0,0,0|4,0,0]=4 304 B11R1.16 N#CC[C@H](N)c1ccccc1 Amb28398545 [0,0,0,0,0,0|3,0,0]=3 305 B11R1.16 N#CC[C@H](N)c1cccnc1 Amb28282641 [0,0,0,0,0,0|4,0,0]=4 306 B11R1.16 N#CC[C@H](N)c1ccncc1 Amb27817756 [0,0,0,0,0,0|4,0,0]=4 307 B11R1.16 N#CC[C@H](O)c1ccccc1 Amb24617537 [0,0,0,0,0,0|3,0,0]=3 308 B11R1.16 N#CC[C@H](O)c1cccnc1 Amb27252164 [0,0,0,0,0,0|4,0,0]=4 309 B11R1.16 NC(CC=O)c1ccccc1 Amb28122676 [0,0,0,0,0,0|3,0,0]=3 310 B11R1.16 NC(CCCl)c1ccccc1 Amb27247405 [0,0,0,0,0,0|3,0,0]=3 311 B11R1.16 NC(CCO)c1ccccc1 Amb1993953 [0,0,0,0,0,0|3,0,0]=3 312 B11R1.16 NC(CCO)c1ccccn1 Amb18120551 [0,0,0,0,0,0|4,0,0]=4 313 B11R1.16 NC(CCO)c1cccnc1 Amb2697495 [0,0,0,0,0,0|4,0,0]=4 314 B11R1.16 NC(CCO)c1ccncc1 Amb2694579 [0,0,0,0,0,0|4,0,0]=4 315 B11R1.16 NC(CCO)c1ccncc1 Amb28652905 [0,0,0,0,0,0|4,0,0]=4 316 B11R1.16 NCCC(=O)c1ccccc1 Amb2613669 [0,0,0,0,0,0|3,0,1]=4 317 B11R1.16 NCCC(Br)c1ccccc1 Amb27643497 [0,0,0,0,0,0|3,0,0]=3 318 B11R1.16 NCCC(F)c1ccccc1 Amb27760515 [0,0,0,0,0,0|3,0,0]=3 319 B11R1.16 NCCC(F)c1ccccn1 Amb33360782 [0,0,0,0,0,0|4,0,0]=4 320 B11R1.16 NCCC(F)c1cccnc1 Amb25936622 [0,0,0,0,0,0|4,0,0]=4 321 B11R1.16 NCCC(F)c1ccncc1 Amb25329368 [0,0,0,0,0,0|4,0,0]=4 322 B11R1.16 NCCC(N)c1ccccc1 Amb18972395 [0,0,0,0,0,0|3,0,0]=3 323 B11R1.16 NCCC(N)c1cccnc1 Amb27489008 [0,0,0,0,0,0|4,0,0]=4 324 B11R1.16 NCCC(O)c1ccccc1 Amb21984527 [0,0,0,0,0,0|3,0,0]=3 325 B11R1.16 NCCC(O)c1ccccc1 Amb9782359 [0,0,0,0,0,0|3,0,0]=3 326 B11R1.16 NCCC(O)c1ccccn1 Amb18121017 [0,0,0,0,0,0|4,0,0]=4 327 B11R1.16 NCCC(O)c1cccnc1 Amb18639338 [0,0,0,0,0,0|4,0,0]=4 328 B11R1.16 NCCC(O)c1ccncc1 Amb18121042 [0,0,0,0,0,0|4,0,0]=4 329 B11R1.16 NCCS(=O)c1ccccc1 Amb18974516 [0,0,0,0,0,0|4,0,0]=4 330 B11R1.16 NCCS(=O)c1ccccc1 Amb19349568 [0,0,0,0,0,0|4,0,0]=4 331 B11R1.16 NCC[C@@H](N)c1ccncc1 Amb27205112 [0,0,0,0,0,0|4,0,0]=4 332 B11R1.16 NCC[C@@H](O)c1ccccc1 Amb22225304 [0,0,0,0,0,0|3,0,0]=3 333 B11R1.16 NCC[C@@H](O)c1ccccn1 Amb33360784 [0,0,0,0,0,0|4,0,0]=4 334 B11R1.16 NCC[C@@H](O)c1cccnc1 Amb33360063 [0,0,0,0,0,0|4,0,0]=4 335 B11R1.16 NCC[C@@H](O)c1ccncc1 Amb33225169 [0,0,0,0,0,0|4,0,0]=4 336 B11R1.16 NCC[C@H](N)c1cccnc1 Amb27205253 [0,0,0,0,0,0|4,0,0]=4 337 B11R1.16 NCC[C@H](O)c1ccccc1 Amb22226644 [0,0,0,0,0,0|3,0,0]=3 338 B11R1.16 NCC[C@H](O)c1ccccn1 Amb33360783 [0,0,0,0,0,0|4,0,0]=4 339 B11R1.16 NCC[C@H](O)c1cccnc1 Amb33360062 [0,0,0,0,0,0|4,0,0]=4 340 B11R1.16 NCC[C@H](O)c1ccncc1 Amb33380660 [0,0,0,0,0,0|4,0,0]=4 341 B11R1.16 NNCC(=O)c1cccnc1 Amb28342492 [0,0,0,0,0,0|3,0,1]=4 342 B11R1.16 NNCC(O)c1ccccc1 Amb17232104 [0,0,0,0,0,0|2,0,0]=2 343 B11R1.16 NNCC(O)c1ccccn1 Amb18065400 [0,0,0,0,0,0|3,0,0]=3 344 B11R1.16 NNCC(O)c1cccnc1 Amb17232118 [0,0,0,0,0,0|3,0,0]=3 345 B11R1.16 NNCC(O)c1ccncc1 Amb18065401 [0,0,0,0,0,0|3,0,0]=3 346 B11R1.16 NOCC(=O)c1ccccc1 Amb29848094 [0,0,0,0,0,0|3,0,1]=4 347 B11R1.16 NOCC(O)c1ccccc1 Amb17334342 [0,0,0,0,0,0|3,0,0]=3 348 B11R1.16 N[C@@H](CCO)c1ccccc1 Amb8384290 [0,0,0,0,0,0|3,0,0]=3 349 B11R1.16 N[C@@H](CCO)c1ccccn1 Amb28457255 [0,0,0,0,0,0|4,0,0]=4 350 B11R1.16 N[C@@H](CCO)c1cccnc1 Amb26920229 [0,0,0,0,0,0|4,0,0]=4 351 B11R1.16 N[C@@H](CCO)c1ccncc1 Amb25131721 [0,0,0,0,0,0|4,0,0]=4 352 B11R1.16 N[C@H](CCO)c1ccccc1 Amb22265524 [0,0,0,0,0,0|3,0,0]=3 353 B11R1.16 N[C@H](CCO)c1ccccc1 Amb8397180 [0,0,0,0,0,0|3,0,0]=3 354 B11R1.16 N[C@H](CCO)c1ccccn1 Amb25789774 [0,0,0,0,0,0|4,0,0]=4 355 B11R1.16 N[C@H](CCO)c1cccnc1 Amb26505375 [0,0,0,0,0,0|4,0,0]=4 356 B11R1.16 N[C@H](CCO)c1cccnc1 Amb33803480 [0,0,0,0,0,0|4,0,0]=4 357 B11R1.16 N[C@H](CCO)c1ccncc1 Amb25843798 [0,0,0,0,0,0|4,0,0]=4 358 B11R1.16 O=C(CCBr)c1ccccc1 Amb4066411 [0,0,0,0,0,0|3,0,1]=4 359 B11R1.16 O=C(CCCl)c1ccccc1 Amb3940266 [0,0,0,0,0,0|3,0,1]=4 360 B11R1.16 O=C(CCO)c1ccccc1 Amb16231606 [0,0,0,0,0,0|3,0,1]=4 361 B11R1.16 O=C(CCS)c1ccccc1 Amb17400214 [0,0,0,0,0,0|3,0,1]=4 362 B11R1.16 O=C=NC(F)c1ccccc1 Amb27437162 [0,0,0,0,0,0|4,0,0]=4 363 B11R1.16 O=CCC(=O)c1ccccc1 Amb8394158 [0,0,0,0,0,0|3,0,1]=4 364 B11R1.16 O=CCC(O)c1ccccn1 Amb26844000 [0,0,0,0,0,0|4,0,0]=4 365 B11R1.16 O=CCC(O)c1ccncc1 Amb24434533 [0,0,0,0,0,0|4,0,0]=4 366 B11R1.16 O=S(CCCl)c1ccccc1 Amb9158149 [0,0,0,0,0,0|4,0,0]=4 367 B11R1.16 O=S(CCO)c1ccccc1 Amb27411411 [0,0,0,0,0,0|4,0,0]=4 368 B11R1.16 OC(C#CBr)c1ccccc1 Amb1083115 [0,0,0,0,0,0|3,0,1]=4 369 B11R1.16 OC(CCBr)c1ccccc1 Amb26365753 [0,0,0,0,0,0|3,0,0]=3 370 B11R1.16 OC(CCCl)c1ccccc1 Amb17611064 [0,0,0,0,0,0|3,0,0]=3 371 B11R1.16 OCCC(Cl)c1ccccc1 Amb27823326 [0,0,0,0,0,0|3,0,0]=3 372 B11R1.16 OCCC(F)c1ccccc1 Amb28460703 [0,0,0,0,0,0|3,0,0]=3 373 B11R1.16 OCCC(O)c1ccccc1 Amb17777842 [0,0,0,0,0,0|3,0,0]=3 374 B11R1.16 OCCC(O)c1ccccn1 Amb22756156 [0,0,0,0,0,0|4,0,0]=4 375 B11R1.16 OCCC(O)c1cccnc1 Amb27257189 [0,0,0,0,0,0|4,0,0]=4 376 B11R1.16 OCCC(O)c1ccncc1 Amb25760239 [0,0,0,0,0,0|4,0,0]=4 377 B11R1.16 OCC[C@@H](O)c1ccccc1 Amb8516760 [0,0,0,0,0,0|3,0,0]=3 378 B11R1.16 OCC[C@@H](O)c1ccncc1 Amb27668896 [0,0,0,0,0,0|4,0,0]=4 379 B11R1.16 OCC[C@H](O)c1ccccn1 Amb27394769 [0,0,0,0,0,0|4,0,0]=4 380 B11R1.16 ONCC(O)c1ccccc1 Amb4009046 [0,0,0,0,0,0|2,0,0]=2 381 B11R1.16 ONCC(O)c1ccccn1 Amb17334345 [0,0,0,0,0,0|3,0,0]=3 382 B11R1.16 ONCC(O)c1cccnc1 Amb17334346 [0,0,0,0,0,0|3,0,0]=3 383 B11R1.16 ONCC(O)c1ccncc1 Amb17334347 [0,0,0,0,0,0|3,0,0]=3 384 B11R1.16 O[C@@H](CCCl)c1ccccc1 Amb17611058 [0,0,0,0,0,0|3,0,0]=3 385 B11R1.16 O[C@H](CCBr)c1ccccc1 Amb27437857 [0,0,0,0,0,0|3,0,0]=3 386 B11R1.16 O[C@H](CCCl)c1ccccc1 Amb2779830 [0,0,0,0,0,0|3,0,0]=3 387 B11R1.16 O[C@H](CCI)c1ccccc1 Amb27603615 [0,0,0,0,0,0|3,0,0]=3 388 B11R1.16 [C-]#[N+]CC(C)c1ccccc1 Amb2684685 [0,0,0,0,0,0|0,0,2]=2 389 B11R1.16 [C-]#[N+]CC(F)c1ccccc1 Amb27441196 [0,0,0,0,0,0|1,0,2]=3 390 B10R1.15 BP(CO)c1ccccc1 Amb27652937 [1,0,0,0,0,0|3,0,0]=4 391 B10R1.15 B[PH](CO)c1ccccc1 Amb27826578 [1,0,0,0,0,0|3,0,0]=4 392 B10R1.15 BrCC(Br)c1ccccc1 Amb8394124 [1,0,0,0,0,0|2,0,0]=3 393 B10R1.15 C#CC(Br)c1ccccc1 Amb28121035 [1,0,0,0,0,0|1,0,2]=4 394 B10R1.15 C#CC(C)c1ccccc1 Amb24106607 [1,0,0,0,0,0|0,0,2]=3 395 B10R1.15 C#CC(C)c1ccccn1 Amb33360773 [1,0,0,0,0,0|1,0,2]=4 396 B10R1.15 C#CC(C)c1cccnc1 Amb33224702 [1,0,0,0,0,0|1,0,2]=4 397 B10R1.15 C#CC(C)c1ccncc1 Amb33380650 [1,0,0,0,0,0|1,0,2]=4 398 B10R1.15 C#CC(N)c1ccccc1 Amb23504019 [1,0,0,0,0,0|1,0,2]=4 399 B10R1.15 C#CC(N)c1ccccc1 Amb33204420 [1,0,0,0,0,0|1,0,2]=4 400 B10R1.15 C#CC(O)c1ccccc1 Amb2721623 [1,0,0,0,0,0|1,0,2]=4 401 B10R1.15 C#C[C@@H](N)c1ccccc1 Amb27599946 [1,0,0,0,0,0|1,0,2]=4 402 B10R1.15 C#C[C@@H](O)c1ccccc1 Amb10844978 [1,0,0,0,0,0|1,0,2]=4 403 B10R1.15 C#C[C@H](O)c1ccccc1 Amb22360907 [1,0,0,0,0,0|1,0,2]=4 404 B10R1.15 C=C(CBr)c1ccccc1 Amb8391739 [1,0,0,0,0,0|1,0,2]=4 405 B10R1.15 C=C(CC)c1ccccn1 Amb24467663 [1,0,0,0,0,0|1,0,2]=4 406 B10R1.15 C=C(CCl)c1ccccc1 Amb26968652 [1,0,0,0,0,0|1,0,2]=4 407 B10R1.15 C=C(CN)c1ccccc1 Amb10609068 [1,0,0,0,0,0|0,0,2]=3 408 B10R1.15 C=C(CN)c1ccccc1 Amb9421165 [1,0,0,0,0,0|0,0,2]=3 409 B10R1.15 C=C(CN)c1ccccn1 Amb27767907 [1,0,0,0,0,0|1,0,2]=4 410 B10R1.15 C=C(CN)c1cccnc1 Amb33360054 [1,0,0,0,0,0|1,0,2]=4 411 B10R1.15 C=C(CN)c1ccncc1 Amb33380645 [1,0,0,0,0,0|1,0,2]=4 412 B10R1.15 C=C(CO)c1ccccc1 Amb27839071 [1,0,0,0,0,0|1,0,2]=4 413 B10R1.15 C=C(NC)c1ccccc1 Amb27975699 [1,0,0,0,0,0|0,0,2]=3 414 B10R1.15 C=CC(C)c1ccccc1 Amb26460576 [1,0,0,0,0,0|0,0,2]=3 415 B10R1.15 C=CC(C)c1ccccn1 Amb27838866 [1,0,0,0,0,0|1,0,2]=4 416 B10R1.15 C=CC(Cl)c1ccccc1 Amb17943120 [1,0,0,0,0,0|1,0,2]=4 417 B10R1.15 C=CC(Cl)c1ccccc1 Amb33963194 [1,0,0,0,0,0|1,0,2]=4 418 B10R1.15 C=CC(N)c1ccccc1 Amb18642931 [1,0,0,0,0,0|1,0,2]=4 419 B10R1.15 C=CC(N)c1ccccc1 Amb22584092 [1,0,0,0,0,0|1,0,2]=4 420 B10R1.15 C=CC(O)c1ccccc1 Amb21520382 [1,0,0,0,0,0|1,0,2]=4 421 B10R1.15 C=CN(C)c1ccccc1 Amb27878913 [1,0,0,0,0,0|1,0,2]=4 422 B10R1.15 C=C[C@@H](N)c1ccccc1 Amb27391592 [1,0,0,0,0,0|1,0,2]=4 423 B10R1.15 C=C[C@@H](O)c1ccccc1 Amb22348498 [1,0,0,0,0,0|1,0,2]=4 424 B10R1.15 C=C[SiH](C)c1ccccc1 Amb8515879 [1,0,0,0,0,0|0,1,2]=4 425 B10R1.15 C=NC(C)c1ccccn1 Amb28204098 [1,0,0,0,0,0|1,0,2]=4 426 B10R1.15 CC(C#N)c1ccccc1 Amb2387010 [1,0,0,0,0,0|0,0,2]=3 427 B10R1.15 CC(C#N)c1ccccn1 Amb8950070 [1,0,0,0,0,0|1,0,2]=4 428 B10R1.15 CC(C#N)c1cccnc1 Amb8950033 [1,0,0,0,0,0|1,0,2]=4 429 B10R1.15 CC(C#N)c1ccncc1 Amb8950034 [1,0,0,0,0,0|1,0,2]=4 430 B10R1.15 CC(C=O)c1ccccc1 Amb2720746 [1,0,0,0,0,0|1,0,1]=3 431 B10R1.15 CC(C=O)c1ccccn1 Amb29762718 [1,0,0,0,0,0|2,0,1]=4 432 B10R1.15 CC(C=O)c1cccnc1 Amb24100578 [1,0,0,0,0,0|2,0,1]=4 433 B10R1.15 CC(C=O)c1ccncc1 Amb33358501 [1,0,0,0,0,0|2,0,1]=4 434 B10R1.15 CC(CBr)c1ccccc1 Amb3940569 [1,0,0,0,0,0|1,0,0]=2 435 B10R1.15 CC(CBr)c1ccccn1 Amb27471389 [1,0,0,0,0,0|2,0,0]=3 436 B10R1.15 CC(CBr)c1cccnc1 Amb33118517 [1,0,0,0,0,0|2,0,0]=3 437 B10R1.15 CC(CBr)c1ccncc1 Amb26369737 [1,0,0,0,0,0|2,0,0]=3 438 B10R1.15 CC(CBr)c1ccncn1 Amb33009045 [1,0,0,0,0,0|3,0,0]=4 439 B10R1.15 CC(CBr)c1cnccn1 Amb33451447 [1,0,0,0,0,0|3,0,0]=4 440 B10R1.15 CC(CBr)c1cncnc1 Amb33005790 [1,0,0,0,0,0|3,0,0]=4 441 B10R1.15 CC(CBr)c1ncccn1 Amb33007404 [1,0,0,0,0,0|3,0,0]=4 442 B10R1.15 CC(CCl)c1ccccc1 Amb17232147 [1,0,0,0,0,0|1,0,0]=2 443 B10R1.15 CC(CCl)c1cccnc1 Amb24085112 [1,0,0,0,0,0|2,0,0]=3 444 B10R1.15 CC(CCl)c1ccncc1 Amb27835971 [1,0,0,0,0,0|2,0,0]=3 445 B10R1.15 CC(CI)c1ccccc1 Amb26629255 [1,0,0,0,0,0|1,0,0]=2 446 B10R1.15 CC(CI)c1ccccn1 Amb30010228 [1,0,0,0,0,0|2,0,0]=3 447 B10R1.15 CC(CN)c1ccccc1 Amb19958781 [1,0,0,0,0,0|0,0,0]=1 448 B10R1.15 CC(CN)c1ccccc1 Amb5717369 [1,0,0,0,0,0|0,0,0]=1 449 B10R1.15 CC(CN)c1ccccn1 Amb33528304 [1,0,0,0,0,0|1,0,0]=2 450 B10R1.15 CC(CN)c1cccnc1 Amb8950129 [1,0,0,0,0,0|1,0,0]=2 451 B10R1.15 CC(CN)c1ccncc1 Amb32668866 [1,0,0,0,0,0|1,0,0]=2 452 B10R1.15 CC(CN)c1ccncc1 Amb8950130 [1,0,0,0,0,0|1,0,0]=2 453 B10R1.15 CC(CN)c1ccncn1 Amb25917566 [1,0,0,0,0,0|2,0,0]=3 454 B10R1.15 CC(CN)c1cnccn1 Amb18832279 [1,0,0,0,0,0|2,0,0]=3 455 B10R1.15 CC(CN)c1cncnc1 Amb18251160 [1,0,0,0,0,0|2,0,0]=3 456 B10R1.15 CC(CN)c1ncccn1 Amb27599600 [1,0,0,0,0,0|2,0,0]=3 457 B10R1.15 CC(CO)c1ccccc1 Amb2720837 [1,0,0,0,0,0|1,0,0]=2 458 B10R1.15 CC(CO)c1ccccn1 Amb22896757 [1,0,0,0,0,0|2,0,0]=3 459 B10R1.15 CC(CO)c1cccnc1 Amb33745581 [1,0,0,0,0,0|2,0,0]=3 460 B10R1.15 CC(CO)c1ccncc1 Amb24480432 [1,0,0,0,0,0|2,0,0]=3 461 B10R1.15 CC(CO)c1cnccn1 Amb33746148 [1,0,0,0,0,0|3,0,0]=4 462 B10R1.15 CC(CS)c1ccccc1 Amb28349926 [1,0,0,0,0,0|1,0,0]=2 463 B10R1.15 CC(CS)c1ccccn1 Amb29858764 [1,0,0,0,0,0|2,0,0]=3 464 B10R1.15 CC(NCl)c1ccccc1 Amb28049660 [1,0,0,0,0,0|1,0,0]=2 465 B10R1.15 CC(NN)c1ccccc1 Amb10610271 [1,0,0,0,0,0|1,0,0]=2 466 B10R1.15 CC(NN)c1ccccc1 Amb6251215 [1,0,0,0,0,0|1,0,0]=2 467 B10R1.15 CC(NN)c1ccccn1 Amb6243803 [1,0,0,0,0,0|2,0,0]=3 468 B10R1.15 CC(NN)c1cccnc1 Amb6243761 [1,0,0,0,0,0|2,0,0]=3 469 B10R1.15 CC(NN)c1ccncc1 Amb32663987 [1,0,0,0,0,0|2,0,0]=3 470 B10R1.15 CC(NN)c1ccncc1 Amb9714299 [1,0,0,0,0,0|2,0,0]=3 471 B10R1.15 CC(NO)c1ccccc1 Amb10605006 [1,0,0,0,0,0|1,0,0]=2 472 B10R1.15 CC(NO)c1ccccn1 Amb10605008 [1,0,0,0,0,0|2,0,0]=3 473 B10R1.15 CC(NO)c1cccnc1 Amb10605009 [1,0,0,0,0,0|2,0,0]=3 474 B10R1.15 CC(ON)c1ccccc1 Amb17089185 [1,0,0,0,0,0|1,0,0]=2 475 B10R1.15 CC(ON)c1ccccc1 Amb22491086 [1,0,0,0,0,0|1,0,0]=2 476 B10R1.15 CC(ON)c1ccccn1 Amb22397048 [1,0,0,0,0,0|2,0,0]=3 477 B10R1.15 CC(ON)c1cccnc1 Amb31295300 [1,0,0,0,0,0|2,0,0]=3 478 B10R1.15 CC(ON)c1ccncc1 Amb22397090 [1,0,0,0,0,0|2,0,0]=3 479 B10R1.15 CC(ON)c1ccncn1 Amb33268673 [1,0,0,0,0,0|3,0,0]=4 480 B10R1.15 CC(ON)c1cnccn1 Amb33359983 [1,0,0,0,0,0|3,0,0]=4 481 B10R1.15 CC(ON)c1cncnc1 Amb33149194 [1,0,0,0,0,0|3,0,0]=4 482 B10R1.15 CC(ON)c1ncccn1 Amb33270401 [1,0,0,0,0,0|3,0,0]=4 483 B10R1.15 CCC(=N)c1ccccn1 Amb28182447 [1,0,0,0,0,0|2,0,1]=4 484 B10R1.15 CCC(=O)c1ccccc1 Amb4037285 [1,0,0,0,0,0|1,0,1]=3 485 B10R1.15 CCC(=O)c1ccccn1 Amb6301470 [1,0,0,0,0,0|2,0,1]=4 486 B10R1.15 CCC(=O)c1cccnc1 Amb8386799 [1,0,0,0,0,0|2,0,1]=4 487 B10R1.15 CCC(=O)c1ccncc1 Amb10576400 [1,0,0,0,0,0|2,0,1]=4 488 B10R1.15 CCC(Br)c1ccccc1 Amb9210652 [1,0,0,0,0,0|1,0,0]=2 489 B10R1.15 CCC(Br)c1ccccn1 Amb27647660 [1,0,0,0,0,0|2,0,0]=3 490 B10R1.15 CCC(Br)c1cccnc1 Amb24556035 [1,0,0,0,0,0|2,0,0]=3 491 B10R1.15 CCC(Br)c1ccncc1 Amb27463363 [1,0,0,0,0,0|2,0,0]=3 492 B10R1.15 CCC(Br)c1cnccn1 Amb27481128 [1,0,0,0,0,0|3,0,0]=4 493 B10R1.15 CCC(Br)c1ncccn1 Amb24480847 [1,0,0,0,0,0|3,0,0]=4 494 B10R1.15 CCC(C)c1ccccc1 Amb9702788 [1,0,0,0,0,0|0,0,0]=1 495 B10R1.15 CCC(C)c1ccccn1 Amb28145932 [1,0,0,0,0,0|1,0,0]=2 496 B10R1.15 CCC(C)c1ccncc1 Amb26842817 [1,0,0,0,0,0|1,0,0]=2 497 B10R1.15 CCC(Cl)c1ccccc1 Amb7766794 [1,0,0,0,0,0|1,0,0]=2 498 B10R1.15 CCC(N)c1ccccc1 Amb19959910 [1,0,0,0,0,0|1,0,0]=2 499 B10R1.15 CCC(N)c1ccccc1 Amb9703596 [1,0,0,0,0,0|1,0,0]=2 500 B10R1.15 CCC(N)c1ccccn1 Amb10607917 [1,0,0,0,0,0|2,0,0]=3 501 B10R1.15 CCC(N)c1ccccn1 Amb22587075 [1,0,0,0,0,0|2,0,0]=3 502 B10R1.15 CCC(N)c1cccnc1 Amb10607957 [1,0,0,0,0,0|2,0,0]=3 503 B10R1.15 CCC(N)c1cccnc1 Amb30588534 [1,0,0,0,0,0|2,0,0]=3 504 B10R1.15 CCC(N)c1ccncc1 Amb8009606 [1,0,0,0,0,0|2,0,0]=3 505 B10R1.15 CCC(N)c1ccnnc1 Amb27205048 [1,0,0,0,0,0|3,0,0]=4 506 B10R1.15 CCC(N)c1cnccn1 Amb18281061 [1,0,0,0,0,0|3,0,0]=4 507 B10R1.15 CCC(N)c1cnccn1 Amb23440161 [1,0,0,0,0,0|3,0,0]=4 508 B10R1.15 CCC(N)c1ncccn1 Amb33535047 [1,0,0,0,0,0|3,0,0]=4 509 B10R1.15 CCC(O)c1ccccc1 Amb6705776 [1,0,0,0,0,0|1,0,0]=2 510 B10R1.15 CCC(O)c1ccccn1 Amb26851902 [1,0,0,0,0,0|2,0,0]=3 511 B10R1.15 CCC(O)c1cccnc1 Amb17231904 [1,0,0,0,0,0|2,0,0]=3 512 B10R1.15 CCC(O)c1ccncc1 Amb16233288 [1,0,0,0,0,0|2,0,0]=3 513 B10R1.15 CCC(O)c1cncnc1 Amb26619472 [1,0,0,0,0,0|3,0,0]=4 514 B10R1.15 CCC(O)c1ncccn1 Amb28049305 [1,0,0,0,0,0|3,0,0]=4 515 B10R1.15 CCC(S)c1ccccc1 Amb9208017 [1,0,0,0,0,0|1,0,0]=2 516 B10R1.15 CCN(C)c1ccccn1 Amb26564265 [1,0,0,0,0,0|2,0,0]=3 517 B10R1.15 CCN(C)c1ccncn1 Amb24425418 [1,0,0,0,0,0|3,0,0]=4 518 B10R1.15 CCN(N)c1ccccc1 Amb836839 [1,0,0,0,0,0|2,0,0]=3 519 B10R1.15 CCN(N)c1ccccn1 Amb18643189 [1,0,0,0,0,0|3,0,0]=4 520 B10R1.15 CCP(Cl)c1ccccc1 Amb27765906 [1,0,0,0,0,0|2,0,0]=3 521 B10R1.15 CCS(=O)c1ccccc1 Amb22500370 [1,0,0,0,0,0|2,0,0]=3 522 B10R1.15 CCS(=O)c1ccccn1 Amb28049400 [1,0,0,0,0,0|3,0,0]=4 523 B10R1.15 CC[C@@H](Br)c1ccccc1 Amb27761826 [1,0,0,0,0,0|1,0,0]=2 524 B10R1.15 CC[C@@H](N)c1ccccc1 Amb22265426 [1,0,0,0,0,0|1,0,0]=2 525 B10R1.15 CC[C@@H](N)c1ccccc1 Amb8383789 [1,0,0,0,0,0|1,0,0]=2 526 B10R1.15 CC[C@@H](N)c1ccccn1 Amb25797820 [1,0,0,0,0,0|2,0,0]=3 527 B10R1.15 CC[C@@H](N)c1ccccn1 Amb30869540 [1,0,0,0,0,0|2,0,0]=3 528 B10R1.15 CC[C@@H](N)c1ccncc1 Amb30647447 [1,0,0,0,0,0|2,0,0]=3 529 B10R1.15 CC[C@@H](N)c1ncccn1 Amb28189771 [1,0,0,0,0,0|3,0,0]=4 530 B10R1.15 CC[C@@H](O)c1ccccc1 Amb8517168 [1,0,0,0,0,0|1,0,0]=2 531 B10R1.15 CC[C@@H](O)c1ccccn1 Amb25717055 [1,0,0,0,0,0|2,0,0]=3 532 B10R1.15 CC[C@@H](O)c1cccnc1 Amb27161307 [1,0,0,0,0,0|2,0,0]=3 533 B10R1.15 CC[C@@H](O)c1cncnc1 Amb27431312 [1,0,0,0,0,0|3,0,0]=4 534 B10R1.15 CC[C@H](Br)c1ccccc1 Amb27659277 [1,0,0,0,0,0|1,0,0]=2 535 B10R1.15 CC[C@H](C)c1ccccc1 Amb28326096 [1,0,0,0,0,0|0,0,0]=1 536 B10R1.15 CC[C@H](C)c1ccccn1 Amb27407415 [1,0,0,0,0,0|1,0,0]=2 537 B10R1.15 CC[C@H](N)c1ccccc1 Amb22265559 [1,0,0,0,0,0|1,0,0]=2 538 B10R1.15 CC[C@H](N)c1ccccc1 Amb8628779 [1,0,0,0,0,0|1,0,0]=2 539 B10R1.15 CC[C@H](N)c1ccccn1 Amb26961005 [1,0,0,0,0,0|2,0,0]=3 540 B10R1.15 CC[C@H](N)c1ccccn1 Amb33802008 [1,0,0,0,0,0|2,0,0]=3 541 B10R1.15 CC[C@H](N)c1ccccn1 Amb33872493 [1,0,0,0,0,0|2,0,0]=3 542 B10R1.15 CC[C@H](N)c1cccnc1 Amb30647446 [1,0,0,0,0,0|2,0,0]=3 543 B10R1.15 CC[C@H](N)c1ccncc1 Amb27404537 [1,0,0,0,0,0|2,0,0]=3 544 B10R1.15 CC[C@H](N)c1ccncc1 Amb30647448 [1,0,0,0,0,0|2,0,0]=3 545 B10R1.15 CC[C@H](N)c1cncnc1 Amb27959585 [1,0,0,0,0,0|3,0,0]=4 546 B10R1.15 CC[C@H](N)c1ncccn1 Amb27972716 [1,0,0,0,0,0|3,0,0]=4 547 B10R1.15 CC[C@H](O)c1ccccc1 Amb8517167 [1,0,0,0,0,0|1,0,0]=2 548 B10R1.15 CC[C@H](O)c1ccccn1 Amb25910593 [1,0,0,0,0,0|2,0,0]=3 549 B10R1.15 CC[C@H](O)c1cccnc1 Amb24432697 [1,0,0,0,0,0|2,0,0]=3 550 B10R1.15 CC[C@H](O)c1ccncc1 Amb27861997 [1,0,0,0,0,0|2,0,0]=3 551 B10R1.15 CN(C#N)c1ccccc1 Amb24658199 [1,0,0,0,0,0|1,0,2]=4 552 B10R1.15 CN(C=O)c1ccccc1 Amb7969686 [1,0,0,0,0,0|2,0,1]=4 553 B10R1.15 CN(N=O)c1ccccc1 Amb6308537 [1,0,0,0,0,0|2,0,1]=4 554 B10R1.15 CNC(=N)c1ccccc1 Amb23447117 [1,0,0,0,0,0|1,0,1]=3 555 B10R1.15 CNC(=N)c1ccccc1 Amb28775800 [1,0,0,0,0,0|1,0,1]=3 556 B10R1.15 CNC(=N)c1cccnc1 Amb32667420 [1,0,0,0,0,0|2,0,1]=4 557 B10R1.15 CNC(=O)c1ccccc1 Amb2591685 [1,0,0,0,0,0|1,0,1]=3 558 B10R1.15 CNC(=O)c1ccccn1 Amb6892873 [1,0,0,0,0,0|2,0,1]=4 559 B10R1.15 CNC(=O)c1cccnc1 Amb3886560 [1,0,0,0,0,0|2,0,1]=4 560 B10R1.15 CNC(=O)c1ccncc1 Amb26328844 [1,0,0,0,0,0|2,0,1]=4 561 B10R1.15 CNC(=S)c1ccccc1 Amb10552988 [1,0,0,0,0,0|1,0,1]=3 562 B10R1.15 CNC(=S)c1cccnc1 Amb27877638 [1,0,0,0,0,0|2,0,1]=4 563 B10R1.15 CNC(C)c1ccccc1 Amb6382953 [1,0,0,0,0,0|0,0,0]=1 564 B10R1.15 CNC(C)c1ccccc1 Amb9745717 [1,0,0,0,0,0|0,0,0]=1 565 B10R1.15 CNC(C)c1ccccn1 Amb10189608 [1,0,0,0,0,0|1,0,0]=2 566 B10R1.15 CNC(C)c1ccccn1 Amb22587689 [1,0,0,0,0,0|1,0,0]=2 567 B10R1.15 CNC(C)c1ccccn1 Amb9705005 [1,0,0,0,0,0|1,0,0]=2 568 B10R1.15 CNC(C)c1cccnc1 Amb10189690 [1,0,0,0,0,0|1,0,0]=2 569 B10R1.15 CNC(C)c1cccnc1 Amb1121577 [1,0,0,0,0,0|1,0,0]=2 570 B10R1.15 CNC(C)c1cccnc1 Amb22587688 [1,0,0,0,0,0|1,0,0]=2 571 B10R1.15 CNC(C)c1ccncc1 Amb10189609 [1,0,0,0,0,0|1,0,0]=2 572 B10R1.15 CNC(C)c1ccncc1 Amb22492289 [1,0,0,0,0,0|1,0,0]=2 573 B10R1.15 CNC(C)c1ccncc1 Amb22587687 [1,0,0,0,0,0|1,0,0]=2 574 B10R1.15 CNC(C)c1ccncc1 Amb9705906 [1,0,0,0,0,0|1,0,0]=2 575 B10R1.15 CNC(C)c1ccncn1 Amb10608544 [1,0,0,0,0,0|2,0,0]=3 576 B10R1.15 CNC(C)c1ccncn1 Amb22587685 [1,0,0,0,0,0|2,0,0]=3 577 B10R1.15 CNC(C)c1ncccn1 Amb18949733 [1,0,0,0,0,0|2,0,0]=3 578 B10R1.15 CNN(C)c1ccccc1 Amb27398128 [1,0,0,0,0,0|1,0,0]=2 579 B10R1.15 CN[C@@H](C)c1ccccc1 Amb17740009 [1,0,0,0,0,0|0,0,0]=1 580 B10R1.15 CN[C@@H](C)c1ccccn1 Amb24744532 [1,0,0,0,0,0|1,0,0]=2 581 B10R1.15 CN[C@@H](C)c1ccccn1 Amb33457847 [1,0,0,0,0,0|1,0,0]=2 582 B10R1.15 CN[C@@H](C)c1cccnc1 Amb27162166 [1,0,0,0,0,0|1,0,0]=2 583 B10R1.15 CN[C@@H](C)c1cccnc1 Amb33457822 [1,0,0,0,0,0|1,0,0]=2 584 B10R1.15 CN[C@@H](C)c1ccncc1 Amb28193264 [1,0,0,0,0,0|1,0,0]=2 585 B10R1.15 CN[C@@H](C)c1ccncc1 Amb33457902 [1,0,0,0,0,0|1,0,0]=2 586 B10R1.15 CN[C@H](C)c1ccccc1 Amb10844610 [1,0,0,0,0,0|0,0,0]=1 587 B10R1.15 CN[C@H](C)c1ccccn1 Amb27391593 [1,0,0,0,0,0|1,0,0]=2 588 B10R1.15 CN[C@H](C)c1cccnc1 Amb25084519 [1,0,0,0,0,0|1,0,0]=2 589 B10R1.15 CN[C@H](C)c1cccnc1 Amb33328981 [1,0,0,0,0,0|1,0,0]=2 590 B10R1.15 COC(=N)c1ccccc1 Amb4009954 [1,0,0,0,0,0|2,0,1]=4 591 B10R1.15 COC(=N)c1ccccc1 Amb6366188 [1,0,0,0,0,0|2,0,1]=4 592 B10R1.15 COC(=O)c1ccccc1 Amb4302710 [1,0,0,0,0,0|2,0,1]=4 593 B10R1.15 COC(=S)c1ccccc1 Amb10569749 [1,0,0,0,0,0|2,0,1]=4 594 B10R1.15 COC(C)c1ccccc1 Amb23568513 [1,0,0,0,0,0|1,0,0]=2 595 B10R1.15 CON(C)c1ccccn1 Amb27804447 [1,0,0,0,0,0|3,0,0]=4 596 B10R1.15 COS(=O)c1ccccc1 Amb2689327 [1,0,0,0,0,0|3,0,0]=4 597 B10R1.15 CP(CO)c1ccccc1 Amb27410449 [1,0,0,0,0,0|2,0,0]=3 598 B10R1.15 CSC(=N)c1ccccc1 Amb22488568 [1,0,0,0,0,0|2,0,1]=4 599 B10R1.15 CSC(=S)c1ccccc1 Amb24395059 [1,0,0,0,0,0|2,0,1]=4 600 B10R1.15 CSC(C)c1cnccn1 Amb28049764 [1,0,0,0,0,0|3,0,0]=4 601 B10R1.15 C[C@@H](C=O)c1ccccc1 Amb24399258 [1,0,0,0,0,0|1,0,1]=3 602 B10R1.15 C[C@@H](CN)c1ccccc1 Amb33623692 [1,0,0,0,0,0|0,0,0]=1 603 B10R1.15 C[C@@H](CN)c1ccccc1 Amb4036825 [1,0,0,0,0,0|0,0,0]=1 604 B10R1.15 C[C@@H](CN)c1cccnc1 Amb33744398 [1,0,0,0,0,0|1,0,0]=2 605 B10R1.15 C[C@@H](CN)c1ccncc1 Amb33727423 [1,0,0,0,0,0|1,0,0]=2 606 B10R1.15 C[C@@H](CN)c1cnccn1 Amb33748932 [1,0,0,0,0,0|2,0,0]=3 607 B10R1.15 C[C@@H](CO)c1ccccc1 Amb3939247 [1,0,0,0,0,0|1,0,0]=2 608 B10R1.15 C[C@@H](CO)c1ccccn1 Amb28137345 [1,0,0,0,0,0|2,0,0]=3 609 B10R1.15 C[C@@H](CO)c1cccnc1 Amb33746677 [1,0,0,0,0,0|2,0,0]=3 610 B10R1.15 C[C@@H](CO)c1ccncc1 Amb33735556 [1,0,0,0,0,0|2,0,0]=3 611 B10R1.15 C[C@@H](CO)c1cnccn1 Amb33748024 [1,0,0,0,0,0|3,0,0]=4 612 B10R1.15 C[C@@H](NN)c1ccccc1 Amb25824988 [1,0,0,0,0,0|1,0,0]=2 613 B10R1.15 C[C@@H](NO)c1ccccc1 Amb20670899 [1,0,0,0,0,0|1,0,0]=2 614 B10R1.15 C[C@@H](NO)c1ccccc1 Amb22736690 [1,0,0,0,0,0|1,0,0]=2 615 B10R1.15 C[C@@H](ON)c1ccccc1 Amb25850037 [1,0,0,0,0,0|1,0,0]=2 616 B10R1.15 C[C@@H](ON)c1ccccc1 Amb32665789 [1,0,0,0,0,0|1,0,0]=2 617 B10R1.15 C[C@@H](ON)c1ccccn1 Amb33483784 [1,0,0,0,0,0|2,0,0]=3 618 B10R1.15 C[C@@H](ON)c1ccncc1 Amb33620851 [1,0,0,0,0,0|2,0,0]=3 619 B10R1.15 C[C@H](C=O)c1ccccc1 Amb24476962 [1,0,0,0,0,0|1,0,1]=3 620 B10R1.15 C[C@H](CN)c1ccccc1 Amb10070369 [1,0,0,0,0,0|0,0,0]=1 621 B10R1.15 C[C@H](CN)c1cccnc1 Amb33740278 [1,0,0,0,0,0|1,0,0]=2 622 B10R1.15 C[C@H](CN)c1ccncc1 Amb33747422 [1,0,0,0,0,0|1,0,0]=2 623 B10R1.15 C[C@H](CN)c1cnccn1 Amb33728700 [1,0,0,0,0,0|2,0,0]=3 624 B10R1.15 C[C@H](CO)c1ccccc1 Amb3939248 [1,0,0,0,0,0|1,0,0]=2 625 B10R1.15 C[C@H](CO)c1cccnc1 Amb33738165 [1,0,0,0,0,0|2,0,0]=3 626 B10R1.15 C[C@H](CO)c1ccncc1 Amb33730462 [1,0,0,0,0,0|2,0,0]=3 627 B10R1.15 C[C@H](CO)c1cnccn1 Amb33744967 [1,0,0,0,0,0|3,0,0]=4 628 B10R1.15 C[C@H](NN)c1ccccc1 Amb26589811 [1,0,0,0,0,0|1,0,0]=2 629 B10R1.15 C[C@H](NO)c1cccnc1 Amb27242936 [1,0,0,0,0,0|2,0,0]=3 630 B10R1.15 C[C@H](ON)c1ccccc1 Amb32665788 [1,0,0,0,0,0|1,0,0]=2 631 B10R1.15 C[C@H](ON)c1ccccc1 Amb32666539 [1,0,0,0,0,0|1,0,0]=2 632 B10R1.15 C[C@H](ON)c1ccccn1 Amb33483778 [1,0,0,0,0,0|2,0,0]=3 633 B10R1.15 C[C@H](ON)c1ccncc1 Amb33299308 [1,0,0,0,0,0|2,0,0]=3 634 B10R1.15 C\C(=C/Br)c1ccccc1 Amb25066105 [1,0,0,0,0,0|1,0,2]=4 635 B10R1.15 C\C(=C/Cl)c1ccccc1 Amb30621745 [1,0,0,0,0,0|1,0,2]=4 636 B10R1.15 C\C(=C\Br)c1ccccc1 Amb4035454 [1,0,0,0,0,0|1,0,2]=4 637 B10R1.15 C\C(=C\Cl)c1ccccc1 Amb26652006 [1,0,0,0,0,0|1,0,2]=4 638 B10R1.15 C\C(=N/N)c1ccccc1 Amb4016930 [1,0,0,0,0,0|1,0,1]=3 639 B10R1.15 C\C(=N/N)c1ccccn1 Amb22552431 [1,0,0,0,0,0|2,0,1]=4 640 B10R1.15 C\C(=N/O)c1ccccc1 Amb2387477 [1,0,0,0,0,0|1,0,2]=4 641 B10R1.15 C\C(=N\O)c1ccccc1 Amb3428046 [1,0,0,0,0,0|1,0,2]=4 642 B10R1.15 C\C=C(/C)c1ccccc1 Amb29628341 [1,0,0,0,0,0|0,0,2]=3 643 B10R1.15 C\C=C(/C)c1ccncc1 Amb24103190 [1,0,0,0,0,0|1,0,2]=4 644 B10R1.15 C\C=C(/F)c1ccccc1 Amb25881627 [1,0,0,0,0,0|1,0,2]=4 645 B10R1.15 C\C=C(/N)c1ccccc1 Amb27787637 [1,0,0,0,0,0|1,0,2]=4 646 B10R1.15 C\C=C(\C)c1ccccc1 Amb26360165 [1,0,0,0,0,0|0,0,2]=3 647 B10R1.15 C\C=C(\C)c1cccnc1 Amb27260271 [1,0,0,0,0,0|1,0,2]=4 648 B10R1.15 C\N=C(\C)c1ccccn1 Amb24433259 [1,0,0,0,0,0|1,0,2]=4 649 B10R1.15 ClCC(Cl)c1ccccc1 Amb2720893 [1,0,0,0,0,0|2,0,0]=3 650 B10R1.15 FC(CBr)c1ccccc1 Amb20075900 [1,0,0,0,0,0|2,0,0]=3 651 B10R1.15 FC(CCl)c1ccccc1 Amb27596575 [1,0,0,0,0,0|2,0,0]=3 652 B10R1.15 N#CC(Br)c1ccccc1 Amb9787616 [1,0,0,0,0,0|1,0,2]=4 653 B10R1.15 N#CC(F)c1ccccc1 Amb22747439 [1,0,0,0,0,0|1,0,2]=4 654 B10R1.15 N#CC(N)c1ccccc1 Amb3940545 [1,0,0,0,0,0|1,0,2]=4 655 B10R1.15 N#CC(O)c1ccccc1 Amb3997186 [1,0,0,0,0,0|1,0,2]=4 656 B10R1.15 N#CC([NH3+])c1ccccc1 Amb6365971 [1,0,0,0,0,0|1,0,2]=4 657 B10R1.15 N#C[C@@H](Br)c1ccccc1 Amb24479015 [1,0,0,0,0,0|1,0,2]=4 658 B10R1.15 N#C[C@@H](N)c1ccccc1 Amb17399826 [1,0,0,0,0,0|1,0,2]=4 659 B10R1.15 N#C[C@H](Cl)c1ccccc1 Amb27184041 [1,0,0,0,0,0|1,0,2]=4 660 B10R1.15 N#C[C@H](O)c1ccccc1 Amb21618705 [1,0,0,0,0,0|1,0,2]=4 661 B10R1.15 N=C(NN)c1ccccc1 Amb22234855 [1,0,0,0,0,0|2,0,1]=4 662 B10R1.15 NC(C=O)c1ccccc1 Amb27490826 [1,0,0,0,0,0|2,0,1]=4 663 B10R1.15 NC(CCl)c1ccccc1 Amb27602197 [1,0,0,0,0,0|2,0,0]=3 664 B10R1.15 NC(CF)c1ccccc1 Amb2372575 [1,0,0,0,0,0|2,0,0]=3 665 B10R1.15 NC(CF)c1ccccc1 Amb33362248 [1,0,0,0,0,0|2,0,0]=3 666 B10R1.15 NC(CF)c1cccnc1 Amb27251300 [1,0,0,0,0,0|3,0,0]=4 667 B10R1.15 NC(CO)c1ccccc1 Amb8513829 [1,0,0,0,0,0|2,0,0]=3 668 B10R1.15 NC(CO)c1ccccn1 Amb17935880 [1,0,0,0,0,0|3,0,0]=4 669 B10R1.15 NC(CO)c1ccccn1 Amb18560041 [1,0,0,0,0,0|3,0,0]=4 670 B10R1.15 NC(CO)c1cccnc1 Amb2683353 [1,0,0,0,0,0|3,0,0]=4 671 B10R1.15 NC(CO)c1cccnc1 Amb32644753 [1,0,0,0,0,0|3,0,0]=4 672 B10R1.15 NC(CO)c1cccnc1 Amb33548117 [1,0,0,0,0,0|3,0,0]=4 673 B10R1.15 NC(CO)c1ccncc1 Amb17935881 [1,0,0,0,0,0|3,0,0]=4 674 B10R1.15 NC(CO)c1ccncc1 Amb18561776 [1,0,0,0,0,0|3,0,0]=4 675 B10R1.15 NCC(=O)c1ccccc1 Amb1073498 [1,0,0,0,0,0|1,0,1]=3 676 B10R1.15 NCC(=O)c1ccccc1 Amb33531112 [1,0,0,0,0,0|1,0,1]=3 677 B10R1.15 NCC(=O)c1ccccn1 Amb10601921 [1,0,0,0,0,0|2,0,1]=4 678 B10R1.15 NCC(=O)c1ccccn1 Amb18832469 [1,0,0,0,0,0|2,0,1]=4 679 B10R1.15 NCC(=O)c1cccnc1 Amb17607867 [1,0,0,0,0,0|2,0,1]=4 680 B10R1.15 NCC(=O)c1cccnc1 Amb22277079 [1,0,0,0,0,0|2,0,1]=4 681 B10R1.15 NCC(=O)c1cccnc1 Amb22754018 [1,0,0,0,0,0|2,0,1]=4 682 B10R1.15 NCC(=O)c1ccncc1 Amb18832471 [1,0,0,0,0,0|2,0,1]=4 683 B10R1.15 NCC(=O)c1ccncc1 Amb22002046 [1,0,0,0,0,0|2,0,1]=4 684 B10R1.15 NCC(Cl)c1ccccc1 Amb27984951 [1,0,0,0,0,0|1,0,0]=2 685 B10R1.15 NCC(F)c1ccccc1 Amb23454844 [1,0,0,0,0,0|1,0,0]=2 686 B10R1.15 NCC(F)c1ccccc1 Amb33249671 [1,0,0,0,0,0|1,0,0]=2 687 B10R1.15 NCC(F)c1ccccn1 Amb24473175 [1,0,0,0,0,0|2,0,0]=3 688 B10R1.15 NCC(F)c1cccnc1 Amb27405475 [1,0,0,0,0,0|2,0,0]=3 689 B10R1.15 NCC(F)c1ccncc1 Amb27653637 [1,0,0,0,0,0|2,0,0]=3 690 B10R1.15 NCC(F)c1ccncn1 Amb33269015 [1,0,0,0,0,0|3,0,0]=4 691 B10R1.15 NCC(F)c1cnccn1 Amb25756644 [1,0,0,0,0,0|3,0,0]=4 692 B10R1.15 NCC(F)c1cncnc1 Amb27210622 [1,0,0,0,0,0|3,0,0]=4 693 B10R1.15 NCC(F)c1ncccn1 Amb33270411 [1,0,0,0,0,0|3,0,0]=4 694 B10R1.15 NCC(N)c1ccccc1 Amb21857142 [1,0,0,0,0,0|1,0,0]=2 695 B10R1.15 NCC(N)c1ccccc1 Amb33473621 [1,0,0,0,0,0|1,0,0]=2 696 B10R1.15 NCC(N)c1ccccc1 Amb9380661 [1,0,0,0,0,0|1,0,0]=2 697 B10R1.15 NCC(N)c1ccncc1 Amb18063802 [1,0,0,0,0,0|2,0,0]=3 698 B10R1.15 NCC(N)c1ccncn1 Amb27669693 [1,0,0,0,0,0|3,0,0]=4 699 B10R1.15 NCC(O)c1ccccc1 Amb33542602 [1,0,0,0,0,0|1,0,0]=2 700 B10R1.15 NCC(O)c1ccccc1 Amb33544420 [1,0,0,0,0,0|1,0,0]=2 701 B10R1.15 NCC(O)c1ccccn1 Amb1109027 [1,0,0,0,0,0|2,0,0]=3 702 B10R1.15 NCC(O)c1ccccn1 Amb20622942 [1,0,0,0,0,0|2,0,0]=3 703 B10R1.15 NCC(O)c1ccccn1 Amb6892508 [1,0,0,0,0,0|2,0,0]=3 704 B10R1.15 NCC(O)c1cccnc1 Amb10068830 [1,0,0,0,0,0|2,0,0]=3 705 B10R1.15 NCC(O)c1cccnc1 Amb8503375 [1,0,0,0,0,0|2,0,0]=3 706 B10R1.15 NCC(O)c1cccnc1 Amb9703829 [1,0,0,0,0,0|2,0,0]=3 707 B10R1.15 NCC(O)c1ccncc1 Amb22755845 [1,0,0,0,0,0|2,0,0]=3 708 B10R1.15 NCC(O)c1ccncc1 Amb9703695 [1,0,0,0,0,0|2,0,0]=3 709 B10R1.15 NCC(O)c1ccncn1 Amb24434504 [1,0,0,0,0,0|3,0,0]=4 710 B10R1.15 NCC(O)c1cnccn1 Amb27230477 [1,0,0,0,0,0|3,0,0]=4 711 B10R1.15 NCC(O)c1cncnc1 Amb25731161 [1,0,0,0,0,0|3,0,0]=4 712 B10R1.15 NCC(O)c1ncccn1 Amb26039872 [1,0,0,0,0,0|3,0,0]=4 713 B10R1.15 NC[C@@H](F)c1ccccc1 Amb25279947 [1,0,0,0,0,0|1,0,0]=2 714 B10R1.15 NC[C@@H](F)c1ccccc1 Amb32661014 [1,0,0,0,0,0|1,0,0]=2 715 B10R1.15 NC[C@@H](N)c1cccnc1 Amb28046917 [1,0,0,0,0,0|2,0,0]=3 716 B10R1.15 NC[C@@H](O)c1ccccc1 Amb24107154 [1,0,0,0,0,0|1,0,0]=2 717 B10R1.15 NC[C@@H](O)c1ccccc1 Amb8630286 [1,0,0,0,0,0|1,0,0]=2 718 B10R1.15 NC[C@@H](O)c1ccccn1 Amb25052826 [1,0,0,0,0,0|2,0,0]=3 719 B10R1.15 NC[C@@H](O)c1cccnc1 Amb22744742 [1,0,0,0,0,0|2,0,0]=3 720 B10R1.15 NC[C@@H](O)c1cccnc1 Amb22748405 [1,0,0,0,0,0|2,0,0]=3 721 B10R1.15 NC[C@@H](O)c1ccncc1 Amb24479579 [1,0,0,0,0,0|2,0,0]=3 722 B10R1.15 NC[C@@H](O)c1ccncn1 Amb24546069 [1,0,0,0,0,0|3,0,0]=4 723 B10R1.15 NC[C@@H](O)c1cnccn1 Amb25370172 [1,0,0,0,0,0|3,0,0]=4 724 B10R1.15 NC[C@@H](O)c1cncnc1 Amb33149206 [1,0,0,0,0,0|3,0,0]=4 725 B10R1.15 NC[C@@H](O)c1ncccn1 Amb33270410 [1,0,0,0,0,0|3,0,0]=4 726 B10R1.15 NC[C@H](N)c1ccncc1 Amb27617070 [1,0,0,0,0,0|2,0,0]=3 727 B10R1.15 NC[C@H](O)c1ccccc1 Amb10070626 [1,0,0,0,0,0|1,0,0]=2 728 B10R1.15 NC[C@H](O)c1ccccc1 Amb8631408 [1,0,0,0,0,0|1,0,0]=2 729 B10R1.15 NC[C@H](O)c1ccccn1 Amb24569794 [1,0,0,0,0,0|2,0,0]=3 730 B10R1.15 NC[C@H](O)c1cccnc1 Amb23385336 [1,0,0,0,0,0|2,0,0]=3 731 B10R1.15 NC[C@H](O)c1cccnc1 Amb25127978 [1,0,0,0,0,0|2,0,0]=3 732 B10R1.15 NC[C@H](O)c1ccncc1 Amb27227500 [1,0,0,0,0,0|2,0,0]=3 733 B10R1.15 NC[C@H](O)c1ccncn1 Amb25917456 [1,0,0,0,0,0|3,0,0]=4 734 B10R1.15 NC[C@H](O)c1cnccn1 Amb26496616 [1,0,0,0,0,0|3,0,0]=4 735 B10R1.15 NC[C@H](O)c1cncnc1 Amb33149202 [1,0,0,0,0,0|3,0,0]=4 736 B10R1.15 NC[C@H](O)c1ncccn1 Amb33225262 [1,0,0,0,0,0|3,0,0]=4 737 B10R1.15 NC[PH](=O)c1ccccc1 Amb28119772 [1,0,0,0,0,0|2,0,0]=3 738 B10R1.15 NNC(=O)c1ccccc1 Amb1208583 [1,0,0,0,0,0|2,0,1]=4 739 B10R1.15 NNC(=S)c1ccccc1 Amb23513674 [1,0,0,0,0,0|2,0,1]=4 740 B10R1.15 NNS(=O)c1ccccc1 Amb27428863 [1,0,0,0,0,0|3,0,0]=4 741 B10R1.15 N[C@@H](CBr)c1ccccc1 Amb27876239 [1,0,0,0,0,0|2,0,0]=3 742 B10R1.15 N[C@@H](CF)c1ccccc1 Amb22887019 [1,0,0,0,0,0|2,0,0]=3 743 B10R1.15 N[C@@H](CF)c1ccccc1 Amb22887020 [1,0,0,0,0,0|2,0,0]=3 744 B10R1.15 N[C@@H](CF)c1cccnc1 Amb27237037 [1,0,0,0,0,0|3,0,0]=4 745 B10R1.15 N[C@@H](CO)c1ccccc1 Amb3939344 [1,0,0,0,0,0|2,0,0]=3 746 B10R1.15 N[C@@H](CO)c1ccccn1 Amb28346863 [1,0,0,0,0,0|3,0,0]=4 747 B10R1.15 N[C@@H](CO)c1ccccn1 Amb33483256 [1,0,0,0,0,0|3,0,0]=4 748 B10R1.15 N[C@@H](CO)c1cccnc1 Amb25146409 [1,0,0,0,0,0|3,0,0]=4 749 B10R1.15 N[C@@H](CO)c1ccncc1 Amb25146410 [1,0,0,0,0,0|3,0,0]=4 750 B10R1.15 N[C@H](CCl)c1ccccc1 Amb27214165 [1,0,0,0,0,0|2,0,0]=3 751 B10R1.15 N[C@H](CF)c1ccccc1 Amb27768745 [1,0,0,0,0,0|2,0,0]=3 752 B10R1.15 N[C@H](CF)c1ccccc1 Amb33482690 [1,0,0,0,0,0|2,0,0]=3 753 B10R1.15 N[C@H](CO)c1ccccc1 Amb2720557 [1,0,0,0,0,0|2,0,0]=3 754 B10R1.15 N[C@H](CO)c1ccccn1 Amb27617071 [1,0,0,0,0,0|3,0,0]=4 755 B10R1.15 N[C@H](CO)c1ccccn1 Amb33483257 [1,0,0,0,0,0|3,0,0]=4 756 B10R1.15 N[C@H](CO)c1cccnc1 Amb24712243 [1,0,0,0,0,0|3,0,0]=4 757 B10R1.15 N[C@H](CO)c1ccncc1 Amb24714739 [1,0,0,0,0,0|3,0,0]=4 758 B10R1.15 N\N=C(/Cl)c1ccccc1 Amb27951117 [1,0,0,0,0,0|2,0,1]=4 759 B10R1.15 N\N=C(/N)c1ccccc1 Amb20407822 [1,0,0,0,0,0|2,0,1]=4 760 B10R1.15 N\N=C(\Cl)c1ccccc1 Amb27210015 [1,0,0,0,0,0|2,0,1]=4 761 B10R1.15 O=C(CBr)c1ccccc1 Amb33533065 [1,0,0,0,0,0|2,0,1]=4 762 B10R1.15 O=C(CCl)c1ccccc1 Amb3940253 [1,0,0,0,0,0|2,0,1]=4 763 B10R1.15 O=C(CF)c1ccccc1 Amb10603600 [1,0,0,0,0,0|2,0,1]=4 764 B10R1.15 O=C(CI)c1ccccc1 Amb23579972 [1,0,0,0,0,0|2,0,1]=4 765 B10R1.15 O=C(CO)c1ccccc1 Amb3940718 [1,0,0,0,0,0|2,0,1]=4 766 B10R1.15 O=C(CS)c1ccccc1 Amb16192503 [1,0,0,0,0,0|2,0,1]=4 767 B10R1.15 O=C(NI)c1ccccc1 Amb27787732 [1,0,0,0,0,0|2,0,1]=4 768 B10R1.15 O=C(NO)c1ccccc1 Amb1645521 [1,0,0,0,0,0|2,0,1]=4 769 B10R1.15 O=C(N[O-])c1ccccc1 Amb18800075 [1,0,0,0,0,0|2,0,1]=4 770 B10R1.15 O=C(N[O-])c1ccccc1 Amb4035742 [1,0,0,0,0,0|2,0,1]=4 771 B10R1.15 O=CC(Cl)c1ccccc1 Amb18644699 [1,0,0,0,0,0|2,0,1]=4 772 B10R1.15 O=CC(F)c1ccccc1 Amb24117053 [1,0,0,0,0,0|2,0,1]=4 773 B10R1.15 O=CC(O)c1ccccc1 Amb17593446 [1,0,0,0,0,0|2,0,1]=4 774 B10R1.15 O=C[C@H](F)c1ccccc1 Amb27863823 [1,0,0,0,0,0|2,0,1]=4 775 B10R1.15 O=C[C@H](O)c1ccccc1 Amb28388660 [1,0,0,0,0,0|2,0,1]=4 776 B10R1.15 O=S(CF)c1ccccc1 Amb22723398 [1,0,0,0,0,0|3,0,0]=4 777 B10R1.15 O=S(CO)c1ccccc1 Amb27617047 [1,0,0,0,0,0|3,0,0]=4 778 B10R1.15 OC(CBr)c1ccccc1 Amb17206105 [1,0,0,0,0,0|2,0,0]=3 779 B10R1.15 OC(CBr)c1ccccn1 Amb27623201 [1,0,0,0,0,0|3,0,0]=4 780 B10R1.15 OC(CBr)c1ccncc1 Amb24099591 [1,0,0,0,0,0|3,0,0]=4 781 B10R1.15 OC(CCl)c1ccccc1 Amb9826903 [1,0,0,0,0,0|2,0,0]=3 782 B10R1.15 OC(CCl)c1ccccn1 Amb26455692 [1,0,0,0,0,0|3,0,0]=4 783 B10R1.15 OC(CCl)c1cccnc1 Amb3319284 [1,0,0,0,0,0|3,0,0]=4 784 B10R1.15 OC(CCl)c1ccncc1 Amb27470348 [1,0,0,0,0,0|3,0,0]=4 785 B10R1.15 OC(CF)c1ccccc1 Amb22731897 [1,0,0,0,0,0|2,0,0]=3 786 B10R1.15 OC(CF)c1ccccn1 Amb25136249 [1,0,0,0,0,0|3,0,0]=4 787 B10R1.15 OC(CF)c1cccnc1 Amb33360057 [1,0,0,0,0,0|3,0,0]=4 788 B10R1.15 OC(CF)c1ccncc1 Amb33380647 [1,0,0,0,0,0|3,0,0]=4 789 B10R1.15 OC(CI)c1ccccc1 Amb28073875 [1,0,0,0,0,0|2,0,0]=3 790 B10R1.15 OC(CS)c1ccccc1 Amb10608997 [1,0,0,0,0,0|2,0,0]=3 791 B10R1.15 OCC(Br)c1ccccc1 Amb27971765 [1,0,0,0,0,0|2,0,0]=3 792 B10R1.15 OCC(Cl)c1ccccc1 Amb27165767 [1,0,0,0,0,0|2,0,0]=3 793 B10R1.15 OCC(F)c1ccccc1 Amb24105399 [1,0,0,0,0,0|2,0,0]=3 794 B10R1.15 OCC(F)c1ccncc1 Amb28384557 [1,0,0,0,0,0|3,0,0]=4 795 B10R1.15 OCC(O)c1ccccc1 Amb4350706 [1,0,0,0,0,0|2,0,0]=3 796 B10R1.15 OCC(O)c1ccccn1 Amb4017599 [1,0,0,0,0,0|3,0,0]=4 797 B10R1.15 OCC(O)c1cccnc1 Amb23538717 [1,0,0,0,0,0|3,0,0]=4 798 B10R1.15 OCC(O)c1ccncc1 Amb23538718 [1,0,0,0,0,0|3,0,0]=4 799 B10R1.15 OCC(O)c1ccncc1 Amb32656243 [1,0,0,0,0,0|3,0,0]=4 800 B10R1.15 OCC(S)c1ccccc1 Amb25333535 [1,0,0,0,0,0|2,0,0]=3 801 B10R1.15 OC[C@@H](O)c1ccccc1 Amb8514912 [1,0,0,0,0,0|2,0,0]=3 802 B10R1.15 OC[C@@H](O)c1ccccn1 Amb26554033 [1,0,0,0,0,0|3,0,0]=4 803 B10R1.15 OC[C@@H](O)c1ccncc1 Amb28291407 [1,0,0,0,0,0|3,0,0]=4 804 B10R1.15 OC[C@H](Br)c1ccccc1 Amb27798351 [1,0,0,0,0,0|2,0,0]=3 805 B10R1.15 OC[C@H](Cl)c1ccccc1 Amb27659257 [1,0,0,0,0,0|2,0,0]=3 806 B10R1.15 OC[C@H](O)c1ccccc1 Amb8389336 [1,0,0,0,0,0|2,0,0]=3 807 B10R1.15 OC[C@H](O)c1ccccn1 Amb27838863 [1,0,0,0,0,0|3,0,0]=4 808 B10R1.15 OC[C@H](S)c1ccccc1 Amb28207325 [1,0,0,0,0,0|2,0,0]=3 809 B10R1.15 O[C@@H](CBr)c1ccccc1 Amb19929326 [1,0,0,0,0,0|2,0,0]=3 810 B10R1.15 O[C@@H](CBr)c1cccnc1 Amb27614899 [1,0,0,0,0,0|3,0,0]=4 811 B10R1.15 O[C@@H](CCl)c1ccccc1 Amb16231709 [1,0,0,0,0,0|2,0,0]=3 812 B10R1.15 O[C@@H](CCl)c1ccccn1 Amb28122883 [1,0,0,0,0,0|3,0,0]=4 813 B10R1.15 O[C@@H](CF)c1ccccc1 Amb24389146 [1,0,0,0,0,0|2,0,0]=3 814 B10R1.15 O[C@@H](CF)c1ccccn1 Amb27839237 [1,0,0,0,0,0|3,0,0]=4 815 B10R1.15 O[C@@H](CS)c1ccccc1 Amb27604413 [1,0,0,0,0,0|2,0,0]=3 816 B10R1.15 O[C@H](CBr)c1ccccc1 Amb19929329 [1,0,0,0,0,0|2,0,0]=3 817 B10R1.15 O[C@H](CCl)c1ccccc1 Amb8394082 [1,0,0,0,0,0|2,0,0]=3 818 B10R1.15 O[C@H](CCl)c1ccncc1 Amb27973641 [1,0,0,0,0,0|3,0,0]=4 819 B10R1.15 O[C@H](CF)c1ccccc1 Amb24437736 [1,0,0,0,0,0|2,0,0]=3 820 B10R1.15 O[C@H](CF)c1ccccn1 Amb27979963 [1,0,0,0,0,0|3,0,0]=4 821 B10R1.15 O[C@H](CS)c1ccccc1 Amb27494941 [1,0,0,0,0,0|2,0,0]=3 822 B10R1.15 S=C(CBr)c1ccccc1 Amb27755078 [1,0,0,0,0,0|2,0,1]=4 823 B10R1.15 [C-]#[N+]C(C)c1ccccc1 Amb2688979 [1,0,0,0,0,0|0,0,2]=3 824 B10R1.15 [C-]#[N+]C(C)c1cccnc1 Amb3973252 [1,0,0,0,0,0|1,0,2]=4 825 B10R1.15 [C-]#[N+]C(C)c1ccncc1 Amb2235825 [1,0,0,0,0,0|1,0,2]=4 826 B10R1.15 [C-]#[N+][C@@H](C)c1ccccc1 Amb2684311 [1,0,0,0,0,0|0,0,2]=3 827 B10R1.15 [C-]#[N+][C@H](C)c1ccccc1 Amb2684310 [1,0,0,0,0,0|0,0,2]=3 828 B10R1.15 [NH3+]CC(=O)c1ccccc1 Amb9787668 [1,0,0,0,0,0|1,0,2]=4 829 B10R1.17 BrCCCc1ccccc1 Amb2721516 [1,0,0,0,0,0|2,0,0]=3 830 B10R1.17 BrCCCc1ccccn1 Amb27866171 [1,0,0,0,0,0|3,0,0]=4 831 B10R1.17 BrCCCc1cccnc1 Amb1102301 [1,0,0,0,0,0|3,0,0]=4 832 B10R1.17 BrCCCc1cccnc1 Amb17610084 [1,0,0,0,0,0|3,0,0]=4 833 B10R1.17 BrCCCc1ccncc1 Amb32751195 [1,0,0,0,0,0|3,0,0]=4 834 B10R1.17 BrCCOc1ccccc1 Amb1152333 [1,0,0,0,0,0|3,0,0]=4 835 B10R1.17 BrCCSc1ccccc1 Amb6255409 [1,0,0,0,0,0|3,0,0]=4 836 B10R1.17 BrCOCc1ccccc1 Amb27410470 [1,0,0,0,0,0|3,0,0]=4 837 B10R1.17 Br[Mg]CCc1ccccc1 Amb22000585 [1,0,0,0,0,0|2,0,0]=3 838 B10R1.17 Br\C=C\Cc1ccccc1 Amb33134791 [1,0,0,0,0,0|2,0,1]=4 839 B10R1.17 C#CCCc1ccccc1 Amb6336492 [1,0,0,0,0,0|1,0,1]=3 840 B10R1.17 C#CCCc1ccccn1 Amb24571654 [1,0,0,0,0,0|2,0,1]=4 841 B10R1.17 C#CCCc1cccnc1 Amb24085226 [1,0,0,0,0,0|2,0,1]=4 842 B10R1.17 C#CCCc1ccncc1 Amb24091331 [1,0,0,0,0,0|2,0,1]=4 843 B10R1.17 C#CCOc1ccccc1 Amb839455 [1,0,0,0,0,0|2,0,1]=4 844 B10R1.17 C#CCSc1ccccc1 Amb3836098 [1,0,0,0,0,0|2,0,1]=4 845 B10R1.17 C=CCCc1ccccc1 Amb2721241 [1,0,0,0,0,0|1,0,1]=3 846 B10R1.17 C=CCCc1ccccn1 Amb25337662 [1,0,0,0,0,0|2,0,1]=4 847 B10R1.17 C=CCCc1cccnc1 Amb24477186 [1,0,0,0,0,0|2,0,1]=4 848 B10R1.17 C=CCNc1ccccc1 Amb2720315 [1,0,0,0,0,0|2,0,1]=4 849 B10R1.17 C=CCOc1ccccc1 Amb2842273 [1,0,0,0,0,0|2,0,1]=4 850 B10R1.17 C=CCSc1ccccc1 Amb3836099 [1,0,0,0,0,0|2,0,1]=4 851 B10R1.17 C=COCc1ccccc1 Amb17940722 [1,0,0,0,0,0|2,0,1]=4 852 B10R1.17 CC=C=Cc1ccccc1 Amb27435633 [1,0,0,0,0,0|1,0,2]=4 853 B10R1.17 CCCC[n+]1ccccc1 Amb8393211 [1,0,0,0,0,0|2,0,0]=3 854 B10R1.17 CCCC[n+]1ccccc1 Amb8516223 [1,0,0,0,0,0|2,0,0]=3 855 B10R1.17 CCCC[n+]1ccccc1 Amb8516227 [1,0,0,0,0,0|2,0,0]=3 856 B10R1.17 CCCC[n+]1ccccc1 Amb8516263 [1,0,0,0,0,0|2,0,0]=3 857 B10R1.17 CCCCc1ccccc1 Amb6608912 [1,0,0,0,0,0|1,0,0]=2 858 B10R1.17 CCCCc1ccccn1 Amb8395993 [1,0,0,0,0,0|2,0,0]=3 859 B10R1.17 CCCCc1cccnc1 Amb4037068 [1,0,0,0,0,0|2,0,0]=3 860 B10R1.17 CCCCc1cccnn1 Amb22235740 [1,0,0,0,0,0|3,0,0]=4 861 B10R1.17 CCCCc1ccncc1 Amb10555008 [1,0,0,0,0,0|2,0,0]=3 862 B10R1.17 CCCNc1ccccc1 Amb534130 [1,0,0,0,0,0|2,0,0]=3 863 B10R1.17 CCCNc1cccnc1 Amb6686632 [1,0,0,0,0,0|3,0,0]=4 864 B10R1.17 CCCNc1ccncc1 Amb6614447 [1,0,0,0,0,0|3,0,0]=4 865 B10R1.17 CCCOc1ccccc1 Amb2842271 [1,0,0,0,0,0|2,0,0]=3 866 B10R1.17 CCCSc1ccccc1 Amb4014460 [1,0,0,0,0,0|2,0,0]=3 867 B10R1.17 CCCSc1ccccn1 Amb24733306 [1,0,0,0,0,0|3,0,0]=4 868 B10R1.17 CCCSc1ccncc1 Amb28126322 [1,0,0,0,0,0|3,0,0]=4 869 B10R1.17 CCNCc1ccccc1 Amb3699539 [1,0,0,0,0,0|2,0,0]=3 870 B10R1.17 CCNCc1ccccn1 Amb2592098 [1,0,0,0,0,0|3,0,0]=4 871 B10R1.17 CCNCc1cccnc1 Amb21972163 [1,0,0,0,0,0|3,0,0]=4 872 B10R1.17 CCNCc1cccnc1 Amb837759 [1,0,0,0,0,0|3,0,0]=4 873 B10R1.17 CCNCc1ccncc1 Amb1214646 [1,0,0,0,0,0|3,0,0]=4 874 B10R1.17 CCOCc1ccccc1 Amb9787555 [1,0,0,0,0,0|2,0,0]=3 875 B10R1.17 CCOCc1ccccn1 Amb27267027 [1,0,0,0,0,0|3,0,0]=4 876 B10R1.17 CCOCc1ccncc1 Amb27255285 [1,0,0,0,0,0|3,0,0]=4 877 B10R1.17 CCOSc1ccccc1 Amb28049338 [1,0,0,0,0,0|3,0,0]=4 878 B10R1.17 CCSCc1ccccc1 Amb9787636 [1,0,0,0,0,0|2,0,0]=3 879 B10R1.17 CCSCc1ccccn1 Amb28124640 [1,0,0,0,0,0|3,0,0]=4 880 B10R1.17 CCSCc1cccnc1 Amb26909883 [1,0,0,0,0,0|3,0,0]=4 881 B10R1.17 CCSSc1ccccc1 Amb28057163 [1,0,0,0,0,0|3,0,0]=4 882 B10R1.17 CC\C=C\c1ccccc1 Amb17673826 [1,0,0,0,0,0|1,0,2]=4 883 B10R1.17 CC\N=C\c1ccccc1 Amb10558476 [1,0,0,0,0,0|2,0,1]=4 884 B10R1.17 CN=C=Cc1ccccc1 Amb27423885 [1,0,0,0,0,0|0,0,3]=4 885 B10R1.17 CNC#Cc1ccccc1 Amb28422275 [1,0,0,0,0,0|0,0,2]=3 886 B10R1.17 CNCCc1ccccc1 Amb1132990 [1,0,0,0,0,0|0,0,0]=1 887 B10R1.17 CNCCc1ccccc1 Amb33545919 [1,0,0,0,0,0|0,0,0]=1 888 B10R1.17 CNCCc1ccccn1 Amb1651624 [1,0,0,0,0,0|1,0,0]=2 889 B10R1.17 CNCCc1ccccn1 Amb22167479 [1,0,0,0,0,0|1,0,0]=2 890 B10R1.17 CNCCc1ccccn1 Amb6741463 [1,0,0,0,0,0|1,0,0]=2 891 B10R1.17 CNCCc1cccnc1 Amb10068754 [1,0,0,0,0,0|1,0,0]=2 892 B10R1.17 CNCCc1cccnc1 Amb10576410 [1,0,0,0,0,0|1,0,0]=2 893 B10R1.17 CNCCc1ccncc1 Amb10071184 [1,0,0,0,0,0|1,0,0]=2 894 B10R1.17 CNCCc1ccncc1 Amb19958269 [1,0,0,0,0,0|1,0,0]=2 895 B10R1.17 CNCCc1ccncc1 Amb2592519 [1,0,0,0,0,0|1,0,0]=2 896 B10R1.17 CNCCc1ccncn1 Amb8010524 [1,0,0,0,0,0|2,0,0]=3 897 B10R1.17 CNCCc1cnccn1 Amb22059364 [1,0,0,0,0,0|2,0,0]=3 898 B10R1.17 CNCCc1cncnc1 Amb8010527 [1,0,0,0,0,0|2,0,0]=3 899 B10R1.17 CNCCc1cncnn1 Amb27848609 [1,0,0,0,0,0|3,0,0]=4 900 B10R1.17 CNCCc1ncccn1 Amb31156561 [1,0,0,0,0,0|2,0,0]=3 901 B10R1.17 CNCCc1ncccn1 Amb8010522 [1,0,0,0,0,0|2,0,0]=3 902 B10R1.17 CNCCc1nccnn1 Amb18224135 [1,0,0,0,0,0|3,0,0]=4 903 B10R1.17 CNCCc1ncncn1 Amb18861081 [1,0,0,0,0,0|3,0,0]=4 904 B10R1.17 CNNCc1ccccc1 Amb26859422 [1,0,0,0,0,0|1,0,0]=2 905 B10R1.17 CNNCc1ccccc1 Amb33328543 [1,0,0,0,0,0|1,0,0]=2 906 B10R1.17 CNNCc1ccccn1 Amb26421896 [1,0,0,0,0,0|2,0,0]=3 907 B10R1.17 CNNCc1cccnc1 Amb24558769 [1,0,0,0,0,0|2,0,0]=3 908 B10R1.17 CNOCc1ccccc1 Amb22059601 [1,0,0,0,0,0|1,0,0]=2 909 B10R1.17 CNOCc1ccccc1 Amb32412803 [1,0,0,0,0,0|1,0,0]=2 910 B10R1.17 CN\C=N\c1cccnc1 Amb24671021 [1,0,0,0,0,0|2,0,1]=4 911 B10R1.17 CN\N=C\c1ccccc1 Amb17867553 [1,0,0,0,0,0|1,0,1]=3 912 B10R1.17 CN\N=C\c1cccnc1 Amb28049739 [1,0,0,0,0,0|2,0,1]=4 913 B10R1.17 CN\N=N\c1ccccc1 Amb25720206 [1,0,0,0,0,0|2,0,0]=3 914 B10R1.17 COCC[n+]1ccccc1 Amb28125435 [1,0,0,0,0,0|2,0,0]=3 915 B10R1.17 COCCc1ccccc1 Amb4020014 [1,0,0,0,0,0|1,0,0]=2 916 B10R1.17 COCCc1ccccn1 Amb4034583 [1,0,0,0,0,0|2,0,0]=3 917 B10R1.17 COCCc1ccncc1 Amb26565974 [1,0,0,0,0,0|2,0,0]=3 918 B10R1.17 COCOc1ccccc1 Amb2608594 [1,0,0,0,0,0|2,0,0]=3 919 B10R1.17 COCOc1ccccn1 Amb27757113 [1,0,0,0,0,0|3,0,0]=4 920 B10R1.17 CONCc1ccccc1 Amb26432339 [1,0,0,0,0,0|2,0,0]=3 921 B10R1.17 CO\C=C\c1ccccc1 Amb22002452 [1,0,0,0,0,0|1,0,2]=4 922 B10R1.17 CO\C=N\c1ccccc1 Amb6297410 [1,0,0,0,0,0|2,0,1]=4 923 B10R1.17 CSCCc1ccccc1 Amb26586093 [1,0,0,0,0,0|1,0,0]=2 924 B10R1.17 CSCCc1ccccn1 Amb24552366 [1,0,0,0,0,0|2,0,0]=3 925 B10R1.17 CSCNc1ccccc1 Amb25992690 [1,0,0,0,0,0|2,0,0]=3 926 B10R1.17 CSCNc1ccccn1 Amb27972069 [1,0,0,0,0,0|3,0,0]=4 927 B10R1.17 CSCOc1ccccc1 Amb22231357 [1,0,0,0,0,0|2,0,0]=3 928 B10R1.17 CSCOc1ccccn1 Amb27256230 [1,0,0,0,0,0|3,0,0]=4 929 B10R1.17 CS\C=C\c1ccccc1 Amb27654244 [1,0,0,0,0,0|1,0,2]=4 930 B10R1.17 C\C=C/Cc1cccnc1 Amb27470932 [1,0,0,0,0,0|2,0,1]=4 931 B10R1.17 C\C=C\Cc1ccccc1 Amb4035140 [1,0,0,0,0,0|1,0,1]=3 932 B10R1.17 C\C=C\Sc1ccccc1 Amb24665698 [1,0,0,0,0,0|2,0,1]=4 933 B10R1.17 C\C=N\Nc1ccccc1 Amb27788878 [1,0,0,0,0,0|3,0,0]=4 934 B10R1.17 ClCCCc1ccccc1 Amb3941487 [1,0,0,0,0,0|2,0,0]=3 935 B10R1.17 ClCCCc1ccccn1 Amb32751196 [1,0,0,0,0,0|3,0,0]=4 936 B10R1.17 ClCCCc1cccnc1 Amb17477795 [1,0,0,0,0,0|3,0,0]=4 937 B10R1.17 ClCCCc1cccnc1 Amb32665795 [1,0,0,0,0,0|3,0,0]=4 938 B10R1.17 ClCCCc1ccncc1 Amb17477794 [1,0,0,0,0,0|3,0,0]=4 939 B10R1.17 ClCCNc1ccccc1 Amb17334388 [1,0,0,0,0,0|3,0,0]=4 940 B10R1.17 ClCCOc1ccccc1 Amb3940573 [1,0,0,0,0,0|3,0,0]=4 941 B10R1.17 ClCCSc1ccccc1 Amb2685910 [1,0,0,0,0,0|3,0,0]=4 942 B10R1.17 ClCOCc1ccccc1 Amb2684626 [1,0,0,0,0,0|3,0,0]=4 943 B10R1.17 ClCSCc1ccccc1 Amb16231183 [1,0,0,0,0,0|3,0,0]=4 944 B10R1.17 FCCNc1ccccc1 Amb26349791 [1,0,0,0,0,0|3,0,0]=4 945 B10R1.17 ICCCc1ccccc1 Amb10605506 [1,0,0,0,0,0|2,0,0]=3 946 B10R1.17 ICCOc1ccccc1 Amb10608588 [1,0,0,0,0,0|3,0,0]=4 947 B10R1.17 ICCSc1ccccc1 Amb27458209 [1,0,0,0,0,0|3,0,0]=4 948 B10R1.17 ICOCc1ccccc1 Amb28348666 [1,0,0,0,0,0|3,0,0]=4 949 B10R1.17 N#CCC[n+]1ccccc1 Amb28458262 [1,0,0,0,0,0|3,0,0]=4 950 B10R1.17 N#CCCc1ccccc1 Amb33551192 [1,0,0,0,0,0|2,0,0]=3 951 B10R1.17 N#CCCc1ccccn1 Amb1102488 [1,0,0,0,0,0|3,0,0]=4 952 B10R1.17 N#CCCc1cccnc1 Amb10605345 [1,0,0,0,0,0|3,0,0]=4 953 B10R1.17 N#CCCc1ccncc1 Amb2694189 [1,0,0,0,0,0|3,0,0]=4 954 B10R1.17 N#CCNc1ccccc1 Amb1651088 [1,0,0,0,0,0|3,0,0]=4 955 B10R1.17 N#CCOc1ccccc1 Amb2725206 [1,0,0,0,0,0|3,0,0]=4 956 B10R1.17 N#CCSc1ccccc1 Amb2690327 [1,0,0,0,0,0|3,0,0]=4 957 B10R1.17 N#CNCc1ccccc1 Amb27257452 [1,0,0,0,0,0|3,0,0]=4 958 B10R1.17 N#CSCc1ccccc1 Amb2611897 [1,0,0,0,0,0|3,0,0]=4 959 B10R1.17 NCCCc1ccccc1 Amb844788 [1,0,0,0,0,0|2,0,0]=3 960 B10R1.17 NCCCc1ccccn1 Amb1088884 [1,0,0,0,0,0|3,0,0]=4 961 B10R1.17 NCCCc1ccccn1 Amb21954278 [1,0,0,0,0,0|3,0,0]=4 962 B10R1.17 NCCCc1cccnc1 Amb18363942 [1,0,0,0,0,0|3,0,0]=4 963 B10R1.17 NCCCc1cccnc1 Amb31188323 [1,0,0,0,0,0|3,0,0]=4 964 B10R1.17 NCCCc1cccnc1 Amb5735475 [1,0,0,0,0,0|3,0,0]=4 965 B10R1.17 NCCCc1ccncc1 Amb22490382 [1,0,0,0,0,0|3,0,0]=4 966 B10R1.17 NCCCc1ccncc1 Amb24099592 [1,0,0,0,0,0|3,0,0]=4 967 B10R1.17 NCCCc1ccncc1 Amb33535434 [1,0,0,0,0,0|3,0,0]=4 968 B10R1.17 NCCNc1ccccc1 Amb23412206 [1,0,0,0,0,0|3,0,0]=4 969 B10R1.17 NCCNc1ccccc1 Amb2720312 [1,0,0,0,0,0|3,0,0]=4 970 B10R1.17 NCCOc1ccccc1 Amb1214559 [1,0,0,0,0,0|3,0,0]=4 971 B10R1.17 NCCOc1ccccc1 Amb2099529 [1,0,0,0,0,0|3,0,0]=4 972 B10R1.17 NCCSc1ccccc1 Amb6374305 [1,0,0,0,0,0|3,0,0]=4 973 B10R1.17 NCCSc1ccccc1 Amb6827055 [1,0,0,0,0,0|3,0,0]=4 974 B10R1.17 NNCCc1ccccc1 Amb10608987 [1,0,0,0,0,0|1,0,0]=2 975 B10R1.17 NNCCc1ccccc1 Amb1117029 [1,0,0,0,0,0|1,0,0]=2 976 B10R1.17 NNCCc1ccccc1 Amb33552804 [1,0,0,0,0,0|1,0,0]=2 977 B10R1.17 NNCCc1ccccn1 Amb20669588 [1,0,0,0,0,0|2,0,0]=3 978 B10R1.17 NNCCc1ccccn1 Amb33528741 [1,0,0,0,0,0|2,0,0]=3 979 B10R1.17 NNCCc1ccncc1 Amb6248763 [1,0,0,0,0,0|2,0,0]=3 980 B10R1.17 NNCCc1cnccn1 Amb35695639 [1,0,0,0,0,0|3,0,0]=4 981 B10R1.17 NOCCc1ccccc1 Amb2899735 [1,0,0,0,0,0|2,0,0]=3 982 B10R1.17 NOCCc1ccccc1 Amb6308543 [1,0,0,0,0,0|2,0,0]=3 983 B10R1.17 NOCCc1ccccn1 Amb17231907 [1,0,0,0,0,0|3,0,0]=4 984 B10R1.17 NOCCc1cccnc1 Amb25779030 [1,0,0,0,0,0|3,0,0]=4 985 B10R1.17 NOCCc1ccncc1 Amb17231908 [1,0,0,0,0,0|3,0,0]=4 986 B10R1.17 O=C=NCc1ccccc1 Amb3939117 [1,0,0,0,0,0|3,0,0]=4 987 B10R1.17 O=CCCc1ccccc1 Amb2720576 [1,0,0,0,0,0|2,0,0]=3 988 B10R1.17 O=CCCc1ccccn1 Amb17081674 [1,0,0,0,0,0|3,0,0]=4 989 B10R1.17 O=CCCc1cccnc1 Amb17081675 [1,0,0,0,0,0|3,0,0]=4 990 B10R1.17 O=CCCc1ccncc1 Amb8388451 [1,0,0,0,0,0|3,0,0]=4 991 B10R1.17 O=CCOc1ccccc1 Amb3465095 [1,0,0,0,0,0|3,0,0]=4 992 B10R1.17 O=CCSc1ccccc1 Amb17082903 [1,0,0,0,0,0|3,0,0]=4 993 B10R1.17 O=CNCc1ccccc1 Amb1916036 [1,0,0,0,0,0|3,0,0]=4 994 B10R1.17 O=COCc1ccccc1 Amb4605893 [1,0,0,0,0,0|3,0,0]=4 995 B10R1.17 O=C[CH]Cc1ccccc1 Amb34916523 [1,0,0,0,0,0|2,0,1]=4 996 B10R1.17 OCCCc1ccccc1 Amb3939054 [1,0,0,0,0,0|2,0,0]=3 997 B10R1.17 OCCCc1ccccn1 Amb22749323 [1,0,0,0,0,0|3,0,0]=4 998 B10R1.17 OCCCc1ccccn1 Amb3939333 [1,0,0,0,0,0|3,0,0]=4 999 B10R1.17 OCCCc1cccnc1 Amb2694598 [1,0,0,0,0,0|3,0,0]=4 1000 B10R1.17 OCCCc1cccnc1 Amb33623848 [1,0,0,0,0,0|3,0,0]=4 1001 B10R1.17 OCCCc1ccncc1 Amb3650114 [1,0,0,0,0,0|3,0,0]=4 1002 B10R1.17 OCCNc1ccccc1 Amb3940335 [1,0,0,0,0,0|3,0,0]=4 1003 B10R1.17 OCCOc1ccccc1 Amb2209344 [1,0,0,0,0,0|3,0,0]=4 1004 B10R1.17 OCOCc1ccccc1 Amb25727798 [1,0,0,0,0,0|3,0,0]=4 1005 B10R1.17 OCSCc1ccccc1 Amb27839241 [1,0,0,0,0,0|3,0,0]=4 1006 B10R1.17 ONCCc1ccccc1 Amb33544180 [1,0,0,0,0,0|1,0,0]=2 1007 B10R1.17 O\N=C\Cc1ccccc1 Amb31275669 [1,0,0,0,0,0|1,0,2]=4 1008 B10R1.17 S=C=NCc1ccccc1 Amb1102095 [1,0,0,0,0,0|3,0,0]=4 1009 B10R1.17 SCCCc1ccccc1 Amb6255807 [1,0,0,0,0,0|2,0,0]=3 1010 B10R1.17 SCCCc1ccccn1 Amb17399950 [1,0,0,0,0,0|3,0,0]=4 1011 B10R1.17 SCCCc1cccnc1 Amb17399951 [1,0,0,0,0,0|3,0,0]=4 1012 B10R1.17 SCCCc1ccncc1 Amb17399952 [1,0,0,0,0,0|3,0,0]=4 1013 B10R1.17 SCCOc1ccccc1 Amb2794986 [1,0,0,0,0,0|3,0,0]=4 1014 B10R1.17 SCCSc1ccccc1 Amb13881734 [1,0,0,0,0,0|3,0,0]=4 1015 B10R1.17 [C-]#[N+]CCc1ccccc1 Amb1981030 [1,0,0,0,0,0|0,0,2]=3 1016 B10R1.17 [C-]#[N+]CCc1ccccn1 Amb5456295 [1,0,0,0,0,0|1,0,2]=4 1017 B10R1.17 [C-]#[N+]CCc1cccnc1 Amb33429418 [1,0,0,0,0,0|1,0,2]=4 1018 B10R1.17 [C-]#[N+]CCc1ccncc1 Amb2235948 [1,0,0,0,0,0|1,0,2]=4 1019 B10R1.17 [N-]=[N+]=NCc1ccccc1 Amb2721052 [1,0,0,0,0,0|2,0,1]=4 1020 B10R1.17 [SiH3]CCCc1ccccc1 Amb22347053 [1,0,0,0,0,0|1,1,0]=3 1021 B12R1.3 C#CCC(CO)c1ccccc1 Amb27662159 [0,1,0,0,0,0|1,0,1]=3 1022 B12R1.3 C#CCC(NC)c1ccccc1 Amb18800161 [0,1,0,0,0,0|1,0,1]=3 1023 B12R1.3 C#CCC(NC)c1ccccc1 Amb19514703 [0,1,0,0,0,0|1,0,1]=3 1024 B12R1.3 C#CCC(NN)c1ccccc1 Amb27587660 [0,1,0,0,0,0|2,0,1]=4 1025 B12R1.3 C=CCC(C#N)c1ccccc1 Amb17593937 [0,1,0,0,0,0|1,0,2]=4 1026 B12R1.3 C=CCC(C=O)c1ccccc1 Amb18645372 [0,1,0,0,0,0|1,0,2]=4 1027 B12R1.3 C=CCC(CBr)c1ccccc1 Amb32688906 [0,1,0,0,0,0|1,0,1]=3 1028 B12R1.3 C=CCC(CCl)c1ccccc1 Amb32688904 [0,1,0,0,0,0|1,0,1]=3 1029 B12R1.3 C=CCC(CN)c1ccccc1 Amb18126304 [0,1,0,0,0,0|1,0,1]=3 1030 B12R1.3 C=CCC(CO)c1ccccc1 Amb32665506 [0,1,0,0,0,0|1,0,1]=3 1031 B12R1.3 CC=C=C(CO)c1ccccc1 Amb27978491 [0,1,0,0,0,0|1,0,2]=4 1032 B12R1.3 CCC(CCN)c1ccccc1 Amb5739026 [0,1,0,0,0,0|2,0,0]=3 1033 B12R1.3 CCC(CCO)c1ccccc1 Amb17232488 [0,1,0,0,0,0|2,0,0]=3 1034 B12R1.3 CCC(CNC)c1ccccc1 Amb8841502 [0,1,0,0,0,0|0,0,0]=1 1035 B12R1.3 CCC(N=C=O)c1ccccc1 Amb33529216 [0,1,0,0,0,0|3,0,0]=4 1036 B12R1.3 CCC(NC=O)c1ccccc1 Amb27781012 [0,1,0,0,0,0|3,0,0]=4 1037 B12R1.3 CCC(\C=C\Br)c1ccccc1 Amb33135174 [0,1,0,0,0,0|2,0,1]=4 1038 B12R1.3 CCC(\C=N\N)c1ccccc1 Amb27607282 [0,1,0,0,0,0|1,0,2]=4 1039 B12R1.3 CCCC(C#N)c1ccccc1 Amb2720802 [0,1,0,0,0,0|1,0,1]=3 1040 B12R1.3 CCCC(C#N)c1ccccn1 Amb18645394 [0,1,0,0,0,0|2,0,1]=4 1041 B12R1.3 CCCC(C=O)c1ccccc1 Amb17594046 [0,1,0,0,0,0|1,0,1]=3 1042 B12R1.3 CCCC(CBr)c1ccccc1 Amb17247626 [0,1,0,0,0,0|1,0,0]=2 1043 B12R1.3 CCCC(CC)c1ccccc1 Amb9787575 [0,1,0,0,0,0|1,0,0]=2 1044 B12R1.3 CCCC(CCl)c1ccccc1 Amb17233968 [0,1,0,0,0,0|1,0,0]=2 1045 B12R1.3 CCCC(CN)c1ccccc1 Amb8950183 [0,1,0,0,0,0|1,0,0]=2 1046 B12R1.3 CCCC(CO)c1ccccc1 Amb17232487 [0,1,0,0,0,0|1,0,0]=2 1047 B12R1.3 CCCC(NC)c1ccccn1 Amb18792590 [0,1,0,0,0,0|2,0,0]=3 1048 B12R1.3 CCCC(NC)c1cccnc1 Amb18792591 [0,1,0,0,0,0|2,0,0]=3 1049 B12R1.3 CCCN(C#N)c1ccccc1 Amb27434318 [0,1,0,0,0,0|2,0,1]=4 1050 B12R1.3 CCC\C(=N\N)c1ccccc1 Amb27649935 [0,1,0,0,0,0|2,0,1]=4 1051 B12R1.3 CCC\C(=N\O)c1ccccc1 Amb27979178 [0,1,0,0,0,0|2,0,1]=4 1052 B12R1.3 CCN(CCCl)c1ccccc1 Amb8392941 [0,1,0,0,0,0|3,0,0]=4 1053 B12R1.3 CCN(CCN)c1ccccc1 Amb1136918 [0,1,0,0,0,0|3,0,0]=4 1054 B12R1.3 CCN(CCN)c1ccccc1 Amb33266057 [0,1,0,0,0,0|3,0,0]=4 1055 B12R1.3 CCN(CCO)c1ccccc1 Amb1208392 [0,1,0,0,0,0|3,0,0]=4 1056 B12R1.3 CCN(CCS)c1ccccc1 Amb13881733 [0,1,0,0,0,0|3,0,0]=4 1057 B12R1.3 CCNC(C#N)c1ccccc1 Amb22736556 [0,1,0,0,0,0|2,0,1]=4 1058 B12R1.3 CCNC(C#N)c1ccccc1 Amb7761469 [0,1,0,0,0,0|2,0,1]=4 1059 B12R1.3 CCNC(CC)c1ccccc1 Amb9721097 [0,1,0,0,0,0|2,0,0]=3 1060 B12R1.3 CCNC(CC)c1ccncc1 Amb19003595 [0,1,0,0,0,0|3,0,0]=4 1061 B12R1.3 CCNC(CO)c1ccccc1 Amb6739961 [0,1,0,0,0,0|2,0,0]=3 1062 B12R1.3 CCNC(CO)c1ccccn1 Amb15692071 [0,1,0,0,0,0|3,0,0]=4 1063 B12R1.3 CCN[C@@H](CO)c1ccccc1 Amb22745949 [0,1,0,0,0,0|2,0,0]=3 1064 B12R1.3 CCN\C(=N\C)c1ccccc1 Amb26858373 [0,1,0,0,0,0|2,0,1]=4 1065 B12R1.3 CCOC(C#N)c1ccccc1 Amb27828457 [0,1,0,0,0,0|2,0,1]=4 1066 B12R1.3 CCOC(CBr)c1ccccc1 Amb33348513 [0,1,0,0,0,0|2,0,0]=3 1067 B12R1.3 CCOC(CI)c1ccccc1 Amb33349128 [0,1,0,0,0,0|2,0,0]=3 1068 B12R1.3 CCOC(CN)c1ccccc1 Amb17605997 [0,1,0,0,0,0|2,0,0]=3 1069 B12R1.3 CCOC(CN)c1ccccc1 Amb33447126 [0,1,0,0,0,0|2,0,0]=3 1070 B12R1.3 CC[C@@H](N=C=O)c1ccccc1 Amb6357913 [0,1,0,0,0,0|3,0,0]=4 1071 B12R1.3 CC[C@@H](N=C=S)c1ccccc1 Amb6357840 [0,1,0,0,0,0|3,0,0]=4 1072 B12R1.3 CC[C@@H](NC=S)c1ccccc1 Amb27598041 [0,1,0,0,0,0|3,0,0]=4 1073 B12R1.3 CC[C@H](N=C=O)c1ccccc1 Amb22045308 [0,1,0,0,0,0|3,0,0]=4 1074 B12R1.3 CC[C@H](N=C=S)c1ccccc1 Amb22045322 [0,1,0,0,0,0|3,0,0]=4 1075 B12R1.3 CC[C@H](NC#N)c1ccccc1 Amb27801348 [0,1,0,0,0,0|3,0,0]=4 1076 B12R1.3 CC[C@H](NC=O)c1ccccc1 Amb27643444 [0,1,0,0,0,0|3,0,0]=4 1077 B12R1.3 CC\C(=N\NC)c1ccccc1 Amb27757106 [0,1,0,0,0,0|1,0,1]=3 1078 B12R1.3 CNC(CC#N)c1ccccc1 Amb18997456 [0,1,0,0,0,0|2,0,0]=3 1079 B12R1.3 CNC(CCO)c1ccccc1 Amb18563697 [0,1,0,0,0,0|2,0,0]=3 1080 B12R1.3 CNC(COC)c1ccccn1 Amb10607923 [0,1,0,0,0,0|2,0,0]=3 1081 B12R1.3 CNCC(OC)c1ccccc1 Amb17605856 [0,1,0,0,0,0|0,0,0]=1 1082 B12R1.3 CN\C(=N\OC)c1ccccc1 Amb24519522 [0,1,0,0,0,0|2,0,1]=4 1083 B12R1.3 CN\C=C(\C#N)c1ccccc1 Amb27211595 [0,1,0,0,0,0|0,0,3]=4 1084 B12R1.3 COC(CCN)c1ccccc1 Amb17334641 [0,1,0,0,0,0|2,0,0]=3 1085 B12R1.3 COC(N=[N+]=[N-])c1ccccc1 Amb28143658 [0,1,0,0,0,0|2,0,1]=4 1086 B12R1.3 COCC(CBr)c1ccccc1 Amb32688366 [0,1,0,0,0,0|1,0,0]=2 1087 B12R1.3 COCC(CCl)c1ccccc1 Amb32688364 [0,1,0,0,0,0|1,0,0]=2 1088 B12R1.3 COC\C(=N\O)c1ccccc1 Amb27770752 [0,1,0,0,0,0|2,0,1]=4 1089 B12R1.3 CSC(CC#N)c1ccccc1 Amb18804687 [0,1,0,0,0,0|2,0,0]=3 1090 B12R1.3 CSCC(C#N)c1ccccc1 Amb27828366 [0,1,0,0,0,0|1,0,1]=3 1091 B12R1.3 CSC\C(=N\N)c1ccccc1 Amb28316277 [0,1,0,0,0,0|2,0,1]=4 1092 B12R1.3 CS\C=C(\CO)c1ccccc1 Amb27831038 [0,1,0,0,0,0|1,0,2]=4 1093 B12R1.3 N#CC(CCO)c1ccccc1 Amb17334526 [0,1,0,0,0,0|2,0,1]=4 1094 B12R1.3 N#CCC(C#N)c1ccccc1 Amb6335802 [0,1,0,0,0,0|2,0,1]=4 1095 B12R1.3 N#CCC(CO)c1ccccc1 Amb27172827 [0,1,0,0,0,0|2,0,0]=3 1096 B12R1.3 N#CN[C@@H](CO)c1ccccc1 Amb27753887 [0,1,0,0,0,0|3,0,0]=4 1097 B12R1.3 NCC(CCO)c1ccccc1 Amb5494015 [0,1,0,0,0,0|2,0,0]=3 1098 B12R1.3 NCC(CCO)c1cccnc1 Amb17232607 [0,1,0,0,0,0|3,0,0]=4 1099 B12R1.3 NCC(CCO)c1ccncc1 Amb35789216 [0,1,0,0,0,0|3,0,0]=4 1100 B12R1.3 NCC(CCO)c1ccncc1 Amb35789737 [0,1,0,0,0,0|3,0,0]=4 1101 B12R1.3 NCCC(CN)c1ccccc1 Amb1111605 [0,1,0,0,0,0|2,0,0]=3 1102 B12R1.3 NCCC(CN)c1cccnc1 Amb17232561 [0,1,0,0,0,0|3,0,0]=4 1103 B12R1.3 NNC\C(=C/F)c1ccccc1 Amb8391753 [0,1,0,0,0,0|1,0,2]=4 1104 B12R1.3 O=C=NC(CF)c1ccccc1 Amb27635600 [0,1,0,0,0,0|3,0,0]=4 1105 B12R1.3 O=C=NC(CO)c1ccccc1 Amb27596918 [0,1,0,0,0,0|3,0,0]=4 1106 B12R1.3 [C-]#[N+]\C(=C\NC)c1ccccc1 Amb26078141 [0,1,0,0,0,0|0,0,3]=4 1107 B12R1.3 [N-]=[N+]=NC(CBr)c1ccccc1 Amb27399609 [0,1,0,0,0,0|2,0,1]=4 1108 B12R1.3 [N-]=[N+]=NC(CO)c1ccccc1 Amb25806192 [0,1,0,0,0,0|2,0,1]=4 1109 B12R1.3 [N-]=[N+]=N[C@@H](CO)c1ccccc1 Amb25772941 [0,1,0,0,0,0|2,0,1]=4 1110 B12R1.16 C#CCC(C)c1ccc(F)cc1 Amb33273767 [0,1,0,0,0,0|1,0,1]=3 1111 B12R1.16 C#CCC(N)c1ccc(Br)cc1 Amb27809629 [0,1,0,0,0,0|2,0,1]=4 1112 B12R1.16 C#CCC(N)c1ccc(Cl)cc1 Amb18809277 [0,1,0,0,0,0|2,0,1]=4 1113 B12R1.16 C#CCC(N)c1ccc(I)cc1 Amb27871167 [0,1,0,0,0,0|2,0,1]=4 1114 B12R1.16 C#CCC(O)c1ccc(O)cc1 Amb18117920 [0,1,0,0,0,0|2,0,1]=4 1115 B12R1.16 C#CC[C@@H](O)c1ccc(Cl)cc1 Amb27770776 [0,1,0,0,0,0|2,0,1]=4 1116 B12R1.16 C#CC[C@H](N)c1ccc(C)cc1 Amb27486382 [0,1,0,0,0,0|2,0,1]=4 1117 B12R1.16 C=C(CCC)c1ccc(C)cc1 Amb27639357 [0,1,0,0,0,0|1,0,2]=4 1118 B12R1.16 C=CCC(C)c1ccc(C)cc1 Amb24556400 [0,1,0,0,0,0|1,0,1]=3 1119 B12R1.16 C=CCC(C)c1ccc(O)cc1 Amb27614507 [0,1,0,0,0,0|1,0,1]=3 1120 B12R1.16 C=CCC(N)c1ccc(F)cc1 Amb18977583 [0,1,0,0,0,0|2,0,1]=4 1121 B12R1.16 C=CCC(N)c1ccc(I)cc1 Amb27229949 [0,1,0,0,0,0|2,0,1]=4 1122 B12R1.16 C=CCC(O)c1ccc(Br)cc1 Amb2685397 [0,1,0,0,0,0|2,0,1]=4 1123 B12R1.16 C=CCC(O)c1ccc(C)cc1 Amb18177785 [0,1,0,0,0,0|2,0,1]=4 1124 B12R1.16 C=CCC(O)c1ccc(Cl)cc1 Amb2686332 [0,1,0,0,0,0|2,0,1]=4 1125 B12R1.16 C=CCC(O)c1ccc(F)cc1 Amb18788452 [0,1,0,0,0,0|2,0,1]=4 1126 B12R1.16 C=CCC(O)c1ccc(N)cc1 Amb27955305 [0,1,0,0,0,0|2,0,1]=4 1127 B12R1.16 C=CCN(C)c1ccc(C)cc1 Amb28064452 [0,1,0,0,0,0|2,0,1]=4 1128 B12R1.16 C=CCN(C)c1ccc(N)cc1 Amb27434700 [0,1,0,0,0,0|2,0,1]=4 1129 B12R1.16 C=CC[C@@H](N)c1ccc(Br)cc1 Amb22831742 [0,1,0,0,0,0|2,0,1]=4 1130 B12R1.16 C=CC[C@@H](N)c1ccc(C)cc1 Amb27468576 [0,1,0,0,0,0|2,0,1]=4 1131 B12R1.16 C=CC[C@@H](N)c1ccc(F)cc1 Amb23440406 [0,1,0,0,0,0|2,0,1]=4 1132 B12R1.16 C=CC[C@@H](N)c1ccc(N)cc1 Amb27468664 [0,1,0,0,0,0|2,0,1]=4 1133 B12R1.16 C=CC[C@@H](O)c1ccc(Br)cc1 Amb28457059 [0,1,0,0,0,0|2,0,1]=4 1134 B12R1.16 C=CC[C@@H](O)c1ccc(C)cc1 Amb28142668 [0,1,0,0,0,0|2,0,1]=4 1135 B12R1.16 C=CC[C@@H](O)c1ccc(Cl)cc1 Amb27193055 [0,1,0,0,0,0|2,0,1]=4 1136 B12R1.16 C=CC[C@@H](O)c1ccc(F)cc1 Amb28255493 [0,1,0,0,0,0|2,0,1]=4 1137 B12R1.16 C=CC[C@H](N)c1ccc(F)cc1 Amb26841094 [0,1,0,0,0,0|2,0,1]=4 1138 B12R1.16 C=CC[C@H](N)c1ccc(N)cc1 Amb27639872 [0,1,0,0,0,0|2,0,1]=4 1139 B12R1.16 C=CC[C@H](N)c1ccc(S)cc1 Amb27461406 [0,1,0,0,0,0|2,0,1]=4 1140 B12R1.16 C=CC[C@H](O)c1ccc(C)cc1 Amb8392357 [0,1,0,0,0,0|2,0,1]=4 1141 B12R1.16 C=CC[C@H](O)c1ccc(F)cc1 Amb8392359 [0,1,0,0,0,0|2,0,1]=4 1142 B12R1.16 CC#CC(O)c1ccc(C)cc1 Amb28244315 [0,1,0,0,0,0|2,0,1]=4 1143 B12R1.16 CC(CC#N)c1ccc(Br)cc1 Amb25794629 [0,1,0,0,0,0|2,0,0]=3 1144 B12R1.16 CC(CC#N)c1ccc(Cl)cc1 Amb26539908 [0,1,0,0,0,0|2,0,0]=3 1145 B12R1.16 CC(CC#N)c1ccc(F)cc1 Amb27207006 [0,1,0,0,0,0|2,0,0]=3 1146 B12R1.16 CC(CC#N)c1ccc(O)cc1 Amb28243902 [0,1,0,0,0,0|2,0,0]=3 1147 B12R1.16 CC(CC=O)c1ccc(F)cc1 Amb27827352 [0,1,0,0,0,0|2,0,0]=3 1148 B12R1.16 CC(CC=O)c1ccc(I)cc1 Amb27416593 [0,1,0,0,0,0|2,0,0]=3 1149 B12R1.16 CC(CCBr)c1ccc(Cl)cc1 Amb17259616 [0,1,0,0,0,0|2,0,0]=3 1150 B12R1.16 CC(CCBr)c1ccc(F)cc1 Amb17249285 [0,1,0,0,0,0|2,0,0]=3 1151 B12R1.16 CC(CCCl)c1ccc(Br)cc1 Amb17259618 [0,1,0,0,0,0|2,0,0]=3 1152 B12R1.16 CC(CCCl)c1ccc(Cl)cc1 Amb17237597 [0,1,0,0,0,0|2,0,0]=3 1153 B12R1.16 CC(CCCl)c1ccc(F)cc1 Amb17234366 [0,1,0,0,0,0|2,0,0]=3 1154 B12R1.16 CC(CCN)c1ccc(Br)cc1 Amb5739016 [0,1,0,0,0,0|2,0,0]=3 1155 B12R1.16 CC(CCN)c1ccc(Br)cn1 Amb33477127 [0,1,0,0,0,0|3,0,0]=4 1156 B12R1.16 CC(CCN)c1ccc(Br)nc1 Amb33387708 [0,1,0,0,0,0|3,0,0]=4 1157 B12R1.16 CC(CCN)c1ccc(Cl)cc1 Amb22034632 [0,1,0,0,0,0|2,0,0]=3 1158 B12R1.16 CC(CCN)c1ccc(Cl)cc1 Amb5739015 [0,1,0,0,0,0|2,0,0]=3 1159 B12R1.16 CC(CCN)c1ccc(Cl)nc1 Amb33261508 [0,1,0,0,0,0|3,0,0]=4 1160 B12R1.16 CC(CCN)c1ccc(F)cc1 Amb5739014 [0,1,0,0,0,0|2,0,0]=3 1161 B12R1.16 CC(CCN)c1ccc(F)cn1 Amb26354354 [0,1,0,0,0,0|3,0,0]=4 1162 B12R1.16 CC(CCN)c1ccc(F)nc1 Amb33426572 [0,1,0,0,0,0|3,0,0]=4 1163 B12R1.16 CC(CCN)c1ccc(O)cc1 Amb33269858 [0,1,0,0,0,0|2,0,0]=3 1164 B12R1.16 CC(CCO)c1ccc(Br)cc1 Amb17248426 [0,1,0,0,0,0|2,0,0]=3 1165 B12R1.16 CC(CCO)c1ccc(Cl)cc1 Amb17234157 [0,1,0,0,0,0|2,0,0]=3 1166 B12R1.16 CC(CCO)c1ccc(F)cc1 Amb17232668 [0,1,0,0,0,0|2,0,0]=3 1167 B12R1.16 CC(CCS)c1ccc(F)cc1 Amb33423592 [0,1,0,0,0,0|2,0,0]=3 1168 B12R1.16 CC(CNN)c1ccc(F)cc1 Amb33274185 [0,1,0,0,0,0|1,0,0]=2 1169 B12R1.16 CC(CNO)c1ccc(F)cc1 Amb33274590 [0,1,0,0,0,0|1,0,0]=2 1170 B12R1.16 CC(CON)c1ccc(Br)cc1 Amb33451555 [0,1,0,0,0,0|2,0,0]=3 1171 B12R1.16 CC(CON)c1ccc(Br)cn1 Amb33477131 [0,1,0,0,0,0|3,0,0]=4 1172 B12R1.16 CC(CON)c1ccc(Br)nc1 Amb33388064 [0,1,0,0,0,0|3,0,0]=4 1173 B12R1.16 CC(CON)c1ccc(Cl)cc1 Amb33052811 [0,1,0,0,0,0|2,0,0]=3 1174 B12R1.16 CC(CON)c1ccc(Cl)nc1 Amb33261577 [0,1,0,0,0,0|3,0,0]=4 1175 B12R1.16 CC(CON)c1ccc(F)cc1 Amb33376578 [0,1,0,0,0,0|2,0,0]=3 1176 B12R1.16 CC(CON)c1ccc(F)cn1 Amb33315867 [0,1,0,0,0,0|3,0,0]=4 1177 B12R1.16 CC(CON)c1ccc(F)nc1 Amb33426197 [0,1,0,0,0,0|3,0,0]=4 1178 B12R1.16 CC(CON)c1ccc(O)cc1 Amb33269536 [0,1,0,0,0,0|2,0,0]=3 1179 B12R1.16 CC(N=C=O)c1ccc(Br)cc1 Amb33529292 [0,1,0,0,0,0|3,0,0]=4 1180 B12R1.16 CC(N=C=O)c1ccc(Cl)cc1 Amb33528522 [0,1,0,0,0,0|3,0,0]=4 1181 B12R1.16 CC(N=C=O)c1ccc(F)cc1 Amb5750721 [0,1,0,0,0,0|3,0,0]=4 1182 B12R1.16 CC(N=C=S)c1ccc(Br)cc1 Amb25045923 [0,1,0,0,0,0|3,0,0]=4 1183 B12R1.16 CC(N=C=S)c1ccc(Cl)cc1 Amb7102653 [0,1,0,0,0,0|3,0,0]=4 1184 B12R1.16 CC(N=C=S)c1ccc(F)cc1 Amb2688204 [0,1,0,0,0,0|3,0,0]=4 1185 B12R1.16 CC(N=[N+]=[N-])c1ccc(Cl)cc1 Amb28422388 [0,1,0,0,0,0|2,0,1]=4 1186 B12R1.16 CC(N=[N+]=[N-])c1ccc(F)cc1 Amb27875221 [0,1,0,0,0,0|2,0,1]=4 1187 B12R1.16 CC(NC#N)c1ccc(Cl)cc1 Amb18809458 [0,1,0,0,0,0|3,0,0]=4 1188 B12R1.16 CC(NC=O)c1ccc(Br)cc1 Amb4149067 [0,1,0,0,0,0|3,0,0]=4 1189 B12R1.16 CC(NC=O)c1ccc(Cl)cc1 Amb24692281 [0,1,0,0,0,0|3,0,0]=4 1190 B12R1.16 CC(\C=C\Br)c1ccc(F)cc1 Amb33135459 [0,1,0,0,0,0|2,0,1]=4 1191 B12R1.16 CCCC(=O)c1ccc(Br)cc1 Amb2567820 [0,1,0,0,0,0|2,0,1]=4 1192 B12R1.16 CCCC(=O)c1ccc(C)cc1 Amb3940678 [0,1,0,0,0,0|2,0,1]=4 1193 B12R1.16 CCCC(=O)c1ccc(Cl)cc1 Amb1679791 [0,1,0,0,0,0|2,0,1]=4 1194 B12R1.16 CCCC(=O)c1ccc(F)cc1 Amb4020581 [0,1,0,0,0,0|2,0,1]=4 1195 B12R1.16 CCCC(=O)c1ccc(I)cc1 Amb4013959 [0,1,0,0,0,0|2,0,1]=4 1196 B12R1.16 CCCC(=O)c1ccc(N)cc1 Amb2684368 [0,1,0,0,0,0|2,0,1]=4 1197 B12R1.16 CCCC(=O)c1ccc(O)cc1 Amb1033062 [0,1,0,0,0,0|2,0,1]=4 1198 B12R1.16 CCCC(Br)c1ccc(Br)cc1 Amb27976372 [0,1,0,0,0,0|2,0,0]=3 1199 B12R1.16 CCCC(C)c1ccc(O)cc1 Amb17594074 [0,1,0,0,0,0|1,0,0]=2 1200 B12R1.16 CCCC(Cl)c1ccc(C)cc1 Amb17139051 [0,1,0,0,0,0|2,0,0]=3 1201 B12R1.16 CCCC(Cl)c1ccc(Cl)cc1 Amb17139906 [0,1,0,0,0,0|2,0,0]=3 1202 B12R1.16 CCCC(Cl)c1ccc(F)cc1 Amb17139162 [0,1,0,0,0,0|2,0,0]=3 1203 B12R1.16 CCCC(N)c1ccc(Br)cc1 Amb6255527 [0,1,0,0,0,0|2,0,0]=3 1204 B12R1.16 CCCC(N)c1ccc(C)cc1 Amb6256136 [0,1,0,0,0,0|2,0,0]=3 1205 B12R1.16 CCCC(N)c1ccc(Cl)cc1 Amb20626143 [0,1,0,0,0,0|2,0,0]=3 1206 B12R1.16 CCCC(N)c1ccc(Cl)cc1 Amb9717984 [0,1,0,0,0,0|2,0,0]=3 1207 B12R1.16 CCCC(N)c1ccc(F)cc1 Amb9717477 [0,1,0,0,0,0|2,0,0]=3 1208 B12R1.16 CCCC(N)c1ccc(F)nc1 Amb28340972 [0,1,0,0,0,0|3,0,0]=4 1209 B12R1.16 CCCC(N)c1ccc(N)cc1 Amb27476459 [0,1,0,0,0,0|2,0,0]=3 1210 B12R1.16 CCCC(N)c1ccc(O)cc1 Amb18939625 [0,1,0,0,0,0|2,0,0]=3 1211 B12R1.16 CCCC(N)c1ccc(S)cc1 Amb27214632 [0,1,0,0,0,0|2,0,0]=3 1212 B12R1.16 CCCC(O)c1ccc(Br)cc1 Amb4011737 [0,1,0,0,0,0|2,0,0]=3 1213 B12R1.16 CCCC(O)c1ccc(C)cc1 Amb4035735 [0,1,0,0,0,0|2,0,0]=3 1214 B12R1.16 CCCC(O)c1ccc(Cl)cc1 Amb4035851 [0,1,0,0,0,0|2,0,0]=3 1215 B12R1.16 CCCC(O)c1ccc(F)cc1 Amb4036341 [0,1,0,0,0,0|2,0,0]=3 1216 B12R1.16 CCCC(O)c1ccc(N)cn1 Amb35622102 [0,1,0,0,0,0|3,0,0]=4 1217 B12R1.16 CCCC(O)c1ccc(O)cc1 Amb27226065 [0,1,0,0,0,0|2,0,0]=3 1218 B12R1.16 CCCC(S)c1ccc(Cl)cc1 Amb32788871 [0,1,0,0,0,0|2,0,0]=3 1219 B12R1.16 CCCN(C)c1ccc(Cl)cc1 Amb27804750 [0,1,0,0,0,0|2,0,0]=3 1220 B12R1.16 CCCN(C)c1ccc(F)cc1 Amb27653560 [0,1,0,0,0,0|2,0,0]=3 1221 B12R1.16 CCCN(C)c1ccc(N)cn1 Amb8898675 [0,1,0,0,0,0|3,0,0]=4 1222 B12R1.16 CCCN(C)c1ccc(O)cc1 Amb28064673 [0,1,0,0,0,0|2,0,0]=3 1223 B12R1.16 CCCS(=O)c1ccc(N)cc1 Amb18977331 [0,1,0,0,0,0|3,0,0]=4 1224 B12R1.16 CCC[C@@H](N)c1ccc(Br)nc1 Amb27441111 [0,1,0,0,0,0|3,0,0]=4 1225 B12R1.16 CCC[C@@H](N)c1ccc(C)cc1 Amb27259101 [0,1,0,0,0,0|2,0,0]=3 1226 B12R1.16 CCC[C@@H](N)c1ccc(C)nc1 Amb28456644 [0,1,0,0,0,0|3,0,0]=4 1227 B12R1.16 CCC[C@@H](N)c1ccc(F)cc1 Amb22298535 [0,1,0,0,0,0|2,0,0]=3 1228 B12R1.16 CCC[C@@H](O)c1ccc(Cl)cc1 Amb27834099 [0,1,0,0,0,0|2,0,0]=3 1229 B12R1.16 CCC[C@H](N)c1ccc(Br)cc1 Amb27871377 [0,1,0,0,0,0|2,0,0]=3 1230 B12R1.16 CCC[C@H](N)c1ccc(Br)cn1 Amb27790908 [0,1,0,0,0,0|3,0,0]=4 1231 B12R1.16 CCC[C@H](N)c1ccc(Cl)cn1 Amb27593471 [0,1,0,0,0,0|3,0,0]=4 1232 B12R1.16 CCC[C@H](N)c1ccc(F)cc1 Amb22298578 [0,1,0,0,0,0|2,0,0]=3 1233 B12R1.16 CCC[C@H](N)c1ccc(F)cc1 Amb24700451 [0,1,0,0,0,0|2,0,0]=3 1234 B12R1.16 CCC[C@H](N)c1ccc(F)cn1 Amb27404605 [0,1,0,0,0,0|3,0,0]=4 1235 B12R1.16 CCC[C@H](N)c1ccc(O)cc1 Amb27461355 [0,1,0,0,0,0|2,0,0]=3 1236 B12R1.16 CCC[C@H](O)c1ccc(Br)cc1 Amb27752379 [0,1,0,0,0,0|2,0,0]=3 1237 B12R1.16 CCC[C@H](O)c1ccc(C)cn1 Amb27959954 [0,1,0,0,0,0|3,0,0]=4 1238 B12R1.16 CCC[C@H](O)c1ccc(Cl)cn1 Amb28063198 [0,1,0,0,0,0|3,0,0]=4 1239 B12R1.16 CCC[C@H](O)c1ccc(F)cn1 Amb27452848 [0,1,0,0,0,0|3,0,0]=4 1240 B12R1.16 CCNC(C)c1ccc(Br)cc1 Amb1095032 [0,1,0,0,0,0|2,0,0]=3 1241 B12R1.16 CCNC(C)c1ccc(Br)cc1 Amb5716086 [0,1,0,0,0,0|2,0,0]=3 1242 B12R1.16 CCNC(C)c1ccc(C)nc1 Amb28146590 [0,1,0,0,0,0|3,0,0]=4 1243 B12R1.16 CCNC(C)c1ccc(Cl)cn1 Amb25892769 [0,1,0,0,0,0|3,0,0]=4 1244 B12R1.16 CCNC(C)c1ccc(F)cc1 Amb10188230 [0,1,0,0,0,0|2,0,0]=3 1245 B12R1.16 CCNC(C)c1ccc(F)cc1 Amb9728805 [0,1,0,0,0,0|2,0,0]=3 1246 B12R1.16 CCNC(C)c1ccc(O)cc1 Amb6268123 [0,1,0,0,0,0|2,0,0]=3 1247 B12R1.16 CCNC(C)c1ccc(O)cn1 Amb27652331 [0,1,0,0,0,0|3,0,0]=4 1248 B12R1.16 CCNC(C)c1ccc(S)cc1 Amb27591497 [0,1,0,0,0,0|2,0,0]=3 1249 B12R1.16 CCN[C@@H](C)c1ccc(Br)cc1 Amb28349963 [0,1,0,0,0,0|2,0,0]=3 1250 B12R1.16 CCN[C@@H](C)c1ccc(F)cc1 Amb27955045 [0,1,0,0,0,0|2,0,0]=3 1251 B12R1.16 CCOC(C)c1ccc(I)cc1 Amb33512232 [0,1,0,0,0,0|2,0,0]=3 1252 B12R1.16 CCON(C)c1ccc(N)cc1 Amb27789813 [0,1,0,0,0,0|3,0,0]=4 1253 B12R1.16 CCSC(C)c1ccc(F)cc1 Amb28206909 [0,1,0,0,0,0|2,0,0]=3 1254 B12R1.16 CN(CC#N)c1ccc(Br)cc1 Amb17343205 [0,1,0,0,0,0|3,0,0]=4 1255 B12R1.16 CN(CC#N)c1ccc(Cl)cc1 Amb17335465 [0,1,0,0,0,0|3,0,0]=4 1256 B12R1.16 CN(CC#N)c1ccc(F)cc1 Amb17334603 [0,1,0,0,0,0|3,0,0]=4 1257 B12R1.16 CN(CC#N)c1ccc(O)cc1 Amb5781400 [0,1,0,0,0,0|3,0,0]=4 1258 B12R1.16 CN(CCCl)c1ccc(Br)cc1 Amb17351918 [0,1,0,0,0,0|3,0,0]=4 1259 B12R1.16 CN(CCCl)c1ccc(Cl)cc1 Amb17338057 [0,1,0,0,0,0|3,0,0]=4 1260 B12R1.16 CN(CCCl)c1ccc(F)cc1 Amb17335952 [0,1,0,0,0,0|3,0,0]=4 1261 B12R1.16 CN(CCCl)c1ccc(N)cc1 Amb27592197 [0,1,0,0,0,0|3,0,0]=4 1262 B12R1.16 CN(CCF)c1ccc(F)cc1 Amb28185618 [0,1,0,0,0,0|3,0,0]=4 1263 B12R1.16 CN(CCN)c1ccc(Br)cc1 Amb17059648 [0,1,0,0,0,0|3,0,0]=4 1264 B12R1.16 CN(CCN)c1ccc(Cl)cc1 Amb17059647 [0,1,0,0,0,0|3,0,0]=4 1265 B12R1.16 CN(CCN)c1ccc(F)cc1 Amb17059644 [0,1,0,0,0,0|3,0,0]=4 1266 B12R1.16 CN(CCN)c1ccc(I)cc1 Amb27762292 [0,1,0,0,0,0|3,0,0]=4 1267 B12R1.16 CN(CCN)c1ccc(N)cc1 Amb18251776 [0,1,0,0,0,0|3,0,0]=4 1268 B12R1.16 CN(CCO)c1ccc(Br)cc1 Amb17344450 [0,1,0,0,0,0|3,0,0]=4 1269 B12R1.16 CN(CCO)c1ccc(Cl)cc1 Amb17335812 [0,1,0,0,0,0|3,0,0]=4 1270 B12R1.16 CN(CCO)c1ccc(F)cc1 Amb17334764 [0,1,0,0,0,0|3,0,0]=4 1271 B12R1.16 CN(CCO)c1ccc(N)cc1 Amb7765984 [0,1,0,0,0,0|3,0,0]=4 1272 B12R1.16 CNCC(=O)c1ccc(Br)cc1 Amb17248090 [0,1,0,0,0,0|1,0,1]=3 1273 B12R1.16 CNCC(=O)c1ccc(Br)cn1 Amb33477130 [0,1,0,0,0,0|2,0,1]=4 1274 B12R1.16 CNCC(=O)c1ccc(Br)nc1 Amb33387717 [0,1,0,0,0,0|2,0,1]=4 1275 B12R1.16 CNCC(=O)c1ccc(C)cc1 Amb17232427 [0,1,0,0,0,0|1,0,1]=3 1276 B12R1.16 CNCC(=O)c1ccc(C)cn1 Amb33199156 [0,1,0,0,0,0|2,0,1]=4 1277 B12R1.16 CNCC(=O)c1ccc(C)nc1 Amb25154107 [0,1,0,0,0,0|2,0,1]=4 1278 B12R1.16 CNCC(=O)c1ccc(Cl)cc1 Amb2777315 [0,1,0,0,0,0|1,0,1]=3 1279 B12R1.16 CNCC(=O)c1ccc(Cl)nc1 Amb33261546 [0,1,0,0,0,0|2,0,1]=4 1280 B12R1.16 CNCC(=O)c1ccc(F)cc1 Amb17232631 [0,1,0,0,0,0|1,0,1]=3 1281 B12R1.16 CNCC(=O)c1ccc(F)cc1 Amb24121219 [0,1,0,0,0,0|1,0,1]=3 1282 B12R1.16 CNCC(=O)c1ccc(F)cn1 Amb28199191 [0,1,0,0,0,0|2,0,1]=4 1283 B12R1.16 CNCC(=O)c1ccc(F)nc1 Amb33225302 [0,1,0,0,0,0|2,0,1]=4 1284 B12R1.16 CNCC(=O)c1ccc(N)cc1 Amb18550919 [0,1,0,0,0,0|1,0,1]=3 1285 B12R1.16 CNCC(=O)c1ccc(O)cc1 Amb1075808 [0,1,0,0,0,0|1,0,1]=3 1286 B12R1.16 CNCC(=O)c1ccc(O)cc1 Amb6859390 [0,1,0,0,0,0|1,0,1]=3 1287 B12R1.16 CNCC(C)c1ccc(Br)cc1 Amb17248095 [0,1,0,0,0,0|0,0,0]=1 1288 B12R1.16 CNCC(C)c1ccc(C)cc1 Amb17232442 [0,1,0,0,0,0|0,0,0]=1 1289 B12R1.16 CNCC(C)c1ccc(Cl)cc1 Amb17234045 [0,1,0,0,0,0|0,0,0]=1 1290 B12R1.16 CNCC(C)c1ccc(F)cc1 Amb17232642 [0,1,0,0,0,0|0,0,0]=1 1291 B12R1.16 CNCC(C)c1ccc(F)cn1 Amb28204636 [0,1,0,0,0,0|1,0,0]=2 1292 B12R1.16 CNCC(Cl)c1ccc(F)cc1 Amb27974219 [0,1,0,0,0,0|1,0,0]=2 1293 B12R1.16 CNCC(O)c1ccc(Br)cc1 Amb17142608 [0,1,0,0,0,0|1,0,0]=2 1294 B12R1.16 CNCC(O)c1ccc(Br)cn1 Amb23586103 [0,1,0,0,0,0|2,0,0]=3 1295 B12R1.16 CNCC(O)c1ccc(Br)nc1 Amb33387715 [0,1,0,0,0,0|2,0,0]=3 1296 B12R1.16 CNCC(O)c1ccc(C)cc1 Amb5750897 [0,1,0,0,0,0|1,0,0]=2 1297 B12R1.16 CNCC(O)c1ccc(C)cn1 Amb24380693 [0,1,0,0,0,0|2,0,0]=3 1298 B12R1.16 CNCC(O)c1ccc(C)nc1 Amb26370715 [0,1,0,0,0,0|2,0,0]=3 1299 B12R1.16 CNCC(O)c1ccc(Cl)cc1 Amb5750903 [0,1,0,0,0,0|1,0,0]=2 1300 B12R1.16 CNCC(O)c1ccc(Cl)nc1 Amb33261541 [0,1,0,0,0,0|2,0,0]=3 1301 B12R1.16 CNCC(O)c1ccc(F)cc1 Amb33547967 [0,1,0,0,0,0|1,0,0]=2 1302 B12R1.16 CNCC(O)c1ccc(F)cc1 Amb6357663 [0,1,0,0,0,0|1,0,0]=2 1303 B12R1.16 CNCC(O)c1ccc(F)cn1 Amb26860789 [0,1,0,0,0,0|2,0,0]=3 1304 B12R1.16 CNCC(O)c1ccc(F)nc1 Amb33426570 [0,1,0,0,0,0|2,0,0]=3 1305 B12R1.16 CNCC(O)c1ccc(N)cc1 Amb19888327 [0,1,0,0,0,0|1,0,0]=2 1306 B12R1.16 CNCC(O)c1ccc(O)cc1 Amb22166782 [0,1,0,0,0,0|1,0,0]=2 1307 B12R1.16 CNCC(O)c1ccc(O)cc1 Amb8629233 [0,1,0,0,0,0|1,0,0]=2 1308 B12R1.16 CNCC(O)c1ccc(O)cc1 Amb9784888 [0,1,0,0,0,0|1,0,0]=2 1309 B12R1.16 CNCC(O)c1cnc(C)cn1 Amb33375101 [0,1,0,0,0,0|3,0,0]=4 1310 B12R1.16 CNCC(O)c1ncc(Br)cn1 Amb33334407 [0,1,0,0,0,0|3,0,0]=4 1311 B12R1.16 CNC[C@@H](O)c1ccc(Br)cc1 Amb27642048 [0,1,0,0,0,0|1,0,0]=2 1312 B12R1.16 CNC[C@@H](O)c1ccc(O)cc1 Amb25764531 [0,1,0,0,0,0|1,0,0]=2 1313 B12R1.16 CN\C=C(\C)c1ccc(Cl)cc1 Amb27814193 [0,1,0,0,0,0|0,0,2]=3 1314 B12R1.16 CN\N=C(\C)c1ccc(F)cc1 Amb27802349 [0,1,0,0,0,0|1,0,1]=3 1315 B12R1.16 COCC(=O)c1ccc(Br)cc1 Amb9665975 [0,1,0,0,0,0|2,0,1]=4 1316 B12R1.16 COCC(=O)c1ccc(Cl)cc1 Amb9666006 [0,1,0,0,0,0|2,0,1]=4 1317 B12R1.16 COCC(=O)c1ccc(F)cc1 Amb9666007 [0,1,0,0,0,0|2,0,1]=4 1318 B12R1.16 COCC(=O)c1ccc(N)cc1 Amb17202004 [0,1,0,0,0,0|2,0,1]=4 1319 B12R1.16 COCC(=O)c1ccc(O)cc1 Amb17616985 [0,1,0,0,0,0|2,0,1]=4 1320 B12R1.16 COCC(F)c1ccc(N)cc1 Amb27615528 [0,1,0,0,0,0|2,0,0]=3 1321 B12R1.16 COCC(N)c1ccc(Br)cc1 Amb18070171 [0,1,0,0,0,0|2,0,0]=3 1322 B12R1.16 COCC(N)c1ccc(Cl)cc1 Amb18979034 [0,1,0,0,0,0|2,0,0]=3 1323 B12R1.16 COCC(N)c1ccc(Cl)cn1 Amb27391602 [0,1,0,0,0,0|3,0,0]=4 1324 B12R1.16 COCC(N)c1ccc(F)cc1 Amb1139881 [0,1,0,0,0,0|2,0,0]=3 1325 B12R1.16 COCC(N)c1ccc(F)cc1 Amb19375549 [0,1,0,0,0,0|2,0,0]=3 1326 B12R1.16 COCC(N)c1ccc(N)cc1 Amb27874108 [0,1,0,0,0,0|2,0,0]=3 1327 B12R1.16 COCC(N)c1ccc(N)cn1 Amb27413866 [0,1,0,0,0,0|3,0,0]=4 1328 B12R1.16 COCC(N)c1ccc(O)nc1 Amb27786309 [0,1,0,0,0,0|3,0,0]=4 1329 B12R1.16 COCC(O)c1ccc(Br)cn1 Amb27409423 [0,1,0,0,0,0|3,0,0]=4 1330 B12R1.16 COCC(O)c1ccc(C)cn1 Amb27397271 [0,1,0,0,0,0|3,0,0]=4 1331 B12R1.16 COCC(O)c1ccc(Cl)nc1 Amb27596374 [0,1,0,0,0,0|3,0,0]=4 1332 B12R1.16 COCC(O)c1ccc(N)cc1 Amb18987938 [0,1,0,0,0,0|2,0,0]=3 1333 B12R1.16 COCC(O)c1ccc(N)cn1 Amb35622241 [0,1,0,0,0,0|3,0,0]=4 1334 B12R1.16 COC[C@@H](N)c1ccc(C)nc1 Amb28340969 [0,1,0,0,0,0|3,0,0]=4 1335 B12R1.16 COC[C@@H](N)c1ccc(F)cn1 Amb27748685 [0,1,0,0,0,0|3,0,0]=4 1336 B12R1.16 COC[C@@H](N)c1ccc(F)nc1 Amb27975807 [0,1,0,0,0,0|3,0,0]=4 1337 B12R1.16 COC[C@@H](N)c1ccc(I)cn1 Amb27621397 [0,1,0,0,0,0|3,0,0]=4 1338 B12R1.16 COC[C@@H](N)c1ccc(N)cn1 Amb27602183 [0,1,0,0,0,0|3,0,0]=4 1339 B12R1.16 COC[C@@H](N)c1ccc(O)cc1 Amb27810795 [0,1,0,0,0,0|2,0,0]=3 1340 B12R1.16 COC[C@@H](N)c1ccc(O)cn1 Amb27494034 [0,1,0,0,0,0|3,0,0]=4 1341 B12R1.16 COC[C@H](N)c1ccc(C)cc1 Amb27883359 [0,1,0,0,0,0|2,0,0]=3 1342 B12R1.16 COC[C@H](N)c1ccc(F)cn1 Amb27226173 [0,1,0,0,0,0|3,0,0]=4 1343 B12R1.16 COC[C@H](N)c1ccc(I)cc1 Amb27165996 [0,1,0,0,0,0|2,0,0]=3 1344 B12R1.16 COC[C@H](N)c1ccc(N)cn1 Amb27859647 [0,1,0,0,0,0|3,0,0]=4 1345 B12R1.16 COC[C@H](N)c1ccc(S)cc1 Amb27202609 [0,1,0,0,0,0|2,0,0]=3 1346 B12R1.16 CONC(C)c1ccc(Br)cc1 Amb18747016 [0,1,0,0,0,0|2,0,0]=3 1347 B12R1.16 CONC(C)c1ccc(Br)cn1 Amb35669882 [0,1,0,0,0,0|3,0,0]=4 1348 B12R1.16 CONC(C)c1ccc(Cl)cc1 Amb27770716 [0,1,0,0,0,0|2,0,0]=3 1349 B12R1.16 CONC(C)c1ccc(Cl)cn1 Amb35676506 [0,1,0,0,0,0|3,0,0]=4 1350 B12R1.16 CONC(C)c1ccc(F)cn1 Amb27590830 [0,1,0,0,0,0|3,0,0]=4 1351 B12R1.16 CO\N=C(/C)c1ccc(Cl)cc1 Amb33868175 [0,1,0,0,0,0|2,0,1]=4 1352 B12R1.16 CO\N=C(/C)c1ccc(F)cc1 Amb32661033 [0,1,0,0,0,0|2,0,1]=4 1353 B12R1.16 CO\N=C(\C)c1ccc(F)cc1 Amb27164505 [0,1,0,0,0,0|2,0,1]=4 1354 B12R1.16 CO\N=C(\C)c1ccc(I)cc1 Amb27178833 [0,1,0,0,0,0|2,0,1]=4 1355 B12R1.16 CSCC(=O)c1ccc(Br)cc1 Amb24638487 [0,1,0,0,0,0|2,0,1]=4 1356 B12R1.16 CSCC(=O)c1ccc(C)cc1 Amb18796320 [0,1,0,0,0,0|2,0,1]=4 1357 B12R1.16 CSCC(=O)c1ccc(Cl)cc1 Amb18320090 [0,1,0,0,0,0|2,0,1]=4 1358 B12R1.16 CSCC(=O)c1ccc(F)cc1 Amb19057445 [0,1,0,0,0,0|2,0,1]=4 1359 B12R1.16 CSCC(=O)c1ccc(I)cc1 Amb25826398 [0,1,0,0,0,0|2,0,1]=4 1360 B12R1.16 CSCC(=O)c1ccc(O)cc1 Amb18181564 [0,1,0,0,0,0|2,0,1]=4 1361 B12R1.16 CSCC(Cl)c1ccc(C)cc1 Amb25805205 [0,1,0,0,0,0|2,0,0]=3 1362 B12R1.16 CSCC(N)c1ccc(Br)cc1 Amb35591576 [0,1,0,0,0,0|2,0,0]=3 1363 B12R1.16 CSCC(N)c1ccc(F)cc1 Amb18300300 [0,1,0,0,0,0|2,0,0]=3 1364 B12R1.16 CSCC(O)c1ccc(Br)cc1 Amb35605452 [0,1,0,0,0,0|2,0,0]=3 1365 B12R1.16 CSCC(O)c1ccc(C)cc1 Amb19061295 [0,1,0,0,0,0|2,0,0]=3 1366 B12R1.16 CSCC(O)c1ccc(F)cc1 Amb19070006 [0,1,0,0,0,0|2,0,0]=3 1367 B12R1.16 CSCC(O)c1ccc(N)cc1 Amb18987939 [0,1,0,0,0,0|2,0,0]=3 1368 B12R1.16 C[C@@H](CCBr)c1ccc(Cl)cc1 Amb24667919 [0,1,0,0,0,0|2,0,0]=3 1369 B12R1.16 C[C@@H](CCO)c1ccc(Cl)cc1 Amb25832765 [0,1,0,0,0,0|2,0,0]=3 1370 B12R1.16 C[C@@H](N=C=O)c1ccc(Br)cc1 Amb22053849 [0,1,0,0,0,0|3,0,0]=4 1371 B12R1.16 C[C@@H](N=C=O)c1ccc(Cl)cc1 Amb6366014 [0,1,0,0,0,0|3,0,0]=4 1372 B12R1.16 C[C@@H](N=C=O)c1ccc(F)cc1 Amb6357905 [0,1,0,0,0,0|3,0,0]=4 1373 B12R1.16 C[C@@H](N=C=S)c1ccc(Br)cc1 Amb6366146 [0,1,0,0,0,0|3,0,0]=4 1374 B12R1.16 C[C@@H](N=C=S)c1ccc(Cl)cc1 Amb6366015 [0,1,0,0,0,0|3,0,0]=4 1375 B12R1.16 C[C@@H](N=[N+]=[N-])c1ccc(Cl)cc1 Amb27413228 [0,1,0,0,0,0|2,0,1]=4 1376 B12R1.16 C[C@H](CCO)c1ccc(Cl)cc1 Amb28125864 [0,1,0,0,0,0|2,0,0]=3 1377 B12R1.16 C[C@H](N=C=O)c1ccc(Br)cc1 Amb22045324 [0,1,0,0,0,0|3,0,0]=4 1378 B12R1.16 C[C@H](N=C=O)c1ccc(Cl)cc1 Amb22045301 [0,1,0,0,0,0|3,0,0]=4 1379 B12R1.16 C[C@H](N=C=O)c1ccc(F)cc1 Amb22045303 [0,1,0,0,0,0|3,0,0]=4 1380 B12R1.16 C[C@H](N=[N+]=[N-])c1ccc(Br)cc1 Amb28423171 [0,1,0,0,0,0|2,0,1]=4 1381 B12R1.16 C[C@H](N=[N+]=[N-])c1ccc(Cl)cc1 Amb27655309 [0,1,0,0,0,0|2,0,1]=4 1382 B12R1.16 C[C@H](N=[N+]=[N-])c1ccc(I)cc1 Amb27596243 [0,1,0,0,0,0|2,0,1]=4 1383 B12R1.16 C\C=C\C(C)c1ccc(N)cc1 Amb18645538 [0,1,0,0,0,0|1,0,1]=3 1384 B12R1.16 C\C=C\C(O)c1ccc(F)cc1 Amb27615221 [0,1,0,0,0,0|2,0,1]=4 1385 B12R1.16 Cc1ccc(C(C)CC#N)cc1 Amb26989301 [0,1,0,0,0,0|2,0,0]=3 1386 B12R1.16 Cc1ccc(C(C)CC=O)cc1 Amb18645706 [0,1,0,0,0,0|2,0,0]=3 1387 B12R1.16 Cc1ccc(C(C)CCBr)cc1 Amb857803 [0,1,0,0,0,0|2,0,0]=3 1388 B12R1.16 Cc1ccc(C(C)CCCl)cc1 Amb17233970 [0,1,0,0,0,0|2,0,0]=3 1389 B12R1.16 Cc1ccc(C(C)CCN)cc1 Amb5739007 [0,1,0,0,0,0|2,0,0]=3 1390 B12R1.16 Cc1ccc(C(C)CCN)cn1 Amb24525060 [0,1,0,0,0,0|3,0,0]=4 1391 B12R1.16 Cc1ccc(C(C)CCN)nc1 Amb33199159 [0,1,0,0,0,0|3,0,0]=4 1392 B12R1.16 Cc1ccc(C(C)CCO)cc1 Amb17232490 [0,1,0,0,0,0|2,0,0]=3 1393 B12R1.16 Cc1ccc(C(C)CON)cc1 Amb33373957 [0,1,0,0,0,0|2,0,0]=3 1394 B12R1.16 Cc1ccc(C(C)CON)cn1 Amb32877855 [0,1,0,0,0,0|3,0,0]=4 1395 B12R1.16 Cc1ccc(C(C)CON)nc1 Amb33198541 [0,1,0,0,0,0|3,0,0]=4 1396 B12R1.16 Cc1ccc(C(C)N=C=O)cc1 Amb25189504 [0,1,0,0,0,0|3,0,0]=4 1397 B12R1.16 Cc1ccc(C(C)N=[N+]=[N-])cc1 Amb27178142 [0,1,0,0,0,0|2,0,1]=4 1398 B12R1.16 Cc1ccc(C(C)\C=C\Br)cc1 Amb33135290 [0,1,0,0,0,0|2,0,1]=4 1399 B12R1.16 Cc1ccc(C(F)CCN)cc1 Amb26912355 [0,1,0,0,0,0|3,0,0]=4 1400 B12R1.16 Cc1ccc(C(N)CC#N)cc1 Amb18563500 [0,1,0,0,0,0|3,0,0]=4 1401 B12R1.16 Cc1ccc(C(N)CCO)cc1 Amb17103955 [0,1,0,0,0,0|3,0,0]=4 1402 B12R1.16 Cc1ccc(C(O)CC#N)cc1 Amb17232362 [0,1,0,0,0,0|3,0,0]=4 1403 B12R1.16 Cc1ccc(C(O)CCCl)cc1 Amb17194565 [0,1,0,0,0,0|3,0,0]=4 1404 B12R1.16 Cc1ccc(C(O)CCN)cc1 Amb17079132 [0,1,0,0,0,0|3,0,0]=4 1405 B12R1.16 Cc1ccc(C(O)CCO)cc1 Amb18563722 [0,1,0,0,0,0|3,0,0]=4 1406 B12R1.16 Cc1ccc(C(O)CNN)cc1 Amb17232610 [0,1,0,0,0,0|2,0,0]=3 1407 B12R1.16 Cc1ccc(C(O)CNO)cc1 Amb17334704 [0,1,0,0,0,0|2,0,0]=3 1408 B12R1.16 Cc1ccc(C(O)CON)cc1 Amb17334705 [0,1,0,0,0,0|3,0,0]=4 1409 B12R1.16 Cc1ccc(N(C)CC#N)cc1 Amb17334503 [0,1,0,0,0,0|3,0,0]=4 1410 B12R1.16 Cc1ccc(N(C)CCCl)cc1 Amb17335672 [0,1,0,0,0,0|3,0,0]=4 1411 B12R1.16 Cc1ccc(N(C)CCN)cc1 Amb13893182 [0,1,0,0,0,0|3,0,0]=4 1412 B12R1.16 Cc1ccc(N(C)CCO)cc1 Amb17334645 [0,1,0,0,0,0|3,0,0]=4 1413 B12R1.16 Cc1ccc([C@@H](N)CC#N)cc1 Amb27398631 [0,1,0,0,0,0|3,0,0]=4 1414 B12R1.16 Cc1ccc([C@@H](N)CCO)cc1 Amb19888370 [0,1,0,0,0,0|3,0,0]=4 1415 B12R1.16 Cc1ccc([C@@H](N)CCO)cc1 Amb23399704 [0,1,0,0,0,0|3,0,0]=4 1416 B12R1.16 Cc1ccc([C@@H](O)CCCl)cc1 Amb28365650 [0,1,0,0,0,0|3,0,0]=4 1417 B12R1.16 Cc1ccc([C@@H](O)CCN)cc1 Amb25996449 [0,1,0,0,0,0|3,0,0]=4 1418 B12R1.16 Cc1ccc([C@H](N)CCN)cc1 Amb28056003 [0,1,0,0,0,0|3,0,0]=4 1419 B12R1.16 Cc1ccc([C@H](N)CCO)cc1 Amb19887704 [0,1,0,0,0,0|3,0,0]=4 1420 B12R1.16 Cc1ccc([C@H](O)CC#N)cc1 Amb27447803 [0,1,0,0,0,0|3,0,0]=4 1421 B12R1.16 Cc1ccc([C@H](O)CCN)cc1 Amb28123207 [0,1,0,0,0,0|3,0,0]=4 1422 B12R1.16 ClCCC(Br)c1ccc(Cl)cc1 Amb25089461 [0,1,0,0,0,0|3,0,0]=4 1423 B12R1.16 Clc1ccc(C(Br)CCBr)cc1 Amb22001093 [0,1,0,0,0,0|3,0,0]=4 1424 B12R1.16 FC(CCCl)c1ccc(Br)cc1 Amb27872465 [0,1,0,0,0,0|3,0,0]=4 1425 B12R1.16 N#CCC(N)c1ccc(Br)cc1 Amb18069916 [0,1,0,0,0,0|3,0,0]=4 1426 B12R1.16 N#CCC(N)c1ccc(Cl)cc1 Amb18564160 [0,1,0,0,0,0|3,0,0]=4 1427 B12R1.16 N#CCC(N)c1ccc(F)cc1 Amb18563605 [0,1,0,0,0,0|3,0,0]=4 1428 B12R1.16 N#CCC(N)c1ccc(I)cc1 Amb26472687 [0,1,0,0,0,0|3,0,0]=4 1429 B12R1.16 N#CCC(N)c1ccc(N)cc1 Amb27425195 [0,1,0,0,0,0|3,0,0]=4 1430 B12R1.16 N#CCC(N)c1ccc(O)cc1 Amb27425196 [0,1,0,0,0,0|3,0,0]=4 1431 B12R1.16 N#CCC(O)c1ccc(Br)cc1 Amb18134741 [0,1,0,0,0,0|3,0,0]=4 1432 B12R1.16 N#CCC(O)c1ccc(Cl)cc1 Amb597588 [0,1,0,0,0,0|3,0,0]=4 1433 B12R1.16 N#CCC(O)c1ccc(F)cc1 Amb17232518 [0,1,0,0,0,0|3,0,0]=4 1434 B12R1.16 N#CCC(O)c1ccc(I)cc1 Amb27658371 [0,1,0,0,0,0|3,0,0]=4 1435 B12R1.16 N#CCC(O)c1ccc(O)cc1 Amb33269075 [0,1,0,0,0,0|3,0,0]=4 1436 B12R1.16 N#CC[C@@H](N)c1ccc(Br)cc1 Amb27259370 [0,1,0,0,0,0|3,0,0]=4 1437 B12R1.16 N#CC[C@@H](N)c1ccc(I)cc1 Amb28252095 [0,1,0,0,0,0|3,0,0]=4 1438 B12R1.16 N#CC[C@@H](N)c1ccc(N)cc1 Amb27389232 [0,1,0,0,0,0|3,0,0]=4 1439 B12R1.16 N#CC[C@H](O)c1ccc(Cl)cc1 Amb27179708 [0,1,0,0,0,0|3,0,0]=4 1440 B12R1.16 NC(CCO)c1ccc(Br)cc1 Amb2683232 [0,1,0,0,0,0|3,0,0]=4 1441 B12R1.16 NC(CCO)c1ccc(Br)cc1 Amb8631678 [0,1,0,0,0,0|3,0,0]=4 1442 B12R1.16 NC(CCO)c1ccc(Cl)cc1 Amb19888463 [0,1,0,0,0,0|3,0,0]=4 1443 B12R1.16 NC(CCO)c1ccc(Cl)cc1 Amb1993959 [0,1,0,0,0,0|3,0,0]=4 1444 B12R1.16 NC(CCO)c1ccc(F)cc1 Amb2683230 [0,1,0,0,0,0|3,0,0]=4 1445 B12R1.16 NC(CCO)c1ccc(I)cc1 Amb28398110 [0,1,0,0,0,0|3,0,0]=4 1446 B12R1.16 NC(CCO)c1ccc(O)cc1 Amb27781361 [0,1,0,0,0,0|3,0,0]=4 1447 B12R1.16 NCCC(F)c1ccc(Br)cc1 Amb25255565 [0,1,0,0,0,0|3,0,0]=4 1448 B12R1.16 NCCC(F)c1ccc(Cl)cc1 Amb27756577 [0,1,0,0,0,0|3,0,0]=4 1449 B12R1.16 NCCC(F)c1ccc(F)cc1 Amb28062015 [0,1,0,0,0,0|3,0,0]=4 1450 B12R1.16 NCCC(F)c1ccc(O)cc1 Amb27481950 [0,1,0,0,0,0|3,0,0]=4 1451 B12R1.16 NCCC(N)c1ccc(O)cc1 Amb27850065 [0,1,0,0,0,0|3,0,0]=4 1452 B12R1.16 NCCC(O)c1ccc(Br)cc1 Amb17079141 [0,1,0,0,0,0|3,0,0]=4 1453 B12R1.16 NCCC(O)c1ccc(Cl)cc1 Amb17079140 [0,1,0,0,0,0|3,0,0]=4 1454 B12R1.16 NCCC(O)c1ccc(Cl)cc1 Amb21984559 [0,1,0,0,0,0|3,0,0]=4 1455 B12R1.16 NCCC(O)c1ccc(F)cc1 Amb17079139 [0,1,0,0,0,0|3,0,0]=4 1456 B12R1.16 NCCC(O)c1ccc(F)cc1 Amb21984558 [0,1,0,0,0,0|3,0,0]=4 1457 B12R1.16 NCCC(O)c1ccc(I)cc1 Amb27187555 [0,1,0,0,0,0|3,0,0]=4 1458 B12R1.16 NCCC(O)c1ccc(O)cc1 Amb18251886 [0,1,0,0,0,0|3,0,0]=4 1459 B12R1.16 NCC[C@@H](N)c1ccc(I)cc1 Amb27880603 [0,1,0,0,0,0|3,0,0]=4 1460 B12R1.16 NCC[C@@H](O)c1ccc(Br)cc1 Amb33451500 [0,1,0,0,0,0|3,0,0]=4 1461 B12R1.16 NCC[C@@H](O)c1ccc(Cl)cc1 Amb28240508 [0,1,0,0,0,0|3,0,0]=4 1462 B12R1.16 NCC[C@@H](O)c1ccc(F)cc1 Amb25148762 [0,1,0,0,0,0|3,0,0]=4 1463 B12R1.16 NCC[C@@H](O)c1ccc(O)cc1 Amb33269541 [0,1,0,0,0,0|3,0,0]=4 1464 B12R1.16 NCC[C@H](N)c1ccc(Cl)cc1 Amb28196691 [0,1,0,0,0,0|3,0,0]=4 1465 B12R1.16 NCC[C@H](N)c1ccc(I)cc1 Amb27629698 [0,1,0,0,0,0|3,0,0]=4 1466 B12R1.16 NCC[C@H](O)c1ccc(Br)cc1 Amb33451906 [0,1,0,0,0,0|3,0,0]=4 1467 B12R1.16 NCC[C@H](O)c1ccc(Cl)cc1 Amb24727053 [0,1,0,0,0,0|3,0,0]=4 1468 B12R1.16 NCC[C@H](O)c1ccc(F)cc1 Amb25148765 [0,1,0,0,0,0|3,0,0]=4 1469 B12R1.16 NCC[C@H](O)c1ccc(O)cc1 Amb33269539 [0,1,0,0,0,0|3,0,0]=4 1470 B12R1.16 NNCC(O)c1ccc(Br)cc1 Amb17249280 [0,1,0,0,0,0|2,0,0]=3 1471 B12R1.16 NNCC(O)c1ccc(Cl)cc1 Amb17234362 [0,1,0,0,0,0|2,0,0]=3 1472 B12R1.16 NNCC(O)c1ccc(F)cc1 Amb17232743 [0,1,0,0,0,0|2,0,0]=3 1473 B12R1.16 NOCC(O)c1ccc(Br)cc1 Amb17345008 [0,1,0,0,0,0|3,0,0]=4 1474 B12R1.16 NOCC(O)c1ccc(Cl)cc1 Amb17335950 [0,1,0,0,0,0|3,0,0]=4 1475 B12R1.16 NOCC(O)c1ccc(F)cc1 Amb17334839 [0,1,0,0,0,0|3,0,0]=4 1476 B12R1.16 N[C@@H](CCO)c1ccc(Br)cc1 Amb8631672 [0,1,0,0,0,0|3,0,0]=4 1477 B12R1.16 N[C@@H](CCO)c1ccc(Cl)cc1 Amb19888405 [0,1,0,0,0,0|3,0,0]=4 1478 B12R1.16 N[C@@H](CCO)c1ccc(Cl)cc1 Amb22747365 [0,1,0,0,0,0|3,0,0]=4 1479 B12R1.16 N[C@@H](CCO)c1ccc(F)cc1 Amb19888378 [0,1,0,0,0,0|3,0,0]=4 1480 B12R1.16 N[C@@H](CCO)c1ccc(O)cc1 Amb24446583 [0,1,0,0,0,0|3,0,0]=4 1481 B12R1.16 N[C@@H](CCO)c1ccc(S)cc1 Amb27413141 [0,1,0,0,0,0|3,0,0]=4 1482 B12R1.16 N[C@H](CCO)c1ccc(Br)cc1 Amb19887638 [0,1,0,0,0,0|3,0,0]=4 1483 B12R1.16 N[C@H](CCO)c1ccc(Cl)cc1 Amb19887657 [0,1,0,0,0,0|3,0,0]=4 1484 B12R1.16 N[C@H](CCO)c1ccc(F)cc1 Amb19887667 [0,1,0,0,0,0|3,0,0]=4 1485 B12R1.16 Nc1ccc(C(N)CCO)cc1 Amb19887602 [0,1,0,0,0,0|3,0,0]=4 1486 B12R1.16 Nc1ccc(C(N)CCO)cc1 Amb8631339 [0,1,0,0,0,0|3,0,0]=4 1487 B12R1.16 Nc1ccc([C@@H](N)CCO)cc1 Amb31289320 [0,1,0,0,0,0|3,0,0]=4 1488 B12R1.16 Nc1ccc([C@@H](N)CCO)cc1 Amb8631338 [0,1,0,0,0,0|3,0,0]=4 1489 B12R1.16 O=CCC(O)c1ccc(I)cc1 Amb27954814 [0,1,0,0,0,0|3,0,0]=4 1490 B12R1.16 O=CC[C@@H](O)c1ccc(Cl)cc1 Amb27770788 [0,1,0,0,0,0|3,0,0]=4 1491 B12R1.16 O=NCC(Cl)c1ccc(F)cc1 Amb28385616 [0,1,0,0,0,0|2,0,1]=4 1492 B12R1.16 OC(CCBr)c1ccc(Br)cc1 Amb32676367 [0,1,0,0,0,0|3,0,0]=4 1493 B12R1.16 OC(CCBr)c1ccc(Cl)cc1 Amb32676368 [0,1,0,0,0,0|3,0,0]=4 1494 B12R1.16 OC(CCBr)c1ccc(F)cc1 Amb32676369 [0,1,0,0,0,0|3,0,0]=4 1495 B12R1.16 OC(CCCl)c1ccc(Br)cc1 Amb17196599 [0,1,0,0,0,0|3,0,0]=4 1496 B12R1.16 OC(CCCl)c1ccc(Cl)cc1 Amb17194897 [0,1,0,0,0,0|3,0,0]=4 1497 B12R1.16 OC(CCCl)c1ccc(F)cc1 Amb17194592 [0,1,0,0,0,0|3,0,0]=4 1498 B12R1.16 OC(CCI)c1ccc(F)cc1 Amb24537939 [0,1,0,0,0,0|3,0,0]=4 1499 B12R1.16 OC(CCS)c1ccc(F)cc1 Amb28066032 [0,1,0,0,0,0|3,0,0]=4 1500 B12R1.16 OCCC(Cl)c1ccc(F)cc1 Amb27880878 [0,1,0,0,0,0|3,0,0]=4 1501 B12R1.16 OCCC(F)c1ccc(Br)cc1 Amb27491853 [0,1,0,0,0,0|3,0,0]=4 1502 B12R1.16 OCCC(F)c1ccc(Cl)cc1 Amb28188244 [0,1,0,0,0,0|3,0,0]=4 1503 B12R1.16 OCCC(O)c1ccc(Br)cc1 Amb18070318 [0,1,0,0,0,0|3,0,0]=4 1504 B12R1.16 OCCC(O)c1ccc(Cl)cc1 Amb18066186 [0,1,0,0,0,0|3,0,0]=4 1505 B12R1.16 OCCC(O)c1ccc(F)cc1 Amb18563926 [0,1,0,0,0,0|3,0,0]=4 1506 B12R1.16 ONCC(O)c1ccc(Br)cc1 Amb17345007 [0,1,0,0,0,0|2,0,0]=3 1507 B12R1.16 ONCC(O)c1ccc(Cl)cc1 Amb17335949 [0,1,0,0,0,0|2,0,0]=3 1508 B12R1.16 ONCC(O)c1ccc(F)cc1 Amb17334838 [0,1,0,0,0,0|2,0,0]=3 1509 B12R1.16 ONCC(O)c1ccc(O)cc1 Amb17334758 [0,1,0,0,0,0|2,0,0]=3 1510 B12R1.16 O[C@@H](CCCl)c1ccc(Cl)cc1 Amb27178138 [0,1,0,0,0,0|3,0,0]=4 1511 B12R1.16 O[C@@H](CCCl)c1ccc(F)cc1 Amb25073942 [0,1,0,0,0,0|3,0,0]=4 1512 B12R1.16 O[C@@H](CCI)c1ccc(F)cc1 Amb16233257 [0,1,0,0,0,0|3,0,0]=4 1513 B12R1.16 [C-]#[N+]CC(C)c1ccc(F)cc1 Amb33274138 [0,1,0,0,0,0|0,0,2]=3 1514 B12R1.16 [C-]#[N+]CC(F)c1ccc(C)cc1 Amb27481958 [0,1,0,0,0,0|1,0,2]=4 1515 B12R1.16 [C-]#[N+]CC(F)c1ccc(Cl)cc1 Amb28071580 [0,1,0,0,0,0|1,0,2]=4 1516 B12R1.16 [C-]#[N+]CC(F)c1ccc(O)cc1 Amb27958649 [0,1,0,0,0,0|1,0,2]=4 1517 B12R1.17 C#CCC(N)c1cccc(I)c1 Amb27480387 [0,1,0,0,0,0|2,0,1]=4 1518 B12R1.17 C#CCC(O)c1cccc(O)c1 Amb18117926 [0,1,0,0,0,0|2,0,1]=4 1519 B12R1.17 C#CC[C@@H](O)c1cccc(O)c1 Amb28126629 [0,1,0,0,0,0|2,0,1]=4 1520 B12R1.17 C=CCC(N)c1cccc(C)c1 Amb18977591 [0,1,0,0,0,0|2,0,1]=4 1521 B12R1.17 C=CCC(N)c1cccc(Cl)c1 Amb18292091 [0,1,0,0,0,0|2,0,1]=4 1522 B12R1.17 C=CCC(N)c1cccc(Cl)c1 Amb33623157 [0,1,0,0,0,0|2,0,1]=4 1523 B12R1.17 C=CCC(O)c1cccc(Br)c1 Amb2685396 [0,1,0,0,0,0|2,0,1]=4 1524 B12R1.17 C=CCC(O)c1cccc(C)c1 Amb18177788 [0,1,0,0,0,0|2,0,1]=4 1525 B12R1.17 C=CCC(O)c1cccc(Cl)c1 Amb2686331 [0,1,0,0,0,0|2,0,1]=4 1526 B12R1.17 C=CCC(O)c1cccc(F)c1 Amb18177817 [0,1,0,0,0,0|2,0,1]=4 1527 B12R1.17 C=CCC(O)c1cccc(I)c1 Amb27878433 [0,1,0,0,0,0|2,0,1]=4 1528 B12R1.17 C=CCN(C)c1cccc(C)c1 Amb27604925 [0,1,0,0,0,0|2,0,1]=4 1529 B12R1.17 C=CCN(C)c1cccc(F)c1 Amb28063447 [0,1,0,0,0,0|2,0,1]=4 1530 B12R1.17 C=CCN(C)c1cccc(N)c1 Amb27208329 [0,1,0,0,0,0|2,0,1]=4 1531 B12R1.17 C=CC[C@@H](N)c1cccc(F)c1 Amb27595583 [0,1,0,0,0,0|2,0,1]=4 1532 B12R1.17 C=CC[C@@H](N)c1cccc(O)c1 Amb27810779 [0,1,0,0,0,0|2,0,1]=4 1533 B12R1.17 C=CC[C@@H](O)c1cccc(C)c1 Amb27244794 [0,1,0,0,0,0|2,0,1]=4 1534 B12R1.17 C=CC[C@@H](O)c1cccc(Cl)c1 Amb27954584 [0,1,0,0,0,0|2,0,1]=4 1535 B12R1.17 C=CC[C@H](N)c1cccc(Br)c1 Amb25221639 [0,1,0,0,0,0|2,0,1]=4 1536 B12R1.17 C=CC[C@H](N)c1cccc(F)c1 Amb27170776 [0,1,0,0,0,0|2,0,1]=4 1537 B12R1.17 C=CC[C@H](N)c1cccc(N)c1 Amb27425199 [0,1,0,0,0,0|2,0,1]=4 1538 B12R1.17 C=CC[C@H](N)c1cccc(S)c1 Amb28146702 [0,1,0,0,0,0|2,0,1]=4 1539 B12R1.17 C=CC[C@H](O)c1cccc(Br)c1 Amb28399563 [0,1,0,0,0,0|2,0,1]=4 1540 B12R1.17 CC#CC(O)c1cccc(Br)c1 Amb27974839 [0,1,0,0,0,0|2,0,1]=4 1541 B12R1.17 CC#CC(O)c1cccc(Cl)c1 Amb27249762 [0,1,0,0,0,0|2,0,1]=4 1542 B12R1.17 CC#CC(O)c1cccc(F)c1 Amb27261472 [0,1,0,0,0,0|2,0,1]=4 1543 B12R1.17 CC(CC#N)c1cccc(Br)c1 Amb24645330 [0,1,0,0,0,0|2,0,0]=3 1544 B12R1.17 CC(CC#N)c1cccc(Cl)c1 Amb26040011 [0,1,0,0,0,0|2,0,0]=3 1545 B12R1.17 CC(CC#N)c1cccc(F)c1 Amb24732112 [0,1,0,0,0,0|2,0,0]=3 1546 B12R1.17 CC(CCN)c1cc(F)ccn1 Amb33415294 [0,1,0,0,0,0|3,0,0]=4 1547 B12R1.17 CC(CCN)c1cccc(Br)c1 Amb30021557 [0,1,0,0,0,0|2,0,0]=3 1548 B12R1.17 CC(CCN)c1cccc(Br)n1 Amb33432800 [0,1,0,0,0,0|3,0,0]=4 1549 B12R1.17 CC(CCN)c1cccc(Cl)c1 Amb17234051 [0,1,0,0,0,0|2,0,0]=3 1550 B12R1.17 CC(CCN)c1cccc(Cl)n1 Amb33223267 [0,1,0,0,0,0|3,0,0]=4 1551 B12R1.17 CC(CCN)c1cccc(F)c1 Amb17232650 [0,1,0,0,0,0|2,0,0]=3 1552 B12R1.17 CC(CCN)c1cccc(O)c1 Amb33311223 [0,1,0,0,0,0|2,0,0]=3 1553 B12R1.17 CC(CCN)c1cncc(Br)c1 Amb33389083 [0,1,0,0,0,0|3,0,0]=4 1554 B12R1.17 CC(CCN)c1cncc(F)c1 Amb25068199 [0,1,0,0,0,0|3,0,0]=4 1555 B12R1.17 CC(CCO)c1cccc(Cl)c1 Amb17234166 [0,1,0,0,0,0|2,0,0]=3 1556 B12R1.17 CC(CCO)c1cccc(F)c1 Amb17232674 [0,1,0,0,0,0|2,0,0]=3 1557 B12R1.17 CC(CON)c1cc(F)ccn1 Amb33320308 [0,1,0,0,0,0|3,0,0]=4 1558 B12R1.17 CC(CON)c1cccc(Br)c1 Amb33451596 [0,1,0,0,0,0|2,0,0]=3 1559 B12R1.17 CC(CON)c1cccc(Br)n1 Amb33433128 [0,1,0,0,0,0|3,0,0]=4 1560 B12R1.17 CC(CON)c1cccc(Cl)c1 Amb33223337 [0,1,0,0,0,0|2,0,0]=3 1561 B12R1.17 CC(CON)c1cccc(Cl)n1 Amb33222404 [0,1,0,0,0,0|3,0,0]=4 1562 B12R1.17 CC(CON)c1cccc(F)c1 Amb33316038 [0,1,0,0,0,0|2,0,0]=3 1563 B12R1.17 CC(CON)c1cccc(O)c1 Amb33310967 [0,1,0,0,0,0|2,0,0]=3 1564 B12R1.17 CC(CON)c1cncc(Br)c1 Amb33389578 [0,1,0,0,0,0|3,0,0]=4 1565 B12R1.17 CC(CON)c1cncc(F)c1 Amb33480696 [0,1,0,0,0,0|3,0,0]=4 1566 B12R1.17 CC(N=C=O)c1cccc(Br)c1 Amb25045945 [0,1,0,0,0,0|3,0,0]=4 1567 B12R1.17 CC(N=C=O)c1cccc(Cl)c1 Amb25189503 [0,1,0,0,0,0|3,0,0]=4 1568 B12R1.17 CC(N=C=O)c1cccc(F)c1 Amb25782325 [0,1,0,0,0,0|3,0,0]=4 1569 B12R1.17 CC(N=C=S)c1cccc(F)c1 Amb18796432 [0,1,0,0,0,0|3,0,0]=4 1570 B12R1.17 CC(N=[N+]=[N-])c1cccc(Cl)c1 Amb28382299 [0,1,0,0,0,0|2,0,1]=4 1571 B12R1.17 CC(NC#N)c1cccc(F)c1 Amb18800783 [0,1,0,0,0,0|3,0,0]=4 1572 B12R1.17 CC(NC=O)c1cccc(Br)c1 Amb28396418 [0,1,0,0,0,0|3,0,0]=4 1573 B12R1.17 CCCC(=O)c1cccc(Br)c1 Amb17193987 [0,1,0,0,0,0|2,0,1]=4 1574 B12R1.17 CCCC(=O)c1cccc(C)c1 Amb3940677 [0,1,0,0,0,0|2,0,1]=4 1575 B12R1.17 CCCC(=O)c1cccc(Cl)c1 Amb17198744 [0,1,0,0,0,0|2,0,1]=4 1576 B12R1.17 CCCC(=O)c1cccc(F)c1 Amb17232581 [0,1,0,0,0,0|2,0,1]=4 1577 B12R1.17 CCCC(=O)c1cccc(N)c1 Amb33548311 [0,1,0,0,0,0|2,0,1]=4 1578 B12R1.17 CCCC(C)c1cccc(O)c1 Amb27229592 [0,1,0,0,0,0|1,0,0]=2 1579 B12R1.17 CCCC(C)c1ccnc(N)c1 Amb27803952 [0,1,0,0,0,0|2,0,0]=3 1580 B12R1.17 CCCC(C)c1cncc(O)c1 Amb32669515 [0,1,0,0,0,0|2,0,0]=3 1581 B12R1.17 CCCC(C)c1nccc(F)n1 Amb29883728 [0,1,0,0,0,0|3,0,0]=4 1582 B12R1.17 CCCC(Cl)c1cccc(Br)c1 Amb29880680 [0,1,0,0,0,0|2,0,0]=3 1583 B12R1.17 CCCC(Cl)c1cccc(Cl)c1 Amb27656221 [0,1,0,0,0,0|2,0,0]=3 1584 B12R1.17 CCCC(N)c1cc(I)ccn1 Amb27644671 [0,1,0,0,0,0|3,0,0]=4 1585 B12R1.17 CCCC(N)c1cccc(Br)c1 Amb28240805 [0,1,0,0,0,0|2,0,0]=3 1586 B12R1.17 CCCC(N)c1cccc(C)c1 Amb17232449 [0,1,0,0,0,0|2,0,0]=3 1587 B12R1.17 CCCC(N)c1cccc(C)c1 Amb32662396 [0,1,0,0,0,0|2,0,0]=3 1588 B12R1.17 CCCC(N)c1cccc(C)n1 Amb18828650 [0,1,0,0,0,0|3,0,0]=4 1589 B12R1.17 CCCC(N)c1cccc(Cl)c1 Amb17234050 [0,1,0,0,0,0|2,0,0]=3 1590 B12R1.17 CCCC(N)c1cccc(F)c1 Amb17232649 [0,1,0,0,0,0|2,0,0]=3 1591 B12R1.17 CCCC(N)c1cccc(F)c1 Amb30982493 [0,1,0,0,0,0|2,0,0]=3 1592 B12R1.17 CCCC(N)c1cccc(F)n1 Amb18199297 [0,1,0,0,0,0|3,0,0]=4 1593 B12R1.17 CCCC(N)c1cccc(I)c1 Amb27209580 [0,1,0,0,0,0|2,0,0]=3 1594 B12R1.17 CCCC(N)c1cccc(N)c1 Amb25891904 [0,1,0,0,0,0|2,0,0]=3 1595 B12R1.17 CCCC(N)c1cccc(O)n1 Amb28040881 [0,1,0,0,0,0|3,0,0]=4 1596 B12R1.17 CCCC(N)c1ccnc(Br)c1 Amb28411693 [0,1,0,0,0,0|3,0,0]=4 1597 B12R1.17 CCCC(N)c1ccnc(F)c1 Amb27596105 [0,1,0,0,0,0|3,0,0]=4 1598 B12R1.17 CCCC(N)c1ccnc(N)c1 Amb27872124 [0,1,0,0,0,0|3,0,0]=4 1599 B12R1.17 CCCC(N)c1cncc(F)c1 Amb18978747 [0,1,0,0,0,0|3,0,0]=4 1600 B12R1.17 CCCC(O)c1cc(C)ccn1 Amb24425208 [0,1,0,0,0,0|3,0,0]=4 1601 B12R1.17 CCCC(O)c1ccc[n+]([O-])c1 Amb4010118 [0,1,0,0,0,0|3,0,0]=4 1602 B12R1.17 CCCC(O)c1cccc(Br)c1 Amb17248424 [0,1,0,0,0,0|2,0,0]=3 1603 B12R1.17 CCCC(O)c1cccc(C)c1 Amb17232484 [0,1,0,0,0,0|2,0,0]=3 1604 B12R1.17 CCCC(O)c1cccc(Cl)c1 Amb17234155 [0,1,0,0,0,0|2,0,0]=3 1605 B12R1.17 CCCC(O)c1cccc(F)c1 Amb17232673 [0,1,0,0,0,0|2,0,0]=3 1606 B12R1.17 CCCC(O)c1cccc(N)n1 Amb35743352 [0,1,0,0,0,0|3,0,0]=4 1607 B12R1.17 CCCC(O)c1cncc(Br)c1 Amb27396365 [0,1,0,0,0,0|3,0,0]=4 1608 B12R1.17 CCCN(C)c1cc(Br)ccn1 Amb28184932 [0,1,0,0,0,0|3,0,0]=4 1609 B12R1.17 CCCN(C)c1cc(C)ccn1 Amb27665095 [0,1,0,0,0,0|3,0,0]=4 1610 B12R1.17 CCCN(C)c1cc(N)ccn1 Amb18981480 [0,1,0,0,0,0|3,0,0]=4 1611 B12R1.17 CCCN(C)c1cccc(Br)n1 Amb27790601 [0,1,0,0,0,0|3,0,0]=4 1612 B12R1.17 CCCN(C)c1cccc(F)n1 Amb18177870 [0,1,0,0,0,0|3,0,0]=4 1613 B12R1.17 CCCN(C)c1ccnc(C)c1 Amb28207107 [0,1,0,0,0,0|3,0,0]=4 1614 B12R1.17 CCCN(C)c1ccnc(Cl)c1 Amb28366069 [0,1,0,0,0,0|3,0,0]=4 1615 B12R1.17 CCCN(C)c1cncc(N)c1 Amb27832876 [0,1,0,0,0,0|3,0,0]=4 1616 B12R1.17 CCCS(=O)c1cccc(N)c1 Amb27258884 [0,1,0,0,0,0|3,0,0]=4 1617 B12R1.17 CCC[C@@H](N)c1cccc(Br)n1 Amb27389222 [0,1,0,0,0,0|3,0,0]=4 1618 B12R1.17 CCC[C@@H](N)c1cccc(I)c1 Amb27814307 [0,1,0,0,0,0|2,0,0]=3 1619 B12R1.17 CCC[C@@H](N)c1cncc(Br)c1 Amb27871457 [0,1,0,0,0,0|3,0,0]=4 1620 B12R1.17 CCC[C@@H](N)c1cncc(Cl)c1 Amb27413079 [0,1,0,0,0,0|3,0,0]=4 1621 B12R1.17 CCC[C@@H](N)c1cncc(F)c1 Amb28314221 [0,1,0,0,0,0|3,0,0]=4 1622 B12R1.17 CCC[C@@H](N)c1cncc(N)c1 Amb28289918 [0,1,0,0,0,0|3,0,0]=4 1623 B12R1.17 CCC[C@@H](O)c1cc(C)ccn1 Amb25048748 [0,1,0,0,0,0|3,0,0]=4 1624 B12R1.17 CCC[C@@H](O)c1cccc(Br)c1 Amb27176217 [0,1,0,0,0,0|2,0,0]=3 1625 B12R1.17 CCC[C@@H](O)c1cccc(C)n1 Amb27614634 [0,1,0,0,0,0|3,0,0]=4 1626 B12R1.17 CCC[C@@H](O)c1cccc(F)c1 Amb28138837 [0,1,0,0,0,0|2,0,0]=3 1627 B12R1.17 CCC[C@H](N)c1cc(Br)ccn1 Amb27870781 [0,1,0,0,0,0|3,0,0]=4 1628 B12R1.17 CCC[C@H](N)c1cc(Cl)ccn1 Amb27243945 [0,1,0,0,0,0|3,0,0]=4 1629 B12R1.17 CCC[C@H](N)c1cc(I)ccn1 Amb27402524 [0,1,0,0,0,0|3,0,0]=4 1630 B12R1.17 CCC[C@H](N)c1cc(N)ccn1 Amb27389122 [0,1,0,0,0,0|3,0,0]=4 1631 B12R1.17 CCC[C@H](N)c1cccc(C)c1 Amb28313719 [0,1,0,0,0,0|2,0,0]=3 1632 B12R1.17 CCC[C@H](N)c1cccc(Cl)c1 Amb28346844 [0,1,0,0,0,0|2,0,0]=3 1633 B12R1.17 CCC[C@H](N)c1cccc(Cl)n1 Amb27413078 [0,1,0,0,0,0|3,0,0]=4 1634 B12R1.17 CCC[C@H](N)c1cccc(F)c1 Amb27626030 [0,1,0,0,0,0|2,0,0]=3 1635 B12R1.17 CCC[C@H](N)c1cccc(N)c1 Amb28255487 [0,1,0,0,0,0|2,0,0]=3 1636 B12R1.17 CCC[C@H](N)c1cncc(F)c1 Amb27786356 [0,1,0,0,0,0|3,0,0]=4 1637 B12R1.17 CCC[C@H](O)c1cc(C)ccn1 Amb25848810 [0,1,0,0,0,0|3,0,0]=4 1638 B12R1.17 CCC[C@H](O)c1cccc(Cl)c1 Amb27826760 [0,1,0,0,0,0|2,0,0]=3 1639 B12R1.17 CCNC(C)c1cc(C)ccn1 Amb27470438 [0,1,0,0,0,0|3,0,0]=4 1640 B12R1.17 CCNC(C)c1cccc(Br)c1 Amb6258594 [0,1,0,0,0,0|2,0,0]=3 1641 B12R1.17 CCNC(C)c1cccc(C)n1 Amb27600611 [0,1,0,0,0,0|3,0,0]=4 1642 B12R1.17 CCNC(C)c1cccc(Cl)c1 Amb6258034 [0,1,0,0,0,0|2,0,0]=3 1643 B12R1.17 CCNC(C)c1cccc(F)c1 Amb6269871 [0,1,0,0,0,0|2,0,0]=3 1644 B12R1.17 CCNC(C)c1cccc(O)c1 Amb6266939 [0,1,0,0,0,0|2,0,0]=3 1645 B12R1.17 CCNC(C)c1cccc(O)c1 Amb7969803 [0,1,0,0,0,0|2,0,0]=3 1646 B12R1.17 CCNC(C)c1cccc(O)n1 Amb35733805 [0,1,0,0,0,0|3,0,0]=4 1647 B12R1.17 CCNC(C)c1ccnc(Cl)c1 Amb27615319 [0,1,0,0,0,0|3,0,0]=4 1648 B12R1.17 CCNC(C)c1cncc(C)c1 Amb27748440 [0,1,0,0,0,0|3,0,0]=4 1649 B12R1.17 CCNC(C)c1cncc(Cl)c1 Amb27414504 [0,1,0,0,0,0|3,0,0]=4 1650 B12R1.17 CCNC(C)c1cncc(F)c1 Amb18978755 [0,1,0,0,0,0|3,0,0]=4 1651 B12R1.17 CCNC(C)c1cncc(O)c1 Amb35669884 [0,1,0,0,0,0|3,0,0]=4 1652 B12R1.17 CCN[C@H](C)c1cccc(F)c1 Amb27263944 [0,1,0,0,0,0|2,0,0]=3 1653 B12R1.17 CCN[C@H](C)c1cccc(O)c1 Amb28206952 [0,1,0,0,0,0|2,0,0]=3 1654 B12R1.17 CCOC(C)c1cccc(N)c1 Amb18973987 [0,1,0,0,0,0|2,0,0]=3 1655 B12R1.17 CCSC(C)c1cccc(F)c1 Amb27790121 [0,1,0,0,0,0|2,0,0]=3 1656 B12R1.17 CN(CC#N)c1cccc(Br)c1 Amb17343207 [0,1,0,0,0,0|3,0,0]=4 1657 B12R1.17 CN(CC#N)c1cccc(Cl)c1 Amb17335464 [0,1,0,0,0,0|3,0,0]=4 1658 B12R1.17 CN(CC#N)c1cccc(F)c1 Amb17334604 [0,1,0,0,0,0|3,0,0]=4 1659 B12R1.17 CN(CC#N)c1cccc(O)c1 Amb28281647 [0,1,0,0,0,0|3,0,0]=4 1660 B12R1.17 CN(CCCl)c1cccc(Br)c1 Amb17351920 [0,1,0,0,0,0|3,0,0]=4 1661 B12R1.17 CN(CCCl)c1cccc(Cl)c1 Amb17338056 [0,1,0,0,0,0|3,0,0]=4 1662 B12R1.17 CN(CCCl)c1cccc(F)c1 Amb17335953 [0,1,0,0,0,0|3,0,0]=4 1663 B12R1.17 CN(CCF)c1cccc(N)c1 Amb27614743 [0,1,0,0,0,0|3,0,0]=4 1664 B12R1.17 CN(CCN)c1cccc(Br)c1 Amb17059773 [0,1,0,0,0,0|3,0,0]=4 1665 B12R1.17 CN(CCN)c1cccc(Cl)c1 Amb17059646 [0,1,0,0,0,0|3,0,0]=4 1666 B12R1.17 CN(CCN)c1cccc(F)c1 Amb17059643 [0,1,0,0,0,0|3,0,0]=4 1667 B12R1.17 CN(CCO)c1cccc(Br)c1 Amb17344452 [0,1,0,0,0,0|3,0,0]=4 1668 B12R1.17 CN(CCO)c1cccc(Cl)c1 Amb17335811 [0,1,0,0,0,0|3,0,0]=4 1669 B12R1.17 CN(CCO)c1cccc(F)c1 Amb17334765 [0,1,0,0,0,0|3,0,0]=4 1670 B12R1.17 CNCC(=O)c1cc(C)ccn1 Amb33318413 [0,1,0,0,0,0|2,0,1]=4 1671 B12R1.17 CNCC(=O)c1cc(Cl)ccn1 Amb24653655 [0,1,0,0,0,0|2,0,1]=4 1672 B12R1.17 CNCC(=O)c1cc(F)ccn1 Amb33415289 [0,1,0,0,0,0|2,0,1]=4 1673 B12R1.17 CNCC(=O)c1cccc(Br)c1 Amb17315041 [0,1,0,0,0,0|1,0,1]=3 1674 B12R1.17 CNCC(=O)c1cccc(Br)n1 Amb33432804 [0,1,0,0,0,0|2,0,1]=4 1675 B12R1.17 CNCC(=O)c1cccc(C)c1 Amb18862586 [0,1,0,0,0,0|1,0,1]=3 1676 B12R1.17 CNCC(=O)c1cccc(C)n1 Amb33200738 [0,1,0,0,0,0|2,0,1]=4 1677 B12R1.17 CNCC(=O)c1cccc(Cl)c1 Amb18863066 [0,1,0,0,0,0|1,0,1]=3 1678 B12R1.17 CNCC(=O)c1cccc(Cl)n1 Amb33223284 [0,1,0,0,0,0|2,0,1]=4 1679 B12R1.17 CNCC(=O)c1cccc(F)c1 Amb18862706 [0,1,0,0,0,0|1,0,1]=3 1680 B12R1.17 CNCC(=O)c1cccc(N)c1 Amb18051532 [0,1,0,0,0,0|1,0,1]=3 1681 B12R1.17 CNCC(=O)c1cccc(O)c1 Amb16231895 [0,1,0,0,0,0|1,0,1]=3 1682 B12R1.17 CNCC(=O)c1cccc(O)c1 Amb17619313 [0,1,0,0,0,0|1,0,1]=3 1683 B12R1.17 CNCC(=O)c1cccc(O)c1 Amb18646278 [0,1,0,0,0,0|1,0,1]=3 1684 B12R1.17 CNCC(=O)c1ccnc(C)c1 Amb33268226 [0,1,0,0,0,0|2,0,1]=4 1685 B12R1.17 CNCC(=O)c1cncc(Br)c1 Amb33389078 [0,1,0,0,0,0|2,0,1]=4 1686 B12R1.17 CNCC(=O)c1cncc(C)c1 Amb25041572 [0,1,0,0,0,0|2,0,1]=4 1687 B12R1.17 CNCC(=O)c1cncc(F)c1 Amb28313591 [0,1,0,0,0,0|2,0,1]=4 1688 B12R1.17 CNCC(C)c1cccc(Br)c1 Amb28454540 [0,1,0,0,0,0|0,0,0]=1 1689 B12R1.17 CNCC(C)c1cccc(Cl)c1 Amb27836338 [0,1,0,0,0,0|0,0,0]=1 1690 B12R1.17 CNCC(C)c1cccc(F)c1 Amb27770263 [0,1,0,0,0,0|0,0,0]=1 1691 B12R1.17 CNCC(C)c1cccc(N)c1 Amb33071780 [0,1,0,0,0,0|0,0,0]=1 1692 B12R1.17 CNCC(C)c1nccc(O)n1 Amb33189041 [0,1,0,0,0,0|2,0,0]=3 1693 B12R1.17 CNCC(Cl)c1cccc(O)c1 Amb27983837 [0,1,0,0,0,0|1,0,0]=2 1694 B12R1.17 CNCC(N)c1cccc(C)c1 Amb33229799 [0,1,0,0,0,0|1,0,0]=2 1695 B12R1.17 CNCC(N)c1cccc(O)c1 Amb27223878 [0,1,0,0,0,0|1,0,0]=2 1696 B12R1.17 CNCC(O)c1cc(C)ccn1 Amb33318415 [0,1,0,0,0,0|2,0,0]=3 1697 B12R1.17 CNCC(O)c1cc(F)ccn1 Amb33415290 [0,1,0,0,0,0|2,0,0]=3 1698 B12R1.17 CNCC(O)c1cccc(Br)c1 Amb17142607 [0,1,0,0,0,0|1,0,0]=2 1699 B12R1.17 CNCC(O)c1cccc(Br)n1 Amb33432802 [0,1,0,0,0,0|2,0,0]=3 1700 B12R1.17 CNCC(O)c1cccc(C)c1 Amb5750896 [0,1,0,0,0,0|1,0,0]=2 1701 B12R1.17 CNCC(O)c1cccc(C)n1 Amb27209524 [0,1,0,0,0,0|2,0,0]=3 1702 B12R1.17 CNCC(O)c1cccc(Cl)c1 Amb5750902 [0,1,0,0,0,0|1,0,0]=2 1703 B12R1.17 CNCC(O)c1cccc(Cl)n1 Amb33223281 [0,1,0,0,0,0|2,0,0]=3 1704 B12R1.17 CNCC(O)c1cccc(F)c1 Amb18289718 [0,1,0,0,0,0|1,0,0]=2 1705 B12R1.17 CNCC(O)c1cccc(N)c1 Amb17594135 [0,1,0,0,0,0|1,0,0]=2 1706 B12R1.17 CNCC(O)c1cccc(O)c1 Amb532942 [0,1,0,0,0,0|1,0,0]=2 1707 B12R1.17 CNCC(O)c1ccnc(C)c1 Amb33268228 [0,1,0,0,0,0|2,0,0]=3 1708 B12R1.17 CNCC(O)c1cncc(Br)c1 Amb23586082 [0,1,0,0,0,0|2,0,0]=3 1709 B12R1.17 CNCC(O)c1cncc(C)c1 Amb26351556 [0,1,0,0,0,0|2,0,0]=3 1710 B12R1.17 CNCC(O)c1cncc(F)c1 Amb25787544 [0,1,0,0,0,0|2,0,0]=3 1711 B12R1.17 CNC[C@@H](O)c1cccc(F)c1 Amb27232737 [0,1,0,0,0,0|1,0,0]=2 1712 B12R1.17 CNC[C@@H](O)c1cccc(O)c1 Amb16231685 [0,1,0,0,0,0|1,0,0]=2 1713 B12R1.17 CNC[C@@H](O)c1cccc(O)c1 Amb19133645 [0,1,0,0,0,0|1,0,0]=2 1714 B12R1.17 CNC[C@H](O)c1cccc(F)c1 Amb28118835 [0,1,0,0,0,0|1,0,0]=2 1715 B12R1.17 CNC[C@H](O)c1cccc(O)c1 Amb22168059 [0,1,0,0,0,0|1,0,0]=2 1716 B12R1.17 CNC[C@H](O)c1cccc(O)c1 Amb3940531 [0,1,0,0,0,0|1,0,0]=2 1717 B12R1.17 CNC[C@H](O)c1cccc(O)c1 Amb8514350 [0,1,0,0,0,0|1,0,0]=2 1718 B12R1.17 CN\N=C(\C)c1cccc(F)c1 Amb28065760 [0,1,0,0,0,0|1,0,1]=3 1719 B12R1.17 COCC(=O)c1cccc(C)c1 Amb9665971 [0,1,0,0,0,0|2,0,1]=4 1720 B12R1.17 COCC(=O)c1cccc(Cl)c1 Amb9665994 [0,1,0,0,0,0|2,0,1]=4 1721 B12R1.17 COCC(C)c1nccc(F)n1 Amb35627099 [0,1,0,0,0,0|3,0,0]=4 1722 B12R1.17 COCC(N)c1cc(F)ccn1 Amb28078951 [0,1,0,0,0,0|3,0,0]=4 1723 B12R1.17 COCC(N)c1cc(N)ccn1 Amb27168702 [0,1,0,0,0,0|3,0,0]=4 1724 B12R1.17 COCC(N)c1cccc(Br)c1 Amb26539591 [0,1,0,0,0,0|2,0,0]=3 1725 B12R1.17 COCC(N)c1cccc(Cl)c1 Amb18983032 [0,1,0,0,0,0|2,0,0]=3 1726 B12R1.17 COCC(N)c1cccc(Cl)n1 Amb27473267 [0,1,0,0,0,0|3,0,0]=4 1727 B12R1.17 COCC(N)c1cccc(O)n1 Amb27184534 [0,1,0,0,0,0|3,0,0]=4 1728 B12R1.17 COCC(N)c1ccnc(O)c1 Amb27595564 [0,1,0,0,0,0|3,0,0]=4 1729 B12R1.17 COCC(N)c1cncc(Cl)c1 Amb27596521 [0,1,0,0,0,0|3,0,0]=4 1730 B12R1.17 COCC(O)c1cccc(Br)c1 Amb28460964 [0,1,0,0,0,0|2,0,0]=3 1731 B12R1.17 COCC(O)c1cccc(C)c1 Amb18792769 [0,1,0,0,0,0|2,0,0]=3 1732 B12R1.17 COCC(O)c1cccc(C)n1 Amb27969909 [0,1,0,0,0,0|3,0,0]=4 1733 B12R1.17 COCC(O)c1cccc(I)c1 Amb27840725 [0,1,0,0,0,0|2,0,0]=3 1734 B12R1.17 COCC(O)c1cccc(N)c1 Amb13952267 [0,1,0,0,0,0|2,0,0]=3 1735 B12R1.17 COCC(O)c1cccc(N)n1 Amb35743463 [0,1,0,0,0,0|3,0,0]=4 1736 B12R1.17 COCC(O)c1ccnc(Cl)c1 Amb27173945 [0,1,0,0,0,0|3,0,0]=4 1737 B12R1.17 COCC(O)c1cncc(Br)c1 Amb27389209 [0,1,0,0,0,0|3,0,0]=4 1738 B12R1.17 COCC(O)c1cncc(F)c1 Amb18180316 [0,1,0,0,0,0|3,0,0]=4 1739 B12R1.17 COC[C@@H](N)c1cc(C)ccn1 Amb27874124 [0,1,0,0,0,0|3,0,0]=4 1740 B12R1.17 COC[C@@H](N)c1cccc(C)c1 Amb28140107 [0,1,0,0,0,0|2,0,0]=3 1741 B12R1.17 COC[C@@H](N)c1cccc(Cl)n1 Amb27476344 [0,1,0,0,0,0|3,0,0]=4 1742 B12R1.17 COC[C@@H](N)c1cccc(I)c1 Amb27200280 [0,1,0,0,0,0|2,0,0]=3 1743 B12R1.17 COC[C@@H](N)c1cccc(S)c1 Amb27173664 [0,1,0,0,0,0|2,0,0]=3 1744 B12R1.17 COC[C@@H](N)c1ccnc(C)c1 Amb27810857 [0,1,0,0,0,0|3,0,0]=4 1745 B12R1.17 COC[C@@H](N)c1ccnc(F)c1 Amb27173663 [0,1,0,0,0,0|3,0,0]=4 1746 B12R1.17 COC[C@@H](N)c1ccnc(N)c1 Amb27494100 [0,1,0,0,0,0|3,0,0]=4 1747 B12R1.17 COC[C@@H](N)c1ccnc(O)c1 Amb28340970 [0,1,0,0,0,0|3,0,0]=4 1748 B12R1.17 COC[C@@H](N)c1cncc(F)c1 Amb28364904 [0,1,0,0,0,0|3,0,0]=4 1749 B12R1.17 COC[C@@H](N)c1cncc(O)c1 Amb28314269 [0,1,0,0,0,0|3,0,0]=4 1750 B12R1.17 COC[C@H](N)c1cc(C)ccn1 Amb28324614 [0,1,0,0,0,0|3,0,0]=4 1751 B12R1.17 COC[C@H](N)c1cccc(Br)c1 Amb27614746 [0,1,0,0,0,0|2,0,0]=3 1752 B12R1.17 COC[C@H](N)c1cccc(Cl)n1 Amb27453549 [0,1,0,0,0,0|3,0,0]=4 1753 B12R1.17 COC[C@H](N)c1cccc(F)c1 Amb28314321 [0,1,0,0,0,0|2,0,0]=3 1754 B12R1.17 COC[C@H](N)c1cccc(F)n1 Amb27461292 [0,1,0,0,0,0|3,0,0]=4 1755 B12R1.17 COC[C@H](N)c1cccc(O)c1 Amb27950844 [0,1,0,0,0,0|2,0,0]=3 1756 B12R1.17 COC[C@H](N)c1ccnc(Br)c1 Amb28385050 [0,1,0,0,0,0|3,0,0]=4 1757 B12R1.17 COC[C@H](N)c1cncc(C)c1 Amb27860397 [0,1,0,0,0,0|3,0,0]=4 1758 B12R1.17 CONC(C)c1cccc(C)c1 Amb28324975 [0,1,0,0,0,0|2,0,0]=3 1759 B12R1.17 CONC(C)c1cccc(Cl)c1 Amb27862192 [0,1,0,0,0,0|2,0,0]=3 1760 B12R1.17 CONC(C)c1cncc(Br)c1 Amb35702505 [0,1,0,0,0,0|3,0,0]=4 1761 B12R1.17 CO\N=C(\C)c1cccc(Br)c1 Amb27190646 [0,1,0,0,0,0|2,0,1]=4 1762 B12R1.17 CO\N=C(\C)c1cccc(Cl)c1 Amb27804711 [0,1,0,0,0,0|2,0,1]=4 1763 B12R1.17 CO\N=C(\C)c1cccc(F)c1 Amb27833435 [0,1,0,0,0,0|2,0,1]=4 1764 B12R1.17 CO\N=C(\C)c1cccc(N)c1 Amb28044905 [0,1,0,0,0,0|2,0,1]=4 1765 B12R1.17 CO\N=C(\C)c1cccc(O)c1 Amb27178904 [0,1,0,0,0,0|2,0,1]=4 1766 B12R1.17 CSCC(=O)c1cccc(Br)c1 Amb25149784 [0,1,0,0,0,0|2,0,1]=4 1767 B12R1.17 CSCC(=O)c1cccc(C)c1 Amb18796323 [0,1,0,0,0,0|2,0,1]=4 1768 B12R1.17 CSCC(=O)c1cccc(Cl)c1 Amb18320097 [0,1,0,0,0,0|2,0,1]=4 1769 B12R1.17 CSCC(=O)c1cccc(F)c1 Amb19057446 [0,1,0,0,0,0|2,0,1]=4 1770 B12R1.17 CSCC(=O)c1cccc(I)c1 Amb27866073 [0,1,0,0,0,0|2,0,1]=4 1771 B12R1.17 CSCC(N)c1cccc(Br)c1 Amb35626225 [0,1,0,0,0,0|2,0,0]=3 1772 B12R1.17 CSCC(O)c1cccc(Br)c1 Amb35728583 [0,1,0,0,0,0|2,0,0]=3 1773 B12R1.17 CSCC(O)c1cccc(C)c1 Amb19061294 [0,1,0,0,0,0|2,0,0]=3 1774 B12R1.17 CSCC(O)c1cccc(Cl)c1 Amb28120471 [0,1,0,0,0,0|2,0,0]=3 1775 B12R1.17 C[C@@H](N=[N+]=[N-])c1cccc(F)c1 Amb27216617 [0,1,0,0,0,0|2,0,1]=4 1776 B12R1.17 C[C@@H](NC#N)c1cccc(Br)c1 Amb27390730 [0,1,0,0,0,0|3,0,0]=4 1777 B12R1.17 C[C@@H](NC=O)c1cccc(F)c1 Amb27950150 [0,1,0,0,0,0|3,0,0]=4 1778 B12R1.17 C[C@H](CCO)c1cccc(Cl)c1 Amb28317668 [0,1,0,0,0,0|2,0,0]=3 1779 B12R1.17 C[C@H](N=[N+]=[N-])c1cccc(F)c1 Amb27253862 [0,1,0,0,0,0|2,0,1]=4 1780 B12R1.17 C[C@H](NC#N)c1cccc(Cl)c1 Amb27831046 [0,1,0,0,0,0|3,0,0]=4 1781 B12R1.17 C[C@H](NC=O)c1cccc(Cl)c1 Amb28130598 [0,1,0,0,0,0|3,0,0]=4 1782 B12R1.17 C[NH2+]CC(O)c1cccc(O)c1 Amb4282886 [0,1,0,0,0,0|1,0,1]=3 1783 B12R1.17 Cc1cc(C(C)CCN)ccn1 Amb33268669 [0,1,0,0,0,0|3,0,0]=4 1784 B12R1.17 Cc1cc(C(C)CON)ccn1 Amb32732953 [0,1,0,0,0,0|3,0,0]=4 1785 B12R1.17 Cc1cccc(C(C)CC#N)c1 Amb28125812 [0,1,0,0,0,0|2,0,0]=3 1786 B12R1.17 Cc1cccc(C(C)CCN)c1 Amb17232450 [0,1,0,0,0,0|2,0,0]=3 1787 B12R1.17 Cc1cccc(C(C)CCN)n1 Amb33200746 [0,1,0,0,0,0|3,0,0]=4 1788 B12R1.17 Cc1cccc(C(C)CCO)c1 Amb17232501 [0,1,0,0,0,0|2,0,0]=3 1789 B12R1.17 Cc1cccc(C(C)CON)c1 Amb33203925 [0,1,0,0,0,0|2,0,0]=3 1790 B12R1.17 Cc1cccc(C(C)CON)n1 Amb33199939 [0,1,0,0,0,0|3,0,0]=4 1791 B12R1.17 Cc1cccc(C(C)N=C=O)c1 Amb25160024 [0,1,0,0,0,0|3,0,0]=4 1792 B12R1.17 Cc1cccc(C(C)N=[N+]=[N-])c1 Amb27408076 [0,1,0,0,0,0|2,0,1]=4 1793 B12R1.17 Cc1cccc(C(F)CCN)c1 Amb25043004 [0,1,0,0,0,0|3,0,0]=4 1794 B12R1.17 Cc1cccc(C(N)CC#N)c1 Amb18563499 [0,1,0,0,0,0|3,0,0]=4 1795 B12R1.17 Cc1cccc(C(N)CCO)c1 Amb17103954 [0,1,0,0,0,0|3,0,0]=4 1796 B12R1.17 Cc1cccc(C(O)CC#N)c1 Amb1111387 [0,1,0,0,0,0|3,0,0]=4 1797 B12R1.17 Cc1cccc(C(O)CCN)c1 Amb17232540 [0,1,0,0,0,0|3,0,0]=4 1798 B12R1.17 Cc1cccc(C(O)CCO)c1 Amb27404138 [0,1,0,0,0,0|3,0,0]=4 1799 B12R1.17 Cc1cccc(C(O)CNN)c1 Amb17232609 [0,1,0,0,0,0|2,0,0]=3 1800 B12R1.17 Cc1cccc(C(O)CNO)c1 Amb17334703 [0,1,0,0,0,0|2,0,0]=3 1801 B12R1.17 Cc1cccc(N(C)CC#N)c1 Amb17334502 [0,1,0,0,0,0|3,0,0]=4 1802 B12R1.17 Cc1cccc(N(C)CCBr)c1 Amb27751471 [0,1,0,0,0,0|3,0,0]=4 1803 B12R1.17 Cc1cccc(N(C)CCCl)c1 Amb17335671 [0,1,0,0,0,0|3,0,0]=4 1804 B12R1.17 Cc1cccc(N(C)CCN)c1 Amb17059641 [0,1,0,0,0,0|3,0,0]=4 1805 B12R1.17 Cc1cccc(N(C)CCN)c1 Amb33446965 [0,1,0,0,0,0|3,0,0]=4 1806 B12R1.17 Cc1cccc(N(C)CCO)c1 Amb17334644 [0,1,0,0,0,0|3,0,0]=4 1807 B12R1.17 Cc1cccc([C@@H](C)N=[N+]=[N-])c1 Amb27468447 [0,1,0,0,0,0|2,0,1]=4 1808 B12R1.17 Cc1cccc([C@@H](N)CCN)c1 Amb28131373 [0,1,0,0,0,0|3,0,0]=4 1809 B12R1.17 Cc1cccc([C@@H](N)CCO)c1 Amb19888371 [0,1,0,0,0,0|3,0,0]=4 1810 B12R1.17 Cc1cccc([C@@H](O)CCN)c1 Amb33203928 [0,1,0,0,0,0|3,0,0]=4 1811 B12R1.17 Cc1cccc([C@H](N)CC#N)c1 Amb28057146 [0,1,0,0,0,0|3,0,0]=4 1812 B12R1.17 Cc1cccc([C@H](N)CCO)c1 Amb19887706 [0,1,0,0,0,0|3,0,0]=4 1813 B12R1.17 Cc1cccc([C@H](O)CC#N)c1 Amb27587419 [0,1,0,0,0,0|3,0,0]=4 1814 B12R1.17 Cc1cccc([C@H](O)CCN)c1 Amb33203929 [0,1,0,0,0,0|3,0,0]=4 1815 B12R1.17 Cc1ccnc(C(C)CCN)c1 Amb33318417 [0,1,0,0,0,0|3,0,0]=4 1816 B12R1.17 Cc1ccnc(C(C)CON)c1 Amb33318123 [0,1,0,0,0,0|3,0,0]=4 1817 B12R1.17 Cc1cncc(C(C)CCN)c1 Amb26993219 [0,1,0,0,0,0|3,0,0]=4 1818 B12R1.17 Cc1cncc(C(C)CON)c1 Amb33318015 [0,1,0,0,0,0|3,0,0]=4 1819 B12R1.17 N#CCC(N)c1cccc(Br)c1 Amb18068031 [0,1,0,0,0,0|3,0,0]=4 1820 B12R1.17 N#CCC(N)c1cccc(Cl)c1 Amb18564159 [0,1,0,0,0,0|3,0,0]=4 1821 B12R1.17 N#CCC(N)c1cccc(F)c1 Amb18563606 [0,1,0,0,0,0|3,0,0]=4 1822 B12R1.17 N#CCC(N)c1cccc(I)c1 Amb27462137 [0,1,0,0,0,0|3,0,0]=4 1823 B12R1.17 N#CCC(O)c1cccc(Br)c1 Amb25139301 [0,1,0,0,0,0|3,0,0]=4 1824 B12R1.17 N#CCC(O)c1cccc(Cl)c1 Amb17233865 [0,1,0,0,0,0|3,0,0]=4 1825 B12R1.17 N#CCC(O)c1cccc(F)c1 Amb17232517 [0,1,0,0,0,0|3,0,0]=4 1826 B12R1.17 N#CCC(O)c1cccc(I)c1 Amb27187554 [0,1,0,0,0,0|3,0,0]=4 1827 B12R1.17 N#CCC(O)c1cccc(N)c1 Amb27251610 [0,1,0,0,0,0|3,0,0]=4 1828 B12R1.17 N#CCC(O)c1cccc(O)c1 Amb25674244 [0,1,0,0,0,0|3,0,0]=4 1829 B12R1.17 N#CC[C@@H](N)c1cccc(Br)c1 Amb27200359 [0,1,0,0,0,0|3,0,0]=4 1830 B12R1.17 N#CC[C@@H](N)c1cccc(I)c1 Amb28383397 [0,1,0,0,0,0|3,0,0]=4 1831 B12R1.17 N#CC[C@@H](N)c1cccc(O)c1 Amb27854039 [0,1,0,0,0,0|3,0,0]=4 1832 B12R1.17 N#CC[C@H](N)c1cccc(F)c1 Amb28119938 [0,1,0,0,0,0|3,0,0]=4 1833 B12R1.17 N#CC[C@H](O)c1cccc(O)c1 Amb27599471 [0,1,0,0,0,0|3,0,0]=4 1834 B12R1.17 NC(CCO)c1cccc(Br)c1 Amb18990231 [0,1,0,0,0,0|3,0,0]=4 1835 B12R1.17 NC(CCO)c1cccc(Br)c1 Amb30586495 [0,1,0,0,0,0|3,0,0]=4 1836 B12R1.17 NC(CCO)c1cccc(Cl)c1 Amb2417047 [0,1,0,0,0,0|3,0,0]=4 1837 B12R1.17 NC(CCO)c1cccc(F)c1 Amb2697503 [0,1,0,0,0,0|3,0,0]=4 1838 B12R1.17 NC(CCO)c1cccc(O)c1 Amb19887678 [0,1,0,0,0,0|3,0,0]=4 1839 B12R1.17 NC(CCO)c1cccc(O)c1 Amb31307762 [0,1,0,0,0,0|3,0,0]=4 1840 B12R1.17 NCCC(F)c1cccc(Br)c1 Amb33452141 [0,1,0,0,0,0|3,0,0]=4 1841 B12R1.17 NCCC(F)c1cccc(Cl)c1 Amb26051695 [0,1,0,0,0,0|3,0,0]=4 1842 B12R1.17 NCCC(F)c1cccc(F)c1 Amb28048483 [0,1,0,0,0,0|3,0,0]=4 1843 B12R1.17 NCCC(F)c1cccc(O)c1 Amb26987845 [0,1,0,0,0,0|3,0,0]=4 1844 B12R1.17 NCCC(N)c1cccc(Cl)c1 Amb28348609 [0,1,0,0,0,0|3,0,0]=4 1845 B12R1.17 NCCC(N)c1cccc(F)c1 Amb27629792 [0,1,0,0,0,0|3,0,0]=4 1846 B12R1.17 NCCC(O)c1cccc(Br)c1 Amb18121493 [0,1,0,0,0,0|3,0,0]=4 1847 B12R1.17 NCCC(O)c1cccc(Cl)c1 Amb17234260 [0,1,0,0,0,0|3,0,0]=4 1848 B12R1.17 NCCC(O)c1cccc(F)c1 Amb17232697 [0,1,0,0,0,0|3,0,0]=4 1849 B12R1.17 NCCC(O)c1cccc(I)c1 Amb24493265 [0,1,0,0,0,0|3,0,0]=4 1850 B12R1.17 NCCC(O)c1cccc(O)c1 Amb18251885 [0,1,0,0,0,0|3,0,0]=4 1851 B12R1.17 NCC[C@@H](O)c1cccc(Br)c1 Amb33451583 [0,1,0,0,0,0|3,0,0]=4 1852 B12R1.17 NCC[C@@H](O)c1cccc(Cl)c1 Amb25105024 [0,1,0,0,0,0|3,0,0]=4 1853 B12R1.17 NCC[C@@H](O)c1cccc(F)c1 Amb33316044 [0,1,0,0,0,0|3,0,0]=4 1854 B12R1.17 NCC[C@@H](O)c1cccc(O)c1 Amb33225571 [0,1,0,0,0,0|3,0,0]=4 1855 B12R1.17 NCC[C@H](N)c1cccc(Br)c1 Amb28057464 [0,1,0,0,0,0|3,0,0]=4 1856 B12R1.17 NCC[C@H](N)c1cccc(Cl)c1 Amb27788404 [0,1,0,0,0,0|3,0,0]=4 1857 B12R1.17 NCC[C@H](O)c1cccc(Br)c1 Amb33451586 [0,1,0,0,0,0|3,0,0]=4 1858 B12R1.17 NCC[C@H](O)c1cccc(Cl)c1 Amb28323010 [0,1,0,0,0,0|3,0,0]=4 1859 B12R1.17 NCC[C@H](O)c1cccc(F)c1 Amb33316043 [0,1,0,0,0,0|3,0,0]=4 1860 B12R1.17 NCC[C@H](O)c1cccc(O)c1 Amb33312067 [0,1,0,0,0,0|3,0,0]=4 1861 B12R1.17 NNCC(O)c1cccc(Br)c1 Amb17249279 [0,1,0,0,0,0|2,0,0]=3 1862 B12R1.17 NNCC(O)c1cccc(Cl)c1 Amb17234361 [0,1,0,0,0,0|2,0,0]=3 1863 B12R1.17 NNCC(O)c1cccc(F)c1 Amb18563928 [0,1,0,0,0,0|2,0,0]=3 1864 B12R1.17 N[C@@H](CCO)c1cccc(Br)c1 Amb8631673 [0,1,0,0,0,0|3,0,0]=4 1865 B12R1.17 N[C@@H](CCO)c1cccc(Br)c1 Amb8631674 [0,1,0,0,0,0|3,0,0]=4 1866 B12R1.17 N[C@@H](CCO)c1cccc(Cl)c1 Amb19888404 [0,1,0,0,0,0|3,0,0]=4 1867 B12R1.17 N[C@@H](CCO)c1cccc(Cl)c1 Amb30874077 [0,1,0,0,0,0|3,0,0]=4 1868 B12R1.17 N[C@@H](CCO)c1cccc(F)c1 Amb19888379 [0,1,0,0,0,0|3,0,0]=4 1869 B12R1.17 N[C@@H](CCO)c1cccc(I)c1 Amb27248087 [0,1,0,0,0,0|3,0,0]=4 1870 B12R1.17 N[C@@H](CCO)c1cccc(O)c1 Amb19888375 [0,1,0,0,0,0|3,0,0]=4 1871 B12R1.17 N[C@@H](CCO)c1cccc(O)c1 Amb19929578 [0,1,0,0,0,0|3,0,0]=4 1872 B12R1.17 N[C@H](CCO)c1cccc(Br)c1 Amb19887619 [0,1,0,0,0,0|3,0,0]=4 1873 B12R1.17 N[C@H](CCO)c1cccc(Br)c1 Amb19943918 [0,1,0,0,0,0|3,0,0]=4 1874 B12R1.17 N[C@H](CCO)c1cccc(Cl)c1 Amb19887652 [0,1,0,0,0,0|3,0,0]=4 1875 B12R1.17 N[C@H](CCO)c1cccc(F)c1 Amb19887668 [0,1,0,0,0,0|3,0,0]=4 1876 B12R1.17 N[C@H](CCO)c1cccc(F)c1 Amb19888995 [0,1,0,0,0,0|3,0,0]=4 1877 B12R1.17 N[C@H](CCO)c1cccc(I)c1 Amb28048810 [0,1,0,0,0,0|3,0,0]=4 1878 B12R1.17 N[C@H](CCO)c1cccc(O)c1 Amb33812400 [0,1,0,0,0,0|3,0,0]=4 1879 B12R1.17 N[C@H](CCO)c1cccc(S)c1 Amb27874125 [0,1,0,0,0,0|3,0,0]=4 1880 B12R1.17 Nc1cccc(C(N)CCO)c1 Amb19929590 [0,1,0,0,0,0|3,0,0]=4 1881 B12R1.17 Nc1cccc(C(N)CCO)c1 Amb22235814 [0,1,0,0,0,0|3,0,0]=4 1882 B12R1.17 Nc1cccc([C@@H](N)CCO)c1 Amb8631340 [0,1,0,0,0,0|3,0,0]=4 1883 B12R1.17 O=CCC(O)c1cccc(I)c1 Amb28066980 [0,1,0,0,0,0|3,0,0]=4 1884 B12R1.17 OCC[C@@H](O)c1cccc(Cl)c1 Amb25049479 [0,1,0,0,0,0|3,0,0]=4 1885 B12R1.17 OCC[C@H](O)c1cccc(Cl)c1 Amb26561233 [0,1,0,0,0,0|3,0,0]=4 1886 B12R1.17 ONCC(O)c1cccc(Br)c1 Amb17345006 [0,1,0,0,0,0|2,0,0]=3 1887 B12R1.17 ONCC(O)c1cccc(Cl)c1 Amb17335948 [0,1,0,0,0,0|2,0,0]=3 1888 B12R1.17 ONCC(O)c1cccc(O)c1 Amb17334759 [0,1,0,0,0,0|2,0,0]=3 1889 B12R1.17 O[C@@H](CCCl)c1cccc(F)c1 Amb28365651 [0,1,0,0,0,0|3,0,0]=4 1890 B12R1.17 O[C@H](CCCl)c1cccc(F)c1 Amb28121134 [0,1,0,0,0,0|3,0,0]=4 1891 B12R1.17 [C-]#[N+]CC(F)c1cccc(O)c1 Amb28435299 [0,1,0,0,0,0|1,0,2]=4 1892 B12R1.30 C#CCCC(C)c1ccccc1 Amb33081910 [0,1,0,0,0,0|1,0,1]=3 1893 B12R1.30 C#CCCC(N)c1ccccc1 Amb25959477 [0,1,0,0,0,0|2,0,1]=4 1894 B12R1.30 C#CCCC(O)c1ccccc1 Amb18800360 [0,1,0,0,0,0|2,0,1]=4 1895 B12R1.30 C#CCCN(C)c1ccccc1 Amb10559135 [0,1,0,0,0,0|2,0,1]=4 1896 B12R1.30 C#CCNC(C)c1ccccc1 Amb2721857 [0,1,0,0,0,0|1,0,1]=3 1897 B12R1.30 C#CCN[C@H](C)c1ccccc1 Amb27389242 [0,1,0,0,0,0|1,0,1]=3 1898 B12R1.30 C#CCN[C@H](C)c1ccncc1 Amb28280209 [0,1,0,0,0,0|2,0,1]=4 1899 B12R1.30 C#CCSC(C)c1cccnc1 Amb27660720 [0,1,0,0,0,0|2,0,1]=4 1900 B12R1.30 C=C=CCC(O)c1ccccc1 Amb27484788 [0,1,0,0,0,0|2,0,1]=4 1901 B12R1.30 C=C=CC[C@@H](O)c1ccccc1 Amb27977896 [0,1,0,0,0,0|2,0,1]=4 1902 B12R1.30 C=CCCC(C)c1ccccc1 Amb24062989 [0,1,0,0,0,0|1,0,1]=3 1903 B12R1.30 C=CCCC(N)c1ccccc1 Amb18126305 [0,1,0,0,0,0|2,0,1]=4 1904 B12R1.30 C=CCCC(O)c1ccccc1 Amb18800658 [0,1,0,0,0,0|2,0,1]=4 1905 B12R1.30 C=CCNC(C)c1ccccc1 Amb6683836 [0,1,0,0,0,0|1,0,1]=3 1906 B12R1.30 C=CCNC(C)c1ccccn1 Amb6683854 [0,1,0,0,0,0|2,0,1]=4 1907 B12R1.30 C=CCNC(C)c1cccnc1 Amb6683856 [0,1,0,0,0,0|2,0,1]=4 1908 B12R1.30 C=CCNC(C)c1ccncc1 Amb6683855 [0,1,0,0,0,0|2,0,1]=4 1909 B12R1.30 CC#CCC(O)c1ccccn1 Amb18797972 [0,1,0,0,0,0|3,0,0]=4 1910 B12R1.30 CC#CCN(C)c1ccccc1 Amb28197101 [0,1,0,0,0,0|2,0,0]=3 1911 B12R1.30 CC(CCC#N)c1ccccc1 Amb18645228 [0,1,0,0,0,0|1,0,1]=3 1912 B12R1.30 CC(CCC=O)c1ccccc1 Amb18645711 [0,1,0,0,0,0|1,0,1]=3 1913 B12R1.30 CC(CCCBr)c1ccccc1 Amb33082370 [0,1,0,0,0,0|1,0,0]=2 1914 B12R1.30 CC(CCCN)c1ccccc1 Amb18563593 [0,1,0,0,0,0|1,0,0]=2 1915 B12R1.30 CC(CCCO)c1ccccc1 Amb33213887 [0,1,0,0,0,0|1,0,0]=2 1916 B12R1.30 CC(CCCS)c1ccccc1 Amb33082130 [0,1,0,0,0,0|1,0,0]=2 1917 B12R1.30 CC(CCON)c1ccccc1 Amb33081860 [0,1,0,0,0,0|2,0,0]=3 1918 B12R1.30 CC(CN=C=O)c1ccccc1 Amb2694678 [0,1,0,0,0,0|0,0,2]=3 1919 B12R1.30 CC(CN=C=O)c1ccccn1 Amb25045651 [0,1,0,0,0,0|1,0,2]=4 1920 B12R1.30 CC(CN=C=O)c1cccnc1 Amb25762873 [0,1,0,0,0,0|1,0,2]=4 1921 B12R1.30 CC(CN=C=O)c1ccncc1 Amb26050029 [0,1,0,0,0,0|1,0,2]=4 1922 B12R1.30 CC(CN=C=S)c1ccccn1 Amb35701089 [0,1,0,0,0,0|1,0,2]=4 1923 B12R1.30 CC(CN=[N+]=[N-])c1ccccc1 Amb26883116 [0,1,0,0,0,0|1,0,1]=3 1924 B12R1.30 CC(CN=[N+]=[N-])c1ccccn1 Amb29857299 [0,1,0,0,0,0|2,0,1]=4 1925 B12R1.30 CC(CNC#N)c1ccccn1 Amb35701235 [0,1,0,0,0,0|1,0,1]=3 1926 B12R1.30 CC(CNC=O)c1ccccc1 Amb27776616 [0,1,0,0,0,0|0,0,1]=2 1927 B12R1.30 CC(CNC=O)c1ccccn1 Amb35693999 [0,1,0,0,0,0|1,0,1]=3 1928 B12R1.30 CC(NC=S=O)c1ccccc1 Amb27614786 [0,1,0,0,0,0|2,0,1]=4 1929 B12R1.30 CC(NCC#N)c1ccccc1 Amb6706903 [0,1,0,0,0,0|2,0,0]=3 1930 B12R1.30 CC(NCCCl)c1ccccc1 Amb17335659 [0,1,0,0,0,0|2,0,0]=3 1931 B12R1.30 CC(NCCN)c1ccccc1 Amb17091024 [0,1,0,0,0,0|2,0,0]=3 1932 B12R1.30 CC(NCCO)c1ccccc1 Amb2092663 [0,1,0,0,0,0|2,0,0]=3 1933 B12R1.30 CC(NCCO)c1ccccn1 Amb7809203 [0,1,0,0,0,0|3,0,0]=4 1934 B12R1.30 CC(NCCO)c1cccnc1 Amb7809201 [0,1,0,0,0,0|3,0,0]=4 1935 B12R1.30 CC(NCCO)c1ccncc1 Amb7809202 [0,1,0,0,0,0|3,0,0]=4 1936 B12R1.30 CC(OCCN)c1ccccc1 Amb6248427 [0,1,0,0,0,0|2,0,0]=3 1937 B12R1.30 CC(OCCO)c1ccccc1 Amb24103429 [0,1,0,0,0,0|2,0,0]=3 1938 B12R1.30 CC(SCCN)c1ccccc1 Amb17500453 [0,1,0,0,0,0|2,0,0]=3 1939 B12R1.30 CC(\C=C\C=O)c1ccccc1 Amb33042868 [0,1,0,0,0,0|1,0,2]=4 1940 B12R1.30 CC(\C=C\CBr)c1ccccc1 Amb27495265 [0,1,0,0,0,0|1,0,1]=3 1941 B12R1.30 CC(\C=C\CCl)c1ccccc1 Amb25776220 [0,1,0,0,0,0|1,0,1]=3 1942 B12R1.30 CC(\C=C\CN)c1ccccc1 Amb33042866 [0,1,0,0,0,0|1,0,1]=3 1943 B12R1.30 CC(\C=C\CO)c1ccccc1 Amb33042867 [0,1,0,0,0,0|1,0,1]=3 1944 B12R1.30 CCCCC(=O)c1ccccc1 Amb4605998 [0,1,0,0,0,0|2,0,1]=4 1945 B12R1.30 CCCCC(N)c1ccccc1 Amb9717704 [0,1,0,0,0,0|2,0,0]=3 1946 B12R1.30 CCCCC(N)c1ccccn1 Amb19026090 [0,1,0,0,0,0|3,0,0]=4 1947 B12R1.30 CCCCC(N)c1ccccn1 Amb35745637 [0,1,0,0,0,0|3,0,0]=4 1948 B12R1.30 CCCCC(N)c1cccnc1 Amb10607965 [0,1,0,0,0,0|3,0,0]=4 1949 B12R1.30 CCCCC(N)c1ccncc1 Amb10573553 [0,1,0,0,0,0|3,0,0]=4 1950 B12R1.30 CCCCC(O)c1ccccc1 Amb4034459 [0,1,0,0,0,0|2,0,0]=3 1951 B12R1.30 CCCCC(S)c1ccccc1 Amb32788793 [0,1,0,0,0,0|2,0,0]=3 1952 B12R1.30 CCCCN(N)c1ccccc1 Amb17226670 [0,1,0,0,0,0|3,0,0]=4 1953 B12R1.30 CCCC[C@@H](N)c1ccccc1 Amb28555742 [0,1,0,0,0,0|2,0,0]=3 1954 B12R1.30 CCCC[C@@H](N)c1ccccc1 Amb33276169 [0,1,0,0,0,0|2,0,0]=3 1955 B12R1.30 CCCC[C@@H](O)c1ccccc1 Amb30627576 [0,1,0,0,0,0|2,0,0]=3 1956 B12R1.30 CCCC[C@H](N)c1ccccc1 Amb28555741 [0,1,0,0,0,0|2,0,0]=3 1957 B12R1.30 CCCC[C@H](N)c1ccccc1 Amb33276167 [0,1,0,0,0,0|2,0,0]=3 1958 B12R1.30 CCCC[C@H](O)c1ccccc1 Amb28555740 [0,1,0,0,0,0|2,0,0]=3 1959 B12R1.30 CCCNC(=N)c1ccccc1 Amb23447119 [0,1,0,0,0,0|2,0,1]=4 1960 B12R1.30 CCCNC(C)c1ccccc1 Amb6335367 [0,1,0,0,0,0|1,0,0]=2 1961 B12R1.30 CCCNC(C)c1ccccc1 Amb9726952 [0,1,0,0,0,0|1,0,0]=2 1962 B12R1.30 CCCNC(C)c1ccccn1 Amb6267689 [0,1,0,0,0,0|2,0,0]=3 1963 B12R1.30 CCCNC(C)c1cccnc1 Amb6278552 [0,1,0,0,0,0|2,0,0]=3 1964 B12R1.30 CCCNC(C)c1ccncc1 Amb6279575 [0,1,0,0,0,0|2,0,0]=3 1965 B12R1.30 CCCOC(=O)c1ccccc1 Amb6357116 [0,1,0,0,0,0|2,0,1]=4 1966 B12R1.30 CCC\C=C(\N)c1ccccc1 Amb27965051 [0,1,0,0,0,0|2,0,1]=4 1967 B12R1.30 CCC\N=C(/C)c1ccccc1 Amb17779516 [0,1,0,0,0,0|1,0,1]=3 1968 B12R1.30 CCNCC(C)c1ccccc1 Amb6729198 [0,1,0,0,0,0|0,0,0]=1 1969 B12R1.30 CCNCC(N)c1ccccc1 Amb19009737 [0,1,0,0,0,0|1,0,0]=2 1970 B12R1.30 CCNCC(O)c1ccccc1 Amb9247502 [0,1,0,0,0,0|1,0,0]=2 1971 B12R1.30 CCNCC(O)c1ccccn1 Amb17138608 [0,1,0,0,0,0|2,0,0]=3 1972 B12R1.30 CCNCC(O)c1cccnc1 Amb17138609 [0,1,0,0,0,0|2,0,0]=3 1973 B12R1.30 CCNCC(O)c1ccncc1 Amb17138610 [0,1,0,0,0,0|2,0,0]=3 1974 B12R1.30 CCN\C=C(/N)c1ccccc1 Amb27668811 [0,1,0,0,0,0|1,0,2]=4 1975 B12R1.30 CCOCC(=O)c1ccccc1 Amb9666077 [0,1,0,0,0,0|2,0,1]=4 1976 B12R1.30 CCOCC(N)c1ccccc1 Amb1125200 [0,1,0,0,0,0|2,0,0]=3 1977 B12R1.30 CCOC[C@@H](N)c1ccccc1 Amb17061646 [0,1,0,0,0,0|2,0,0]=3 1978 B12R1.30 CCOC[C@H](N)c1ccccc1 Amb35747248 [0,1,0,0,0,0|2,0,0]=3 1979 B12R1.30 CCOC[C@H](N)c1ccccc1 Amb35747836 [0,1,0,0,0,0|2,0,0]=3 1980 B12R1.30 CCSCC(=O)c1ccccc1 Amb2778943 [0,1,0,0,0,0|2,0,1]=4 1981 B12R1.30 CC\C=C\C(N)c1ccccc1 Amb27790820 [0,1,0,0,0,0|2,0,1]=4 1982 B12R1.30 CC\C=C\C(O)c1ccccc1 Amb22546781 [0,1,0,0,0,0|2,0,1]=4 1983 B12R1.30 CC\C=C\[C@@H](O)c1ccccc1 Amb27598606 [0,1,0,0,0,0|2,0,1]=4 1984 B12R1.30 CC\C=N\[C@H](C)c1ccccc1 Amb27852444 [0,1,0,0,0,0|1,0,1]=3 1985 B12R1.30 CN(CCC#N)c1ccccc1 Amb6357793 [0,1,0,0,0,0|2,0,1]=4 1986 B12R1.30 CN(CCCBr)c1ccccc1 Amb32664174 [0,1,0,0,0,0|2,0,0]=3 1987 B12R1.30 CN(CCCBr)c1ccccc1 Amb32664423 [0,1,0,0,0,0|2,0,0]=3 1988 B12R1.30 CN(CCCCl)c1ccccc1 Amb17335669 [0,1,0,0,0,0|2,0,0]=3 1989 B12R1.30 CN(CCCN)c1ccccc1 Amb2786601 [0,1,0,0,0,0|2,0,0]=3 1990 B12R1.30 CN(CCCN)c1ccccn1 Amb32675145 [0,1,0,0,0,0|3,0,0]=4 1991 B12R1.30 CN(CCCN)c1ccccn1 Amb6670402 [0,1,0,0,0,0|3,0,0]=4 1992 B12R1.30 CN(CCCO)c1ccccc1 Amb9246590 [0,1,0,0,0,0|2,0,0]=3 1993 B12R1.30 CN(CCON)c1ccccc1 Amb17104857 [0,1,0,0,0,0|3,0,0]=4 1994 B12R1.30 CN(C\C=C\Cl)c1ccccc1 Amb27409057 [0,1,0,0,0,0|2,0,1]=4 1995 B12R1.30 CNCCC(=O)c1ccccc1 Amb11032366 [0,1,0,0,0,0|1,0,1]=3 1996 B12R1.30 CNCCC(=O)c1ccccc1 Amb8390832 [0,1,0,0,0,0|1,0,1]=3 1997 B12R1.30 CNCCC(C)c1ccccc1 Amb5739286 [0,1,0,0,0,0|0,0,0]=1 1998 B12R1.30 CNCCC(Cl)c1ccccc1 Amb8629327 [0,1,0,0,0,0|1,0,0]=2 1999 B12R1.30 CNCCC(O)c1ccccc1 Amb3939363 [0,1,0,0,0,0|1,0,0]=2 2000 B12R1.30 CNCCN(C)c1ccccc1 Amb6715077 [0,1,0,0,0,0|1,0,0]=2 2001 B12R1.30 CNCNC(=O)c1ccccc1 Amb27402677 [0,1,0,0,0,0|1,0,1]=3 2002 B12R1.30 CNC\C=C(/C)c1ccccc1 Amb23555664 [0,1,0,0,0,0|0,0,1]=2 2003 B12R1.30 CNC\C=C(/C)c1ccccn1 Amb31161604 [0,1,0,0,0,0|1,0,1]=3 2004 B12R1.30 CNC\C=C(/C)c1cccnc1 Amb31161605 [0,1,0,0,0,0|1,0,1]=3 2005 B12R1.30 CNC\C=C(/C)c1ccncc1 Amb31161606 [0,1,0,0,0,0|1,0,1]=3 2006 B12R1.30 CNC\C=C(\C)c1ccccc1 Amb27963918 [0,1,0,0,0,0|0,0,1]=2 2007 B12R1.30 CN\C=C/C(=O)c1ccccc1 Amb2386631 [0,1,0,0,0,0|1,0,2]=4 2008 B12R1.30 CN\C=C\C(=S)c1ccccc1 Amb27462236 [0,1,0,0,0,0|1,0,2]=4 2009 B12R1.30 CN\N=C\N(C)c1ccccc1 Amb28244156 [0,1,0,0,0,0|1,0,1]=3 2010 B12R1.30 COCCC(=O)c1ccccc1 Amb33538573 [0,1,0,0,0,0|2,0,1]=4 2011 B12R1.30 COCCC(Cl)c1ccccc1 Amb32686938 [0,1,0,0,0,0|2,0,0]=3 2012 B12R1.30 COCCC(N)c1ccccc1 Amb34912740 [0,1,0,0,0,0|2,0,0]=3 2013 B12R1.30 COCCC(N)c1cccnc1 Amb19025773 [0,1,0,0,0,0|3,0,0]=4 2014 B12R1.30 COCCC(N)c1cccnc1 Amb29932235 [0,1,0,0,0,0|3,0,0]=4 2015 B12R1.30 COCCC(O)c1ccccc1 Amb18788453 [0,1,0,0,0,0|2,0,0]=3 2016 B12R1.30 COCC[C@@H](N)c1ccccc1 Amb33620965 [0,1,0,0,0,0|2,0,0]=3 2017 B12R1.30 COCC[C@@H](N)c1ccccc1 Amb33738637 [0,1,0,0,0,0|2,0,0]=3 2018 B12R1.30 CO\N=C\[C@H](O)c1ccccc1 Amb27766548 [0,1,0,0,0,0|1,0,2]=4 2019 B12R1.30 CSCCC(=O)c1ccccc1 Amb32683163 [0,1,0,0,0,0|2,0,1]=4 2020 B12R1.30 CSCNC(=O)c1ccccc1 Amb28208358 [0,1,0,0,0,0|2,0,1]=4 2021 B12R1.30 C[C@@H](CN=C=O)c1ccccc1 Amb28397289 [0,1,0,0,0,0|0,0,2]=3 2022 B12R1.30 C[C@@H](CN=C=S)c1ccccc1 Amb19892937 [0,1,0,0,0,0|0,0,2]=3 2023 B12R1.30 C[C@@H](CN=[N+]=[N-])c1ccccc1 Amb28382300 [0,1,0,0,0,0|1,0,1]=3 2024 B12R1.30 C[C@@H](NCCCl)c1ccccc1 Amb30621967 [0,1,0,0,0,0|2,0,0]=3 2025 B12R1.30 C[C@@H](NCCO)c1ccccc1 Amb2721786 [0,1,0,0,0,0|2,0,0]=3 2026 B12R1.30 C[C@H](CN=C=S)c1ccccc1 Amb19892936 [0,1,0,0,0,0|0,0,2]=3 2027 B12R1.30 C[C@H](NCC#N)c1ccccc1 Amb27413002 [0,1,0,0,0,0|2,0,0]=3 2028 B12R1.30 C[C@H](NCC#N)c1cccnc1 Amb27758272 [0,1,0,0,0,0|3,0,0]=4 2029 B12R1.30 C[C@H](NCCO)c1ccccc1 Amb2698698 [0,1,0,0,0,0|2,0,0]=3 2030 B12R1.30 C[NH2+]CCC(O)c1ccccc1 Amb33513043 [0,1,0,0,0,0|1,0,1]=3 2031 B12R1.30 C\C(=C/CCBr)c1ccccc1 Amb17246875 [0,1,0,0,0,0|1,0,2]=4 2032 B12R1.30 C\C(=C/CCCl)c1ccccc1 Amb17233775 [0,1,0,0,0,0|1,0,2]=4 2033 B12R1.30 C\C(=C/CCN)c1ccccc1 Amb17232384 [0,1,0,0,0,0|1,0,2]=4 2034 B12R1.30 C\C(=C/CCO)c1ccccc1 Amb28421884 [0,1,0,0,0,0|1,0,2]=4 2035 B12R1.30 C\C(=C\CC=O)c1ccccc1 Amb24757521 [0,1,0,0,0,0|2,0,1]=4 2036 B12R1.30 C\C(=C\CCN)c1ccccc1 Amb27453270 [0,1,0,0,0,0|1,0,2]=4 2037 B12R1.30 C\C(=C\CCO)c1ccccc1 Amb27840638 [0,1,0,0,0,0|1,0,2]=4 2038 B12R1.30 C\C(=C\CNN)c1ccccc1 Amb28429635 [0,1,0,0,0,0|1,0,1]=3 2039 B12R1.30 C\C(=C\NC=O)c1ccccc1 Amb27848948 [0,1,0,0,0,0|0,0,3]=4 2040 B12R1.30 C\C(=N/OCCl)c1ccccc1 Amb27974241 [0,1,0,0,0,0|2,0,1]=4 2041 B12R1.30 C\C=C/CC(N)c1ccccc1 Amb28140782 [0,1,0,0,0,0|2,0,0]=3 2042 B12R1.30 C\C=C\CC(C)c1ccccc1 Amb26891020 [0,1,0,0,0,0|1,0,0]=2 2043 B12R1.30 C\C=C\CN(C)c1ccccc1 Amb22546831 [0,1,0,0,0,0|2,0,0]=3 2044 B12R1.30 C\C=C\CS(=O)c1ccccc1 Amb28365911 [0,1,0,0,0,0|3,0,0]=4 2045 B12R1.30 C\C=C\C[C@H](O)c1ccccc1 Amb28241948 [0,1,0,0,0,0|2,0,0]=3 2046 B12R1.30 C\C=C\NC(C)c1ccccc1 Amb27791879 [0,1,0,0,0,0|1,0,1]=3 2047 B12R1.30 C\C=N\C[C@H](O)c1ccccc1 Amb27472643 [0,1,0,0,0,0|1,0,1]=3 2048 B12R1.30 N#CCCC(N)c1ccccc1 Amb26967002 [0,1,0,0,0,0|2,0,1]=4 2049 B12R1.30 N#CCCC(N)c1ccccc1 Amb30584969 [0,1,0,0,0,0|2,0,1]=4 2050 B12R1.30 N#CCCC(O)c1ccccc1 Amb17232364 [0,1,0,0,0,0|2,0,1]=4 2051 B12R1.30 N#CNCC(O)c1ccccc1 Amb18800628 [0,1,0,0,0,0|1,0,1]=3 2052 B12R1.30 N#CSCC(Cl)c1ccccc1 Amb27955263 [0,1,0,0,0,0|2,0,1]=4 2053 B12R1.30 NC(CCCO)c1ccccc1 Amb9783958 [0,1,0,0,0,0|2,0,0]=3 2054 B12R1.30 NCC#CC(O)c1ccccc1 Amb27484208 [0,1,0,0,0,0|2,0,1]=4 2055 B12R1.30 NCCCC(=O)c1ccccc1 Amb18623671 [0,1,0,0,0,0|2,0,1]=4 2056 B12R1.30 NCCCC(N)c1ccccn1 Amb10070102 [0,1,0,0,0,0|3,0,0]=4 2057 B12R1.30 NCCCC(N)c1cccnc1 Amb10070101 [0,1,0,0,0,0|3,0,0]=4 2058 B12R1.30 NCCCC(N)c1ccncc1 Amb10070100 [0,1,0,0,0,0|3,0,0]=4 2059 B12R1.30 NCCCC(O)c1ccccc1 Amb17079154 [0,1,0,0,0,0|2,0,0]=3 2060 B12R1.30 NCCCC(O)c1ccccc1 Amb21984517 [0,1,0,0,0,0|2,0,0]=3 2061 B12R1.30 NCCCC(O)c1ccccn1 Amb18563728 [0,1,0,0,0,0|3,0,0]=4 2062 B12R1.30 NCCCC(O)c1cccnc1 Amb17232606 [0,1,0,0,0,0|3,0,0]=4 2063 B12R1.30 NCCCC(O)c1ccncc1 Amb18563731 [0,1,0,0,0,0|3,0,0]=4 2064 B12R1.30 NC\C=C\C(O)c1ccccc1 Amb26551917 [0,1,0,0,0,0|2,0,1]=4 2065 B12R1.30 N[C@@H](CCCO)c1ccccc1 Amb23440411 [0,1,0,0,0,0|2,0,0]=3 2066 B12R1.30 O=C(CCCBr)c1ccccc1 Amb17247624 [0,1,0,0,0,0|2,0,1]=4 2067 B12R1.30 O=C(CCCCl)c1ccccc1 Amb1229841 [0,1,0,0,0,0|2,0,1]=4 2068 B12R1.30 O=C(CCCO)c1ccccc1 Amb17334609 [0,1,0,0,0,0|2,0,1]=4 2069 B12R1.30 O=CNCC(=O)c1ccccc1 Amb20075907 [0,1,0,0,0,0|1,0,2]=4 2070 B12R1.30 O=CNCC(O)c1ccccc1 Amb18792635 [0,1,0,0,0,0|1,0,1]=3 2071 B12R1.30 OC(CCCCl)c1ccccc1 Amb17194564 [0,1,0,0,0,0|2,0,0]=3 2072 B12R1.30 OC(C\C=C\Cl)c1ccccc1 Amb27419899 [0,1,0,0,0,0|2,0,1]=4 2073 B12R1.30 OC(C\C=C\F)c1ccccc1 Amb27766637 [0,1,0,0,0,0|2,0,1]=4 2074 B12R1.30 OCC#CC(O)c1ccccc1 Amb776273 [0,1,0,0,0,0|2,0,1]=4 2075 B12R1.30 OCCCC(O)c1ccccc1 Amb17334675 [0,1,0,0,0,0|2,0,0]=3 2076 B12R1.30 OCCCC(O)c1cccnc1 Amb17619700 [0,1,0,0,0,0|3,0,0]=4 2077 B12R1.30 OC\C=C/C(O)c1ccccc1 Amb30621777 [0,1,0,0,0,0|2,0,1]=4 2078 B12R1.30 OC\C=C\C(O)c1ccccc1 Amb25071691 [0,1,0,0,0,0|2,0,1]=4 2079 B12R1.30 OC\C=C\[C@H](O)c1ccccc1 Amb28244279 [0,1,0,0,0,0|2,0,1]=4 2080 B12R1.30 S=C=NCC(Cl)c1ccccc1 Amb27184622 [0,1,0,0,0,0|1,0,2]=4 2081 B12R1.30 [C-]#[N+]CCC(C)c1ccccc1 Amb33081599 [0,1,0,0,0,0|0,0,2]=3 2082 B12R1.30 [N-]=[N+]=NCC(O)c1ccccc1 Amb18792465 [0,1,0,0,0,0|2,0,1]=4 2083 B12R1.30 [N-]=[N+]=NC[C@@H](O)c1ccccc1 Amb27873258 [0,1,0,0,0,0|2,0,1]=4 2084 B12R1.30 [N-]=[N+]=NC[C@H](N)c1ccccc1 Amb27859042 [0,1,0,0,0,0|2,0,1]=4 2085 B12R1.30 [N-]=[N+]=NC[C@H](O)c1ccccc1 Amb25102649 [0,1,0,0,0,0|2,0,1]=4 2086 B12R1.34 BrCC(Br)C(Br)c1ccccc1 Amb25114235 [0,1,0,0,0,0|3,0,0]=4 2087 B12R1.34 C#CC(=O)C(C)c1ccccc1 Amb27474587 [0,1,0,0,0,0|1,0,2]=4 2088 B12R1.34 C#CC(C)C(C)c1ccccc1 Amb33081864 [0,1,0,0,0,0|1,0,1]=3 2089 B12R1.34 C#CC(C)C(N)c1ccccc1 Amb28254509 [0,1,0,0,0,0|2,0,1]=4 2090 B12R1.34 C#CC(Cl)C(O)c1ccccc1 Amb27878811 [0,1,0,0,0,0|2,0,1]=4 2091 B12R1.34 C#CC(O)C(N)c1ccccc1 Amb29875675 [0,1,0,0,0,0|2,0,1]=4 2092 B12R1.34 C#C[C@@H](C)[C@@H](O)c1ccccc1 Amb27757239 [0,1,0,0,0,0|2,0,1]=4 2093 B12R1.34 C#C[C@@H](C)[C@H](O)c1ccccc1 Amb27405268 [0,1,0,0,0,0|2,0,1]=4 2094 B12R1.34 C#C[C@@H](O)C(C)c1ccccc1 Amb29852035 [0,1,0,0,0,0|1,0,1]=3 2095 B12R1.34 C#C[C@H](C)[C@@H](O)c1ccccc1 Amb27650164 [0,1,0,0,0,0|2,0,1]=4 2096 B12R1.34 C#C[C@H](O)C(C)c1ccccc1 Amb29852036 [0,1,0,0,0,0|1,0,1]=3 2097 B12R1.34 C=C(C=O)C(C)c1ccccc1 Amb8392634 [0,1,0,0,0,0|2,0,1]=4 2098 B12R1.34 C=C(CBr)C(C)c1ccccc1 Amb33081882 [0,1,0,0,0,0|2,0,1]=4 2099 B12R1.34 C=C(CC)[C@H](O)c1ccccc1 Amb28460718 [0,1,0,0,0,0|2,0,1]=4 2100 B12R1.34 C=C(CCl)C(C)c1ccccc1 Amb33081913 [0,1,0,0,0,0|2,0,1]=4 2101 B12R1.34 C=C(CN)C(C)c1ccccc1 Amb33081877 [0,1,0,0,0,0|2,0,1]=4 2102 B12R1.34 C=C(OC)C(O)c1ccccc1 Amb27652842 [0,1,0,0,0,0|2,0,1]=4 2103 B12R1.34 C=C(SC)C(O)c1ccccc1 Amb28242432 [0,1,0,0,0,0|2,0,1]=4 2104 B12R1.34 C=C(c1ccccc1)C(O)CC Amb27431432 [0,1,0,0,0,0|1,0,2]=4 2105 B12R1.34 C=CC(=O)C(C)c1ccccc1 Amb24537754 [0,1,0,0,0,0|1,0,2]=4 2106 B12R1.34 C=CC(C)C(N)c1ccccc1 Amb27392398 [0,1,0,0,0,0|2,0,1]=4 2107 B12R1.34 C=CC(C)N(C)c1ccccc1 Amb27979353 [0,1,0,0,0,0|2,0,1]=4 2108 B12R1.34 C=CC(N)C(N)c1ccccc1 Amb27390654 [0,1,0,0,0,0|2,0,1]=4 2109 B12R1.34 C=CC(O)C(C)c1ccccc1 Amb25310831 [0,1,0,0,0,0|1,0,1]=3 2110 B12R1.34 C=C[C@@H](Cl)[C@@H](O)c1ccccc1 Amb27232990 [0,1,0,0,0,0|2,0,1]=4 2111 B12R1.34 C=C[C@@H](O)[C@H](O)c1ccccc1 Amb27615222 [0,1,0,0,0,0|2,0,1]=4 2112 B12R1.34 C=C[C@H](C)[C@@H](O)c1ccccc1 Amb25071531 [0,1,0,0,0,0|2,0,1]=4 2113 B12R1.34 C=C[C@H](N)[C@H](O)c1ccccc1 Amb27876610 [0,1,0,0,0,0|2,0,1]=4 2114 B12R1.34 C=C[C@H](O)[C@@H](C)c1ccccc1 Amb27169905 [0,1,0,0,0,0|1,0,1]=3 2115 B12R1.34 CC(C#N)C(C)c1ccccc1 Amb33081594 [0,1,0,0,0,0|2,0,0]=3 2116 B12R1.34 CC(C(=O)CCl)c1ccccc1 Amb25150842 [0,1,0,0,0,0|2,0,1]=4 2117 B12R1.34 CC(C(=O)CN)c1ccccc1 Amb24535411 [0,1,0,0,0,0|2,0,1]=4 2118 B12R1.34 CC(C(=O)CO)c1ccccc1 Amb28250155 [0,1,0,0,0,0|2,0,1]=4 2119 B12R1.34 CC(C(=O)NN)c1ccccc1 Amb28120718 [0,1,0,0,0,0|1,0,1]=3 2120 B12R1.34 CC(C=O)C(C)c1ccccc1 Amb24065337 [0,1,0,0,0,0|2,0,0]=3 2121 B12R1.34 CC(C=O)C(O)c1ccccc1 Amb28397488 [0,1,0,0,0,0|3,0,0]=4 2122 B12R1.34 CC(CBr)C(C)c1ccccc1 Amb33081859 [0,1,0,0,0,0|2,0,0]=3 2123 B12R1.34 CC(CCl)C(C)c1ccccc1 Amb27592178 [0,1,0,0,0,0|2,0,0]=3 2124 B12R1.34 CC(CN)C(C)c1ccccc1 Amb18829124 [0,1,0,0,0,0|2,0,0]=3 2125 B12R1.34 CC(CN)C(C)c1cccnc1 Amb18828712 [0,1,0,0,0,0|3,0,0]=4 2126 B12R1.34 CC(CN)C(F)c1ccccc1 Amb28048144 [0,1,0,0,0,0|3,0,0]=4 2127 B12R1.34 CC(CN)C(N)c1ccccc1 Amb28066263 [0,1,0,0,0,0|3,0,0]=4 2128 B12R1.34 CC(CN)C(O)c1ccccc1 Amb18646366 [0,1,0,0,0,0|3,0,0]=4 2129 B12R1.34 CC(CN)N(C)c1ccccc1 Amb1128364 [0,1,0,0,0,0|3,0,0]=4 2130 B12R1.34 CC(CN)N(C)c1ccccc1 Amb13949221 [0,1,0,0,0,0|3,0,0]=4 2131 B12R1.34 CC(CO)C(C)c1ccccc1 Amb26375616 [0,1,0,0,0,0|2,0,0]=3 2132 B12R1.34 CC(CO)C(C)c1cccnc1 Amb33745857 [0,1,0,0,0,0|3,0,0]=4 2133 B12R1.34 CC(CO)[C@H](C)c1ccccc1 Amb28207416 [0,1,0,0,0,0|2,0,0]=3 2134 B12R1.34 CC(NN)C(O)c1ccccc1 Amb27867037 [0,1,0,0,0,0|2,0,0]=3 2135 B12R1.34 CC(ON)C(C)c1ccccc1 Amb33081868 [0,1,0,0,0,0|2,0,0]=3 2136 B12R1.34 CC(\C(Cl)=N\O)c1ccccc1 Amb27163553 [0,1,0,0,0,0|1,0,2]=4 2137 B12R1.34 CC(\C(N)=N\O)c1ccccc1 Amb24595995 [0,1,0,0,0,0|1,0,2]=4 2138 B12R1.34 CC(c1ccccc1)C(Br)C#N Amb26043284 [0,1,0,0,0,0|2,0,0]=3 2139 B12R1.34 CC(c1ccccc1)C(Cl)C#N Amb18791080 [0,1,0,0,0,0|2,0,0]=3 2140 B12R1.34 CC(c1ccccc1)C(Cl)C=O Amb18648719 [0,1,0,0,0,0|2,0,0]=3 2141 B12R1.34 CC(c1ccccc1)C(F)C=O Amb27413171 [0,1,0,0,0,0|2,0,0]=3 2142 B12R1.34 CC(c1ccccc1)C(F)CN Amb33082393 [0,1,0,0,0,0|2,0,0]=3 2143 B12R1.34 CC(c1ccccc1)C(N)C#N Amb18953074 [0,1,0,0,0,0|2,0,0]=3 2144 B12R1.34 CC(c1ccccc1)C(N)CN Amb18972125 [0,1,0,0,0,0|2,0,0]=3 2145 B12R1.34 CC(c1ccccc1)C(N)CN Amb33537059 [0,1,0,0,0,0|2,0,0]=3 2146 B12R1.34 CC(c1ccccc1)C(N)CO Amb18975503 [0,1,0,0,0,0|2,0,0]=3 2147 B12R1.34 CC(c1ccccc1)C(N)CO Amb19349648 [0,1,0,0,0,0|2,0,0]=3 2148 B12R1.34 CC(c1ccccc1)C(O)CBr Amb33081873 [0,1,0,0,0,0|2,0,0]=3 2149 B12R1.34 CC(c1ccccc1)C(O)CCl Amb33081872 [0,1,0,0,0,0|2,0,0]=3 2150 B12R1.34 CC(c1ccccc1)C(O)CF Amb27416766 [0,1,0,0,0,0|2,0,0]=3 2151 B12R1.34 CC(c1ccccc1)C(O)CN Amb17232553 [0,1,0,0,0,0|2,0,0]=3 2152 B12R1.34 CC(c1ccccc1)C(O)CO Amb26021855 [0,1,0,0,0,0|2,0,0]=3 2153 B12R1.34 CC(c1ccccc1)N(C)C#N Amb28190109 [0,1,0,0,0,0|3,0,0]=4 2154 B12R1.34 CC(c1ccccc1)N(O)C=O Amb10606548 [0,1,0,0,0,0|3,0,0]=4 2155 B12R1.34 CC(c1ccccc1)[C@@H](C)CN Amb33738459 [0,1,0,0,0,0|2,0,0]=3 2156 B12R1.34 CC(c1ccccc1)[C@@H](C)CO Amb33746406 [0,1,0,0,0,0|2,0,0]=3 2157 B12R1.34 CC(c1ccccc1)[C@@H](N)CO Amb33081836 [0,1,0,0,0,0|2,0,0]=3 2158 B12R1.34 CC(c1ccccc1)[C@@H](O)CN Amb33081825 [0,1,0,0,0,0|2,0,0]=3 2159 B12R1.34 CC(c1ccccc1)[C@H](C)CN Amb33746913 [0,1,0,0,0,0|2,0,0]=3 2160 B12R1.34 CC(c1ccccc1)[C@H](C)CO Amb33727265 [0,1,0,0,0,0|2,0,0]=3 2161 B12R1.34 CC(c1ccccc1)[C@H](N)CO Amb33081833 [0,1,0,0,0,0|2,0,0]=3 2162 B12R1.34 CC(c1ccccc1)[C@H](O)CN Amb33081831 [0,1,0,0,0,0|2,0,0]=3 2163 B12R1.34 CC(c1cccnc1)[C@@H](C)CN Amb33744945 [0,1,0,0,0,0|3,0,0]=4 2164 B12R1.34 CC(c1cccnc1)[C@@H](C)CO Amb33736432 [0,1,0,0,0,0|3,0,0]=4 2165 B12R1.34 CC(c1cccnc1)[C@H](C)CN Amb33730038 [0,1,0,0,0,0|3,0,0]=4 2166 B12R1.34 CC(c1cccnc1)[C@H](C)CO Amb33743120 [0,1,0,0,0,0|3,0,0]=4 2167 B12R1.34 CCC(=O)C(Br)c1ccccc1 Amb17596238 [0,1,0,0,0,0|2,0,1]=4 2168 B12R1.34 CCC(=O)C(C)c1ccccc1 Amb3940841 [0,1,0,0,0,0|1,0,1]=3 2169 B12R1.34 CCC(=O)C(C)c1cccnc1 Amb27175914 [0,1,0,0,0,0|2,0,1]=4 2170 B12R1.34 CCC(=O)C(Cl)c1ccccc1 Amb27477956 [0,1,0,0,0,0|2,0,1]=4 2171 B12R1.34 CCC(=O)C(F)c1ccccc1 Amb27668940 [0,1,0,0,0,0|2,0,1]=4 2172 B12R1.34 CCC(=O)C(N)c1ccccc1 Amb27244834 [0,1,0,0,0,0|2,0,1]=4 2173 B12R1.34 CCC(=O)C(O)c1ccccc1 Amb28201072 [0,1,0,0,0,0|2,0,1]=4 2174 B12R1.34 CCC(=O)N(C)c1ccccc1 Amb2611725 [0,1,0,0,0,0|2,0,1]=4 2175 B12R1.34 CCC(Br)C(=O)c1ccccc1 Amb6673863 [0,1,0,0,0,0|2,0,1]=4 2176 B12R1.34 CCC(Br)C(C)c1ccncc1 Amb28399518 [0,1,0,0,0,0|2,0,0]=3 2177 B12R1.34 CCC(C)C(=O)c1ccccc1 Amb8850439 [0,1,0,0,0,0|2,0,1]=4 2178 B12R1.34 CCC(C)C(N)c1ccccc1 Amb30628584 [0,1,0,0,0,0|2,0,0]=3 2179 B12R1.34 CCC(C)C(N)c1cccnc1 Amb27804504 [0,1,0,0,0,0|3,0,0]=4 2180 B12R1.34 CCC(C)[C@@H](N)c1ccccn1 Amb28140785 [0,1,0,0,0,0|3,0,0]=4 2181 B12R1.34 CCC(C)[C@H](N)c1ccccc1 Amb27430422 [0,1,0,0,0,0|2,0,0]=3 2182 B12R1.34 CCC(Cl)C(=O)c1ccccc1 Amb19074252 [0,1,0,0,0,0|2,0,1]=4 2183 B12R1.34 CCC(Cl)C(C)c1ccccn1 Amb27776061 [0,1,0,0,0,0|2,0,0]=3 2184 B12R1.34 CCC(F)C(=O)c1ccccc1 Amb26600904 [0,1,0,0,0,0|2,0,1]=4 2185 B12R1.34 CCC(N)C(=O)c1ccccc1 Amb17138555 [0,1,0,0,0,0|2,0,1]=4 2186 B12R1.34 CCC(N)C(=O)c1ccccc1 Amb22549075 [0,1,0,0,0,0|2,0,1]=4 2187 B12R1.34 CCC(N)C(C)c1ccccc1 Amb18829127 [0,1,0,0,0,0|1,0,0]=2 2188 B12R1.34 CCC(N)C(C)c1ccccc1 Amb20623710 [0,1,0,0,0,0|1,0,0]=2 2189 B12R1.34 CCC(N)C(O)c1ccccc1 Amb19373101 [0,1,0,0,0,0|2,0,0]=3 2190 B12R1.34 CCC(N)C(O)c1ccccc1 Amb9428998 [0,1,0,0,0,0|2,0,0]=3 2191 B12R1.34 CCC(N)C(O)c1cccnc1 Amb9429025 [0,1,0,0,0,0|3,0,0]=4 2192 B12R1.34 CCC(O)C(=O)c1ccccc1 Amb18800792 [0,1,0,0,0,0|2,0,1]=4 2193 B12R1.34 CCC(O)C(C)c1ccncc1 Amb27647403 [0,1,0,0,0,0|2,0,0]=3 2194 B12R1.34 CCC(O)C(N)c1ccccn1 Amb27857528 [0,1,0,0,0,0|3,0,0]=4 2195 B12R1.34 CCC(O)C(N)c1ccncc1 Amb27763667 [0,1,0,0,0,0|3,0,0]=4 2196 B12R1.34 CCC(O)C(O)c1ccccc1 Amb27163573 [0,1,0,0,0,0|2,0,0]=3 2197 B12R1.34 CCC(O)[C@H](C)c1ccccc1 Amb27981671 [0,1,0,0,0,0|1,0,0]=2 2198 B12R1.34 CCS(=O)C(C)c1ccccc1 Amb28063578 [0,1,0,0,0,0|2,0,0]=3 2199 B12R1.34 CC[C@@H](C)[C@H](O)c1ccccc1 Amb28321457 [0,1,0,0,0,0|2,0,0]=3 2200 B12R1.34 CC[C@@H](N)C(C)c1ccccc1 Amb29867804 [0,1,0,0,0,0|1,0,0]=2 2201 B12R1.34 CC[C@@H](N)C(O)c1ccccc1 Amb35602701 [0,1,0,0,0,0|2,0,0]=3 2202 B12R1.34 CC[C@@H](N)C(O)c1cccnc1 Amb35602697 [0,1,0,0,0,0|3,0,0]=4 2203 B12R1.34 CC[C@@H](N)[C@@H](O)c1ccccc1 Amb27760494 [0,1,0,0,0,0|2,0,0]=3 2204 B12R1.34 CC[C@@H](N)[C@@H](O)c1cccnc1 Amb27626980 [0,1,0,0,0,0|3,0,0]=4 2205 B12R1.34 CC[C@@H](N)[C@H](O)c1ccncc1 Amb27233986 [0,1,0,0,0,0|3,0,0]=4 2206 B12R1.34 CC[C@@H](O)C(C)c1ccccc1 Amb29852038 [0,1,0,0,0,0|1,0,0]=2 2207 B12R1.34 CC[C@@H](O)[C@@H](C)c1ccccc1 Amb27766563 [0,1,0,0,0,0|1,0,0]=2 2208 B12R1.34 CC[C@@H](O)[C@@H](O)c1ccccc1 Amb28293390 [0,1,0,0,0,0|2,0,0]=3 2209 B12R1.34 CC[C@@H](O)[C@H](O)c1ccccc1 Amb27835137 [0,1,0,0,0,0|2,0,0]=3 2210 B12R1.34 CC[C@H](N)C(C)c1ccccc1 Amb29867785 [0,1,0,0,0,0|1,0,0]=2 2211 B12R1.34 CC[C@H](N)C(O)c1ccccc1 Amb35601261 [0,1,0,0,0,0|2,0,0]=3 2212 B12R1.34 CC[C@H](N)C(O)c1cccnc1 Amb35601299 [0,1,0,0,0,0|3,0,0]=4 2213 B12R1.34 CC[C@H](N)[C@@H](N)c1cccnc1 Amb27489089 [0,1,0,0,0,0|3,0,0]=4 2214 B12R1.34 CC[C@H](N)[C@@H](O)c1cccnc1 Amb27776956 [0,1,0,0,0,0|3,0,0]=4 2215 B12R1.34 CC[C@H](N)[C@H](O)c1ccccc1 Amb28121117 [0,1,0,0,0,0|2,0,0]=3 2216 B12R1.34 CC[C@H](O)C(C)c1ccccc1 Amb29852039 [0,1,0,0,0,0|1,0,0]=2 2217 B12R1.34 CC[C@H](O)[C@H](N)c1ccccc1 Amb28292456 [0,1,0,0,0,0|2,0,0]=3 2218 B12R1.34 CC[C@H](O)[C@H](O)c1ccccc1 Amb27835888 [0,1,0,0,0,0|2,0,0]=3 2219 B12R1.34 CN(C(=O)NO)c1ccccc1 Amb26639375 [0,1,0,0,0,0|2,0,1]=4 2220 B12R1.34 CN(C(=S)NN)c1ccccc1 Amb18564176 [0,1,0,0,0,0|2,0,1]=4 2221 B12R1.34 CNC(=N)C(C)c1ccccc1 Amb35715674 [0,1,0,0,0,0|0,0,1]=2 2222 B12R1.34 CNC(=N)N(C)c1ccccc1 Amb18798220 [0,1,0,0,0,0|1,0,1]=3 2223 B12R1.34 CNC(=N)N(C)c1cccnc1 Amb27601191 [0,1,0,0,0,0|2,0,1]=4 2224 B12R1.34 CNC(=O)C(=O)c1ccccc1 Amb17334577 [0,1,0,0,0,0|1,0,2]=4 2225 B12R1.34 CNC(=O)C(Br)c1ccccc1 Amb8631535 [0,1,0,0,0,0|1,0,1]=3 2226 B12R1.34 CNC(=O)C(C)c1ccccc1 Amb28325026 [0,1,0,0,0,0|0,0,1]=2 2227 B12R1.34 CNC(=O)C(Cl)c1ccccc1 Amb9209230 [0,1,0,0,0,0|1,0,1]=3 2228 B12R1.34 CNC(=O)C(F)c1ccccc1 Amb27660594 [0,1,0,0,0,0|1,0,1]=3 2229 B12R1.34 CNC(=O)C(N)c1ccccc1 Amb33549035 [0,1,0,0,0,0|1,0,1]=3 2230 B12R1.34 CNC(=O)C(N)c1ccccc1 Amb9726565 [0,1,0,0,0,0|1,0,1]=3 2231 B12R1.34 CNC(=O)C(N)c1ccccn1 Amb26346573 [0,1,0,0,0,0|2,0,1]=4 2232 B12R1.34 CNC(=O)C(N)c1cccnc1 Amb27615584 [0,1,0,0,0,0|2,0,1]=4 2233 B12R1.34 CNC(=O)C(N)c1ccncc1 Amb24396250 [0,1,0,0,0,0|2,0,1]=4 2234 B12R1.34 CNC(=O)C(O)c1ccccc1 Amb17400179 [0,1,0,0,0,0|1,0,1]=3 2235 B12R1.34 CNC(=O)C(O)c1ccccn1 Amb27411454 [0,1,0,0,0,0|2,0,1]=4 2236 B12R1.34 CNC(=O)C(O)c1cccnc1 Amb26883806 [0,1,0,0,0,0|2,0,1]=4 2237 B12R1.34 CNC(=O)C(O)c1ccncc1 Amb24497547 [0,1,0,0,0,0|2,0,1]=4 2238 B12R1.34 CNC(=O)N(C)c1ccccn1 Amb27393812 [0,1,0,0,0,0|2,0,1]=4 2239 B12R1.34 CNC(=O)N(O)c1ccccc1 Amb4136448 [0,1,0,0,0,0|2,0,1]=4 2240 B12R1.34 CNC(=O)[C@@H](N)c1ccccc1 Amb17232478 [0,1,0,0,0,0|1,0,1]=3 2241 B12R1.34 CNC(=O)[C@@H](O)c1ccccc1 Amb28398484 [0,1,0,0,0,0|1,0,1]=3 2242 B12R1.34 CNC(=O)[C@H](N)c1ccccc1 Amb24678684 [0,1,0,0,0,0|1,0,1]=3 2243 B12R1.34 CNC(=O)[C@H](N)c1ccccc1 Amb32686954 [0,1,0,0,0,0|1,0,1]=3 2244 B12R1.34 CNC(=O)[C@H](O)c1ccccc1 Amb25792321 [0,1,0,0,0,0|1,0,1]=3 2245 B12R1.34 CNC(=S)N(C)c1ccccc1 Amb2682774 [0,1,0,0,0,0|1,0,1]=3 2246 B12R1.34 CNC(=S)P(C)c1ccccc1 Amb27789599 [0,1,0,0,0,0|1,0,1]=3 2247 B12R1.34 CNC(C)C(=O)c1ccccc1 Amb8384820 [0,1,0,0,0,0|1,0,1]=3 2248 B12R1.34 CNC(C)C(=O)c1ccccn1 Amb27172409 [0,1,0,0,0,0|2,0,1]=4 2249 B12R1.34 CNC(C)C(=O)c1cccnc1 Amb26392364 [0,1,0,0,0,0|2,0,1]=4 2250 B12R1.34 CNC(C)C(=O)c1ccncc1 Amb25381151 [0,1,0,0,0,0|2,0,1]=4 2251 B12R1.34 CNC(C)C(C)c1ccccc1 Amb18645936 [0,1,0,0,0,0|0,0,0]=1 2252 B12R1.34 CNC(C)C(C)c1ccccc1 Amb33276248 [0,1,0,0,0,0|0,0,0]=1 2253 B12R1.34 CNC(C)C(F)c1ccccc1 Amb27392376 [0,1,0,0,0,0|1,0,0]=2 2254 B12R1.34 CNC(C)C(O)c1ccccc1 Amb8629224 [0,1,0,0,0,0|1,0,0]=2 2255 B12R1.34 CNC(C)C(O)c1cnccn1 Amb35621613 [0,1,0,0,0,0|3,0,0]=4 2256 B12R1.34 CNC(C)C(O)c1cncnc1 Amb35741308 [0,1,0,0,0,0|3,0,0]=4 2257 B12R1.34 CN[C@@H](C)C(=O)c1cccnc1 Amb35659710 [0,1,0,0,0,0|2,0,1]=4 2258 B12R1.34 CN[C@@H](C)C(O)c1cccnc1 Amb35662448 [0,1,0,0,0,0|2,0,0]=3 2259 B12R1.34 CN[C@@H](C)C(O)c1cnccn1 Amb29891487 [0,1,0,0,0,0|3,0,0]=4 2260 B12R1.34 CN[C@@H](C)C(O)c1cncnc1 Amb35662597 [0,1,0,0,0,0|3,0,0]=4 2261 B12R1.34 CN[C@@H](C)[C@@H](F)c1ccccc1 Amb27400552 [0,1,0,0,0,0|1,0,0]=2 2262 B12R1.34 CN[C@@H](C)[C@@H](O)c1ccccc1 Amb533737 [0,1,0,0,0,0|1,0,0]=2 2263 B12R1.34 CN[C@@H](C)[C@H](F)c1ccccc1 Amb27441123 [0,1,0,0,0,0|1,0,0]=2 2264 B12R1.34 CN[C@@H](C)[C@H](O)c1ccccc1 Amb3939358 [0,1,0,0,0,0|1,0,0]=2 2265 B12R1.34 CN[C@@H](O)[C@@H](O)c1ccccc1 Amb27190916 [0,1,0,0,0,0|1,0,0]=2 2266 B12R1.34 CN[C@H](C)C(=O)c1ccccc1 Amb28129791 [0,1,0,0,0,0|1,0,1]=3 2267 B12R1.34 CN[C@H](C)[C@@H](F)c1ccccc1 Amb27393978 [0,1,0,0,0,0|1,0,0]=2 2268 B12R1.34 CN[C@H](C)[C@H](Cl)c1ccccc1 Amb28184716 [0,1,0,0,0,0|1,0,0]=2 2269 B12R1.34 CN[C@H](C)[C@H](O)c1ccccc1 Amb19133732 [0,1,0,0,0,0|1,0,0]=2 2270 B12R1.34 CN[C@H](C)[C@H](O)c1ccccc1 Amb3939359 [0,1,0,0,0,0|1,0,0]=2 2271 B12R1.34 CN[C@H](C)[C@H](S)c1ccccc1 Amb27430364 [0,1,0,0,0,0|1,0,0]=2 2272 B12R1.34 COC(=N)C(O)c1ccccc1 Amb27953078 [0,1,0,0,0,0|2,0,1]=4 2273 B12R1.34 COC(=O)C(Br)c1ccccc1 Amb3939722 [0,1,0,0,0,0|2,0,1]=4 2274 B12R1.34 COC(=O)C(C)c1ccccc1 Amb16185437 [0,1,0,0,0,0|1,0,1]=3 2275 B12R1.34 COC(=O)C(C)c1ccccn1 Amb19375013 [0,1,0,0,0,0|2,0,1]=4 2276 B12R1.34 COC(=O)C(C)c1cccnc1 Amb18798400 [0,1,0,0,0,0|2,0,1]=4 2277 B12R1.34 COC(=O)C(C)c1ccncc1 Amb19374810 [0,1,0,0,0,0|2,0,1]=4 2278 B12R1.34 COC(=O)C(Cl)c1ccccc1 Amb1212399 [0,1,0,0,0,0|2,0,1]=4 2279 B12R1.34 COC(=O)C(F)c1ccccc1 Amb24179152 [0,1,0,0,0,0|2,0,1]=4 2280 B12R1.34 COC(=O)C(N)c1ccccc1 Amb1196141 [0,1,0,0,0,0|2,0,1]=4 2281 B12R1.34 COC(=O)C(N)c1ccccc1 Amb1911591 [0,1,0,0,0,0|2,0,1]=4 2282 B12R1.34 COC(=O)C(O)c1ccccc1 Amb3939682 [0,1,0,0,0,0|2,0,1]=4 2283 B12R1.34 COC(=O)C([NH-])c1ccccc1 Amb8439013 [0,1,0,0,0,0|2,0,1]=4 2284 B12R1.34 COC(=O)C([NH3+])c1ccccc1 Amb4006043 [0,1,0,0,0,0|2,0,1]=4 2285 B12R1.34 COC(=O)[C@@H](C)c1ccccc1 Amb24704365 [0,1,0,0,0,0|1,0,1]=3 2286 B12R1.34 COC(=O)[C@@H](Cl)c1ccccc1 Amb27984727 [0,1,0,0,0,0|2,0,1]=4 2287 B12R1.34 COC(=O)[C@@H](N)c1ccccc1 Amb3941407 [0,1,0,0,0,0|2,0,1]=4 2288 B12R1.34 COC(=O)[C@@H](N)c1ccccc1 Amb8627870 [0,1,0,0,0,0|2,0,1]=4 2289 B12R1.34 COC(=O)[C@@H](O)c1ccccc1 Amb3939704 [0,1,0,0,0,0|2,0,1]=4 2290 B12R1.34 COC(=O)[C@H](C)c1ccccc1 Amb28244200 [0,1,0,0,0,0|1,0,1]=3 2291 B12R1.34 COC(=O)[C@H](N)c1ccccc1 Amb20240647 [0,1,0,0,0,0|2,0,1]=4 2292 B12R1.34 COC(=O)[C@H](N)c1ccccc1 Amb3940044 [0,1,0,0,0,0|2,0,1]=4 2293 B12R1.34 COC(=O)[C@H](O)c1ccccc1 Amb3939671 [0,1,0,0,0,0|2,0,1]=4 2294 B12R1.34 COC(N)C(O)c1ccccc1 Amb28397502 [0,1,0,0,0,0|2,0,0]=3 2295 B12R1.34 COC(O)[C@@H](N)c1ccccc1 Amb27625851 [0,1,0,0,0,0|2,0,0]=3 2296 B12R1.34 CO[C@@H](C)[C@@H](O)c1ccccc1 Amb27615564 [0,1,0,0,0,0|2,0,0]=3 2297 B12R1.34 CSC(C)C(=O)c1ccccc1 Amb18796322 [0,1,0,0,0,0|2,0,1]=4 2298 B12R1.34 CSC(O)C(=O)c1ccccc1 Amb17594697 [0,1,0,0,0,0|2,0,1]=4 2299 B12R1.34 C[C@@H](C#N)[C@@H](O)c1ccccc1 Amb27757193 [0,1,0,0,0,0|3,0,0]=4 2300 B12R1.34 C[C@@H](CO)[C@@H](C)c1ccccc1 Amb27178556 [0,1,0,0,0,0|2,0,0]=3 2301 B12R1.34 C[C@@H](NO)[C@@H](O)c1ccccc1 Amb27770879 [0,1,0,0,0,0|2,0,0]=3 2302 B12R1.34 C[C@@H](c1ccccc1)[C@@H](O)CO Amb27763660 [0,1,0,0,0,0|2,0,0]=3 2303 B12R1.34 C[C@@H](c1ccccc1)[C@H](F)CO Amb27770738 [0,1,0,0,0,0|2,0,0]=3 2304 B12R1.34 C[C@H](C#N)[C@@H](O)c1ccccc1 Amb27170255 [0,1,0,0,0,0|3,0,0]=4 2305 B12R1.34 C[C@H](C=O)[C@@H](C)c1ccccc1 Amb28243965 [0,1,0,0,0,0|2,0,0]=3 2306 B12R1.34 C[C@H](C=O)[C@H](O)c1ccccc1 Amb27873253 [0,1,0,0,0,0|3,0,0]=4 2307 B12R1.34 C[C@H](CO)C(N)c1ccccc1 Amb27614720 [0,1,0,0,0,0|3,0,0]=4 2308 B12R1.34 C[C@H](NN)[C@@H](O)c1ccccc1 Amb27662181 [0,1,0,0,0,0|2,0,0]=3 2309 B12R1.34 C[C@H](NO)[C@@H](O)c1ccccc1 Amb28242677 [0,1,0,0,0,0|2,0,0]=3 2310 B12R1.34 C[C@H](c1ccccc1)[C@@H](C)C=O Amb27193040 [0,1,0,0,0,0|2,0,0]=3 2311 B12R1.34 C[C@H](c1ccccc1)[C@H](F)CO Amb27766616 [0,1,0,0,0,0|2,0,0]=3 2312 B12R1.34 C[C@H](c1ccccc1)[C@H](O)C#N Amb27484775 [0,1,0,0,0,0|2,0,0]=3 2313 B12R1.34 C\C=C(\C)C(O)c1ccccc1 Amb27764784 [0,1,0,0,0,0|2,0,1]=4 2314 B12R1.34 C\C=C(\Cl)N(C)c1ccccc1 Amb27619788 [0,1,0,0,0,0|2,0,1]=4 2315 B12R1.34 C\N=C(/C)C(Cl)c1ccccc1 Amb28343046 [0,1,0,0,0,0|1,0,2]=4 2316 B12R1.34 C\N=C(\C)C(O)c1ccccc1 Amb27761496 [0,1,0,0,0,0|1,0,2]=4 2317 B12R1.34 N#CC(Br)C(Br)c1ccccc1 Amb4012475 [0,1,0,0,0,0|3,0,0]=4 2318 B12R1.34 N#CC(O)C(F)c1ccccc1 Amb25320704 [0,1,0,0,0,0|3,0,0]=4 2319 B12R1.34 N#CC(O)C(O)c1ccccc1 Amb27829928 [0,1,0,0,0,0|3,0,0]=4 2320 B12R1.34 N#CC(O)[C@@H](N)c1ccccc1 Amb27400526 [0,1,0,0,0,0|3,0,0]=4 2321 B12R1.34 N#C[C@@H](O)[C@@H](F)c1ccccc1 Amb27835111 [0,1,0,0,0,0|3,0,0]=4 2322 B12R1.34 N#C[C@@H](O)[C@@H](O)c1ccccc1 Amb27651908 [0,1,0,0,0,0|3,0,0]=4 2323 B12R1.34 N#C[C@H](N)[C@@H](F)c1ccccc1 Amb28135510 [0,1,0,0,0,0|3,0,0]=4 2324 B12R1.34 NC(C(=O)NO)c1ccccc1 Amb2430893 [0,1,0,0,0,0|2,0,1]=4 2325 B12R1.34 NC(CO)C(N)c1ccccc1 Amb27430428 [0,1,0,0,0,0|3,0,0]=4 2326 B12R1.34 NC(CO)C(O)c1ccccc1 Amb4034588 [0,1,0,0,0,0|3,0,0]=4 2327 B12R1.34 NC(c1ccccc1)C(O)CO Amb18646773 [0,1,0,0,0,0|3,0,0]=4 2328 B12R1.34 NCC(O)C(O)c1ccccc1 Amb19148004 [0,1,0,0,0,0|3,0,0]=4 2329 B12R1.34 NNC(=O)C(Cl)c1ccccc1 Amb27760517 [0,1,0,0,0,0|2,0,1]=4 2330 B12R1.34 NNC(=O)C(N)c1ccccc1 Amb18061964 [0,1,0,0,0,0|2,0,1]=4 2331 B12R1.34 NNC(=O)C(O)c1ccccc1 Amb9758540 [0,1,0,0,0,0|2,0,1]=4 2332 B12R1.34 NNC(=O)[C@@H](O)c1ccccc1 Amb22587557 [0,1,0,0,0,0|2,0,1]=4 2333 B12R1.34 NNC(=O)[C@H](N)c1ccccc1 Amb28458191 [0,1,0,0,0,0|2,0,1]=4 2334 B12R1.34 NNC(=O)[C@H](O)c1ccccc1 Amb25121730 [0,1,0,0,0,0|2,0,1]=4 2335 B12R1.34 N[C@@H](CO)[C@@H](O)c1ccccc1 Amb6298328 [0,1,0,0,0,0|3,0,0]=4 2336 B12R1.34 N[C@H](C(=O)NO)c1ccccc1 Amb27236809 [0,1,0,0,0,0|2,0,1]=4 2337 B12R1.34 N[C@H](CO)[C@@H](Cl)c1ccccc1 Amb27791780 [0,1,0,0,0,0|3,0,0]=4 2338 B12R1.34 N[C@H](CO)[C@H](O)c1ccccc1 Amb8515836 [0,1,0,0,0,0|3,0,0]=4 2339 B12R1.34 N[C@H](c1ccccc1)[C@H](O)CO Amb27430365 [0,1,0,0,0,0|3,0,0]=4 2340 B12R1.34 O=C(NCl)C(Cl)c1ccccc1 Amb27799831 [0,1,0,0,0,0|2,0,1]=4 2341 B12R1.34 O=CC(Cl)C(O)c1ccccc1 Amb27407093 [0,1,0,0,0,0|3,0,0]=4 2342 B12R1.34 O=C[C@@H](O)[C@H](O)c1ccccc1 Amb27390110 [0,1,0,0,0,0|3,0,0]=4 2343 B12R1.34 OC(CCl)C(F)c1ccccc1 Amb28343186 [0,1,0,0,0,0|3,0,0]=4 2344 B12R1.34 OC(CF)C(F)c1ccccc1 Amb28127891 [0,1,0,0,0,0|3,0,0]=4 2345 B12R1.34 OC(c1ccccc1)C(Cl)CCl Amb27623177 [0,1,0,0,0,0|3,0,0]=4 2346 B12R1.34 OCC(Br)C(Br)c1ccccc1 Amb27393982 [0,1,0,0,0,0|3,0,0]=4 2347 B12R1.34 OC[C@@H](Cl)[C@@H](O)c1ccccc1 Amb27983838 [0,1,0,0,0,0|3,0,0]=4 2348 B12R1.34 OC[C@@H](O)[C@@H](O)c1ccccc1 Amb28244272 [0,1,0,0,0,0|3,0,0]=4 2349 B12R1.34 OC[C@@H](O)[C@H](O)c1ccccc1 Amb24496901 [0,1,0,0,0,0|3,0,0]=4 2350 B12R1.34 OC[C@H](O)[C@H](Cl)c1ccccc1 Amb27231781 [0,1,0,0,0,0|3,0,0]=4 2351 B12R1.34 O[C@@H](CCl)[C@@H](F)c1ccccc1 Amb28343033 [0,1,0,0,0,0|3,0,0]=4 2352 B12R1.34 O[C@@H](CF)[C@H](F)c1ccccc1 Amb27255180 [0,1,0,0,0,0|3,0,0]=4 2353 B12R1.34 O[C@H](CCl)[C@H](O)c1ccccc1 Amb27657548 [0,1,0,0,0,0|3,0,0]=4 2354 B12R1.34 [BH3-]NC(C)C(O)c1ccccc1 Amb28193544 [0,1,0,0,0,0|2,0,0]=3 2355 B12R1.34 [C-]#[N+]C(C)C(C)c1ccccc1 Amb33081598 [0,1,0,0,0,0|0,0,2]=3 2356 B12R1.34 [NH3+]C(CO)C(O)c1ccccc1 Amb33513059 [0,1,0,0,0,0|3,0,0]=4 2357 B12R1.39 B[P](C)(CCO)c1ccccc1 Amb27770875 [0,1,0,0,0,0|3,0,0]=4 2358 B12R1.39 C#CCC(C)(C)c1ccccc1 Amb33175838 [0,1,0,0,0,0|1,0,1]=3 2359 B12R1.39 C#CCC(C)(N)c1ccccc1 Amb35678351 [0,1,0,0,0,0|1,0,1]=3 2360 B12R1.39 C#CCC(C)(O)c1ccccc1 Amb25987029 [0,1,0,0,0,0|1,0,1]=3 2361 B12R1.39 C#CCC(C)(O)c1ccccn1 Amb24686664 [0,1,0,0,0,0|2,0,1]=4 2362 B12R1.39 C#CCC(C)(O)c1cccnc1 Amb28066455 [0,1,0,0,0,0|2,0,1]=4 2363 B12R1.39 C#CCC(C)(O)c1ccncc1 Amb25153969 [0,1,0,0,0,0|2,0,1]=4 2364 B12R1.39 C#CCC(F)(F)c1ccccc1 Amb33082223 [0,1,0,0,0,0|2,0,1]=4 2365 B12R1.39 C=C=CC(C)(N)c1ccccc1 Amb28240482 [0,1,0,0,0,0|1,0,2]=4 2366 B12R1.39 C=CCC(C)(N)c1ccccc1 Amb28290415 [0,1,0,0,0,0|1,0,1]=3 2367 B12R1.39 C=CCC(C)(N)c1cccnc1 Amb28282549 [0,1,0,0,0,0|2,0,1]=4 2368 B12R1.39 C=CCC(C)(O)c1ccccc1 Amb4035093 [0,1,0,0,0,0|1,0,1]=3 2369 B12R1.39 C=CC[Si](C)(C)c1ccccc1 Amb2389294 [0,1,0,0,0,0|1,1,1]=4 2370 B12R1.39 CC(C)(CC#N)c1ccccc1 Amb18645224 [0,1,0,0,0,0|2,0,0]=3 2371 B12R1.39 CC(C)(CC=O)c1ccccc1 Amb18645712 [0,1,0,0,0,0|2,0,0]=3 2372 B12R1.39 CC(C)(CCBr)c1ccccc1 Amb25726868 [0,1,0,0,0,0|2,0,0]=3 2373 B12R1.39 CC(C)(CCCl)c1ccccc1 Amb27425237 [0,1,0,0,0,0|2,0,0]=3 2374 B12R1.39 CC(C)(CCN)c1ccccc1 Amb6740021 [0,1,0,0,0,0|2,0,0]=3 2375 B12R1.39 CC(C)(CCN)c1ccccn1 Amb26595541 [0,1,0,0,0,0|3,0,0]=4 2376 B12R1.39 CC(C)(CCN)c1cccnc1 Amb26399514 [0,1,0,0,0,0|3,0,0]=4 2377 B12R1.39 CC(C)(CCN)c1ccncc1 Amb25911787 [0,1,0,0,0,0|3,0,0]=4 2378 B12R1.39 CC(C)(CCO)c1ccccc1 Amb23440831 [0,1,0,0,0,0|2,0,0]=3 2379 B12R1.39 CC(C)(CCO)c1ccncc1 Amb27456693 [0,1,0,0,0,0|3,0,0]=4 2380 B12R1.39 CC(C)(CCS)c1ccccc1 Amb33176152 [0,1,0,0,0,0|2,0,0]=3 2381 B12R1.39 CC(C)(CNN)c1ccccc1 Amb6250005 [0,1,0,0,0,0|1,0,0]=2 2382 B12R1.39 CC(C)(CNO)c1ccccc1 Amb33475500 [0,1,0,0,0,0|1,0,0]=2 2383 B12R1.39 CC(C)(CON)c1ccccc1 Amb32953309 [0,1,0,0,0,0|2,0,0]=3 2384 B12R1.39 CC(C)(CON)c1ccccn1 Amb33360780 [0,1,0,0,0,0|3,0,0]=4 2385 B12R1.39 CC(C)(CON)c1cccnc1 Amb33224703 [0,1,0,0,0,0|3,0,0]=4 2386 B12R1.39 CC(C)(CON)c1ccncc1 Amb33380659 [0,1,0,0,0,0|3,0,0]=4 2387 B12R1.39 CC(C)(N=C=O)c1ccccc1 Amb17232367 [0,1,0,0,0,0|3,0,0]=4 2388 B12R1.39 CC(C)(N=C=S)c1ccccc1 Amb27659643 [0,1,0,0,0,0|3,0,0]=4 2389 B12R1.39 CC(C)(NC=O)c1ccccc1 Amb27875118 [0,1,0,0,0,0|3,0,0]=4 2390 B12R1.39 CC(C)(\C=C\Cl)c1ccccc1 Amb27444624 [0,1,0,0,0,0|2,0,1]=4 2391 B12R1.39 CC(N)(CC#N)c1ccccc1 Amb27792007 [0,1,0,0,0,0|2,0,0]=3 2392 B12R1.39 CC(N)(CCF)c1ccccc1 Amb35711305 [0,1,0,0,0,0|2,0,0]=3 2393 B12R1.39 CC(N)(CCO)c1ccccc1 Amb18862633 [0,1,0,0,0,0|2,0,0]=3 2394 B12R1.39 CC(N)(\C=C\Cl)c1ccccc1 Amb28396503 [0,1,0,0,0,0|2,0,1]=4 2395 B12R1.39 CC(O)(CC#N)c1ccccc1 Amb4405874 [0,1,0,0,0,0|2,0,0]=3 2396 B12R1.39 CC(O)(CC=O)c1ccccn1 Amb28069286 [0,1,0,0,0,0|3,0,0]=4 2397 B12R1.39 CC(O)(CCN)c1ccccc1 Amb17594116 [0,1,0,0,0,0|2,0,0]=3 2398 B12R1.39 CC(O)(CCN)c1ccccn1 Amb18827673 [0,1,0,0,0,0|3,0,0]=4 2399 B12R1.39 CC(O)(CCN)c1cccnc1 Amb18827674 [0,1,0,0,0,0|3,0,0]=4 2400 B12R1.39 CC(O)(CCN)c1ccncc1 Amb18827672 [0,1,0,0,0,0|3,0,0]=4 2401 B12R1.39 CC(O)(CNN)c1ccccc1 Amb17232616 [0,1,0,0,0,0|1,0,0]=2 2402 B12R1.39 CCCC(C)(C)c1ccccc1 Amb27231101 [0,1,0,0,0,0|1,0,0]=2 2403 B12R1.39 CCCC(C)(N)c1ccccc1 Amb9676775 [0,1,0,0,0,0|1,0,0]=2 2404 B12R1.39 CCCC(C)(N)c1ncccn1 Amb32716245 [0,1,0,0,0,0|3,0,0]=4 2405 B12R1.39 CCCC(C)(O)c1ccccc1 Amb4019246 [0,1,0,0,0,0|1,0,0]=2 2406 B12R1.39 CCCC(C)(O)c1ccccn1 Amb28455870 [0,1,0,0,0,0|2,0,0]=3 2407 B12R1.39 CCCC(C)(O)c1cccnc1 Amb27979710 [0,1,0,0,0,0|2,0,0]=3 2408 B12R1.39 CCCS(=O)(=O)c1ccccc1 Amb24485446 [0,1,0,0,0,0|3,0,0]=4 2409 B12R1.39 CCOP(C)(=O)c1ccccc1 Amb24487373 [0,1,0,0,0,0|3,0,0]=4 2410 B12R1.39 CCO[Si](C)(C)c1ccccc1 Amb19894004 [0,1,0,0,0,0|2,1,0]=4 2411 B12R1.39 CCSC(C)(C)c1ccccc1 Amb28349658 [0,1,0,0,0,0|2,0,0]=3 2412 B12R1.39 CNCC(C)(C)c1ccccc1 Amb9214715 [0,1,0,0,0,0|0,0,0]=1 2413 B12R1.39 CNCC(C)(C)c1ccccn1 Amb27396065 [0,1,0,0,0,0|1,0,0]=2 2414 B12R1.39 CNCC(C)(C)c1cccnc1 Amb26365951 [0,1,0,0,0,0|1,0,0]=2 2415 B12R1.39 CNCC(C)(C)c1ccncc1 Amb26539559 [0,1,0,0,0,0|1,0,0]=2 2416 B12R1.39 CNCC(C)(O)c1ccccc1 Amb5751082 [0,1,0,0,0,0|0,0,0]=1 2417 B12R1.39 CNCC(C)(O)c1ccccn1 Amb18064992 [0,1,0,0,0,0|1,0,0]=2 2418 B12R1.39 CNCC(C)(O)c1cccnc1 Amb18062824 [0,1,0,0,0,0|1,0,0]=2 2419 B12R1.39 CNCC(C)(O)c1ccncc1 Amb18562953 [0,1,0,0,0,0|1,0,0]=2 2420 B12R1.39 CNCC(F)(F)c1ccccc1 Amb27251609 [0,1,0,0,0,0|1,0,0]=2 2421 B12R1.39 CNCP(=O)(O)c1ccccc1 Amb27778480 [0,1,0,0,0,0|2,0,0]=3 2422 B12R1.39 COCC(C)(N)c1ccccc1 Amb18992592 [0,1,0,0,0,0|1,0,0]=2 2423 B12R1.39 COCC(C)(N)c1ccccn1 Amb25762842 [0,1,0,0,0,0|2,0,0]=3 2424 B12R1.39 COCC(C)(N)c1ccncc1 Amb24593523 [0,1,0,0,0,0|2,0,0]=3 2425 B12R1.39 COCC(C)(N)c1cncnc1 Amb18299361 [0,1,0,0,0,0|3,0,0]=4 2426 B12R1.39 COCC(C)(O)c1ccccc1 Amb18801043 [0,1,0,0,0,0|1,0,0]=2 2427 B12R1.39 COCC(C)(O)c1ccccn1 Amb22897034 [0,1,0,0,0,0|2,0,0]=3 2428 B12R1.39 COCC(C)(O)c1cncnc1 Amb18805826 [0,1,0,0,0,0|3,0,0]=4 2429 B12R1.39 COCS(=O)(=O)c1ccccc1 Amb24324970 [0,1,0,0,0,0|3,0,0]=4 2430 B12R1.39 CSCC(C)(O)c1ccccc1 Amb19061286 [0,1,0,0,0,0|1,0,0]=2 2431 B12R1.39 CSCS(=O)(=O)c1ccccc1 Amb9786504 [0,1,0,0,0,0|3,0,0]=4 2432 B12R1.39 C[C@@](O)(CCO)c1ccccc1 Amb27179357 [0,1,0,0,0,0|2,0,0]=3 2433 B12R1.39 C[C@](O)(CC=O)c1ccccc1 Amb27855035 [0,1,0,0,0,0|2,0,0]=3 2434 B12R1.39 C[NH2+]CC(C)(O)c1ccccc1 Amb4282803 [0,1,0,0,0,0|0,0,1]=2 2435 B12R1.39 C[Si](C)(CCN)c1ccccc1 Amb27480080 [0,1,0,0,0,0|2,1,0]=4 2436 B12R1.39 FC(F)(CCBr)c1ccccc1 Amb33082218 [0,1,0,0,0,0|3,0,0]=4 2437 B12R1.39 FC(F)(CCCl)c1ccccc1 Amb27222842 [0,1,0,0,0,0|3,0,0]=4 2438 B12R1.39 FC(F)(CCS)c1ccccc1 Amb33082515 [0,1,0,0,0,0|3,0,0]=4 2439 B12R1.39 N#CCC(F)(F)c1ccccc1 Amb25070879 [0,1,0,0,0,0|3,0,0]=4 2440 B12R1.39 NCCC(F)(F)c1ccccc1 Amb27249550 [0,1,0,0,0,0|3,0,0]=4 2441 B12R1.39 NNCC(F)(F)c1ccccc1 Amb25692683 [0,1,0,0,0,0|2,0,0]=3 2442 B12R1.39 NOCC(F)(F)c1ccccc1 Amb25842068 [0,1,0,0,0,0|3,0,0]=4 2443 B12R1.39 N[C@@](O)(CCO)c1ccccc1 Amb28064120 [0,1,0,0,0,0|3,0,0]=4 2444 B12R1.39 O=CCC(F)(F)c1ccccc1 Amb26558709 [0,1,0,0,0,0|3,0,0]=4 2445 B12R1.39 OCCC(F)(F)c1ccccc1 Amb27653210 [0,1,0,0,0,0|3,0,0]=4 2446 B12R1.39 ONCC(F)(F)c1ccccc1 Amb33081926 [0,1,0,0,0,0|2,0,0]=3 2447 B12R1.39 [BH3-][P@+](C)(CC=O)c1ccccc1 Amb27260522 [0,1,0,0,0,0|3,0,0]=4 2448 B12R1.39 [BH3-][P@@+](C)(CC=O)c1ccccc1 Amb27972984 [0,1,0,0,0,0|3,0,0]=4 2449 B12R1.39 [C-]#[N+]CC(C)(C)c1ccccc1 Amb33475556 [0,1,0,0,0,0|0,0,2]=3 2450 B12R1.39 [C-]#[N+]CC(F)(F)c1ccccc1 Amb25249868 [0,1,0,0,0,0|1,0,2]=4 2451 B12R1.107 C=C(C)CC(=O)c1ccccc1 Amb18563490 [0,1,0,0,0,0|2,0,1]=4 2452 B12R1.107 C=C(C)C[C@@H](N)c1ccccn1 Amb27196269 [0,1,0,0,0,0|3,0,0]=4 2453 B12R1.107 C=C(C)C[C@@H](O)c1ccccc1 Amb27396487 [0,1,0,0,0,0|2,0,0]=3 2454 B12R1.107 C=C(C)C[C@@H](O)c1ccccn1 Amb27652999 [0,1,0,0,0,0|3,0,0]=4 2455 B12R1.107 C=C(C)NC(C)c1ccccc1 Amb27616873 [0,1,0,0,0,0|2,0,0]=3 2456 B12R1.107 C=C(C)N[C@@H](C)c1ccccc1 Amb27858912 [0,1,0,0,0,0|2,0,0]=3 2457 B12R1.107 C=C(CC(C)=O)c1ccccc1 Amb27802448 [0,1,0,0,0,0|1,0,2]=4 2458 B12R1.107 C=C(CC(C)O)c1ccccc1 Amb27486292 [0,1,0,0,0,0|1,0,2]=4 2459 B12R1.107 C=C(CN(C)C)c1ccccn1 Amb27779301 [0,1,0,0,0,0|1,0,2]=4 2460 B12R1.107 C=C(Cl)CC(N)c1ccccc1 Amb27259258 [0,1,0,0,0,0|2,0,1]=4 2461 B12R1.107 C=C(Cl)CN(C)c1ccccc1 Amb4009715 [0,1,0,0,0,0|2,0,1]=4 2462 B12R1.107 C=C(Cl)C[C@@H](O)c1ccccc1 Amb27834223 [0,1,0,0,0,0|2,0,1]=4 2463 B12R1.107 C=C(O)CC(C)c1ccncc1 Amb27163578 [0,1,0,0,0,0|2,0,1]=4 2464 B12R1.107 CC(=N)CC(=O)c1ccccc1 Amb4354188 [0,1,0,0,0,0|2,0,1]=4 2465 B12R1.107 CC(=N)NC(C)c1ccccc1 Amb27662516 [0,1,0,0,0,0|2,0,0]=3 2466 B12R1.107 CC(=N)N[C@@H](C)c1ccccc1 Amb27633148 [0,1,0,0,0,0|2,0,0]=3 2467 B12R1.107 CC(=O)CC(=O)c1ccccc1 Amb534154 [0,1,0,0,0,0|2,0,1]=4 2468 B12R1.107 CC(=O)CC(C)c1ccccc1 Amb5740067 [0,1,0,0,0,0|1,0,0]=2 2469 B12R1.107 CC(=O)CC(C)c1cnccn1 Amb27267583 [0,1,0,0,0,0|3,0,0]=4 2470 B12R1.107 CC(=O)CC(C)c1cncnc1 Amb27175545 [0,1,0,0,0,0|3,0,0]=4 2471 B12R1.107 CC(=O)CC(O)c1ccccc1 Amb28324943 [0,1,0,0,0,0|2,0,0]=3 2472 B12R1.107 CC(=O)CC(O)c1ccccn1 Amb1016907 [0,1,0,0,0,0|3,0,0]=4 2473 B12R1.107 CC(=O)CC(O)c1cccnc1 Amb28399354 [0,1,0,0,0,0|3,0,0]=4 2474 B12R1.107 CC(=O)C[C@@H](O)c1ccccc1 Amb27802735 [0,1,0,0,0,0|2,0,0]=3 2475 B12R1.107 CC(=O)C[C@H](N)c1ccccc1 Amb27882797 [0,1,0,0,0,0|2,0,0]=3 2476 B12R1.107 CC(=O)C[C@H](O)c1ccncc1 Amb27227062 [0,1,0,0,0,0|3,0,0]=4 2477 B12R1.107 CC(=O)NC(C)c1ccccc1 Amb6390965 [0,1,0,0,0,0|2,0,0]=3 2478 B12R1.107 CC(=O)NC(C)c1cccnc1 Amb27243970 [0,1,0,0,0,0|3,0,0]=4 2479 B12R1.107 CC(=O)NN(C)c1ccccc1 Amb6400375 [0,1,0,0,0,0|3,0,0]=4 2480 B12R1.107 CC(=O)N[C@@H](C)c1ccccc1 Amb8516282 [0,1,0,0,0,0|2,0,0]=3 2481 B12R1.107 CC(=O)N[C@H](C)c1ccccc1 Amb2742666 [0,1,0,0,0,0|2,0,0]=3 2482 B12R1.107 CC(=O)OC(C)c1ccccc1 Amb4037062 [0,1,0,0,0,0|2,0,0]=3 2483 B12R1.107 CC(=O)O[C@@H](C)c1ccccn1 Amb27762276 [0,1,0,0,0,0|3,0,0]=4 2484 B12R1.107 CC(=O)SC(O)c1ccccc1 Amb27775515 [0,1,0,0,0,0|3,0,0]=4 2485 B12R1.107 CC(Br)CC(Br)c1ccccc1 Amb27267411 [0,1,0,0,0,0|2,0,0]=3 2486 B12R1.107 CC(Br)CC(C)c1ccccc1 Amb25273655 [0,1,0,0,0,0|1,0,0]=2 2487 B12R1.107 CC(Br)CC(C)c1cccnc1 Amb27861849 [0,1,0,0,0,0|2,0,0]=3 2488 B12R1.107 CC(C)=C[C@@H](O)c1ccccc1 Amb27432272 [0,1,0,0,0,0|2,0,1]=4 2489 B12R1.107 CC(C)CC(=O)c1ccccc1 Amb4017884 [0,1,0,0,0,0|2,0,1]=4 2490 B12R1.107 CC(C)CC(C)c1ccccn1 Amb2694521 [0,1,0,0,0,0|2,0,0]=3 2491 B12R1.107 CC(C)CC(N)c1ccccc1 Amb6892355 [0,1,0,0,0,0|2,0,0]=3 2492 B12R1.107 CC(C)CC(N)c1ccccc1 Amb9703509 [0,1,0,0,0,0|2,0,0]=3 2493 B12R1.107 CC(C)CC(N)c1ccccn1 Amb18993299 [0,1,0,0,0,0|3,0,0]=4 2494 B12R1.107 CC(C)CC(N)c1cccnc1 Amb10607963 [0,1,0,0,0,0|3,0,0]=4 2495 B12R1.107 CC(C)CC(N)c1ccncc1 Amb18968290 [0,1,0,0,0,0|3,0,0]=4 2496 B12R1.107 CC(C)CC(O)c1ccccc1 Amb1110402 [0,1,0,0,0,0|2,0,0]=3 2497 B12R1.107 CC(C)CC(O)c1ccccn1 Amb18792671 [0,1,0,0,0,0|3,0,0]=4 2498 B12R1.107 CC(C)CC(O)c1cccnc1 Amb17232541 [0,1,0,0,0,0|3,0,0]=4 2499 B12R1.107 CC(C)CC(S)c1ccccc1 Amb7784758 [0,1,0,0,0,0|2,0,0]=3 2500 B12R1.107 CC(C)CN(C)c1ccccc1 Amb17232437 [0,1,0,0,0,0|2,0,0]=3 2501 B12R1.107 CC(C)CN(C)c1ccccn1 Amb27979304 [0,1,0,0,0,0|3,0,0]=4 2502 B12R1.107 CC(C)C[C@@H](N)c1ccccc1 Amb22288660 [0,1,0,0,0,0|2,0,0]=3 2503 B12R1.107 CC(C)C[C@@H](N)c1ccccc1 Amb27175567 [0,1,0,0,0,0|2,0,0]=3 2504 B12R1.107 CC(C)C[C@H](N)c1ccccc1 Amb22288705 [0,1,0,0,0,0|2,0,0]=3 2505 B12R1.107 CC(C)C[C@H](N)c1ccccc1 Amb27249677 [0,1,0,0,0,0|2,0,0]=3 2506 B12R1.107 CC(C)C[C@H](N)c1ccccn1 Amb27983523 [0,1,0,0,0,0|3,0,0]=4 2507 B12R1.107 CC(C)C[C@H](N)c1cccnc1 Amb27202869 [0,1,0,0,0,0|3,0,0]=4 2508 B12R1.107 CC(C)NC(C)c1ccccc1 Amb9739299 [0,1,0,0,0,0|2,0,0]=3 2509 B12R1.107 CC(C)NC(C)c1ccccn1 Amb6685439 [0,1,0,0,0,0|3,0,0]=4 2510 B12R1.107 CC(C)NC(C)c1cccnc1 Amb6685441 [0,1,0,0,0,0|3,0,0]=4 2511 B12R1.107 CC(C)NC(C)c1ccncc1 Amb6685440 [0,1,0,0,0,0|3,0,0]=4 2512 B12R1.107 CC(C)N[C@@H](C)c1ccccc1 Amb22747560 [0,1,0,0,0,0|2,0,0]=3 2513 B12R1.107 CC(C)N[C@@H](C)c1ccccc1 Amb27251954 [0,1,0,0,0,0|2,0,0]=3 2514 B12R1.107 CC(C)N[C@H](C)c1ccccn1 Amb27397940 [0,1,0,0,0,0|3,0,0]=4 2515 B12R1.107 CC(CC(=N)N)c1ccccc1 Amb25898810 [0,1,0,0,0,0|2,0,0]=3 2516 B12R1.107 CC(CC(=N)N)c1ccccn1 Amb30010229 [0,1,0,0,0,0|3,0,0]=4 2517 B12R1.107 CC(CC(=O)Cl)c1ccccc1 Amb2690275 [0,1,0,0,0,0|2,0,0]=3 2518 B12R1.107 CC(CC(=O)O)c1ccccc1 Amb1207393 [0,1,0,0,0,0|2,0,0]=3 2519 B12R1.107 CC(CC(=O)O)c1ccccn1 Amb6749249 [0,1,0,0,0,0|3,0,0]=4 2520 B12R1.107 CC(CC(=O)O)c1cccnc1 Amb6749217 [0,1,0,0,0,0|3,0,0]=4 2521 B12R1.107 CC(CC(=O)O)c1ccncc1 Amb32668732 [0,1,0,0,0,0|3,0,0]=4 2522 B12R1.107 CC(CC(=O)O)c1ccncc1 Amb33528474 [0,1,0,0,0,0|3,0,0]=4 2523 B12R1.107 CC(CC(N)=O)c1ccccc1 Amb3886650 [0,1,0,0,0,0|2,0,0]=3 2524 B12R1.107 CC(CC(N)=O)c1cccnc1 Amb27832020 [0,1,0,0,0,0|3,0,0]=4 2525 B12R1.107 CC(CC(N)=S)c1ccccc1 Amb24583414 [0,1,0,0,0,0|2,0,0]=3 2526 B12R1.107 CC(CC(N)=S)c1ccccn1 Amb30010249 [0,1,0,0,0,0|3,0,0]=4 2527 B12R1.107 CC(CN(C)O)c1ccccc1 Amb33081590 [0,1,0,0,0,0|0,0,0]=1 2528 B12R1.107 CC(CS(=O)Cl)c1ccccc1 Amb28286106 [0,1,0,0,0,0|2,0,0]=3 2529 B12R1.107 CC(CS(=O)[O-])c1ccccc1 Amb24385785 [0,1,0,0,0,0|2,0,0]=3 2530 B12R1.107 CC(C[C@@H](C)N)c1ccccc1 Amb33081852 [0,1,0,0,0,0|1,0,0]=2 2531 B12R1.107 CC(C[C@@H](C)O)c1ccccc1 Amb28207302 [0,1,0,0,0,0|1,0,0]=2 2532 B12R1.107 CC(C[C@H](C)N)c1ccccc1 Amb33081854 [0,1,0,0,0,0|1,0,0]=2 2533 B12R1.107 CC(C[C@H](C)O)c1ccccc1 Amb33081855 [0,1,0,0,0,0|1,0,0]=2 2534 B12R1.107 CC(C[N+](=O)[O-])c1ccccc1 Amb28200114 [0,1,0,0,0,0|1,0,1]=3 2535 B12R1.107 CC(Cl)CC(=O)c1ccccc1 Amb28042789 [0,1,0,0,0,0|2,0,1]=4 2536 B12R1.107 CC(Cl)CC(C)c1ccccc1 Amb27175543 [0,1,0,0,0,0|1,0,0]=2 2537 B12R1.107 CC(Cl)CC(C)c1cccnc1 Amb27624312 [0,1,0,0,0,0|2,0,0]=3 2538 B12R1.107 CC(Cl)CC(C)c1cnccn1 Amb28130865 [0,1,0,0,0,0|3,0,0]=4 2539 B12R1.107 CC(Cl)CC(Cl)c1ccccc1 Amb28068688 [0,1,0,0,0,0|2,0,0]=3 2540 B12R1.107 CC(Cl)CC(O)c1ccccc1 Amb27865488 [0,1,0,0,0,0|2,0,0]=3 2541 B12R1.107 CC(N)CC(=O)c1ccccc1 Amb20668879 [0,1,0,0,0,0|2,0,1]=4 2542 B12R1.107 CC(N)CC(=O)c1ccccc1 Amb22059727 [0,1,0,0,0,0|2,0,1]=4 2543 B12R1.107 CC(N)CC(C)c1ccccc1 Amb27831891 [0,1,0,0,0,0|1,0,0]=2 2544 B12R1.107 CC(N)CC(C)c1ccccn1 Amb35657942 [0,1,0,0,0,0|2,0,0]=3 2545 B12R1.107 CC(N)CC(C)c1cnccn1 Amb27787568 [0,1,0,0,0,0|3,0,0]=4 2546 B12R1.107 CC(N)CC(O)c1ccccc1 Amb18646365 [0,1,0,0,0,0|2,0,0]=3 2547 B12R1.107 CC(N)CN(C)c1ccccc1 Amb10610213 [0,1,0,0,0,0|2,0,0]=3 2548 B12R1.107 CC(N)CN(C)c1ccccc1 Amb1137929 [0,1,0,0,0,0|2,0,0]=3 2549 B12R1.107 CC(N)CN(C)c1ccccn1 Amb18828177 [0,1,0,0,0,0|3,0,0]=4 2550 B12R1.107 CC(N)CS(=O)c1ccccc1 Amb27165944 [0,1,0,0,0,0|3,0,0]=4 2551 B12R1.107 CC(NC(=N)N)c1ccccc1 Amb10669498 [0,1,0,0,0,0|3,0,0]=4 2552 B12R1.107 CC(NC(=N)N)c1ccccc1 Amb22284229 [0,1,0,0,0,0|3,0,0]=4 2553 B12R1.107 CC(NC(=S)S)c1ccccc1 Amb27870768 [0,1,0,0,0,0|3,0,0]=4 2554 B12R1.107 CC(NC(N)=O)c1ccccc1 Amb1135151 [0,1,0,0,0,0|3,0,0]=4 2555 B12R1.107 CC(NC(N)=S)c1ccccc1 Amb1645582 [0,1,0,0,0,0|3,0,0]=4 2556 B12R1.107 CC(NC(O)=S)c1ccccc1 Amb27614814 [0,1,0,0,0,0|3,0,0]=4 2557 B12R1.107 CC(O)CC(=O)c1ccccc1 Amb27177964 [0,1,0,0,0,0|2,0,1]=4 2558 B12R1.107 CC(O)CC(C)c1ccccc1 Amb27651998 [0,1,0,0,0,0|1,0,0]=2 2559 B12R1.107 CC(O)CC(F)c1ccccc1 Amb27588281 [0,1,0,0,0,0|2,0,0]=3 2560 B12R1.107 CC(O)CC(O)c1ccccc1 Amb1110547 [0,1,0,0,0,0|2,0,0]=3 2561 B12R1.107 CC(O)CN(C)c1ccccc1 Amb17138595 [0,1,0,0,0,0|2,0,0]=3 2562 B12R1.107 CC(O)CP(C)c1ccccc1 Amb27615506 [0,1,0,0,0,0|2,0,0]=3 2563 B12R1.107 CC(O)C[C@@H](O)c1ccccc1 Amb27748936 [0,1,0,0,0,0|2,0,0]=3 2564 B12R1.107 CC(O)OC(C)c1ccccc1 Amb28455545 [0,1,0,0,0,0|2,0,0]=3 2565 B12R1.107 CC(OC(=O)Cl)c1ccccc1 Amb27181225 [0,1,0,0,0,0|3,0,0]=4 2566 B12R1.107 CC(SC(=N)N)c1ccccc1 Amb6373046 [0,1,0,0,0,0|3,0,0]=4 2567 B12R1.107 CN(C)CC(=O)c1ccccc1 Amb22264767 [0,1,0,0,0,0|1,0,1]=3 2568 B12R1.107 CN(C)CC(=O)c1ccccc1 Amb9217331 [0,1,0,0,0,0|1,0,1]=3 2569 B12R1.107 CN(C)CC(Cl)c1ccccc1 Amb17546791 [0,1,0,0,0,0|1,0,0]=2 2570 B12R1.107 CN(C)CC(N)c1ccccc1 Amb1218288 [0,1,0,0,0,0|1,0,0]=2 2571 B12R1.107 CN(C)CC(N)c1ccccc1 Amb22042488 [0,1,0,0,0,0|1,0,0]=2 2572 B12R1.107 CN(C)CC(N)c1ccccc1 Amb33249605 [0,1,0,0,0,0|1,0,0]=2 2573 B12R1.107 CN(C)CC(N)c1ccccn1 Amb24543991 [0,1,0,0,0,0|2,0,0]=3 2574 B12R1.107 CN(C)CC(N)c1cccnc1 Amb26007699 [0,1,0,0,0,0|2,0,0]=3 2575 B12R1.107 CN(C)CC(N)c1ccncc1 Amb25315967 [0,1,0,0,0,0|2,0,0]=3 2576 B12R1.107 CN(C)CC(O)c1ccccc1 Amb17104281 [0,1,0,0,0,0|1,0,0]=2 2577 B12R1.107 CN(C)CC(O)c1ccccn1 Amb17550347 [0,1,0,0,0,0|2,0,0]=3 2578 B12R1.107 CN(C)CC(O)c1ccncc1 Amb17550252 [0,1,0,0,0,0|2,0,0]=3 2579 B12R1.107 CN(C)CC(O)c1cnccn1 Amb27446935 [0,1,0,0,0,0|3,0,0]=4 2580 B12R1.107 CN(C)C[C@@H](N)c1ccccc1 Amb22745082 [0,1,0,0,0,0|1,0,0]=2 2581 B12R1.107 CN(C)C[C@@H](N)c1ccccc1 Amb28555756 [0,1,0,0,0,0|1,0,0]=2 2582 B12R1.107 CN(C)C[C@H](N)c1ccccc1 Amb26550171 [0,1,0,0,0,0|1,0,0]=2 2583 B12R1.107 CN(C)C[C@H](N)c1ccccc1 Amb33801432 [0,1,0,0,0,0|1,0,0]=2 2584 B12R1.107 CN(C)C[C@H](N)c1ncccn1 Amb32716299 [0,1,0,0,0,0|3,0,0]=4 2585 B12R1.107 CN(C)C[C@H](O)c1ccccc1 Amb24707113 [0,1,0,0,0,0|1,0,0]=2 2586 B12R1.107 CN(C)NC(=O)c1ccccc1 Amb10574824 [0,1,0,0,0,0|2,0,1]=4 2587 B12R1.107 CN(C)\C=C(/O)c1ccccc1 Amb24068870 [0,1,0,0,0,0|1,0,2]=4 2588 B12R1.107 CN(CC(=O)Cl)c1ccccc1 Amb17142999 [0,1,0,0,0,0|3,0,0]=4 2589 B12R1.107 CN(CC(=O)O)c1ccccc1 Amb10610413 [0,1,0,0,0,0|3,0,0]=4 2590 B12R1.107 CN(CC(=O)O)c1ccccc1 Amb4598567 [0,1,0,0,0,0|3,0,0]=4 2591 B12R1.107 CN(CC(F)Cl)c1ccccc1 Amb28118828 [0,1,0,0,0,0|3,0,0]=4 2592 B12R1.107 CN(CC(N)=O)c1ccccc1 Amb8342086 [0,1,0,0,0,0|3,0,0]=4 2593 B12R1.107 CN(CC(N)=S)c1ccccc1 Amb6269019 [0,1,0,0,0,0|3,0,0]=4 2594 B12R1.107 CS(=O)CC(N)c1ccccc1 Amb18648795 [0,1,0,0,0,0|2,0,0]=3 2595 B12R1.107 CS(=O)CC(O)c1ccccn1 Amb28138649 [0,1,0,0,0,0|3,0,0]=4 2596 B12R1.107 CS(=O)C[C@@H](N)c1ccccc1 Amb28195318 [0,1,0,0,0,0|2,0,0]=3 2597 B12R1.107 C[C@@H](CC(=O)Cl)c1ccccc1 Amb28139675 [0,1,0,0,0,0|2,0,0]=3 2598 B12R1.107 C[C@@H](CC(=O)O)c1ccccc1 Amb10844379 [0,1,0,0,0,0|2,0,0]=3 2599 B12R1.107 C[C@@H](Cl)C[C@@H](Cl)c1ccccc1 Amb28202622 [0,1,0,0,0,0|2,0,0]=3 2600 B12R1.107 C[C@@H](N)C[C@@H](O)c1ccccc1 Amb27592173 [0,1,0,0,0,0|2,0,0]=3 2601 B12R1.107 C[C@@H](NC(=S)S)c1ccccc1 Amb27642488 [0,1,0,0,0,0|3,0,0]=4 2602 B12R1.107 C[C@@H](NC(N)=O)c1ccccc1 Amb22232053 [0,1,0,0,0,0|3,0,0]=4 2603 B12R1.107 C[C@@H](O)C[C@@H](C)c1ccccc1 Amb27457680 [0,1,0,0,0,0|1,0,0]=2 2604 B12R1.107 C[C@@H](O)C[C@@H](S)c1ccccc1 Amb27218944 [0,1,0,0,0,0|2,0,0]=3 2605 B12R1.107 C[C@@H](OC(=O)Cl)c1ccccc1 Amb33297316 [0,1,0,0,0,0|3,0,0]=4 2606 B12R1.107 C[C@H](CC(=O)O)c1ccccc1 Amb10844340 [0,1,0,0,0,0|2,0,0]=3 2607 B12R1.107 C[C@H](N)CN(C)c1ccccc1 Amb5782045 [0,1,0,0,0,0|2,0,0]=3 2608 B12R1.107 C[C@H](N)C[C@H](O)c1ccccc1 Amb27217333 [0,1,0,0,0,0|2,0,0]=3 2609 B12R1.107 C[C@H](NC(=S)S)c1ccccc1 Amb27412492 [0,1,0,0,0,0|3,0,0]=4 2610 B12R1.107 C[C@H](NC(N)=O)c1ccccc1 Amb22232024 [0,1,0,0,0,0|3,0,0]=4 2611 B12R1.107 C[C@H](NC(N)=S)c1ccccc1 Amb27614623 [0,1,0,0,0,0|3,0,0]=4 2612 B12R1.107 C[C@H](O)CC(=O)c1ccccc1 Amb27178049 [0,1,0,0,0,0|2,0,1]=4 2613 B12R1.107 C[C@H](O)CN(C)c1ccccc1 Amb27615291 [0,1,0,0,0,0|2,0,0]=3 2614 B12R1.107 C[C@H](O)CN(C)c1ccncc1 Amb27458447 [0,1,0,0,0,0|3,0,0]=4 2615 B12R1.107 C[C@H](O)C[C@H](N)c1ccccc1 Amb27646110 [0,1,0,0,0,0|2,0,0]=3 2616 B12R1.107 C[C@H](OC(=O)Cl)c1ccccc1 Amb33297317 [0,1,0,0,0,0|3,0,0]=4 2617 B12R1.107 C[S+](C)CC(=O)c1ccccc1 Amb10838263 [0,1,0,0,0,0|2,0,1]=4 2618 B12R1.107 C[S+](C)CC(=O)c1ccccc1 Amb4036338 [0,1,0,0,0,0|2,0,1]=4 2619 B12R1.107 C\C(=C\C(C)C)c1ccccc1 Amb4018527 [0,1,0,0,0,0|1,0,2]=4 2620 B12R1.107 C\C(=C\[C@H](C)O)c1ccccc1 Amb27650888 [0,1,0,0,0,0|1,0,2]=4 2621 B12R1.107 C\C(=N/C(C)C)c1ccccc1 Amb24053029 [0,1,0,0,0,0|2,0,1]=4 2622 B12R1.107 C\C(=N\N(C)C)c1ccccc1 Amb22347640 [0,1,0,0,0,0|1,0,1]=3 2623 B12R1.107 C\C(=N\N(C)C)c1ccccn1 Amb28294006 [0,1,0,0,0,0|2,0,1]=4 2624 B12R1.107 C\C(=N\S(C)=O)c1ccccc1 Amb35681678 [0,1,0,0,0,0|2,0,1]=4 2625 B12R1.107 C\C(N)=N\N(C)c1ccccc1 Amb26589111 [0,1,0,0,0,0|3,0,0]=4 2626 B12R1.107 NC(=O)CC(N)c1ccccc1 Amb10609847 [0,1,0,0,0,0|3,0,0]=4 2627 B12R1.107 NC(=O)CC(N)c1ccccc1 Amb10609952 [0,1,0,0,0,0|3,0,0]=4 2628 B12R1.107 NC(=O)CC(N)c1ccccc1 Amb6264599 [0,1,0,0,0,0|3,0,0]=4 2629 B12R1.107 NC(=O)C[C@@H](N)c1ccccc1 Amb18792562 [0,1,0,0,0,0|3,0,0]=4 2630 B12R1.107 NC(=O)C[C@@H](N)c1ccccc1 Amb32661465 [0,1,0,0,0,0|3,0,0]=4 2631 B12R1.107 NC(=O)C[C@H](N)c1ccccc1 Amb28129120 [0,1,0,0,0,0|3,0,0]=4 2632 B12R1.107 NC(=O)C[C@H](N)c1ccccc1 Amb32661309 [0,1,0,0,0,0|3,0,0]=4 2633 B12R1.107 NC(=S)CC(O)c1ccccc1 Amb18805332 [0,1,0,0,0,0|3,0,0]=4 2634 B12R1.107 NC(=S)C[C@@H](O)c1ccccc1 Amb27494152 [0,1,0,0,0,0|3,0,0]=4 2635 B12R1.107 NC(CC(=O)O)c1ccccc1 Amb8566722 [0,1,0,0,0,0|3,0,0]=4 2636 B12R1.107 NC(CC(=O)O)c1ccccc1 Amb9730098 [0,1,0,0,0,0|3,0,0]=4 2637 B12R1.107 NC(CC(F)F)c1ccccc1 Amb18802187 [0,1,0,0,0,0|3,0,0]=4 2638 B12R1.107 NC(CC(F)F)c1ccccc1 Amb28872389 [0,1,0,0,0,0|3,0,0]=4 2639 B12R1.107 NC(C[N+](=O)[O-])c1ccccc1 Amb27443064 [0,1,0,0,0,0|2,0,1]=4 2640 B12R1.107 N[C@@H](CC(=O)O)c1ccccc1 Amb8384247 [0,1,0,0,0,0|3,0,0]=4 2641 B12R1.107 N[C@@H](CC(=O)O)c1ccccc1 Amb8396895 [0,1,0,0,0,0|3,0,0]=4 2642 B12R1.107 N[C@H](CC(=O)O)c1ccccc1 Amb4296884 [0,1,0,0,0,0|3,0,0]=4 2643 B12R1.107 N[C@H](CC(=O)O)c1ccccc1 Amb6365358 [0,1,0,0,0,0|3,0,0]=4 2644 B12R1.107 N[C@H](C[N+](=O)[O-])c1ccccc1 Amb27491689 [0,1,0,0,0,0|2,0,1]=4 2645 B12R1.107 O=C(O)CC(Br)c1ccccc1 Amb2721208 [0,1,0,0,0,0|3,0,0]=4 2646 B12R1.107 O=C(O)CC(Cl)c1ccccc1 Amb18120400 [0,1,0,0,0,0|3,0,0]=4 2647 B12R1.107 O=C(O)CC(O)c1ccccc1 Amb2697927 [0,1,0,0,0,0|3,0,0]=4 2648 B12R1.107 O=C(O)C[C@@H](O)c1ccccc1 Amb8516664 [0,1,0,0,0,0|3,0,0]=4 2649 B12R1.107 O=C(O)C[C@H](O)c1ccccc1 Amb6357183 [0,1,0,0,0,0|3,0,0]=4 2650 B12R1.107 O=C(S)CC(O)c1ccccc1 Amb27197171 [0,1,0,0,0,0|3,0,0]=4 2651 B12R1.107 O=[N+]([O-])CC(O)c1ccccc1 Amb1048142 [0,1,0,0,0,0|2,0,1]=4 2652 B12R1.107 OC(CC(F)F)c1ccccc1 Amb24433354 [0,1,0,0,0,0|3,0,0]=4 2653 B12R1.308 C#CCC(N)c1ccccc1I Amb28044520 [0,1,0,0,0,0|2,0,1]=4 2654 B12R1.308 C#CCC(O)c1ccccc1O Amb28321844 [0,1,0,0,0,0|2,0,1]=4 2655 B12R1.308 C#CC[C@@H](O)c1ccccc1C Amb28400792 [0,1,0,0,0,0|2,0,1]=4 2656 B12R1.308 C#CC[C@H](O)c1ccccc1F Amb28065958 [0,1,0,0,0,0|2,0,1]=4 2657 B12R1.308 C=CCC(C)c1ccccc1O Amb27256380 [0,1,0,0,0,0|1,0,1]=3 2658 B12R1.308 C=CCC(N)c1ccccc1Cl Amb18986268 [0,1,0,0,0,0|2,0,1]=4 2659 B12R1.308 C=CCC(N)c1ccccc1F Amb19002611 [0,1,0,0,0,0|2,0,1]=4 2660 B12R1.308 C=CCC(O)c1ccccc1Br Amb24671319 [0,1,0,0,0,0|2,0,1]=4 2661 B12R1.308 C=CCC(O)c1ccccc1C Amb18177787 [0,1,0,0,0,0|2,0,1]=4 2662 B12R1.308 C=CCC(O)c1ccccc1Cl Amb19074253 [0,1,0,0,0,0|2,0,1]=4 2663 B12R1.308 C=CCC(O)c1ccccc1F Amb18177819 [0,1,0,0,0,0|2,0,1]=4 2664 B12R1.308 C=CC[C@@H](N)c1ccccc1O Amb27947600 [0,1,0,0,0,0|2,0,1]=4 2665 B12R1.308 C=CC[C@@H](O)c1ccccc1Br Amb28129784 [0,1,0,0,0,0|2,0,1]=4 2666 B12R1.308 C=CC[C@@H](O)c1ccccc1C Amb28188194 [0,1,0,0,0,0|2,0,1]=4 2667 B12R1.308 C=CC[C@@H](O)c1ccccc1F Amb27812041 [0,1,0,0,0,0|2,0,1]=4 2668 B12R1.308 C=CC[C@@H](O)c1ccccc1S Amb28066020 [0,1,0,0,0,0|2,0,1]=4 2669 B12R1.308 C=CC[C@H](N)c1ccccc1Br Amb27642507 [0,1,0,0,0,0|2,0,1]=4 2670 B12R1.308 C=CC[C@H](N)c1ccccc1C Amb27850932 [0,1,0,0,0,0|2,0,1]=4 2671 B12R1.308 C=CC[C@H](N)c1ccccc1Cl Amb28364530 [0,1,0,0,0,0|2,0,1]=4 2672 B12R1.308 C=CC[C@H](N)c1ccccc1F Amb27951102 [0,1,0,0,0,0|2,0,1]=4 2673 B12R1.308 C=CC[C@H](O)c1ccccc1C Amb27981945 [0,1,0,0,0,0|2,0,1]=4 2674 B12R1.308 C=CC[C@H](O)c1ccccc1F Amb27219078 [0,1,0,0,0,0|2,0,1]=4 2675 B12R1.308 CC#CC(O)c1ccccc1C Amb28453534 [0,1,0,0,0,0|2,0,1]=4 2676 B12R1.308 CC(CC#N)c1ccccc1Br Amb26631665 [0,1,0,0,0,0|2,0,0]=3 2677 B12R1.308 CC(CC#N)c1ccccc1Cl Amb25083306 [0,1,0,0,0,0|2,0,0]=3 2678 B12R1.308 CC(CC#N)c1ccccc1F Amb26883743 [0,1,0,0,0,0|2,0,0]=3 2679 B12R1.308 CC(CCN)c1ccccc1Br Amb33387586 [0,1,0,0,0,0|2,0,0]=3 2680 B12R1.308 CC(CCN)c1ccccc1Cl Amb17234048 [0,1,0,0,0,0|2,0,0]=3 2681 B12R1.308 CC(CCN)c1ccccc1F Amb17232646 [0,1,0,0,0,0|2,0,0]=3 2682 B12R1.308 CC(CCN)c1ccccc1O Amb24643805 [0,1,0,0,0,0|2,0,0]=3 2683 B12R1.308 CC(CCN)c1cccnc1Br Amb33110731 [0,1,0,0,0,0|3,0,0]=4 2684 B12R1.308 CC(CCN)c1cccnc1Cl Amb33256923 [0,1,0,0,0,0|3,0,0]=4 2685 B12R1.308 CC(CCN)c1cccnc1F Amb33378332 [0,1,0,0,0,0|3,0,0]=4 2686 B12R1.308 CC(CCN)c1ccncc1Br Amb33388508 [0,1,0,0,0,0|3,0,0]=4 2687 B12R1.308 CC(CCN)c1ccncc1Cl Amb33413513 [0,1,0,0,0,0|3,0,0]=4 2688 B12R1.308 CC(CCN)c1ccncc1F Amb25378379 [0,1,0,0,0,0|3,0,0]=4 2689 B12R1.308 CC(CCN)c1ncccc1Br Amb33335729 [0,1,0,0,0,0|3,0,0]=4 2690 B12R1.308 CC(CCN)c1ncccc1F Amb33419505 [0,1,0,0,0,0|3,0,0]=4 2691 B12R1.308 CC(CCO)c1ccccc1Cl Amb17234164 [0,1,0,0,0,0|2,0,0]=3 2692 B12R1.308 CC(CCO)c1ccccc1F Amb17232671 [0,1,0,0,0,0|2,0,0]=3 2693 B12R1.308 CC(CCO)c1ccccc1N Amb28196373 [0,1,0,0,0,0|2,0,0]=3 2694 B12R1.308 CC(CON)c1ccccc1Br Amb33387624 [0,1,0,0,0,0|2,0,0]=3 2695 B12R1.308 CC(CON)c1ccccc1Cl Amb33052584 [0,1,0,0,0,0|2,0,0]=3 2696 B12R1.308 CC(CON)c1ccccc1F Amb33361487 [0,1,0,0,0,0|2,0,0]=3 2697 B12R1.308 CC(CON)c1ccccc1O Amb33196415 [0,1,0,0,0,0|2,0,0]=3 2698 B12R1.308 CC(CON)c1cccnc1Br Amb33387775 [0,1,0,0,0,0|3,0,0]=4 2699 B12R1.308 CC(CON)c1cccnc1Cl Amb33257337 [0,1,0,0,0,0|3,0,0]=4 2700 B12R1.308 CC(CON)c1cccnc1F Amb33377677 [0,1,0,0,0,0|3,0,0]=4 2701 B12R1.308 CC(CON)c1ccncc1Br Amb33388680 [0,1,0,0,0,0|3,0,0]=4 2702 B12R1.308 CC(CON)c1ccncc1Cl Amb33413770 [0,1,0,0,0,0|3,0,0]=4 2703 B12R1.308 CC(CON)c1ccncc1F Amb33317192 [0,1,0,0,0,0|3,0,0]=4 2704 B12R1.308 CC(CON)c1ncccc1Br Amb33336074 [0,1,0,0,0,0|3,0,0]=4 2705 B12R1.308 CC(CON)c1ncccc1F Amb33418802 [0,1,0,0,0,0|3,0,0]=4 2706 B12R1.308 CC(N=C=O)c1ccccc1Br Amb28044126 [0,1,0,0,0,0|3,0,0]=4 2707 B12R1.308 CC(N=C=O)c1ccccc1Cl Amb26979671 [0,1,0,0,0,0|3,0,0]=4 2708 B12R1.308 CC(N=C=O)c1ccccc1F Amb24483318 [0,1,0,0,0,0|3,0,0]=4 2709 B12R1.308 CC(N=C=S)c1ccccc1Cl Amb19054917 [0,1,0,0,0,0|3,0,0]=4 2710 B12R1.308 CC(N=[N+]=[N-])c1ccccc1Br Amb26561544 [0,1,0,0,0,0|2,0,1]=4 2711 B12R1.308 CC(N=[N+]=[N-])c1ccccc1Cl Amb25779276 [0,1,0,0,0,0|2,0,1]=4 2712 B12R1.308 CC(N=[N+]=[N-])c1ccccc1F Amb27396978 [0,1,0,0,0,0|2,0,1]=4 2713 B12R1.308 CC(NC#N)c1ccccc1F Amb18800782 [0,1,0,0,0,0|3,0,0]=4 2714 B12R1.308 CC(NC=O)c1ccccc1Br Amb27770008 [0,1,0,0,0,0|3,0,0]=4 2715 B12R1.308 CCCC(=O)c1ccccc1Br Amb17343723 [0,1,0,0,0,0|2,0,1]=4 2716 B12R1.308 CCCC(=O)c1ccccc1C Amb17198733 [0,1,0,0,0,0|2,0,1]=4 2717 B12R1.308 CCCC(=O)c1ccccc1Cl Amb17198743 [0,1,0,0,0,0|2,0,1]=4 2718 B12R1.308 CCCC(=O)c1ccccc1F Amb17198734 [0,1,0,0,0,0|2,0,1]=4 2719 B12R1.308 CCCC(=O)c1ccccc1N Amb18645869 [0,1,0,0,0,0|2,0,1]=4 2720 B12R1.308 CCCC(=O)c1ccccc1O Amb8629040 [0,1,0,0,0,0|2,0,1]=4 2721 B12R1.308 CCCC(C)c1ccccc1C Amb27244850 [0,1,0,0,0,0|1,0,0]=2 2722 B12R1.308 CCCC(C)c1ccccc1O Amb3939443 [0,1,0,0,0,0|1,0,0]=2 2723 B12R1.308 CCCC(Cl)c1ccccc1Cl Amb27808095 [0,1,0,0,0,0|2,0,0]=3 2724 B12R1.308 CCCC(N)c1ccccc1Br Amb27815075 [0,1,0,0,0,0|2,0,0]=3 2725 B12R1.308 CCCC(N)c1ccccc1C Amb17232446 [0,1,0,0,0,0|2,0,0]=3 2726 B12R1.308 CCCC(N)c1ccccc1C Amb32662363 [0,1,0,0,0,0|2,0,0]=3 2727 B12R1.308 CCCC(N)c1ccccc1Cl Amb17234047 [0,1,0,0,0,0|2,0,0]=3 2728 B12R1.308 CCCC(N)c1ccccc1F Amb17232645 [0,1,0,0,0,0|2,0,0]=3 2729 B12R1.308 CCCC(N)c1ccccc1F Amb30982461 [0,1,0,0,0,0|2,0,0]=3 2730 B12R1.308 CCCC(N)c1cccnc1Br Amb27465808 [0,1,0,0,0,0|3,0,0]=4 2731 B12R1.308 CCCC(N)c1cccnc1Cl Amb27655462 [0,1,0,0,0,0|3,0,0]=4 2732 B12R1.308 CCCC(N)c1cccnc1N Amb28124004 [0,1,0,0,0,0|3,0,0]=4 2733 B12R1.308 CCCC(N)c1cccnc1O Amb27587404 [0,1,0,0,0,0|3,0,0]=4 2734 B12R1.308 CCCC(N)c1ccncc1Br Amb27814583 [0,1,0,0,0,0|3,0,0]=4 2735 B12R1.308 CCCC(N)c1ccncc1F Amb27168255 [0,1,0,0,0,0|3,0,0]=4 2736 B12R1.308 CCCC(N)c1cnccc1C Amb18828707 [0,1,0,0,0,0|3,0,0]=4 2737 B12R1.308 CCCC(O)c1ccccc1C Amb17232483 [0,1,0,0,0,0|2,0,0]=3 2738 B12R1.308 CCCC(O)c1ccccc1Cl Amb17234154 [0,1,0,0,0,0|2,0,0]=3 2739 B12R1.308 CCCC(O)c1ccccc1F Amb17232666 [0,1,0,0,0,0|2,0,0]=3 2740 B12R1.308 CCCC(O)c1cccnc1Br Amb35702777 [0,1,0,0,0,0|3,0,0]=4 2741 B12R1.308 CCCC(O)c1cccnc1C Amb27399818 [0,1,0,0,0,0|3,0,0]=4 2742 B12R1.308 CCCC(O)c1ccncc1Cl Amb27979725 [0,1,0,0,0,0|3,0,0]=4 2743 B12R1.308 CCCC(O)c1cnccc1N Amb27803449 [0,1,0,0,0,0|3,0,0]=4 2744 B12R1.308 CCCC(O)c1ncccc1C Amb18182634 [0,1,0,0,0,0|3,0,0]=4 2745 B12R1.308 CCCC(O)c1ncccc1Cl Amb27162023 [0,1,0,0,0,0|3,0,0]=4 2746 B12R1.308 CCCC(O)c1ncccc1N Amb35587562 [0,1,0,0,0,0|3,0,0]=4 2747 B12R1.308 CCCN(C)c1ccccc1N Amb8898676 [0,1,0,0,0,0|2,0,0]=3 2748 B12R1.308 CCCN(C)c1ncccc1N Amb8898671 [0,1,0,0,0,0|3,0,0]=4 2749 B12R1.308 CCC[C@@H](N)c1ccccc1C Amb27391198 [0,1,0,0,0,0|2,0,0]=3 2750 B12R1.308 CCC[C@@H](N)c1ccccc1Cl Amb27196196 [0,1,0,0,0,0|2,0,0]=3 2751 B12R1.308 CCC[C@@H](N)c1cccnc1Cl Amb27831928 [0,1,0,0,0,0|3,0,0]=4 2752 B12R1.308 CCC[C@@H](N)c1cccnc1O Amb25789514 [0,1,0,0,0,0|3,0,0]=4 2753 B12R1.308 CCC[C@@H](N)c1ccncc1C Amb28072847 [0,1,0,0,0,0|3,0,0]=4 2754 B12R1.308 CCC[C@@H](N)c1ccncc1N Amb28291421 [0,1,0,0,0,0|3,0,0]=4 2755 B12R1.308 CCC[C@@H](N)c1cnccc1C Amb28397848 [0,1,0,0,0,0|3,0,0]=4 2756 B12R1.308 CCC[C@@H](N)c1ncccc1Br Amb28123203 [0,1,0,0,0,0|3,0,0]=4 2757 B12R1.308 CCC[C@@H](N)c1ncccc1Cl Amb27620350 [0,1,0,0,0,0|3,0,0]=4 2758 B12R1.308 CCC[C@@H](N)c1ncccc1N Amb27470724 [0,1,0,0,0,0|3,0,0]=4 2759 B12R1.308 CCC[C@@H](O)c1ccccc1F Amb28064219 [0,1,0,0,0,0|2,0,0]=3 2760 B12R1.308 CCC[C@@H](O)c1ccncc1C Amb27220301 [0,1,0,0,0,0|3,0,0]=4 2761 B12R1.308 CCC[C@H](N)c1ccccc1C Amb26841003 [0,1,0,0,0,0|2,0,0]=3 2762 B12R1.308 CCC[C@H](N)c1ccccc1F Amb27830664 [0,1,0,0,0,0|2,0,0]=3 2763 B12R1.308 CCC[C@H](N)c1ccccc1I Amb28401584 [0,1,0,0,0,0|2,0,0]=3 2764 B12R1.308 CCC[C@H](N)c1ccccc1O Amb28072846 [0,1,0,0,0,0|2,0,0]=3 2765 B12R1.308 CCC[C@H](N)c1ccccc1S Amb27816971 [0,1,0,0,0,0|2,0,0]=3 2766 B12R1.308 CCC[C@H](N)c1cccnc1F Amb27469618 [0,1,0,0,0,0|3,0,0]=4 2767 B12R1.308 CCC[C@H](N)c1cccnc1O Amb28457234 [0,1,0,0,0,0|3,0,0]=4 2768 B12R1.308 CCC[C@H](N)c1ccncc1Br Amb27851411 [0,1,0,0,0,0|3,0,0]=4 2769 B12R1.308 CCC[C@H](N)c1cnccc1Br Amb27461989 [0,1,0,0,0,0|3,0,0]=4 2770 B12R1.308 CCC[C@H](N)c1ncccc1N Amb27227956 [0,1,0,0,0,0|3,0,0]=4 2771 B12R1.308 CCC[C@H](O)c1ccccc1Br Amb27661408 [0,1,0,0,0,0|2,0,0]=3 2772 B12R1.308 CCC[C@H](O)c1ccccc1Cl Amb28381799 [0,1,0,0,0,0|2,0,0]=3 2773 B12R1.308 CCC[C@H](O)c1ccncc1C Amb28185410 [0,1,0,0,0,0|3,0,0]=4 2774 B12R1.308 CCC[C@H](O)c1cnccc1C Amb27758501 [0,1,0,0,0,0|3,0,0]=4 2775 B12R1.308 CCC[C@H](O)c1ncccc1Br Amb27228260 [0,1,0,0,0,0|3,0,0]=4 2776 B12R1.308 CCC[C@H](O)c1ncccc1C Amb27651963 [0,1,0,0,0,0|3,0,0]=4 2777 B12R1.308 CCC[C@H](O)c1ncccc1Cl Amb27871918 [0,1,0,0,0,0|3,0,0]=4 2778 B12R1.308 CCNC(C)c1ccccc1I Amb28288975 [0,1,0,0,0,0|2,0,0]=3 2779 B12R1.308 CCNC(C)c1cccnc1N Amb27864775 [0,1,0,0,0,0|3,0,0]=4 2780 B12R1.308 CCNC(C)c1ccncc1Cl Amb27817635 [0,1,0,0,0,0|3,0,0]=4 2781 B12R1.308 CCNC(C)c1cnccc1C Amb28398057 [0,1,0,0,0,0|3,0,0]=4 2782 B12R1.308 CCN[C@H](C)c1ccccc1Br Amb27615416 [0,1,0,0,0,0|2,0,0]=3 2783 B12R1.308 CCN[C@H](C)c1ccccc1C Amb28350570 [0,1,0,0,0,0|2,0,0]=3 2784 B12R1.308 CCN[C@H](C)c1ccccc1Cl Amb27637568 [0,1,0,0,0,0|2,0,0]=3 2785 B12R1.308 CCSC(C)C1=CC=CNC1=O Amb27749735 [0,1,0,0,0,0|3,0,0]=4 2786 B12R1.308 CCSC(C)c1ccccc1Cl Amb28127831 [0,1,0,0,0,0|2,0,0]=3 2787 B12R1.308 CCSC(C)c1ccccc1F Amb28185640 [0,1,0,0,0,0|2,0,0]=3 2788 B12R1.308 CCSC(C)c1cccnc1N Amb27762420 [0,1,0,0,0,0|3,0,0]=4 2789 B12R1.308 CN(CC#N)c1ccccc1Br Amb17343206 [0,1,0,0,0,0|3,0,0]=4 2790 B12R1.308 CN(CC#N)c1ccccc1Cl Amb17335463 [0,1,0,0,0,0|3,0,0]=4 2791 B12R1.308 CN(CC#N)c1ccccc1F Amb17334602 [0,1,0,0,0,0|3,0,0]=4 2792 B12R1.308 CN(CC#N)c1ccccc1O Amb28070395 [0,1,0,0,0,0|3,0,0]=4 2793 B12R1.308 CN(CCCl)c1ccccc1Br Amb17351919 [0,1,0,0,0,0|3,0,0]=4 2794 B12R1.308 CN(CCCl)c1ccccc1Cl Amb17338055 [0,1,0,0,0,0|3,0,0]=4 2795 B12R1.308 CN(CCCl)c1ccccc1F Amb17335951 [0,1,0,0,0,0|3,0,0]=4 2796 B12R1.308 CN(CCCl)c1ccccc1N Amb27863533 [0,1,0,0,0,0|3,0,0]=4 2797 B12R1.308 CN(CCF)c1ccccc1O Amb27853039 [0,1,0,0,0,0|3,0,0]=4 2798 B12R1.308 CN(CCI)c1ccccc1O Amb28078731 [0,1,0,0,0,0|3,0,0]=4 2799 B12R1.308 CN(CCN)c1ccccc1Br Amb17059772 [0,1,0,0,0,0|3,0,0]=4 2800 B12R1.308 CN(CCN)c1ccccc1Cl Amb17059645 [0,1,0,0,0,0|3,0,0]=4 2801 B12R1.308 CN(CCN)c1ccccc1F Amb17059642 [0,1,0,0,0,0|3,0,0]=4 2802 B12R1.308 CN(CCO)c1ccccc1Br Amb17344451 [0,1,0,0,0,0|3,0,0]=4 2803 B12R1.308 CN(CCO)c1ccccc1Cl Amb17335810 [0,1,0,0,0,0|3,0,0]=4 2804 B12R1.308 CN(CCO)c1ccccc1F Amb17334763 [0,1,0,0,0,0|3,0,0]=4 2805 B12R1.308 CN(CCO)c1ccccc1N Amb8997333 [0,1,0,0,0,0|3,0,0]=4 2806 B12R1.308 CN(CCO)c1ccccc1O Amb27256043 [0,1,0,0,0,0|3,0,0]=4 2807 B12R1.308 CNCC(=O)c1ccccc1Br Amb18160384 [0,1,0,0,0,0|1,0,1]=3 2808 B12R1.308 CNCC(=O)c1ccccc1C Amb18862585 [0,1,0,0,0,0|1,0,1]=3 2809 B12R1.308 CNCC(=O)c1ccccc1Cl Amb18863065 [0,1,0,0,0,0|1,0,1]=3 2810 B12R1.308 CNCC(=O)c1ccccc1Cl Amb32679864 [0,1,0,0,0,0|1,0,1]=3 2811 B12R1.308 CNCC(=O)c1ccccc1F Amb18862705 [0,1,0,0,0,0|1,0,1]=3 2812 B12R1.308 CNCC(=O)c1ccccc1O Amb26392452 [0,1,0,0,0,0|1,0,1]=3 2813 B12R1.308 CNCC(=O)c1cccnc1Br Amb33387442 [0,1,0,0,0,0|2,0,1]=4 2814 B12R1.308 CNCC(=O)c1cccnc1C Amb32880138 [0,1,0,0,0,0|2,0,1]=4 2815 B12R1.308 CNCC(=O)c1cccnc1Cl Amb33256936 [0,1,0,0,0,0|2,0,1]=4 2816 B12R1.308 CNCC(=O)c1cccnc1F Amb33378328 [0,1,0,0,0,0|2,0,1]=4 2817 B12R1.308 CNCC(=O)c1ccncc1Br Amb33388473 [0,1,0,0,0,0|2,0,1]=4 2818 B12R1.308 CNCC(=O)c1ccncc1C Amb33414506 [0,1,0,0,0,0|2,0,1]=4 2819 B12R1.308 CNCC(=O)c1ccncc1Cl Amb33413520 [0,1,0,0,0,0|2,0,1]=4 2820 B12R1.308 CNCC(=O)c1ccncc1F Amb25076936 [0,1,0,0,0,0|2,0,1]=4 2821 B12R1.308 CNCC(=O)c1cnccc1C Amb26503018 [0,1,0,0,0,0|2,0,1]=4 2822 B12R1.308 CNCC(=O)c1cnccc1N Amb27196154 [0,1,0,0,0,0|2,0,1]=4 2823 B12R1.308 CNCC(=O)c1ncccc1Br Amb33335735 [0,1,0,0,0,0|2,0,1]=4 2824 B12R1.308 CNCC(=O)c1ncccc1C Amb33429064 [0,1,0,0,0,0|2,0,1]=4 2825 B12R1.308 CNCC(=O)c1ncccc1F Amb28435430 [0,1,0,0,0,0|2,0,1]=4 2826 B12R1.308 CNCC(C)c1ccccc1Cl Amb28207901 [0,1,0,0,0,0|0,0,0]=1 2827 B12R1.308 CNCC(O)c1ccccc1Br Amb18301236 [0,1,0,0,0,0|1,0,0]=2 2828 B12R1.308 CNCC(O)c1ccccc1C Amb5750895 [0,1,0,0,0,0|1,0,0]=2 2829 B12R1.308 CNCC(O)c1ccccc1Cl Amb5750901 [0,1,0,0,0,0|1,0,0]=2 2830 B12R1.308 CNCC(O)c1ccccc1F Amb5750898 [0,1,0,0,0,0|1,0,0]=2 2831 B12R1.308 CNCC(O)c1ccccc1O Amb24739803 [0,1,0,0,0,0|1,0,0]=2 2832 B12R1.308 CNCC(O)c1cccnc1Br Amb33387439 [0,1,0,0,0,0|2,0,0]=3 2833 B12R1.308 CNCC(O)c1cccnc1C Amb32880621 [0,1,0,0,0,0|2,0,0]=3 2834 B12R1.308 CNCC(O)c1cccnc1Cl Amb33256933 [0,1,0,0,0,0|2,0,0]=3 2835 B12R1.308 CNCC(O)c1cccnc1F Amb33378329 [0,1,0,0,0,0|2,0,0]=3 2836 B12R1.308 CNCC(O)c1ccncc1Br Amb33241237 [0,1,0,0,0,0|2,0,0]=3 2837 B12R1.308 CNCC(O)c1ccncc1C Amb33414520 [0,1,0,0,0,0|2,0,0]=3 2838 B12R1.308 CNCC(O)c1ccncc1Cl Amb33413516 [0,1,0,0,0,0|2,0,0]=3 2839 B12R1.308 CNCC(O)c1ccncc1F Amb25259123 [0,1,0,0,0,0|2,0,0]=3 2840 B12R1.308 CNCC(O)c1cnccc1C Amb26616381 [0,1,0,0,0,0|2,0,0]=3 2841 B12R1.308 CNCC(O)c1cncnc1C Amb33472505 [0,1,0,0,0,0|3,0,0]=4 2842 B12R1.308 CNCC(O)c1ncccc1Br Amb23586111 [0,1,0,0,0,0|2,0,0]=3 2843 B12R1.308 CNCC(O)c1ncccc1C Amb24711552 [0,1,0,0,0,0|2,0,0]=3 2844 B12R1.308 CNCC(O)c1ncccc1F Amb27958803 [0,1,0,0,0,0|2,0,0]=3 2845 B12R1.308 CNCC(O)c1nccnc1C Amb33142590 [0,1,0,0,0,0|3,0,0]=4 2846 B12R1.308 CNNC(=O)c1ccccc1N Amb18646316 [0,1,0,0,0,0|2,0,1]=4 2847 B12R1.308 CNNC(=O)c1ccccc1O Amb25910765 [0,1,0,0,0,0|2,0,1]=4 2848 B12R1.308 CNOC(=O)c1ccccc1O Amb28381144 [0,1,0,0,0,0|2,0,1]=4 2849 B12R1.308 COCC(C)c1cnccc1N Amb27231363 [0,1,0,0,0,0|2,0,0]=3 2850 B12R1.308 COCC(C)c1nccnc1N Amb27840574 [0,1,0,0,0,0|3,0,0]=4 2851 B12R1.308 COCC(F)c1ccccc1N Amb27615210 [0,1,0,0,0,0|2,0,0]=3 2852 B12R1.308 COCC(N)c1ccccc1Br Amb25974461 [0,1,0,0,0,0|2,0,0]=3 2853 B12R1.308 COCC(N)c1ccccc1Cl Amb18979037 [0,1,0,0,0,0|2,0,0]=3 2854 B12R1.308 COCC(N)c1cccnc1N Amb27470702 [0,1,0,0,0,0|3,0,0]=4 2855 B12R1.308 COCC(N)c1ccncc1C Amb27391221 [0,1,0,0,0,0|3,0,0]=4 2856 B12R1.308 COCC(N)c1ncccc1C Amb27872125 [0,1,0,0,0,0|3,0,0]=4 2857 B12R1.308 COCC(N)c1ncccc1O Amb27398623 [0,1,0,0,0,0|3,0,0]=4 2858 B12R1.308 COCC(O)c1cccnc1Br Amb35702779 [0,1,0,0,0,0|3,0,0]=4 2859 B12R1.308 COCC(O)c1ccncc1F Amb27754889 [0,1,0,0,0,0|3,0,0]=4 2860 B12R1.308 COCC(O)c1cnccc1C Amb27243298 [0,1,0,0,0,0|3,0,0]=4 2861 B12R1.308 COCC(O)c1cnccc1N Amb28197976 [0,1,0,0,0,0|3,0,0]=4 2862 B12R1.308 COCC(O)c1ncccc1Br Amb27436429 [0,1,0,0,0,0|3,0,0]=4 2863 B12R1.308 COCC(O)c1ncccc1N Amb30022916 [0,1,0,0,0,0|3,0,0]=4 2864 B12R1.308 COC[C@@H](N)c1ccccc1Br Amb27259275 [0,1,0,0,0,0|2,0,0]=3 2865 B12R1.308 COC[C@@H](N)c1ccccc1I Amb27642503 [0,1,0,0,0,0|2,0,0]=3 2866 B12R1.308 COC[C@@H](N)c1ccccc1N Amb27882660 [0,1,0,0,0,0|2,0,0]=3 2867 B12R1.308 COC[C@@H](N)c1ccccc1O Amb27399755 [0,1,0,0,0,0|2,0,0]=3 2868 B12R1.308 COC[C@@H](N)c1cccnc1Cl Amb27780864 [0,1,0,0,0,0|3,0,0]=4 2869 B12R1.308 COC[C@@H](N)c1cccnc1S Amb27817815 [0,1,0,0,0,0|3,0,0]=4 2870 B12R1.308 COC[C@@H](N)c1ccncc1Cl Amb27256689 [0,1,0,0,0,0|3,0,0]=4 2871 B12R1.308 COC[C@@H](N)c1ncccc1Br Amb27597609 [0,1,0,0,0,0|3,0,0]=4 2872 B12R1.308 COC[C@@H](N)c1ncccc1O Amb27879452 [0,1,0,0,0,0|3,0,0]=4 2873 B12R1.308 COC[C@H](N)c1ccccc1F Amb27752235 [0,1,0,0,0,0|2,0,0]=3 2874 B12R1.308 COC[C@H](N)c1ccccc1O Amb28341304 [0,1,0,0,0,0|2,0,0]=3 2875 B12R1.308 COC[C@H](N)c1cccnc1Cl Amb27596522 [0,1,0,0,0,0|3,0,0]=4 2876 B12R1.308 COC[C@H](N)c1cccnc1N Amb27593480 [0,1,0,0,0,0|3,0,0]=4 2877 B12R1.308 COC[C@H](N)c1cnccc1Cl Amb27785556 [0,1,0,0,0,0|3,0,0]=4 2878 B12R1.308 COC[C@H](N)c1ncccc1Br Amb28133343 [0,1,0,0,0,0|3,0,0]=4 2879 B12R1.308 COC[C@H](N)c1ncccc1O Amb27250849 [0,1,0,0,0,0|3,0,0]=4 2880 B12R1.308 CONC(C)c1ccccc1Br Amb28075911 [0,1,0,0,0,0|2,0,0]=3 2881 B12R1.308 CONC(C)c1ccccc1C Amb26449486 [0,1,0,0,0,0|2,0,0]=3 2882 B12R1.308 CONC(C)c1ccccc1C Amb33552564 [0,1,0,0,0,0|2,0,0]=3 2883 B12R1.308 CO\N=C(/C)c1ccccc1F Amb32660955 [0,1,0,0,0,0|2,0,1]=4 2884 B12R1.308 CO\N=C(/C)c1ccccc1O Amb27854963 [0,1,0,0,0,0|2,0,1]=4 2885 B12R1.308 CO\N=C(\C)c1ccccc1Br Amb27207597 [0,1,0,0,0,0|2,0,1]=4 2886 B12R1.308 CO\N=C(\C)c1ccccc1C Amb27448740 [0,1,0,0,0,0|2,0,1]=4 2887 B12R1.308 CSCC(=O)c1ccccc1Br Amb27389140 [0,1,0,0,0,0|2,0,1]=4 2888 B12R1.308 CSCC(=O)c1ccccc1C Amb18796321 [0,1,0,0,0,0|2,0,1]=4 2889 B12R1.308 CSCC(=O)c1ccccc1Cl Amb18320104 [0,1,0,0,0,0|2,0,1]=4 2890 B12R1.308 CSCC(=O)c1ccccc1F Amb19057447 [0,1,0,0,0,0|2,0,1]=4 2891 B12R1.308 CSCC(N)c1ccccc1Cl Amb18300371 [0,1,0,0,0,0|2,0,0]=3 2892 B12R1.308 CSCC(N)c1ccncc1F Amb27760134 [0,1,0,0,0,0|3,0,0]=4 2893 B12R1.308 CSCC(N)c1cnccc1N Amb28132671 [0,1,0,0,0,0|3,0,0]=4 2894 B12R1.308 CSCC(O)c1ccccc1C Amb19061296 [0,1,0,0,0,0|2,0,0]=3 2895 B12R1.308 CSCC(O)c1ccccc1N Amb18987947 [0,1,0,0,0,0|2,0,0]=3 2896 B12R1.308 C[C@@H](N=[N+]=[N-])c1ccccc1Br Amb27251930 [0,1,0,0,0,0|2,0,1]=4 2897 B12R1.308 C[C@@H](N=[N+]=[N-])c1ccccc1Cl Amb25946854 [0,1,0,0,0,0|2,0,1]=4 2898 B12R1.308 C[C@@H](N=[N+]=[N-])c1ccccc1F Amb27472849 [0,1,0,0,0,0|2,0,1]=4 2899 B12R1.308 C[C@@H](NC#N)c1ccccc1F Amb27975041 [0,1,0,0,0,0|3,0,0]=4 2900 B12R1.308 C[C@H](N=[N+]=[N-])c1ccccc1Br Amb26841248 [0,1,0,0,0,0|2,0,1]=4 2901 B12R1.308 C[C@H](N=[N+]=[N-])c1ccccc1Cl Amb26959249 [0,1,0,0,0,0|2,0,1]=4 2902 B12R1.308 C\C=C/C(O)c1ccccc1O Amb28324317 [0,1,0,0,0,0|2,0,1]=4 2903 B12R1.308 C\C=C\N(C)c1ccccc1O Amb28351392 [0,1,0,0,0,0|2,0,1]=4 2904 B12R1.308 Cc1ccccc1C(C)CC#N Amb27762988 [0,1,0,0,0,0|2,0,0]=3 2905 B12R1.308 Cc1ccccc1C(C)CCN Amb17232447 [0,1,0,0,0,0|2,0,0]=3 2906 B12R1.308 Cc1ccccc1C(C)CCO Amb17232499 [0,1,0,0,0,0|2,0,0]=3 2907 B12R1.308 Cc1ccccc1C(C)CON Amb33360571 [0,1,0,0,0,0|2,0,0]=3 2908 B12R1.308 Cc1ccccc1C(C)N=C=O Amb25189609 [0,1,0,0,0,0|3,0,0]=4 2909 B12R1.308 Cc1ccccc1C(C)N=C=S Amb18795944 [0,1,0,0,0,0|3,0,0]=4 2910 B12R1.308 Cc1ccccc1C(C)N=[N+]=[N-] Amb28186064 [0,1,0,0,0,0|2,0,1]=4 2911 B12R1.308 Cc1ccccc1C(F)CCN Amb25894968 [0,1,0,0,0,0|3,0,0]=4 2912 B12R1.308 Cc1ccccc1C(N)CC#N Amb18563498 [0,1,0,0,0,0|3,0,0]=4 2913 B12R1.308 Cc1ccccc1C(N)CCO Amb17103953 [0,1,0,0,0,0|3,0,0]=4 2914 B12R1.308 Cc1ccccc1C(O)CC#N Amb1111330 [0,1,0,0,0,0|3,0,0]=4 2915 B12R1.308 Cc1ccccc1C(O)CCN Amb17232539 [0,1,0,0,0,0|3,0,0]=4 2916 B12R1.308 Cc1ccccc1C(O)CCO Amb28195046 [0,1,0,0,0,0|3,0,0]=4 2917 B12R1.308 Cc1ccccc1C(O)CNN Amb17232608 [0,1,0,0,0,0|2,0,0]=3 2918 B12R1.308 Cc1ccccc1C(O)CNO Amb17334702 [0,1,0,0,0,0|2,0,0]=3 2919 B12R1.308 Cc1ccccc1N(C)CC#N Amb17334501 [0,1,0,0,0,0|3,0,0]=4 2920 B12R1.308 Cc1ccccc1N(C)CCCl Amb17335670 [0,1,0,0,0,0|3,0,0]=4 2921 B12R1.308 Cc1ccccc1N(C)CCN Amb17059640 [0,1,0,0,0,0|3,0,0]=4 2922 B12R1.308 Cc1ccccc1N(C)CCO Amb17334643 [0,1,0,0,0,0|3,0,0]=4 2923 B12R1.308 Cc1ccccc1[C@@H](C)CCO Amb27981985 [0,1,0,0,0,0|2,0,0]=3 2924 B12R1.308 Cc1ccccc1[C@@H](N)CCO Amb24393358 [0,1,0,0,0,0|3,0,0]=4 2925 B12R1.308 Cc1ccccc1[C@@H](O)CC#N Amb28188196 [0,1,0,0,0,0|3,0,0]=4 2926 B12R1.308 Cc1ccccc1[C@@H](O)CCN Amb33360572 [0,1,0,0,0,0|3,0,0]=4 2927 B12R1.308 Cc1ccccc1[C@H](C)N=C=O Amb27178191 [0,1,0,0,0,0|3,0,0]=4 2928 B12R1.308 Cc1ccccc1[C@H](N)CCO Amb27221061 [0,1,0,0,0,0|3,0,0]=4 2929 B12R1.308 Cc1ccccc1[C@H](O)CCN Amb33360573 [0,1,0,0,0,0|3,0,0]=4 2930 B12R1.308 Cc1cccnc1C(C)CCN Amb33429066 [0,1,0,0,0,0|3,0,0]=4 2931 B12R1.308 Cc1cccnc1C(C)CON Amb33428795 [0,1,0,0,0,0|3,0,0]=4 2932 B12R1.308 Cc1ccncc1C(C)CCN Amb24566086 [0,1,0,0,0,0|3,0,0]=4 2933 B12R1.308 Cc1ccncc1C(C)CON Amb33376745 [0,1,0,0,0,0|3,0,0]=4 2934 B12R1.308 Cc1cnccc1C(C)CCN Amb33226338 [0,1,0,0,0,0|3,0,0]=4 2935 B12R1.308 Cc1cnccc1C(C)CON Amb33414177 [0,1,0,0,0,0|3,0,0]=4 2936 B12R1.308 Cc1ncccc1C(C)CCN Amb32880593 [0,1,0,0,0,0|3,0,0]=4 2937 B12R1.308 Cc1ncccc1C(C)CON Amb33224585 [0,1,0,0,0,0|3,0,0]=4 2938 B12R1.308 N#CCC(N)c1ccccc1Br Amb18066761 [0,1,0,0,0,0|3,0,0]=4 2939 B12R1.308 N#CCC(N)c1ccccc1Cl Amb18564158 [0,1,0,0,0,0|3,0,0]=4 2940 B12R1.308 N#CCC(N)c1ccccc1F Amb18563603 [0,1,0,0,0,0|3,0,0]=4 2941 B12R1.308 N#CCC(N)c1ccccc1I Amb27202260 [0,1,0,0,0,0|3,0,0]=4 2942 B12R1.308 N#CCC(N)c1ccccc1N Amb27595646 [0,1,0,0,0,0|3,0,0]=4 2943 B12R1.308 N#CCC(N)c1ccccc1S Amb27389236 [0,1,0,0,0,0|3,0,0]=4 2944 B12R1.308 N#CCC(O)c1ccccc1Br Amb27444920 [0,1,0,0,0,0|3,0,0]=4 2945 B12R1.308 N#CCC(O)c1ccccc1Cl Amb4405009 [0,1,0,0,0,0|3,0,0]=4 2946 B12R1.308 N#CCC(O)c1ccccc1F Amb17232516 [0,1,0,0,0,0|3,0,0]=4 2947 B12R1.308 N#CCC(O)c1ccccc1O Amb27433523 [0,1,0,0,0,0|3,0,0]=4 2948 B12R1.308 N#CC[C@@H](O)c1ccccc1F Amb27879709 [0,1,0,0,0,0|3,0,0]=4 2949 B12R1.308 N#CC[C@H](N)c1ccccc1Br Amb27403589 [0,1,0,0,0,0|3,0,0]=4 2950 B12R1.308 N#CC[C@H](N)c1ccccc1F Amb27425307 [0,1,0,0,0,0|3,0,0]=4 2951 B12R1.308 N#CC[C@H](O)c1ccccc1Br Amb27464759 [0,1,0,0,0,0|3,0,0]=4 2952 B12R1.308 NC(CCO)c1ccccc1Br Amb18297962 [0,1,0,0,0,0|3,0,0]=4 2953 B12R1.308 NC(CCO)c1ccccc1Cl Amb1993960 [0,1,0,0,0,0|3,0,0]=4 2954 B12R1.308 NC(CCO)c1ccccc1F Amb2408130 [0,1,0,0,0,0|3,0,0]=4 2955 B12R1.308 NC(CCO)c1ccccc1F Amb32664424 [0,1,0,0,0,0|3,0,0]=4 2956 B12R1.308 NC(CCO)c1ccccc1O Amb24487329 [0,1,0,0,0,0|3,0,0]=4 2957 B12R1.308 NCCC(F)c1ccccc1Br Amb25996777 [0,1,0,0,0,0|3,0,0]=4 2958 B12R1.308 NCCC(F)c1ccccc1Cl Amb25083769 [0,1,0,0,0,0|3,0,0]=4 2959 B12R1.308 NCCC(F)c1ccccc1F Amb25894969 [0,1,0,0,0,0|3,0,0]=4 2960 B12R1.308 NCCC(F)c1ccccc1O Amb24742701 [0,1,0,0,0,0|3,0,0]=4 2961 B12R1.308 NCCC(N)c1ccccc1I Amb27788534 [0,1,0,0,0,0|3,0,0]=4 2962 B12R1.308 NCCC(O)c1ccccc1Br Amb18747006 [0,1,0,0,0,0|3,0,0]=4 2963 B12R1.308 NCCC(O)c1ccccc1Cl Amb17234259 [0,1,0,0,0,0|3,0,0]=4 2964 B12R1.308 NCCC(O)c1ccccc1F Amb17232696 [0,1,0,0,0,0|3,0,0]=4 2965 B12R1.308 NCCC(O)c1ccccc1N Amb28249964 [0,1,0,0,0,0|3,0,0]=4 2966 B12R1.308 NCCC(O)c1ccccc1O Amb24718394 [0,1,0,0,0,0|3,0,0]=4 2967 B12R1.308 NCC[C@@H](N)c1ccccc1Cl Amb27205254 [0,1,0,0,0,0|3,0,0]=4 2968 B12R1.308 NCC[C@@H](N)c1ccccc1I Amb27204878 [0,1,0,0,0,0|3,0,0]=4 2969 B12R1.308 NCC[C@@H](O)c1ccccc1Br Amb33387618 [0,1,0,0,0,0|3,0,0]=4 2970 B12R1.308 NCC[C@@H](O)c1ccccc1Cl Amb33052581 [0,1,0,0,0,0|3,0,0]=4 2971 B12R1.308 NCC[C@@H](O)c1ccccc1F Amb33361507 [0,1,0,0,0,0|3,0,0]=4 2972 B12R1.308 NCC[C@@H](O)c1ccccc1O Amb33196477 [0,1,0,0,0,0|3,0,0]=4 2973 B12R1.308 NCC[C@H](O)c1ccccc1Br Amb33387621 [0,1,0,0,0,0|3,0,0]=4 2974 B12R1.308 NCC[C@H](O)c1ccccc1Cl Amb33052779 [0,1,0,0,0,0|3,0,0]=4 2975 B12R1.308 NCC[C@H](O)c1ccccc1F Amb33361910 [0,1,0,0,0,0|3,0,0]=4 2976 B12R1.308 NCC[C@H](O)c1ccccc1O Amb33196476 [0,1,0,0,0,0|3,0,0]=4 2977 B12R1.308 NNCC(O)c1ccccc1Br Amb18070085 [0,1,0,0,0,0|2,0,0]=3 2978 B12R1.308 NNCC(O)c1ccccc1Cl Amb17234360 [0,1,0,0,0,0|2,0,0]=3 2979 B12R1.308 NNCC(O)c1ccccc1F Amb17232742 [0,1,0,0,0,0|2,0,0]=3 2980 B12R1.308 N[C@@H](CCO)c1ccccc1Br Amb25140602 [0,1,0,0,0,0|3,0,0]=4 2981 B12R1.308 N[C@@H](CCO)c1ccccc1Cl Amb19888408 [0,1,0,0,0,0|3,0,0]=4 2982 B12R1.308 N[C@@H](CCO)c1ccccc1F Amb27468716 [0,1,0,0,0,0|3,0,0]=4 2983 B12R1.308 N[C@@H](CCO)c1ccccc1I Amb27851414 [0,1,0,0,0,0|3,0,0]=4 2984 B12R1.308 N[C@@H](CCO)c1ccccc1O Amb28345683 [0,1,0,0,0,0|3,0,0]=4 2985 B12R1.308 N[C@H](CCO)c1ccccc1Br Amb25301240 [0,1,0,0,0,0|3,0,0]=4 2986 B12R1.308 N[C@H](CCO)c1ccccc1Cl Amb19887650 [0,1,0,0,0,0|3,0,0]=4 2987 B12R1.308 N[C@H](CCO)c1ccccc1F Amb25970063 [0,1,0,0,0,0|3,0,0]=4 2988 B12R1.308 N[C@H](CCO)c1ccccc1I Amb27411983 [0,1,0,0,0,0|3,0,0]=4 2989 B12R1.308 Nc1ccccc1C(N)CCO Amb22235813 [0,1,0,0,0,0|3,0,0]=4 2990 B12R1.308 Nc1ccccc1[C@@H](N)CCO Amb8631341 [0,1,0,0,0,0|3,0,0]=4 2991 B12R1.308 O=CCC(O)c1ccccc1F Amb27947440 [0,1,0,0,0,0|3,0,0]=4 2992 B12R1.308 OCCC(F)c1ccccc1Br Amb27421489 [0,1,0,0,0,0|3,0,0]=4 2993 B12R1.308 OCCC(O)c1ccccc1Br Amb24668754 [0,1,0,0,0,0|3,0,0]=4 2994 B12R1.308 OCCC(O)c1ccccc1Cl Amb25275717 [0,1,0,0,0,0|3,0,0]=4 2995 B12R1.308 ONCC(O)c1ccccc1Cl Amb17335947 [0,1,0,0,0,0|2,0,0]=3 2996 B12R1.308 ONCC(O)c1ccccc1F Amb17334837 [0,1,0,0,0,0|2,0,0]=3 2997 B12R1.308 [C-]#[N+]CC(F)c1ccccc1F Amb27638289 [0,1,0,0,0,0|1,0,2]=4 2998 B12R2.2 C1=C(c2ccccc2)CCC1 Amb4317492 [0,0,0,1,0,0|1,0,2]=4 2999 B12R2.2 C1=C(c2ccccc2)CNC1 Amb22059494 [0,0,0,1,0,0|0,0,2]=3 3000 B12R2.2 C1=C(c2ccccc2)CNC1 Amb30584704 [0,0,0,1,0,0|0,0,2]=3 3001 B12R2.2 C1=C(c2ccccn2)CNC1 Amb26610597 [0,0,0,1,0,0|1,0,2]=4 3002 B12R2.2 C1=C(c2ccccn2)CNC1 Amb32651704 [0,0,0,1,0,0|1,0,2]=4 3003 B12R2.2 C1=C(c2cccnc2)CNC1 Amb27780657 [0,0,0,1,0,0|1,0,2]=4 3004 B12R2.2 C1=C(c2cccnc2)CNC1 Amb30584706 [0,0,0,1,0,0|1,0,2]=4 3005 B12R2.2 C1=CCP(c2ccccc2)C1 Amb25736369 [0,0,0,1,0,0|2,0,1]=4 3006 B12R2.2 C1=NC(c2cccnc2)CC1 Amb17616205 [0,0,0,1,0,0|3,0,0]=4 3007 B12R2.2 C1=NCCN1c2ccccc2 Amb22527125 [0,0,0,1,0,0|1,0,2]=4 3008 B12R2.2 C1=NNC(c2ccccc2)C1 Amb2797582 [0,0,0,1,0,0|1,0,2]=4 3009 B12R2.2 C1=N[C@@H](c2ccccc2)CN1 Amb27174575 [0,0,0,1,0,0|1,0,1]=3 3010 B12R2.2 c1cc(C2CCCC2)ncn1 Amb33070128 [0,0,0,1,0,0|3,0,0]=4 3011 B12R2.2 c1cc(C2CCCN2)ccn1 Amb17659139 [0,0,0,1,0,0|3,0,0]=4 3012 B12R2.2 c1cc(C2CCCS2)ccn1 Amb19373819 [0,0,0,1,0,0|3,0,0]=4 3013 B12R2.2 c1cc(C2CCNC2)ccn1 Amb22233781 [0,0,0,1,0,0|1,0,0]=2 3014 B12R2.2 c1cc(C2CCNC2)ccn1 Amb33551300 [0,0,0,1,0,0|1,0,0]=2 3015 B12R2.2 c1cc(C2CCNC2)ccn1 Amb3940962 [0,0,0,1,0,0|1,0,0]=2 3016 B12R2.2 c1cc(C2CCNC2)ncn1 Amb18831325 [0,0,0,1,0,0|2,0,0]=3 3017 B12R2.2 c1cc(C2CCNC2)ncn1 Amb32410150 [0,0,0,1,0,0|2,0,0]=3 3018 B12R2.2 c1cc(C2CCOC2)ncn1 Amb33070127 [0,0,0,1,0,0|3,0,0]=4 3019 B12R2.2 c1cc(C2CNCO2)ccn1 Amb18065319 [0,0,0,1,0,0|2,0,0]=3 3020 B12R2.2 c1cc(N2CCCC2)cc[nH+]1 Amb33512940 [0,0,0,1,0,0|3,0,0]=4 3021 B12R2.2 c1cc(N2CCCC2)ccn1 Amb2708565 [0,0,0,1,0,0|3,0,0]=4 3022 B12R2.2 c1cc([C@@H]2CCCN2)ccn1 Amb26413775 [0,0,0,1,0,0|3,0,0]=4 3023 B12R2.2 c1cc([C@H]2CCCN2)ccn1 Amb26565678 [0,0,0,1,0,0|3,0,0]=4 3024 B12R2.2 c1ccc(C2=NCCC2)cc1 Amb1106418 [0,0,0,1,0,0|2,0,1]=4 3025 B12R2.2 c1ccc(C2=NNCC2)cc1 Amb25354740 [0,0,0,1,0,0|1,0,1]=3 3026 B12R2.2 c1ccc(C2=NNCC2)nc1 Amb22055158 [0,0,0,1,0,0|2,0,1]=4 3027 B12R2.2 c1ccc(C2CCCC2)cc1 Amb9787161 [0,0,0,1,0,0|1,0,0]=2 3028 B12R2.2 c1ccc(C2CCCC2)nc1 Amb23589711 [0,0,0,1,0,0|2,0,0]=3 3029 B12R2.2 c1ccc(C2CCCN2)cc1 Amb10808365 [0,0,0,1,0,0|2,0,0]=3 3030 B12R2.2 c1ccc(C2CCCN2)cc1 Amb9702996 [0,0,0,1,0,0|2,0,0]=3 3031 B12R2.2 c1ccc(C2CCCN2)nc1 Amb21960411 [0,0,0,1,0,0|3,0,0]=4 3032 B12R2.2 c1ccc(C2CCCN2)nc1 Amb2235736 [0,0,0,1,0,0|3,0,0]=4 3033 B12R2.2 c1ccc(C2CCCN2)nc1 Amb30586497 [0,0,0,1,0,0|3,0,0]=4 3034 B12R2.2 c1ccc(C2CCCO2)cc1 Amb17334283 [0,0,0,1,0,0|2,0,0]=3 3035 B12R2.2 c1ccc(C2CCC[NH2+]2)cc1 Amb33512932 [0,0,0,1,0,0|2,0,0]=3 3036 B12R2.2 c1ccc(C2CCNC2)cc1 Amb10069263 [0,0,0,1,0,0|0,0,0]=1 3037 B12R2.2 c1ccc(C2CCNC2)cc1 Amb10072809 [0,0,0,1,0,0|0,0,0]=1 3038 B12R2.2 c1ccc(C2CCNC2)cc1 Amb701982 [0,0,0,1,0,0|0,0,0]=1 3039 B12R2.2 c1ccc(C2CCNC2)nc1 Amb10808435 [0,0,0,1,0,0|1,0,0]=2 3040 B12R2.2 c1ccc(C2CCNC2)nc1 Amb32719303 [0,0,0,1,0,0|1,0,0]=2 3041 B12R2.2 c1ccc(C2CCNC2)nc1 Amb3941368 [0,0,0,1,0,0|1,0,0]=2 3042 B12R2.2 c1ccc(C2CCOC2)nc1 Amb24320768 [0,0,0,1,0,0|2,0,0]=3 3043 B12R2.2 c1ccc(C2CCSC2)cc1 Amb4140293 [0,0,0,1,0,0|1,0,0]=2 3044 B12R2.2 c1ccc(C2CC[NH2+]C2)cc1 Amb4258873 [0,0,0,1,0,0|0,0,1]=2 3045 B12R2.2 c1ccc(C2CNCO2)cc1 Amb18065307 [0,0,0,1,0,0|1,0,0]=2 3046 B12R2.2 c1ccc(C2CNCO2)nc1 Amb18065316 [0,0,0,1,0,0|2,0,0]=3 3047 B12R2.2 c1ccc(C2NCCO2)cc1 Amb17334284 [0,0,0,1,0,0|3,0,0]=4 3048 B12R2.2 c1ccc(C2NCCP2)cc1 Amb27606514 [0,0,0,1,0,0|3,0,0]=4 3049 B12R2.2 c1ccc(C2NCCS2)cc1 Amb3466213 [0,0,0,1,0,0|3,0,0]=4 3050 B12R2.2 c1ccc(C2OCCO2)cc1 Amb9786741 [0,0,0,1,0,0|3,0,0]=4 3051 B12R2.2 c1ccc(C2SCCS2)cc1 Amb23401446 [0,0,0,1,0,0|3,0,0]=4 3052 B12R2.2 c1ccc(N2CCCC2)cc1 Amb8391946 [0,0,0,1,0,0|2,0,0]=3 3053 B12R2.2 c1ccc(N2CCCC2)nc1 Amb18269671 [0,0,0,1,0,0|3,0,0]=4 3054 B12R2.2 c1ccc(N2CCNC2)cc1 Amb27785561 [0,0,0,1,0,0|1,0,0]=2 3055 B12R2.2 c1ccc([C@@H]2CCCN2)cc1 Amb20241933 [0,0,0,1,0,0|2,0,0]=3 3056 B12R2.2 c1ccc([C@@H]2CCCN2)cc1 Amb8397178 [0,0,0,1,0,0|2,0,0]=3 3057 B12R2.2 c1ccc([C@@H]2CCCN2)nc1 Amb22802416 [0,0,0,1,0,0|3,0,0]=4 3058 B12R2.2 c1ccc([C@@H]2CCNC2)cc1 Amb19888399 [0,0,0,1,0,0|0,0,0]=1 3059 B12R2.2 c1ccc([C@@H]2CCNC2)cc1 Amb27617269 [0,0,0,1,0,0|0,0,0]=1 3060 B12R2.2 c1ccc([C@H]2CCCN2)cc1 Amb20241932 [0,0,0,1,0,0|2,0,0]=3 3061 B12R2.2 c1ccc([C@H]2CCCN2)cc1 Amb8397179 [0,0,0,1,0,0|2,0,0]=3 3062 B12R2.2 c1ccc([C@H]2CCCN2)nc1 Amb22754034 [0,0,0,1,0,0|3,0,0]=4 3063 B12R2.2 c1ccc([C@H]2CCNC2)cc1 Amb19887561 [0,0,0,1,0,0|0,0,0]=1 3064 B12R2.2 c1ccc([C@H]2CCNC2)cc1 Amb24183516 [0,0,0,1,0,0|0,0,0]=1 3065 B12R2.2 c1ccc([C@H]2COCN2)cc1 Amb25877610 [0,0,0,1,0,0|2,0,0]=3 3066 B12R2.2 c1ccc([S+]2CCCC2)nc1 Amb2612713 [0,0,0,1,0,0|3,0,0]=4 3067 B12R2.2 c1cnc(C2CCNC2)cn1 Amb10068866 [0,0,0,1,0,0|2,0,0]=3 3068 B12R2.2 c1cnc(C2CCNC2)cn1 Amb29083428 [0,0,0,1,0,0|2,0,0]=3 3069 B12R2.2 c1cnc(C2CCNC2)cn1 Amb8009638 [0,0,0,1,0,0|2,0,0]=3 3070 B12R2.2 c1cnc(C2CCNC2)nc1 Amb32684570 [0,0,0,1,0,0|2,0,0]=3 3071 B12R2.2 c1cnc(C2CCNC2)nc1 Amb8009637 [0,0,0,1,0,0|2,0,0]=3 3072 B12R2.2 c1cnc([C@@H]2CCNC2)cn1 Amb27175285 [0,0,0,1,0,0|2,0,0]=3 3073 B12R2.2 c1cnc([C@H]2CCNC2)cn1 Amb31308314 [0,0,0,1,0,0|2,0,0]=3 3074 B12R2.2 c1cncc(C2CCCC2)c1 Amb25121665 [0,0,0,1,0,0|2,0,0]=3 3075 B12R2.2 c1cncc(C2CCCN2)c1 Amb17659140 [0,0,0,1,0,0|3,0,0]=4 3076 B12R2.2 c1cncc(C2CCCN2)c1 Amb32409359 [0,0,0,1,0,0|3,0,0]=4 3077 B12R2.2 c1cncc(C2CCCS2)c1 Amb19373816 [0,0,0,1,0,0|3,0,0]=4 3078 B12R2.2 c1cncc(C2CCNC2)c1 Amb19958035 [0,0,0,1,0,0|1,0,0]=2 3079 B12R2.2 c1cncc(C2CCNC2)c1 Amb22490712 [0,0,0,1,0,0|1,0,0]=2 3080 B12R2.2 c1cncc(C2CCNC2)c1 Amb30647467 [0,0,0,1,0,0|1,0,0]=2 3081 B12R2.2 c1cncc(C2CCNC2)c1 Amb3938889 [0,0,0,1,0,0|1,0,0]=2 3082 B12R2.2 c1cncc(C2CCOC2)c1 Amb24320767 [0,0,0,1,0,0|2,0,0]=3 3083 B12R2.2 c1cncc(C2CNCO2)c1 Amb18065317 [0,0,0,1,0,0|2,0,0]=3 3084 B12R2.2 c1cncc(C2NNCO2)c1 Amb28249019 [0,0,0,1,0,0|3,0,0]=4 3085 B12R2.2 c1cncc(N2CCCC2)c1 Amb8394249 [0,0,0,1,0,0|3,0,0]=4 3086 B12R2.2 c1cncc([C@@H]2CCCN2)c1 Amb33871642 [0,0,0,1,0,0|3,0,0]=4 3087 B12R2.2 c1cncc([C@@H]2CCCN2)c1 Amb8630852 [0,0,0,1,0,0|3,0,0]=4 3088 B12R2.2 c1cncc([C@H]2CCCN2)c1 Amb22748224 [0,0,0,1,0,0|3,0,0]=4 3089 B12R2.2 c1cncc([C@H]2CCCN2)c1 Amb22899133 [0,0,0,1,0,0|3,0,0]=4 3090 B12R2.2 c1cncc([C@H]2CCCN2)c1 Amb31291285 [0,0,0,1,0,0|3,0,0]=4 3091 B12R2.2 c1ncc(C2CCNC2)cn1 Amb18202037 [0,0,0,1,0,0|2,0,0]=3 3092 B12R2.22 BrC1CC(c2ccccc2)C1 Amb27798250 [0,0,0,1,0,0|2,0,0]=3 3093 B12R2.22 Br[C@H]1C[C@@H](c2ccccc2)C1 Amb27166116 [0,0,0,1,0,0|2,0,0]=3 3094 B12R2.22 C=C1CC(c2ccccc2)C1 Amb35681149 [0,0,0,1,0,0|1,0,1]=3 3095 B12R2.22 ClC1CC(c2ccccc2)C1 Amb35733980 [0,0,0,1,0,0|2,0,0]=3 3096 B12R2.22 NC1CC(c2ccccc2)C1 Amb19514746 [0,0,0,1,0,0|2,0,0]=3 3097 B12R2.22 NC1CC(c2ccccc2)C1 Amb9496746 [0,0,0,1,0,0|2,0,0]=3 3098 B12R2.22 NC1CC(c2ccccn2)C1 Amb26370978 [0,0,0,1,0,0|3,0,0]=4 3099 B12R2.22 NC1CC(c2ccccn2)C1 Amb33295179 [0,0,0,1,0,0|3,0,0]=4 3100 B12R2.22 NC1CC(c2cccnc2)C1 Amb24178936 [0,0,0,1,0,0|3,0,0]=4 3101 B12R2.22 NC1CC(c2cccnc2)C1 Amb25313817 [0,0,0,1,0,0|3,0,0]=4 3102 B12R2.22 NC1CC(c2ccncc2)C1 Amb26975408 [0,0,0,1,0,0|3,0,0]=4 3103 B12R2.22 NC1CC(c2ccncc2)C1 Amb33456466 [0,0,0,1,0,0|3,0,0]=4 3104 B12R2.22 NC1CC(c2ccncc2)C1 Amb35788877 [0,0,0,1,0,0|3,0,0]=4 3105 B12R2.22 NC1CN(c2ccccc2)C1 Amb23598844 [0,0,0,1,0,0|3,0,0]=4 3106 B12R2.22 NC1CN(c2ccccc2)C1 Amb30869768 [0,0,0,1,0,0|3,0,0]=4 3107 B12R2.22 N[C@H]1C[C@@H](c2ccccc2)C1 Amb23439754 [0,0,0,1,0,0|2,0,0]=3 3108 B12R2.22 N[C@H]1C[C@@H](c2ccccc2)C1 Amb32653334 [0,0,0,1,0,0|2,0,0]=3 3109 B12R2.22 N[C@H]1C[C@@H](c2cccnc2)C1 Amb24178917 [0,0,0,1,0,0|3,0,0]=4 3110 B12R2.22 N[C@H]1C[C@@H](c2ccncc2)C1 Amb27176278 [0,0,0,1,0,0|3,0,0]=4 3111 B12R2.22 N[C@H]1C[C@@H](c2ccncc2)C1 Amb33677251 [0,0,0,1,0,0|3,0,0]=4 3112 B12R2.22 N[C@H]1C[C@H](c2ccccc2)C1 Amb23439755 [0,0,0,1,0,0|2,0,0]=3 3113 B12R2.22 N[C@H]1C[C@H](c2ccccc2)C1 Amb33473674 [0,0,0,1,0,0|2,0,0]=3 3114 B12R2.22 N[C@H]1C[C@H](c2ccccn2)C1 Amb27839832 [0,0,0,1,0,0|3,0,0]=4 3115 B12R2.22 N[C@H]1C[C@H](c2cccnc2)C1 Amb24178920 [0,0,0,1,0,0|3,0,0]=4 3116 B12R2.22 N[C@H]1C[C@H](c2cccnc2)C1 Amb28287764 [0,0,0,1,0,0|3,0,0]=4 3117 B12R2.22 N[C@H]1C[C@H](c2ccncc2)C1 Amb27440155 [0,0,0,1,0,0|3,0,0]=4 3118 B12R2.22 N[C@H]1C[C@H](c2ccncc2)C1 Amb33677250 [0,0,0,1,0,0|3,0,0]=4 3119 B12R2.22 O=C1CC(c2ccccc2)C1 Amb6739873 [0,0,0,1,0,0|2,0,0]=3 3120 B12R2.22 O=C1CC(c2ccccc2)N1 Amb1993905 [0,0,0,1,0,0|3,0,0]=4 3121 B12R2.22 O=C1CC(c2ccccn2)C1 Amb25891417 [0,0,0,1,0,0|3,0,0]=4 3122 B12R2.22 O=C1CC(c2cccnc2)C1 Amb25151161 [0,0,0,1,0,0|3,0,0]=4 3123 B12R2.22 O=C1CC(c2ccncc2)C1 Amb24407200 [0,0,0,1,0,0|3,0,0]=4 3124 B12R2.22 OC1CC(c2ccccc2)C1 Amb33550604 [0,0,0,1,0,0|2,0,0]=3 3125 B12R2.22 OC1CN(c2ccccc2)C1 Amb23598700 [0,0,0,1,0,0|3,0,0]=4 3126 B12R2.22 O[C@H]1C[C@@H](c2ccccc2)C1 Amb27839916 [0,0,0,1,0,0|2,0,0]=3 3127 B12R2.22 O[C@H]1C[C@@H](c2ccncc2)C1 Amb27258016 [0,0,0,1,0,0|3,0,0]=4 3128 B12R2.22 O[C@H]1C[C@H](c2ccccc2)C1 Amb25749083 [0,0,0,1,0,0|2,0,0]=3 3129 B12R2.22 O[C@H]1C[C@H](c2ccccn2)C1 Amb27839913 [0,0,0,1,0,0|3,0,0]=4 3130 B12R2.22 O[C@H]1C[C@H](c2ccncc2)C1 Amb27802818 [0,0,0,1,0,0|3,0,0]=4 3131 B12R2.22 S=C1CC(c2ccccc2)N1 Amb28182509 [0,0,0,1,0,0|3,0,0]=4 3132 B12R2.22 SC1CC(c2ccccc2)C1 Amb24690234 [0,0,0,1,0,0|2,0,0]=3 3133 B12R2.27 BrCC1CC1c2ccccc2 Amb25099525 [0,0,0,1,0,0|2,0,0]=3 3134 B12R2.27 BrC[C@@H]1C[C@H]1c2ccccc2 Amb26055377 [0,0,0,1,0,0|2,0,0]=3 3135 B12R2.27 BrC[C@@H]1O[C@H]1c2ccccc2 Amb28249045 [0,0,0,1,0,0|3,0,0]=4 3136 B12R2.27 C#CC1OC1c2ccccc2 Amb28254723 [0,0,0,1,0,0|2,0,1]=4 3137 B12R2.27 C=CC1CC1c2ccccc2 Amb26889126 [0,0,0,1,0,0|1,0,1]=3 3138 B12R2.27 CC[C@@H]1O[C@H]1c2ccccc2 Amb27768002 [0,0,0,1,0,0|2,0,0]=3 3139 B12R2.27 CNC1CC1c2ccccc2 Amb18957298 [0,0,0,1,0,0|0,0,0]=1 3140 B12R2.27 CNC1CC1c2ccccc2 Amb20630184 [0,0,0,1,0,0|0,0,0]=1 3141 B12R2.27 CN[C@@H]1C[C@H]1c2ccccc2 Amb28056101 [0,0,0,1,0,0|0,0,0]=1 3142 B12R2.27 CN[C@@H]1C[C@H]1c2ccccc2 Amb33309625 [0,0,0,1,0,0|0,0,0]=1 3143 B12R2.27 ClC[C@@H]1O[C@@H]1c2ccccc2 Amb28457544 [0,0,0,1,0,0|3,0,0]=4 3144 B12R2.27 N#CC1CC1c2ccccc2 Amb17231961 [0,0,0,1,0,0|2,0,0]=3 3145 B12R2.27 N#C[C@@H]1C[C@H]1c2ccccc2 Amb25309014 [0,0,0,1,0,0|2,0,0]=3 3146 B12R2.27 N#C[C@H]1C[C@@H]1c2ccccc2 Amb27613258 [0,0,0,1,0,0|2,0,0]=3 3147 B12R2.27 NCC1CC1c2ccccc2 Amb17232030 [0,0,0,1,0,0|2,0,0]=3 3148 B12R2.27 NCC1CC1c2ccccc2 Amb19515036 [0,0,0,1,0,0|2,0,0]=3 3149 B12R2.27 NCC1CC1c2ccccn2 Amb18963618 [0,0,0,1,0,0|3,0,0]=4 3150 B12R2.27 NCC1CC1c2cccnc2 Amb17232044 [0,0,0,1,0,0|3,0,0]=4 3151 B12R2.27 NCC1CC1c2cccnc2 Amb33172856 [0,0,0,1,0,0|3,0,0]=4 3152 B12R2.27 NCC1CC1c2ccncc2 Amb18963616 [0,0,0,1,0,0|3,0,0]=4 3153 B12R2.27 NCC1OC1c2ccccc2 Amb25836323 [0,0,0,1,0,0|3,0,0]=4 3154 B12R2.27 NC[C@@H]1C[C@@H]1c2ccccc2 Amb34916191 [0,0,0,1,0,0|2,0,0]=3 3155 B12R2.27 NC[C@@H]1C[C@@H]1c2cccnc2 Amb34915991 [0,0,0,1,0,0|3,0,0]=4 3156 B12R2.27 NC[C@@H]1C[C@H]1c2ccccc2 Amb24514797 [0,0,0,1,0,0|2,0,0]=3 3157 B12R2.27 NC[C@@H]1C[C@H]1c2ccccc2 Amb32661485 [0,0,0,1,0,0|2,0,0]=3 3158 B12R2.27 NC[C@@H]1C[C@H]1c2ccccn2 Amb26887881 [0,0,0,1,0,0|3,0,0]=4 3159 B12R2.27 NC[C@@H]1C[C@H]1c2cccnc2 Amb25168891 [0,0,0,1,0,0|3,0,0]=4 3160 B12R2.27 NC[C@@H]1C[C@H]1c2cccnc2 Amb33172877 [0,0,0,1,0,0|3,0,0]=4 3161 B12R2.27 NC[C@@H]1C[C@H]1c2ccncc2 Amb25271512 [0,0,0,1,0,0|3,0,0]=4 3162 B12R2.27 NC[C@H]1C[C@@H]1c2ccccc2 Amb24606663 [0,0,0,1,0,0|2,0,0]=3 3163 B12R2.27 NC[C@H]1C[C@@H]1c2ccccc2 Amb32664390 [0,0,0,1,0,0|2,0,0]=3 3164 B12R2.27 NC[C@H]1C[C@@H]1c2ccncc2 Amb27440247 [0,0,0,1,0,0|3,0,0]=4 3165 B12R2.27 NC[C@H]1C[C@H]1c2ccccc2 Amb34916190 [0,0,0,1,0,0|2,0,0]=3 3166 B12R2.27 NC[C@H]1O[C@@H]1c2ccccc2 Amb27188182 [0,0,0,1,0,0|3,0,0]=4 3167 B12R2.27 O=CC1CC1c2ccccc2 Amb10844842 [0,0,0,1,0,0|2,0,0]=3 3168 B12R2.27 O=CC1CC1c2cccnc2 Amb27872437 [0,0,0,1,0,0|3,0,0]=4 3169 B12R2.27 O=CC1CC1c2ccncc2 Amb6572446 [0,0,0,1,0,0|3,0,0]=4 3170 B12R2.27 O=C[C@@H]1C[C@@H]1c2ccccc2 Amb26433208 [0,0,0,1,0,0|2,0,0]=3 3171 B12R2.27 O=C[C@@H]1C[C@H]1c2ccccc2 Amb25368620 [0,0,0,1,0,0|2,0,0]=3 3172 B12R2.27 O=C[C@@H]1O[C@H]1c2ccccc2 Amb26550113 [0,0,0,1,0,0|3,0,0]=4 3173 B12R2.27 O=C[C@H]1C[C@@H]1c2ccccc2 Amb27421992 [0,0,0,1,0,0|2,0,0]=3 3174 B12R2.27 O=C[C@H]1C[C@H]1c2ccccc2 Amb26548788 [0,0,0,1,0,0|2,0,0]=3 3175 B12R2.27 O=C[C@H]1O[C@@H]1c2ccccc2 Amb28195860 [0,0,0,1,0,0|3,0,0]=4 3176 B12R2.27 OCC1CC1c2ccccc2 Amb17605543 [0,0,0,1,0,0|2,0,0]=3 3177 B12R2.27 OCC1CC1c2ccccn2 Amb23536863 [0,0,0,1,0,0|3,0,0]=4 3178 B12R2.27 OCC1CC1c2ccncc2 Amb23536862 [0,0,0,1,0,0|3,0,0]=4 3179 B12R2.27 OCC1C[C@@H]1c2ccccc2 Amb28182630 [0,0,0,1,0,0|2,0,0]=3 3180 B12R2.27 OCC1C[C@H]1c2ccccc2 Amb28207313 [0,0,0,1,0,0|2,0,0]=3 3181 B12R2.27 OCC1OC1c2ccccc2 Amb24063567 [0,0,0,1,0,0|3,0,0]=4 3182 B12R2.27 OC[C@@H]1C[C@@H]1c2ccccc2 Amb25917153 [0,0,0,1,0,0|2,0,0]=3 3183 B12R2.27 OC[C@@H]1C[C@@H]1c2cccnc2 Amb22744875 [0,0,0,1,0,0|3,0,0]=4 3184 B12R2.27 OC[C@@H]1C[C@@H]1c2ccncc2 Amb27485910 [0,0,0,1,0,0|3,0,0]=4 3185 B12R2.27 OC[C@@H]1C[C@H]1c2ccccc2 Amb28146004 [0,0,0,1,0,0|2,0,0]=3 3186 B12R2.27 OC[C@@H]1C[C@H]1c2ccccn2 Amb27968717 [0,0,0,1,0,0|3,0,0]=4 3187 B12R2.27 OC[C@H]1C[C@@H]1c2ccccc2 Amb3634122 [0,0,0,1,0,0|2,0,0]=3 3188 B12R2.27 OC[C@H]1C[C@@H]1c2ccccn2 Amb27428354 [0,0,0,1,0,0|3,0,0]=4 3189 B12R2.27 OC[C@H]1O[C@@H]1c2ccccc2 Amb20242388 [0,0,0,1,0,0|3,0,0]=4 3190 B12R2.27 OC[C@H]1O[C@H]1c2ccccc2 Amb27432251 [0,0,0,1,0,0|3,0,0]=4 3191 B12R2.116 CC1(c2ccccc2)CCN1 Amb27263594 [0,0,0,1,0,0|2,0,0]=3 3192 B12R2.116 CC1(c2ccccc2)CCO1 Amb22497354 [0,0,0,1,0,0|2,0,0]=3 3193 B12R2.116 CC1(c2ccccc2)CNC1 Amb18065223 [0,0,0,1,0,0|0,0,0]=1 3194 B12R2.116 CC1(c2ccccc2)CNC1 Amb33551677 [0,0,0,1,0,0|0,0,0]=1 3195 B12R2.116 CC1(c2ccccc2)COC1 Amb22497353 [0,0,0,1,0,0|1,0,0]=2 3196 B12R2.116 CC1(c2ccccn2)CCC1 Amb26066736 [0,0,0,1,0,0|2,0,0]=3 3197 B12R2.116 CC1(c2ccccn2)CCN1 Amb28424071 [0,0,0,1,0,0|3,0,0]=4 3198 B12R2.116 CC1(c2ccccn2)CCO1 Amb32642016 [0,0,0,1,0,0|3,0,0]=4 3199 B12R2.116 CC1(c2cccnc2)CCO1 Amb32642010 [0,0,0,1,0,0|3,0,0]=4 3200 B12R2.116 CC1(c2ccncc2)CCO1 Amb32642022 [0,0,0,1,0,0|3,0,0]=4 3201 B12R2.116 ClC1(c2ccccc2)CNC1 Amb27444675 [0,0,0,1,0,0|1,0,0]=2 3202 B12R2.116 FC1(c2ccccc2)CNC1 Amb26450082 [0,0,0,1,0,0|1,0,0]=2 3203 B12R2.116 FC1(c2ccccc2)CNC1 Amb28872317 [0,0,0,1,0,0|1,0,0]=2 3204 B12R2.116 FC1(c2ccccc2)COC1 Amb22738854 [0,0,0,1,0,0|2,0,0]=3 3205 B12R2.116 FC1(c2cccnc2)CNC1 Amb25151802 [0,0,0,1,0,0|2,0,0]=3 3206 B12R2.116 NC1(c2ccccc2)CCC1 Amb2371533 [0,0,0,1,0,0|2,0,0]=3 3207 B12R2.116 NC1(c2ccccc2)CCC1 Amb453192 [0,0,0,1,0,0|2,0,0]=3 3208 B12R2.116 NC1(c2ccccc2)CNC1 Amb24120649 [0,0,0,1,0,0|1,0,0]=2 3209 B12R2.116 NC1(c2ccccc2)COC1 Amb22386882 [0,0,0,1,0,0|2,0,0]=3 3210 B12R2.116 NC1(c2ccccc2)COC1 Amb33534183 [0,0,0,1,0,0|2,0,0]=3 3211 B12R2.116 NC1(c2ccccn2)CCC1 Amb25891423 [0,0,0,1,0,0|3,0,0]=4 3212 B12R2.116 NC1(c2ccccn2)COC1 Amb25978058 [0,0,0,1,0,0|3,0,0]=4 3213 B12R2.116 NC1(c2cccnc2)CCC1 Amb22498055 [0,0,0,1,0,0|3,0,0]=4 3214 B12R2.116 NC1(c2cccnc2)CCC1 Amb35749840 [0,0,0,1,0,0|3,0,0]=4 3215 B12R2.116 NC1(c2cccnc2)COC1 Amb24716676 [0,0,0,1,0,0|3,0,0]=4 3216 B12R2.116 NC1(c2cccnc2)COC1 Amb30869338 [0,0,0,1,0,0|3,0,0]=4 3217 B12R2.116 NC1(c2ccncc2)CCC1 Amb22500386 [0,0,0,1,0,0|3,0,0]=4 3218 B12R2.116 OC1(c2ccccc2)CCC1 Amb33544160 [0,0,0,1,0,0|2,0,0]=3 3219 B12R2.116 OC1(c2ccccc2)CNC1 Amb22406135 [0,0,0,1,0,0|1,0,0]=2 3220 B12R2.116 OC1(c2ccccc2)CNC1 Amb22496452 [0,0,0,1,0,0|1,0,0]=2 3221 B12R2.116 OC1(c2ccccc2)CNC1 Amb32758790 [0,0,0,1,0,0|1,0,0]=2 3222 B12R2.116 OC1(c2ccccc2)COC1 Amb21960821 [0,0,0,1,0,0|2,0,0]=3 3223 B12R2.116 OC1(c2ccccc2)CSC1 Amb22386890 [0,0,0,1,0,0|2,0,0]=3 3224 B12R2.116 OC1(c2ccccn2)CNC1 Amb24486814 [0,0,0,1,0,0|2,0,0]=3 3225 B12R2.116 OC1(c2ccccn2)CNC1 Amb33623661 [0,0,0,1,0,0|2,0,0]=3 3226 B12R2.116 OC1(c2cccnc2)CCC1 Amb25123095 [0,0,0,1,0,0|3,0,0]=4 3227 B12R2.116 OC1(c2cccnc2)CCC1 Amb32665519 [0,0,0,1,0,0|3,0,0]=4 3228 B12R2.116 OC1(c2cccnc2)CNC1 Amb27968637 [0,0,0,1,0,0|2,0,0]=3 3229 B12R2.116 OC1(c2cccnc2)CNC1 Amb35747823 [0,0,0,1,0,0|2,0,0]=3 3230 B12R2.116 OC1(c2cccnc2)COC1 Amb22737297 [0,0,0,1,0,0|3,0,0]=4 3231 B12R2.116 OC1(c2cccnc2)CSC1 Amb27784348 [0,0,0,1,0,0|3,0,0]=4 3232 B12R2.116 OC1(c2ccncc2)CNC1 Amb33380637 [0,0,0,1,0,0|2,0,0]=3 3233 B12R2.116 OC1(c2ccncn2)CNC1 Amb33267966 [0,0,0,1,0,0|3,0,0]=4 3234 B12R2.116 OC1(c2cnccn2)CNC1 Amb25791772 [0,0,0,1,0,0|3,0,0]=4 3235 B12R2.116 OC1(c2cncnc2)CNC1 Amb25756768 [0,0,0,1,0,0|3,0,0]=4 3236 B12R2.116 OC1(c2ncccn2)CNC1 Amb33269932 [0,0,0,1,0,0|3,0,0]=4 3237 B12R2.235 CC1(c2ccccc2)CC1Br Amb27184089 [0,0,0,1,0,0|2,0,0]=3 3238 B12R2.235 CC1(c2ccccc2)CC1N Amb18947391 [0,0,0,1,0,0|2,0,0]=3 3239 B12R2.235 CC1(c2ccccc2)CC1N Amb33549909 [0,0,0,1,0,0|2,0,0]=3 3240 B12R2.235 CC1(c2ccccc2)OC1Cl Amb27776758 [0,0,0,1,0,0|3,0,0]=4 3241 B12R2.235 CC1(c2cccnc2)CC1N Amb18947383 [0,0,0,1,0,0|3,0,0]=4 3242 B12R2.235 CC1CC1(N)c2ccncc2 Amb27806893 [0,0,0,1,0,0|3,0,0]=4 3243 B12R2.235 CC1CC1(O)c2ccccn2 Amb25149270 [0,0,0,1,0,0|3,0,0]=4 3244 B12R2.235 CC1CC1(O)c2ccncc2 Amb28064515 [0,0,0,1,0,0|3,0,0]=4 3245 B12R2.235 CC1OC1(O)c2ccccc2 Amb26510326 [0,0,0,1,0,0|3,0,0]=4 3246 B12R2.235 CN1NC1(C)c2ccccc2 Amb27184008 [0,0,0,1,0,0|1,0,0]=2 3247 B12R2.235 C[C@@]1(c2ccccc2)CC1Cl Amb27791824 [0,0,0,1,0,0|2,0,0]=3 3248 B12R2.235 C[C@@]1(c2ccccc2)C[C@@H]1Br Amb28053371 [0,0,0,1,0,0|2,0,0]=3 3249 B12R2.235 C[C@@]1(c2ccccc2)C[C@H]1Br Amb28053370 [0,0,0,1,0,0|2,0,0]=3 3250 B12R2.235 C[C@@]1(c2ccccc2)C[C@H]1Cl Amb28458446 [0,0,0,1,0,0|2,0,0]=3 3251 B12R2.235 C[C@@]1(c2ccccc2)O[C@@H]1Cl Amb27195805 [0,0,0,1,0,0|3,0,0]=4 3252 B12R2.235 NC1CC1(F)c2ccccc2 Amb32663945 [0,0,0,1,0,0|3,0,0]=4 3253 B12R2.235 NC1CC1(F)c2ccccc2 Amb8389488 [0,0,0,1,0,0|3,0,0]=4 3254 B12R2.931 BrCCC1Cc2ccccc21 Amb28060024 [0,0,0,1,0,0|2,0,0]=3 3255 B12R2.931 CCNC1Cc2ccccc21 Amb27840306 [0,0,0,1,0,0|2,0,0]=3 3256 B12R2.931 ClCCC1Cc2ccccc21 Amb27260584 [0,0,0,1,0,0|2,0,0]=3 3257 B12R2.931 N#CCC1Cc2ccccc21 Amb27780963 [0,0,0,1,0,0|2,0,0]=3 3258 B12R2.1081 BrC1CCCc2ccccc21 Amb8384413 [0,0,0,1,0,0|2,0,0]=3 3259 B12R2.1081 BrC1CCCc2cccnc21 Amb24680202 [0,0,0,1,0,0|3,0,0]=4 3260 B12R2.1081 BrC1CCNc2ccccc21 Amb26657292 [0,0,0,1,0,0|3,0,0]=4 3261 B12R2.1081 BrC1CCOc2ccccc21 Amb9210662 [0,0,0,1,0,0|3,0,0]=4 3262 B12R2.1081 BrC1NCCc2ccccc21 Amb27176472 [0,0,0,1,0,0|3,0,0]=4 3263 B12R2.1081 BrC1OCCc2ccccc21 Amb23441457 [0,0,0,1,0,0|3,0,0]=4 3264 B12R2.1081 C=C1CCCc2ccccc21 Amb25736652 [0,0,0,1,0,0|1,0,2]=4 3265 B12R2.1081 CC1=CCCc2ccccc21 Amb2439915 [0,0,0,1,0,0|1,0,2]=4 3266 B12R2.1081 CC1=NCCc2ccccc21 Amb17940779 [0,0,0,1,0,0|2,0,1]=4 3267 B12R2.1081 CC1=NCCc2ccccc21 Amb33446974 [0,0,0,1,0,0|2,0,1]=4 3268 B12R2.1081 CC1=NCCc2ccccc21 Amb8517423 [0,0,0,1,0,0|2,0,1]=4 3269 B12R2.1081 CC1CCCc2ccccc21 Amb22730060 [0,0,0,1,0,0|1,0,0]=2 3270 B12R2.1081 CC1CCCc2cccnc21 Amb26442760 [0,0,0,1,0,0|2,0,0]=3 3271 B12R2.1081 CC1CCCc2ncccc21 Amb27617300 [0,0,0,1,0,0|2,0,0]=3 3272 B12R2.1081 CC1CCCc2ncncc21 Amb27456609 [0,0,0,1,0,0|3,0,0]=4 3273 B12R2.1081 CC1CCNc2ccccc21 Amb7969716 [0,0,0,1,0,0|2,0,0]=3 3274 B12R2.1081 CC1CCNc2ccccc21 Amb9782720 [0,0,0,1,0,0|2,0,0]=3 3275 B12R2.1081 CC1CCNc2ncccc21 Amb26399114 [0,0,0,1,0,0|3,0,0]=4 3276 B12R2.1081 CC1CCOc2ccccc21 Amb28194294 [0,0,0,1,0,0|2,0,0]=3 3277 B12R2.1081 CC1CCOc2ccncc21 Amb28400483 [0,0,0,1,0,0|3,0,0]=4 3278 B12R2.1081 CC1CNCc2ccccc21 Amb17399906 [0,0,0,1,0,0|0,0,0]=1 3279 B12R2.1081 CC1CNCc2ccccc21 Amb22275944 [0,0,0,1,0,0|0,0,0]=1 3280 B12R2.1081 CC1CNCc2cncnc21 Amb32674880 [0,0,0,1,0,0|2,0,0]=3 3281 B12R2.1081 CC1CNCc2cncnc21 Amb32674915 [0,0,0,1,0,0|2,0,0]=3 3282 B12R2.1081 CC1COCc2ccccc21 Amb23580749 [0,0,0,1,0,0|1,0,0]=2 3283 B12R2.1081 CC1NC=Cc2ccccc21 Amb28424328 [0,0,0,1,0,0|2,0,1]=4 3284 B12R2.1081 CC1NCCc2ccccc21 Amb19514854 [0,0,0,1,0,0|2,0,0]=3 3285 B12R2.1081 CC1NCCc2ccccc21 Amb5735598 [0,0,0,1,0,0|2,0,0]=3 3286 B12R2.1081 CC1NCCc2ccncc21 Amb33483942 [0,0,0,1,0,0|3,0,0]=4 3287 B12R2.1081 CC1NCCc2ncccc21 Amb33544943 [0,0,0,1,0,0|3,0,0]=4 3288 B12R2.1081 CC1OCNc2ccccc21 Amb28118766 [0,0,0,1,0,0|3,0,0]=4 3289 B12R2.1081 CN1CC=Cc2ccccc21 Amb26960927 [0,0,0,1,0,0|2,0,1]=4 3290 B12R2.1081 CN1CCCc2ccccc21 Amb15692645 [0,0,0,1,0,0|2,0,0]=3 3291 B12R2.1081 CN1CCCc2cccnc21 Amb24538105 [0,0,0,1,0,0|3,0,0]=4 3292 B12R2.1081 CN1CCNc2ccccc21 Amb19957895 [0,0,0,1,0,0|3,0,0]=4 3293 B12R2.1081 CN1CCNc2ccccc21 Amb2383679 [0,0,0,1,0,0|3,0,0]=4 3294 B12R2.1081 CN1CCOc2ccccc21 Amb10569245 [0,0,0,1,0,0|3,0,0]=4 3295 B12R2.1081 C[C@@H]1CCCc2ncccc21 Amb27476144 [0,0,0,1,0,0|2,0,0]=3 3296 B12R2.1081 C[C@@H]1CNCc2ccccc21 Amb30594264 [0,0,0,1,0,0|0,0,0]=1 3297 B12R2.1081 C[C@@H]1NCCc2ccccc21 Amb22751772 [0,0,0,1,0,0|2,0,0]=3 3298 B12R2.1081 C[C@H]1NCCc2ccccc21 Amb28186683 [0,0,0,1,0,0|2,0,0]=3 3299 B12R2.1081 ClC1CCCc2ccccc21 Amb9204490 [0,0,0,1,0,0|2,0,0]=3 3300 B12R2.1081 ClC1CCCc2cccnc21 Amb16234115 [0,0,0,1,0,0|3,0,0]=4 3301 B12R2.1081 ClC1CCCc2cccnc21 Amb32671478 [0,0,0,1,0,0|3,0,0]=4 3302 B12R2.1081 ClC1CCCc2cnccc21 Amb23412277 [0,0,0,1,0,0|3,0,0]=4 3303 B12R2.1081 ClC1CCCc2ncccc21 Amb25152726 [0,0,0,1,0,0|3,0,0]=4 3304 B12R2.1081 ClC1CCNc2ccccc21 Amb24636938 [0,0,0,1,0,0|3,0,0]=4 3305 B12R2.1081 ClC1CCOc2ccccc21 Amb33529009 [0,0,0,1,0,0|3,0,0]=4 3306 B12R2.1081 ClC1CCSc2ccccc21 Amb33529010 [0,0,0,1,0,0|3,0,0]=4 3307 B12R2.1081 ClC1COCc2ccccc21 Amb22490656 [0,0,0,1,0,0|2,0,0]=3 3308 B12R2.1081 ClC1CSCc2ccccc21 Amb27454843 [0,0,0,1,0,0|2,0,0]=3 3309 B12R2.1081 Cl[C@H]1CCCc2cccnc21 Amb27213220 [0,0,0,1,0,0|3,0,0]=4 3310 B12R2.1081 FC1CCNc2ccccc21 Amb28079527 [0,0,0,1,0,0|3,0,0]=4 3311 B12R2.1081 FC1CNCc2ccccc21 Amb10841578 [0,0,0,1,0,0|1,0,0]=2 3312 B12R2.1081 IC1CCCc2ccccc21 Amb33714900 [0,0,0,1,0,0|2,0,0]=3 3313 B12R2.1081 IC1CCCc2cccnc21 Amb32685579 [0,0,0,1,0,0|3,0,0]=4 3314 B12R2.1081 IC1CCNc2ccccc21 Amb24754405 [0,0,0,1,0,0|3,0,0]=4 3315 B12R2.1081 IC1CCOc2ccccc21 Amb28060969 [0,0,0,1,0,0|3,0,0]=4 3316 B12R2.1081 NC1CCCc2ccccc21 Amb24273096 [0,0,0,1,0,0|2,0,0]=3 3317 B12R2.1081 NC1CCCc2ccccc21 Amb5716841 [0,0,0,1,0,0|2,0,0]=3 3318 B12R2.1081 NC1CCCc2ccccc21 Amb6334842 [0,0,0,1,0,0|2,0,0]=3 3319 B12R2.1081 NC1CCCc2cccnc21 Amb22371548 [0,0,0,1,0,0|3,0,0]=4 3320 B12R2.1081 NC1CCCc2cccnc21 Amb8010256 [0,0,0,1,0,0|3,0,0]=4 3321 B12R2.1081 NC1CCCc2ccncc21 Amb22751608 [0,0,0,1,0,0|3,0,0]=4 3322 B12R2.1081 NC1CCCc2cnccc21 Amb20622033 [0,0,0,1,0,0|3,0,0]=4 3323 B12R2.1081 NC1CCCc2cnccc21 Amb23399856 [0,0,0,1,0,0|3,0,0]=4 3324 B12R2.1081 NC1CCCc2ncccc21 Amb22499726 [0,0,0,1,0,0|3,0,0]=4 3325 B12R2.1081 NC1CCCc2ncccc21 Amb2695428 [0,0,0,1,0,0|3,0,0]=4 3326 B12R2.1081 NC1CCNc2ccccc21 Amb22233827 [0,0,0,1,0,0|3,0,0]=4 3327 B12R2.1081 NC1CCNc2ccccc21 Amb2700188 [0,0,0,1,0,0|3,0,0]=4 3328 B12R2.1081 NC1CCOc2ccccc21 Amb5717381 [0,0,0,1,0,0|3,0,0]=4 3329 B12R2.1081 NC1CCOc2ccccc21 Amb8333718 [0,0,0,1,0,0|3,0,0]=4 3330 B12R2.1081 NC1CCSc2ccccc21 Amb6891903 [0,0,0,1,0,0|3,0,0]=4 3331 B12R2.1081 NC1CCSc2ccccc21 Amb9703514 [0,0,0,1,0,0|3,0,0]=4 3332 B12R2.1081 NC1CNCc2ccccc21 Amb19929632 [0,0,0,1,0,0|1,0,0]=2 3333 B12R2.1081 NC1COCc2ccccc21 Amb10067658 [0,0,0,1,0,0|2,0,0]=3 3334 B12R2.1081 NC1COCc2ccccc21 Amb18202067 [0,0,0,1,0,0|2,0,0]=3 3335 B12R2.1081 NC1CSCc2ccccc21 Amb10067686 [0,0,0,1,0,0|2,0,0]=3 3336 B12R2.1081 NC1CSCc2ccccc21 Amb9620859 [0,0,0,1,0,0|2,0,0]=3 3337 B12R2.1081 NN1CCCc2ccccc21 Amb33172813 [0,0,0,1,0,0|3,0,0]=4 3338 B12R2.1081 NN1CCCc2ccccc21 Amb836811 [0,0,0,1,0,0|3,0,0]=4 3339 B12R2.1081 N[C@@H]1CCCc2ccccc21 Amb10844952 [0,0,0,1,0,0|2,0,0]=3 3340 B12R2.1081 N[C@@H]1CCCc2cccnc21 Amb22748844 [0,0,0,1,0,0|3,0,0]=4 3341 B12R2.1081 N[C@@H]1CCCc2cccnc21 Amb22748845 [0,0,0,1,0,0|3,0,0]=4 3342 B12R2.1081 N[C@@H]1CCCc2cccnc21 Amb8397713 [0,0,0,1,0,0|3,0,0]=4 3343 B12R2.1081 N[C@@H]1CCCc2ccncc21 Amb26019463 [0,0,0,1,0,0|3,0,0]=4 3344 B12R2.1081 N[C@@H]1CCCc2cnccc21 Amb27864893 [0,0,0,1,0,0|3,0,0]=4 3345 B12R2.1081 N[C@@H]1CCCc2ncccc21 Amb27170343 [0,0,0,1,0,0|3,0,0]=4 3346 B12R2.1081 N[C@@H]1CCNc2ccccc21 Amb26012444 [0,0,0,1,0,0|3,0,0]=4 3347 B12R2.1081 N[C@@H]1CCOc2ccccc21 Amb13953038 [0,0,0,1,0,0|3,0,0]=4 3348 B12R2.1081 N[C@@H]1CCOc2ccccc21 Amb19515762 [0,0,0,1,0,0|3,0,0]=4 3349 B12R2.1081 N[C@@H]1CCSc2ccccc21 Amb13952927 [0,0,0,1,0,0|3,0,0]=4 3350 B12R2.1081 N[C@H]1CCCc2ccccc21 Amb19929634 [0,0,0,1,0,0|2,0,0]=3 3351 B12R2.1081 N[C@H]1CCCc2ccccc21 Amb8383429 [0,0,0,1,0,0|2,0,0]=3 3352 B12R2.1081 N[C@H]1CCCc2cccnc21 Amb33870724 [0,0,0,1,0,0|3,0,0]=4 3353 B12R2.1081 N[C@H]1CCCc2cccnc21 Amb8397714 [0,0,0,1,0,0|3,0,0]=4 3354 B12R2.1081 N[C@H]1CCCc2ccncc21 Amb25326344 [0,0,0,1,0,0|3,0,0]=4 3355 B12R2.1081 N[C@H]1CCCc2cnccc21 Amb28341706 [0,0,0,1,0,0|3,0,0]=4 3356 B12R2.1081 N[C@H]1CCNc2ccccc21 Amb25697589 [0,0,0,1,0,0|3,0,0]=4 3357 B12R2.1081 N[C@H]1CCOc2ccccc21 Amb13953039 [0,0,0,1,0,0|3,0,0]=4 3358 B12R2.1081 N[C@H]1CCOc2ccccc21 Amb24052964 [0,0,0,1,0,0|3,0,0]=4 3359 B12R2.1081 N[C@H]1CCSc2ccccc21 Amb13952928 [0,0,0,1,0,0|3,0,0]=4 3360 B12R2.1081 N[C@H]1COCc2ccccc21 Amb27839884 [0,0,0,1,0,0|2,0,0]=3 3361 B12R2.1081 O=C1CCCc2ccccc21 Amb534638 [0,0,0,1,0,0|2,0,1]=4 3362 B12R2.1081 O=C1CNCc2ccccc21 Amb22494722 [0,0,0,1,0,0|1,0,1]=3 3363 B12R2.1081 O=C1CNCc2ccccc21 Amb9783330 [0,0,0,1,0,0|1,0,1]=3 3364 B12R2.1081 O=C1CNCc2ncccc21 Amb18202251 [0,0,0,1,0,0|2,0,1]=4 3365 B12R2.1081 O=C1CNNc2ccccc21 Amb22057606 [0,0,0,1,0,0|2,0,1]=4 3366 B12R2.1081 O=C1CNNc2ccccc21 Amb22494235 [0,0,0,1,0,0|2,0,1]=4 3367 B12R2.1081 O=C1COCc2ccccc21 Amb10067824 [0,0,0,1,0,0|2,0,1]=4 3368 B12R2.1081 O=C1CSCc2ccccc21 Amb2733969 [0,0,0,1,0,0|2,0,1]=4 3369 B12R2.1081 O=C1NNCc2ccccc21 Amb27215032 [0,0,0,1,0,0|2,0,1]=4 3370 B12R2.1081 O=C1NNCc2ccccc21 Amb33482996 [0,0,0,1,0,0|2,0,1]=4 3371 B12R2.1081 OC1CCCc2ccccc21 Amb9702810 [0,0,0,1,0,0|2,0,0]=3 3372 B12R2.1081 OC1CCCc2cccnc21 Amb17935812 [0,0,0,1,0,0|3,0,0]=4 3373 B12R2.1081 OC1CCCc2cccnc21 Amb8397302 [0,0,0,1,0,0|3,0,0]=4 3374 B12R2.1081 OC1CCCc2cnccc21 Amb23399822 [0,0,0,1,0,0|3,0,0]=4 3375 B12R2.1081 OC1CCNc2ccccc21 Amb10553386 [0,0,0,1,0,0|3,0,0]=4 3376 B12R2.1081 OC1CCNc2ccccc21 Amb22276045 [0,0,0,1,0,0|3,0,0]=4 3377 B12R2.1081 OC1CCOc2ccccc21 Amb2719725 [0,0,0,1,0,0|3,0,0]=4 3378 B12R2.1081 OC1CCSc2ccccc21 Amb9748233 [0,0,0,1,0,0|3,0,0]=4 3379 B12R2.1081 OC1CNCc2ccccc21 Amb16233378 [0,0,0,1,0,0|1,0,0]=2 3380 B12R2.1081 OC1CNCc2ccccc21 Amb22587041 [0,0,0,1,0,0|1,0,0]=2 3381 B12R2.1081 OC1CNCc2ncccc21 Amb18201914 [0,0,0,1,0,0|2,0,0]=3 3382 B12R2.1081 OC1CNCc2ncncc21 Amb18201680 [0,0,0,1,0,0|3,0,0]=4 3383 B12R2.1081 OC1COCc2ccccc21 Amb20171360 [0,0,0,1,0,0|2,0,0]=3 3384 B12R2.1081 OC1CSCc2ccccc21 Amb9619601 [0,0,0,1,0,0|2,0,0]=3 3385 B12R2.1081 OC1OCCc2ccccc21 Amb27860258 [0,0,0,1,0,0|3,0,0]=4 3386 B12R2.1081 O[C@@H]1CC=Cc2ccccc21 Amb8384066 [0,0,0,1,0,0|2,0,1]=4 3387 B12R2.1081 O[C@@H]1CCCc2ccccc21 Amb22337827 [0,0,0,1,0,0|2,0,0]=3 3388 B12R2.1081 O[C@@H]1CCCc2cccnc21 Amb24062853 [0,0,0,1,0,0|3,0,0]=4 3389 B12R2.1081 O[C@@H]1CCCc2cnccc21 Amb28065163 [0,0,0,1,0,0|3,0,0]=4 3390 B12R2.1081 O[C@@H]1CCCc2ncccc21 Amb26874431 [0,0,0,1,0,0|3,0,0]=4 3391 B12R2.1081 O[C@@H]1CCOc2ccccc21 Amb561634 [0,0,0,1,0,0|3,0,0]=4 3392 B12R2.1081 O[C@@H]1CCSc2ccccc21 Amb13952924 [0,0,0,1,0,0|3,0,0]=4 3393 B12R2.1081 O[C@@H]1COCc2ccccc21 Amb22748516 [0,0,0,1,0,0|2,0,0]=3 3394 B12R2.1081 O[C@@H]1CSCc2ccccc21 Amb27836959 [0,0,0,1,0,0|2,0,0]=3 3395 B12R2.1081 O[C@H]1C=CCc2ccccc21 Amb28249097 [0,0,0,1,0,0|2,0,1]=4 3396 B12R2.1081 O[C@H]1CC=Cc2ccccc21 Amb27804916 [0,0,0,1,0,0|2,0,1]=4 3397 B12R2.1081 O[C@H]1CCCc2ccccc21 Amb22336192 [0,0,0,1,0,0|2,0,0]=3 3398 B12R2.1081 O[C@H]1CCCc2cccnc21 Amb24083650 [0,0,0,1,0,0|3,0,0]=4 3399 B12R2.1081 O[C@H]1CCCc2cnccc21 Amb32698572 [0,0,0,1,0,0|3,0,0]=4 3400 B12R2.1081 O[C@H]1CCOc2ccccc21 Amb2609035 [0,0,0,1,0,0|3,0,0]=4 3401 B12R2.1081 O[C@H]1CCSc2ccccc21 Amb13952926 [0,0,0,1,0,0|3,0,0]=4 3402 B12R2.1081 O[C@H]1CNCc2ccccc21 Amb24533225 [0,0,0,1,0,0|1,0,0]=2 3403 B12R2.1081 SC1CCCc2ccccc21 Amb9208036 [0,0,0,1,0,0|2,0,0]=3 3404 B12R2.1081 SC1CCCc2cccnc21 Amb32788872 [0,0,0,1,0,0|3,0,0]=4 3405 B12R2.1081 SC1CCCc2cnccc21 Amb32788837 [0,0,0,1,0,0|3,0,0]=4 3406 B12R2.1081 SC1CCCc2ncccc21 Amb32788546 [0,0,0,1,0,0|3,0,0]=4 3407 B12R2.1081 SC1CCNc2ccccc21 Amb26423876 [0,0,0,1,0,0|3,0,0]=4 3408 B12R2.1081 SC1CCOc2ccccc21 Amb9208037 [0,0,0,1,0,0|3,0,0]=4 3409 B12R2.1081 SC1CCSc2ccccc21 Amb9208043 [0,0,0,1,0,0|3,0,0]=4 3410 B12R2.1081 SC1COCc2ccccc21 Amb28349489 [0,0,0,1,0,0|2,0,0]=3 3411 B12R2.1081 SC1CSCc2ccccc21 Amb32788444 [0,0,0,1,0,0|2,0,0]=3 3412 B12R2.1081 [NH3+]C1CCCc2ccccc21 Amb24113843 [0,0,0,1,0,0|2,0,0]=3 3413 B12R2.2028 BrC1CC(Br)c2ccccc21 Amb28136954 [0,0,0,1,0,0|3,0,0]=4 3414 B12R2.2028 CC1=CC(O)c2ccccc21 Amb17778893 [0,0,0,1,0,0|2,0,1]=4 3415 B12R2.2028 CC1C=C(Cl)c2ccccc21 Amb17778911 [0,0,0,1,0,0|2,0,1]=4 3416 B12R2.2028 CC1CC(=O)c2ccccc21 Amb9747864 [0,0,0,1,0,0|2,0,0]=3 3417 B12R2.2028 CC1CC(Cl)c2ccccc21 Amb27413208 [0,0,0,1,0,0|2,0,0]=3 3418 B12R2.2028 CC1CC(N)c2ccccc21 Amb19373084 [0,0,0,1,0,0|2,0,0]=3 3419 B12R2.2028 CC1CC(N)c2ccccc21 Amb6705561 [0,0,0,1,0,0|2,0,0]=3 3420 B12R2.2028 CC1CC(S)c2ccccc21 Amb24465175 [0,0,0,1,0,0|2,0,0]=3 3421 B12R2.2028 CC1CN(C)c2ccccc21 Amb5718018 [0,0,0,1,0,0|0,0,0]=1 3422 B12R2.2028 CC1NC(=O)c2ccccc21 Amb24104648 [0,0,0,1,0,0|3,0,0]=4 3423 B12R2.2028 CC1NC(=S)c2ccccc21 Amb27962483 [0,0,0,1,0,0|3,0,0]=4 3424 B12R2.2028 CC1NC(C)c2ccccc21 Amb20622620 [0,0,0,1,0,0|2,0,0]=3 3425 B12R2.2028 CC1NN(C)c2ccccc21 Amb27222813 [0,0,0,1,0,0|1,0,0]=2 3426 B12R2.2028 CC1OB(O)c2ccccc21 Amb25893330 [0,0,0,1,0,0|3,0,0]=4 3427 B12R2.2028 CN1CC(N)c2ccccc21 Amb26601033 [0,0,0,1,0,0|1,0,0]=2 3428 B12R2.2028 CN1NC(=O)c2ccccc21 Amb22372319 [0,0,0,1,0,0|2,0,1]=4 3429 B12R2.2028 CN1NC(=S)c2ccccc21 Amb26952885 [0,0,0,1,0,0|2,0,1]=4 3430 B12R2.2028 CN1SC(=O)c2ccccc21 Amb19664923 [0,0,0,1,0,0|2,0,1]=4 3431 B12R2.2028 C[C@@H]1CC(=O)c2ccccc21 Amb24467053 [0,0,0,1,0,0|2,0,0]=3 3432 B12R2.2028 C[C@@H]1C[C@@H](O)c2ccccc21 Amb27623223 [0,0,0,1,0,0|2,0,0]=3 3433 B12R2.2028 C[C@@H]1C[C@@H](O)c2ccncc21 Amb25102087 [0,0,0,1,0,0|3,0,0]=4 3434 B12R2.2028 C[C@@H]1N[C@@H](C)c2ccccc21 Amb27788108 [0,0,0,1,0,0|2,0,0]=3 3435 B12R2.2028 C[C@@H]1N[C@@H](C)c2ccccc21 Amb35788409 [0,0,0,1,0,0|2,0,0]=3 3436 B12R2.2028 C[C@@H]1OC(=O)c2ccccc21 Amb25892505 [0,0,0,1,0,0|3,0,0]=4 3437 B12R2.2028 C[C@@H]1OC(O)c2ccccc21 Amb26648832 [0,0,0,1,0,0|3,0,0]=4 3438 B12R2.2028 C[C@H]1CC(=O)c2ccccc21 Amb25768595 [0,0,0,1,0,0|2,0,0]=3 3439 B12R2.2028 C[C@H]1O[C@@H](O)c2ccccc21 Amb28142292 [0,0,0,1,0,0|3,0,0]=4 3440 B12R2.2028 Cc1cn(Br)c2ccccc12 Amb28286948 [0,0,0,1,0,0|1,0,2]=4 3441 B12R2.2028 Cc1cn(C)c2ccccc12 Amb842585 [0,0,0,1,0,0|0,0,2]=3 3442 B12R2.2028 Cc1cn(C)c2ncccc12 Amb13884969 [0,0,0,1,0,0|1,0,2]=4 3443 B12R2.2028 Cc1nn(C)c2ccccc12 Amb22491231 [0,0,0,1,0,0|1,0,1]=3 3444 B12R2.2028 Cc1nn(C)c2cnccc12 Amb22741024 [0,0,0,1,0,0|2,0,1]=4 3445 B12R2.2028 Cc1nn(C)c2ncccc12 Amb9677687 [0,0,0,1,0,0|2,0,1]=4 3446 B12R2.2028 Cc1nn(N)c2ccccc12 Amb27859143 [0,0,0,1,0,0|2,0,1]=4 3447 B12R2.2028 Cn1c[n+](C)c2ccccc21 Amb19895221 [0,0,0,1,0,0|1,0,1]=3 3448 B12R2.2028 Cn1c[n+]([O-])c2ccccc21 Amb10552961 [0,0,0,1,0,0|2,0,1]=4 3449 B12R2.2028 Cn1cc(Br)c2ccccc21 Amb9210485 [0,0,0,1,0,0|1,0,2]=4 3450 B12R2.2028 Cn1cc(Cl)c2ccccc21 Amb28066534 [0,0,0,1,0,0|1,0,2]=4 3451 B12R2.2028 Cn1cc(N)c2ccccc21 Amb18064415 [0,0,0,1,0,0|1,0,2]=4 3452 B12R2.2028 Cn1cc(N)c2ccccc21 Amb33620933 [0,0,0,1,0,0|1,0,2]=4 3453 B12R2.2028 Cn1cc(O)c2ccccc21 Amb24069283 [0,0,0,1,0,0|1,0,2]=4 3454 B12R2.2028 Cn1cc(S)c2ccccc21 Amb25721189 [0,0,0,1,0,0|1,0,2]=4 3455 B12R2.2028 Cn1nc(Br)c2ccccc21 Amb10604243 [0,0,0,1,0,0|2,0,1]=4 3456 B12R2.2028 Cn1nc(I)c2ccccc21 Amb10608014 [0,0,0,1,0,0|2,0,1]=4 3457 B12R2.2028 Cn1nc(N)c2ccccc21 Amb9677805 [0,0,0,1,0,0|2,0,1]=4 3458 B12R2.2028 NC1CC(=O)c2ccccc21 Amb17470381 [0,0,0,1,0,0|3,0,0]=4 3459 B12R2.2028 NC1CC(=O)c2ccccc21 Amb21955324 [0,0,0,1,0,0|3,0,0]=4 3460 B12R2.2028 NC1CC(F)c2ccccc21 Amb24117897 [0,0,0,1,0,0|3,0,0]=4 3461 B12R2.2028 NC1CC(F)c2ccccc21 Amb24361429 [0,0,0,1,0,0|3,0,0]=4 3462 B12R2.2028 NC1CC(O)c2ccccc21 Amb17470387 [0,0,0,1,0,0|3,0,0]=4 3463 B12R2.2028 NC1CC(S)c2ccccc21 Amb32788269 [0,0,0,1,0,0|3,0,0]=4 3464 B12R2.2028 N[C@@H]1CC(=O)c2ccccc21 Amb27655630 [0,0,0,1,0,0|3,0,0]=4 3465 B12R2.2028 N[C@@H]1C[C@@H](N)c2ccccc21 Amb27627309 [0,0,0,1,0,0|3,0,0]=4 3466 B12R2.2028 N[C@@H]1C[C@@H](O)c2ccccc21 Amb25213011 [0,0,0,1,0,0|3,0,0]=4 3467 B12R2.2028 N[C@@H]1C[C@H](O)c2ccccc21 Amb24657326 [0,0,0,1,0,0|3,0,0]=4 3468 B12R2.2028 N[C@H]1C[C@@H](N)c2ccccc21 Amb27468638 [0,0,0,1,0,0|3,0,0]=4 3469 B12R2.2028 N[C@H]1C[C@@H](O)c2ccccc21 Amb27810799 [0,0,0,1,0,0|3,0,0]=4 3470 B12R2.2028 O=C1CC(Br)c2ccccc21 Amb10068269 [0,0,0,1,0,0|3,0,0]=4 3471 B12R2.2028 O=C1CC(Cl)c2ccccc21 Amb26945025 [0,0,0,1,0,0|3,0,0]=4 3472 B12R2.2028 O=C1CC(F)c2ccccc21 Amb26621970 [0,0,0,1,0,0|3,0,0]=4 3473 B12R2.2028 O=C1CC(I)c2ccccc21 Amb28289407 [0,0,0,1,0,0|3,0,0]=4 3474 B12R2.2028 O=C1CC(O)c2ccccc21 Amb27872121 [0,0,0,1,0,0|3,0,0]=4 3475 B12R2.2028 OC1CC(O)c2ccccc21 Amb1110942 [0,0,0,1,0,0|3,0,0]=4 3476 B12R2.2028 O[C@H]1C[C@@H](O)c2ccccc21 Amb17938072 [0,0,0,1,0,0|3,0,0]=4 3477 B12R2.2028 O[C@H]1C[C@H](O)c2ccccc21 Amb10068281 [0,0,0,1,0,0|3,0,0]=4 3478 B12R2.2047 COC1C(=O)c2ccccc21 Amb28201023 [0,0,0,1,0,0|2,0,1]=4 3479 B12R2.2047 CO[C@H]1c2cccnc2[C@H]1Br Amb27798356 [0,0,0,1,0,0|3,0,0]=4 3480 B12R2.2047 C[C@H]1c2ccccc2[C@@H]1CO Amb28435749 [0,0,0,1,0,0|2,0,0]=3 3481 B12R2.2075 Br[C@@H](c1ccccc1)[C@@H]2CO2 Amb27204462 [0,0,0,1,0,0|2,0,0]=3 3482 B12R2.2075 C=C(c1ccccc1)C2CC2 Amb27856321 [0,0,0,1,0,0|1,0,2]=4 3483 B12R2.2075 CC(c1ccccc1)C2CO2 Amb33540219 [0,0,0,1,0,0|1,0,0]=2 3484 B12R2.2075 CC(c1ccccc1)[C@@H]2CO2 Amb33082137 [0,0,0,1,0,0|1,0,0]=2 3485 B12R2.2075 CC(c1ccccc1)[C@H]2CO2 Amb33082136 [0,0,0,1,0,0|1,0,0]=2 3486 B12R2.2075 CN(c1ccccc1)C2CC2 Amb26509274 [0,0,0,1,0,0|2,0,0]=3 3487 B12R2.2075 Cl[C@@H](c1ccccc1)[C@@H]2CO2 Amb27865491 [0,0,0,1,0,0|2,0,0]=3 3488 B12R2.2075 NC(c1ccccc1)C2CC2 Amb2371625 [0,0,0,1,0,0|2,0,0]=3 3489 B12R2.2075 NC(c1ccccc1)C2CC2 Amb482312 [0,0,0,1,0,0|2,0,0]=3 3490 B12R2.2075 NC(c1ccccn1)C2CC2 Amb3788125 [0,0,0,1,0,0|3,0,0]=4 3491 B12R2.2075 NC(c1cccnc1)C2CC2 Amb33535397 [0,0,0,1,0,0|3,0,0]=4 3492 B12R2.2075 NC(c1ccncc1)C2CC2 Amb22497035 [0,0,0,1,0,0|3,0,0]=4 3493 B12R2.2075 N[C@@H](c1ccccc1)C2CC2 Amb22406366 [0,0,0,1,0,0|2,0,0]=3 3494 B12R2.2075 N[C@@H](c1ccccc1)C2CC2 Amb26960416 [0,0,0,1,0,0|2,0,0]=3 3495 B12R2.2075 N[C@H](c1ccccc1)C2CC2 Amb22406367 [0,0,0,1,0,0|2,0,0]=3 3496 B12R2.2075 N[C@H](c1ccccc1)C2CC2 Amb22744981 [0,0,0,1,0,0|2,0,0]=3 3497 B12R2.2075 N[C@H](c1cccnc1)C2CC2 Amb28423502 [0,0,0,1,0,0|3,0,0]=4 3498 B12R2.2075 N[C@H](c1ccncc1)C2CC2 Amb28429801 [0,0,0,1,0,0|3,0,0]=4 3499 B12R2.2075 O=C(c1ccccc1)C2CC2 Amb4115715 [0,0,0,1,0,0|2,0,1]=4 3500 B12R2.2075 OC(c1ccccc1)C2CC2 Amb33534747 [0,0,0,1,0,0|2,0,0]=3 3501 B12R2.2075 OC(c1ccccc1)C2CO2 Amb27210172 [0,0,0,1,0,0|2,0,0]=3 3502 B12R2.2075 OC(c1ccccn1)C2CC2 Amb27982276 [0,0,0,1,0,0|3,0,0]=4 3503 B12R2.2075 OC(c1ccccn1)C2CC2 Amb32666125 [0,0,0,1,0,0|3,0,0]=4 3504 B12R2.2075 OC(c1cccnc1)C2CC2 Amb22497231 [0,0,0,1,0,0|3,0,0]=4 3505 B12R2.2075 O[C@@H](c1ccccc1)C2CO2 Amb27839920 [0,0,0,1,0,0|2,0,0]=3 3506 B12R2.2075 O[C@@H](c1ccccn1)C2CC2 Amb32882520 [0,0,0,1,0,0|3,0,0]=4 3507 B12R2.2075 O[C@H](c1ccccc1)C2CC2 Amb27955379 [0,0,0,1,0,0|2,0,0]=3 3508 B12R2.2075 O[C@H](c1ccccc1)C2CO2 Amb27593359 [0,0,0,1,0,0|2,0,0]=3 3509 B12R2.2075 O[C@H](c1ccccc1)[C@@H]2CO2 Amb27448761 [0,0,0,1,0,0|2,0,0]=3 3510 B12R2.2075 O[C@H](c1ccccn1)C2CC2 Amb32882519 [0,0,0,1,0,0|3,0,0]=4 3511 B12R2.2075 SC(c1ccccc1)C2CC2 Amb33537940 [0,0,0,1,0,0|2,0,0]=3 3512 B10R1.11 CC(CC=O)c1ccco1 Amb17593491 [0,0,0,0,1,0|3,0,0]=4 3513 B10R1.11 CC(CCBr)c1cccs1 Amb17243542 [0,0,0,0,1,0|3,0,0]=4 3514 B10R1.11 CC(CCCl)c1cccs1 Amb17233057 [0,0,0,0,1,0|3,0,0]=4 3515 B10R1.11 CC(CCN)c1ccco1 Amb17226683 [0,0,0,0,1,0|3,0,0]=4 3516 B10R1.11 CC(CCN)c1cccs1 Amb5739005 [0,0,0,0,1,0|3,0,0]=4 3517 B10R1.11 CC(CCN)c1ccoc1 Amb27837761 [0,0,0,0,1,0|3,0,0]=4 3518 B10R1.11 CC(CCN)c1ccsc1 Amb28049507 [0,0,0,0,1,0|3,0,0]=4 3519 B10R1.11 CC(CCO)c1ccco1 Amb27604308 [0,0,0,0,1,0|3,0,0]=4 3520 B10R1.11 CC(CCO)c1cccs1 Amb17232175 [0,0,0,0,1,0|3,0,0]=4 3521 B10R1.11 CC(CCO)c1ccsc1 Amb25676863 [0,0,0,0,1,0|3,0,0]=4 3522 B10R1.11 CC(CON)c1ccco1 Amb33360962 [0,0,0,0,1,0|3,0,0]=4 3523 B10R1.11 CC(CON)c1cccs1 Amb33360889 [0,0,0,0,1,0|3,0,0]=4 3524 B10R1.11 CC(CON)c1ccoc1 Amb33360616 [0,0,0,0,1,0|3,0,0]=4 3525 B10R1.11 CC(CON)c1ccsc1 Amb33225360 [0,0,0,0,1,0|3,0,0]=4 3526 B10R1.11 CCCC(C)c1cnco1 Amb35652252 [0,0,0,0,1,0|3,0,0]=4 3527 B10R1.11 CCCC(C)n1ccnc1 Amb27205427 [0,0,0,0,1,0|3,0,0]=4 3528 B10R1.11 CCCC(Cl)c1ccco1 Amb17138479 [0,0,0,0,1,0|3,0,0]=4 3529 B10R1.11 CCCC(Cl)c1cccs1 Amb17138753 [0,0,0,0,1,0|3,0,0]=4 3530 B10R1.11 CCCC(N)c1ccco1 Amb18991109 [0,0,0,0,1,0|3,0,0]=4 3531 B10R1.11 CCCC(N)c1ccco1 Amb35745825 [0,0,0,0,1,0|3,0,0]=4 3532 B10R1.11 CCCC(N)c1cccs1 Amb17622125 [0,0,0,0,1,0|3,0,0]=4 3533 B10R1.11 CCCC(N)c1cccs1 Amb5380417 [0,0,0,0,1,0|3,0,0]=4 3534 B10R1.11 CCCC(N)c1ccoc1 Amb18832008 [0,0,0,0,1,0|3,0,0]=4 3535 B10R1.11 CCCC(N)c1ccsc1 Amb18294779 [0,0,0,0,1,0|3,0,0]=4 3536 B10R1.11 CCCC(N)c1ccsc1 Amb35745772 [0,0,0,0,1,0|3,0,0]=4 3537 B10R1.11 CCCC(O)c1ccco1 Amb4139715 [0,0,0,0,1,0|3,0,0]=4 3538 B10R1.11 CCCC(O)c1cccs1 Amb4314141 [0,0,0,0,1,0|3,0,0]=4 3539 B10R1.11 CCC[C@@H](N)c1ccsc1 Amb28057709 [0,0,0,0,1,0|3,0,0]=4 3540 B10R1.11 CCNC(C)c1ccco1 Amb6276681 [0,0,0,0,1,0|3,0,0]=4 3541 B10R1.11 CCNC(C)c1ccsc1 Amb18984963 [0,0,0,0,1,0|3,0,0]=4 3542 B10R1.11 CNCC(=O)c1ccco1 Amb21862170 [0,0,0,0,1,0|2,0,1]=4 3543 B10R1.11 CNCC(=O)c1cccs1 Amb17232156 [0,0,0,0,1,0|2,0,1]=4 3544 B10R1.11 CNCC(=O)c1ccoc1 Amb25369027 [0,0,0,0,1,0|2,0,1]=4 3545 B10R1.11 CNCC(=O)c1ccsc1 Amb24461147 [0,0,0,0,1,0|2,0,1]=4 3546 B10R1.11 CNCC(C)c1cccs1 Amb17232163 [0,0,0,0,1,0|1,0,0]=2 3547 B10R1.11 CNCC(C)c1ccno1 Amb27782130 [0,0,0,0,1,0|2,0,0]=3 3548 B10R1.11 CNCC(C)c1cnco1 Amb33295060 [0,0,0,0,1,0|2,0,0]=3 3549 B10R1.11 CNCC(C)c1nccs1 Amb17232178 [0,0,0,0,1,0|2,0,0]=3 3550 B10R1.11 CNCC(C)n1cccn1 Amb18992877 [0,0,0,0,1,0|2,0,0]=3 3551 B10R1.11 CNCC(O)c1ccco1 Amb5750893 [0,0,0,0,1,0|2,0,0]=3 3552 B10R1.11 CNCC(O)c1cccs1 Amb5750894 [0,0,0,0,1,0|2,0,0]=3 3553 B10R1.11 CNCC(O)c1ccoc1 Amb27870982 [0,0,0,0,1,0|2,0,0]=3 3554 B10R1.11 CNCC(O)c1ccon1 Amb33198787 [0,0,0,0,1,0|3,0,0]=4 3555 B10R1.11 CNCC(O)c1ccsc1 Amb18997460 [0,0,0,0,1,0|2,0,0]=3 3556 B10R1.11 CNCC(O)c1cnco1 Amb33415280 [0,0,0,0,1,0|3,0,0]=4 3557 B10R1.11 CNCC(O)c1cncs1 Amb24478439 [0,0,0,0,1,0|3,0,0]=4 3558 B10R1.11 CNCC(O)c1cnsc1 Amb35711426 [0,0,0,0,1,0|3,0,0]=4 3559 B10R1.11 CNCC(O)c1cscn1 Amb24371861 [0,0,0,0,1,0|3,0,0]=4 3560 B10R1.11 CNCC(O)c1nccs1 Amb24334731 [0,0,0,0,1,0|3,0,0]=4 3561 B10R1.11 CNC[C@@H](O)c1ccco1 Amb26968688 [0,0,0,0,1,0|2,0,0]=3 3562 B10R1.11 CNC[C@@H](O)c1cccs1 Amb27228422 [0,0,0,0,1,0|2,0,0]=3 3563 B10R1.11 CNC[C@@H](O)c1nccs1 Amb27955862 [0,0,0,0,1,0|3,0,0]=4 3564 B10R1.11 COCC(C)n1cccc1 Amb402236 [0,0,0,0,1,0|2,0,0]=3 3565 B10R1.11 COCC(N)c1ccco1 Amb1126956 [0,0,0,0,1,0|3,0,0]=4 3566 B10R1.11 COCC(N)c1ccoc1 Amb28193266 [0,0,0,0,1,0|3,0,0]=4 3567 B10R1.11 COCC(O)c1cccs1 Amb18791923 [0,0,0,0,1,0|3,0,0]=4 3568 B10R1.11 COCC(O)c1ccoc1 Amb27639195 [0,0,0,0,1,0|3,0,0]=4 3569 B10R1.11 COC[C@@H](N)c1cccs1 Amb27215862 [0,0,0,0,1,0|3,0,0]=4 3570 B10R1.11 COC[C@@H](N)c1ccsc1 Amb27469632 [0,0,0,0,1,0|3,0,0]=4 3571 B10R1.11 COC[C@H](N)c1ccco1 Amb28250819 [0,0,0,0,1,0|3,0,0]=4 3572 B10R1.11 COC[C@H](N)c1cccs1 Amb27618431 [0,0,0,0,1,0|3,0,0]=4 3573 B10R1.11 COC[C@H](N)c1ccsc1 Amb27640281 [0,0,0,0,1,0|3,0,0]=4 3574 B10R1.11 CONC(C)c1ccco1 Amb27425113 [0,0,0,0,1,0|3,0,0]=4 3575 B10R1.11 CONC(C)c1cccs1 Amb27859951 [0,0,0,0,1,0|3,0,0]=4 3576 B10R1.11 CSCC(Cl)c1ccco1 Amb27847565 [0,0,0,0,1,0|3,0,0]=4 3577 B10R1.11 CSCC(Cl)c1cccs1 Amb25337589 [0,0,0,0,1,0|3,0,0]=4 3578 B10R1.11 CSCC(N)c1ccco1 Amb24502407 [0,0,0,0,1,0|3,0,0]=4 3579 B10R1.11 CSCC(N)c1cccs1 Amb18300357 [0,0,0,0,1,0|3,0,0]=4 3580 B10R1.11 CSCC(N)c1ccsc1 Amb27244963 [0,0,0,0,1,0|3,0,0]=4 3581 B10R1.11 CSCC(O)c1ccco1 Amb25703539 [0,0,0,0,1,0|3,0,0]=4 3582 B10R1.11 CSCC(O)c1cccs1 Amb18183876 [0,0,0,0,1,0|3,0,0]=4 3583 B10R1.11 CSCC(O)c1ccoc1 Amb27234597 [0,0,0,0,1,0|3,0,0]=4 3584 B10R1.11 C[C@H](CC=O)c1ccsc1 Amb28199920 [0,0,0,0,1,0|3,0,0]=4 3585 B10R1.11 NNCC(O)c1ccco1 Amb17231941 [0,0,0,0,1,0|3,0,0]=4 3586 B10R1.11 NNCC(O)c1cccs1 Amb17232256 [0,0,0,0,1,0|3,0,0]=4 3587 B10R1.11 ONCC(O)c1ccco1 Amb17334210 [0,0,0,0,1,0|3,0,0]=4 3588 B10R1.11 ONCC(O)c1cccs1 Amb17334462 [0,0,0,0,1,0|3,0,0]=4 3589 B12R1.32 C#CCC(N)Cc1ccccc1 Amb18296094 [0,0,0,0,0,1|2,0,1]=4 3590 B12R1.32 C#CCC(N)Cc1ccccc1 Amb32652619 [0,0,0,0,0,1|2,0,1]=4 3591 B12R1.32 C#CCC(O)Cc1ccccc1 Amb18800362 [0,0,0,0,0,1|2,0,1]=4 3592 B12R1.32 C#CCN(C)Cc1ccccc1 Amb3940470 [0,0,0,0,0,1|2,0,1]=4 3593 B12R1.32 C#CCN(C)Cc1ccccc1 Amb8390240 [0,0,0,0,0,1|2,0,1]=4 3594 B12R1.32 C#CC\C(C)=C\c1ccccc1 Amb33476744 [0,0,0,0,0,1|1,0,2]=4 3595 B12R1.32 C=CCC(C)Nc1ccccc1 Amb27794468 [0,0,0,0,0,1|1,0,1]=3 3596 B12R1.32 C=CCC(C)Nc1ccccn1 Amb10554010 [0,0,0,0,0,1|2,0,1]=4 3597 B12R1.32 C=CCC(N)Cc1ccccc1 Amb32663713 [0,0,0,0,0,1|2,0,1]=4 3598 B12R1.32 C=CCC(N)Cc1ccccc1 Amb33538411 [0,0,0,0,0,1|2,0,1]=4 3599 B12R1.32 C=CCC(O)Cc1ccccc1 Amb18177786 [0,0,0,0,0,1|2,0,1]=4 3600 B12R1.32 C=CCN(C)Cc1ccccc1 Amb6360694 [0,0,0,0,0,1|2,0,1]=4 3601 B12R1.32 CC#CC(C)Oc1ccccc1 Amb25964142 [0,0,0,0,0,1|1,0,1]=3 3602 B12R1.32 CC#CC(Cl)Cc1ccccc1 Amb27232835 [0,0,0,0,0,1|2,0,1]=4 3603 B12R1.32 CC#CC(O)Cc1ccccc1 Amb4034860 [0,0,0,0,0,1|2,0,1]=4 3604 B12R1.32 CC(CC#N)Nc1ccccc1 Amb17138511 [0,0,0,0,0,1|2,0,0]=3 3605 B12R1.32 CC(CC#N)Oc1ccccc1 Amb17232369 [0,0,0,0,0,1|2,0,0]=3 3606 B12R1.32 CC(CC#N)Sc1ccccn1 Amb18180844 [0,0,0,0,0,1|3,0,0]=4 3607 B12R1.32 CC(CCCl)Nc1ccccn1 Amb27254697 [0,0,0,0,0,1|3,0,0]=4 3608 B12R1.32 CC(CCN)Cc1ccccc1 Amb17232439 [0,0,0,0,0,1|2,0,0]=3 3609 B12R1.32 CC(CCN)Oc1ccccc1 Amb17232556 [0,0,0,0,0,1|2,0,0]=3 3610 B12R1.32 CC(CCO)Cc1ccccc1 Amb17232486 [0,0,0,0,0,1|2,0,0]=3 3611 B12R1.32 CC(CCO)Nc1ccccn1 Amb27433290 [0,0,0,0,0,1|3,0,0]=4 3612 B12R1.32 CC(CCO)Oc1ccccc1 Amb17232598 [0,0,0,0,0,1|2,0,0]=3 3613 B12R1.32 CC(CNN)Oc1ccccc1 Amb18563756 [0,0,0,0,0,1|1,0,0]=2 3614 B12R1.32 CC(CON)Cc1ccccc1 Amb32953166 [0,0,0,0,0,1|2,0,0]=3 3615 B12R1.32 CC(Cc1ccccc1)N=C=O Amb17103991 [0,0,0,0,0,1|3,0,0]=4 3616 B12R1.32 CC(Cc1ccccc1)N=C=S Amb18790890 [0,0,0,0,0,1|3,0,0]=4 3617 B12R1.32 CC(Cc1ccccc1)NC=O Amb8503525 [0,0,0,0,0,1|3,0,0]=4 3618 B12R1.32 CCCC(=O)Cc1ccccc1 Amb3940679 [0,0,0,0,0,1|2,0,1]=4 3619 B12R1.32 CCCC(=O)Nc1ccccc1 Amb5794989 [0,0,0,0,0,1|2,0,1]=4 3620 B12R1.32 CCCC(=O)Oc1ccccc1 Amb3103918 [0,0,0,0,0,1|2,0,1]=4 3621 B12R1.32 CCCC(C)Nc1ccccc1 Amb6685188 [0,0,0,0,0,1|1,0,0]=2 3622 B12R1.32 CCCC(C)Nc1ncccn1 Amb6648747 [0,0,0,0,0,1|3,0,0]=4 3623 B12R1.32 CCCC(N)Cc1ccccc1 Amb18180073 [0,0,0,0,0,1|2,0,0]=3 3624 B12R1.32 CCC\C(I)=C/c1ccccc1 Amb22546627 [0,0,0,0,0,1|2,0,1]=4 3625 B12R1.32 CCNC(C)Cc1ccccc1 Amb18552940 [0,0,0,0,0,1|2,0,0]=3 3626 B12R1.32 CCNC(C)Cc1ccccn1 Amb1995151 [0,0,0,0,0,1|3,0,0]=4 3627 B12R1.32 CCO\C(C)=N\c1ccccc1 Amb17939699 [0,0,0,0,0,1|2,0,1]=4 3628 B12R1.32 CN(CC#N)Cc1ccccc1 Amb5781387 [0,0,0,0,0,1|3,0,0]=4 3629 B12R1.32 CN(CC=O)Cc1ccccc1 Amb18800711 [0,0,0,0,0,1|3,0,0]=4 3630 B12R1.32 CN(CCBr)Cc1ccccc1 Amb24357900 [0,0,0,0,0,1|3,0,0]=4 3631 B12R1.32 CN(CCBr)Cc1ccccc1 Amb32882453 [0,0,0,0,0,1|3,0,0]=4 3632 B12R1.32 CN(CCCl)Cc1ccccc1 Amb19895292 [0,0,0,0,0,1|3,0,0]=4 3633 B12R1.32 CN(CCCl)Cc1ccccc1 Amb3940690 [0,0,0,0,0,1|3,0,0]=4 3634 B12R1.32 CN(CCN)Cc1ccccc1 Amb5357836 [0,0,0,0,0,1|3,0,0]=4 3635 B12R1.32 CN(CCO)Cc1ccccc1 Amb3938987 [0,0,0,0,0,1|3,0,0]=4 3636 B12R1.32 CN(CCS)Cc1ccccc1 Amb13881720 [0,0,0,0,0,1|3,0,0]=4 3637 B12R1.32 CNCC(=O)Cc1ccccc1 Amb32954289 [0,0,0,0,0,1|1,0,1]=3 3638 B12R1.32 CNCC(=O)Cc1ccccc1 Amb8628392 [0,0,0,0,0,1|1,0,1]=3 3639 B12R1.32 CNCC(=O)Nc1ccccc1 Amb6246115 [0,0,0,0,0,1|1,0,1]=3 3640 B12R1.32 CNCC(=O)Nc1ccccc1 Amb6893116 [0,0,0,0,0,1|1,0,1]=3 3641 B12R1.32 CNCC(=O)Nc1cccnc1 Amb15740831 [0,0,0,0,0,1|2,0,1]=4 3642 B12R1.32 CNCC(=O)Nc1cccnc1 Amb6263744 [0,0,0,0,0,1|2,0,1]=4 3643 B12R1.32 CNCC(C)Cc1ccccc1 Amb19023878 [0,0,0,0,0,1|0,0,0]=1 3644 B12R1.32 CNCC(C)Nc1ccccc1 Amb27955315 [0,0,0,0,0,1|0,0,0]=1 3645 B12R1.32 CNCC(N)Cc1ccccc1 Amb19009730 [0,0,0,0,0,1|1,0,0]=2 3646 B12R1.32 CNCC(N)Cc1ccnnc1 Amb33230895 [0,0,0,0,0,1|3,0,0]=4 3647 B12R1.32 CNCC(O)Cc1ccccc1 Amb17193901 [0,0,0,0,0,1|1,0,0]=2 3648 B12R1.32 CNCC(O)Cc1ccccc1 Amb32661172 [0,0,0,0,0,1|1,0,0]=2 3649 B12R1.32 CNCC(O)Cc1cccnc1 Amb17232605 [0,0,0,0,0,1|2,0,0]=3 3650 B12R1.32 CNC\C(C)=C\c1ccccc1 Amb17100030 [0,0,0,0,0,1|0,0,1]=2 3651 B12R1.32 CNC\C(C)=C\c1cccnc1 Amb28042037 [0,0,0,0,0,1|1,0,1]=3 3652 B12R1.32 CNC\C(C)=C\c1cnccn1 Amb35602992 [0,0,0,0,0,1|2,0,1]=4 3653 B12R1.32 CNNC(=O)Nc1ccccc1 Amb28252417 [0,0,0,0,0,1|2,0,1]=4 3654 B12R1.32 COCC(=O)Cc1ccccc1 Amb9665963 [0,0,0,0,0,1|2,0,1]=4 3655 B12R1.32 COCC(=O)Nc1ccccc1 Amb3115714 [0,0,0,0,0,1|2,0,1]=4 3656 B12R1.32 COCC(C)Nc1ccccc1 Amb19024307 [0,0,0,0,0,1|1,0,0]=2 3657 B12R1.32 COCC(C)Nc1cccnc1 Amb19024143 [0,0,0,0,0,1|2,0,0]=3 3658 B12R1.32 COCC(C)Nc1ccncc1 Amb6614428 [0,0,0,0,0,1|2,0,0]=3 3659 B12R1.32 COCC(C)Nc1ccncn1 Amb19011498 [0,0,0,0,0,1|3,0,0]=4 3660 B12R1.32 COCC(C)Nc1cncnc1 Amb27587684 [0,0,0,0,0,1|3,0,0]=4 3661 B12R1.32 COCC(N)Cc1ccccc1 Amb20623561 [0,0,0,0,0,1|2,0,0]=3 3662 B12R1.32 COC[C@@H](C)Nc1ccccn1 Amb28398735 [0,0,0,0,0,1|2,0,0]=3 3663 B12R1.32 COC[C@@H](C)Nc1cccnn1 Amb28398736 [0,0,0,0,0,1|3,0,0]=4 3664 B12R1.32 COC[C@@H](N)Cc1ccccc1 Amb3940159 [0,0,0,0,0,1|2,0,0]=3 3665 B12R1.32 COC[C@@H](N)Cc1ccccc1 Amb4037107 [0,0,0,0,0,1|2,0,0]=3 3666 B12R1.32 COC[C@H](N)Cc1ccccc1 Amb33871543 [0,0,0,0,0,1|2,0,0]=3 3667 B12R1.32 CONC(C)Cc1ccccc1 Amb28984063 [0,0,0,0,0,1|2,0,0]=3 3668 B12R1.32 CSCC(=O)Cc1ccccc1 Amb18796330 [0,0,0,0,0,1|2,0,1]=4 3669 B12R1.32 CSCC(=O)Nc1ccccc1 Amb2373904 [0,0,0,0,0,1|2,0,1]=4 3670 B12R1.32 CSCC(C)Nc1ncccn1 Amb27441586 [0,0,0,0,0,1|3,0,0]=4 3671 B12R1.32 C[C@H](Cc1ccccc1)NC=S Amb27209575 [0,0,0,0,0,1|3,0,0]=4 3672 B12R1.32 C\C(=C/c1ccccc1)CC#N Amb33476434 [0,0,0,0,0,1|2,0,1]=4 3673 B12R1.32 C\C(=C/c1ccccc1)CC=O Amb32952974 [0,0,0,0,0,1|2,0,1]=4 3674 B12R1.32 C\C(=C/c1ccccc1)CCBr Amb18063581 [0,0,0,0,0,1|2,0,1]=4 3675 B12R1.32 C\C(=C/c1ccccc1)CCN Amb18063553 [0,0,0,0,0,1|2,0,1]=4 3676 B12R1.32 C\C(=C/c1ccccc1)CCO Amb27792195 [0,0,0,0,0,1|2,0,1]=4 3677 B12R1.32 C\C(=C/c1ccccc1)CCS Amb33381247 [0,0,0,0,0,1|2,0,1]=4 3678 B12R1.32 C\C(=C/c1ccccc1)CNN Amb27769440 [0,0,0,0,0,1|1,0,1]=3 3679 B12R1.32 C\C(=C/c1ccccc1)CNO Amb33506732 [0,0,0,0,0,1|1,0,1]=3 3680 B12R1.32 C\C(=C/c1ccccc1)CON Amb33476431 [0,0,0,0,0,1|2,0,1]=4 3681 B12R1.32 C\C(=C\c1ccccc1)CCBr Amb27445443 [0,0,0,0,0,1|2,0,1]=4 3682 B12R1.32 C\C(=C\c1ccccc1)CCN Amb27843446 [0,0,0,0,0,1|2,0,1]=4 3683 B12R1.32 C\C=C\C(C)Nc1ccccc1 Amb28245278 [0,0,0,0,0,1|1,0,1]=3 3684 B12R1.32 C\C=C\C(O)Cc1ccccc1 Amb27641998 [0,0,0,0,0,1|2,0,1]=4 3685 B12R1.32 N#CCC(O)Cc1ccccc1 Amb17232368 [0,0,0,0,0,1|3,0,0]=4 3686 B12R1.32 N#CC[C@@H](N)Cc1ccccc1 Amb27251534 [0,0,0,0,0,1|3,0,0]=4 3687 B12R1.32 NC(CCO)Cc1ccccc1 Amb28872403 [0,0,0,0,0,1|3,0,0]=4 3688 B12R1.32 NC(CCO)Cc1ccccc1 Amb8392175 [0,0,0,0,0,1|3,0,0]=4 3689 B12R1.32 NCCC(F)Cc1ccccc1 Amb32954290 [0,0,0,0,0,1|3,0,0]=4 3690 B12R1.32 NCCC(N)Cc1ccccc1 Amb33039576 [0,0,0,0,0,1|3,0,0]=4 3691 B12R1.32 NCCC(O)Cc1ccccc1 Amb17232552 [0,0,0,0,0,1|3,0,0]=4 3692 B12R1.32 NCC[C@@H](O)Cc1ccccc1 Amb32953160 [0,0,0,0,0,1|3,0,0]=4 3693 B12R1.32 NCC[C@H](O)Cc1ccccc1 Amb32953161 [0,0,0,0,0,1|3,0,0]=4 3694 B12R1.32 NNCC(=O)Nc1ccccc1 Amb26632802 [0,0,0,0,0,1|2,0,1]=4 3695 B12R1.32 [C-]#[N+]CC(C)Oc1ccccc1 Amb28251447 [0,0,0,0,0,1|0,0,2]=3 3696 B12R1.32 [C-]#[N+]C\C(C)=C\c1ccccc1 Amb33476725 [0,0,0,0,0,1|0,0,3]=4 3697 B9R0.46 CCC(C)\C=C\C=C/C=O Amb18643327 [1,0,1,0,0,0|1,0,0]=3 3698 B9R0.46 CCC(C)\C=C\C=C\C=O Amb27754102 [1,0,1,0,0,0|1,0,0]=3 3699 B9R0.46 CC[C@@H](C)\C=C\C=C\CO Amb27588775 [1,0,1,0,0,0|1,0,1]=4 3700 B9R0.46 CC[C@H](C)\C=C\C=C\C=O Amb27393613 [1,0,1,0,0,0|1,0,0]=3 3701 B9R0.12 C=C=C(CC=C)C(C)CN Amb27222342 [1,0,1,0,0,0|0,0,2]=4 3702 B9R1.6 BrC(Br)c1ccccc1 Amb8513496 [2,0,0,0,0,0|2,0,0]=4 3703 B9R1.6 C=C(C)c1ccccc1 Amb8394996 [2,0,0,0,0,0|0,0,2]=4 3704 B9R1.6 CC(=O)c1ccccc1 Amb2792761 [2,0,0,0,0,0|1,0,1]=4 3705 B9R1.6 CC(Br)c1ccccc1 Amb5716854 [2,0,0,0,0,0|1,0,0]=3 3706 B9R1.6 CC(Br)c1ccccn1 Amb6770323 [2,0,0,0,0,0|2,0,0]=4 3707 B9R1.6 CC(Br)c1ccccn1 Amb8835436 [2,0,0,0,0,0|2,0,0]=4 3708 B9R1.6 CC(Br)c1cccnc1 Amb33552368 [2,0,0,0,0,0|2,0,0]=4 3709 B9R1.6 CC(Br)c1cccnc1 Amb8835401 [2,0,0,0,0,0|2,0,0]=4 3710 B9R1.6 CC(Br)c1ccncc1 Amb10610143 [2,0,0,0,0,0|2,0,0]=4 3711 B9R1.6 CC(Br)c1ccncc1 Amb9210657 [2,0,0,0,0,0|2,0,0]=4 3712 B9R1.6 CC(C)c1ccccc1 Amb2793016 [2,0,0,0,0,0|0,0,0]=2 3713 B9R1.6 CC(C)c1ccccc1 Amb33524021 [2,0,0,0,0,0|0,0,0]=2 3714 B9R1.6 CC(C)c1ccccn1 Amb8438962 [2,0,0,0,0,0|1,0,0]=3 3715 B9R1.6 CC(C)c1cccnc1 Amb24320774 [2,0,0,0,0,0|1,0,0]=3 3716 B9R1.6 CC(C)c1cccnn1 Amb26572070 [2,0,0,0,0,0|2,0,0]=4 3717 B9R1.6 CC(C)c1ccncc1 Amb2694187 [2,0,0,0,0,0|1,0,0]=3 3718 B9R1.6 CC(C)c1ccncn1 Amb24070425 [2,0,0,0,0,0|2,0,0]=4 3719 B9R1.6 CC(Cl)c1ccccc1 Amb5716855 [2,0,0,0,0,0|1,0,0]=3 3720 B9R1.6 CC(Cl)c1ccccn1 Amb10610197 [2,0,0,0,0,0|2,0,0]=4 3721 B9R1.6 CC(Cl)c1ccccn1 Amb9205056 [2,0,0,0,0,0|2,0,0]=4 3722 B9R1.6 CC(Cl)c1cccnc1 Amb13952205 [2,0,0,0,0,0|2,0,0]=4 3723 B9R1.6 CC(Cl)c1cccnc1 Amb9205037 [2,0,0,0,0,0|2,0,0]=4 3724 B9R1.6 CC(Cl)c1ccncc1 Amb19514972 [2,0,0,0,0,0|2,0,0]=4 3725 B9R1.6 CC(Cl)c1ccncc1 Amb9205038 [2,0,0,0,0,0|2,0,0]=4 3726 B9R1.6 CC(N)c1ccccc1 Amb5716844 [2,0,0,0,0,0|0,0,0]=2 3727 B9R1.6 CC(N)c1ccccn1 Amb1102610 [2,0,0,0,0,0|1,0,0]=3 3728 B9R1.6 CC(N)c1ccccn1 Amb22265614 [2,0,0,0,0,0|1,0,0]=3 3729 B9R1.6 CC(N)c1ccccn1 Amb24064899 [2,0,0,0,0,0|1,0,0]=3 3730 B9R1.6 CC(N)c1ccccn1 Amb31206895 [2,0,0,0,0,0|1,0,0]=3 3731 B9R1.6 CC(N)c1cccnc1 Amb1214297 [2,0,0,0,0,0|1,0,0]=3 3732 B9R1.6 CC(N)c1cccnc1 Amb22754521 [2,0,0,0,0,0|1,0,0]=3 3733 B9R1.6 CC(N)c1ccncc1 Amb19958395 [2,0,0,0,0,0|1,0,0]=3 3734 B9R1.6 CC(N)c1ccncc1 Amb32662788 [2,0,0,0,0,0|1,0,0]=3 3735 B9R1.6 CC(N)c1ccncc1 Amb9745700 [2,0,0,0,0,0|1,0,0]=3 3736 B9R1.6 CC(N)c1ccncn1 Amb10608543 [2,0,0,0,0,0|2,0,0]=4 3737 B9R1.6 CC(N)c1ccncn1 Amb22587681 [2,0,0,0,0,0|2,0,0]=4 3738 B9R1.6 CC(N)c1ccnnc1 Amb21964416 [2,0,0,0,0,0|2,0,0]=4 3739 B9R1.6 CC(N)c1ccnnc1 Amb22757188 [2,0,0,0,0,0|2,0,0]=4 3740 B9R1.6 CC(N)c1cnccn1 Amb18278310 [2,0,0,0,0,0|2,0,0]=4 3741 B9R1.6 CC(N)c1cnccn1 Amb32752562 [2,0,0,0,0,0|2,0,0]=4 3742 B9R1.6 CC(N)c1cncnc1 Amb8010526 [2,0,0,0,0,0|2,0,0]=4 3743 B9R1.6 CC(N)c1ncccn1 Amb22757229 [2,0,0,0,0,0|2,0,0]=4 3744 B9R1.6 CC(N)c1ncccn1 Amb30585152 [2,0,0,0,0,0|2,0,0]=4 3745 B9R1.6 CC(N)c1ncccn1 Amb8010520 [2,0,0,0,0,0|2,0,0]=4 3746 B9R1.6 CC(O)c1ccccc1 Amb3940114 [2,0,0,0,0,0|1,0,0]=3 3747 B9R1.6 CC(O)c1ccccn1 Amb32666055 [2,0,0,0,0,0|2,0,0]=4 3748 B9R1.6 CC(O)c1ccccn1 Amb9748230 [2,0,0,0,0,0|2,0,0]=4 3749 B9R1.6 CC(O)c1cccnc1 Amb9748268 [2,0,0,0,0,0|2,0,0]=4 3750 B9R1.6 CC(O)c1ccncc1 Amb6705768 [2,0,0,0,0,0|2,0,0]=4 3751 B9R1.6 CC(S)c1ccccc1 Amb6256013 [2,0,0,0,0,0|1,0,0]=3 3752 B9R1.6 CC(S)c1ccccn1 Amb9208044 [2,0,0,0,0,0|2,0,0]=4 3753 B9R1.6 CC(S)c1cccnc1 Amb9208030 [2,0,0,0,0,0|2,0,0]=4 3754 B9R1.6 CC(S)c1ccncc1 Amb9208031 [2,0,0,0,0,0|2,0,0]=4 3755 B9R1.6 CN(C)c1ccccc1 Amb2793014 [2,0,0,0,0,0|1,0,0]=3 3756 B9R1.6 CN(C)c1ccccn1 Amb9825822 [2,0,0,0,0,0|2,0,0]=4 3757 B9R1.6 CN(C)c1cccnc1 Amb2622130 [2,0,0,0,0,0|2,0,0]=4 3758 B9R1.6 CN(C)c1ccncc1 Amb2613773 [2,0,0,0,0,0|2,0,0]=4 3759 B9R1.6 CN(N)c1ccccc1 Amb1153615 [2,0,0,0,0,0|1,0,0]=3 3760 B9R1.6 CN(N)c1ccccc1 Amb22754142 [2,0,0,0,0,0|1,0,0]=3 3761 B9R1.6 CN(N)c1ccccc1 Amb33172726 [2,0,0,0,0,0|1,0,0]=3 3762 B9R1.6 CN(N)c1ccccc1 Amb9677307 [2,0,0,0,0,0|1,0,0]=3 3763 B9R1.6 CN(N)c1ccccn1 Amb18642128 [2,0,0,0,0,0|2,0,0]=4 3764 B9R1.6 CN(N)c1cccnc1 Amb24085137 [2,0,0,0,0,0|2,0,0]=4 3765 B9R1.6 CN(N)c1ccncc1 Amb26494358 [2,0,0,0,0,0|2,0,0]=4 3766 B9R1.6 CN(O)c1ccccc1 Amb28245898 [2,0,0,0,0,0|2,0,0]=4 3767 B9R1.6 CP(C)c1ccncc1 Amb35750173 [2,0,0,0,0,0|2,0,0]=4 3768 B9R1.6 CP(Cl)c1ccccc1 Amb25837553 [2,0,0,0,0,0|2,0,0]=4 3769 B9R1.6 CS(=O)c1ccccc1 Amb8516154 [2,0,0,0,0,0|2,0,0]=4 3770 B9R1.6 C[C@@H](Br)c1ccccc1 Amb25055693 [2,0,0,0,0,0|1,0,0]=3 3771 B9R1.6 C[C@@H](N)c1ccccc1 Amb22168000 [2,0,0,0,0,0|0,0,0]=2 3772 B9R1.6 C[C@@H](N)c1ccccc1 Amb3940166 [2,0,0,0,0,0|0,0,0]=2 3773 B9R1.6 C[C@@H](N)c1ccccn1 Amb19514583 [2,0,0,0,0,0|1,0,0]=3 3774 B9R1.6 C[C@@H](N)c1ccccn1 Amb2695967 [2,0,0,0,0,0|1,0,0]=3 3775 B9R1.6 C[C@@H](N)c1ccccn1 Amb30526699 [2,0,0,0,0,0|1,0,0]=3 3776 B9R1.6 C[C@@H](N)c1cccnc1 Amb13951181 [2,0,0,0,0,0|1,0,0]=3 3777 B9R1.6 C[C@@H](N)c1cccnc1 Amb6893473 [2,0,0,0,0,0|1,0,0]=3 3778 B9R1.6 C[C@@H](N)c1ccncc1 Amb13952719 [2,0,0,0,0,0|1,0,0]=3 3779 B9R1.6 C[C@@H](N)c1ccncc1 Amb6893468 [2,0,0,0,0,0|1,0,0]=3 3780 B9R1.6 C[C@@H](N)c1ccncn1 Amb18832953 [2,0,0,0,0,0|2,0,0]=4 3781 B9R1.6 C[C@@H](N)c1cnccn1 Amb22747093 [2,0,0,0,0,0|2,0,0]=4 3782 B9R1.6 C[C@@H](N)c1cnccn1 Amb32664964 [2,0,0,0,0,0|2,0,0]=4 3783 B9R1.6 C[C@@H](N)c1cncnc1 Amb23439227 [2,0,0,0,0,0|2,0,0]=4 3784 B9R1.6 C[C@@H](N)c1cncnc1 Amb25727204 [2,0,0,0,0,0|2,0,0]=4 3785 B9R1.6 C[C@@H](N)c1ncccn1 Amb27264293 [2,0,0,0,0,0|2,0,0]=4 3786 B9R1.6 C[C@@H](O)c1ccccc1 Amb6366772 [2,0,0,0,0,0|1,0,0]=3 3787 B9R1.6 C[C@@H](O)c1ccccn1 Amb24087444 [2,0,0,0,0,0|2,0,0]=4 3788 B9R1.6 C[C@@H](O)c1ccccn1 Amb4166327 [2,0,0,0,0,0|2,0,0]=4 3789 B9R1.6 C[C@@H](O)c1cccnc1 Amb6893471 [2,0,0,0,0,0|2,0,0]=4 3790 B9R1.6 C[C@@H](O)c1ccncc1 Amb6893466 [2,0,0,0,0,0|2,0,0]=4 3791 B9R1.6 C[C@@H](S)c1ccccc1 Amb28069838 [2,0,0,0,0,0|1,0,0]=3 3792 B9R1.6 C[C@H](Br)c1ccccn1 Amb28123940 [2,0,0,0,0,0|2,0,0]=4 3793 B9R1.6 C[C@H](Cl)c1ccccn1 Amb33068907 [2,0,0,0,0,0|2,0,0]=4 3794 B9R1.6 C[C@H](N)C1=C=CCC=C1 Amb28368961 [2,0,0,0,0,0|0,0,2]=4 3795 B9R1.6 C[C@H](N)C1C=C=CC=C1 Amb28118529 [2,0,0,0,0,0|0,0,2]=4 3796 B9R1.6 C[C@H](N)c1ccccc1 Amb2725550 [2,0,0,0,0,0|0,0,0]=2 3797 B9R1.6 C[C@H](N)c1ccccn1 Amb13951343 [2,0,0,0,0,0|1,0,0]=3 3798 B9R1.6 C[C@H](N)c1ccccn1 Amb33871554 [2,0,0,0,0,0|1,0,0]=3 3799 B9R1.6 C[C@H](N)c1ccccn1 Amb6893465 [2,0,0,0,0,0|1,0,0]=3 3800 B9R1.6 C[C@H](N)c1cccnc1 Amb30647445 [2,0,0,0,0,0|1,0,0]=3 3801 B9R1.6 C[C@H](N)c1cccnc1 Amb6893472 [2,0,0,0,0,0|1,0,0]=3 3802 B9R1.6 C[C@H](N)c1ccncc1 Amb28895917 [2,0,0,0,0,0|1,0,0]=3 3803 B9R1.6 C[C@H](N)c1ccncc1 Amb6893469 [2,0,0,0,0,0|1,0,0]=3 3804 B9R1.6 C[C@H](N)c1ccncn1 Amb24099656 [2,0,0,0,0,0|2,0,0]=4 3805 B9R1.6 C[C@H](N)c1cnccn1 Amb25980810 [2,0,0,0,0,0|2,0,0]=4 3806 B9R1.6 C[C@H](N)c1cnccn1 Amb32665356 [2,0,0,0,0,0|2,0,0]=4 3807 B9R1.6 C[C@H](N)c1cncnc1 Amb25691811 [2,0,0,0,0,0|2,0,0]=4 3808 B9R1.6 C[C@H](N)c1ncccn1 Amb27437960 [2,0,0,0,0,0|2,0,0]=4 3809 B9R1.6 C[C@H](O)c1ccccc1 Amb4021849 [2,0,0,0,0,0|1,0,0]=3 3810 B9R1.6 C[C@H](O)c1ccccn1 Amb30526838 [2,0,0,0,0,0|2,0,0]=4 3811 B9R1.6 C[C@H](O)c1cccnc1 Amb6893470 [2,0,0,0,0,0|2,0,0]=4 3812 B9R1.6 C[C@H](O)c1ccncc1 Amb6893467 [2,0,0,0,0,0|2,0,0]=4 3813 B9R1.6 C[C@H](S)c1ccccc1 Amb25935694 [2,0,0,0,0,0|1,0,0]=3 3814 B9R1.6 C[S+](C)c1ccccc1 Amb27958149 [2,0,0,0,0,0|1,0,0]=3 3815 B9R1.6 C[SiH](C)c1ccccn1 Amb22336977 [2,0,0,0,0,0|1,1,0]=4 3816 B9R1.6 C[Si](C)c1ccccc1 Amb33781101 [2,0,0,0,0,0|0,1,0]=3 3817 B9R1.6 FC(Cl)c1ccccc1 Amb10838337 [2,0,0,0,0,0|2,0,0]=4 3818 B9R1.6 FC(F)c1ccccc1 Amb10606272 [2,0,0,0,0,0|2,0,0]=4 3819 B9R1.6 N=C(N)c1ccccc1 Amb10068704 [2,0,0,0,0,0|1,0,1]=4 3820 B9R1.6 N=C(N)c1ccccc1 Amb2371546 [2,0,0,0,0,0|1,0,1]=4 3821 B9R1.6 N=C(N)c1ccccc1 Amb6337518 [2,0,0,0,0,0|1,0,1]=4 3822 B9R1.6 NC(=O)c1ccccc1 Amb6399766 [2,0,0,0,0,0|1,0,1]=4 3823 B9R1.6 NC(=S)c1ccccc1 Amb6338789 [2,0,0,0,0,0|1,0,1]=4 3824 B9R1.6 NC(F)c1ccncc1 Amb27844854 [2,0,0,0,0,0|2,0,0]=4 3825 B9R1.6 NC(N)c1ccccc1 Amb28069502 [2,0,0,0,0,0|1,0,0]=3 3826 B9R1.6 NC(N)c1ccncc1 Amb24079161 [2,0,0,0,0,0|2,0,0]=4 3827 B9R1.6 NS(=O)c1ccccc1 Amb26487323 [2,0,0,0,0,0|2,0,0]=4 3828 B9R1.6 O[C@@H](Br)c1ccccc1 Amb27233551 [2,0,0,0,0,0|2,0,0]=4 3829 B9R1.6 O[C@@H](Cl)c1ccccc1 Amb28119929 [2,0,0,0,0,0|2,0,0]=4 3830 B9R1.8 BrCC[n+]1ccccc1 Amb2617784 [2,0,0,0,0,0|2,0,0]=4 3831 B9R1.8 BrCC[n+]1ccccc1 Amb26365793 [2,0,0,0,0,0|2,0,0]=4 3832 B9R1.8 BrCCc1ccccn1 Amb1102303 [2,0,0,0,0,0|2,0,0]=4 3833 B9R1.8 BrCCc1ccccn1 Amb17935743 [2,0,0,0,0,0|2,0,0]=4 3834 B9R1.8 BrCCc1cccnc1 Amb19069960 [2,0,0,0,0,0|2,0,0]=4 3835 B9R1.8 BrCCc1cccnc1 Amb19372982 [2,0,0,0,0,0|2,0,0]=4 3836 B9R1.8 BrCCc1ccncc1 Amb18326675 [2,0,0,0,0,0|2,0,0]=4 3837 B9R1.8 BrCCc1ccncc1 Amb33313562 [2,0,0,0,0,0|2,0,0]=4 3838 B9R1.8 C#NCc1ccccc1 Amb31132452 [2,0,0,0,0,0|0,0,2]=4 3839 B9R1.8 C=CCc1ccccc1 Amb2599341 [2,0,0,0,0,0|0,0,2]=4 3840 B9R1.8 C=NCc1ccccc1 Amb28256747 [2,0,0,0,0,0|0,0,2]=4 3841 B9R1.8 CC#Cc1ccccc1 Amb8513696 [2,0,0,0,0,0|0,0,2]=4 3842 B9R1.8 CCC[n+]1ccccc1 Amb24325390 [2,0,0,0,0,0|1,0,0]=3 3843 B9R1.8 CCCc1ccccc1 Amb2447143 [2,0,0,0,0,0|0,0,0]=2 3844 B9R1.8 CCCc1ccccn1 Amb6366812 [2,0,0,0,0,0|1,0,0]=3 3845 B9R1.8 CCCc1cccnc1 Amb2613018 [2,0,0,0,0,0|1,0,0]=3 3846 B9R1.8 CCCc1cccnn1 Amb24447402 [2,0,0,0,0,0|2,0,0]=4 3847 B9R1.8 CCCc1ccncc1 Amb4017941 [2,0,0,0,0,0|1,0,0]=3 3848 B9R1.8 CCCc1ccncn1 Amb24070638 [2,0,0,0,0,0|2,0,0]=4 3849 B9R1.8 CCCc1cnccn1 Amb2690413 [2,0,0,0,0,0|2,0,0]=4 3850 B9R1.8 CCNc1ccccc1 Amb3940127 [2,0,0,0,0,0|1,0,0]=3 3851 B9R1.8 CCNc1ccccn1 Amb6640743 [2,0,0,0,0,0|2,0,0]=4 3852 B9R1.8 CCNc1cccnc1 Amb6686634 [2,0,0,0,0,0|2,0,0]=4 3853 B9R1.8 CCNc1ccncc1 Amb33545749 [2,0,0,0,0,0|2,0,0]=4 3854 B9R1.8 CCOc1ccccc1 Amb2842270 [2,0,0,0,0,0|1,0,0]=3 3855 B9R1.8 CCOc1ccccn1 Amb2609960 [2,0,0,0,0,0|2,0,0]=4 3856 B9R1.8 CCOc1cccnc1 Amb10573342 [2,0,0,0,0,0|2,0,0]=4 3857 B9R1.8 CCOc1ccncc1 Amb8396897 [2,0,0,0,0,0|2,0,0]=4 3858 B9R1.8 CCSc1ccccc1 Amb2687929 [2,0,0,0,0,0|1,0,0]=3 3859 B9R1.8 CCSc1ccccn1 Amb26656831 [2,0,0,0,0,0|2,0,0]=4 3860 B9R1.8 CCSc1ccncc1 Amb27766422 [2,0,0,0,0,0|2,0,0]=4 3861 B9R1.8 CNCc1ccccc1 Amb3699562 [2,0,0,0,0,0|0,0,0]=2 3862 B9R1.8 CNCc1ccccn1 Amb10068750 [2,0,0,0,0,0|1,0,0]=3 3863 B9R1.8 CNCc1ccccn1 Amb10576408 [2,0,0,0,0,0|1,0,0]=3 3864 B9R1.8 CNCc1ccccn1 Amb3941148 [2,0,0,0,0,0|1,0,0]=3 3865 B9R1.8 CNCc1cccnc1 Amb10066918 [2,0,0,0,0,0|1,0,0]=3 3866 B9R1.8 CNCc1cccnc1 Amb10576409 [2,0,0,0,0,0|1,0,0]=3 3867 B9R1.8 CNCc1cccnc1 Amb1648828 [2,0,0,0,0,0|1,0,0]=3 3868 B9R1.8 CNCc1cccnn1 Amb32667437 [2,0,0,0,0,0|2,0,0]=4 3869 B9R1.8 CNCc1cccnn1 Amb8010012 [2,0,0,0,0,0|2,0,0]=4 3870 B9R1.8 CNCc1ccncc1 Amb10068773 [2,0,0,0,0,0|1,0,0]=3 3871 B9R1.8 CNCc1ccncc1 Amb1115812 [2,0,0,0,0,0|1,0,0]=3 3872 B9R1.8 CNCc1ccncn1 Amb21962059 [2,0,0,0,0,0|2,0,0]=4 3873 B9R1.8 CNCc1ccncn1 Amb22587684 [2,0,0,0,0,0|2,0,0]=4 3874 B9R1.8 CNCc1ccncn1 Amb3941356 [2,0,0,0,0,0|2,0,0]=4 3875 B9R1.8 CNCc1ccnnc1 Amb24183593 [2,0,0,0,0,0|2,0,0]=4 3876 B9R1.8 CNCc1ccnnc1 Amb27784160 [2,0,0,0,0,0|2,0,0]=4 3877 B9R1.8 CNCc1cnccn1 Amb1094140 [2,0,0,0,0,0|2,0,0]=4 3878 B9R1.8 CNCc1cnccn1 Amb21959600 [2,0,0,0,0,0|2,0,0]=4 3879 B9R1.8 CNCc1cncnc1 Amb32664708 [2,0,0,0,0,0|2,0,0]=4 3880 B9R1.8 CNCc1cncnc1 Amb8010525 [2,0,0,0,0,0|2,0,0]=4 3881 B9R1.8 CNCc1ncccn1 Amb30585159 [2,0,0,0,0,0|2,0,0]=4 3882 B9R1.8 CNCc1ncccn1 Amb8010518 [2,0,0,0,0,0|2,0,0]=4 3883 B9R1.8 CNNc1ccccc1 Amb20242875 [2,0,0,0,0,0|1,0,0]=3 3884 B9R1.8 CNNc1ccccc1 Amb27969267 [2,0,0,0,0,0|1,0,0]=3 3885 B9R1.8 COCc1ccccc1 Amb2782562 [2,0,0,0,0,0|1,0,0]=3 3886 B9R1.8 COCc1ccccn1 Amb4017561 [2,0,0,0,0,0|2,0,0]=4 3887 B9R1.8 CSCc1ccccn1 Amb27837576 [2,0,0,0,0,0|2,0,0]=4 3888 B9R1.8 CSCc1cccnc1 Amb24523080 [2,0,0,0,0,0|2,0,0]=4 3889 B9R1.8 CSSc1ccccc1 Amb4008371 [2,0,0,0,0,0|2,0,0]=4 3890 B9R1.8 C[NH2+]Cc1ccccc1 Amb20648430 [2,0,0,0,0,0|0,0,1]=3 3891 B9R1.8 C\C=C/c1ccccc1 Amb2690400 [2,0,0,0,0,0|0,0,2]=4 3892 B9R1.8 C\C=C\c1ccccc1 Amb6366726 [2,0,0,0,0,0|0,0,2]=4 3893 B9R1.8 C\C=N\c1ccccc1 Amb8392386 [2,0,0,0,0,0|1,0,1]=4 3894 B9R1.8 C\N=C\c1ccccc1 Amb8513063 [2,0,0,0,0,0|0,0,2]=4 3895 B9R1.8 ClCC[n+]1ccccc1 Amb28195087 [2,0,0,0,0,0|2,0,0]=4 3896 B9R1.8 ClCCc1ccccc1 Amb535682 [2,0,0,0,0,0|1,0,0]=3 3897 B9R1.8 ClCCc1ccccn1 Amb1102254 [2,0,0,0,0,0|2,0,0]=4 3898 B9R1.8 ClCCc1ccccn1 Amb19892295 [2,0,0,0,0,0|2,0,0]=4 3899 B9R1.8 ClCCc1cccnc1 Amb24061504 [2,0,0,0,0,0|2,0,0]=4 3900 B9R1.8 ClCCc1ccncc1 Amb23400891 [2,0,0,0,0,0|2,0,0]=4 3901 B9R1.8 ClCCc1ccncc1 Amb9004339 [2,0,0,0,0,0|2,0,0]=4 3902 B9R1.8 ClCOc1ccccc1 Amb22059503 [2,0,0,0,0,0|2,0,0]=4 3903 B9R1.8 ClNCc1cccnc1 Amb27951574 [2,0,0,0,0,0|2,0,0]=4 3904 B9R1.8 ICCc1ccccc1 Amb8515353 [2,0,0,0,0,0|1,0,0]=3 3905 B9R1.8 ICCc1cccnc1 Amb33534604 [2,0,0,0,0,0|2,0,0]=4 3906 B9R1.8 ICCc1ccncc1 Amb28383331 [2,0,0,0,0,0|2,0,0]=4 3907 B9R1.8 N#CCc1ccccc1 Amb3598087 [2,0,0,0,0,0|0,0,2]=4 3908 B9R1.8 NCC[n+]1ccccc1 Amb27246156 [2,0,0,0,0,0|1,0,0]=3 3909 B9R1.8 NCCc1ccccc1 Amb17843439 [2,0,0,0,0,0|0,0,0]=2 3910 B9R1.8 NCCc1ccccc1 Amb2792829 [2,0,0,0,0,0|0,0,0]=2 3911 B9R1.8 NCCc1ccccn1 Amb1156071 [2,0,0,0,0,0|1,0,0]=3 3912 B9R1.8 NCCc1ccccn1 Amb24066975 [2,0,0,0,0,0|1,0,0]=3 3913 B9R1.8 NCCc1cccnc1 Amb1134784 [2,0,0,0,0,0|1,0,0]=3 3914 B9R1.8 NCCc1cccnc1 Amb16230500 [2,0,0,0,0,0|1,0,0]=3 3915 B9R1.8 NCCc1cccnc1 Amb20241523 [2,0,0,0,0,0|1,0,0]=3 3916 B9R1.8 NCCc1cccnc1 Amb8631307 [2,0,0,0,0,0|1,0,0]=3 3917 B9R1.8 NCCc1cccnn1 Amb23592188 [2,0,0,0,0,0|2,0,0]=4 3918 B9R1.8 NCCc1ccncc1 Amb1102164 [2,0,0,0,0,0|1,0,0]=3 3919 B9R1.8 NCCc1ccncc1 Amb8631358 [2,0,0,0,0,0|1,0,0]=3 3920 B9R1.8 NCCc1ccncn1 Amb22899210 [2,0,0,0,0,0|2,0,0]=4 3921 B9R1.8 NCCc1ccncn1 Amb8009432 [2,0,0,0,0,0|2,0,0]=4 3922 B9R1.8 NCCc1ccnnc1 Amb31217486 [2,0,0,0,0,0|2,0,0]=4 3923 B9R1.8 NCCc1ccnnc1 Amb8009433 [2,0,0,0,0,0|2,0,0]=4 3924 B9R1.8 NCCc1cnccn1 Amb10067912 [2,0,0,0,0,0|2,0,0]=4 3925 B9R1.8 NCCc1cnccn1 Amb1995199 [2,0,0,0,0,0|2,0,0]=4 3926 B9R1.8 NCCc1cnccn1 Amb22756001 [2,0,0,0,0,0|2,0,0]=4 3927 B9R1.8 NCCc1cnccn1 Amb24066949 [2,0,0,0,0,0|2,0,0]=4 3928 B9R1.8 NCCc1cnccn1 Amb30526944 [2,0,0,0,0,0|2,0,0]=4 3929 B9R1.8 NCCc1cncnc1 Amb32667660 [2,0,0,0,0,0|2,0,0]=4 3930 B9R1.8 NCCc1cncnc1 Amb8009434 [2,0,0,0,0,0|2,0,0]=4 3931 B9R1.8 NCCc1cncnc1 Amb8631335 [2,0,0,0,0,0|2,0,0]=4 3932 B9R1.8 NCCc1ncccn1 Amb17074351 [2,0,0,0,0,0|2,0,0]=4 3933 B9R1.8 NCCc1ncccn1 Amb18199432 [2,0,0,0,0,0|2,0,0]=4 3934 B9R1.8 NCCc1ncccn1 Amb23399636 [2,0,0,0,0,0|2,0,0]=4 3935 B9R1.8 NCNc1ccccc1 Amb17117015 [2,0,0,0,0,0|1,0,0]=3 3936 B9R1.8 NCOc1ccccc1 Amb25128781 [2,0,0,0,0,0|1,0,0]=3 3937 B9R1.8 NNCc1ccccc1 Amb1105200 [2,0,0,0,0,0|1,0,0]=3 3938 B9R1.8 NNCc1ccccc1 Amb16231890 [2,0,0,0,0,0|1,0,0]=3 3939 B9R1.8 NNCc1ccccc1 Amb22492438 [2,0,0,0,0,0|1,0,0]=3 3940 B9R1.8 NNCc1ccccc1 Amb8513062 [2,0,0,0,0,0|1,0,0]=3 3941 B9R1.8 NNCc1ccccc1 Amb9826089 [2,0,0,0,0,0|1,0,0]=3 3942 B9R1.8 NNCc1ccccn1 Amb1117330 [2,0,0,0,0,0|2,0,0]=4 3943 B9R1.8 NNCc1ccccn1 Amb28984160 [2,0,0,0,0,0|2,0,0]=4 3944 B9R1.8 NNCc1ccccn1 Amb6892424 [2,0,0,0,0,0|2,0,0]=4 3945 B9R1.8 NNCc1cccnc1 Amb1121062 [2,0,0,0,0,0|2,0,0]=4 3946 B9R1.8 NNCc1cccnc1 Amb22491471 [2,0,0,0,0,0|2,0,0]=4 3947 B9R1.8 NNCc1cccnc1 Amb33551495 [2,0,0,0,0,0|2,0,0]=4 3948 B9R1.8 NNCc1ccncc1 Amb1118337 [2,0,0,0,0,0|2,0,0]=4 3949 B9R1.8 NNCc1ccncc1 Amb19893255 [2,0,0,0,0,0|2,0,0]=4 3950 B9R1.8 NNCc1ccncc1 Amb2691315 [2,0,0,0,0,0|2,0,0]=4 3951 B9R1.8 NNCc1ccncc1 Amb28984138 [2,0,0,0,0,0|2,0,0]=4 3952 B9R1.8 NOCc1ccccc1 Amb1154307 [2,0,0,0,0,0|1,0,0]=3 3953 B9R1.8 NOCc1ccccc1 Amb22489499 [2,0,0,0,0,0|1,0,0]=3 3954 B9R1.8 NOCc1ccccc1 Amb6600539 [2,0,0,0,0,0|1,0,0]=3 3955 B9R1.8 NOCc1ccccn1 Amb18642195 [2,0,0,0,0,0|2,0,0]=4 3956 B9R1.8 NOCc1ccccn1 Amb32663271 [2,0,0,0,0,0|2,0,0]=4 3957 B9R1.8 NOCc1cccnc1 Amb24074265 [2,0,0,0,0,0|2,0,0]=4 3958 B9R1.8 NOCc1cccnc1 Amb33546939 [2,0,0,0,0,0|2,0,0]=4 3959 B9R1.8 NOCc1ccncc1 Amb22397036 [2,0,0,0,0,0|2,0,0]=4 3960 B9R1.8 N\C=N\c1ccccc1 Amb10552787 [2,0,0,0,0,0|1,0,1]=4 3961 B9R1.8 N\C=P\c1ccccc1 Amb27643938 [2,0,0,0,0,0|1,0,1]=4 3962 B9R1.8 N\N=C\c1ccccc1 Amb31284503 [2,0,0,0,0,0|1,0,1]=4 3963 B9R1.8 O=CCc1ccccc1 Amb3939950 [2,0,0,0,0,0|1,0,1]=4 3964 B9R1.8 OCC[n+]1ccccc1 Amb27839429 [2,0,0,0,0,0|2,0,0]=4 3965 B9R1.8 OCCc1ccccc1 Amb2793058 [2,0,0,0,0,0|1,0,0]=3 3966 B9R1.8 OCCc1ccccn1 Amb3939045 [2,0,0,0,0,0|2,0,0]=4 3967 B9R1.8 OCCc1cccnc1 Amb2688750 [2,0,0,0,0,0|2,0,0]=4 3968 B9R1.8 OCCc1ccncc1 Amb3939219 [2,0,0,0,0,0|2,0,0]=4 3969 B9R1.8 OCSc1ccccc1 Amb27776457 [2,0,0,0,0,0|2,0,0]=4 3970 B9R1.8 ONCc1ccccc1 Amb22001943 [2,0,0,0,0,0|1,0,0]=3 3971 B9R1.8 ONCc1ccccc1 Amb9825936 [2,0,0,0,0,0|1,0,0]=3 3972 B9R1.8 ONCc1ccccn1 Amb28457793 [2,0,0,0,0,0|2,0,0]=4 3973 B9R1.8 ONCc1ccccn1 Amb32680372 [2,0,0,0,0,0|2,0,0]=4 3974 B9R1.8 ONCc1cccnc1 Amb25147084 [2,0,0,0,0,0|2,0,0]=4 3975 B9R1.8 ONCc1ccncc1 Amb25851052 [2,0,0,0,0,0|2,0,0]=4 3976 B9R1.8 SCCc1ccccc1 Amb6255605 [2,0,0,0,0,0|1,0,0]=3 3977 B9R1.8 SCCc1ccccn1 Amb17619707 [2,0,0,0,0,0|2,0,0]=4 3978 B9R1.8 SCCc1cccnc1 Amb22008806 [2,0,0,0,0,0|2,0,0]=4 3979 B9R1.8 SCCc1ccncc1 Amb10552830 [2,0,0,0,0,0|2,0,0]=4 3980 B9R1.8 SCCc1ccncc1 Amb9800962 [2,0,0,0,0,0|2,0,0]=4 3981 B9R1.8 SSCc1ccccc1 Amb27646980 [2,0,0,0,0,0|2,0,0]=4 3982 B9R1.8 [C-]#[N+]Cc1ccccc1 Amb2234859 [2,0,0,0,0,0|0,0,2]=4 3983 B9R1.8 [NH3+]CCc1ccccc1 Amb17843435 [2,0,0,0,0,0|0,0,1]=3 3984 B9R1.8 [NH3+]OCc1ccccc1 Amb9786371 [2,0,0,0,0,0|1,0,1]=4 3985 B11R1.7 C#CC(C)(C)c1ccccc1 Amb24106606 [1,1,0,0,0,0|0,0,2]=4 3986 B11R1.7 C#CC(C)(O)c1ccccc1 Amb1088912 [1,1,0,0,0,0|0,0,2]=4 3987 B11R1.7 C=CC(C)(C)c1ccccc1 Amb24476101 [1,1,0,0,0,0|0,0,2]=4 3988 B11R1.7 C=C[C@@](C)(N)c1ccccc1 Amb27784091 [1,1,0,0,0,0|0,0,2]=4 3989 B11R1.7 CC(Br)(CBr)c1ccccc1 Amb27258041 [1,1,0,0,0,0|1,0,0]=3 3990 B11R1.7 CC(C)(C#N)c1ccccc1 Amb2782202 [1,1,0,0,0,0|0,0,2]=4 3991 B11R1.7 CC(C)(C=O)c1ccccc1 Amb17232040 [1,1,0,0,0,0|1,0,1]=4 3992 B11R1.7 CC(C)(CBr)c1ccccc1 Amb17140754 [1,1,0,0,0,0|1,0,0]=3 3993 B11R1.7 CC(C)(CBr)c1ccccn1 Amb33452087 [1,1,0,0,0,0|2,0,0]=4 3994 B11R1.7 CC(C)(CBr)c1cccnc1 Amb33451913 [1,1,0,0,0,0|2,0,0]=4 3995 B11R1.7 CC(C)(CBr)c1ccncc1 Amb33451914 [1,1,0,0,0,0|2,0,0]=4 3996 B11R1.7 CC(C)(CCl)c1ccccc1 Amb3940255 [1,1,0,0,0,0|1,0,0]=3 3997 B11R1.7 CC(C)(CN)c1ccccc1 Amb32666735 [1,1,0,0,0,0|0,0,0]=2 3998 B11R1.7 CC(C)(CN)c1ccccc1 Amb5753148 [1,1,0,0,0,0|0,0,0]=2 3999 B11R1.7 CC(C)(CN)c1ccccn1 Amb17106798 [1,1,0,0,0,0|1,0,0]=3 4000 B11R1.7 CC(C)(CN)c1ccccn1 Amb32653251 [1,1,0,0,0,0|1,0,0]=3 4001 B11R1.7 CC(C)(CN)c1ccccn1 Amb8467933 [1,1,0,0,0,0|1,0,0]=3 4002 B11R1.7 CC(C)(CN)c1cccnc1 Amb17106797 [1,1,0,0,0,0|1,0,0]=3 4003 B11R1.7 CC(C)(CN)c1ccncc1 Amb17748503 [1,1,0,0,0,0|1,0,0]=3 4004 B11R1.7 CC(C)(CN)c1ccncn1 Amb25064128 [1,1,0,0,0,0|2,0,0]=4 4005 B11R1.7 CC(C)(CN)c1cnccn1 Amb17779860 [1,1,0,0,0,0|2,0,0]=4 4006 B11R1.7 CC(C)(CN)c1cncnc1 Amb18908421 [1,1,0,0,0,0|2,0,0]=4 4007 B11R1.7 CC(C)(CN)c1ncccn1 Amb27479796 [1,1,0,0,0,0|2,0,0]=4 4008 B11R1.7 CC(C)(CO)c1ccccc1 Amb33545970 [1,1,0,0,0,0|1,0,0]=3 4009 B11R1.7 CC(C)(CO)c1ccccn1 Amb28066531 [1,1,0,0,0,0|2,0,0]=4 4010 B11R1.7 CC(C)(CO)c1cccnc1 Amb33429426 [1,1,0,0,0,0|2,0,0]=4 4011 B11R1.7 CC(C)(CS)c1ccccc1 Amb33176151 [1,1,0,0,0,0|1,0,0]=3 4012 B11R1.7 CC(C)(NN)c1ccccc1 Amb18644446 [1,1,0,0,0,0|1,0,0]=3 4013 B11R1.7 CC(C)(NO)c1ccccc1 Amb25786374 [1,1,0,0,0,0|1,0,0]=3 4014 B11R1.7 CC(C)(NO)c1ccccc1 Amb32663803 [1,1,0,0,0,0|1,0,0]=3 4015 B11R1.7 CC(C)(ON)c1ccccc1 Amb32953168 [1,1,0,0,0,0|1,0,0]=3 4016 B11R1.7 CC(C)(ON)c1ccccn1 Amb33360777 [1,1,0,0,0,0|2,0,0]=4 4017 B11R1.7 CC(C)(ON)c1cccnc1 Amb33360033 [1,1,0,0,0,0|2,0,0]=4 4018 B11R1.7 CC(C)(ON)c1ccncc1 Amb33380655 [1,1,0,0,0,0|2,0,0]=4 4019 B11R1.7 CC(C)(OO)c1ccccc1 Amb8516134 [1,1,0,0,0,0|2,0,0]=4 4020 B11R1.7 CC(Cl)(C=O)c1ccccc1 Amb18126588 [1,1,0,0,0,0|1,0,1]=4 4021 B11R1.7 CC(F)(C#N)c1ccccc1 Amb22546815 [1,1,0,0,0,0|0,0,2]=4 4022 B11R1.7 CC(F)(C=O)c1ccccc1 Amb27176350 [1,1,0,0,0,0|1,0,1]=4 4023 B11R1.7 CC(F)(CCl)c1ccccc1 Amb28325717 [1,1,0,0,0,0|1,0,0]=3 4024 B11R1.7 CC(N)(C#N)c1ccccc1 Amb9707675 [1,1,0,0,0,0|0,0,2]=4 4025 B11R1.7 CC(N)(CF)c1ccccc1 Amb27465429 [1,1,0,0,0,0|1,0,0]=3 4026 B11R1.7 CC(N)(CN)c1ccccc1 Amb18286210 [1,1,0,0,0,0|0,0,0]=2 4027 B11R1.7 CC(N)(CN)c1ccncc1 Amb23538716 [1,1,0,0,0,0|1,0,0]=3 4028 B11R1.7 CC(N)(CO)c1ccccc1 Amb13951678 [1,1,0,0,0,0|1,0,0]=3 4029 B11R1.7 CC(N)(CO)c1ccccc1 Amb30647392 [1,1,0,0,0,0|1,0,0]=3 4030 B11R1.7 CC(N)(CO)c1ccccn1 Amb18951181 [1,1,0,0,0,0|2,0,0]=4 4031 B11R1.7 CC(N)(CO)c1cccnc1 Amb18951182 [1,1,0,0,0,0|2,0,0]=4 4032 B11R1.7 CC(N)(CO)c1ccncc1 Amb18281689 [1,1,0,0,0,0|2,0,0]=4 4033 B11R1.7 CC(O)(C=O)c1ccccc1 Amb17593726 [1,1,0,0,0,0|1,0,1]=4 4034 B11R1.7 CC(O)(CBr)c1ccccc1 Amb26066904 [1,1,0,0,0,0|1,0,0]=3 4035 B11R1.7 CC(O)(CI)c1ccccc1 Amb26330264 [1,1,0,0,0,0|1,0,0]=3 4036 B11R1.7 CC(O)(CN)c1ccccc1 Amb1993837 [1,1,0,0,0,0|0,0,0]=2 4037 B11R1.7 CC(O)(CN)c1ccccn1 Amb18064991 [1,1,0,0,0,0|1,0,0]=3 4038 B11R1.7 CC(O)(CN)c1cccnc1 Amb18062788 [1,1,0,0,0,0|1,0,0]=3 4039 B11R1.7 CC(O)(CN)c1ccncc1 Amb18562952 [1,1,0,0,0,0|1,0,0]=3 4040 B11R1.7 CC(O)(CN)c1ccncn1 Amb27214205 [1,1,0,0,0,0|2,0,0]=4 4041 B11R1.7 CC(O)(CN)c1cnccn1 Amb25890847 [1,1,0,0,0,0|2,0,0]=4 4042 B11R1.7 CC(O)(CN)c1cncnc1 Amb26929051 [1,1,0,0,0,0|2,0,0]=4 4043 B11R1.7 CC(O)(CN)c1ncccn1 Amb33270059 [1,1,0,0,0,0|2,0,0]=4 4044 B11R1.7 CC(O)(CO)c1ccccc1 Amb9825861 [1,1,0,0,0,0|1,0,0]=3 4045 B11R1.7 CC(O)(CO)c1cccnc1 Amb27656590 [1,1,0,0,0,0|2,0,0]=4 4046 B11R1.7 CC(O)(CO)c1ccncc1 Amb28042032 [1,1,0,0,0,0|2,0,0]=4 4047 B11R1.7 CC(S)(CO)c1ccccc1 Amb27764909 [1,1,0,0,0,0|1,0,0]=3 4048 B11R1.7 CCC(C)(Br)c1ccccc1 Amb27755440 [1,1,0,0,0,0|0,0,0]=2 4049 B11R1.7 CCC(C)(C)c1ccccc1 Amb8383409 [1,1,0,0,0,0|0,0,0]=2 4050 B11R1.7 CCC(C)(N)c1ccccc1 Amb4036326 [1,1,0,0,0,0|0,0,0]=2 4051 B11R1.7 CCC(C)(N)c1ccccc1 Amb9781829 [1,1,0,0,0,0|0,0,0]=2 4052 B11R1.7 CCC(C)(N)c1ccccn1 Amb27176554 [1,1,0,0,0,0|1,0,0]=3 4053 B11R1.7 CCC(C)(N)c1cccnc1 Amb18950468 [1,1,0,0,0,0|1,0,0]=3 4054 B11R1.7 CCC(C)(N)c1ccncc1 Amb27621504 [1,1,0,0,0,0|1,0,0]=3 4055 B11R1.7 CCC(C)(N)c1ccncn1 Amb27960260 [1,1,0,0,0,0|2,0,0]=4 4056 B11R1.7 CCC(C)(N)c1cncnc1 Amb18962177 [1,1,0,0,0,0|2,0,0]=4 4057 B11R1.7 CCC(C)(N)c1ncccn1 Amb26470616 [1,1,0,0,0,0|2,0,0]=4 4058 B11R1.7 CCC(C)(O)c1ccccc1 Amb4036362 [1,1,0,0,0,0|0,0,0]=2 4059 B11R1.7 CCC(C)(O)c1cnccn1 Amb28350671 [1,1,0,0,0,0|2,0,0]=4 4060 B11R1.7 CCC(F)(F)c1ccccc1 Amb20670157 [1,1,0,0,0,0|1,0,0]=3 4061 B11R1.7 CCC(F)(F)c1cccnc1 Amb20669751 [1,1,0,0,0,0|2,0,0]=4 4062 B11R1.7 CCC(F)(F)c1ccncc1 Amb20669846 [1,1,0,0,0,0|2,0,0]=4 4063 B11R1.7 CCS(=N)(=O)c1ccccc1 Amb27948141 [1,1,0,0,0,0|2,0,0]=4 4064 B11R1.7 CCS(=N)(=O)c1ccccc1 Amb33456347 [1,1,0,0,0,0|2,0,0]=4 4065 B11R1.7 CCS(=O)(=O)c1ccccc1 Amb2687930 [1,1,0,0,0,0|2,0,0]=4 4066 B11R1.7 CC[C@@](C)(N)c1ccccc1 Amb27831677 [1,1,0,0,0,0|0,0,0]=2 4067 B11R1.7 CC[C@@](C)(N)c1ccncc1 Amb27879626 [1,1,0,0,0,0|1,0,0]=3 4068 B11R1.7 CC[C@](C)(N)c1ccccc1 Amb26955224 [1,1,0,0,0,0|0,0,0]=2 4069 B11R1.7 CC[S@](=N)(=O)c1ccccc1 Amb33743997 [1,1,0,0,0,0|2,0,0]=4 4070 B11R1.7 CC[Si](Cl)(Cl)c1ccccc1 Amb19893874 [1,1,0,0,0,0|1,1,0]=4 4071 B11R1.7 CN=S(C)(=O)c1ccccc1 Amb9826001 [1,1,0,0,0,0|1,0,1]=4 4072 B11R1.7 CNC(C)(C)c1ccccc1 Amb32664594 [1,1,0,0,0,0|0,0,0]=2 4073 B11R1.7 CNC(C)(C)c1ccccc1 Amb33530550 [1,1,0,0,0,0|0,0,0]=2 4074 B11R1.7 CNC(C)(C)c1ccccn1 Amb31176231 [1,1,0,0,0,0|1,0,0]=3 4075 B11R1.7 CNC(C)(C)c1cccnc1 Amb31176232 [1,1,0,0,0,0|1,0,0]=3 4076 B11R1.7 CNC(C)(C)c1ccncc1 Amb31176233 [1,1,0,0,0,0|1,0,0]=3 4077 B11R1.7 CNC(C)(C)c1ccncn1 Amb33267949 [1,1,0,0,0,0|2,0,0]=4 4078 B11R1.7 CNC(C)(C)c1cnccn1 Amb33429633 [1,1,0,0,0,0|2,0,0]=4 4079 B11R1.7 CNC(C)(C)c1cncnc1 Amb32876138 [1,1,0,0,0,0|2,0,0]=4 4080 B11R1.7 CNC(C)(C)c1ncccn1 Amb33270003 [1,1,0,0,0,0|2,0,0]=4 4081 B11R1.7 CNP(=O)(O)c1ccccc1 Amb28343794 [1,1,0,0,0,0|2,0,0]=4 4082 B11R1.7 CNS(=O)(=O)c1ccccc1 Amb1152097 [1,1,0,0,0,0|2,0,0]=4 4083 B11R1.7 COC(O)(O)c1ccccc1 Amb22749915 [1,1,0,0,0,0|2,0,0]=4 4084 B11R1.7 COP(C)(=O)c1ccccc1 Amb6365870 [1,1,0,0,0,0|2,0,0]=4 4085 B11R1.7 CO[Si](C)(C)c1ccccc1 Amb22047319 [1,1,0,0,0,0|1,1,0]=4 4086 B11R1.7 CP(=O)(CCl)c1ccccc1 Amb27650535 [1,1,0,0,0,0|2,0,0]=4 4087 B11R1.7 CSC(F)(F)c1ccccc1 Amb28077321 [1,1,0,0,0,0|2,0,0]=4 4088 B11R1.7 C[C@@](F)(C=O)c1ccccc1 Amb27176339 [1,1,0,0,0,0|1,0,1]=4 4089 B11R1.7 C[C@@](N)(C#N)c1ccccc1 Amb27970203 [1,1,0,0,0,0|0,0,2]=4 4090 B11R1.7 C[C@@](N)(CO)c1ccncc1 Amb27468713 [1,1,0,0,0,0|2,0,0]=4 4091 B11R1.7 C[C@@](O)(C=O)c1ccccc1 Amb27176382 [1,1,0,0,0,0|1,0,1]=4 4092 B11R1.7 C[C@@](O)(CCl)c1ccccc1 Amb28290325 [1,1,0,0,0,0|1,0,0]=3 4093 B11R1.7 C[C@@](O)(CN)c1ccccc1 Amb27232715 [1,1,0,0,0,0|0,0,0]=2 4094 B11R1.7 C[C@@](O)(CO)c1ccccc1 Amb27448075 [1,1,0,0,0,0|1,0,0]=3 4095 B11R1.7 C[C@](F)(CO)c1ccccc1 Amb28292153 [1,1,0,0,0,0|1,0,0]=3 4096 B11R1.7 C[C@](N)(CO)c1cccnc1 Amb27230770 [1,1,0,0,0,0|2,0,0]=4 4097 B11R1.7 C[C@](O)(C=O)c1ccccc1 Amb27176325 [1,1,0,0,0,0|1,0,1]=4 4098 B11R1.7 C[C@](O)(CN)c1ccccc1 Amb28343028 [1,1,0,0,0,0|0,0,0]=2 4099 B11R1.7 C[Si](C)(CBr)c1ccccc1 Amb24382689 [1,1,0,0,0,0|1,1,0]=4 4100 B11R1.7 C[Si](C)(CCl)c1ccccc1 Amb8393619 [1,1,0,0,0,0|1,1,0]=4 4101 B11R1.7 C[Si](C)(CN)c1ccccc1 Amb25893143 [1,1,0,0,0,0|0,1,0]=3 4102 B11R1.7 C[Si](C)(CO)c1ccccc1 Amb22347007 [1,1,0,0,0,0|1,1,0]=4 4103 B11R1.7 C[Si](Cl)(CCl)c1ccccc1 Amb27796273 [1,1,0,0,0,0|1,1,0]=4 4104 B11R1.7 C[Si](F)(CCl)c1ccccc1 Amb27477906 [1,1,0,0,0,0|1,1,0]=4 4105 B11R1.7 FC(F)(CBr)c1ccccc1 Amb10839191 [1,1,0,0,0,0|2,0,0]=4 4106 B11R1.7 FC(F)(CCl)c1ccccc1 Amb20670164 [1,1,0,0,0,0|2,0,0]=4 4107 B11R1.7 FC(F)(CI)c1ccccc1 Amb28251947 [1,1,0,0,0,0|2,0,0]=4 4108 B11R1.7 FC(F)(CS)c1ccccc1 Amb24382777 [1,1,0,0,0,0|2,0,0]=4 4109 B11R1.7 FCC(F)(F)c1ccccc1 Amb33714909 [1,1,0,0,0,0|2,0,0]=4 4110 B11R1.7 NCC(F)(F)c1ccccc1 Amb20247960 [1,1,0,0,0,0|1,0,0]=3 4111 B11R1.7 NCC(F)(F)c1ccccc1 Amb28872306 [1,1,0,0,0,0|1,0,0]=3 4112 B11R1.7 NCC(F)(F)c1ccccn1 Amb24074639 [1,1,0,0,0,0|2,0,0]=4 4113 B11R1.7 NCC(F)(F)c1ccccn1 Amb8011554 [1,1,0,0,0,0|2,0,0]=4 4114 B11R1.7 NCC(F)(F)c1cccnc1 Amb20247961 [1,1,0,0,0,0|2,0,0]=4 4115 B11R1.7 NCC(F)(F)c1ccncc1 Amb25194771 [1,1,0,0,0,0|2,0,0]=4 4116 B11R1.7 NCP(=O)(O)c1ccccc1 Amb27823125 [1,1,0,0,0,0|2,0,0]=4 4117 B11R1.7 OCC(Cl)(Cl)c1ccccc1 Amb27481207 [1,1,0,0,0,0|2,0,0]=4 4118 B11R1.7 OCC(F)(Cl)c1ccccc1 Amb28065066 [1,1,0,0,0,0|2,0,0]=4 4119 B11R1.7 OCC(F)(F)c1ccccc1 Amb24105388 [1,1,0,0,0,0|2,0,0]=4 4120 B11R1.7 [C-]#[N+]C(C)(C)c1ccccc1 Amb2690314 [1,1,0,0,0,0|0,0,2]=4 4121 B11R1.12 BrCC(CBr)c1ccccc1 Amb4005805 [1,1,0,0,0,0|1,0,0]=3 4122 B11R1.12 C#CC(CO)c1ccccc1 Amb16185451 [1,1,0,0,0,0|0,0,2]=4 4123 B11R1.12 C#CC(NC)c1ccccc1 Amb28072379 [1,1,0,0,0,0|0,0,1]=3 4124 B11R1.12 C#CC(NC)c1ccccn1 Amb27640807 [1,1,0,0,0,0|1,0,1]=4 4125 B11R1.12 C#CC(NC)c1cccnc1 Amb27494399 [1,1,0,0,0,0|1,0,1]=4 4126 B11R1.12 C=CC(CC)c1ccccc1 Amb24485761 [1,1,0,0,0,0|0,0,1]=3 4127 B11R1.12 C=CC(CO)c1ccccc1 Amb27839855 [1,1,0,0,0,0|0,0,2]=4 4128 B11R1.12 C=CC(NC)c1cccnc1 Amb27601261 [1,1,0,0,0,0|1,0,1]=4 4129 B11R1.12 C=C[C@H](CCl)c1ccccc1 Amb27494109 [1,1,0,0,0,0|0,0,2]=4 4130 B11R1.12 CCB(CC)c1ccccn1 Amb2612863 [1,1,0,0,0,0|2,0,0]=4 4131 B11R1.12 CCB(CC)c1cccnc1 Amb9825909 [1,1,0,0,0,0|2,0,0]=4 4132 B11R1.12 CCB(CC)c1ccncc1 Amb26504941 [1,1,0,0,0,0|2,0,0]=4 4133 B11R1.12 CCC(C#N)c1ccccc1 Amb4136418 [1,1,0,0,0,0|0,0,1]=3 4134 B11R1.12 CCC(C#N)c1ccccn1 Amb2698716 [1,1,0,0,0,0|1,0,1]=4 4135 B11R1.12 CCC(C=O)c1ccccc1 Amb17138422 [1,1,0,0,0,0|0,0,1]=3 4136 B11R1.12 CCC(C=O)c1ccccn1 Amb26423415 [1,1,0,0,0,0|1,0,1]=4 4137 B11R1.12 CCC(C=O)c1cccnc1 Amb27631428 [1,1,0,0,0,0|1,0,1]=4 4138 B11R1.12 CCC(C=O)c1ccncc1 Amb27198828 [1,1,0,0,0,0|1,0,1]=4 4139 B11R1.12 CCC(CBr)c1ccccc1 Amb17241352 [1,1,0,0,0,0|0,0,0]=2 4140 B11R1.12 CCC(CC)c1ccncc1 Amb6608936 [1,1,0,0,0,0|1,0,0]=3 4141 B11R1.12 CCC(CCl)c1ccccc1 Amb8860571 [1,1,0,0,0,0|0,0,0]=2 4142 B11R1.12 CCC(CI)c1ccccc1 Amb26060739 [1,1,0,0,0,0|0,0,0]=2 4143 B11R1.12 CCC(CN)c1ccccc1 Amb2371100 [1,1,0,0,0,0|0,0,0]=2 4144 B11R1.12 CCC(CN)c1ccccc1 Amb431023 [1,1,0,0,0,0|0,0,0]=2 4145 B11R1.12 CCC(CN)c1ccccn1 Amb25785396 [1,1,0,0,0,0|1,0,0]=3 4146 B11R1.12 CCC(CN)c1cccnc1 Amb18251338 [1,1,0,0,0,0|1,0,0]=3 4147 B11R1.12 CCC(CN)c1ccncc1 Amb26373299 [1,1,0,0,0,0|1,0,0]=3 4148 B11R1.12 CCC(CN)c1cnccn1 Amb25100461 [1,1,0,0,0,0|2,0,0]=4 4149 B11R1.12 CCC(CN)c1cncnc1 Amb18201509 [1,1,0,0,0,0|2,0,0]=4 4150 B11R1.12 CCC(CO)N1C=CCC=C1 Amb27212806 [1,1,0,0,0,0|1,0,1]=4 4151 B11R1.12 CCC(CO)c1ccccc1 Amb4019936 [1,1,0,0,0,0|0,0,0]=2 4152 B11R1.12 CCC(NC)c1ccccc1 Amb22492401 [1,1,0,0,0,0|0,0,0]=2 4153 B11R1.12 CCC(NC)c1ccccc1 Amb9705433 [1,1,0,0,0,0|0,0,0]=2 4154 B11R1.12 CCC(NC)c1ccccn1 Amb10607918 [1,1,0,0,0,0|1,0,0]=3 4155 B11R1.12 CCC(NC)c1cccnc1 Amb10607958 [1,1,0,0,0,0|1,0,0]=3 4156 B11R1.12 CCC(NC)c1ccncc1 Amb18301849 [1,1,0,0,0,0|1,0,0]=3 4157 B11R1.12 CCC(NC)c1ccnnc1 Amb27880752 [1,1,0,0,0,0|2,0,0]=4 4158 B11R1.12 CCC(NC)c1cnccn1 Amb18301460 [1,1,0,0,0,0|2,0,0]=4 4159 B11R1.12 CCC(NC)c1cncnc1 Amb18298659 [1,1,0,0,0,0|2,0,0]=4 4160 B11R1.12 CCC(NN)c1ccccc1 Amb6245428 [1,1,0,0,0,0|1,0,0]=3 4161 B11R1.12 CCC(NN)c1ccccn1 Amb27875576 [1,1,0,0,0,0|2,0,0]=4 4162 B11R1.12 CCN(C#N)c1ccccc1 Amb25759456 [1,1,0,0,0,0|1,0,1]=4 4163 B11R1.12 CCN(CC)c1ccccc1 Amb10072363 [1,1,0,0,0,0|1,0,0]=3 4164 B11R1.12 CCN(CC)c1ccccc1 Amb6608642 [1,1,0,0,0,0|1,0,0]=3 4165 B11R1.12 CCN(CC)c1ccccn1 Amb18268946 [1,1,0,0,0,0|2,0,0]=4 4166 B11R1.12 CCN(CC)c1cccnc1 Amb18268930 [1,1,0,0,0,0|2,0,0]=4 4167 B11R1.12 CCN(CC)c1ccncc1 Amb18931830 [1,1,0,0,0,0|2,0,0]=4 4168 B11R1.12 CCN(CO)c1ccccc1 Amb20621228 [1,1,0,0,0,0|1,0,0]=3 4169 B11R1.12 CCN(N=O)c1ccccc1 Amb17618581 [1,1,0,0,0,0|2,0,0]=4 4170 B11R1.12 CC[C@@H](C=O)c1ccccc1 Amb27169433 [1,1,0,0,0,0|0,0,1]=3 4171 B11R1.12 CC[C@@H](CBr)c1ccccc1 Amb27839615 [1,1,0,0,0,0|0,0,0]=2 4172 B11R1.12 CC[C@@H](CCl)c1ccccc1 Amb25250668 [1,1,0,0,0,0|0,0,0]=2 4173 B11R1.12 CC[C@@H](CI)c1ccccc1 Amb26641610 [1,1,0,0,0,0|0,0,0]=2 4174 B11R1.12 CC[C@@H](CO)c1ccccc1 Amb27219809 [1,1,0,0,0,0|0,0,0]=2 4175 B11R1.12 CC[C@H](CCl)c1ccccc1 Amb27248249 [1,1,0,0,0,0|0,0,0]=2 4176 B11R1.12 CC[C@H](CN)c1ccccc1 Amb26959455 [1,1,0,0,0,0|0,0,0]=2 4177 B11R1.12 CC[C@H](CO)c1cccnc1 Amb28281934 [1,1,0,0,0,0|1,0,0]=3 4178 B11R1.12 CC[C@H](NC)c1ccccc1 Amb27758866 [1,1,0,0,0,0|0,0,0]=2 4179 B11R1.12 CC\C(=N/O)c1ccccc1 Amb3367838 [1,1,0,0,0,0|1,0,1]=4 4180 B11R1.12 CNC(C#N)c1ccccc1 Amb17621643 [1,1,0,0,0,0|0,0,1]=3 4181 B11R1.12 CNC(C#N)c1ccccc1 Amb9203732 [1,1,0,0,0,0|0,0,1]=3 4182 B11R1.12 CNC(C#N)c1ccccn1 Amb17043382 [1,1,0,0,0,0|1,0,1]=4 4183 B11R1.12 CNC(C#N)c1cccnc1 Amb22551064 [1,1,0,0,0,0|1,0,1]=4 4184 B11R1.12 CNC(C#N)c1cccnc1 Amb9205102 [1,1,0,0,0,0|1,0,1]=4 4185 B11R1.12 CNC(C#N)c1ccncc1 Amb17043489 [1,1,0,0,0,0|1,0,1]=4 4186 B11R1.12 CNC(CF)c1ccncc1 Amb28135718 [1,1,0,0,0,0|1,0,0]=3 4187 B11R1.12 CNC(CN)c1ccccc1 Amb32661838 [1,1,0,0,0,0|0,0,0]=2 4188 B11R1.12 CNC(CN)c1ccncc1 Amb18065359 [1,1,0,0,0,0|1,0,0]=3 4189 B11R1.12 CNC(CN)c1ccncn1 Amb27233164 [1,1,0,0,0,0|2,0,0]=4 4190 B11R1.12 CNC(CO)c1ccccc1 Amb18035932 [1,1,0,0,0,0|0,0,0]=2 4191 B11R1.12 CNC(CO)c1ccccn1 Amb18065363 [1,1,0,0,0,0|1,0,0]=3 4192 B11R1.12 CNC(CO)c1cccnc1 Amb17232101 [1,1,0,0,0,0|1,0,0]=3 4193 B11R1.12 CNC(CO)c1ccncc1 Amb18065364 [1,1,0,0,0,0|1,0,0]=3 4194 B11R1.12 CNC(CS)c1ccccc1 Amb27945468 [1,1,0,0,0,0|0,0,0]=2 4195 B11R1.12 CN[C@@H](CN)c1ccccc1 Amb27830229 [1,1,0,0,0,0|0,0,0]=2 4196 B11R1.12 CN[C@H](C#N)c1ccccc1 Amb27242723 [1,1,0,0,0,0|0,0,1]=3 4197 B11R1.12 CN[C@H](CO)c1ccccc1 Amb33871648 [1,1,0,0,0,0|0,0,0]=2 4198 B11R1.12 CN[C@H](CO)c1ccccn1 Amb27251973 [1,1,0,0,0,0|1,0,0]=3 4199 B11R1.12 COC(C#N)c1ccccc1 Amb26595696 [1,1,0,0,0,0|0,0,2]=4 4200 B11R1.12 COC(CBr)c1ccccc1 Amb24079930 [1,1,0,0,0,0|1,0,0]=3 4201 B11R1.12 COC(CCl)c1ccccc1 Amb17674030 [1,1,0,0,0,0|1,0,0]=3 4202 B11R1.12 COC(CI)c1ccccc1 Amb25998600 [1,1,0,0,0,0|1,0,0]=3 4203 B11R1.12 COC(CN)c1ccccc1 Amb10609834 [1,1,0,0,0,0|0,0,0]=2 4204 B11R1.12 COC(CN)c1ccccc1 Amb6892239 [1,1,0,0,0,0|0,0,0]=2 4205 B11R1.12 COC(CN)c1cccnc1 Amb18980565 [1,1,0,0,0,0|1,0,0]=3 4206 B11R1.12 COC(CN)c1cncnc1 Amb27965135 [1,1,0,0,0,0|2,0,0]=4 4207 B11R1.12 COC(CO)c1ccccc1 Amb3939163 [1,1,0,0,0,0|1,0,0]=3 4208 B11R1.12 COC(OC)c1ccccc1 Amb6297219 [1,1,0,0,0,0|1,0,0]=3 4209 B11R1.12 COP(OC)c1ccccc1 Amb6365796 [1,1,0,0,0,0|2,0,0]=4 4210 B11R1.12 CO[C@@H](CBr)c1ccccc1 Amb28428431 [1,1,0,0,0,0|1,0,0]=3 4211 B11R1.12 CO[C@@H](CN)c1ccccc1 Amb28249989 [1,1,0,0,0,0|0,0,0]=2 4212 B11R1.12 CO[C@H](C=O)c1ccccc1 Amb27455008 [1,1,0,0,0,0|1,0,1]=4 4213 B11R1.12 CO[C@H](CO)c1ccccc1 Amb10807423 [1,1,0,0,0,0|1,0,0]=3 4214 B11R1.12 CSC(C=O)c1ccccc1 Amb18646623 [1,1,0,0,0,0|1,0,1]=4 4215 B11R1.12 C\C=C(/CC)c1ccccc1 Amb26588977 [1,1,0,0,0,0|0,0,1]=3 4216 B11R1.12 C\C=C(/CC)c1ccccn1 Amb24101962 [1,1,0,0,0,0|1,0,1]=4 4217 B11R1.12 C\C=C(\CC)c1ccccc1 Amb26421595 [1,1,0,0,0,0|0,0,1]=3 4218 B11R1.12 C\C=C(\CCl)c1ccccc1 Amb27413555 [1,1,0,0,0,0|0,0,2]=4 4219 B11R1.12 C\N=C(/NC)c1ccccc1 Amb8487310 [1,1,0,0,0,0|0,0,1]=3 4220 B11R1.12 C\N=C(/SC)c1ccccc1 Amb32718735 [1,1,0,0,0,0|0,0,2]=4 4221 B11R1.12 N#CC(CO)c1ccccc1 Amb9787024 [1,1,0,0,0,0|0,0,2]=4 4222 B11R1.12 N#CC(NN)c1ccccc1 Amb17399905 [1,1,0,0,0,0|1,0,1]=4 4223 B11R1.12 NCC(C=O)c1ccccc1 Amb28282628 [1,1,0,0,0,0|0,0,1]=3 4224 B11R1.12 NCC(CF)c1cccnc1 Amb27796445 [1,1,0,0,0,0|1,0,0]=3 4225 B11R1.12 NCC(CN)c1ccccc1 Amb18301720 [1,1,0,0,0,0|0,0,0]=2 4226 B11R1.12 NCC(CN)c1ccccc1 Amb33172781 [1,1,0,0,0,0|0,0,0]=2 4227 B11R1.12 NCC(CN)c1ccccn1 Amb18065356 [1,1,0,0,0,0|1,0,0]=3 4228 B11R1.12 NCC(CN)c1cccnc1 Amb18065357 [1,1,0,0,0,0|1,0,0]=3 4229 B11R1.12 NCC(CN)c1ccncc1 Amb18065358 [1,1,0,0,0,0|1,0,0]=3 4230 B11R1.12 NCC(CO)c1ccccc1 Amb34006674 [1,1,0,0,0,0|0,0,0]=2 4231 B11R1.12 NCC(CO)c1ccccc1 Amb8631066 [1,1,0,0,0,0|0,0,0]=2 4232 B11R1.12 NCC(CO)c1ccccn1 Amb25265702 [1,1,0,0,0,0|1,0,0]=3 4233 B11R1.12 NCC(CO)c1cccnc1 Amb18644523 [1,1,0,0,0,0|1,0,0]=3 4234 B11R1.12 NCC(CO)c1cccnc1 Amb32664252 [1,1,0,0,0,0|1,0,0]=3 4235 B11R1.12 NCC(CO)c1ccncc1 Amb25990872 [1,1,0,0,0,0|1,0,0]=3 4236 B11R1.12 NCC(CO)c1ccncn1 Amb25285866 [1,1,0,0,0,0|2,0,0]=4 4237 B11R1.12 NCC(CO)c1cnccn1 Amb26506406 [1,1,0,0,0,0|2,0,0]=4 4238 B11R1.12 NCC(CO)c1cncnc1 Amb33465634 [1,1,0,0,0,0|2,0,0]=4 4239 B11R1.12 NCC(CO)c1ncccn1 Amb24454756 [1,1,0,0,0,0|2,0,0]=4 4240 B11R1.12 NC[C@@H](CO)c1ccccc1 Amb27955143 [1,1,0,0,0,0|0,0,0]=2 4241 B11R1.12 NC[C@@H](CO)c1ccccc1 Amb28990112 [1,1,0,0,0,0|0,0,0]=2 4242 B11R1.12 NC[C@H](CO)c1ccccc1 Amb22802423 [1,1,0,0,0,0|0,0,0]=2 4243 B11R1.12 NC\C(=C/Cl)c1ccccc1 Amb34005133 [1,1,0,0,0,0|0,0,2]=4 4244 B11R1.12 NC\C(=C\Br)c1ccccc1 Amb28319127 [1,1,0,0,0,0|0,0,2]=4 4245 B11R1.12 NC\C(=N\O)c1ccccc1 Amb25368564 [1,1,0,0,0,0|1,0,1]=4 4246 B11R1.12 NNC(CO)c1ccccc1 Amb27252003 [1,1,0,0,0,0|1,0,0]=3 4247 B11R1.12 NNC(CO)c1ccccc1 Amb33422027 [1,1,0,0,0,0|1,0,0]=3 4248 B11R1.12 NOC(CO)c1ccccc1 Amb28321529 [1,1,0,0,0,0|1,0,0]=3 4249 B11R1.12 NO[C@H](CO)c1ccccc1 Amb27835967 [1,1,0,0,0,0|1,0,0]=3 4250 B11R1.12 O=CC(CO)c1ccccc1 Amb27488286 [1,1,0,0,0,0|1,0,1]=4 4251 B11R1.12 OCC(CCl)c1ccccc1 Amb27858742 [1,1,0,0,0,0|1,0,0]=3 4252 B11R1.12 OCC(CO)c1ccccc1 Amb4034678 [1,1,0,0,0,0|1,0,0]=3 4253 B11R1.12 OCC(CO)c1ccccn1 Amb9683740 [1,1,0,0,0,0|2,0,0]=4 4254 B11R1.12 OCC(CO)c1cccnc1 Amb33548009 [1,1,0,0,0,0|2,0,0]=4 4255 B11R1.12 OCC(CO)c1ccncc1 Amb28062940 [1,1,0,0,0,0|2,0,0]=4 4256 B11R1.12 OCC(NO)c1ccccc1 Amb27245910 [1,1,0,0,0,0|1,0,0]=3 4257 B11R1.12 OCN(CO)c1ccccc1 Amb27240792 [1,1,0,0,0,0|2,0,0]=4 4258 B11R1.12 OCP(CO)c1ccccc1 Amb22733968 [1,1,0,0,0,0|2,0,0]=4 4259 B11R1.12 [C-]#[N+]C(CC)c1ccccc1 Amb33732679 [1,1,0,0,0,0|0,0,1]=3 4260 B11R1.12 [C-]#[N+][C@@H](CC)c1ccccc1 Amb33747511 [1,1,0,0,0,0|0,0,1]=3 4261 B11R1.12 [C-]#[N+][C@H](CC)c1ccccc1 Amb33732680 [1,1,0,0,0,0|0,0,1]=3 4262 B11R1.22 BrCC(Br)c1ccc(Br)cc1 Amb22359843 [1,1,0,0,0,0|2,0,0]=4 4263 B11R1.22 C#CC(C)c1ccc(Br)cc1 Amb33451484 [1,1,0,0,0,0|0,0,2]=4 4264 B11R1.22 C#CC(C)c1ccc(C)cc1 Amb33373950 [1,1,0,0,0,0|0,0,2]=4 4265 B11R1.22 C#CC(C)c1ccc(Cl)cc1 Amb33052820 [1,1,0,0,0,0|0,0,2]=4 4266 B11R1.22 C#CC(C)c1ccc(F)cc1 Amb33376263 [1,1,0,0,0,0|0,0,2]=4 4267 B11R1.22 C#CC(C)c1ccc(O)cc1 Amb33269079 [1,1,0,0,0,0|0,0,2]=4 4268 B11R1.22 C=C(CC)c1ccc(Br)cc1 Amb20668394 [1,1,0,0,0,0|0,0,2]=4 4269 B11R1.22 C=C(CC)c1ccc(F)cc1 Amb27803524 [1,1,0,0,0,0|0,0,2]=4 4270 B11R1.22 C=C(CN)c1ccc(Br)cc1 Amb25121108 [1,1,0,0,0,0|0,0,2]=4 4271 B11R1.22 C=C(CN)c1ccc(C)cc1 Amb18124857 [1,1,0,0,0,0|0,0,2]=4 4272 B11R1.22 C=C(CN)c1ccc(Cl)cc1 Amb18908725 [1,1,0,0,0,0|0,0,2]=4 4273 B11R1.22 C=C(CN)c1ccc(F)cc1 Amb18125278 [1,1,0,0,0,0|0,0,2]=4 4274 B11R1.22 C=C(CN)c1ccc(O)cc1 Amb26880201 [1,1,0,0,0,0|0,0,2]=4 4275 B11R1.22 C=CC(C)c1ccc(F)cc1 Amb33273695 [1,1,0,0,0,0|0,0,2]=4 4276 B11R1.22 CC(C#N)c1ccc(Br)cc1 Amb17089240 [1,1,0,0,0,0|0,0,2]=4 4277 B11R1.22 CC(C#N)c1ccc(Cl)cc1 Amb17089239 [1,1,0,0,0,0|0,0,2]=4 4278 B11R1.22 CC(C#N)c1ccc(F)cc1 Amb8950022 [1,1,0,0,0,0|0,0,2]=4 4279 B11R1.22 CC(C#N)c1ccc(I)cc1 Amb27617452 [1,1,0,0,0,0|0,0,2]=4 4280 B11R1.22 CC(C#N)c1ccc(N)cc1 Amb6751979 [1,1,0,0,0,0|0,0,2]=4 4281 B11R1.22 CC(C#N)c1ccc(O)cc1 Amb17593672 [1,1,0,0,0,0|0,0,2]=4 4282 B11R1.22 CC(C=O)c1ccc(Br)cc1 Amb17140753 [1,1,0,0,0,0|1,0,1]=4 4283 B11R1.22 CC(C=O)c1ccc(Cl)cc1 Amb33544215 [1,1,0,0,0,0|1,0,1]=4 4284 B11R1.22 CC(C=O)c1ccc(F)cc1 Amb17138438 [1,1,0,0,0,0|1,0,1]=4 4285 B11R1.22 CC(C=O)c1ccc(N)cc1 Amb27443133 [1,1,0,0,0,0|1,0,1]=4 4286 B11R1.22 CC(C=O)c1ccc(O)cc1 Amb18125109 [1,1,0,0,0,0|1,0,1]=4 4287 B11R1.22 CC(CBr)c1ccc(Br)cc1 Amb17280742 [1,1,0,0,0,0|1,0,0]=3 4288 B11R1.22 CC(CBr)c1ccc(Br)cn1 Amb33477163 [1,1,0,0,0,0|2,0,0]=4 4289 B11R1.22 CC(CBr)c1ccc(Br)nc1 Amb33388393 [1,1,0,0,0,0|2,0,0]=4 4290 B11R1.22 CC(CBr)c1ccc(Cl)cc1 Amb17251213 [1,1,0,0,0,0|1,0,0]=3 4291 B11R1.22 CC(CBr)c1ccc(Cl)cn1 Amb33334405 [1,1,0,0,0,0|2,0,0]=4 4292 B11R1.22 CC(CBr)c1ccc(Cl)nc1 Amb33388752 [1,1,0,0,0,0|2,0,0]=4 4293 B11R1.22 CC(CBr)c1ccc(F)cc1 Amb17242467 [1,1,0,0,0,0|1,0,0]=3 4294 B11R1.22 CC(CBr)c1ccc(F)cn1 Amb27594967 [1,1,0,0,0,0|2,0,0]=4 4295 B11R1.22 CC(CBr)c1ccc(F)nc1 Amb33332990 [1,1,0,0,0,0|2,0,0]=4 4296 B11R1.22 CC(CBr)c1ccc(O)cc1 Amb33007174 [1,1,0,0,0,0|1,0,0]=3 4297 B11R1.22 CC(CCl)c1ccc(Br)cc1 Amb17251214 [1,1,0,0,0,0|1,0,0]=3 4298 B11R1.22 CC(CCl)c1ccc(Cl)cc1 Amb17234620 [1,1,0,0,0,0|1,0,0]=3 4299 B11R1.22 CC(CCl)c1ccc(F)cc1 Amb17232923 [1,1,0,0,0,0|1,0,0]=3 4300 B11R1.22 CC(CCl)c1ccc(O)cc1 Amb28458422 [1,1,0,0,0,0|1,0,0]=3 4301 B11R1.22 CC(CF)c1ccc(N)cc1 Amb28251294 [1,1,0,0,0,0|1,0,0]=3 4302 B11R1.22 CC(CN)c1ccc(Br)cc1 Amb17087284 [1,1,0,0,0,0|0,0,0]=2 4303 B11R1.22 CC(CN)c1ccc(Br)cc1 Amb24183885 [1,1,0,0,0,0|0,0,0]=2 4304 B11R1.22 CC(CN)c1ccc(Br)cn1 Amb33502814 [1,1,0,0,0,0|1,0,0]=3 4305 B11R1.22 CC(CN)c1ccc(Br)nc1 Amb33387703 [1,1,0,0,0,0|1,0,0]=3 4306 B11R1.22 CC(CN)c1ccc(Cl)cc1 Amb22234779 [1,1,0,0,0,0|0,0,0]=2 4307 B11R1.22 CC(CN)c1ccc(Cl)cc1 Amb3940069 [1,1,0,0,0,0|0,0,0]=2 4308 B11R1.22 CC(CN)c1ccc(Cl)cn1 Amb28190253 [1,1,0,0,0,0|1,0,0]=3 4309 B11R1.22 CC(CN)c1ccc(Cl)nc1 Amb25187594 [1,1,0,0,0,0|1,0,0]=3 4310 B11R1.22 CC(CN)c1ccc(F)cc1 Amb10610291 [1,1,0,0,0,0|0,0,0]=2 4311 B11R1.22 CC(CN)c1ccc(F)cc1 Amb8950120 [1,1,0,0,0,0|0,0,0]=2 4312 B11R1.22 CC(CN)c1ccc(F)cn1 Amb25151891 [1,1,0,0,0,0|1,0,0]=3 4313 B11R1.22 CC(CN)c1ccc(F)nc1 Amb33426540 [1,1,0,0,0,0|1,0,0]=3 4314 B11R1.22 CC(CN)c1ccc(I)cc1 Amb25092171 [1,1,0,0,0,0|0,0,0]=2 4315 B11R1.22 CC(CN)c1ccc(N)cn1 Amb33502809 [1,1,0,0,0,0|1,0,0]=3 4316 B11R1.22 CC(CN)c1ccc(O)cc1 Amb19957319 [1,1,0,0,0,0|0,0,0]=2 4317 B11R1.22 CC(CN)c1ccc(O)cc1 Amb26872675 [1,1,0,0,0,0|0,0,0]=2 4318 B11R1.22 CC(CN)c1ccc(O)cc1 Amb29837894 [1,1,0,0,0,0|0,0,0]=2 4319 B11R1.22 CC(CN)c1ncc(Br)cn1 Amb26328534 [1,1,0,0,0,0|2,0,0]=4 4320 B11R1.22 CC(CN)c1ncc(Cl)cn1 Amb33494221 [1,1,0,0,0,0|2,0,0]=4 4321 B11R1.22 CC(CO)c1ccc(Br)cc1 Amb17241865 [1,1,0,0,0,0|1,0,0]=3 4322 B11R1.22 CC(CO)c1ccc(Cl)cc1 Amb17232795 [1,1,0,0,0,0|1,0,0]=3 4323 B11R1.22 CC(CO)c1ccc(Cl)nc1 Amb25201855 [1,1,0,0,0,0|2,0,0]=4 4324 B11R1.22 CC(CO)c1ccc(F)cc1 Amb17232131 [1,1,0,0,0,0|1,0,0]=3 4325 B11R1.22 CC(CO)c1ccc(F)cn1 Amb25129979 [1,1,0,0,0,0|2,0,0]=4 4326 B11R1.22 CC(CO)c1ccc(F)nc1 Amb27176724 [1,1,0,0,0,0|2,0,0]=4 4327 B11R1.22 CC(CO)c1ccc(N)cc1 Amb24740868 [1,1,0,0,0,0|1,0,0]=3 4328 B11R1.22 CC(CS)c1ccc(F)cc1 Amb33423593 [1,1,0,0,0,0|1,0,0]=3 4329 B11R1.22 CC(NN)c1ccc(Br)cc1 Amb13951417 [1,1,0,0,0,0|1,0,0]=3 4330 B11R1.22 CC(NN)c1ccc(Br)cc1 Amb28990938 [1,1,0,0,0,0|1,0,0]=3 4331 B11R1.22 CC(NN)c1ccc(Br)cc1 Amb6252295 [1,1,0,0,0,0|1,0,0]=3 4332 B11R1.22 CC(NN)c1ccc(Cl)cc1 Amb13952413 [1,1,0,0,0,0|1,0,0]=3 4333 B11R1.22 CC(NN)c1ccc(Cl)cc1 Amb28990885 [1,1,0,0,0,0|1,0,0]=3 4334 B11R1.22 CC(NN)c1ccc(Cl)cc1 Amb32411826 [1,1,0,0,0,0|1,0,0]=3 4335 B11R1.22 CC(NN)c1ccc(Cl)cc1 Amb6245571 [1,1,0,0,0,0|1,0,0]=3 4336 B11R1.22 CC(NN)c1ccc(Cl)cn1 Amb27236572 [1,1,0,0,0,0|2,0,0]=4 4337 B11R1.22 CC(NN)c1ccc(F)cc1 Amb6249161 [1,1,0,0,0,0|1,0,0]=3 4338 B11R1.22 CC(NO)c1ccc(Br)cc1 Amb17089212 [1,1,0,0,0,0|1,0,0]=3 4339 B11R1.22 CC(NO)c1ccc(Br)cn1 Amb35669881 [1,1,0,0,0,0|2,0,0]=4 4340 B11R1.22 CC(NO)c1ccc(Cl)cc1 Amb17089211 [1,1,0,0,0,0|1,0,0]=3 4341 B11R1.22 CC(NO)c1ccc(Cl)cn1 Amb35676505 [1,1,0,0,0,0|2,0,0]=4 4342 B11R1.22 CC(NO)c1ccc(F)cc1 Amb17089210 [1,1,0,0,0,0|1,0,0]=3 4343 B11R1.22 CC(NO)c1ccc(O)cc1 Amb27785522 [1,1,0,0,0,0|1,0,0]=3 4344 B11R1.22 CC(ON)c1ccc(Br)cc1 Amb17089195 [1,1,0,0,0,0|1,0,0]=3 4345 B11R1.22 CC(ON)c1ccc(Br)cn1 Amb33477133 [1,1,0,0,0,0|2,0,0]=4 4346 B11R1.22 CC(ON)c1ccc(Br)nc1 Amb33388065 [1,1,0,0,0,0|2,0,0]=4 4347 B11R1.22 CC(ON)c1ccc(Cl)cc1 Amb17089194 [1,1,0,0,0,0|1,0,0]=3 4348 B11R1.22 CC(ON)c1ccc(Cl)nc1 Amb27176832 [1,1,0,0,0,0|2,0,0]=4 4349 B11R1.22 CC(ON)c1ccc(F)cc1 Amb17089193 [1,1,0,0,0,0|1,0,0]=3 4350 B11R1.22 CC(ON)c1ccc(F)cn1 Amb33315866 [1,1,0,0,0,0|2,0,0]=4 4351 B11R1.22 CC(ON)c1ccc(F)nc1 Amb33426196 [1,1,0,0,0,0|2,0,0]=4 4352 B11R1.22 CC(ON)c1ccc(O)cc1 Amb33269535 [1,1,0,0,0,0|1,0,0]=3 4353 B11R1.22 CCC(=O)c1ccc(Br)cc1 Amb267378 [1,1,0,0,0,0|1,0,1]=4 4354 B11R1.22 CCC(=O)c1ccc(C)cc1 Amb5740248 [1,1,0,0,0,0|1,0,1]=4 4355 B11R1.22 CCC(=O)c1ccc(Cl)cc1 Amb6365763 [1,1,0,0,0,0|1,0,1]=4 4356 B11R1.22 CCC(=O)c1ccc(F)cc1 Amb2688408 [1,1,0,0,0,0|1,0,1]=4 4357 B11R1.22 CCC(=O)c1ccc(I)cc1 Amb6244842 [1,1,0,0,0,0|1,0,1]=4 4358 B11R1.22 CCC(=O)c1ccc(N)cc1 Amb2610525 [1,1,0,0,0,0|1,0,1]=4 4359 B11R1.22 CCC(=O)c1ccc(N)cc1 Amb34896232 [1,1,0,0,0,0|1,0,1]=4 4360 B11R1.22 CCC(=O)c1ccc(O)cc1 Amb1336085 [1,1,0,0,0,0|1,0,1]=4 4361 B11R1.22 CCC(Br)c1ccc(Br)cc1 Amb8835448 [1,1,0,0,0,0|1,0,0]=3 4362 B11R1.22 CCC(Br)c1ccc(Cl)cc1 Amb8835385 [1,1,0,0,0,0|1,0,0]=3 4363 B11R1.22 CCC(Br)c1ccc(F)nc1 Amb27197637 [1,1,0,0,0,0|2,0,0]=4 4364 B11R1.22 CCC(Br)c1ccc(I)cc1 Amb27776527 [1,1,0,0,0,0|1,0,0]=3 4365 B11R1.22 CCC(C)C1=CNC(=O)N=C1 Amb27777277 [1,1,0,0,0,0|2,0,0]=4 4366 B11R1.22 CCC(C)C1=CNC(=S)N=C1 Amb28240415 [1,1,0,0,0,0|2,0,0]=4 4367 B11R1.22 CCC(C)C1=NNC(=O)C=C1 Amb18181745 [1,1,0,0,0,0|2,0,0]=4 4368 B11R1.22 CCC(C)c1ccc(Br)cc1 Amb6665350 [1,1,0,0,0,0|0,0,0]=2 4369 B11R1.22 CCC(C)c1ccc(Br)cn1 Amb24320381 [1,1,0,0,0,0|1,0,0]=3 4370 B11R1.22 CCC(C)c1ccc(Br)nc1 Amb24320464 [1,1,0,0,0,0|1,0,0]=3 4371 B11R1.22 CCC(C)c1ccc(Br)nn1 Amb24319733 [1,1,0,0,0,0|2,0,0]=4 4372 B11R1.22 CCC(C)c1ccc(Cl)cc1 Amb25715889 [1,1,0,0,0,0|0,0,0]=2 4373 B11R1.22 CCC(C)c1ccc(Cl)nc1 Amb24558910 [1,1,0,0,0,0|1,0,0]=3 4374 B11R1.22 CCC(C)c1ccc(F)cc1 Amb27635784 [1,1,0,0,0,0|0,0,0]=2 4375 B11R1.22 CCC(C)c1ccc(I)cc1 Amb27442333 [1,1,0,0,0,0|0,0,0]=2 4376 B11R1.22 CCC(C)c1ccc(N)cc1 Amb2792850 [1,1,0,0,0,0|0,0,0]=2 4377 B11R1.22 CCC(C)c1ccc(N)cn1 Amb18831279 [1,1,0,0,0,0|1,0,0]=3 4378 B11R1.22 CCC(C)c1ccc(N)nc1 Amb18831286 [1,1,0,0,0,0|1,0,0]=3 4379 B11R1.22 CCC(C)c1ccc(O)cc1 Amb9702814 [1,1,0,0,0,0|0,0,0]=2 4380 B11R1.22 CCC(C)c1ccc(S)cc1 Amb7773582 [1,1,0,0,0,0|0,0,0]=2 4381 B11R1.22 CCC(C)c1cnc(Br)cn1 Amb27602542 [1,1,0,0,0,0|2,0,0]=4 4382 B11R1.22 CCC(C)c1cnc(Br)nc1 Amb24320198 [1,1,0,0,0,0|2,0,0]=4 4383 B11R1.22 CCC(C)c1cnc(Cl)cn1 Amb26327930 [1,1,0,0,0,0|2,0,0]=4 4384 B11R1.22 CCC(C)c1cnc(Cl)nc1 Amb24320199 [1,1,0,0,0,0|2,0,0]=4 4385 B11R1.22 CCC(C)c1ncc(Br)cn1 Amb24319100 [1,1,0,0,0,0|2,0,0]=4 4386 B11R1.22 CCC(C)c1ncc(N)cn1 Amb18960087 [1,1,0,0,0,0|2,0,0]=4 4387 B11R1.22 CCC(Cl)c1ccc(Br)cc1 Amb7766846 [1,1,0,0,0,0|1,0,0]=3 4388 B11R1.22 CCC(Cl)c1ccc(C)cc1 Amb4016677 [1,1,0,0,0,0|1,0,0]=3 4389 B11R1.22 CCC(Cl)c1ccc(Cl)cc1 Amb7766796 [1,1,0,0,0,0|1,0,0]=3 4390 B11R1.22 CCC(Cl)c1ccc(F)cc1 Amb9205028 [1,1,0,0,0,0|1,0,0]=3 4391 B11R1.22 CCC(Cl)c1ccc(F)cn1 Amb27961082 [1,1,0,0,0,0|2,0,0]=4 4392 B11R1.22 CCC(N)c1ccc(Br)cc1 Amb1106008 [1,1,0,0,0,0|1,0,0]=3 4393 B11R1.22 CCC(N)c1ccc(Br)cc1 Amb6893104 [1,1,0,0,0,0|1,0,0]=3 4394 B11R1.22 CCC(N)c1ccc(Br)cn1 Amb27629150 [1,1,0,0,0,0|2,0,0]=4 4395 B11R1.22 CCC(N)c1ccc(Br)nc1 Amb23446257 [1,1,0,0,0,0|2,0,0]=4 4396 B11R1.22 CCC(N)c1ccc(C)cc1 Amb1658898 [1,1,0,0,0,0|1,0,0]=3 4397 B11R1.22 CCC(N)c1ccc(C)cc1 Amb8503302 [1,1,0,0,0,0|1,0,0]=3 4398 B11R1.22 CCC(N)c1ccc(C)cn1 Amb10608373 [1,1,0,0,0,0|2,0,0]=4 4399 B11R1.22 CCC(N)c1ccc(C)cn1 Amb17622203 [1,1,0,0,0,0|2,0,0]=4 4400 B11R1.22 CCC(N)c1ccc(Cl)cc1 Amb1995281 [1,1,0,0,0,0|1,0,0]=3 4401 B11R1.22 CCC(N)c1ccc(Cl)cn1 Amb28314206 [1,1,0,0,0,0|2,0,0]=4 4402 B11R1.22 CCC(N)c1ccc(Cl)nc1 Amb23446918 [1,1,0,0,0,0|2,0,0]=4 4403 B11R1.22 CCC(N)c1ccc(F)cc1 Amb21955200 [1,1,0,0,0,0|1,0,0]=3 4404 B11R1.22 CCC(N)c1ccc(F)cc1 Amb9703738 [1,1,0,0,0,0|1,0,0]=3 4405 B11R1.22 CCC(N)c1ccc(F)nc1 Amb27391606 [1,1,0,0,0,0|2,0,0]=4 4406 B11R1.22 CCC(N)c1ccc(N)cn1 Amb27881599 [1,1,0,0,0,0|2,0,0]=4 4407 B11R1.22 CCC(N)c1ccc(O)cc1 Amb1117697 [1,1,0,0,0,0|1,0,0]=3 4408 B11R1.22 CCC(N)c1ccc(O)cc1 Amb17622108 [1,1,0,0,0,0|1,0,0]=3 4409 B11R1.22 CCC(O)c1ccc(Br)cc1 Amb9703386 [1,1,0,0,0,0|1,0,0]=3 4410 B11R1.22 CCC(O)c1ccc(C)cc1 Amb9703379 [1,1,0,0,0,0|1,0,0]=3 4411 B11R1.22 CCC(O)c1ccc(C)cn1 Amb27858119 [1,1,0,0,0,0|2,0,0]=4 4412 B11R1.22 CCC(O)c1ccc(Cl)cc1 Amb1109844 [1,1,0,0,0,0|1,0,0]=3 4413 B11R1.22 CCC(O)c1ccc(Cl)cn1 Amb27272822 [1,1,0,0,0,0|2,0,0]=4 4414 B11R1.22 CCC(O)c1ccc(F)cc1 Amb1111265 [1,1,0,0,0,0|1,0,0]=3 4415 B11R1.22 CCC(O)c1ccc(F)cn1 Amb33550559 [1,1,0,0,0,0|2,0,0]=4 4416 B11R1.22 CCC(O)c1ccc(I)cc1 Amb26869478 [1,1,0,0,0,0|1,0,0]=3 4417 B11R1.22 CCC(O)c1ccc(N)cc1 Amb2697290 [1,1,0,0,0,0|1,0,0]=3 4418 B11R1.22 CCC(O)c1ccc(N)cn1 Amb35622097 [1,1,0,0,0,0|2,0,0]=4 4419 B11R1.22 CCC(O)c1ccc(O)cc1 Amb9704428 [1,1,0,0,0,0|1,0,0]=3 4420 B11R1.22 CCC(O)c1ccc(O)nc1 Amb23446711 [1,1,0,0,0,0|2,0,0]=4 4421 B11R1.22 CCC(S)c1ccc(Br)cc1 Amb7784776 [1,1,0,0,0,0|1,0,0]=3 4422 B11R1.22 CCC(S)c1ccc(C)cc1 Amb9208018 [1,1,0,0,0,0|1,0,0]=3 4423 B11R1.22 CCC(S)c1ccc(Cl)cc1 Amb9208019 [1,1,0,0,0,0|1,0,0]=3 4424 B11R1.22 CCC(S)c1ccc(F)cc1 Amb9208016 [1,1,0,0,0,0|1,0,0]=3 4425 B11R1.22 CCC(S)c1ccc(F)cn1 Amb25710915 [1,1,0,0,0,0|2,0,0]=4 4426 B11R1.22 CCC(S)c1ccc(O)cc1 Amb7784759 [1,1,0,0,0,0|1,0,0]=3 4427 B11R1.22 CCN(C)c1ccc(Br)cn1 Amb20617695 [1,1,0,0,0,0|2,0,0]=4 4428 B11R1.22 CCN(C)c1ccc(Br)nc1 Amb20617665 [1,1,0,0,0,0|2,0,0]=4 4429 B11R1.22 CCN(C)c1ccc(N)cc1 Amb33868891 [1,1,0,0,0,0|1,0,0]=3 4430 B11R1.22 CCN(C)c1ccc(N)cc1 Amb7765992 [1,1,0,0,0,0|1,0,0]=3 4431 B11R1.22 CCN(C)c1ccc(N)cn1 Amb8890480 [1,1,0,0,0,0|2,0,0]=4 4432 B11R1.22 CCN(C)c1ccc(N)nc1 Amb8890471 [1,1,0,0,0,0|2,0,0]=4 4433 B11R1.22 CCN(C)c1ccc(O)cc1 Amb28200001 [1,1,0,0,0,0|1,0,0]=3 4434 B11R1.22 CCN(N)c1ccc(C)cc1 Amb18799372 [1,1,0,0,0,0|2,0,0]=4 4435 B11R1.22 CCS(=O)c1ccc(Cl)cc1 Amb27215747 [1,1,0,0,0,0|2,0,0]=4 4436 B11R1.22 CC[C@@H](C)c1ccc(F)cc1 Amb26848779 [1,1,0,0,0,0|0,0,0]=2 4437 B11R1.22 CC[C@@H](N)c1ccc(Br)cc1 Amb23440385 [1,1,0,0,0,0|1,0,0]=3 4438 B11R1.22 CC[C@@H](N)c1ccc(Br)cc1 Amb27390209 [1,1,0,0,0,0|1,0,0]=3 4439 B11R1.22 CC[C@@H](N)c1ccc(Cl)cc1 Amb22288632 [1,1,0,0,0,0|1,0,0]=3 4440 B11R1.22 CC[C@@H](N)c1ccc(Cl)cc1 Amb22747472 [1,1,0,0,0,0|1,0,0]=3 4441 B11R1.22 CC[C@@H](N)c1ccc(Cl)nc1 Amb27800221 [1,1,0,0,0,0|2,0,0]=4 4442 B11R1.22 CC[C@@H](N)c1ccc(F)cc1 Amb22298536 [1,1,0,0,0,0|1,0,0]=3 4443 B11R1.22 CC[C@@H](N)c1ccc(F)cc1 Amb26852363 [1,1,0,0,0,0|1,0,0]=3 4444 B11R1.22 CC[C@@H](N)c1ccc(N)cc1 Amb27815084 [1,1,0,0,0,0|1,0,0]=3 4445 B11R1.22 CC[C@@H](N)c1ccc(N)cn1 Amb28314148 [1,1,0,0,0,0|2,0,0]=4 4446 B11R1.22 CC[C@@H](N)c1ccc(N)nc1 Amb27760013 [1,1,0,0,0,0|2,0,0]=4 4447 B11R1.22 CC[C@@H](N)c1ccc(S)nc1 Amb28141822 [1,1,0,0,0,0|2,0,0]=4 4448 B11R1.22 CC[C@@H](O)c1ccc(C)cc1 Amb27399936 [1,1,0,0,0,0|1,0,0]=3 4449 B11R1.22 CC[C@@H](O)c1ccc(C)cn1 Amb27855182 [1,1,0,0,0,0|2,0,0]=4 4450 B11R1.22 CC[C@@H](O)c1ccc(Cl)cc1 Amb20240761 [1,1,0,0,0,0|1,0,0]=3 4451 B11R1.22 CC[C@@H](O)c1ccc(F)cc1 Amb20240757 [1,1,0,0,0,0|1,0,0]=3 4452 B11R1.22 CC[C@H](C)C1=CNC(=O)C=C1 Amb27483036 [1,1,0,0,0,0|1,0,0]=3 4453 B11R1.22 CC[C@H](C)C1=CNC(=O)N=C1 Amb26433694 [1,1,0,0,0,0|2,0,0]=4 4454 B11R1.22 CC[C@H](N)c1ccc(Br)cc1 Amb33872478 [1,1,0,0,0,0|1,0,0]=3 4455 B11R1.22 CC[C@H](N)c1ccc(C)cc1 Amb28320710 [1,1,0,0,0,0|1,0,0]=3 4456 B11R1.22 CC[C@H](N)c1ccc(Cl)cc1 Amb22288689 [1,1,0,0,0,0|1,0,0]=3 4457 B11R1.22 CC[C@H](N)c1ccc(Cl)cc1 Amb25848651 [1,1,0,0,0,0|1,0,0]=3 4458 B11R1.22 CC[C@H](N)c1ccc(F)cc1 Amb22298579 [1,1,0,0,0,0|1,0,0]=3 4459 B11R1.22 CC[C@H](N)c1ccc(F)cc1 Amb24477560 [1,1,0,0,0,0|1,0,0]=3 4460 B11R1.22 CC[C@H](N)c1ccc(N)cn1 Amb27975651 [1,1,0,0,0,0|2,0,0]=4 4461 B11R1.22 CC[C@H](O)c1ccc(Br)cc1 Amb26332248 [1,1,0,0,0,0|1,0,0]=3 4462 B11R1.22 CC[C@H](O)c1ccc(C)cn1 Amb27959388 [1,1,0,0,0,0|2,0,0]=4 4463 B11R1.22 CC[C@H](O)c1ccc(Cl)cc1 Amb19889432 [1,1,0,0,0,0|1,0,0]=3 4464 B11R1.22 CC[C@H](O)c1ccc(F)cc1 Amb26505561 [1,1,0,0,0,0|1,0,0]=3 4465 B11R1.22 CC[C@H](O)c1ccc(I)cc1 Amb25732463 [1,1,0,0,0,0|1,0,0]=3 4466 B11R1.22 CC[C@H](O)c1ccc(O)cc1 Amb27258200 [1,1,0,0,0,0|1,0,0]=3 4467 B11R1.22 CNC(=N)c1ccc(Br)cc1 Amb27175134 [1,1,0,0,0,0|1,0,1]=4 4468 B11R1.22 CNC(=N)c1ccc(C)cc1 Amb8480217 [1,1,0,0,0,0|1,0,1]=4 4469 B11R1.22 CNC(=O)c1ccc(Br)cc1 Amb1232931 [1,1,0,0,0,0|1,0,1]=4 4470 B11R1.22 CNC(=O)c1ccc(C)cc1 Amb2721101 [1,1,0,0,0,0|1,0,1]=4 4471 B11R1.22 CNC(=O)c1ccc(Cl)cc1 Amb2707199 [1,1,0,0,0,0|1,0,1]=4 4472 B11R1.22 CNC(=O)c1ccc(F)cc1 Amb3886603 [1,1,0,0,0,0|1,0,1]=4 4473 B11R1.22 CNC(=O)c1ccc(I)cc1 Amb1230427 [1,1,0,0,0,0|1,0,1]=4 4474 B11R1.22 CNC(=O)c1ccc(N)cc1 Amb6334818 [1,1,0,0,0,0|1,0,1]=4 4475 B11R1.22 CNC(=O)c1ccc(O)cc1 Amb6671651 [1,1,0,0,0,0|1,0,1]=4 4476 B11R1.22 CNC(=O)c1ccc(S)cc1 Amb24486099 [1,1,0,0,0,0|1,0,1]=4 4477 B11R1.22 CNC(=S)c1ccc(Cl)cc1 Amb28436657 [1,1,0,0,0,0|1,0,1]=4 4478 B11R1.22 CNC(=S)c1ccc(O)cc1 Amb28056735 [1,1,0,0,0,0|1,0,1]=4 4479 B11R1.22 CNC(C)c1ccc(Br)cc1 Amb1128441 [1,1,0,0,0,0|0,0,0]=2 4480 B11R1.22 CNC(C)c1ccc(Br)cn1 Amb27253063 [1,1,0,0,0,0|1,0,0]=3 4481 B11R1.22 CNC(C)c1ccc(Br)nc1 Amb27839631 [1,1,0,0,0,0|1,0,0]=3 4482 B11R1.22 CNC(C)c1ccc(C)cc1 Amb9706282 [1,1,0,0,0,0|0,0,0]=2 4483 B11R1.22 CNC(C)c1ccc(C)nn1 Amb28323343 [1,1,0,0,0,0|2,0,0]=4 4484 B11R1.22 CNC(C)c1ccc(Cl)cc1 Amb1136258 [1,1,0,0,0,0|0,0,0]=2 4485 B11R1.22 CNC(C)c1ccc(Cl)cc1 Amb22587853 [1,1,0,0,0,0|0,0,0]=2 4486 B11R1.22 CNC(C)c1ccc(Cl)cn1 Amb25141809 [1,1,0,0,0,0|1,0,0]=3 4487 B11R1.22 CNC(C)c1ccc(F)cc1 Amb453184 [1,1,0,0,0,0|0,0,0]=2 4488 B11R1.22 CNC(C)c1ccc(F)cc1 Amb9745719 [1,1,0,0,0,0|0,0,0]=2 4489 B11R1.22 CNC(C)c1ccc(N)cc1 Amb27630273 [1,1,0,0,0,0|0,0,0]=2 4490 B11R1.22 CNC(C)c1ccc(N)cn1 Amb27792942 [1,1,0,0,0,0|1,0,0]=3 4491 B11R1.22 CNC(C)c1ccc(O)cc1 Amb1118673 [1,1,0,0,0,0|0,0,0]=2 4492 B11R1.22 CNC(C)c1ccc(O)cc1 Amb6751806 [1,1,0,0,0,0|0,0,0]=2 4493 B11R1.22 CNC(C)c1ccc(O)cn1 Amb27491445 [1,1,0,0,0,0|1,0,0]=3 4494 B11R1.22 CNS(=O)c1ccc(N)cc1 Amb18862841 [1,1,0,0,0,0|2,0,0]=4 4495 B11R1.22 CN[C@@H](C)c1ccc(Br)cc1 Amb23440431 [1,1,0,0,0,0|0,0,0]=2 4496 B11R1.22 CN[C@@H](C)c1ccc(Br)cc1 Amb27605978 [1,1,0,0,0,0|0,0,0]=2 4497 B11R1.22 CN[C@@H](C)c1ccc(Br)nc1 Amb27945296 [1,1,0,0,0,0|1,0,0]=3 4498 B11R1.22 CN[C@@H](C)c1ccc(C)cn1 Amb27658707 [1,1,0,0,0,0|1,0,0]=3 4499 B11R1.22 CN[C@@H](C)c1ccc(Cl)cc1 Amb24487722 [1,1,0,0,0,0|0,0,0]=2 4500 B11R1.22 CN[C@@H](C)c1ccc(Cl)cc1 Amb30869501 [1,1,0,0,0,0|0,0,0]=2 4501 B11R1.22 CN[C@@H](C)c1ccc(F)cc1 Amb10841308 [1,1,0,0,0,0|0,0,0]=2 4502 B11R1.22 CN[C@@H](C)c1ccc(F)nc1 Amb27204165 [1,1,0,0,0,0|1,0,0]=3 4503 B11R1.22 CN[C@@H](C)c1ccc(I)nc1 Amb27945155 [1,1,0,0,0,0|1,0,0]=3 4504 B11R1.22 CN[C@@H](C)c1ccc(N)cc1 Amb27490745 [1,1,0,0,0,0|0,0,0]=2 4505 B11R1.22 CN[C@@H](C)c1ccc(N)cn1 Amb27213170 [1,1,0,0,0,0|1,0,0]=3 4506 B11R1.22 CN[C@@H](C)c1ccc(O)cc1 Amb27470726 [1,1,0,0,0,0|0,0,0]=2 4507 B11R1.22 CN[C@@H](C)c1ccc(O)nc1 Amb28239622 [1,1,0,0,0,0|1,0,0]=3 4508 B11R1.22 CN[C@H](C)c1ccc(Br)cn1 Amb28040680 [1,1,0,0,0,0|1,0,0]=3 4509 B11R1.22 CN[C@H](C)c1ccc(Cl)cc1 Amb24657259 [1,1,0,0,0,0|0,0,0]=2 4510 B11R1.22 CN[C@H](C)c1ccc(Cl)cc1 Amb33872249 [1,1,0,0,0,0|0,0,0]=2 4511 B11R1.22 CN[C@H](C)c1ccc(F)nc1 Amb27798720 [1,1,0,0,0,0|1,0,0]=3 4512 B11R1.22 CN[C@H](C)c1ccc(O)cc1 Amb27617388 [1,1,0,0,0,0|0,0,0]=2 4513 B11R1.22 CN[C@H](C)c1ccc(S)cc1 Amb27974489 [1,1,0,0,0,0|0,0,0]=2 4514 B11R1.22 COC(C)c1ccc(Br)cc1 Amb9173692 [1,1,0,0,0,0|1,0,0]=3 4515 B11R1.22 COC(C)c1ccc(F)cc1 Amb18633172 [1,1,0,0,0,0|1,0,0]=3 4516 B11R1.22 COC(C)c1ccc(I)cc1 Amb23568516 [1,1,0,0,0,0|1,0,0]=3 4517 B11R1.22 COC(C)c1ccc(N)cc1 Amb18952191 [1,1,0,0,0,0|1,0,0]=3 4518 B11R1.22 COC(C)c1ccc(S)cc1 Amb23568715 [1,1,0,0,0,0|1,0,0]=3 4519 B11R1.22 COC(Cl)c1ccc(Cl)cc1 Amb27863573 [1,1,0,0,0,0|2,0,0]=4 4520 B11R1.22 COC(O)c1ccc(Cl)cc1 Amb28125744 [1,1,0,0,0,0|2,0,0]=4 4521 B11R1.22 CO[C@@H](C)c1ccc(Br)cc1 Amb27783049 [1,1,0,0,0,0|1,0,0]=3 4522 B11R1.22 CO[C@@H](C)c1ccc(F)cc1 Amb27263640 [1,1,0,0,0,0|1,0,0]=3 4523 B11R1.22 CSC(C)c1ccc(Cl)cc1 Amb27982627 [1,1,0,0,0,0|1,0,0]=3 4524 B11R1.22 C[C@@H](C=O)c1ccc(Cl)cc1 Amb27176338 [1,1,0,0,0,0|1,0,1]=4 4525 B11R1.22 C[C@@H](CN)c1ccc(F)cc1 Amb33738456 [1,1,0,0,0,0|0,0,0]=2 4526 B11R1.22 C[C@@H](CN)c1ccc(F)cn1 Amb33728847 [1,1,0,0,0,0|1,0,0]=3 4527 B11R1.22 C[C@@H](CO)c1ccc(Cl)cc1 Amb27808771 [1,1,0,0,0,0|1,0,0]=3 4528 B11R1.22 C[C@@H](CO)c1ccc(F)cc1 Amb24068206 [1,1,0,0,0,0|1,0,0]=3 4529 B11R1.22 C[C@@H](CO)c1ccc(F)cn1 Amb33746802 [1,1,0,0,0,0|2,0,0]=4 4530 B11R1.22 C[C@@H](NO)c1ccc(Br)cc1 Amb26640533 [1,1,0,0,0,0|1,0,0]=3 4531 B11R1.22 C[C@@H](NO)c1ccc(F)cc1 Amb27171417 [1,1,0,0,0,0|1,0,0]=3 4532 B11R1.22 C[C@H](C=O)c1ccc(Cl)cc1 Amb27224785 [1,1,0,0,0,0|1,0,1]=4 4533 B11R1.22 C[C@H](CN)c1ccc(F)cc1 Amb26931830 [1,1,0,0,0,0|0,0,0]=2 4534 B11R1.22 C[C@H](CN)c1ccc(F)cn1 Amb33747912 [1,1,0,0,0,0|1,0,0]=3 4535 B11R1.22 C[C@H](CO)c1ccc(F)cc1 Amb24068260 [1,1,0,0,0,0|1,0,0]=3 4536 B11R1.22 C[C@H](CO)c1ccc(F)cn1 Amb33727984 [1,1,0,0,0,0|2,0,0]=4 4537 B11R1.22 C[C@H](NO)c1ccc(Br)cc1 Amb27469901 [1,1,0,0,0,0|1,0,0]=3 4538 B11R1.22 C[C@H](NO)c1ccc(O)cc1 Amb27172118 [1,1,0,0,0,0|1,0,0]=3 4539 B11R1.22 C\C(=N/N)c1ccc(C)cc1 Amb4019900 [1,1,0,0,0,0|1,0,1]=4 4540 B11R1.22 C\C(=N/N)c1ccc(N)cc1 Amb27225960 [1,1,0,0,0,0|1,0,1]=4 4541 B11R1.22 C\C(=N\N)c1ccc(Br)cc1 Amb10552972 [1,1,0,0,0,0|1,0,1]=4 4542 B11R1.22 C\C(=N\N)c1ccc(C)cc1 Amb27840228 [1,1,0,0,0,0|1,0,1]=4 4543 B11R1.22 Cc1ccc(C(=O)CN)cc1 Amb2693534 [1,1,0,0,0,0|1,0,1]=4 4544 B11R1.22 Cc1ccc(C(=O)CN)cc1 Amb33513193 [1,1,0,0,0,0|1,0,1]=4 4545 B11R1.22 Cc1ccc(C(=O)CN)cc1 Amb5739530 [1,1,0,0,0,0|1,0,1]=4 4546 B11R1.22 Cc1ccc(C(C)C#N)cc1 Amb8950030 [1,1,0,0,0,0|0,0,2]=4 4547 B11R1.22 Cc1ccc(C(C)C=O)cc1 Amb10844730 [1,1,0,0,0,0|1,0,1]=4 4548 B11R1.22 Cc1ccc(C(C)CBr)cc1 Amb17241353 [1,1,0,0,0,0|1,0,0]=3 4549 B11R1.22 Cc1ccc(C(C)CBr)cn1 Amb33432211 [1,1,0,0,0,0|2,0,0]=4 4550 B11R1.22 Cc1ccc(C(C)CBr)nc1 Amb33336330 [1,1,0,0,0,0|2,0,0]=4 4551 B11R1.22 Cc1ccc(C(C)CCl)cc1 Amb17232692 [1,1,0,0,0,0|1,0,0]=3 4552 B11R1.22 Cc1ccc(C(C)CCl)nc1 Amb27260822 [1,1,0,0,0,0|2,0,0]=4 4553 B11R1.22 Cc1ccc(C(C)CN)cc1 Amb8950127 [1,1,0,0,0,0|0,0,0]=2 4554 B11R1.22 Cc1ccc(C(C)CN)cn1 Amb27218261 [1,1,0,0,0,0|1,0,0]=3 4555 B11R1.22 Cc1ccc(C(C)CN)nc1 Amb33502812 [1,1,0,0,0,0|1,0,0]=3 4556 B11R1.22 Cc1ccc(C(C)CO)cc1 Amb17232071 [1,1,0,0,0,0|1,0,0]=3 4557 B11R1.22 Cc1ccc(C(C)CO)cn1 Amb33748315 [1,1,0,0,0,0|2,0,0]=4 4558 B11R1.22 Cc1ccc(C(C)NN)cn1 Amb27247891 [1,1,0,0,0,0|2,0,0]=4 4559 B11R1.22 Cc1ccc(C(C)NO)cc1 Amb17089203 [1,1,0,0,0,0|1,0,0]=3 4560 B11R1.22 Cc1ccc(C(C)ON)cc1 Amb17089186 [1,1,0,0,0,0|1,0,0]=3 4561 B11R1.22 Cc1ccc(C(C)ON)cn1 Amb32877854 [1,1,0,0,0,0|2,0,0]=4 4562 B11R1.22 Cc1ccc(C(C)ON)nc1 Amb33198540 [1,1,0,0,0,0|2,0,0]=4 4563 B11R1.22 Cc1ccc(C(Cl)CO)cc1 Amb27835140 [1,1,0,0,0,0|2,0,0]=4 4564 B11R1.22 Cc1ccc(C(F)CBr)cc1 Amb27639277 [1,1,0,0,0,0|2,0,0]=4 4565 B11R1.22 Cc1ccc(C(F)CCl)cc1 Amb27400293 [1,1,0,0,0,0|2,0,0]=4 4566 B11R1.22 Cc1ccc(C(F)CN)cc1 Amb28059153 [1,1,0,0,0,0|1,0,0]=3 4567 B11R1.22 Cc1ccc(C(F)CN)cn1 Amb28128363 [1,1,0,0,0,0|2,0,0]=4 4568 B11R1.22 Cc1ccc(C(F)CN)nc1 Amb33198850 [1,1,0,0,0,0|2,0,0]=4 4569 B11R1.22 Cc1ccc(C(F)CO)cc1 Amb28206185 [1,1,0,0,0,0|2,0,0]=4 4570 B11R1.22 Cc1ccc(C(N)CF)cc1 Amb25326298 [1,1,0,0,0,0|2,0,0]=4 4571 B11R1.22 Cc1ccc(C(N)CF)cc1 Amb28872332 [1,1,0,0,0,0|2,0,0]=4 4572 B11R1.22 Cc1ccc(C(N)CN)cn1 Amb27592396 [1,1,0,0,0,0|2,0,0]=4 4573 B11R1.22 Cc1ccc(C(N)CO)cc1 Amb2236213 [1,1,0,0,0,0|2,0,0]=4 4574 B11R1.22 Cc1ccc(C(N)CS)cc1 Amb27653314 [1,1,0,0,0,0|2,0,0]=4 4575 B11R1.22 Cc1ccc(C(O)CBr)cc1 Amb17206106 [1,1,0,0,0,0|2,0,0]=4 4576 B11R1.22 Cc1ccc(C(O)CCl)cc1 Amb17194483 [1,1,0,0,0,0|2,0,0]=4 4577 B11R1.22 Cc1ccc(C(O)CI)cc1 Amb27836111 [1,1,0,0,0,0|2,0,0]=4 4578 B11R1.22 Cc1ccc(C(O)CN)cc1 Amb1108558 [1,1,0,0,0,0|1,0,0]=3 4579 B11R1.22 Cc1ccc(C(O)CN)cc1 Amb20668083 [1,1,0,0,0,0|1,0,0]=3 4580 B11R1.22 Cc1ccc(C(O)CN)cc1 Amb2697589 [1,1,0,0,0,0|1,0,0]=3 4581 B11R1.22 Cc1ccc(C(O)CN)cn1 Amb3774223 [1,1,0,0,0,0|2,0,0]=4 4582 B11R1.22 Cc1ccc(C(O)CN)nc1 Amb26634202 [1,1,0,0,0,0|2,0,0]=4 4583 B11R1.22 Cc1ccc(C(O)CO)cc1 Amb18563446 [1,1,0,0,0,0|2,0,0]=4 4584 B11R1.22 Cc1ccc([C@@H](C)C=O)cc1 Amb27635261 [1,1,0,0,0,0|1,0,1]=4 4585 B11R1.22 Cc1ccc([C@@H](C)CBr)cc1 Amb27619638 [1,1,0,0,0,0|1,0,0]=3 4586 B11R1.22 Cc1ccc([C@@H](C)CN)cc1 Amb25872704 [1,1,0,0,0,0|0,0,0]=2 4587 B11R1.22 Cc1ccc([C@@H](C)CN)cn1 Amb33727424 [1,1,0,0,0,0|1,0,0]=3 4588 B11R1.22 Cc1ccc([C@@H](C)CO)cc1 Amb25847636 [1,1,0,0,0,0|1,0,0]=3 4589 B11R1.22 Cc1ccc([C@@H](C)CO)cn1 Amb33735557 [1,1,0,0,0,0|2,0,0]=4 4590 B11R1.22 Cc1ccc([C@@H](C)NO)cc1 Amb25715423 [1,1,0,0,0,0|1,0,0]=3 4591 B11R1.22 Cc1ccc([C@@H](N)CN)cn1 Amb27205093 [1,1,0,0,0,0|2,0,0]=4 4592 B11R1.22 Cc1ccc([C@@H](N)CO)cc1 Amb22756871 [1,1,0,0,0,0|2,0,0]=4 4593 B11R1.22 Cc1ccc([C@@H](N)CO)cc1 Amb30634212 [1,1,0,0,0,0|2,0,0]=4 4594 B11R1.22 Cc1ccc([C@@H](O)CCl)cc1 Amb26847861 [1,1,0,0,0,0|2,0,0]=4 4595 B11R1.22 Cc1ccc([C@@H](O)CN)cc1 Amb24700467 [1,1,0,0,0,0|1,0,0]=3 4596 B11R1.22 Cc1ccc([C@@H](O)CN)cc1 Amb28652856 [1,1,0,0,0,0|1,0,0]=3 4597 B11R1.22 Cc1ccc([C@@H](O)CN)cn1 Amb32879610 [1,1,0,0,0,0|2,0,0]=4 4598 B11R1.22 Cc1ccc([C@@H](O)CN)nc1 Amb33198849 [1,1,0,0,0,0|2,0,0]=4 4599 B11R1.22 Cc1ccc([C@H](C)C=O)cc1 Amb27176434 [1,1,0,0,0,0|1,0,1]=4 4600 B11R1.22 Cc1ccc([C@H](C)CN)cc1 Amb24622476 [1,1,0,0,0,0|0,0,0]=2 4601 B11R1.22 Cc1ccc([C@H](C)CN)cn1 Amb33740283 [1,1,0,0,0,0|1,0,0]=3 4602 B11R1.22 Cc1ccc([C@H](C)CO)cc1 Amb26490162 [1,1,0,0,0,0|1,0,0]=3 4603 B11R1.22 Cc1ccc([C@H](C)CO)cn1 Amb33730463 [1,1,0,0,0,0|2,0,0]=4 4604 B11R1.22 Cc1ccc([C@H](C)NO)cc1 Amb27217870 [1,1,0,0,0,0|1,0,0]=3 4605 B11R1.22 Cc1ccc([C@H](Cl)CN)cc1 Amb27440432 [1,1,0,0,0,0|1,0,0]=3 4606 B11R1.22 Cc1ccc([C@H](N)CN)nc1 Amb27655546 [1,1,0,0,0,0|2,0,0]=4 4607 B11R1.22 Cc1ccc([C@H](N)CO)cc1 Amb24453198 [1,1,0,0,0,0|2,0,0]=4 4608 B11R1.22 Cc1ccc([C@H](N)CO)cc1 Amb33801819 [1,1,0,0,0,0|2,0,0]=4 4609 B11R1.22 Cc1ccc([C@H](O)CCl)cc1 Amb27865528 [1,1,0,0,0,0|2,0,0]=4 4610 B11R1.22 Cc1ccc([C@H](O)CF)cc1 Amb27960895 [1,1,0,0,0,0|2,0,0]=4 4611 B11R1.22 Cc1ccc([C@H](O)CN)cc1 Amb20241479 [1,1,0,0,0,0|1,0,0]=3 4612 B11R1.22 Cc1ccc([C@H](O)CN)cc1 Amb33447026 [1,1,0,0,0,0|1,0,0]=3 4613 B11R1.22 Cc1ccc([C@H](O)CN)cn1 Amb32878598 [1,1,0,0,0,0|2,0,0]=4 4614 B11R1.22 Cc1ccc([C@H](O)CN)nc1 Amb33198848 [1,1,0,0,0,0|2,0,0]=4 4615 B11R1.22 Cc1cnc(C(C)CN)cn1 Amb33375105 [1,1,0,0,0,0|2,0,0]=4 4616 B11R1.22 Cc1cnc(C(C)CN)nc1 Amb24477619 [1,1,0,0,0,0|2,0,0]=4 4617 B11R1.22 Clc1ccc(C(Br)CBr)cc1 Amb22336834 [1,1,0,0,0,0|2,0,0]=4 4618 B11R1.22 Clc1ccc(C(Cl)CBr)cc1 Amb28197615 [1,1,0,0,0,0|2,0,0]=4 4619 B11R1.22 FC(CBr)c1ccc(Br)cc1 Amb33457855 [1,1,0,0,0,0|2,0,0]=4 4620 B11R1.22 FC(CBr)c1ccc(Cl)cc1 Amb22325255 [1,1,0,0,0,0|2,0,0]=4 4621 B11R1.22 FCC(Cl)c1ccc(Cl)cc1 Amb27666866 [1,1,0,0,0,0|2,0,0]=4 4622 B11R1.22 Fc1ccc(C(Br)CBr)cc1 Amb8384912 [1,1,0,0,0,0|2,0,0]=4 4623 B11R1.22 Fc1ccc(C(F)CBr)cc1 Amb24053884 [1,1,0,0,0,0|2,0,0]=4 4624 B11R1.22 NC(CBr)c1ccc(Br)cc1 Amb32753101 [1,1,0,0,0,0|2,0,0]=4 4625 B11R1.22 NC(CF)c1ccc(Br)cc1 Amb20247218 [1,1,0,0,0,0|2,0,0]=4 4626 B11R1.22 NC(CF)c1ccc(Br)cc1 Amb32651827 [1,1,0,0,0,0|2,0,0]=4 4627 B11R1.22 NC(CF)c1ccc(Cl)cc1 Amb25921028 [1,1,0,0,0,0|2,0,0]=4 4628 B11R1.22 NC(CF)c1ccc(Cl)cc1 Amb33330569 [1,1,0,0,0,0|2,0,0]=4 4629 B11R1.22 NC(CF)c1ccc(F)cc1 Amb2372602 [1,1,0,0,0,0|2,0,0]=4 4630 B11R1.22 NC(CF)c1ccc(F)cc1 Amb32671445 [1,1,0,0,0,0|2,0,0]=4 4631 B11R1.22 NC(CF)c1ccc(O)cc1 Amb25913836 [1,1,0,0,0,0|2,0,0]=4 4632 B11R1.22 NC(CO)c1ccc(Br)cc1 Amb17242181 [1,1,0,0,0,0|2,0,0]=4 4633 B11R1.22 NC(CO)c1ccc(Br)cc1 Amb2236272 [1,1,0,0,0,0|2,0,0]=4 4634 B11R1.22 NC(CO)c1ccc(Br)cc1 Amb33551420 [1,1,0,0,0,0|2,0,0]=4 4635 B11R1.22 NC(CO)c1ccc(Cl)cc1 Amb17232854 [1,1,0,0,0,0|2,0,0]=4 4636 B11R1.22 NC(CO)c1ccc(Cl)cc1 Amb33533915 [1,1,0,0,0,0|2,0,0]=4 4637 B11R1.22 NC(CO)c1ccc(F)cc1 Amb19279201 [1,1,0,0,0,0|2,0,0]=4 4638 B11R1.22 NC(CO)c1ccc(F)cc1 Amb8855229 [1,1,0,0,0,0|2,0,0]=4 4639 B11R1.22 NC(CO)c1ccc(I)cc1 Amb25696543 [1,1,0,0,0,0|2,0,0]=4 4640 B11R1.22 NCC(=O)c1ccc(Br)cc1 Amb1811968 [1,1,0,0,0,0|1,0,1]=4 4641 B11R1.22 NCC(=O)c1ccc(Br)cc1 Amb2728641 [1,1,0,0,0,0|1,0,1]=4 4642 B11R1.22 NCC(=O)c1ccc(Br)cc1 Amb3940739 [1,1,0,0,0,0|1,0,1]=4 4643 B11R1.22 NCC(=O)c1ccc(Cl)cc1 Amb1208662 [1,1,0,0,0,0|1,0,1]=4 4644 B11R1.22 NCC(=O)c1ccc(Cl)cc1 Amb2370537 [1,1,0,0,0,0|1,0,1]=4 4645 B11R1.22 NCC(=O)c1ccc(F)cc1 Amb1419069 [1,1,0,0,0,0|1,0,1]=4 4646 B11R1.22 NCC(=O)c1ccc(F)cc1 Amb5739537 [1,1,0,0,0,0|1,0,1]=4 4647 B11R1.22 NCC(=O)c1ccc(F)cc1 Amb6384072 [1,1,0,0,0,0|1,0,1]=4 4648 B11R1.22 NCC(=O)c1ccc(I)cc1 Amb21962789 [1,1,0,0,0,0|1,0,1]=4 4649 B11R1.22 NCC(=O)c1ccc(I)cc1 Amb25876415 [1,1,0,0,0,0|1,0,1]=4 4650 B11R1.22 NCC(=O)c1ccc(O)cc1 Amb17593762 [1,1,0,0,0,0|1,0,1]=4 4651 B11R1.22 NCC(=O)c1ccc(O)cc1 Amb22001575 [1,1,0,0,0,0|1,0,1]=4 4652 B11R1.22 NCC(Br)c1ccc(Cl)cc1 Amb28455336 [1,1,0,0,0,0|1,0,0]=3 4653 B11R1.22 NCC(Cl)c1ccc(Cl)cc1 Amb27840216 [1,1,0,0,0,0|1,0,0]=3 4654 B11R1.22 NCC(Cl)c1ccc(F)cc1 Amb28055857 [1,1,0,0,0,0|1,0,0]=3 4655 B11R1.22 NCC(F)c1ccc(Br)cc1 Amb23454846 [1,1,0,0,0,0|1,0,0]=3 4656 B11R1.22 NCC(F)c1ccc(Br)cc1 Amb31204731 [1,1,0,0,0,0|1,0,0]=3 4657 B11R1.22 NCC(F)c1ccc(Br)cn1 Amb33477476 [1,1,0,0,0,0|2,0,0]=4 4658 B11R1.22 NCC(F)c1ccc(Br)nc1 Amb33388034 [1,1,0,0,0,0|2,0,0]=4 4659 B11R1.22 NCC(F)c1ccc(Cl)cc1 Amb28250541 [1,1,0,0,0,0|1,0,0]=3 4660 B11R1.22 NCC(F)c1ccc(Cl)nc1 Amb33261572 [1,1,0,0,0,0|2,0,0]=4 4661 B11R1.22 NCC(F)c1ccc(F)cc1 Amb24084159 [1,1,0,0,0,0|1,0,0]=3 4662 B11R1.22 NCC(F)c1ccc(F)cn1 Amb33315880 [1,1,0,0,0,0|2,0,0]=4 4663 B11R1.22 NCC(F)c1ccc(F)nc1 Amb33426215 [1,1,0,0,0,0|2,0,0]=4 4664 B11R1.22 NCC(F)c1ccc(N)cc1 Amb24679205 [1,1,0,0,0,0|1,0,0]=3 4665 B11R1.22 NCC(F)c1ccc(O)cc1 Amb26387217 [1,1,0,0,0,0|1,0,0]=3 4666 B11R1.22 NCC(N)c1ccc(Br)cc1 Amb9380725 [1,1,0,0,0,0|1,0,0]=3 4667 B11R1.22 NCC(N)c1ccc(Cl)cc1 Amb32651885 [1,1,0,0,0,0|1,0,0]=3 4668 B11R1.22 NCC(N)c1ccc(Cl)cc1 Amb9380724 [1,1,0,0,0,0|1,0,0]=3 4669 B11R1.22 NCC(N)c1ccc(Cl)nc1 Amb27668918 [1,1,0,0,0,0|2,0,0]=4 4670 B11R1.22 NCC(N)c1ccc(F)nc1 Amb27950398 [1,1,0,0,0,0|2,0,0]=4 4671 B11R1.22 NCC(N)c1ccc(I)cn1 Amb27760223 [1,1,0,0,0,0|2,0,0]=4 4672 B11R1.22 NCC(N)c1ccc(I)nc1 Amb27945475 [1,1,0,0,0,0|2,0,0]=4 4673 B11R1.22 NCC(N)c1ccc(N)cn1 Amb27493137 [1,1,0,0,0,0|2,0,0]=4 4674 B11R1.22 NCC(N)c1ccc(S)cc1 Amb27175352 [1,1,0,0,0,0|1,0,0]=3 4675 B11R1.22 NCC(O)c1ccc(Br)cc1 Amb22234871 [1,1,0,0,0,0|1,0,0]=3 4676 B11R1.22 NCC(O)c1ccc(Br)cc1 Amb6383935 [1,1,0,0,0,0|1,0,0]=3 4677 B11R1.22 NCC(O)c1ccc(Br)cn1 Amb23586102 [1,1,0,0,0,0|2,0,0]=4 4678 B11R1.22 NCC(O)c1ccc(Br)cn1 Amb33328699 [1,1,0,0,0,0|2,0,0]=4 4679 B11R1.22 NCC(O)c1ccc(Br)nc1 Amb33388069 [1,1,0,0,0,0|2,0,0]=4 4680 B11R1.22 NCC(O)c1ccc(Cl)cc1 Amb1108621 [1,1,0,0,0,0|1,0,0]=3 4681 B11R1.22 NCC(O)c1ccc(Cl)cc1 Amb2697537 [1,1,0,0,0,0|1,0,0]=3 4682 B11R1.22 NCC(O)c1ccc(Cl)cn1 Amb27640141 [1,1,0,0,0,0|2,0,0]=4 4683 B11R1.22 NCC(O)c1ccc(Cl)nc1 Amb33261201 [1,1,0,0,0,0|2,0,0]=4 4684 B11R1.22 NCC(O)c1ccc(F)cc1 Amb10808445 [1,1,0,0,0,0|1,0,0]=3 4685 B11R1.22 NCC(O)c1ccc(F)cc1 Amb9703703 [1,1,0,0,0,0|1,0,0]=3 4686 B11R1.22 NCC(O)c1ccc(F)cn1 Amb25151889 [1,1,0,0,0,0|2,0,0]=4 4687 B11R1.22 NCC(O)c1ccc(F)nc1 Amb33426951 [1,1,0,0,0,0|2,0,0]=4 4688 B11R1.22 NCC(O)c1ccc(I)cc1 Amb25098773 [1,1,0,0,0,0|1,0,0]=3 4689 B11R1.22 NCC(O)c1ccc(N)cc1 Amb25052395 [1,1,0,0,0,0|1,0,0]=3 4690 B11R1.22 NCC(O)c1ccc(O)cc1 Amb1108209 [1,1,0,0,0,0|1,0,0]=3 4691 B11R1.22 NCC(O)c1ccc(O)cc1 Amb33527773 [1,1,0,0,0,0|1,0,0]=3 4692 B11R1.22 NC[C@@H](N)c1ccc(Br)nc1 Amb28133356 [1,1,0,0,0,0|2,0,0]=4 4693 B11R1.22 NC[C@@H](N)c1ccc(Cl)cc1 Amb27865343 [1,1,0,0,0,0|1,0,0]=3 4694 B11R1.22 NC[C@@H](N)c1ccc(F)nc1 Amb27817853 [1,1,0,0,0,0|2,0,0]=4 4695 B11R1.22 NC[C@@H](N)c1ccc(I)cc1 Amb27259377 [1,1,0,0,0,0|1,0,0]=3 4696 B11R1.22 NC[C@@H](N)c1ccc(I)cn1 Amb27224074 [1,1,0,0,0,0|2,0,0]=4 4697 B11R1.22 NC[C@@H](O)c1ccc(Br)cc1 Amb24486093 [1,1,0,0,0,0|1,0,0]=3 4698 B11R1.22 NC[C@@H](O)c1ccc(Br)cn1 Amb32941814 [1,1,0,0,0,0|2,0,0]=4 4699 B11R1.22 NC[C@@H](O)c1ccc(Br)nc1 Amb33388038 [1,1,0,0,0,0|2,0,0]=4 4700 B11R1.22 NC[C@@H](O)c1ccc(Cl)cc1 Amb20241481 [1,1,0,0,0,0|1,0,0]=3 4701 B11R1.22 NC[C@@H](O)c1ccc(Cl)cc1 Amb24092980 [1,1,0,0,0,0|1,0,0]=3 4702 B11R1.22 NC[C@@H](O)c1ccc(Cl)cn1 Amb32941809 [1,1,0,0,0,0|2,0,0]=4 4703 B11R1.22 NC[C@@H](O)c1ccc(Cl)nc1 Amb33261514 [1,1,0,0,0,0|2,0,0]=4 4704 B11R1.22 NC[C@@H](O)c1ccc(F)cc1 Amb32882506 [1,1,0,0,0,0|1,0,0]=3 4705 B11R1.22 NC[C@@H](O)c1ccc(F)cn1 Amb25769555 [1,1,0,0,0,0|2,0,0]=4 4706 B11R1.22 NC[C@@H](O)c1ccc(F)nc1 Amb33426213 [1,1,0,0,0,0|2,0,0]=4 4707 B11R1.22 NC[C@@H](O)c1ccc(I)cc1 Amb25058833 [1,1,0,0,0,0|1,0,0]=3 4708 B11R1.22 NC[C@@H](O)c1ccc(O)cc1 Amb25027908 [1,1,0,0,0,0|1,0,0]=3 4709 B11R1.22 NC[C@H](N)c1ccc(Cl)nc1 Amb27760018 [1,1,0,0,0,0|2,0,0]=4 4710 B11R1.22 NC[C@H](N)c1ccc(F)cn1 Amb28314190 [1,1,0,0,0,0|2,0,0]=4 4711 B11R1.22 NC[C@H](N)c1ccc(N)nc1 Amb27173293 [1,1,0,0,0,0|2,0,0]=4 4712 B11R1.22 NC[C@H](N)c1ccc(O)cn1 Amb27217269 [1,1,0,0,0,0|2,0,0]=4 4713 B11R1.22 NC[C@H](N)c1ccc(O)nc1 Amb27167844 [1,1,0,0,0,0|2,0,0]=4 4714 B11R1.22 NC[C@H](N)c1ccc(S)cc1 Amb27480582 [1,1,0,0,0,0|1,0,0]=3 4715 B11R1.22 NC[C@H](O)c1ccc(Br)cc1 Amb27631289 [1,1,0,0,0,0|1,0,0]=3 4716 B11R1.22 NC[C@H](O)c1ccc(Br)cn1 Amb32941813 [1,1,0,0,0,0|2,0,0]=4 4717 B11R1.22 NC[C@H](O)c1ccc(Br)nc1 Amb33388036 [1,1,0,0,0,0|2,0,0]=4 4718 B11R1.22 NC[C@H](O)c1ccc(Cl)cc1 Amb25946329 [1,1,0,0,0,0|1,0,0]=3 4719 B11R1.22 NC[C@H](O)c1ccc(Cl)cc1 Amb32661115 [1,1,0,0,0,0|1,0,0]=3 4720 B11R1.22 NC[C@H](O)c1ccc(Cl)cn1 Amb32941808 [1,1,0,0,0,0|2,0,0]=4 4721 B11R1.22 NC[C@H](O)c1ccc(Cl)nc1 Amb33261510 [1,1,0,0,0,0|2,0,0]=4 4722 B11R1.22 NC[C@H](O)c1ccc(F)cc1 Amb25966000 [1,1,0,0,0,0|1,0,0]=3 4723 B11R1.22 NC[C@H](O)c1ccc(F)cc1 Amb32882510 [1,1,0,0,0,0|1,0,0]=3 4724 B11R1.22 NC[C@H](O)c1ccc(F)cn1 Amb25346474 [1,1,0,0,0,0|2,0,0]=4 4725 B11R1.22 NC[C@H](O)c1ccc(F)nc1 Amb33426214 [1,1,0,0,0,0|2,0,0]=4 4726 B11R1.22 NC[C@H](O)c1ccc(I)cc1 Amb26649479 [1,1,0,0,0,0|1,0,0]=3 4727 B11R1.22 NC[C@H](O)c1ccc(O)cc1 Amb567557 [1,1,0,0,0,0|1,0,0]=3 4728 B11R1.22 N[C@@H](CF)c1ccc(Br)cc1 Amb28292785 [1,1,0,0,0,0|2,0,0]=4 4729 B11R1.22 N[C@@H](CF)c1ccc(F)cc1 Amb26607869 [1,1,0,0,0,0|2,0,0]=4 4730 B11R1.22 N[C@@H](CO)c1ccc(Br)cc1 Amb23440363 [1,1,0,0,0,0|2,0,0]=4 4731 B11R1.22 N[C@@H](CO)c1ccc(Br)cc1 Amb24469233 [1,1,0,0,0,0|2,0,0]=4 4732 B11R1.22 N[C@@H](CO)c1ccc(Cl)cc1 Amb22756882 [1,1,0,0,0,0|2,0,0]=4 4733 B11R1.22 N[C@@H](CO)c1ccc(Cl)cc1 Amb30634242 [1,1,0,0,0,0|2,0,0]=4 4734 B11R1.22 N[C@@H](CO)c1ccc(F)cc1 Amb22745476 [1,1,0,0,0,0|2,0,0]=4 4735 B11R1.22 N[C@@H](CO)c1ccc(F)cc1 Amb22746546 [1,1,0,0,0,0|2,0,0]=4 4736 B11R1.22 N[C@@H](CO)c1ccc(O)cc1 Amb24103158 [1,1,0,0,0,0|2,0,0]=4 4737 B11R1.22 N[C@@H](CO)c1ccc(O)cc1 Amb30634211 [1,1,0,0,0,0|2,0,0]=4 4738 B11R1.22 N[C@H](CBr)c1ccc(Br)cc1 Amb32676397 [1,1,0,0,0,0|2,0,0]=4 4739 B11R1.22 N[C@H](CF)c1ccc(Br)cc1 Amb26984107 [1,1,0,0,0,0|2,0,0]=4 4740 B11R1.22 N[C@H](CF)c1ccc(F)cc1 Amb28048826 [1,1,0,0,0,0|2,0,0]=4 4741 B11R1.22 N[C@H](CF)c1ccc(I)cc1 Amb27248455 [1,1,0,0,0,0|2,0,0]=4 4742 B11R1.22 N[C@H](CO)c1ccc(Br)cc1 Amb25844082 [1,1,0,0,0,0|2,0,0]=4 4743 B11R1.22 N[C@H](CO)c1ccc(Br)cc1 Amb33872481 [1,1,0,0,0,0|2,0,0]=4 4744 B11R1.22 N[C@H](CO)c1ccc(Cl)cc1 Amb26460565 [1,1,0,0,0,0|2,0,0]=4 4745 B11R1.22 N[C@H](CO)c1ccc(Cl)cc1 Amb33872473 [1,1,0,0,0,0|2,0,0]=4 4746 B11R1.22 N[C@H](CO)c1ccc(F)cc1 Amb24569357 [1,1,0,0,0,0|2,0,0]=4 4747 B11R1.22 N[C@H](CO)c1ccc(F)cc1 Amb33801894 [1,1,0,0,0,0|2,0,0]=4 4748 B11R1.22 N[C@H](CO)c1ccc(I)cc1 Amb27465733 [1,1,0,0,0,0|2,0,0]=4 4749 B11R1.22 N[C@H](CO)c1ccc(O)cc1 Amb24103172 [1,1,0,0,0,0|2,0,0]=4 4750 B11R1.22 N[C@H](CO)c1ccc(O)cc1 Amb33872243 [1,1,0,0,0,0|2,0,0]=4 4751 B11R1.22 N[C@H](CO)c1ccc(S)cc1 Amb27399138 [1,1,0,0,0,0|2,0,0]=4 4752 B11R1.22 Nc1ccc(C(N)CF)cc1 Amb33190131 [1,1,0,0,0,0|2,0,0]=4 4753 B11R1.22 Nc1ccc(C(N)CO)cc1 Amb28131419 [1,1,0,0,0,0|2,0,0]=4 4754 B11R1.22 Nc1ccc(C(O)CBr)cc1 Amb27839668 [1,1,0,0,0,0|2,0,0]=4 4755 B11R1.22 Nc1ccc([C@@H](N)CF)cc1 Amb33297460 [1,1,0,0,0,0|2,0,0]=4 4756 B11R1.22 Nc1ccc([C@@H](N)CO)cc1 Amb27217162 [1,1,0,0,0,0|2,0,0]=4 4757 B11R1.22 Nc1ccc([C@H](N)CF)cc1 Amb33297461 [1,1,0,0,0,0|2,0,0]=4 4758 B11R1.22 Nc1ccc([C@H](O)CBr)cc1 Amb27759454 [1,1,0,0,0,0|2,0,0]=4 4759 B11R1.22 OC(CBr)c1ccc(Br)cc1 Amb17206111 [1,1,0,0,0,0|2,0,0]=4 4760 B11R1.22 OC(CBr)c1ccc(Cl)cc1 Amb17206112 [1,1,0,0,0,0|2,0,0]=4 4761 B11R1.22 OC(CBr)c1ccc(F)cc1 Amb17206113 [1,1,0,0,0,0|2,0,0]=4 4762 B11R1.22 OC(CCl)c1ccc(Br)cc1 Amb17196014 [1,1,0,0,0,0|2,0,0]=4 4763 B11R1.22 OC(CCl)c1ccc(Cl)cc1 Amb17194627 [1,1,0,0,0,0|2,0,0]=4 4764 B11R1.22 OC(CCl)c1ccc(F)cc1 Amb17194492 [1,1,0,0,0,0|2,0,0]=4 4765 B11R1.22 OC(CF)c1ccc(Br)cc1 Amb24654008 [1,1,0,0,0,0|2,0,0]=4 4766 B11R1.22 OC(CF)c1ccc(F)cc1 Amb25682730 [1,1,0,0,0,0|2,0,0]=4 4767 B11R1.22 OC(CI)c1ccc(Br)cc1 Amb25725604 [1,1,0,0,0,0|2,0,0]=4 4768 B11R1.22 OC(CI)c1ccc(Cl)cc1 Amb27450897 [1,1,0,0,0,0|2,0,0]=4 4769 B11R1.22 OC(CI)c1ccc(F)cc1 Amb27197776 [1,1,0,0,0,0|2,0,0]=4 4770 B11R1.22 OC(CS)c1ccc(F)cc1 Amb28193695 [1,1,0,0,0,0|2,0,0]=4 4771 B11R1.22 OCC(F)c1ccc(O)cc1 Amb27851608 [1,1,0,0,0,0|2,0,0]=4 4772 B11R1.22 OCC(O)c1ccc(Br)cc1 Amb18570007 [1,1,0,0,0,0|2,0,0]=4 4773 B11R1.22 OCC(O)c1ccc(Cl)cc1 Amb18563992 [1,1,0,0,0,0|2,0,0]=4 4774 B11R1.22 OCC(O)c1ccc(F)cc1 Amb18065446 [1,1,0,0,0,0|2,0,0]=4 4775 B11R1.22 OCC(O)c1ccc(O)cc1 Amb18644612 [1,1,0,0,0,0|2,0,0]=4 4776 B11R1.22 OC[C@@H](O)c1ccc(Br)cc1 Amb35747149 [1,1,0,0,0,0|2,0,0]=4 4777 B11R1.22 OC[C@H](O)c1ccc(Br)cc1 Amb33743367 [1,1,0,0,0,0|2,0,0]=4 4778 B11R1.22 OC[C@H](O)c1ccc(Cl)cc1 Amb27600596 [1,1,0,0,0,0|2,0,0]=4 4779 B11R1.22 OC[C@H](O)c1ccc(F)cc1 Amb28200871 [1,1,0,0,0,0|2,0,0]=4 4780 B11R1.22 O[C@@H](CBr)c1ccc(Br)cc1 Amb28285029 [1,1,0,0,0,0|2,0,0]=4 4781 B11R1.22 O[C@@H](CBr)c1ccc(F)cc1 Amb25695505 [1,1,0,0,0,0|2,0,0]=4 4782 B11R1.22 O[C@@H](CCl)c1ccc(Br)cc1 Amb6893357 [1,1,0,0,0,0|2,0,0]=4 4783 B11R1.22 O[C@@H](CCl)c1ccc(F)cc1 Amb16231704 [1,1,0,0,0,0|2,0,0]=4 4784 B11R1.22 O[C@@H](CF)c1ccc(Br)cc1 Amb33297482 [1,1,0,0,0,0|2,0,0]=4 4785 B11R1.22 O[C@@H](CF)c1ccc(Cl)cc1 Amb27980651 [1,1,0,0,0,0|2,0,0]=4 4786 B11R1.22 O[C@@H](CF)c1ccc(F)cc1 Amb26047686 [1,1,0,0,0,0|2,0,0]=4 4787 B11R1.22 O[C@H](CBr)c1ccc(Br)cc1 Amb24719506 [1,1,0,0,0,0|2,0,0]=4 4788 B11R1.22 O[C@H](CBr)c1ccc(I)cc1 Amb27656791 [1,1,0,0,0,0|2,0,0]=4 4789 B11R1.22 O[C@H](CCl)c1ccc(Br)cc1 Amb6893356 [1,1,0,0,0,0|2,0,0]=4 4790 B11R1.22 O[C@H](CCl)c1ccc(Cl)cc1 Amb6893355 [1,1,0,0,0,0|2,0,0]=4 4791 B11R1.22 O[C@H](CCl)c1ccc(F)cc1 Amb2697068 [1,1,0,0,0,0|2,0,0]=4 4792 B11R1.22 O[C@H](CCl)c1ccc(I)cc1 Amb27588521 [1,1,0,0,0,0|2,0,0]=4 4793 B11R1.22 O[C@H](CF)c1ccc(Br)cc1 Amb33297474 [1,1,0,0,0,0|2,0,0]=4 4794 B11R1.22 O[C@H](CF)c1ccc(Cl)cc1 Amb27598524 [1,1,0,0,0,0|2,0,0]=4 4795 B11R1.22 O[C@H](CF)c1ccc(F)cc1 Amb25714715 [1,1,0,0,0,0|2,0,0]=4 4796 B11R1.22 Oc1ccc(C(O)CBr)cc1 Amb33007177 [1,1,0,0,0,0|2,0,0]=4 4797 B11R1.22 Oc1ccc(C(O)CCl)cc1 Amb17594337 [1,1,0,0,0,0|2,0,0]=4 4798 B11R1.22 Oc1ccc(C(O)CF)cc1 Amb24564100 [1,1,0,0,0,0|2,0,0]=4 4799 B11R1.22 Oc1ccc([C@H](O)CCl)cc1 Amb27484019 [1,1,0,0,0,0|2,0,0]=4 4800 B11R1.22 [C-]#[N+]C(C)c1ccc(Br)cc1 Amb2685407 [1,1,0,0,0,0|0,0,2]=4 4801 B11R1.22 [C-]#[N+]C(C)c1ccc(C)cc1 Amb3973238 [1,1,0,0,0,0|0,0,2]=4 4802 B11R1.22 [C-]#[N+]C(C)c1ccc(Cl)cc1 Amb2235817 [1,1,0,0,0,0|0,0,2]=4 4803 B11R1.22 [C-]#[N+]C(C)c1ccc(F)cc1 Amb2688342 [1,1,0,0,0,0|0,0,2]=4 4804 B11R1.22 [C-]#[N+]C(C)c1ccc(O)cc1 Amb27483451 [1,1,0,0,0,0|0,0,2]=4 4805 B11R1.22 [C-]#[N+][C@@H](C)c1ccc(Cl)cc1 Amb33733062 [1,1,0,0,0,0|0,0,2]=4 4806 B11R1.22 [C-]#[N+][C@@H](C)c1ccc(F)cc1 Amb33732358 [1,1,0,0,0,0|0,0,2]=4 4807 B11R1.22 [C-]#[N+][C@H](C)c1ccc(Br)cc1 Amb33748735 [1,1,0,0,0,0|0,0,2]=4 4808 B11R1.23 C#CC(C)c1cccc(Br)c1 Amb33451606 [1,1,0,0,0,0|0,0,2]=4 4809 B11R1.23 C#CC(C)c1cccc(C)c1 Amb33380846 [1,1,0,0,0,0|0,0,2]=4 4810 B11R1.23 C#CC(C)c1cccc(Cl)c1 Amb33223356 [1,1,0,0,0,0|0,0,2]=4 4811 B11R1.23 C#CC(C)c1cccc(F)c1 Amb33316032 [1,1,0,0,0,0|0,0,2]=4 4812 B11R1.23 C#CC(C)c1cccc(O)c1 Amb33310889 [1,1,0,0,0,0|0,0,2]=4 4813 B11R1.23 C=C(CC)c1cccc(Br)c1 Amb27953527 [1,1,0,0,0,0|0,0,2]=4 4814 B11R1.23 C=C(CC)c1cccc(F)c1 Amb28141758 [1,1,0,0,0,0|0,0,2]=4 4815 B11R1.23 C=C(CN)c1cccc(C)c1 Amb18251308 [1,1,0,0,0,0|0,0,2]=4 4816 B11R1.23 C=C(CN)c1cccc(Cl)c1 Amb18908724 [1,1,0,0,0,0|0,0,2]=4 4817 B11R1.23 C=C(CN)c1cccc(F)c1 Amb18908419 [1,1,0,0,0,0|0,0,2]=4 4818 B11R1.23 C=C(CN)c1cccc(O)c1 Amb25326353 [1,1,0,0,0,0|0,0,2]=4 4819 B11R1.23 CC(C#N)c1cccc(Br)c1 Amb18130624 [1,1,0,0,0,0|0,0,2]=4 4820 B11R1.23 CC(C#N)c1cccc(Cl)c1 Amb27175329 [1,1,0,0,0,0|0,0,2]=4 4821 B11R1.23 CC(C#N)c1cccc(F)c1 Amb8950006 [1,1,0,0,0,0|0,0,2]=4 4822 B11R1.23 CC(C#N)c1cccc(I)c1 Amb27400894 [1,1,0,0,0,0|0,0,2]=4 4823 B11R1.23 CC(C#N)c1cccc(N)c1 Amb18124791 [1,1,0,0,0,0|0,0,2]=4 4824 B11R1.23 CC(C#N)c1cccc(O)c1 Amb25807604 [1,1,0,0,0,0|0,0,2]=4 4825 B11R1.23 CC(C=O)c1cccc(Br)c1 Amb18657407 [1,1,0,0,0,0|1,0,1]=4 4826 B11R1.23 CC(C=O)c1cccc(Cl)c1 Amb22059526 [1,1,0,0,0,0|1,0,1]=4 4827 B11R1.23 CC(C=O)c1cccc(F)c1 Amb24100538 [1,1,0,0,0,0|1,0,1]=4 4828 B11R1.23 CC(C=O)c1cccc(I)c1 Amb27208613 [1,1,0,0,0,0|1,0,1]=4 4829 B11R1.23 CC(C=O)c1cccc(O)c1 Amb18125118 [1,1,0,0,0,0|1,0,1]=4 4830 B11R1.23 CC(CBr)c1cc(Cl)ccn1 Amb33432288 [1,1,0,0,0,0|2,0,0]=4 4831 B11R1.23 CC(CBr)c1cc(F)ccn1 Amb33433799 [1,1,0,0,0,0|2,0,0]=4 4832 B11R1.23 CC(CBr)c1cccc(Br)c1 Amb25717190 [1,1,0,0,0,0|1,0,0]=3 4833 B11R1.23 CC(CBr)c1cccc(Br)n1 Amb33433173 [1,1,0,0,0,0|2,0,0]=4 4834 B11R1.23 CC(CBr)c1cccc(Cl)c1 Amb24682607 [1,1,0,0,0,0|1,0,0]=3 4835 B11R1.23 CC(CBr)c1cccc(Cl)n1 Amb33006825 [1,1,0,0,0,0|2,0,0]=4 4836 B11R1.23 CC(CBr)c1cccc(F)c1 Amb25678488 [1,1,0,0,0,0|1,0,0]=3 4837 B11R1.23 CC(CBr)c1cccc(O)c1 Amb33477628 [1,1,0,0,0,0|1,0,0]=3 4838 B11R1.23 CC(CBr)c1ccnc(Cl)c1 Amb33435783 [1,1,0,0,0,0|2,0,0]=4 4839 B11R1.23 CC(CBr)c1cncc(Br)c1 Amb33389093 [1,1,0,0,0,0|2,0,0]=4 4840 B11R1.23 CC(CBr)c1cncc(F)c1 Amb33477945 [1,1,0,0,0,0|2,0,0]=4 4841 B11R1.23 CC(CCl)c1cccc(Br)c1 Amb25890781 [1,1,0,0,0,0|1,0,0]=3 4842 B11R1.23 CC(CCl)c1cccc(Cl)c1 Amb24389754 [1,1,0,0,0,0|1,0,0]=3 4843 B11R1.23 CC(CCl)c1cccc(F)c1 Amb24485968 [1,1,0,0,0,0|1,0,0]=3 4844 B11R1.23 CC(CN)C1=NC=CC(=O)N1 Amb25288822 [1,1,0,0,0,0|2,0,0]=4 4845 B11R1.23 CC(CN)c1cc(Br)ccn1 Amb33502829 [1,1,0,0,0,0|1,0,0]=3 4846 B11R1.23 CC(CN)c1cc(Cl)ccn1 Amb33502838 [1,1,0,0,0,0|1,0,0]=3 4847 B11R1.23 CC(CN)c1cc(F)ccn1 Amb33502827 [1,1,0,0,0,0|1,0,0]=3 4848 B11R1.23 CC(CN)c1cc(N)ccn1 Amb33502822 [1,1,0,0,0,0|1,0,0]=3 4849 B11R1.23 CC(CN)c1cc(O)ncn1 Amb27796576 [1,1,0,0,0,0|2,0,0]=4 4850 B11R1.23 CC(CN)c1cccc(Br)c1 Amb18174810 [1,1,0,0,0,0|0,0,0]=2 4851 B11R1.23 CC(CN)c1cccc(Br)n1 Amb33432797 [1,1,0,0,0,0|1,0,0]=3 4852 B11R1.23 CC(CN)c1cccc(Cl)c1 Amb17079281 [1,1,0,0,0,0|0,0,0]=2 4853 B11R1.23 CC(CN)c1cccc(Cl)n1 Amb33223042 [1,1,0,0,0,0|1,0,0]=3 4854 B11R1.23 CC(CN)c1cccc(F)c1 Amb13951272 [1,1,0,0,0,0|0,0,0]=2 4855 B11R1.23 CC(CN)c1cccc(F)c1 Amb8950103 [1,1,0,0,0,0|0,0,0]=2 4856 B11R1.23 CC(CN)c1cccc(I)c1 Amb27864383 [1,1,0,0,0,0|0,0,0]=2 4857 B11R1.23 CC(CN)c1cccc(N)c1 Amb26573163 [1,1,0,0,0,0|0,0,0]=2 4858 B11R1.23 CC(CN)c1cccc(O)c1 Amb27407680 [1,1,0,0,0,0|0,0,0]=2 4859 B11R1.23 CC(CN)c1ccnc(F)c1 Amb33735126 [1,1,0,0,0,0|1,0,0]=3 4860 B11R1.23 CC(CN)c1ccnc(N)c1 Amb27974524 [1,1,0,0,0,0|1,0,0]=3 4861 B11R1.23 CC(CN)c1cncc(Br)c1 Amb33389077 [1,1,0,0,0,0|1,0,0]=3 4862 B11R1.23 CC(CN)c1cncc(F)c1 Amb18251435 [1,1,0,0,0,0|1,0,0]=3 4863 B11R1.23 CC(CN)c1nccc(N)n1 Amb24640916 [1,1,0,0,0,0|2,0,0]=4 4864 B11R1.23 CC(CO)c1cccc(Br)c1 Amb25377089 [1,1,0,0,0,0|1,0,0]=3 4865 B11R1.23 CC(CO)c1cccc(Cl)c1 Amb33545585 [1,1,0,0,0,0|1,0,0]=3 4866 B11R1.23 CC(CO)c1cccc(F)c1 Amb24485967 [1,1,0,0,0,0|1,0,0]=3 4867 B11R1.23 CC(CO)c1ccnc(F)c1 Amb33740148 [1,1,0,0,0,0|2,0,0]=4 4868 B11R1.23 CC(NN)c1cccc(I)c1 Amb27830005 [1,1,0,0,0,0|1,0,0]=3 4869 B11R1.23 CC(NN)c1cncc(F)c1 Amb27236555 [1,1,0,0,0,0|2,0,0]=4 4870 B11R1.23 CC(NO)c1cccc(N)c1 Amb10606961 [1,1,0,0,0,0|1,0,0]=3 4871 B11R1.23 CC(NO)c1cncc(Br)c1 Amb35702504 [1,1,0,0,0,0|2,0,0]=4 4872 B11R1.23 CC(ON)c1cc(F)ccn1 Amb33320307 [1,1,0,0,0,0|2,0,0]=4 4873 B11R1.23 CC(ON)c1cccc(Br)c1 Amb33451598 [1,1,0,0,0,0|1,0,0]=3 4874 B11R1.23 CC(ON)c1cccc(Br)n1 Amb33433131 [1,1,0,0,0,0|2,0,0]=4 4875 B11R1.23 CC(ON)c1cccc(Cl)c1 Amb33223341 [1,1,0,0,0,0|1,0,0]=3 4876 B11R1.23 CC(ON)c1cccc(Cl)n1 Amb33222409 [1,1,0,0,0,0|2,0,0]=4 4877 B11R1.23 CC(ON)c1cccc(F)c1 Amb33316037 [1,1,0,0,0,0|1,0,0]=3 4878 B11R1.23 CC(ON)c1cccc(O)c1 Amb33310965 [1,1,0,0,0,0|1,0,0]=3 4879 B11R1.23 CC(ON)c1cncc(Br)c1 Amb33389581 [1,1,0,0,0,0|2,0,0]=4 4880 B11R1.23 CC(ON)c1cncc(F)c1 Amb33196293 [1,1,0,0,0,0|2,0,0]=4 4881 B11R1.23 CCC(=O)c1cccc(Br)c1 Amb1233199 [1,1,0,0,0,0|1,0,1]=4 4882 B11R1.23 CCC(=O)c1cccc(C)c1 Amb33534981 [1,1,0,0,0,0|1,0,1]=4 4883 B11R1.23 CCC(=O)c1cccc(Cl)c1 Amb2686437 [1,1,0,0,0,0|1,0,1]=4 4884 B11R1.23 CCC(=O)c1cccc(F)c1 Amb2688407 [1,1,0,0,0,0|1,0,1]=4 4885 B11R1.23 CCC(=O)c1cccc(I)c1 Amb27230465 [1,1,0,0,0,0|1,0,1]=4 4886 B11R1.23 CCC(=O)c1cccc(N)c1 Amb3429288 [1,1,0,0,0,0|1,0,1]=4 4887 B11R1.23 CCC(=O)c1cccc(O)c1 Amb8387616 [1,1,0,0,0,0|1,0,1]=4 4888 B11R1.23 CCC(Br)c1cc(C)ccn1 Amb27768342 [1,1,0,0,0,0|2,0,0]=4 4889 B11R1.23 CCC(Br)c1cccc(Br)c1 Amb25330622 [1,1,0,0,0,0|1,0,0]=3 4890 B11R1.23 CCC(Br)c1cccc(Br)n1 Amb25700057 [1,1,0,0,0,0|2,0,0]=4 4891 B11R1.23 CCC(Br)c1cccc(Cl)n1 Amb24733775 [1,1,0,0,0,0|2,0,0]=4 4892 B11R1.23 CCC(Br)c1ccnc(C)c1 Amb27457736 [1,1,0,0,0,0|2,0,0]=4 4893 B11R1.23 CCC(C)C1=NC(=O)NC=C1 Amb27433592 [1,1,0,0,0,0|2,0,0]=4 4894 B11R1.23 CCC(C)C1=NC=CC(=O)N1 Amb18181729 [1,1,0,0,0,0|2,0,0]=4 4895 B11R1.23 CCC(C)c1cc(Br)ccn1 Amb24320477 [1,1,0,0,0,0|1,0,0]=3 4896 B11R1.23 CCC(C)c1cc(Br)ncn1 Amb10600042 [1,1,0,0,0,0|2,0,0]=4 4897 B11R1.23 CCC(C)c1cc(Cl)ncn1 Amb33298024 [1,1,0,0,0,0|2,0,0]=4 4898 B11R1.23 CCC(C)c1cc(F)ccn1 Amb24319241 [1,1,0,0,0,0|1,0,0]=3 4899 B11R1.23 CCC(C)c1cc(N)ccn1 Amb24320479 [1,1,0,0,0,0|1,0,0]=3 4900 B11R1.23 CCC(C)c1cc(O)ncn1 Amb33298009 [1,1,0,0,0,0|2,0,0]=4 4901 B11R1.23 CCC(C)c1cccc(Br)c1 Amb24321311 [1,1,0,0,0,0|0,0,0]=2 4902 B11R1.23 CCC(C)c1cccc(Br)n1 Amb10600437 [1,1,0,0,0,0|1,0,0]=3 4903 B11R1.23 CCC(C)c1cccc(C)c1 Amb22755118 [1,1,0,0,0,0|0,0,0]=2 4904 B11R1.23 CCC(C)c1cccc(Cl)c1 Amb27421860 [1,1,0,0,0,0|0,0,0]=2 4905 B11R1.23 CCC(C)c1cccc(F)c1 Amb26891562 [1,1,0,0,0,0|0,0,0]=2 4906 B11R1.23 CCC(C)c1cccc(F)n1 Amb24319193 [1,1,0,0,0,0|1,0,0]=3 4907 B11R1.23 CCC(C)c1cccc(N)c1 Amb26880198 [1,1,0,0,0,0|0,0,0]=2 4908 B11R1.23 CCC(C)c1cccc(N)c1 Amb32668333 [1,1,0,0,0,0|0,0,0]=2 4909 B11R1.23 CCC(C)c1cccc(N)n1 Amb18201878 [1,1,0,0,0,0|1,0,0]=3 4910 B11R1.23 CCC(C)c1cccc(O)n1 Amb27267959 [1,1,0,0,0,0|1,0,0]=3 4911 B11R1.23 CCC(C)c1ccnc(Br)c1 Amb24320456 [1,1,0,0,0,0|1,0,0]=3 4912 B11R1.23 CCC(C)c1cncc(Br)c1 Amb24320780 [1,1,0,0,0,0|1,0,0]=3 4913 B11R1.23 CCC(C)c1cncc(Br)n1 Amb10600321 [1,1,0,0,0,0|2,0,0]=4 4914 B11R1.23 CCC(C)c1cncc(C)n1 Amb26420298 [1,1,0,0,0,0|2,0,0]=4 4915 B11R1.23 CCC(C)c1cncc(Cl)n1 Amb26624984 [1,1,0,0,0,0|2,0,0]=4 4916 B11R1.23 CCC(C)c1cncc(N)c1 Amb18201843 [1,1,0,0,0,0|1,0,0]=3 4917 B11R1.23 CCC(C)c1cncc(N)n1 Amb27760737 [1,1,0,0,0,0|2,0,0]=4 4918 B11R1.23 CCC(C)c1cncc(O)c1 Amb24320785 [1,1,0,0,0,0|1,0,0]=3 4919 B11R1.23 CCC(C)c1nccc(C)n1 Amb27456400 [1,1,0,0,0,0|2,0,0]=4 4920 B11R1.23 CCC(C)c1nccc(Cl)n1 Amb18802170 [1,1,0,0,0,0|2,0,0]=4 4921 B11R1.23 CCC(C)c1nccc(F)n1 Amb35642819 [1,1,0,0,0,0|2,0,0]=4 4922 B11R1.23 CCC(C)c1nccc(N)n1 Amb18285140 [1,1,0,0,0,0|2,0,0]=4 4923 B11R1.23 CCC(Cl)c1cccc(Cl)c1 Amb7766801 [1,1,0,0,0,0|1,0,0]=3 4924 B11R1.23 CCC(N)c1cc(C)ccn1 Amb10608272 [1,1,0,0,0,0|2,0,0]=4 4925 B11R1.23 CCC(N)c1cccc(Br)c1 Amb9232335 [1,1,0,0,0,0|1,0,0]=3 4926 B11R1.23 CCC(N)c1cccc(Br)n1 Amb25996589 [1,1,0,0,0,0|2,0,0]=4 4927 B11R1.23 CCC(N)c1cccc(C)c1 Amb17232059 [1,1,0,0,0,0|1,0,0]=3 4928 B11R1.23 CCC(N)c1cccc(C)c1 Amb32662125 [1,1,0,0,0,0|1,0,0]=3 4929 B11R1.23 CCC(N)c1cccc(C)n1 Amb10608330 [1,1,0,0,0,0|2,0,0]=4 4930 B11R1.23 CCC(N)c1cccc(Cl)c1 Amb1126296 [1,1,0,0,0,0|1,0,0]=3 4931 B11R1.23 CCC(N)c1cccc(Cl)n1 Amb27593910 [1,1,0,0,0,0|2,0,0]=4 4932 B11R1.23 CCC(N)c1cccc(F)c1 Amb10839631 [1,1,0,0,0,0|1,0,0]=3 4933 B11R1.23 CCC(N)c1cccc(N)c1 Amb22754502 [1,1,0,0,0,0|1,0,0]=3 4934 B11R1.23 CCC(N)c1cccc(O)c1 Amb27391145 [1,1,0,0,0,0|1,0,0]=3 4935 B11R1.23 CCC(N)c1ccnc(Br)c1 Amb28136508 [1,1,0,0,0,0|2,0,0]=4 4936 B11R1.23 CCC(N)c1ccnc(Cl)c1 Amb25133089 [1,1,0,0,0,0|2,0,0]=4 4937 B11R1.23 CCC(N)c1cncc(Br)c1 Amb23450056 [1,1,0,0,0,0|2,0,0]=4 4938 B11R1.23 CCC(N)c1cncc(Cl)c1 Amb27630039 [1,1,0,0,0,0|2,0,0]=4 4939 B11R1.23 CCC(N)c1cncc(F)c1 Amb18283040 [1,1,0,0,0,0|2,0,0]=4 4940 B11R1.23 CCC(N)c1cncc(O)c1 Amb27413806 [1,1,0,0,0,0|2,0,0]=4 4941 B11R1.23 CCC(O)c1cccc(Br)c1 Amb9704418 [1,1,0,0,0,0|1,0,0]=3 4942 B11R1.23 CCC(O)c1cccc(Br)n1 Amb27207059 [1,1,0,0,0,0|2,0,0]=4 4943 B11R1.23 CCC(O)c1cccc(C)c1 Amb17232070 [1,1,0,0,0,0|1,0,0]=3 4944 B11R1.23 CCC(O)c1cccc(Cl)c1 Amb9748278 [1,1,0,0,0,0|1,0,0]=3 4945 B11R1.23 CCC(O)c1cccc(F)c1 Amb18035934 [1,1,0,0,0,0|1,0,0]=3 4946 B11R1.23 CCC(O)c1cccc(N)n1 Amb24459479 [1,1,0,0,0,0|2,0,0]=4 4947 B11R1.23 CCC(O)c1ccnc(Br)c1 Amb27261787 [1,1,0,0,0,0|2,0,0]=4 4948 B11R1.23 CCC(O)c1ccnc(Cl)c1 Amb24721891 [1,1,0,0,0,0|2,0,0]=4 4949 B11R1.23 CCC(S)c1cccc(Br)c1 Amb25853905 [1,1,0,0,0,0|1,0,0]=3 4950 B11R1.23 CCC(S)c1cccc(C)c1 Amb25703808 [1,1,0,0,0,0|1,0,0]=3 4951 B11R1.23 CCC(S)c1cccc(Cl)c1 Amb7784701 [1,1,0,0,0,0|1,0,0]=3 4952 B11R1.23 CCC(S)c1cccc(F)c1 Amb25893398 [1,1,0,0,0,0|1,0,0]=3 4953 B11R1.23 CCN(C)c1cc(Br)ccn1 Amb10599808 [1,1,0,0,0,0|2,0,0]=4 4954 B11R1.23 CCN(C)c1cc(N)ccn1 Amb18956385 [1,1,0,0,0,0|2,0,0]=4 4955 B11R1.23 CCN(C)c1cccc(Br)c1 Amb25711222 [1,1,0,0,0,0|1,0,0]=3 4956 B11R1.23 CCN(C)c1cccc(Br)n1 Amb10599617 [1,1,0,0,0,0|2,0,0]=4 4957 B11R1.23 CCN(C)c1cccc(F)n1 Amb18177332 [1,1,0,0,0,0|2,0,0]=4 4958 B11R1.23 CCN(C)c1cccc(N)c1 Amb33526914 [1,1,0,0,0,0|1,0,0]=3 4959 B11R1.23 CCN(C)c1cccc(O)c1 Amb18125288 [1,1,0,0,0,0|1,0,0]=3 4960 B11R1.23 CCN(C)c1ccnc(Br)c1 Amb10599872 [1,1,0,0,0,0|2,0,0]=4 4961 B11R1.23 CCN(C)c1ccnc(Cl)c1 Amb27444762 [1,1,0,0,0,0|2,0,0]=4 4962 B11R1.23 CCN(C)c1ccnc(N)c1 Amb24320230 [1,1,0,0,0,0|2,0,0]=4 4963 B11R1.23 CCN(C)c1cncc(Br)c1 Amb20617815 [1,1,0,0,0,0|2,0,0]=4 4964 B11R1.23 CCN(C)c1cncc(N)c1 Amb20617816 [1,1,0,0,0,0|2,0,0]=4 4965 B11R1.23 CCN(C)c1cncc(O)c1 Amb20617804 [1,1,0,0,0,0|2,0,0]=4 4966 B11R1.23 CCN(N)c1cccc(C)c1 Amb17232077 [1,1,0,0,0,0|2,0,0]=4 4967 B11R1.23 CCS(=O)c1cccc(Br)c1 Amb27593385 [1,1,0,0,0,0|2,0,0]=4 4968 B11R1.23 CC[C@@H](N)c1cc(Cl)ccn1 Amb27391584 [1,1,0,0,0,0|2,0,0]=4 4969 B11R1.23 CC[C@@H](N)c1cccc(Br)c1 Amb24533197 [1,1,0,0,0,0|1,0,0]=3 4970 B11R1.23 CC[C@@H](N)c1cccc(Br)n1 Amb25798720 [1,1,0,0,0,0|2,0,0]=4 4971 B11R1.23 CC[C@@H](N)c1cccc(C)c1 Amb22298529 [1,1,0,0,0,0|1,0,0]=3 4972 B11R1.23 CC[C@@H](N)c1cccc(C)c1 Amb25145723 [1,1,0,0,0,0|1,0,0]=3 4973 B11R1.23 CC[C@@H](N)c1cccc(Cl)c1 Amb22232293 [1,1,0,0,0,0|1,0,0]=3 4974 B11R1.23 CC[C@@H](N)c1cccc(F)c1 Amb22288627 [1,1,0,0,0,0|1,0,0]=3 4975 B11R1.23 CC[C@@H](N)c1cccc(F)c1 Amb24426877 [1,1,0,0,0,0|1,0,0]=3 4976 B11R1.23 CC[C@@H](N)c1cccc(F)n1 Amb27164324 [1,1,0,0,0,0|2,0,0]=4 4977 B11R1.23 CC[C@@H](N)c1cccc(I)c1 Amb27208917 [1,1,0,0,0,0|1,0,0]=3 4978 B11R1.23 CC[C@@H](N)c1ccnc(Br)c1 Amb27656268 [1,1,0,0,0,0|2,0,0]=4 4979 B11R1.23 CC[C@@H](N)c1cncc(Br)c1 Amb27258180 [1,1,0,0,0,0|2,0,0]=4 4980 B11R1.23 CC[C@@H](N)c1cncc(C)c1 Amb28288839 [1,1,0,0,0,0|2,0,0]=4 4981 B11R1.23 CC[C@@H](O)c1cccc(C)c1 Amb25151427 [1,1,0,0,0,0|1,0,0]=3 4982 B11R1.23 CC[C@@H](O)c1cccc(Cl)c1 Amb24477555 [1,1,0,0,0,0|1,0,0]=3 4983 B11R1.23 CC[C@@H](O)c1cccc(F)c1 Amb26853148 [1,1,0,0,0,0|1,0,0]=3 4984 B11R1.23 CC[C@H](N)c1cc(Br)ccn1 Amb27641722 [1,1,0,0,0,0|2,0,0]=4 4985 B11R1.23 CC[C@H](N)c1cc(C)ccn1 Amb27801093 [1,1,0,0,0,0|2,0,0]=4 4986 B11R1.23 CC[C@H](N)c1cccc(Br)c1 Amb27826818 [1,1,0,0,0,0|1,0,0]=3 4987 B11R1.23 CC[C@H](N)c1cccc(Br)n1 Amb25923129 [1,1,0,0,0,0|2,0,0]=4 4988 B11R1.23 CC[C@H](N)c1cccc(C)c1 Amb27975769 [1,1,0,0,0,0|1,0,0]=3 4989 B11R1.23 CC[C@H](N)c1cccc(Cl)c1 Amb22232288 [1,1,0,0,0,0|1,0,0]=3 4990 B11R1.23 CC[C@H](N)c1cccc(F)c1 Amb22288686 [1,1,0,0,0,0|1,0,0]=3 4991 B11R1.23 CC[C@H](N)c1cccc(F)c1 Amb27254065 [1,1,0,0,0,0|1,0,0]=3 4992 B11R1.23 CC[C@H](N)c1cccc(N)c1 Amb25169299 [1,1,0,0,0,0|1,0,0]=3 4993 B11R1.23 CC[C@H](N)c1cccc(O)n1 Amb27596837 [1,1,0,0,0,0|2,0,0]=4 4994 B11R1.23 CC[C@H](N)c1cncc(Br)c1 Amb28240927 [1,1,0,0,0,0|2,0,0]=4 4995 B11R1.23 CC[C@H](O)c1cccc(Br)c1 Amb28401259 [1,1,0,0,0,0|1,0,0]=3 4996 B11R1.23 CC[C@H](O)c1cccc(C)c1 Amb25794428 [1,1,0,0,0,0|1,0,0]=3 4997 B11R1.23 CC[C@H](O)c1cccc(Cl)c1 Amb27947376 [1,1,0,0,0,0|1,0,0]=3 4998 B11R1.23 CC[C@H](O)c1cccc(F)c1 Amb24447234 [1,1,0,0,0,0|1,0,0]=3 4999 B11R1.23 CC[C@H](O)c1cccc(O)c1 Amb24484509 [1,1,0,0,0,0|1,0,0]=3 5000 B11R1.23 CNC(=N)c1cccc(Br)c1 Amb27484944 [1,1,0,0,0,0|1,0,1]=4 5001 B11R1.23 CNC(=N)c1cccc(F)c1 Amb27395007 [1,1,0,0,0,0|1,0,1]=4 5002 B11R1.23 CNC(=O)c1cccc(Br)c1 Amb3887216 [1,1,0,0,0,0|1,0,1]=4 5003 B11R1.23 CNC(=O)c1cccc(F)c1 Amb3886602 [1,1,0,0,0,0|1,0,1]=4 5004 B11R1.23 CNC(=O)c1cccc(I)c1 Amb6403460 [1,1,0,0,0,0|1,0,1]=4 5005 B11R1.23 CNC(=O)c1cccc(N)c1 Amb1212262 [1,1,0,0,0,0|1,0,1]=4 5006 B11R1.23 CNC(=O)c1cccc(N)c1 Amb24053079 [1,1,0,0,0,0|1,0,1]=4 5007 B11R1.23 CNC(=O)c1cccc(O)c1 Amb6671640 [1,1,0,0,0,0|1,0,1]=4 5008 B11R1.23 CNC(C)c1cc(N)ccn1 Amb28290394 [1,1,0,0,0,0|1,0,0]=3 5009 B11R1.23 CNC(C)c1cccc(Br)c1 Amb1131184 [1,1,0,0,0,0|0,0,0]=2 5010 B11R1.23 CNC(C)c1cccc(Br)n1 Amb27164237 [1,1,0,0,0,0|1,0,0]=3 5011 B11R1.23 CNC(C)c1cccc(C)n1 Amb24477620 [1,1,0,0,0,0|1,0,0]=3 5012 B11R1.23 CNC(C)c1cccc(Cl)c1 Amb1135714 [1,1,0,0,0,0|0,0,0]=2 5013 B11R1.23 CNC(C)c1cccc(F)c1 Amb6242550 [1,1,0,0,0,0|0,0,0]=2 5014 B11R1.23 CNC(C)c1cccc(F)n1 Amb27403038 [1,1,0,0,0,0|1,0,0]=3 5015 B11R1.23 CNC(C)c1cccc(I)c1 Amb27459770 [1,1,0,0,0,0|0,0,0]=2 5016 B11R1.23 CNC(C)c1cccc(I)n1 Amb27176249 [1,1,0,0,0,0|1,0,0]=3 5017 B11R1.23 CNC(C)c1cccc(N)c1 Amb27833254 [1,1,0,0,0,0|0,0,0]=2 5018 B11R1.23 CNC(C)c1cccc(O)c1 Amb1112055 [1,1,0,0,0,0|0,0,0]=2 5019 B11R1.23 CNC(C)c1cccc(O)c1 Amb19514938 [1,1,0,0,0,0|0,0,0]=2 5020 B11R1.23 CNC(C)c1ccnc(C)n1 Amb28288992 [1,1,0,0,0,0|2,0,0]=4 5021 B11R1.23 CNC(C)c1ccnc(F)c1 Amb28250928 [1,1,0,0,0,0|1,0,0]=3 5022 B11R1.23 CNC(C)c1ccnc(N)n1 Amb27267529 [1,1,0,0,0,0|2,0,0]=4 5023 B11R1.23 CNC(C)c1cncc(F)c1 Amb18283046 [1,1,0,0,0,0|1,0,0]=3 5024 B11R1.23 CNC(C)c1cncc(N)c1 Amb27427199 [1,1,0,0,0,0|1,0,0]=3 5025 B11R1.23 CNC(C)c1cncc(O)c1 Amb27234332 [1,1,0,0,0,0|1,0,0]=3 5026 B11R1.23 CNC(C)c1nccc(O)n1 Amb33189042 [1,1,0,0,0,0|2,0,0]=4 5027 B11R1.23 CN[C@@H](C)c1cc(Cl)ccn1 Amb27471012 [1,1,0,0,0,0|1,0,0]=3 5028 B11R1.23 CN[C@@H](C)c1cccc(Cl)c1 Amb27267029 [1,1,0,0,0,0|0,0,0]=2 5029 B11R1.23 CN[C@@H](C)c1cccc(Cl)n1 Amb27606282 [1,1,0,0,0,0|1,0,0]=3 5030 B11R1.23 CN[C@@H](C)c1cccc(F)c1 Amb10838861 [1,1,0,0,0,0|0,0,0]=2 5031 B11R1.23 CN[C@@H](C)c1cccc(N)n1 Amb27267925 [1,1,0,0,0,0|1,0,0]=3 5032 B11R1.23 CN[C@@H](C)c1cccc(O)c1 Amb28428444 [1,1,0,0,0,0|0,0,0]=2 5033 B11R1.23 CN[C@@H](C)c1ccnc(C)n1 Amb32684733 [1,1,0,0,0,0|2,0,0]=4 5034 B11R1.23 CN[C@@H](C)c1ccnc(N)c1 Amb27860394 [1,1,0,0,0,0|1,0,0]=3 5035 B11R1.23 CN[C@@H](C)c1cncc(O)c1 Amb27476024 [1,1,0,0,0,0|1,0,0]=3 5036 B11R1.23 CN[C@H](C)c1cc(Br)ccn1 Amb27606366 [1,1,0,0,0,0|1,0,0]=3 5037 B11R1.23 CN[C@H](C)c1cccc(F)c1 Amb10840583 [1,1,0,0,0,0|0,0,0]=2 5038 B11R1.23 CN[C@H](C)c1cccc(F)n1 Amb27954563 [1,1,0,0,0,0|1,0,0]=3 5039 B11R1.23 CN[C@H](C)c1cccc(N)n1 Amb27434456 [1,1,0,0,0,0|1,0,0]=3 5040 B11R1.23 CN[C@H](C)c1cccc(O)c1 Amb27391641 [1,1,0,0,0,0|0,0,0]=2 5041 B11R1.23 CN[C@H](C)c1ccnc(Br)c1 Amb27459882 [1,1,0,0,0,0|1,0,0]=3 5042 B11R1.23 CN[C@H](C)c1ccnc(C)c1 Amb28145005 [1,1,0,0,0,0|1,0,0]=3 5043 B11R1.23 CN[C@H](C)c1cncc(I)c1 Amb27166041 [1,1,0,0,0,0|1,0,0]=3 5044 B11R1.23 COC(C)c1cccc(Br)c1 Amb25242655 [1,1,0,0,0,0|1,0,0]=3 5045 B11R1.23 COC(C)c1cccc(N)c1 Amb13952800 [1,1,0,0,0,0|1,0,0]=3 5046 B11R1.23 COC(O)c1cccc(Cl)c1 Amb27775876 [1,1,0,0,0,0|2,0,0]=4 5047 B11R1.23 CSC(C)c1cccc(N)c1 Amb18282127 [1,1,0,0,0,0|1,0,0]=3 5048 B11R1.23 C[C@@H](C#N)c1cccc(Br)c1 Amb27447728 [1,1,0,0,0,0|0,0,2]=4 5049 B11R1.23 C[C@@H](CN)c1cccc(F)c1 Amb33731682 [1,1,0,0,0,0|0,0,0]=2 5050 B11R1.23 C[C@@H](CN)c1ccnc(F)c1 Amb33727241 [1,1,0,0,0,0|1,0,0]=3 5051 B11R1.23 C[C@@H](CO)c1cccc(F)c1 Amb27603645 [1,1,0,0,0,0|1,0,0]=3 5052 B11R1.23 C[C@@H](CO)c1ccnc(F)c1 Amb33748025 [1,1,0,0,0,0|2,0,0]=4 5053 B11R1.23 C[C@H](CN)c1cccc(Br)c1 Amb28284808 [1,1,0,0,0,0|0,0,0]=2 5054 B11R1.23 C[C@H](CN)c1cccc(F)c1 Amb33746914 [1,1,0,0,0,0|0,0,0]=2 5055 B11R1.23 C[C@H](CN)c1ccnc(F)c1 Amb33738150 [1,1,0,0,0,0|1,0,0]=3 5056 B11R1.23 C[C@H](CO)c1cccc(F)c1 Amb25341759 [1,1,0,0,0,0|1,0,0]=3 5057 B11R1.23 C[C@H](CO)c1ccnc(F)c1 Amb33744968 [1,1,0,0,0,0|2,0,0]=4 5058 B11R1.23 C[C@H](NO)c1cccc(Br)c1 Amb27395824 [1,1,0,0,0,0|1,0,0]=3 5059 B11R1.23 C\C(=N/N)c1cccc(O)c1 Amb24484530 [1,1,0,0,0,0|1,0,1]=4 5060 B11R1.23 C\C(=N\N)c1cccc(Cl)c1 Amb27425260 [1,1,0,0,0,0|1,0,1]=4 5061 B11R1.23 C\C=C(/C)c1cccc(F)c1 Amb25837290 [1,1,0,0,0,0|0,0,2]=4 5062 B11R1.23 C\C=C(/C)c1cccc(O)c1 Amb28074810 [1,1,0,0,0,0|0,0,2]=4 5063 B11R1.23 C\C=C(\C)c1cccc(F)c1 Amb26422978 [1,1,0,0,0,0|0,0,2]=4 5064 B11R1.23 Cc1cc(C(C)CBr)ccn1 Amb33004950 [1,1,0,0,0,0|2,0,0]=4 5065 B11R1.23 Cc1cc(C(C)CN)ccn1 Amb18201826 [1,1,0,0,0,0|1,0,0]=3 5066 B11R1.23 Cc1cc(C(C)NN)ccn1 Amb27405269 [1,1,0,0,0,0|2,0,0]=4 5067 B11R1.23 Cc1cc(C(C)ON)ccn1 Amb32732952 [1,1,0,0,0,0|2,0,0]=4 5068 B11R1.23 Cc1cc(C(F)CN)ccn1 Amb32732968 [1,1,0,0,0,0|2,0,0]=4 5069 B11R1.23 Cc1cc(C(O)CN)ccn1 Amb33268552 [1,1,0,0,0,0|2,0,0]=4 5070 B11R1.23 Cc1cc([C@@H](O)CN)ccn1 Amb32732966 [1,1,0,0,0,0|2,0,0]=4 5071 B11R1.23 Cc1cc([C@H](O)CN)ccn1 Amb32732965 [1,1,0,0,0,0|2,0,0]=4 5072 B11R1.23 Cc1cccc(C(=O)CN)c1 Amb10976904 [1,1,0,0,0,0|1,0,1]=4 5073 B11R1.23 Cc1cccc(C(=O)CN)c1 Amb20171473 [1,1,0,0,0,0|1,0,1]=4 5074 B11R1.23 Cc1cccc(C(C)C#N)c1 Amb27806676 [1,1,0,0,0,0|0,0,2]=4 5075 B11R1.23 Cc1cccc(C(C)C=O)c1 Amb24380067 [1,1,0,0,0,0|1,0,1]=4 5076 B11R1.23 Cc1cccc(C(C)CBr)c1 Amb25694936 [1,1,0,0,0,0|1,0,0]=3 5077 B11R1.23 Cc1cccc(C(C)CBr)n1 Amb33336288 [1,1,0,0,0,0|2,0,0]=4 5078 B11R1.23 Cc1cccc(C(C)CCl)c1 Amb27254211 [1,1,0,0,0,0|1,0,0]=3 5079 B11R1.23 Cc1cccc(C(C)CN)c1 Amb17232058 [1,1,0,0,0,0|0,0,0]=2 5080 B11R1.23 Cc1cccc(C(C)CN)n1 Amb33502817 [1,1,0,0,0,0|1,0,0]=3 5081 B11R1.23 Cc1cccc(C(C)CO)c1 Amb24674558 [1,1,0,0,0,0|1,0,0]=3 5082 B11R1.23 Cc1cccc(C(C)NN)c1 Amb18787419 [1,1,0,0,0,0|1,0,0]=3 5083 B11R1.23 Cc1cccc(C(C)ON)c1 Amb33203924 [1,1,0,0,0,0|1,0,0]=3 5084 B11R1.23 Cc1cccc(C(C)ON)n1 Amb25130503 [1,1,0,0,0,0|2,0,0]=4 5085 B11R1.23 Cc1cccc(C(F)CBr)c1 Amb28245879 [1,1,0,0,0,0|2,0,0]=4 5086 B11R1.23 Cc1cccc(C(F)CN)c1 Amb25151821 [1,1,0,0,0,0|1,0,0]=3 5087 B11R1.23 Cc1cccc(C(F)CN)n1 Amb33199965 [1,1,0,0,0,0|2,0,0]=4 5088 B11R1.23 Cc1cccc(C(N)CF)c1 Amb25103802 [1,1,0,0,0,0|2,0,0]=4 5089 B11R1.23 Cc1cccc(C(N)CN)c1 Amb9380692 [1,1,0,0,0,0|1,0,0]=3 5090 B11R1.23 Cc1cccc(C(N)CN)n1 Amb27668971 [1,1,0,0,0,0|2,0,0]=4 5091 B11R1.23 Cc1cccc(C(N)CO)c1 Amb17232091 [1,1,0,0,0,0|2,0,0]=4 5092 B11R1.23 Cc1cccc(C(O)CBr)c1 Amb27839708 [1,1,0,0,0,0|2,0,0]=4 5093 B11R1.23 Cc1cccc(C(O)CCl)c1 Amb25059095 [1,1,0,0,0,0|2,0,0]=4 5094 B11R1.23 Cc1cccc(C(O)CF)c1 Amb25228079 [1,1,0,0,0,0|2,0,0]=4 5095 B11R1.23 Cc1cccc(C(O)CI)c1 Amb27411105 [1,1,0,0,0,0|2,0,0]=4 5096 B11R1.23 Cc1cccc(C(O)CN)c1 Amb1108715 [1,1,0,0,0,0|1,0,0]=3 5097 B11R1.23 Cc1cccc(C(O)CN)c1 Amb22235050 [1,1,0,0,0,0|1,0,0]=3 5098 B11R1.23 Cc1cccc(C(O)CN)n1 Amb24707811 [1,1,0,0,0,0|2,0,0]=4 5099 B11R1.23 Cc1cccc(C(O)CO)c1 Amb24116522 [1,1,0,0,0,0|2,0,0]=4 5100 B11R1.23 Cc1cccc([C@@H](C)CN)c1 Amb33747545 [1,1,0,0,0,0|0,0,0]=2 5101 B11R1.23 Cc1cccc([C@@H](C)CO)c1 Amb27981914 [1,1,0,0,0,0|1,0,0]=3 5102 B11R1.23 Cc1cccc([C@@H](N)CF)c1 Amb25251606 [1,1,0,0,0,0|2,0,0]=4 5103 B11R1.23 Cc1cccc([C@@H](N)CN)n1 Amb28314149 [1,1,0,0,0,0|2,0,0]=4 5104 B11R1.23 Cc1cccc([C@@H](N)CO)c1 Amb22756883 [1,1,0,0,0,0|2,0,0]=4 5105 B11R1.23 Cc1cccc([C@@H](O)CCl)c1 Amb27666931 [1,1,0,0,0,0|2,0,0]=4 5106 B11R1.23 Cc1cccc([C@@H](O)CF)c1 Amb33297484 [1,1,0,0,0,0|2,0,0]=4 5107 B11R1.23 Cc1cccc([C@@H](O)CN)c1 Amb26846212 [1,1,0,0,0,0|1,0,0]=3 5108 B11R1.23 Cc1cccc([C@@H](O)CN)n1 Amb33226207 [1,1,0,0,0,0|2,0,0]=4 5109 B11R1.23 Cc1cccc([C@@H](O)CO)c1 Amb27598612 [1,1,0,0,0,0|2,0,0]=4 5110 B11R1.23 Cc1cccc([C@H](C)CN)c1 Amb33738900 [1,1,0,0,0,0|0,0,0]=2 5111 B11R1.23 Cc1cccc([C@H](C)CO)c1 Amb25220127 [1,1,0,0,0,0|1,0,0]=3 5112 B11R1.23 Cc1cccc([C@H](N)CF)c1 Amb24472618 [1,1,0,0,0,0|2,0,0]=4 5113 B11R1.23 Cc1cccc([C@H](N)CO)c1 Amb27156538 [1,1,0,0,0,0|2,0,0]=4 5114 B11R1.23 Cc1cccc([C@H](N)CO)c1 Amb33872477 [1,1,0,0,0,0|2,0,0]=4 5115 B11R1.23 Cc1cccc([C@H](O)CF)c1 Amb33297475 [1,1,0,0,0,0|2,0,0]=4 5116 B11R1.23 Cc1cccc([C@H](O)CN)c1 Amb27477831 [1,1,0,0,0,0|1,0,0]=3 5117 B11R1.23 Cc1cccc([C@H](O)CN)n1 Amb24378058 [1,1,0,0,0,0|2,0,0]=4 5118 B11R1.23 Cc1cccc([C@H](O)CO)c1 Amb27448748 [1,1,0,0,0,0|2,0,0]=4 5119 B11R1.23 Cc1ccnc(C(C)CBr)c1 Amb33387381 [1,1,0,0,0,0|2,0,0]=4 5120 B11R1.23 Cc1ccnc(C(C)CN)c1 Amb33502791 [1,1,0,0,0,0|1,0,0]=3 5121 B11R1.23 Cc1ccnc(C(C)CN)n1 Amb25307857 [1,1,0,0,0,0|2,0,0]=4 5122 B11R1.23 Cc1ccnc(C(C)ON)c1 Amb33318122 [1,1,0,0,0,0|2,0,0]=4 5123 B11R1.23 Cc1ccnc(C(F)CN)c1 Amb33318134 [1,1,0,0,0,0|2,0,0]=4 5124 B11R1.23 Cc1ccnc(C(O)CN)c1 Amb28060149 [1,1,0,0,0,0|2,0,0]=4 5125 B11R1.23 Cc1ccnc([C@@H](O)CN)c1 Amb33318133 [1,1,0,0,0,0|2,0,0]=4 5126 B11R1.23 Cc1ccnc([C@H](O)CN)c1 Amb33318132 [1,1,0,0,0,0|2,0,0]=4 5127 B11R1.23 Cc1cncc(C(C)CBr)c1 Amb33388760 [1,1,0,0,0,0|2,0,0]=4 5128 B11R1.23 Cc1cncc(C(C)CN)c1 Amb25260685 [1,1,0,0,0,0|1,0,0]=3 5129 B11R1.23 Cc1cncc(C(C)NN)c1 Amb27465374 [1,1,0,0,0,0|2,0,0]=4 5130 B11R1.23 Cc1cncc(C(C)ON)c1 Amb33318013 [1,1,0,0,0,0|2,0,0]=4 5131 B11R1.23 Cc1cncc(C(F)CN)c1 Amb25151834 [1,1,0,0,0,0|2,0,0]=4 5132 B11R1.23 Cc1cncc(C(O)CN)c1 Amb24702062 [1,1,0,0,0,0|2,0,0]=4 5133 B11R1.23 Cc1cncc([C@@H](O)CN)c1 Amb33318026 [1,1,0,0,0,0|2,0,0]=4 5134 B11R1.23 Cc1cncc([C@H](N)CN)c1 Amb28241494 [1,1,0,0,0,0|2,0,0]=4 5135 B11R1.23 Cc1cncc([C@H](O)CN)c1 Amb33318025 [1,1,0,0,0,0|2,0,0]=4 5136 B11R1.23 NC(CF)c1cccc(Br)c1 Amb2372610 [1,1,0,0,0,0|2,0,0]=4 5137 B11R1.23 NC(CF)c1cccc(Br)c1 Amb33330096 [1,1,0,0,0,0|2,0,0]=4 5138 B11R1.23 NC(CF)c1cccc(Cl)c1 Amb22270179 [1,1,0,0,0,0|2,0,0]=4 5139 B11R1.23 NC(CF)c1cccc(Cl)c1 Amb2372608 [1,1,0,0,0,0|2,0,0]=4 5140 B11R1.23 NC(CF)c1cccc(F)c1 Amb26610331 [1,1,0,0,0,0|2,0,0]=4 5141 B11R1.23 NC(CF)c1cccc(O)c1 Amb24488065 [1,1,0,0,0,0|2,0,0]=4 5142 B11R1.23 NC(CO)c1cccc(Br)c1 Amb17242180 [1,1,0,0,0,0|2,0,0]=4 5143 B11R1.23 NC(CO)c1cccc(Br)c1 Amb33549615 [1,1,0,0,0,0|2,0,0]=4 5144 B11R1.23 NC(CO)c1cccc(Cl)c1 Amb17232853 [1,1,0,0,0,0|2,0,0]=4 5145 B11R1.23 NC(CO)c1cccc(Cl)c1 Amb19374550 [1,1,0,0,0,0|2,0,0]=4 5146 B11R1.23 NC(CO)c1cccc(F)c1 Amb19374122 [1,1,0,0,0,0|2,0,0]=4 5147 B11R1.23 NC(CO)c1cccc(F)c1 Amb8855242 [1,1,0,0,0,0|2,0,0]=4 5148 B11R1.23 NC(CO)c1cccc(I)c1 Amb25147935 [1,1,0,0,0,0|2,0,0]=4 5149 B11R1.23 NC(CO)c1cccc(I)c1 Amb35748151 [1,1,0,0,0,0|2,0,0]=4 5150 B11R1.23 NC(CO)c1cccc(O)c1 Amb18281703 [1,1,0,0,0,0|2,0,0]=4 5151 B11R1.23 NC(CO)c1cccc(O)c1 Amb30869523 [1,1,0,0,0,0|2,0,0]=4 5152 B11R1.23 NCC(=O)c1cccc(Br)c1 Amb18281391 [1,1,0,0,0,0|1,0,1]=4 5153 B11R1.23 NCC(=O)c1cccc(Br)c1 Amb2693526 [1,1,0,0,0,0|1,0,1]=4 5154 B11R1.23 NCC(=O)c1cccc(Cl)c1 Amb18951219 [1,1,0,0,0,0|1,0,1]=4 5155 B11R1.23 NCC(=O)c1cccc(Cl)c1 Amb2693527 [1,1,0,0,0,0|1,0,1]=4 5156 B11R1.23 NCC(=O)c1cccc(F)c1 Amb10840040 [1,1,0,0,0,0|1,0,1]=4 5157 B11R1.23 NCC(=O)c1cccc(F)c1 Amb18951218 [1,1,0,0,0,0|1,0,1]=4 5158 B11R1.23 NCC(=O)c1cccc(N)c1 Amb27209101 [1,1,0,0,0,0|1,0,1]=4 5159 B11R1.23 NCC(=O)c1cccc(O)c1 Amb17593761 [1,1,0,0,0,0|1,0,1]=4 5160 B11R1.23 NCC(=O)c1cccc(O)c1 Amb33801517 [1,1,0,0,0,0|1,0,1]=4 5161 B11R1.23 NCC(Cl)c1cccc(Cl)c1 Amb25741499 [1,1,0,0,0,0|1,0,0]=3 5162 B11R1.23 NCC(F)c1cc(F)ccn1 Amb33414501 [1,1,0,0,0,0|2,0,0]=4 5163 B11R1.23 NCC(F)c1cccc(Br)c1 Amb23454841 [1,1,0,0,0,0|1,0,0]=3 5164 B11R1.23 NCC(F)c1cccc(Br)n1 Amb33433126 [1,1,0,0,0,0|2,0,0]=4 5165 B11R1.23 NCC(F)c1cccc(Cl)c1 Amb25151836 [1,1,0,0,0,0|1,0,0]=3 5166 B11R1.23 NCC(F)c1cccc(Cl)n1 Amb33222339 [1,1,0,0,0,0|2,0,0]=4 5167 B11R1.23 NCC(F)c1cccc(F)c1 Amb24084158 [1,1,0,0,0,0|1,0,0]=3 5168 B11R1.23 NCC(F)c1cccc(N)c1 Amb26644355 [1,1,0,0,0,0|1,0,0]=3 5169 B11R1.23 NCC(F)c1cccc(O)c1 Amb28255809 [1,1,0,0,0,0|1,0,0]=3 5170 B11R1.23 NCC(F)c1cncc(Br)c1 Amb33389097 [1,1,0,0,0,0|2,0,0]=4 5171 B11R1.23 NCC(F)c1cncc(F)c1 Amb26861985 [1,1,0,0,0,0|2,0,0]=4 5172 B11R1.23 NCC(N)c1cccc(I)c1 Amb27945299 [1,1,0,0,0,0|1,0,0]=3 5173 B11R1.23 NCC(N)c1cccc(O)n1 Amb27799056 [1,1,0,0,0,0|2,0,0]=4 5174 B11R1.23 NCC(N)c1ccnc(F)c1 Amb27831976 [1,1,0,0,0,0|2,0,0]=4 5175 B11R1.23 NCC(N)c1ccnc(N)c1 Amb27170631 [1,1,0,0,0,0|2,0,0]=4 5176 B11R1.23 NCC(N)c1ccnc(O)c1 Amb27975800 [1,1,0,0,0,0|2,0,0]=4 5177 B11R1.23 NCC(N)c1cncc(N)c1 Amb27882632 [1,1,0,0,0,0|2,0,0]=4 5178 B11R1.23 NCC(N)c1cncc(O)c1 Amb27655532 [1,1,0,0,0,0|2,0,0]=4 5179 B11R1.23 NCC(O)c1cc(F)ccn1 Amb33415312 [1,1,0,0,0,0|2,0,0]=4 5180 B11R1.23 NCC(O)c1cccc(Br)c1 Amb33537036 [1,1,0,0,0,0|1,0,0]=3 5181 B11R1.23 NCC(O)c1cccc(Br)c1 Amb6740183 [1,1,0,0,0,0|1,0,0]=3 5182 B11R1.23 NCC(O)c1cccc(Br)n1 Amb24380697 [1,1,0,0,0,0|2,0,0]=4 5183 B11R1.23 NCC(O)c1cccc(Cl)c1 Amb2699089 [1,1,0,0,0,0|1,0,0]=3 5184 B11R1.23 NCC(O)c1cccc(Cl)c1 Amb9703840 [1,1,0,0,0,0|1,0,0]=3 5185 B11R1.23 NCC(O)c1cccc(Cl)n1 Amb26619287 [1,1,0,0,0,0|2,0,0]=4 5186 B11R1.23 NCC(O)c1cccc(F)c1 Amb1108497 [1,1,0,0,0,0|1,0,0]=3 5187 B11R1.23 NCC(O)c1cccc(F)c1 Amb2699088 [1,1,0,0,0,0|1,0,0]=3 5188 B11R1.23 NCC(O)c1cccc(N)c1 Amb24106017 [1,1,0,0,0,0|1,0,0]=3 5189 B11R1.23 NCC(O)c1cccc(O)c1 Amb2610653 [1,1,0,0,0,0|1,0,0]=3 5190 B11R1.23 NCC(O)c1cccc(O)c1 Amb33527062 [1,1,0,0,0,0|1,0,0]=3 5191 B11R1.23 NCC(O)c1ccnc(N)c1 Amb27839930 [1,1,0,0,0,0|2,0,0]=4 5192 B11R1.23 NCC(O)c1ccnc(O)c1 Amb27624406 [1,1,0,0,0,0|2,0,0]=4 5193 B11R1.23 NCC(O)c1cncc(Br)c1 Amb23586013 [1,1,0,0,0,0|2,0,0]=4 5194 B11R1.23 NCC(O)c1cncc(F)c1 Amb28189830 [1,1,0,0,0,0|2,0,0]=4 5195 B11R1.23 NC[C@@H](N)c1cc(Br)ccn1 Amb28129766 [1,1,0,0,0,0|2,0,0]=4 5196 B11R1.23 NC[C@@H](N)c1cc(Cl)ccn1 Amb27170719 [1,1,0,0,0,0|2,0,0]=4 5197 B11R1.23 NC[C@@H](N)c1cc(N)ccn1 Amb27595569 [1,1,0,0,0,0|2,0,0]=4 5198 B11R1.23 NC[C@@H](N)c1cccc(Cl)c1 Amb27233262 [1,1,0,0,0,0|1,0,0]=3 5199 B11R1.23 NC[C@@H](N)c1cccc(S)c1 Amb28145854 [1,1,0,0,0,0|1,0,0]=3 5200 B11R1.23 NC[C@@H](N)c1cncc(F)c1 Amb27760005 [1,1,0,0,0,0|2,0,0]=4 5201 B11R1.23 NC[C@@H](N)c1cncc(O)c1 Amb27855916 [1,1,0,0,0,0|2,0,0]=4 5202 B11R1.23 NC[C@@H](O)c1cc(F)ccn1 Amb33414555 [1,1,0,0,0,0|2,0,0]=4 5203 B11R1.23 NC[C@@H](O)c1cccc(Br)c1 Amb25362852 [1,1,0,0,0,0|1,0,0]=3 5204 B11R1.23 NC[C@@H](O)c1cccc(Br)c1 Amb32652186 [1,1,0,0,0,0|1,0,0]=3 5205 B11R1.23 NC[C@@H](O)c1cccc(Br)n1 Amb33433133 [1,1,0,0,0,0|2,0,0]=4 5206 B11R1.23 NC[C@@H](O)c1cccc(Cl)c1 Amb20241268 [1,1,0,0,0,0|1,0,0]=3 5207 B11R1.23 NC[C@@H](O)c1cccc(Cl)c1 Amb20241482 [1,1,0,0,0,0|1,0,0]=3 5208 B11R1.23 NC[C@@H](O)c1cccc(Cl)n1 Amb33222345 [1,1,0,0,0,0|2,0,0]=4 5209 B11R1.23 NC[C@@H](O)c1cccc(F)c1 Amb24651917 [1,1,0,0,0,0|1,0,0]=3 5210 B11R1.23 NC[C@@H](O)c1cccc(F)c1 Amb33328749 [1,1,0,0,0,0|1,0,0]=3 5211 B11R1.23 NC[C@@H](O)c1cccc(O)c1 Amb26054581 [1,1,0,0,0,0|1,0,0]=3 5212 B11R1.23 NC[C@@H](O)c1cncc(Br)c1 Amb32941804 [1,1,0,0,0,0|2,0,0]=4 5213 B11R1.23 NC[C@@H](O)c1cncc(F)c1 Amb25202772 [1,1,0,0,0,0|2,0,0]=4 5214 B11R1.23 NC[C@H](N)c1cc(Br)ccn1 Amb27945497 [1,1,0,0,0,0|2,0,0]=4 5215 B11R1.23 NC[C@H](N)c1cc(Cl)ccn1 Amb27216682 [1,1,0,0,0,0|2,0,0]=4 5216 B11R1.23 NC[C@H](N)c1cccc(Br)c1 Amb22406446 [1,1,0,0,0,0|1,0,0]=3 5217 B11R1.23 NC[C@H](N)c1cccc(F)c1 Amb27669580 [1,1,0,0,0,0|1,0,0]=3 5218 B11R1.23 NC[C@H](N)c1cccc(N)c1 Amb27658796 [1,1,0,0,0,0|1,0,0]=3 5219 B11R1.23 NC[C@H](N)c1ccnc(Cl)c1 Amb27455842 [1,1,0,0,0,0|2,0,0]=4 5220 B11R1.23 NC[C@H](N)c1cncc(Cl)c1 Amb27229750 [1,1,0,0,0,0|2,0,0]=4 5221 B11R1.23 NC[C@H](N)c1cncc(O)c1 Amb28187088 [1,1,0,0,0,0|2,0,0]=4 5222 B11R1.23 NC[C@H](O)c1cc(F)ccn1 Amb33414551 [1,1,0,0,0,0|2,0,0]=4 5223 B11R1.23 NC[C@H](O)c1cccc(Br)c1 Amb25306093 [1,1,0,0,0,0|1,0,0]=3 5224 B11R1.23 NC[C@H](O)c1cccc(Br)c1 Amb32651954 [1,1,0,0,0,0|1,0,0]=3 5225 B11R1.23 NC[C@H](O)c1cccc(Br)n1 Amb33433129 [1,1,0,0,0,0|2,0,0]=4 5226 B11R1.23 NC[C@H](O)c1cccc(Cl)c1 Amb8630386 [1,1,0,0,0,0|1,0,0]=3 5227 B11R1.23 NC[C@H](O)c1cccc(Cl)n1 Amb33222342 [1,1,0,0,0,0|2,0,0]=4 5228 B11R1.23 NC[C@H](O)c1cccc(F)c1 Amb25306092 [1,1,0,0,0,0|1,0,0]=3 5229 B11R1.23 NC[C@H](O)c1cccc(O)c1 Amb4037002 [1,1,0,0,0,0|1,0,0]=3 5230 B11R1.23 NC[C@H](O)c1cncc(Br)c1 Amb32941803 [1,1,0,0,0,0|2,0,0]=4 5231 B11R1.23 NC[C@H](O)c1cncc(F)c1 Amb26629926 [1,1,0,0,0,0|2,0,0]=4 5232 B11R1.23 N[C@@H](CF)c1cccc(Br)c1 Amb25151825 [1,1,0,0,0,0|2,0,0]=4 5233 B11R1.23 N[C@@H](CF)c1cccc(Cl)c1 Amb25214549 [1,1,0,0,0,0|2,0,0]=4 5234 B11R1.23 N[C@@H](CF)c1cccc(I)c1 Amb27172152 [1,1,0,0,0,0|2,0,0]=4 5235 B11R1.23 N[C@@H](CO)c1cccc(Br)c1 Amb22756526 [1,1,0,0,0,0|2,0,0]=4 5236 B11R1.23 N[C@@H](CO)c1cccc(Br)c1 Amb27643331 [1,1,0,0,0,0|2,0,0]=4 5237 B11R1.23 N[C@@H](CO)c1cccc(Cl)c1 Amb20242612 [1,1,0,0,0,0|2,0,0]=4 5238 B11R1.23 N[C@@H](CO)c1cccc(Cl)c1 Amb23440437 [1,1,0,0,0,0|2,0,0]=4 5239 B11R1.23 N[C@@H](CO)c1cccc(F)c1 Amb22756437 [1,1,0,0,0,0|2,0,0]=4 5240 B11R1.23 N[C@@H](CO)c1cccc(I)c1 Amb25784595 [1,1,0,0,0,0|2,0,0]=4 5241 B11R1.23 N[C@@H](CO)c1cccc(O)c1 Amb25887114 [1,1,0,0,0,0|2,0,0]=4 5242 B11R1.23 N[C@H](CF)c1cccc(Br)c1 Amb25151696 [1,1,0,0,0,0|2,0,0]=4 5243 B11R1.23 N[C@H](CF)c1cccc(Cl)c1 Amb24623067 [1,1,0,0,0,0|2,0,0]=4 5244 B11R1.23 N[C@H](CF)c1cccc(F)c1 Amb27222594 [1,1,0,0,0,0|2,0,0]=4 5245 B11R1.23 N[C@H](CO)c1cccc(Br)c1 Amb27803545 [1,1,0,0,0,0|2,0,0]=4 5246 B11R1.23 N[C@H](CO)c1cccc(Br)c1 Amb33801818 [1,1,0,0,0,0|2,0,0]=4 5247 B11R1.23 N[C@H](CO)c1cccc(Cl)c1 Amb25084835 [1,1,0,0,0,0|2,0,0]=4 5248 B11R1.23 N[C@H](CO)c1cccc(Cl)c1 Amb33801892 [1,1,0,0,0,0|2,0,0]=4 5249 B11R1.23 N[C@H](CO)c1cccc(F)c1 Amb26443828 [1,1,0,0,0,0|2,0,0]=4 5250 B11R1.23 N[C@H](CO)c1cccc(F)c1 Amb33872479 [1,1,0,0,0,0|2,0,0]=4 5251 B11R1.23 N[C@H](CO)c1cccc(I)c1 Amb27223474 [1,1,0,0,0,0|2,0,0]=4 5252 B11R1.23 N[C@H](CO)c1cccc(I)c1 Amb28989801 [1,1,0,0,0,0|2,0,0]=4 5253 B11R1.23 N[C@H](CO)c1cccc(O)c1 Amb25028057 [1,1,0,0,0,0|2,0,0]=4 5254 B11R1.23 Nc1cccc(C(N)CF)c1 Amb33190134 [1,1,0,0,0,0|2,0,0]=4 5255 B11R1.23 Nc1cccc(C(O)CO)c1 Amb18285028 [1,1,0,0,0,0|2,0,0]=4 5256 B11R1.23 OC(CBr)c1cccc(Br)c1 Amb24757789 [1,1,0,0,0,0|2,0,0]=4 5257 B11R1.23 OC(CBr)c1cccc(Cl)c1 Amb16231782 [1,1,0,0,0,0|2,0,0]=4 5258 B11R1.23 OC(CBr)c1cccc(F)c1 Amb25737937 [1,1,0,0,0,0|2,0,0]=4 5259 B11R1.23 OC(CCl)c1cccc(Br)c1 Amb27594578 [1,1,0,0,0,0|2,0,0]=4 5260 B11R1.23 OC(CCl)c1cccc(Cl)c1 Amb19888402 [1,1,0,0,0,0|2,0,0]=4 5261 B11R1.23 OC(CCl)c1cccc(F)c1 Amb26633446 [1,1,0,0,0,0|2,0,0]=4 5262 B11R1.23 OC(CF)c1cccc(Br)c1 Amb27842367 [1,1,0,0,0,0|2,0,0]=4 5263 B11R1.23 OC(CF)c1cccc(Cl)c1 Amb24457870 [1,1,0,0,0,0|2,0,0]=4 5264 B11R1.23 OC(CF)c1cccc(F)c1 Amb26373104 [1,1,0,0,0,0|2,0,0]=4 5265 B11R1.23 OC(CI)c1cccc(Br)c1 Amb25893508 [1,1,0,0,0,0|2,0,0]=4 5266 B11R1.23 OC(CI)c1cccc(Cl)c1 Amb25893316 [1,1,0,0,0,0|2,0,0]=4 5267 B11R1.23 OC(CI)c1cccc(F)c1 Amb26538548 [1,1,0,0,0,0|2,0,0]=4 5268 B11R1.23 OCC(Cl)c1cccc(Cl)c1 Amb19888392 [1,1,0,0,0,0|2,0,0]=4 5269 B11R1.23 OCC(F)c1cccc(Cl)c1 Amb28065114 [1,1,0,0,0,0|2,0,0]=4 5270 B11R1.23 OCC(F)c1cccc(F)c1 Amb24055411 [1,1,0,0,0,0|2,0,0]=4 5271 B11R1.23 OCC(O)c1cccc(Br)c1 Amb24123027 [1,1,0,0,0,0|2,0,0]=4 5272 B11R1.23 OCC(O)c1cccc(Cl)c1 Amb24116517 [1,1,0,0,0,0|2,0,0]=4 5273 B11R1.23 OCC(O)c1cccc(F)c1 Amb24123033 [1,1,0,0,0,0|2,0,0]=4 5274 B11R1.23 OCC(O)c1cccc(O)c1 Amb25087164 [1,1,0,0,0,0|2,0,0]=4 5275 B11R1.23 OC[C@@H](O)c1cccc(Cl)c1 Amb22745596 [1,1,0,0,0,0|2,0,0]=4 5276 B11R1.23 OC[C@@H](O)c1cccc(O)c1 Amb27174418 [1,1,0,0,0,0|2,0,0]=4 5277 B11R1.23 OC[C@H](O)c1cccc(Cl)c1 Amb25230571 [1,1,0,0,0,0|2,0,0]=4 5278 B11R1.23 OC[C@H](O)c1cccc(O)c1 Amb28280080 [1,1,0,0,0,0|2,0,0]=4 5279 B11R1.23 O[C@@H](CBr)c1cccc(Br)c1 Amb6893361 [1,1,0,0,0,0|2,0,0]=4 5280 B11R1.23 O[C@@H](CCl)c1cccc(Br)c1 Amb25151785 [1,1,0,0,0,0|2,0,0]=4 5281 B11R1.23 O[C@@H](CCl)c1cccc(Cl)c1 Amb16231706 [1,1,0,0,0,0|2,0,0]=4 5282 B11R1.23 O[C@@H](CF)c1cccc(Br)c1 Amb33297479 [1,1,0,0,0,0|2,0,0]=4 5283 B11R1.23 O[C@@H](CF)c1cccc(Cl)c1 Amb24682035 [1,1,0,0,0,0|2,0,0]=4 5284 B11R1.23 O[C@H](CCl)c1cccc(Br)c1 Amb25782368 [1,1,0,0,0,0|2,0,0]=4 5285 B11R1.23 O[C@H](CF)c1cccc(Br)c1 Amb33297463 [1,1,0,0,0,0|2,0,0]=4 5286 B11R1.23 O[C@H](CF)c1cccc(Cl)c1 Amb26889218 [1,1,0,0,0,0|2,0,0]=4 5287 B11R1.23 O[C@H](CF)c1cccc(F)c1 Amb24486716 [1,1,0,0,0,0|2,0,0]=4 5288 B11R1.23 Oc1cccc(C(O)CBr)c1 Amb33478422 [1,1,0,0,0,0|2,0,0]=4 5289 B11R1.23 Oc1cccc(C(O)CCl)c1 Amb24433894 [1,1,0,0,0,0|2,0,0]=4 5290 B11R1.23 Oc1cccc(C(O)CF)c1 Amb24501864 [1,1,0,0,0,0|2,0,0]=4 5291 B11R1.23 Oc1cccc([C@@H](O)CF)c1 Amb28288463 [1,1,0,0,0,0|2,0,0]=4 5292 B11R1.23 [C-]#[N+]C(C)c1cccc(Br)c1 Amb33451572 [1,1,0,0,0,0|0,0,2]=4 5293 B11R1.23 [C-]#[N+]C(C)c1cccc(C)c1 Amb3973237 [1,1,0,0,0,0|0,0,2]=4 5294 B11R1.23 [C-]#[N+]C(C)c1cccc(Cl)c1 Amb2235818 [1,1,0,0,0,0|0,0,2]=4 5295 B11R1.23 [C-]#[N+]C(C)c1cccc(F)c1 Amb27208533 [1,1,0,0,0,0|0,0,2]=4 5296 B11R1.36 C=C(C)C(C)c1ccccc1 Amb27633476 [1,1,0,0,0,0|0,0,1]=3 5297 B11R1.36 C=C(C)C(O)c1ccccc1 Amb10807411 [1,1,0,0,0,0|1,0,1]=4 5298 B11R1.36 C=C(C)[C@H](O)c1ccccc1 Amb27486178 [1,1,0,0,0,0|1,0,1]=4 5299 B11R1.36 C=C(c1ccccc1)C(C)C Amb27803525 [1,1,0,0,0,0|0,0,2]=4 5300 B11R1.36 C=C(c1ccccc1)C(C)Cl Amb27407746 [1,1,0,0,0,0|0,0,2]=4 5301 B11R1.36 CC(=O)C(Br)c1ccccc1 Amb16234147 [1,1,0,0,0,0|1,0,1]=4 5302 B11R1.36 CC(=O)C(C)c1ccccc1 Amb17593697 [1,1,0,0,0,0|0,0,1]=3 5303 B11R1.36 CC(=O)C(C)c1ccccn1 Amb17593714 [1,1,0,0,0,0|1,0,1]=4 5304 B11R1.36 CC(=O)C(Cl)c1ccccc1 Amb387177 [1,1,0,0,0,0|1,0,1]=4 5305 B11R1.36 CC(=O)C(F)c1ccccc1 Amb26477979 [1,1,0,0,0,0|1,0,1]=4 5306 B11R1.36 CC(=O)C(N)c1ccccc1 Amb25131723 [1,1,0,0,0,0|1,0,1]=4 5307 B11R1.36 CC(=O)C(N)c1ccccc1 Amb2725723 [1,1,0,0,0,0|1,0,1]=4 5308 B11R1.36 CC(=O)C(O)c1ccccc1 Amb17593725 [1,1,0,0,0,0|1,0,1]=4 5309 B11R1.36 CC(=O)C(S)c1ccccc1 Amb17594139 [1,1,0,0,0,0|1,0,1]=4 5310 B11R1.36 CC(=O)N(C)c1ccccc1 Amb2610164 [1,1,0,0,0,0|1,0,1]=4 5311 B11R1.36 CC(=O)[C@@H](Br)c1ccccc1 Amb27176478 [1,1,0,0,0,0|1,0,1]=4 5312 B11R1.36 CC(=O)[C@@H](O)c1ccccc1 Amb17619252 [1,1,0,0,0,0|1,0,1]=4 5313 B11R1.36 CC(=O)[C@H](O)c1ccccc1 Amb25088683 [1,1,0,0,0,0|1,0,1]=4 5314 B11R1.36 CC(B(O)O)c1ccccc1 Amb26372362 [1,1,0,0,0,0|2,0,0]=4 5315 B11R1.36 CC(Br)C(=O)c1ccccc1 Amb9732279 [1,1,0,0,0,0|1,0,1]=4 5316 B11R1.36 CC(C(=N)N)c1ccccc1 Amb22886648 [1,1,0,0,0,0|0,0,1]=3 5317 B11R1.36 CC(C(=O)O)c1ccccc1 Amb2720839 [1,1,0,0,0,0|1,0,1]=4 5318 B11R1.36 CC(C(N)=O)c1ccccc1 Amb25837417 [1,1,0,0,0,0|0,0,1]=3 5319 B11R1.36 CC(C(N)=O)c1cccnc1 Amb28068844 [1,1,0,0,0,0|1,0,1]=4 5320 B11R1.36 CC(C(N)=S)c1ccccc1 Amb17465747 [1,1,0,0,0,0|0,0,1]=3 5321 B11R1.36 CC(C)=C(C)c1ccccc1 Amb2780673 [1,1,0,0,0,0|0,0,2]=4 5322 B11R1.36 CC(C)C(=O)c1ccccc1 Amb4605986 [1,1,0,0,0,0|1,0,1]=4 5323 B11R1.36 CC(C)C(Br)c1ccccc1 Amb20667915 [1,1,0,0,0,0|1,0,0]=3 5324 B11R1.36 CC(C)C(Br)c1ccccn1 Amb24359282 [1,1,0,0,0,0|2,0,0]=4 5325 B11R1.36 CC(C)C(C)c1ccccc1 Amb4017389 [1,1,0,0,0,0|0,0,0]=2 5326 B11R1.36 CC(C)C(Cl)c1ccccc1 Amb17138646 [1,1,0,0,0,0|1,0,0]=3 5327 B11R1.36 CC(C)C(N)c1ccccc1 Amb22001648 [1,1,0,0,0,0|1,0,0]=3 5328 B11R1.36 CC(C)C(N)c1ccccc1 Amb9707459 [1,1,0,0,0,0|1,0,0]=3 5329 B11R1.36 CC(C)C(N)c1ccccn1 Amb10607919 [1,1,0,0,0,0|2,0,0]=4 5330 B11R1.36 CC(C)C(N)c1ccccn1 Amb13949179 [1,1,0,0,0,0|2,0,0]=4 5331 B11R1.36 CC(C)C(N)c1cccnc1 Amb10607960 [1,1,0,0,0,0|2,0,0]=4 5332 B11R1.36 CC(C)C(N)c1cccnc1 Amb13949194 [1,1,0,0,0,0|2,0,0]=4 5333 B11R1.36 CC(C)C(N)c1ccncc1 Amb18949710 [1,1,0,0,0,0|2,0,0]=4 5334 B11R1.36 CC(C)C(O)c1ccccc1 Amb9283581 [1,1,0,0,0,0|1,0,0]=3 5335 B11R1.36 CC(C)C(O)c1ccccn1 Amb13952167 [1,1,0,0,0,0|2,0,0]=4 5336 B11R1.36 CC(C)C(O)c1ccncc1 Amb18179396 [1,1,0,0,0,0|2,0,0]=4 5337 B11R1.36 CC(C)C(S)c1ccccc1 Amb18180117 [1,1,0,0,0,0|1,0,0]=3 5338 B11R1.36 CC(C)N(N)c1ccccc1 Amb18125185 [1,1,0,0,0,0|2,0,0]=4 5339 B11R1.36 CC(C)S(=O)c1ccccc1 Amb24484364 [1,1,0,0,0,0|2,0,0]=4 5340 B11R1.36 CC(C)[C@@H](C)c1ccccc1 Amb27445308 [1,1,0,0,0,0|0,0,0]=2 5341 B11R1.36 CC(C)[C@@H](N)c1ccccc1 Amb10608147 [1,1,0,0,0,0|1,0,0]=3 5342 B11R1.36 CC(C)[C@@H](N)c1ccccc1 Amb22288656 [1,1,0,0,0,0|1,0,0]=3 5343 B11R1.36 CC(C)[C@@H](N)c1ccccn1 Amb24725608 [1,1,0,0,0,0|2,0,0]=4 5344 B11R1.36 CC(C)[C@@H](N)c1cccnc1 Amb24538246 [1,1,0,0,0,0|2,0,0]=4 5345 B11R1.36 CC(C)[C@@H](N)c1ccncc1 Amb27639215 [1,1,0,0,0,0|2,0,0]=4 5346 B11R1.36 CC(C)[C@@H](O)c1ccccc1 Amb22225177 [1,1,0,0,0,0|1,0,0]=3 5347 B11R1.36 CC(C)[C@H](C)c1ccccc1 Amb27816366 [1,1,0,0,0,0|0,0,0]=2 5348 B11R1.36 CC(C)[C@H](N)c1ccccc1 Amb22284327 [1,1,0,0,0,0|1,0,0]=3 5349 B11R1.36 CC(C)[C@H](N)c1ccccc1 Amb22288702 [1,1,0,0,0,0|1,0,0]=3 5350 B11R1.36 CC(C)[C@H](N)c1ccccn1 Amb25719548 [1,1,0,0,0,0|2,0,0]=4 5351 B11R1.36 CC(C)[C@H](N)c1cccnc1 Amb24432837 [1,1,0,0,0,0|2,0,0]=4 5352 B11R1.36 CC(C)[C@H](N)c1cccnc1 Amb31291079 [1,1,0,0,0,0|2,0,0]=4 5353 B11R1.36 CC(C)[C@H](N)c1ccncc1 Amb27467693 [1,1,0,0,0,0|2,0,0]=4 5354 B11R1.36 CC(C)[C@H](O)c1ccccn1 Amb27768999 [1,1,0,0,0,0|2,0,0]=4 5355 B11R1.36 CC(Cl)C(=O)c1ccccc1 Amb477908 [1,1,0,0,0,0|1,0,1]=4 5356 B11R1.36 CC(Cl)C(C)c1cnccn1 Amb27408420 [1,1,0,0,0,0|2,0,0]=4 5357 B11R1.36 CC(Cl)C(C)c1cncnc1 Amb27652201 [1,1,0,0,0,0|2,0,0]=4 5358 B11R1.36 CC(F)C(=O)c1ccccc1 Amb10603603 [1,1,0,0,0,0|1,0,1]=4 5359 B11R1.36 CC(N)C(=O)c1ccccc1 Amb6543419 [1,1,0,0,0,0|1,0,1]=4 5360 B11R1.36 CC(N)C(C)c1ccccc1 Amb18125050 [1,1,0,0,0,0|0,0,0]=2 5361 B11R1.36 CC(N)C(C)c1cccnc1 Amb18201853 [1,1,0,0,0,0|1,0,0]=3 5362 B11R1.36 CC(N)C(C)c1ccncc1 Amb18201858 [1,1,0,0,0,0|1,0,0]=3 5363 B11R1.36 CC(N)C(N)c1ccccc1 Amb18644444 [1,1,0,0,0,0|1,0,0]=3 5364 B11R1.36 CC(N)C(N)c1cccnc1 Amb27467935 [1,1,0,0,0,0|2,0,0]=4 5365 B11R1.36 CC(N)C(N)c1ccncc1 Amb13953208 [1,1,0,0,0,0|2,0,0]=4 5366 B11R1.36 CC(N)C(O)c1ccccc1 Amb3940169 [1,1,0,0,0,0|1,0,0]=3 5367 B11R1.36 CC(N)C(O)c1ccccc1 Amb4037026 [1,1,0,0,0,0|1,0,0]=3 5368 B11R1.36 CC(N)C(O)c1ccncc1 Amb19373096 [1,1,0,0,0,0|2,0,0]=4 5369 B11R1.36 CC(N)C(O)c1ccncc1 Amb6740242 [1,1,0,0,0,0|2,0,0]=4 5370 B11R1.36 CC(N)[C@@H](O)c1ccccc1 Amb27242684 [1,1,0,0,0,0|1,0,0]=3 5371 B11R1.36 CC(N)[C@H](O)c1ccccc1 Amb26057134 [1,1,0,0,0,0|1,0,0]=3 5372 B11R1.36 CC(O)C(=O)c1ccccc1 Amb18799361 [1,1,0,0,0,0|1,0,1]=4 5373 B11R1.36 CC(O)C(Br)c1ccccc1 Amb28241304 [1,1,0,0,0,0|1,0,0]=3 5374 B11R1.36 CC(O)C(C)c1ccccc1 Amb4020076 [1,1,0,0,0,0|0,0,0]=2 5375 B11R1.36 CC(O)C(C)c1cccnc1 Amb27227517 [1,1,0,0,0,0|1,0,0]=3 5376 B11R1.36 CC(O)C(C)c1cnccn1 Amb24352493 [1,1,0,0,0,0|2,0,0]=4 5377 B11R1.36 CC(O)C(C)c1cncnc1 Amb27808190 [1,1,0,0,0,0|2,0,0]=4 5378 B11R1.36 CC(O)C(N)c1ccccc1 Amb28960311 [1,1,0,0,0,0|1,0,0]=3 5379 B11R1.36 CC(O)C(N)c1ccccc1 Amb8854990 [1,1,0,0,0,0|1,0,0]=3 5380 B11R1.36 CC(O)C(N)c1ccncc1 Amb27168210 [1,1,0,0,0,0|2,0,0]=4 5381 B11R1.36 CC(O)C(O)c1ccccn1 Amb28290888 [1,1,0,0,0,0|2,0,0]=4 5382 B11R1.36 CC(O)C(O)c1ccncc1 Amb27208087 [1,1,0,0,0,0|2,0,0]=4 5383 B11R1.36 CC(O)[C@H](N)c1cccnc1 Amb27163039 [1,1,0,0,0,0|2,0,0]=4 5384 B11R1.36 CC(S)C(=O)c1ccccc1 Amb25142605 [1,1,0,0,0,0|1,0,1]=4 5385 B11R1.36 CC(c1ccccc1)N(C)C Amb4034685 [1,1,0,0,0,0|0,0,0]=2 5386 B11R1.36 CC(c1ccccc1)[C@@H](C)N Amb33081804 [1,1,0,0,0,0|0,0,0]=2 5387 B11R1.36 CC(c1ccccc1)[C@@H](C)O Amb26461660 [1,1,0,0,0,0|0,0,0]=2 5388 B11R1.36 CC(c1ccccc1)[C@H](C)N Amb29867823 [1,1,0,0,0,0|0,0,0]=2 5389 B11R1.36 CC(c1ccccc1)[C@H](C)O Amb4018956 [1,1,0,0,0,0|0,0,0]=2 5390 B11R1.36 CC(c1ccccc1)[N+](=O)[O-] Amb6298399 [1,1,0,0,0,0|1,0,1]=4 5391 B11R1.36 CC(c1ccccc1)[PH](=O)O Amb28422773 [1,1,0,0,0,0|1,1,0]=4 5392 B11R1.36 CC(c1cccnc1)[C@@H](C)N Amb33731284 [1,1,0,0,0,0|1,0,0]=3 5393 B11R1.36 CC(c1cccnc1)[C@H](C)N Amb33729328 [1,1,0,0,0,0|1,0,0]=3 5394 B11R1.36 CN(C(=N)N)c1ccccc1 Amb33550077 [1,1,0,0,0,0|1,0,1]=4 5395 B11R1.36 CN(C(=N)N)c1ccccc1 Amb6682746 [1,1,0,0,0,0|1,0,1]=4 5396 B11R1.36 CN(C(N)=O)c1ccccc1 Amb1137584 [1,1,0,0,0,0|1,0,1]=4 5397 B11R1.36 CN(C(N)=S)c1ccccc1 Amb1132381 [1,1,0,0,0,0|1,0,1]=4 5398 B11R1.36 CN(C)C(=N)c1ccccc1 Amb23447126 [1,1,0,0,0,0|1,0,1]=4 5399 B11R1.36 CN(C)C(=O)c1ccccc1 Amb33513268 [1,1,0,0,0,0|1,0,1]=4 5400 B11R1.36 CN(C)C(=O)c1ccccc1 Amb3886594 [1,1,0,0,0,0|1,0,1]=4 5401 B11R1.36 CN(C)C(=S)c1ccccc1 Amb2733763 [1,1,0,0,0,0|1,0,1]=4 5402 B11R1.36 CN(C)C(N)c1ccccc1 Amb19516165 [1,1,0,0,0,0|1,0,0]=3 5403 B11R1.36 CN(N)C(=N)c1ccccc1 Amb10870953 [1,1,0,0,0,0|1,0,1]=4 5404 B11R1.36 CN(N)C(=O)c1ccccc1 Amb18125146 [1,1,0,0,0,0|1,0,1]=4 5405 B11R1.36 CN(N)C(=S)c1ccccc1 Amb26880376 [1,1,0,0,0,0|1,0,1]=4 5406 B11R1.36 CN(O)C(=O)c1ccccc1 Amb25082592 [1,1,0,0,0,0|1,0,1]=4 5407 B11R1.36 CS(=O)[C@@H](Cl)c1ccccc1 Amb27401935 [1,1,0,0,0,0|2,0,0]=4 5408 B11R1.36 C[C@@H](Br)C(=O)c1ccccc1 Amb27176347 [1,1,0,0,0,0|1,0,1]=4 5409 B11R1.36 C[C@@H](C(=O)O)c1ccccc1 Amb8514913 [1,1,0,0,0,0|1,0,1]=4 5410 B11R1.36 C[C@@H](C(N)=O)c1ccccc1 Amb4166308 [1,1,0,0,0,0|0,0,1]=3 5411 B11R1.36 C[C@@H](Cl)[C@H](Cl)c1ccccc1 Amb28396543 [1,1,0,0,0,0|1,0,0]=3 5412 B11R1.36 C[C@@H](N)C(=O)c1ccccc1 Amb25757602 [1,1,0,0,0,0|1,0,1]=4 5413 B11R1.36 C[C@@H](N)C(O)c1ccccc1 Amb27753037 [1,1,0,0,0,0|1,0,0]=3 5414 B11R1.36 C[C@@H](N)C(O)c1cccnc1 Amb35618092 [1,1,0,0,0,0|2,0,0]=4 5415 B11R1.36 C[C@@H](N)[C@@H](F)c1ccccc1 Amb27232785 [1,1,0,0,0,0|1,0,0]=3 5416 B11R1.36 C[C@@H](N)[C@@H](O)c1ccccn1 Amb28368419 [1,1,0,0,0,0|2,0,0]=4 5417 B11R1.36 C[C@@H](N)[C@@H](O)c1cccnc1 Amb28055264 [1,1,0,0,0,0|2,0,0]=4 5418 B11R1.36 C[C@@H](N)[C@@H](O)c1ccncc1 Amb27882675 [1,1,0,0,0,0|2,0,0]=4 5419 B11R1.36 C[C@@H](N)[C@H](F)c1ccccc1 Amb27858730 [1,1,0,0,0,0|1,0,0]=3 5420 B11R1.36 C[C@@H](N)[C@H](S)c1ccccc1 Amb27626864 [1,1,0,0,0,0|1,0,0]=3 5421 B11R1.36 C[C@@H](O)[C@@H](F)c1ccccc1 Amb27664239 [1,1,0,0,0,0|1,0,0]=3 5422 B11R1.36 C[C@@H](O)[C@@H](N)c1ccccn1 Amb27823281 [1,1,0,0,0,0|2,0,0]=4 5423 B11R1.36 C[C@@H](c1ccccc1)N(C)C Amb10807413 [1,1,0,0,0,0|0,0,0]=2 5424 B11R1.36 C[C@@H](c1ccccc1)[C@@H](C)N Amb27253730 [1,1,0,0,0,0|0,0,0]=2 5425 B11R1.36 C[C@@H](c1ccccc1)[C@@H](C)O Amb28256055 [1,1,0,0,0,0|0,0,0]=2 5426 B11R1.36 C[C@@H](c1ccccn1)N(C)C Amb25858370 [1,1,0,0,0,0|1,0,0]=3 5427 B11R1.36 C[C@H](Br)C(=O)c1ccccc1 Amb25689646 [1,1,0,0,0,0|1,0,1]=4 5428 B11R1.36 C[C@H](C(=O)O)c1ccccc1 Amb3938973 [1,1,0,0,0,0|1,0,1]=4 5429 B11R1.36 C[C@H](C(N)=O)c1ccccc1 Amb4166312 [1,1,0,0,0,0|0,0,1]=3 5430 B11R1.36 C[C@H](Cl)[C@@H](F)c1ccccc1 Amb27955187 [1,1,0,0,0,0|1,0,0]=3 5431 B11R1.36 C[C@H](F)[C@@H](O)c1ccccc1 Amb27220177 [1,1,0,0,0,0|1,0,0]=3 5432 B11R1.36 C[C@H](N)C(O)c1ccccc1 Amb27659372 [1,1,0,0,0,0|1,0,0]=3 5433 B11R1.36 C[C@H](N)C(O)c1cccnc1 Amb35738409 [1,1,0,0,0,0|2,0,0]=4 5434 B11R1.36 C[C@H](N)[C@@H](Br)c1ccccc1 Amb27205248 [1,1,0,0,0,0|1,0,0]=3 5435 B11R1.36 C[C@H](N)[C@@H](N)c1cccnc1 Amb27473649 [1,1,0,0,0,0|2,0,0]=4 5436 B11R1.36 C[C@H](N)[C@@H](N)c1ccncc1 Amb28075271 [1,1,0,0,0,0|2,0,0]=4 5437 B11R1.36 C[C@H](N)[C@@H](O)c1ccccc1 Amb17619646 [1,1,0,0,0,0|1,0,0]=3 5438 B11R1.36 C[C@H](N)[C@H](C)c1ccccc1 Amb28365429 [1,1,0,0,0,0|0,0,0]=2 5439 B11R1.36 C[C@H](N)[C@H](N)c1ccccc1 Amb27772031 [1,1,0,0,0,0|1,0,0]=3 5440 B11R1.36 C[C@H](N)[C@H](O)c1ccccc1 Amb3939345 [1,1,0,0,0,0|1,0,0]=3 5441 B11R1.36 C[C@H](N)[C@H](O)c1cccnc1 Amb28326046 [1,1,0,0,0,0|2,0,0]=4 5442 B11R1.36 C[C@H](N)[C@H](O)c1ccncc1 Amb27430303 [1,1,0,0,0,0|2,0,0]=4 5443 B11R1.36 C[C@H](O)[C@@H](C)c1ccccc1 Amb16210577 [1,1,0,0,0,0|0,0,0]=2 5444 B11R1.36 C[C@H](O)[C@@H](N)c1ccccc1 Amb25791116 [1,1,0,0,0,0|1,0,0]=3 5445 B11R1.36 C[C@H](O)[C@@H](N)c1cccnc1 Amb28046815 [1,1,0,0,0,0|2,0,0]=4 5446 B11R1.36 C[C@H](O)[C@H](Br)c1ccccc1 Amb27390103 [1,1,0,0,0,0|1,0,0]=3 5447 B11R1.36 C[C@H](O)[C@H](N)c1ccccc1 Amb33872242 [1,1,0,0,0,0|1,0,0]=3 5448 B11R1.36 C[C@H](O)[C@H](O)c1ccccc1 Amb25362712 [1,1,0,0,0,0|1,0,0]=3 5449 B11R1.36 C[C@H](c1ccccc1)N(C)C Amb8516299 [1,1,0,0,0,0|0,0,0]=2 5450 B11R1.36 C\C(Br)=C(/C)c1ccccc1 Amb4035425 [1,1,0,0,0,0|0,0,2]=4 5451 B11R1.36 ClC(Cl)C(Cl)c1ccccc1 Amb17835935 [1,1,0,0,0,0|2,0,0]=4 5452 B11R1.36 FC(F)C(Br)c1ccccc1 Amb24664987 [1,1,0,0,0,0|2,0,0]=4 5453 B11R1.36 FC(F)C(Cl)c1ccccc1 Amb24400669 [1,1,0,0,0,0|2,0,0]=4 5454 B11R1.36 N=C(N)C(O)c1ccccc1 Amb19890170 [1,1,0,0,0,0|1,0,1]=4 5455 B11R1.36 N=C(N)C(O)c1ccccc1 Amb6316124 [1,1,0,0,0,0|1,0,1]=4 5456 B11R1.36 N=C(N)[C@@H](O)c1ccccc1 Amb22587581 [1,1,0,0,0,0|1,0,1]=4 5457 B11R1.36 N=C(N)[C@H](O)c1ccccc1 Amb22587530 [1,1,0,0,0,0|1,0,1]=4 5458 B11R1.36 NC(=O)C(Br)c1ccccc1 Amb23450271 [1,1,0,0,0,0|1,0,1]=4 5459 B11R1.36 NC(=O)C(Cl)c1ccccc1 Amb1678054 [1,1,0,0,0,0|1,0,1]=4 5460 B11R1.36 NC(=O)C(N)c1ccccc1 Amb13951330 [1,1,0,0,0,0|1,0,1]=4 5461 B11R1.36 NC(=O)C(N)c1ccccc1 Amb9720012 [1,1,0,0,0,0|1,0,1]=4 5462 B11R1.36 NC(=O)C(O)c1ccccc1 Amb2611605 [1,1,0,0,0,0|1,0,1]=4 5463 B11R1.36 NC(=O)C(S)c1ccccc1 Amb27823310 [1,1,0,0,0,0|1,0,1]=4 5464 B11R1.36 NC(=O)[C@@H](Cl)c1ccccc1 Amb28244737 [1,1,0,0,0,0|1,0,1]=4 5465 B11R1.36 NC(=O)[C@@H](N)c1ccccc1 Amb10603128 [1,1,0,0,0,0|1,0,1]=4 5466 B11R1.36 NC(=O)[C@@H](N)c1ccccc1 Amb22745343 [1,1,0,0,0,0|1,0,1]=4 5467 B11R1.36 NC(=O)[C@@H](O)c1ccccc1 Amb20671372 [1,1,0,0,0,0|1,0,1]=4 5468 B11R1.36 NC(=O)[C@H](N)c1ccccc1 Amb22353208 [1,1,0,0,0,0|1,0,1]=4 5469 B11R1.36 NC(=O)[C@H](N)c1ccccc1 Amb8392882 [1,1,0,0,0,0|1,0,1]=4 5470 B11R1.36 NC(=O)[C@H](O)c1ccccc1 Amb20671371 [1,1,0,0,0,0|1,0,1]=4 5471 B11R1.36 NC(=S)C(N)c1ccccc1 Amb19374911 [1,1,0,0,0,0|1,0,1]=4 5472 B11R1.36 NC(=S)[C@@H](O)c1ccccc1 Amb27650180 [1,1,0,0,0,0|1,0,1]=4 5473 B11R1.36 NC(Cl)C(O)c1ccccc1 Amb28134966 [1,1,0,0,0,0|1,0,0]=3 5474 B11R1.36 NC(c1ccccc1)C(F)Cl Amb27776949 [1,1,0,0,0,0|2,0,0]=4 5475 B11R1.36 NC(c1ccccc1)C(F)F Amb28872274 [1,1,0,0,0,0|2,0,0]=4 5476 B11R1.36 NC(c1ccccc1)C(F)F Amb7783757 [1,1,0,0,0,0|2,0,0]=4 5477 B11R1.36 N[C@@H](c1ccccc1)C(F)F Amb24485821 [1,1,0,0,0,0|2,0,0]=4 5478 B11R1.36 N[C@@H](c1ccccc1)C(F)F Amb33483668 [1,1,0,0,0,0|2,0,0]=4 5479 B11R1.36 N[C@H](Cl)[C@H](O)c1ccccc1 Amb27194438 [1,1,0,0,0,0|1,0,0]=3 5480 B11R1.36 N[C@H](c1ccccc1)C(F)F Amb27607103 [1,1,0,0,0,0|2,0,0]=4 5481 B11R1.36 N[C@H](c1ccccc1)C(F)F Amb33483577 [1,1,0,0,0,0|2,0,0]=4 5482 B11R1.36 OC(c1ccccc1)C(Cl)Cl Amb28244940 [1,1,0,0,0,0|2,0,0]=4 5483 B11R1.36 OC(c1ccccc1)C(F)F Amb19895457 [1,1,0,0,0,0|2,0,0]=4 5484 B11R1.36 O[C@@H](c1ccccc1)C(F)F Amb24623094 [1,1,0,0,0,0|2,0,0]=4 5485 B11R1.36 O[C@@H](c1ccccc1)[C@@H](F)Cl Amb27878816 [1,1,0,0,0,0|2,0,0]=4 5486 B11R1.36 O[C@H](c1ccccc1)C(Cl)Cl Amb28365479 [1,1,0,0,0,0|2,0,0]=4 5487 B11R1.36 O[C@H](c1ccccc1)C(F)F Amb25977650 [1,1,0,0,0,0|2,0,0]=4 5488 B11R1.222 C#CC(C)c1ccccc1Br Amb33387638 [1,1,0,0,0,0|0,0,2]=4 5489 B11R1.222 C#CC(C)c1ccccc1C Amb33360563 [1,1,0,0,0,0|0,0,2]=4 5490 B11R1.222 C#CC(C)c1ccccc1Cl Amb33052549 [1,1,0,0,0,0|0,0,2]=4 5491 B11R1.222 C#CC(C)c1ccccc1F Amb33361475 [1,1,0,0,0,0|0,0,2]=4 5492 B11R1.222 C#CC(C)c1ccccc1O Amb33196171 [1,1,0,0,0,0|0,0,2]=4 5493 B11R1.222 C=C(CN)c1ccccc1Br Amb33388495 [1,1,0,0,0,0|0,0,2]=4 5494 B11R1.222 C=C(CN)c1ccccc1C Amb18251307 [1,1,0,0,0,0|0,0,2]=4 5495 B11R1.222 C=C(CN)c1ccccc1Cl Amb18251924 [1,1,0,0,0,0|0,0,2]=4 5496 B11R1.222 C=C(CN)c1ccccc1F Amb18908418 [1,1,0,0,0,0|0,0,2]=4 5497 B11R1.222 C=C(CN)c1ccccc1O Amb33196166 [1,1,0,0,0,0|0,0,2]=4 5498 B11R1.222 C=CC(C)c1ccccc1N Amb18124835 [1,1,0,0,0,0|0,0,2]=4 5499 B11R1.222 CC(C#N)c1ccccc1Br Amb18131118 [1,1,0,0,0,0|0,0,2]=4 5500 B11R1.222 CC(C#N)c1ccccc1Cl Amb18126434 [1,1,0,0,0,0|0,0,2]=4 5501 B11R1.222 CC(C#N)c1ccccc1F Amb8950029 [1,1,0,0,0,0|0,0,2]=4 5502 B11R1.222 CC(C#N)c1ccccc1I Amb24683473 [1,1,0,0,0,0|0,0,2]=4 5503 B11R1.222 CC(C=O)c1ccccc1Cl Amb27661607 [1,1,0,0,0,0|1,0,1]=4 5504 B11R1.222 CC(C=O)c1ccccc1F Amb24070131 [1,1,0,0,0,0|1,0,1]=4 5505 B11R1.222 CC(C=O)c1ccccc1I Amb25990503 [1,1,0,0,0,0|1,0,1]=4 5506 B11R1.222 CC(C=O)c1ccccc1N Amb26880158 [1,1,0,0,0,0|1,0,1]=4 5507 B11R1.222 CC(C=O)c1ccccc1O Amb18125106 [1,1,0,0,0,0|1,0,1]=4 5508 B11R1.222 CC(CBr)c1ccccc1Br Amb25875710 [1,1,0,0,0,0|1,0,0]=3 5509 B11R1.222 CC(CBr)c1ccccc1Cl Amb25148944 [1,1,0,0,0,0|1,0,0]=3 5510 B11R1.222 CC(CBr)c1ccccc1F Amb25890520 [1,1,0,0,0,0|1,0,0]=3 5511 B11R1.222 CC(CBr)c1ccccc1O Amb33334192 [1,1,0,0,0,0|1,0,0]=3 5512 B11R1.222 CC(CBr)c1cccnc1Br Amb33387809 [1,1,0,0,0,0|2,0,0]=4 5513 B11R1.222 CC(CBr)c1cccnc1Cl Amb33389004 [1,1,0,0,0,0|2,0,0]=4 5514 B11R1.222 CC(CBr)c1cccnc1F Amb33450429 [1,1,0,0,0,0|2,0,0]=4 5515 B11R1.222 CC(CBr)c1ccncc1Br Amb33388614 [1,1,0,0,0,0|2,0,0]=4 5516 B11R1.222 CC(CBr)c1ccncc1Cl Amb33336312 [1,1,0,0,0,0|2,0,0]=4 5517 B11R1.222 CC(CBr)c1ccncc1F Amb33388759 [1,1,0,0,0,0|2,0,0]=4 5518 B11R1.222 CC(CBr)c1ncccc1Br Amb33336056 [1,1,0,0,0,0|2,0,0]=4 5519 B11R1.222 CC(CBr)c1ncccc1F Amb33335643 [1,1,0,0,0,0|2,0,0]=4 5520 B11R1.222 CC(CCl)c1ccccc1Br Amb25055326 [1,1,0,0,0,0|1,0,0]=3 5521 B11R1.222 CC(CCl)c1ccccc1Cl Amb27805648 [1,1,0,0,0,0|1,0,0]=3 5522 B11R1.222 CC(CCl)c1ccccc1F Amb25098050 [1,1,0,0,0,0|1,0,0]=3 5523 B11R1.222 CC(CCl)c1ccccc1I Amb28292839 [1,1,0,0,0,0|1,0,0]=3 5524 B11R1.222 CC(CN)N1C=CC=CC1=O Amb18542686 [1,1,0,0,0,0|1,0,0]=3 5525 B11R1.222 CC(CN)c1ccccc1Br Amb18174811 [1,1,0,0,0,0|0,0,0]=2 5526 B11R1.222 CC(CN)c1ccccc1Cl Amb17232735 [1,1,0,0,0,0|0,0,0]=2 5527 B11R1.222 CC(CN)c1ccccc1F Amb8950126 [1,1,0,0,0,0|0,0,0]=2 5528 B11R1.222 CC(CN)c1ccccc1I Amb24558935 [1,1,0,0,0,0|0,0,0]=2 5529 B11R1.222 CC(CN)c1ccccc1O Amb25100841 [1,1,0,0,0,0|0,0,0]=2 5530 B11R1.222 CC(CN)c1cccnc1Br Amb33387428 [1,1,0,0,0,0|1,0,0]=3 5531 B11R1.222 CC(CN)c1cccnc1Cl Amb33256917 [1,1,0,0,0,0|1,0,0]=3 5532 B11R1.222 CC(CN)c1cccnc1F Amb33378335 [1,1,0,0,0,0|1,0,0]=3 5533 B11R1.222 CC(CN)c1ccncc1Br Amb33389527 [1,1,0,0,0,0|1,0,0]=3 5534 B11R1.222 CC(CN)c1ccncc1Cl Amb33413506 [1,1,0,0,0,0|1,0,0]=3 5535 B11R1.222 CC(CN)c1ccncc1F Amb25677090 [1,1,0,0,0,0|1,0,0]=3 5536 B11R1.222 CC(CN)c1ncccc1Br Amb24486134 [1,1,0,0,0,0|1,0,0]=3 5537 B11R1.222 CC(CN)c1ncccc1F Amb33502825 [1,1,0,0,0,0|1,0,0]=3 5538 B11R1.222 CC(CO)c1ccccc1Br Amb24453441 [1,1,0,0,0,0|1,0,0]=3 5539 B11R1.222 CC(CO)c1ccccc1Cl Amb27594243 [1,1,0,0,0,0|1,0,0]=3 5540 B11R1.222 CC(CO)c1ccccc1F Amb26648146 [1,1,0,0,0,0|1,0,0]=3 5541 B11R1.222 CC(CO)c1ccccc1N Amb27433927 [1,1,0,0,0,0|1,0,0]=3 5542 B11R1.222 CC(CO)c1ccccc1O Amb27804491 [1,1,0,0,0,0|1,0,0]=3 5543 B11R1.222 CC(CO)c1ccncc1Br Amb33620376 [1,1,0,0,0,0|2,0,0]=4 5544 B11R1.222 CC(NN)c1ccncc1Cl Amb27868198 [1,1,0,0,0,0|2,0,0]=4 5545 B11R1.222 CC(NO)c1ccccc1F Amb27162764 [1,1,0,0,0,0|1,0,0]=3 5546 B11R1.222 CC(ON)c1ccccc1Br Amb33388419 [1,1,0,0,0,0|1,0,0]=3 5547 B11R1.222 CC(ON)c1ccccc1Cl Amb33052586 [1,1,0,0,0,0|1,0,0]=3 5548 B11R1.222 CC(ON)c1ccccc1F Amb33361486 [1,1,0,0,0,0|1,0,0]=3 5549 B11R1.222 CC(ON)c1ccccc1O Amb33196414 [1,1,0,0,0,0|1,0,0]=3 5550 B11R1.222 CC(ON)c1cccnc1Br Amb33387778 [1,1,0,0,0,0|2,0,0]=4 5551 B11R1.222 CC(ON)c1cccnc1Cl Amb33257331 [1,1,0,0,0,0|2,0,0]=4 5552 B11R1.222 CC(ON)c1cccnc1F Amb33377676 [1,1,0,0,0,0|2,0,0]=4 5553 B11R1.222 CC(ON)c1ccncc1Br Amb33388683 [1,1,0,0,0,0|2,0,0]=4 5554 B11R1.222 CC(ON)c1ccncc1Cl Amb33413774 [1,1,0,0,0,0|2,0,0]=4 5555 B11R1.222 CC(ON)c1ccncc1F Amb33317191 [1,1,0,0,0,0|2,0,0]=4 5556 B11R1.222 CC(ON)c1ncccc1Br Amb33336077 [1,1,0,0,0,0|2,0,0]=4 5557 B11R1.222 CC(ON)c1ncccc1F Amb33418801 [1,1,0,0,0,0|2,0,0]=4 5558 B11R1.222 CCC(=O)c1ccccc1Br Amb17339933 [1,1,0,0,0,0|1,0,1]=4 5559 B11R1.222 CCC(=O)c1ccccc1C Amb16185657 [1,1,0,0,0,0|1,0,1]=4 5560 B11R1.222 CCC(=O)c1ccccc1Cl Amb17198735 [1,1,0,0,0,0|1,0,1]=4 5561 B11R1.222 CCC(=O)c1ccccc1F Amb4605916 [1,1,0,0,0,0|1,0,1]=4 5562 B11R1.222 CCC(=O)c1ccccc1I Amb26353010 [1,1,0,0,0,0|1,0,1]=4 5563 B11R1.222 CCC(=O)c1ccccc1N Amb1772753 [1,1,0,0,0,0|1,0,1]=4 5564 B11R1.222 CCC(=O)c1ccccc1O Amb1210123 [1,1,0,0,0,0|1,0,1]=4 5565 B11R1.222 CCC(Br)c1ccccc1F Amb25990504 [1,1,0,0,0,0|1,0,0]=3 5566 B11R1.222 CCC(Br)c1cccnc1Br Amb27662156 [1,1,0,0,0,0|2,0,0]=4 5567 B11R1.222 CCC(Br)c1cccnc1C Amb27662293 [1,1,0,0,0,0|2,0,0]=4 5568 B11R1.222 CCC(Br)c1cccnc1Cl Amb28365792 [1,1,0,0,0,0|2,0,0]=4 5569 B11R1.222 CCC(Br)c1ncccc1Cl Amb27394819 [1,1,0,0,0,0|2,0,0]=4 5570 B11R1.222 CCC(Br)c1ncccc1F Amb27790385 [1,1,0,0,0,0|2,0,0]=4 5571 B11R1.222 CCC(C)c1ccccc1Br Amb20617128 [1,1,0,0,0,0|0,0,0]=2 5572 B11R1.222 CCC(C)c1ccccc1C Amb28455793 [1,1,0,0,0,0|0,0,0]=2 5573 B11R1.222 CCC(C)c1ccccc1Cl Amb27635396 [1,1,0,0,0,0|0,0,0]=2 5574 B11R1.222 CCC(C)c1ccccc1F Amb26891261 [1,1,0,0,0,0|0,0,0]=2 5575 B11R1.222 CCC(C)c1ccccc1I Amb24564175 [1,1,0,0,0,0|0,0,0]=2 5576 B11R1.222 CCC(C)c1ccccc1N Amb9756155 [1,1,0,0,0,0|0,0,0]=2 5577 B11R1.222 CCC(C)c1ccccc1O Amb3939542 [1,1,0,0,0,0|0,0,0]=2 5578 B11R1.222 CCC(C)c1ccccc1S Amb27451633 [1,1,0,0,0,0|0,0,0]=2 5579 B11R1.222 CCC(C)c1cccnc1Br Amb24319292 [1,1,0,0,0,0|1,0,0]=3 5580 B11R1.222 CCC(C)c1cccnc1C Amb27159369 [1,1,0,0,0,0|1,0,0]=3 5581 B11R1.222 CCC(C)c1cccnc1Cl Amb24319293 [1,1,0,0,0,0|1,0,0]=3 5582 B11R1.222 CCC(C)c1cccnc1N Amb18201848 [1,1,0,0,0,0|1,0,0]=3 5583 B11R1.222 CCC(C)c1cccnc1O Amb24319294 [1,1,0,0,0,0|1,0,0]=3 5584 B11R1.222 CCC(C)c1ccncc1Br Amb24321010 [1,1,0,0,0,0|1,0,0]=3 5585 B11R1.222 CCC(C)c1ccncc1C Amb28146835 [1,1,0,0,0,0|1,0,0]=3 5586 B11R1.222 CCC(C)c1ccncc1N Amb18831281 [1,1,0,0,0,0|1,0,0]=3 5587 B11R1.222 CCC(C)c1cnccc1Br Amb24320591 [1,1,0,0,0,0|1,0,0]=3 5588 B11R1.222 CCC(C)c1cnccc1N Amb24320593 [1,1,0,0,0,0|1,0,0]=3 5589 B11R1.222 CCC(C)c1ncccc1Br Amb24320822 [1,1,0,0,0,0|1,0,0]=3 5590 B11R1.222 CCC(C)c1ncccc1N Amb18201845 [1,1,0,0,0,0|1,0,0]=3 5591 B11R1.222 CCC(C)c1nccnc1Br Amb26475506 [1,1,0,0,0,0|2,0,0]=4 5592 B11R1.222 CCC(C)c1nccnc1C Amb28203266 [1,1,0,0,0,0|2,0,0]=4 5593 B11R1.222 CCC(C)c1nccnc1Cl Amb28352330 [1,1,0,0,0,0|2,0,0]=4 5594 B11R1.222 CCC(C)c1ncncc1Br Amb10068153 [1,1,0,0,0,0|2,0,0]=4 5595 B11R1.222 CCC(C)c1ncncc1N Amb25092831 [1,1,0,0,0,0|2,0,0]=4 5596 B11R1.222 CCC(Cl)c1ccccc1Cl Amb27402010 [1,1,0,0,0,0|1,0,0]=3 5597 B11R1.222 CCC(N)c1ccccc1Br Amb18966096 [1,1,0,0,0,0|1,0,0]=3 5598 B11R1.222 CCC(N)c1ccccc1C Amb17232057 [1,1,0,0,0,0|1,0,0]=3 5599 B11R1.222 CCC(N)c1ccccc1Cl Amb17232736 [1,1,0,0,0,0|1,0,0]=3 5600 B11R1.222 CCC(N)c1ccccc1Cl Amb22276945 [1,1,0,0,0,0|1,0,0]=3 5601 B11R1.222 CCC(N)c1ccccc1F Amb10840595 [1,1,0,0,0,0|1,0,0]=3 5602 B11R1.222 CCC(N)c1ccccc1F Amb30982522 [1,1,0,0,0,0|1,0,0]=3 5603 B11R1.222 CCC(N)c1ccccc1O Amb1118100 [1,1,0,0,0,0|1,0,0]=3 5604 B11R1.222 CCC(N)c1ccccc1O Amb19404313 [1,1,0,0,0,0|1,0,0]=3 5605 B11R1.222 CCC(N)c1cccnc1Br Amb27390045 [1,1,0,0,0,0|2,0,0]=4 5606 B11R1.222 CCC(N)c1cccnc1Cl Amb27627388 [1,1,0,0,0,0|2,0,0]=4 5607 B11R1.222 CCC(N)c1cccnc1F Amb18831021 [1,1,0,0,0,0|2,0,0]=4 5608 B11R1.222 CCC(N)c1ccncc1F Amb27175481 [1,1,0,0,0,0|2,0,0]=4 5609 B11R1.222 CCC(N)c1ccncc1N Amb28046654 [1,1,0,0,0,0|2,0,0]=4 5610 B11R1.222 CCC(N)c1ncccc1C Amb10608013 [1,1,0,0,0,0|2,0,0]=4 5611 B11R1.222 CCC(N)c1ncccc1C Amb30869584 [1,1,0,0,0,0|2,0,0]=4 5612 B11R1.222 CCC(O)c1ccccc1Br Amb26598101 [1,1,0,0,0,0|1,0,0]=3 5613 B11R1.222 CCC(O)c1ccccc1C Amb17232069 [1,1,0,0,0,0|1,0,0]=3 5614 B11R1.222 CCC(O)c1ccccc1Cl Amb17232794 [1,1,0,0,0,0|1,0,0]=3 5615 B11R1.222 CCC(O)c1ccccc1F Amb6298273 [1,1,0,0,0,0|1,0,0]=3 5616 B11R1.222 CCC(O)c1ccccc1O Amb1111067 [1,1,0,0,0,0|1,0,0]=3 5617 B11R1.222 CCC(O)c1cccnc1Br Amb27393934 [1,1,0,0,0,0|2,0,0]=4 5618 B11R1.222 CCC(O)c1ncccc1Br Amb27589910 [1,1,0,0,0,0|2,0,0]=4 5619 B11R1.222 CCC(O)c1ncccc1Cl Amb27410271 [1,1,0,0,0,0|2,0,0]=4 5620 B11R1.222 CCC(O)c1ncccc1N Amb35587558 [1,1,0,0,0,0|2,0,0]=4 5621 B11R1.222 CCC(O)c1ncccc1O Amb28143070 [1,1,0,0,0,0|2,0,0]=4 5622 B11R1.222 CCC(S)c1ccccc1F Amb25920899 [1,1,0,0,0,0|1,0,0]=3 5623 B11R1.222 CCC(S)c1ccccc1O Amb7784755 [1,1,0,0,0,0|1,0,0]=3 5624 B11R1.222 CCN(C)c1ccccc1Br Amb28207106 [1,1,0,0,0,0|1,0,0]=3 5625 B11R1.222 CCN(C)c1ccccc1C Amb27806082 [1,1,0,0,0,0|1,0,0]=3 5626 B11R1.222 CCN(C)c1ccccc1Cl Amb28281916 [1,1,0,0,0,0|1,0,0]=3 5627 B11R1.222 CCN(C)c1ccccc1F Amb28065028 [1,1,0,0,0,0|1,0,0]=3 5628 B11R1.222 CCN(C)c1ccccc1N Amb33526915 [1,1,0,0,0,0|1,0,0]=3 5629 B11R1.222 CCN(C)c1cccnc1Br Amb24321076 [1,1,0,0,0,0|2,0,0]=4 5630 B11R1.222 CCN(C)c1cccnc1N Amb24321078 [1,1,0,0,0,0|2,0,0]=4 5631 B11R1.222 CCN(C)c1ccncc1Br Amb24321027 [1,1,0,0,0,0|2,0,0]=4 5632 B11R1.222 CCN(C)c1ccncc1N Amb8890470 [1,1,0,0,0,0|2,0,0]=4 5633 B11R1.222 CCN(C)c1cnccc1Br Amb24320902 [1,1,0,0,0,0|2,0,0]=4 5634 B11R1.222 CCN(C)c1ncccc1Br Amb24320854 [1,1,0,0,0,0|2,0,0]=4 5635 B11R1.222 CCN(C)c1ncccc1N Amb8890476 [1,1,0,0,0,0|2,0,0]=4 5636 B11R1.222 CCN(N)c1ccccc1C Amb18125192 [1,1,0,0,0,0|2,0,0]=4 5637 B11R1.222 CCS(=O)c1ccccc1N Amb18955435 [1,1,0,0,0,0|2,0,0]=4 5638 B11R1.222 CC[C@@H](N)c1ccccc1C Amb22298520 [1,1,0,0,0,0|1,0,0]=3 5639 B11R1.222 CC[C@@H](N)c1ccccc1C Amb25335271 [1,1,0,0,0,0|1,0,0]=3 5640 B11R1.222 CC[C@@H](N)c1ccccc1Cl Amb28457747 [1,1,0,0,0,0|1,0,0]=3 5641 B11R1.222 CC[C@@H](N)c1ccccc1F Amb22288620 [1,1,0,0,0,0|1,0,0]=3 5642 B11R1.222 CC[C@@H](N)c1ccccc1F Amb27788276 [1,1,0,0,0,0|1,0,0]=3 5643 B11R1.222 CC[C@@H](N)c1ccccc1N Amb27590277 [1,1,0,0,0,0|1,0,0]=3 5644 B11R1.222 CC[C@@H](N)c1cccnc1N Amb27873962 [1,1,0,0,0,0|2,0,0]=4 5645 B11R1.222 CC[C@@H](N)c1cccnc1O Amb24455838 [1,1,0,0,0,0|2,0,0]=4 5646 B11R1.222 CC[C@@H](N)c1cnccc1Br Amb28191897 [1,1,0,0,0,0|2,0,0]=4 5647 B11R1.222 CC[C@@H](N)c1cnccc1C Amb28057698 [1,1,0,0,0,0|2,0,0]=4 5648 B11R1.222 CC[C@@H](N)c1ncccc1Br Amb27945482 [1,1,0,0,0,0|2,0,0]=4 5649 B11R1.222 CC[C@@H](O)c1ccccc1Br Amb28318376 [1,1,0,0,0,0|1,0,0]=3 5650 B11R1.222 CC[C@@H](O)c1ccccc1C Amb27217839 [1,1,0,0,0,0|1,0,0]=3 5651 B11R1.222 CC[C@@H](O)c1cccnc1N Amb28119960 [1,1,0,0,0,0|2,0,0]=4 5652 B11R1.222 CC[C@@H](O)c1ccncc1F Amb27832825 [1,1,0,0,0,0|2,0,0]=4 5653 B11R1.222 CC[C@H](C)C1=CC=CNC1=O Amb27945668 [1,1,0,0,0,0|1,0,0]=3 5654 B11R1.222 CC[C@H](C)c1ccccc1N Amb28456473 [1,1,0,0,0,0|0,0,0]=2 5655 B11R1.222 CC[C@H](C)c1ccccc1O Amb28074773 [1,1,0,0,0,0|0,0,0]=2 5656 B11R1.222 CC[C@H](C)c1nccnc1O Amb26647301 [1,1,0,0,0,0|2,0,0]=4 5657 B11R1.222 CC[C@H](N)c1ccccc1C Amb25145851 [1,1,0,0,0,0|1,0,0]=3 5658 B11R1.222 CC[C@H](N)c1ccccc1Cl Amb22298557 [1,1,0,0,0,0|1,0,0]=3 5659 B11R1.222 CC[C@H](N)c1ccccc1F Amb22288682 [1,1,0,0,0,0|1,0,0]=3 5660 B11R1.222 CC[C@H](N)c1ccccc1F Amb27640236 [1,1,0,0,0,0|1,0,0]=3 5661 B11R1.222 CC[C@H](N)c1ccccc1I Amb27390094 [1,1,0,0,0,0|1,0,0]=3 5662 B11R1.222 CC[C@H](N)c1ccccc1N Amb27803863 [1,1,0,0,0,0|1,0,0]=3 5663 B11R1.222 CC[C@H](N)c1ccccc1S Amb28206137 [1,1,0,0,0,0|1,0,0]=3 5664 B11R1.222 CC[C@H](N)c1cccnc1Br Amb27623288 [1,1,0,0,0,0|2,0,0]=4 5665 B11R1.222 CC[C@H](N)c1cccnc1C Amb27952038 [1,1,0,0,0,0|2,0,0]=4 5666 B11R1.222 CC[C@H](N)c1cccnc1O Amb27602616 [1,1,0,0,0,0|2,0,0]=4 5667 B11R1.222 CC[C@H](N)c1cccnc1S Amb27831977 [1,1,0,0,0,0|2,0,0]=4 5668 B11R1.222 CC[C@H](N)c1ccncc1Br Amb27438456 [1,1,0,0,0,0|2,0,0]=4 5669 B11R1.222 CC[C@H](N)c1ccncc1O Amb27960309 [1,1,0,0,0,0|2,0,0]=4 5670 B11R1.222 CC[C@H](N)c1ncccc1C Amb27390201 [1,1,0,0,0,0|2,0,0]=4 5671 B11R1.222 CC[C@H](O)c1ccccc1Br Amb24447235 [1,1,0,0,0,0|1,0,0]=3 5672 B11R1.222 CC[C@H](O)c1ccccc1C Amb25884212 [1,1,0,0,0,0|1,0,0]=3 5673 B11R1.222 CC[C@H](O)c1ccccc1Cl Amb25188608 [1,1,0,0,0,0|1,0,0]=3 5674 B11R1.222 CC[C@H](O)c1ccccc1F Amb27161900 [1,1,0,0,0,0|1,0,0]=3 5675 B11R1.222 CC[C@H](O)c1ccncc1C Amb27855841 [1,1,0,0,0,0|2,0,0]=4 5676 B11R1.222 CC[C@H](O)c1ccncc1F Amb28124348 [1,1,0,0,0,0|2,0,0]=4 5677 B11R1.222 CC[C@H](O)c1ncccc1Br Amb27453735 [1,1,0,0,0,0|2,0,0]=4 5678 B11R1.222 CNC(=N)c1ccccc1Cl Amb24509222 [1,1,0,0,0,0|1,0,1]=4 5679 B11R1.222 CNC(=N)c1ccccc1Cl Amb28652842 [1,1,0,0,0,0|1,0,1]=4 5680 B11R1.222 CNC(=O)c1ccccc1Br Amb2625865 [1,1,0,0,0,0|1,0,1]=4 5681 B11R1.222 CNC(=O)c1ccccc1C Amb2613120 [1,1,0,0,0,0|1,0,1]=4 5682 B11R1.222 CNC(=O)c1ccccc1I Amb2754649 [1,1,0,0,0,0|1,0,1]=4 5683 B11R1.222 CNC(=O)c1ccccc1N Amb6541338 [1,1,0,0,0,0|1,0,1]=4 5684 B11R1.222 CNC(=O)c1ccccc1N Amb6773994 [1,1,0,0,0,0|1,0,1]=4 5685 B11R1.222 CNC(=O)c1ccccc1O Amb534308 [1,1,0,0,0,0|1,0,1]=4 5686 B11R1.222 CNC(=S)c1ccccc1F Amb27412514 [1,1,0,0,0,0|1,0,1]=4 5687 B11R1.222 CNC(=S)c1ccccc1N Amb26845442 [1,1,0,0,0,0|1,0,1]=4 5688 B11R1.222 CNC(=S)c1ccccc1O Amb27215302 [1,1,0,0,0,0|1,0,1]=4 5689 B11R1.222 CNC(C)c1ccccc1Br Amb1138040 [1,1,0,0,0,0|0,0,0]=2 5690 B11R1.222 CNC(C)c1ccccc1Br Amb33550297 [1,1,0,0,0,0|0,0,0]=2 5691 B11R1.222 CNC(C)c1ccccc1C Amb32752837 [1,1,0,0,0,0|0,0,0]=2 5692 B11R1.222 CNC(C)c1ccccc1C Amb9704678 [1,1,0,0,0,0|0,0,0]=2 5693 B11R1.222 CNC(C)c1ccccc1Cl Amb1127237 [1,1,0,0,0,0|0,0,0]=2 5694 B11R1.222 CNC(C)c1ccccc1F Amb1116429 [1,1,0,0,0,0|0,0,0]=2 5695 B11R1.222 CNC(C)c1ccccc1I Amb27617484 [1,1,0,0,0,0|0,0,0]=2 5696 B11R1.222 CNC(C)c1ccccc1O Amb1118530 [1,1,0,0,0,0|0,0,0]=2 5697 B11R1.222 CNC(C)c1ccccc1O Amb6751804 [1,1,0,0,0,0|0,0,0]=2 5698 B11R1.222 CNC(C)c1ccccc1S Amb28434695 [1,1,0,0,0,0|0,0,0]=2 5699 B11R1.222 CNC(C)c1cccnc1Br Amb27830619 [1,1,0,0,0,0|1,0,0]=3 5700 B11R1.222 CNC(C)c1ccncc1N Amb27791980 [1,1,0,0,0,0|1,0,0]=3 5701 B11R1.222 CNC(C)c1cnccc1Cl Amb27607824 [1,1,0,0,0,0|1,0,0]=3 5702 B11R1.222 CNC(C)c1ncccc1Br Amb27985030 [1,1,0,0,0,0|1,0,0]=3 5703 B11R1.222 CNC(C)c1ncccc1C Amb18283561 [1,1,0,0,0,0|1,0,0]=3 5704 B11R1.222 CNC(C)c1ncccc1F Amb27836780 [1,1,0,0,0,0|1,0,0]=3 5705 B11R1.222 CNC(C)c1ncccc1O Amb27176483 [1,1,0,0,0,0|1,0,0]=3 5706 B11R1.222 CNC(C)c1ncncc1Br Amb27778186 [1,1,0,0,0,0|2,0,0]=4 5707 B11R1.222 CNC(O)c1ccncc1O Amb27176839 [1,1,0,0,0,0|2,0,0]=4 5708 B11R1.222 CN[C@@H](C)c1ccccc1C Amb28282685 [1,1,0,0,0,0|0,0,0]=2 5709 B11R1.222 CN[C@@H](C)c1ccccc1Cl Amb26495013 [1,1,0,0,0,0|0,0,0]=2 5710 B11R1.222 CN[C@@H](C)c1ccccc1Cl Amb33309524 [1,1,0,0,0,0|0,0,0]=2 5711 B11R1.222 CN[C@@H](C)c1ccccc1F Amb10838815 [1,1,0,0,0,0|0,0,0]=2 5712 B11R1.222 CN[C@@H](C)c1ccccc1I Amb27647707 [1,1,0,0,0,0|0,0,0]=2 5713 B11R1.222 CN[C@@H](C)c1cccnc1Br Amb27592846 [1,1,0,0,0,0|1,0,0]=3 5714 B11R1.222 CN[C@@H](C)c1cccnc1C Amb27409368 [1,1,0,0,0,0|1,0,0]=3 5715 B11R1.222 CN[C@@H](C)c1cccnc1F Amb27459912 [1,1,0,0,0,0|1,0,0]=3 5716 B11R1.222 CN[C@@H](C)c1cccnc1O Amb28399286 [1,1,0,0,0,0|1,0,0]=3 5717 B11R1.222 CN[C@@H](C)c1cccnc1S Amb28141842 [1,1,0,0,0,0|1,0,0]=3 5718 B11R1.222 CN[C@@H](C)c1ncccc1Br Amb28075548 [1,1,0,0,0,0|1,0,0]=3 5719 B11R1.222 CN[C@H](C)c1ccccc1C Amb24746717 [1,1,0,0,0,0|0,0,0]=2 5720 B11R1.222 CN[C@H](C)c1ccccc1C Amb32657987 [1,1,0,0,0,0|0,0,0]=2 5721 B11R1.222 CN[C@H](C)c1ccccc1Cl Amb27175385 [1,1,0,0,0,0|0,0,0]=2 5722 B11R1.222 CN[C@H](C)c1ccccc1I Amb27866359 [1,1,0,0,0,0|0,0,0]=2 5723 B11R1.222 CN[C@H](C)c1cccnc1Br Amb27798455 [1,1,0,0,0,0|1,0,0]=3 5724 B11R1.222 CN[C@H](C)c1cccnc1O Amb27213169 [1,1,0,0,0,0|1,0,0]=3 5725 B11R1.222 CN[C@H](C)c1cccnc1S Amb28381645 [1,1,0,0,0,0|1,0,0]=3 5726 B11R1.222 CN[C@H](C)c1ccncc1Br Amb27393586 [1,1,0,0,0,0|1,0,0]=3 5727 B11R1.222 CN[C@H](C)c1ccncc1C Amb27798729 [1,1,0,0,0,0|1,0,0]=3 5728 B11R1.222 CN[C@H](C)c1ccncc1O Amb27617420 [1,1,0,0,0,0|1,0,0]=3 5729 B11R1.222 CN[C@H](C)c1ncccc1Br Amb28133638 [1,1,0,0,0,0|1,0,0]=3 5730 B11R1.222 COC(C)c1ccccc1O Amb18125398 [1,1,0,0,0,0|1,0,0]=3 5731 B11R1.222 COC(O)c1ccccc1Cl Amb27651946 [1,1,0,0,0,0|2,0,0]=4 5732 B11R1.222 CON(C)c1ccccc1N Amb9492138 [1,1,0,0,0,0|2,0,0]=4 5733 B11R1.222 CSC(C)c1ccccc1F Amb28285777 [1,1,0,0,0,0|1,0,0]=3 5734 B11R1.222 CSC(C)c1ccccc1O Amb27432693 [1,1,0,0,0,0|1,0,0]=3 5735 B11R1.222 C[C@@H](CN)c1ccccc1F Amb33731710 [1,1,0,0,0,0|0,0,0]=2 5736 B11R1.222 C[C@@H](CO)c1ccccc1F Amb33746405 [1,1,0,0,0,0|1,0,0]=3 5737 B11R1.222 C[C@@H](NO)c1ccccc1Br Amb28241543 [1,1,0,0,0,0|1,0,0]=3 5738 B11R1.222 C[C@@H](NO)c1ccccc1F Amb28041566 [1,1,0,0,0,0|1,0,0]=3 5739 B11R1.222 C[C@@H](NO)c1ccccc1O Amb27222589 [1,1,0,0,0,0|1,0,0]=3 5740 B11R1.222 C[C@H](CN)c1ccccc1F Amb33746912 [1,1,0,0,0,0|0,0,0]=2 5741 B11R1.222 C[C@H](CO)c1ccccc1F Amb33748468 [1,1,0,0,0,0|1,0,0]=3 5742 B11R1.222 C[C@H](NO)c1ccccc1Cl Amb28074234 [1,1,0,0,0,0|1,0,0]=3 5743 B11R1.222 C[C@H](NO)c1ccccc1O Amb27663515 [1,1,0,0,0,0|1,0,0]=3 5744 B11R1.222 C\C(NO)=C1\C=CC=CC1=O Amb33512951 [1,1,0,0,0,0|1,0,1]=4 5745 B11R1.222 C\C=C(/C)c1ccccc1N Amb18124838 [1,1,0,0,0,0|0,0,2]=4 5746 B11R1.222 C\C=C(/C)c1ccccc1O Amb18124922 [1,1,0,0,0,0|0,0,2]=4 5747 B11R1.222 C\C=C(\C)c1ccccc1N Amb28422952 [1,1,0,0,0,0|0,0,2]=4 5748 B11R1.222 C\N=C(/C)c1ccccc1O Amb27591596 [1,1,0,0,0,0|0,0,2]=4 5749 B11R1.222 C\N=C(\C)c1ccccc1O Amb27426431 [1,1,0,0,0,0|0,0,2]=4 5750 B11R1.222 Cc1ccccc1C(=O)CN Amb18281552 [1,1,0,0,0,0|1,0,1]=4 5751 B11R1.222 Cc1ccccc1C(=O)CN Amb2693529 [1,1,0,0,0,0|1,0,1]=4 5752 B11R1.222 Cc1ccccc1C(C)C#N Amb8950038 [1,1,0,0,0,0|0,0,2]=4 5753 B11R1.222 Cc1ccccc1C(C)C=O Amb18124932 [1,1,0,0,0,0|1,0,1]=4 5754 B11R1.222 Cc1ccccc1C(C)CBr Amb25148992 [1,1,0,0,0,0|1,0,0]=3 5755 B11R1.222 Cc1ccccc1C(C)CCl Amb27469675 [1,1,0,0,0,0|1,0,0]=3 5756 B11R1.222 Cc1ccccc1C(C)CN Amb28465568 [1,1,0,0,0,0|0,0,0]=2 5757 B11R1.222 Cc1ccccc1C(C)CN Amb8950134 [1,1,0,0,0,0|0,0,0]=2 5758 B11R1.222 Cc1ccccc1C(C)CO Amb25129854 [1,1,0,0,0,0|1,0,0]=3 5759 B11R1.222 Cc1ccccc1C(C)NN Amb6249679 [1,1,0,0,0,0|1,0,0]=3 5760 B11R1.222 Cc1ccccc1C(C)ON Amb33360515 [1,1,0,0,0,0|1,0,0]=3 5761 B11R1.222 Cc1ccccc1C(F)CN Amb25151822 [1,1,0,0,0,0|1,0,0]=3 5762 B11R1.222 Cc1ccccc1C(N)CF Amb24603875 [1,1,0,0,0,0|2,0,0]=4 5763 B11R1.222 Cc1ccccc1C(N)CF Amb31217523 [1,1,0,0,0,0|2,0,0]=4 5764 B11R1.222 Cc1ccccc1C(N)CN Amb9380695 [1,1,0,0,0,0|1,0,0]=3 5765 B11R1.222 Cc1ccccc1C(N)CO Amb8855227 [1,1,0,0,0,0|2,0,0]=4 5766 B11R1.222 Cc1ccccc1C(O)CBr Amb24106267 [1,1,0,0,0,0|2,0,0]=4 5767 B11R1.222 Cc1ccccc1C(O)CCl Amb24104159 [1,1,0,0,0,0|2,0,0]=4 5768 B11R1.222 Cc1ccccc1C(O)CF Amb24661131 [1,1,0,0,0,0|2,0,0]=4 5769 B11R1.222 Cc1ccccc1C(O)CI Amb26601620 [1,1,0,0,0,0|2,0,0]=4 5770 B11R1.222 Cc1ccccc1C(O)CN Amb10068895 [1,1,0,0,0,0|1,0,0]=3 5771 B11R1.222 Cc1ccccc1C(O)CN Amb33801451 [1,1,0,0,0,0|1,0,0]=3 5772 B11R1.222 Cc1ccccc1C(O)CN Amb9703614 [1,1,0,0,0,0|1,0,0]=3 5773 B11R1.222 Cc1ccccc1C(O)CO Amb27146455 [1,1,0,0,0,0|2,0,0]=4 5774 B11R1.222 Cc1ccccc1[C@@H](C)CN Amb33731716 [1,1,0,0,0,0|0,0,0]=2 5775 B11R1.222 Cc1ccccc1[C@@H](C)CO Amb27431457 [1,1,0,0,0,0|1,0,0]=3 5776 B11R1.222 Cc1ccccc1[C@@H](N)CN Amb27473367 [1,1,0,0,0,0|1,0,0]=3 5777 B11R1.222 Cc1ccccc1[C@@H](N)CO Amb25887070 [1,1,0,0,0,0|2,0,0]=4 5778 B11R1.222 Cc1ccccc1[C@@H](O)CBr Amb28285028 [1,1,0,0,0,0|2,0,0]=4 5779 B11R1.222 Cc1ccccc1[C@@H](O)CCl Amb28142883 [1,1,0,0,0,0|2,0,0]=4 5780 B11R1.222 Cc1ccccc1[C@@H](O)CN Amb24100213 [1,1,0,0,0,0|1,0,0]=3 5781 B11R1.222 Cc1ccccc1[C@H](C)CN Amb33746798 [1,1,0,0,0,0|0,0,0]=2 5782 B11R1.222 Cc1ccccc1[C@H](C)CO Amb33749842 [1,1,0,0,0,0|1,0,0]=3 5783 B11R1.222 Cc1ccccc1[C@H](N)CO Amb27398610 [1,1,0,0,0,0|2,0,0]=4 5784 B11R1.222 Cc1ccccc1[C@H](O)CCl Amb27400107 [1,1,0,0,0,0|2,0,0]=4 5785 B11R1.222 Cc1ccccc1[C@H](O)CN Amb26537233 [1,1,0,0,0,0|1,0,0]=3 5786 B11R1.222 Cc1ccccc1[C@H](O)CO Amb27776437 [1,1,0,0,0,0|2,0,0]=4 5787 B11R1.222 Cc1cccnc1C(C)CBr Amb33450674 [1,1,0,0,0,0|2,0,0]=4 5788 B11R1.222 Cc1cccnc1C(C)CN Amb33502820 [1,1,0,0,0,0|1,0,0]=3 5789 B11R1.222 Cc1cccnc1C(C)ON Amb33428794 [1,1,0,0,0,0|2,0,0]=4 5790 B11R1.222 Cc1cccnc1C(F)CN Amb33428805 [1,1,0,0,0,0|2,0,0]=4 5791 B11R1.222 Cc1cccnc1C(O)CN Amb27483900 [1,1,0,0,0,0|2,0,0]=4 5792 B11R1.222 Cc1cccnc1[C@@H](N)CN Amb27473253 [1,1,0,0,0,0|2,0,0]=4 5793 B11R1.222 Cc1cccnc1[C@@H](O)CN Amb33428804 [1,1,0,0,0,0|2,0,0]=4 5794 B11R1.222 Cc1cccnc1[C@H](N)CN Amb27961477 [1,1,0,0,0,0|2,0,0]=4 5795 B11R1.222 Cc1cccnc1[C@H](O)CN Amb33428803 [1,1,0,0,0,0|2,0,0]=4 5796 B11R1.222 Cc1ccncc1C(C)CBr Amb33389028 [1,1,0,0,0,0|2,0,0]=4 5797 B11R1.222 Cc1ccncc1C(C)CN Amb18201825 [1,1,0,0,0,0|1,0,0]=3 5798 B11R1.222 Cc1ccncc1C(C)ON Amb33376744 [1,1,0,0,0,0|2,0,0]=4 5799 B11R1.222 Cc1ccncc1C(F)CN Amb26051916 [1,1,0,0,0,0|2,0,0]=4 5800 B11R1.222 Cc1ccncc1C(O)CN Amb28349054 [1,1,0,0,0,0|2,0,0]=4 5801 B11R1.222 Cc1ccncc1[C@@H](O)CN Amb33377020 [1,1,0,0,0,0|2,0,0]=4 5802 B11R1.222 Cc1ccncc1[C@H](O)CN Amb33377018 [1,1,0,0,0,0|2,0,0]=4 5803 B11R1.222 Cc1cnccc1C(C)CBr Amb33334120 [1,1,0,0,0,0|2,0,0]=4 5804 B11R1.222 Cc1cnccc1C(C)CN Amb27853963 [1,1,0,0,0,0|1,0,0]=3 5805 B11R1.222 Cc1cnccc1C(C)ON Amb33414176 [1,1,0,0,0,0|2,0,0]=4 5806 B11R1.222 Cc1cnccc1C(F)CN Amb33414469 [1,1,0,0,0,0|2,0,0]=4 5807 B11R1.222 Cc1cnccc1C(N)CN Amb27475952 [1,1,0,0,0,0|2,0,0]=4 5808 B11R1.222 Cc1cnccc1C(O)CN Amb28246816 [1,1,0,0,0,0|2,0,0]=4 5809 B11R1.222 Cc1cnccc1[C@@H](O)CN Amb33414187 [1,1,0,0,0,0|2,0,0]=4 5810 B11R1.222 Cc1cnccc1[C@H](O)CN Amb33414191 [1,1,0,0,0,0|2,0,0]=4 5811 B11R1.222 Cc1ncccc1C(C)CBr Amb33432586 [1,1,0,0,0,0|2,0,0]=4 5812 B11R1.222 Cc1ncccc1C(C)CN Amb32880139 [1,1,0,0,0,0|1,0,0]=3 5813 B11R1.222 Cc1ncccc1C(C)NN Amb27601342 [1,1,0,0,0,0|2,0,0]=4 5814 B11R1.222 Cc1ncccc1C(C)ON Amb32878994 [1,1,0,0,0,0|2,0,0]=4 5815 B11R1.222 Cc1ncccc1C(F)CN Amb32880589 [1,1,0,0,0,0|2,0,0]=4 5816 B11R1.222 Cc1ncccc1C(O)CN Amb18831196 [1,1,0,0,0,0|2,0,0]=4 5817 B11R1.222 Cc1ncccc1[C@@H](O)CN Amb32879572 [1,1,0,0,0,0|2,0,0]=4 5818 B11R1.222 Cc1ncccc1[C@H](O)CN Amb32879571 [1,1,0,0,0,0|2,0,0]=4 5819 B11R1.222 Cc1nccnc1C(C)CN Amb26363047 [1,1,0,0,0,0|2,0,0]=4 5820 B11R1.222 Cc1ncncc1C(C)CN Amb33472511 [1,1,0,0,0,0|2,0,0]=4 5821 B11R1.222 NC(CF)c1ccccc1Br Amb28041536 [1,1,0,0,0,0|2,0,0]=4 5822 B11R1.222 NC(CF)c1ccccc1Cl Amb27247457 [1,1,0,0,0,0|2,0,0]=4 5823 B11R1.222 NC(CF)c1ccccc1F Amb2372611 [1,1,0,0,0,0|2,0,0]=4 5824 B11R1.222 NC(CF)c1ccccc1O Amb24488040 [1,1,0,0,0,0|2,0,0]=4 5825 B11R1.222 NC(CO)c1ccccc1Br Amb23596558 [1,1,0,0,0,0|2,0,0]=4 5826 B11R1.222 NC(CO)c1ccccc1Cl Amb17232852 [1,1,0,0,0,0|2,0,0]=4 5827 B11R1.222 NC(CO)c1ccccc1F Amb19374114 [1,1,0,0,0,0|2,0,0]=4 5828 B11R1.222 NC(CO)c1ccccc1F Amb2236915 [1,1,0,0,0,0|2,0,0]=4 5829 B11R1.222 NC(CO)c1ccccc1I Amb25738482 [1,1,0,0,0,0|2,0,0]=4 5830 B11R1.222 NC(CO)c1ccccc1I Amb30584760 [1,1,0,0,0,0|2,0,0]=4 5831 B11R1.222 NC(CO)c1ccccc1O Amb24069930 [1,1,0,0,0,0|2,0,0]=4 5832 B11R1.222 NCC(=O)c1ccccc1Br Amb10069326 [1,1,0,0,0,0|1,0,1]=4 5833 B11R1.222 NCC(=O)c1ccccc1Br Amb8383857 [1,1,0,0,0,0|1,0,1]=4 5834 B11R1.222 NCC(=O)c1ccccc1Cl Amb10069325 [1,1,0,0,0,0|1,0,1]=4 5835 B11R1.222 NCC(=O)c1ccccc1Cl Amb8383856 [1,1,0,0,0,0|1,0,1]=4 5836 B11R1.222 NCC(=O)c1ccccc1F Amb10840039 [1,1,0,0,0,0|1,0,1]=4 5837 B11R1.222 NCC(=O)c1ccccc1F Amb8383855 [1,1,0,0,0,0|1,0,1]=4 5838 B11R1.222 NCC(=O)c1ccccc1O Amb18125235 [1,1,0,0,0,0|1,0,1]=4 5839 B11R1.222 NCC(=O)c1ccccc1O Amb32664086 [1,1,0,0,0,0|1,0,1]=4 5840 B11R1.222 NCC(=O)c1ccccc1O Amb33801554 [1,1,0,0,0,0|1,0,1]=4 5841 B11R1.222 NCC(F)c1ccccc1Br Amb23454845 [1,1,0,0,0,0|1,0,0]=3 5842 B11R1.222 NCC(F)c1ccccc1Cl Amb24392618 [1,1,0,0,0,0|1,0,0]=3 5843 B11R1.222 NCC(F)c1ccccc1F Amb28457718 [1,1,0,0,0,0|1,0,0]=3 5844 B11R1.222 NCC(F)c1ccccc1N Amb25942093 [1,1,0,0,0,0|1,0,0]=3 5845 B11R1.222 NCC(F)c1ccccc1O Amb26445570 [1,1,0,0,0,0|1,0,0]=3 5846 B11R1.222 NCC(F)c1cccnc1Br Amb33387460 [1,1,0,0,0,0|2,0,0]=4 5847 B11R1.222 NCC(F)c1cccnc1Cl Amb33257024 [1,1,0,0,0,0|2,0,0]=4 5848 B11R1.222 NCC(F)c1cccnc1F Amb33377932 [1,1,0,0,0,0|2,0,0]=4 5849 B11R1.222 NCC(F)c1cccnc1N Amb27172095 [1,1,0,0,0,0|2,0,0]=4 5850 B11R1.222 NCC(F)c1ccncc1Br Amb33388256 [1,1,0,0,0,0|2,0,0]=4 5851 B11R1.222 NCC(F)c1ccncc1Cl Amb33413768 [1,1,0,0,0,0|2,0,0]=4 5852 B11R1.222 NCC(F)c1ccncc1F Amb25321024 [1,1,0,0,0,0|2,0,0]=4 5853 B11R1.222 NCC(F)c1ncccc1Br Amb33335741 [1,1,0,0,0,0|2,0,0]=4 5854 B11R1.222 NCC(F)c1ncccc1F Amb33418785 [1,1,0,0,0,0|2,0,0]=4 5855 B11R1.222 NCC(N)c1ccccc1Br Amb9380656 [1,1,0,0,0,0|1,0,0]=3 5856 B11R1.222 NCC(N)c1cccnc1F Amb27617282 [1,1,0,0,0,0|2,0,0]=4 5857 B11R1.222 NCC(N)c1ccncc1Br Amb27801071 [1,1,0,0,0,0|2,0,0]=4 5858 B11R1.222 NCC(N)c1ccncc1Cl Amb27165132 [1,1,0,0,0,0|2,0,0]=4 5859 B11R1.222 NCC(N)c1ccncc1N Amb27173265 [1,1,0,0,0,0|2,0,0]=4 5860 B11R1.222 NCC(N)c1ccncc1O Amb28313703 [1,1,0,0,0,0|2,0,0]=4 5861 B11R1.222 NCC(N)c1cnccc1Br Amb27441737 [1,1,0,0,0,0|2,0,0]=4 5862 B11R1.222 NCC(N)c1cnccc1Cl Amb27881554 [1,1,0,0,0,0|2,0,0]=4 5863 B11R1.222 NCC(N)c1ncccc1F Amb27488656 [1,1,0,0,0,0|2,0,0]=4 5864 B11R1.222 NCC(O)c1ccccc1Br Amb22587182 [1,1,0,0,0,0|1,0,0]=3 5865 B11R1.222 NCC(O)c1ccccc1Br Amb2383122 [1,1,0,0,0,0|1,0,0]=3 5866 B11R1.222 NCC(O)c1ccccc1Cl Amb2697538 [1,1,0,0,0,0|1,0,0]=3 5867 B11R1.222 NCC(O)c1ccccc1Cl Amb9703590 [1,1,0,0,0,0|1,0,0]=3 5868 B11R1.222 NCC(O)c1ccccc1F Amb1108863 [1,1,0,0,0,0|1,0,0]=3 5869 B11R1.222 NCC(O)c1ccccc1F Amb2699087 [1,1,0,0,0,0|1,0,0]=3 5870 B11R1.222 NCC(O)c1ccccc1I Amb22234793 [1,1,0,0,0,0|1,0,0]=3 5871 B11R1.222 NCC(O)c1ccccc1I Amb2383126 [1,1,0,0,0,0|1,0,0]=3 5872 B11R1.222 NCC(O)c1ccccc1O Amb1108822 [1,1,0,0,0,0|1,0,0]=3 5873 B11R1.222 NCC(O)c1cccnc1Br Amb33389446 [1,1,0,0,0,0|2,0,0]=4 5874 B11R1.222 NCC(O)c1cccnc1Cl Amb33256981 [1,1,0,0,0,0|2,0,0]=4 5875 B11R1.222 NCC(O)c1cccnc1F Amb26038957 [1,1,0,0,0,0|2,0,0]=4 5876 B11R1.222 NCC(O)c1ccncc1Br Amb33430084 [1,1,0,0,0,0|2,0,0]=4 5877 B11R1.222 NCC(O)c1ccncc1Cl Amb33407322 [1,1,0,0,0,0|2,0,0]=4 5878 B11R1.222 NCC(O)c1ccncc1F Amb25863245 [1,1,0,0,0,0|2,0,0]=4 5879 B11R1.222 NCC(O)c1ncccc1Br Amb23586110 [1,1,0,0,0,0|2,0,0]=4 5880 B11R1.222 NCC(O)c1ncccc1F Amb27642083 [1,1,0,0,0,0|2,0,0]=4 5881 B11R1.222 NC[C@@H](N)c1ccccc1O Amb28203922 [1,1,0,0,0,0|1,0,0]=3 5882 B11R1.222 NC[C@@H](N)c1cccnc1F Amb27873973 [1,1,0,0,0,0|2,0,0]=4 5883 B11R1.222 NC[C@@H](N)c1cccnc1S Amb27620326 [1,1,0,0,0,0|2,0,0]=4 5884 B11R1.222 NC[C@@H](N)c1cnccc1Br Amb27823159 [1,1,0,0,0,0|2,0,0]=4 5885 B11R1.222 NC[C@@H](N)c1ncccc1Cl Amb27645058 [1,1,0,0,0,0|2,0,0]=4 5886 B11R1.222 NC[C@@H](N)c1ncccc1F Amb28072886 [1,1,0,0,0,0|2,0,0]=4 5887 B11R1.222 NC[C@@H](N)c1ncccc1O Amb27252086 [1,1,0,0,0,0|2,0,0]=4 5888 B11R1.222 NC[C@@H](O)c1ccccc1Br Amb24415174 [1,1,0,0,0,0|1,0,0]=3 5889 B11R1.222 NC[C@@H](O)c1ccccc1Cl Amb20241478 [1,1,0,0,0,0|1,0,0]=3 5890 B11R1.222 NC[C@@H](O)c1ccccc1Cl Amb20241480 [1,1,0,0,0,0|1,0,0]=3 5891 B11R1.222 NC[C@@H](O)c1ccccc1F Amb26880377 [1,1,0,0,0,0|1,0,0]=3 5892 B11R1.222 NC[C@@H](O)c1ccccc1O Amb33196482 [1,1,0,0,0,0|1,0,0]=3 5893 B11R1.222 NC[C@@H](O)c1cccnc1Br Amb33388505 [1,1,0,0,0,0|2,0,0]=4 5894 B11R1.222 NC[C@@H](O)c1cccnc1Cl Amb33263088 [1,1,0,0,0,0|2,0,0]=4 5895 B11R1.222 NC[C@@H](O)c1cccnc1F Amb33224055 [1,1,0,0,0,0|2,0,0]=4 5896 B11R1.222 NC[C@@H](O)c1ccncc1Br Amb33388510 [1,1,0,0,0,0|2,0,0]=4 5897 B11R1.222 NC[C@@H](O)c1ccncc1Cl Amb33413775 [1,1,0,0,0,0|2,0,0]=4 5898 B11R1.222 NC[C@@H](O)c1ccncc1F Amb33317200 [1,1,0,0,0,0|2,0,0]=4 5899 B11R1.222 NC[C@@H](O)c1ncccc1Br Amb33336041 [1,1,0,0,0,0|2,0,0]=4 5900 B11R1.222 NC[C@@H](O)c1ncccc1F Amb33224648 [1,1,0,0,0,0|2,0,0]=4 5901 B11R1.222 NC[C@H](N)c1ccccc1Br Amb28135268 [1,1,0,0,0,0|1,0,0]=3 5902 B11R1.222 NC[C@H](N)c1ccccc1I Amb28365341 [1,1,0,0,0,0|1,0,0]=3 5903 B11R1.222 NC[C@H](N)c1ccccc1O Amb27831169 [1,1,0,0,0,0|1,0,0]=3 5904 B11R1.222 NC[C@H](N)c1cccnc1S Amb27602190 [1,1,0,0,0,0|2,0,0]=4 5905 B11R1.222 NC[C@H](N)c1ccncc1Cl Amb27233806 [1,1,0,0,0,0|2,0,0]=4 5906 B11R1.222 NC[C@H](N)c1ccncc1F Amb27409349 [1,1,0,0,0,0|2,0,0]=4 5907 B11R1.222 NC[C@H](N)c1cnccc1Cl Amb27617257 [1,1,0,0,0,0|2,0,0]=4 5908 B11R1.222 NC[C@H](N)c1ncccc1Br Amb27597504 [1,1,0,0,0,0|2,0,0]=4 5909 B11R1.222 NC[C@H](O)c1ccccc1Br Amb25686880 [1,1,0,0,0,0|1,0,0]=3 5910 B11R1.222 NC[C@H](O)c1ccccc1Cl Amb27954604 [1,1,0,0,0,0|1,0,0]=3 5911 B11R1.222 NC[C@H](O)c1ccccc1F Amb25994717 [1,1,0,0,0,0|1,0,0]=3 5912 B11R1.222 NC[C@H](O)c1ccccc1O Amb33196478 [1,1,0,0,0,0|1,0,0]=3 5913 B11R1.222 NC[C@H](O)c1cccnc1Br Amb33388504 [1,1,0,0,0,0|2,0,0]=4 5914 B11R1.222 NC[C@H](O)c1cccnc1Cl Amb33257028 [1,1,0,0,0,0|2,0,0]=4 5915 B11R1.222 NC[C@H](O)c1cccnc1F Amb33377690 [1,1,0,0,0,0|2,0,0]=4 5916 B11R1.222 NC[C@H](O)c1ccncc1Br Amb33388509 [1,1,0,0,0,0|2,0,0]=4 5917 B11R1.222 NC[C@H](O)c1ccncc1Cl Amb33413771 [1,1,0,0,0,0|2,0,0]=4 5918 B11R1.222 NC[C@H](O)c1ccncc1F Amb33317201 [1,1,0,0,0,0|2,0,0]=4 5919 B11R1.222 NC[C@H](O)c1ncccc1Br Amb33336039 [1,1,0,0,0,0|2,0,0]=4 5920 B11R1.222 NC[C@H](O)c1ncccc1F Amb33418815 [1,1,0,0,0,0|2,0,0]=4 5921 B11R1.222 N[C@@H](CF)c1ccccc1F Amb24487040 [1,1,0,0,0,0|2,0,0]=4 5922 B11R1.222 N[C@@H](CO)c1ccccc1Br Amb26868624 [1,1,0,0,0,0|2,0,0]=4 5923 B11R1.222 N[C@@H](CO)c1ccccc1Cl Amb22756886 [1,1,0,0,0,0|2,0,0]=4 5924 B11R1.222 N[C@@H](CO)c1ccccc1F Amb22756438 [1,1,0,0,0,0|2,0,0]=4 5925 B11R1.222 N[C@@H](CO)c1ccccc1O Amb27669549 [1,1,0,0,0,0|2,0,0]=4 5926 B11R1.222 N[C@H](CF)c1ccccc1Cl Amb27807596 [1,1,0,0,0,0|2,0,0]=4 5927 B11R1.222 N[C@H](CF)c1ccccc1F Amb25125365 [1,1,0,0,0,0|2,0,0]=4 5928 B11R1.222 N[C@H](CO)c1ccccc1Br Amb26498620 [1,1,0,0,0,0|2,0,0]=4 5929 B11R1.222 N[C@H](CO)c1ccccc1Cl Amb25228430 [1,1,0,0,0,0|2,0,0]=4 5930 B11R1.222 N[C@H](CO)c1ccccc1Cl Amb33872480 [1,1,0,0,0,0|2,0,0]=4 5931 B11R1.222 N[C@H](CO)c1ccccc1F Amb24349743 [1,1,0,0,0,0|2,0,0]=4 5932 B11R1.222 N[C@H](CO)c1ccccc1F Amb33801935 [1,1,0,0,0,0|2,0,0]=4 5933 B11R1.222 N[C@H](CO)c1ccccc1O Amb24383657 [1,1,0,0,0,0|2,0,0]=4 5934 B11R1.222 Nc1ccccc1C(N)CF Amb33190142 [1,1,0,0,0,0|2,0,0]=4 5935 B11R1.222 OC(CBr)c1ccccc1Br Amb25741136 [1,1,0,0,0,0|2,0,0]=4 5936 B11R1.222 OC(CBr)c1ccccc1Cl Amb24081185 [1,1,0,0,0,0|2,0,0]=4 5937 B11R1.222 OC(CBr)c1ccccc1F Amb28195216 [1,1,0,0,0,0|2,0,0]=4 5938 B11R1.222 OC(CCl)c1ccccc1Br Amb27452273 [1,1,0,0,0,0|2,0,0]=4 5939 B11R1.222 OC(CCl)c1ccccc1Cl Amb25726431 [1,1,0,0,0,0|2,0,0]=4 5940 B11R1.222 OC(CCl)c1ccccc1F Amb25306094 [1,1,0,0,0,0|2,0,0]=4 5941 B11R1.222 OC(CF)c1ccccc1Br Amb27219160 [1,1,0,0,0,0|2,0,0]=4 5942 B11R1.222 OC(CF)c1ccccc1Cl Amb27790858 [1,1,0,0,0,0|2,0,0]=4 5943 B11R1.222 OC(CF)c1ccccc1F Amb24688002 [1,1,0,0,0,0|2,0,0]=4 5944 B11R1.222 OC(CI)c1ccccc1Br Amb24555966 [1,1,0,0,0,0|2,0,0]=4 5945 B11R1.222 OC(CI)c1ccccc1Cl Amb26638892 [1,1,0,0,0,0|2,0,0]=4 5946 B11R1.222 OC(CI)c1ccccc1F Amb26862764 [1,1,0,0,0,0|2,0,0]=4 5947 B11R1.222 OCC(Br)c1ccccc1Cl Amb27839842 [1,1,0,0,0,0|2,0,0]=4 5948 B11R1.222 OCC(F)c1ccccc1Br Amb27591310 [1,1,0,0,0,0|2,0,0]=4 5949 B11R1.222 OCC(F)c1ccccc1Cl Amb25145452 [1,1,0,0,0,0|2,0,0]=4 5950 B11R1.222 OCC(F)c1ccccc1F Amb27983139 [1,1,0,0,0,0|2,0,0]=4 5951 B11R1.222 OCC(F)c1ccccc1O Amb28368767 [1,1,0,0,0,0|2,0,0]=4 5952 B11R1.222 OCC(O)c1ccccc1Br Amb24123020 [1,1,0,0,0,0|2,0,0]=4 5953 B11R1.222 OCC(O)c1ccccc1Cl Amb24123046 [1,1,0,0,0,0|2,0,0]=4 5954 B11R1.222 OCC(O)c1ccccc1F Amb24123031 [1,1,0,0,0,0|2,0,0]=4 5955 B11R1.222 OCC(O)c1ccccc1I Amb27176284 [1,1,0,0,0,0|2,0,0]=4 5956 B11R1.222 OCC(O)c1ccccc1O Amb24646646 [1,1,0,0,0,0|2,0,0]=4 5957 B11R1.222 OC[C@@H](F)c1ccccc1Cl Amb27409787 [1,1,0,0,0,0|2,0,0]=4 5958 B11R1.222 OC[C@@H](O)c1ccccc1Cl Amb6365718 [1,1,0,0,0,0|2,0,0]=4 5959 B11R1.222 OC[C@H](O)c1ccccc1Br Amb27867396 [1,1,0,0,0,0|2,0,0]=4 5960 B11R1.222 OC[C@H](O)c1ccccc1Cl Amb25776080 [1,1,0,0,0,0|2,0,0]=4 5961 B11R1.222 O[C@@H](CCl)c1ccccc1Br Amb28342836 [1,1,0,0,0,0|2,0,0]=4 5962 B11R1.222 O[C@@H](CCl)c1ccccc1F Amb27228743 [1,1,0,0,0,0|2,0,0]=4 5963 B11R1.222 O[C@@H](CF)c1ccccc1F Amb26978378 [1,1,0,0,0,0|2,0,0]=4 5964 B11R1.222 O[C@H](CBr)c1ccccc1Cl Amb6893368 [1,1,0,0,0,0|2,0,0]=4 5965 B11R1.222 O[C@H](CBr)c1ccccc1F Amb28250735 [1,1,0,0,0,0|2,0,0]=4 5966 B11R1.222 O[C@H](CCl)c1ccccc1Br Amb28285031 [1,1,0,0,0,0|2,0,0]=4 5967 B11R1.222 O[C@H](CF)c1ccccc1F Amb24454550 [1,1,0,0,0,0|2,0,0]=4 5968 B11R1.222 Oc1ccccc1C(O)CBr Amb33334195 [1,1,0,0,0,0|2,0,0]=4 5969 B11R1.222 Oc1ccccc1C(O)CCl Amb33262875 [1,1,0,0,0,0|2,0,0]=4 5970 B11R1.222 Oc1ccccc1C(O)CF Amb26529482 [1,1,0,0,0,0|2,0,0]=4 5971 B11R1.222 [C-]#[N+]C(C)c1ccccc1Br Amb3973420 [1,1,0,0,0,0|0,0,2]=4 5972 B11R1.222 [C-]#[N+]C(C)c1ccccc1C Amb3973236 [1,1,0,0,0,0|0,0,2]=4 5973 B11R1.222 [C-]#[N+]C(C)c1ccccc1Cl Amb3973235 [1,1,0,0,0,0|0,0,2]=4 5974 B11R1.222 [C-]#[N+]C(C)c1ccccc1F Amb3973421 [1,1,0,0,0,0|0,0,2]=4 5975 B11R1.1 BrCCCc1ccc(Br)cc1 Amb17104577 [1,1,0,0,0,0|2,0,0]=4 5976 B11R1.1 BrCCCc1ccc(I)cc1 Amb25083701 [1,1,0,0,0,0|2,0,0]=4 5977 B11R1.1 C#CCCc1ccc(Br)cc1 Amb18116967 [1,1,0,0,0,0|1,0,1]=4 5978 B11R1.1 C#CCCc1ccc(C)cc1 Amb18634818 [1,1,0,0,0,0|1,0,1]=4 5979 B11R1.1 C#CCCc1ccc(Cl)cc1 Amb18116815 [1,1,0,0,0,0|1,0,1]=4 5980 B11R1.1 C#CCCc1ccc(F)cc1 Amb18116891 [1,1,0,0,0,0|1,0,1]=4 5981 B11R1.1 C#CCCc1ccc(O)cc1 Amb26053114 [1,1,0,0,0,0|1,0,1]=4 5982 B11R1.1 C=CCCc1ccc(Br)cc1 Amb6298956 [1,1,0,0,0,0|1,0,1]=4 5983 B11R1.1 C=CCCc1ccc(C)cc1 Amb6299000 [1,1,0,0,0,0|1,0,1]=4 5984 B11R1.1 C=CCCc1ccc(F)cc1 Amb2721507 [1,1,0,0,0,0|1,0,1]=4 5985 B11R1.1 C=CCCc1ccc(O)cc1 Amb25249578 [1,1,0,0,0,0|1,0,1]=4 5986 B11R1.1 CCCC[n+]1ccc(C)cc1 Amb22350531 [1,1,0,0,0,0|2,0,0]=4 5987 B11R1.1 CCCC[n+]1ccc(C)cc1 Amb22350545 [1,1,0,0,0,0|2,0,0]=4 5988 B11R1.1 CCCC[n+]1ccc(C)cc1 Amb22353653 [1,1,0,0,0,0|2,0,0]=4 5989 B11R1.1 CCCC[n+]1ccc(C)cc1 Amb9825673 [1,1,0,0,0,0|2,0,0]=4 5990 B11R1.1 CCCCc1ccc(Br)cc1 Amb3939176 [1,1,0,0,0,0|1,0,0]=3 5991 B11R1.1 CCCCc1ccc(C)cc1 Amb22002059 [1,1,0,0,0,0|1,0,0]=3 5992 B11R1.1 CCCCc1ccc(Cl)cc1 Amb6365908 [1,1,0,0,0,0|1,0,0]=3 5993 B11R1.1 CCCCc1ccc(F)cc1 Amb22730516 [1,1,0,0,0,0|1,0,0]=3 5994 B11R1.1 CCCCc1ccc(I)cc1 Amb2726236 [1,1,0,0,0,0|1,0,0]=3 5995 B11R1.1 CCCCc1ccc(N)cc1 Amb2721121 [1,1,0,0,0,0|1,0,0]=3 5996 B11R1.1 CCCCc1ccc(N)cn1 Amb26866351 [1,1,0,0,0,0|2,0,0]=4 5997 B11R1.1 CCCCc1ccc(N)nc1 Amb26477797 [1,1,0,0,0,0|2,0,0]=4 5998 B11R1.1 CCCCc1ccc(O)cc1 Amb2778508 [1,1,0,0,0,0|1,0,0]=3 5999 B11R1.1 CCCCc1ccc(O)cn1 Amb25831110 [1,1,0,0,0,0|2,0,0]=4 6000 B11R1.1 CCCCc1ccc(S)cc1 Amb2685702 [1,1,0,0,0,0|1,0,0]=3 6001 B11R1.1 CCCNc1ccc(Br)cc1 Amb29083384 [1,1,0,0,0,0|2,0,0]=4 6002 B11R1.1 CCCNc1ccc(Br)cc1 Amb4313508 [1,1,0,0,0,0|2,0,0]=4 6003 B11R1.1 CCCNc1ccc(C)cc1 Amb4313501 [1,1,0,0,0,0|2,0,0]=4 6004 B11R1.1 CCCNc1ccc(Cl)cc1 Amb19407162 [1,1,0,0,0,0|2,0,0]=4 6005 B11R1.1 CCCNc1ccc(Cl)cc1 Amb4313503 [1,1,0,0,0,0|2,0,0]=4 6006 B11R1.1 CCCNc1ccc(F)cc1 Amb4313509 [1,1,0,0,0,0|2,0,0]=4 6007 B11R1.1 CCCNc1ccc(I)cc1 Amb7784946 [1,1,0,0,0,0|2,0,0]=4 6008 B11R1.1 CCCOc1ccc(Br)cc1 Amb3428588 [1,1,0,0,0,0|2,0,0]=4 6009 B11R1.1 CCCOc1ccc(C)cc1 Amb26409646 [1,1,0,0,0,0|2,0,0]=4 6010 B11R1.1 CCCOc1ccc(Cl)cc1 Amb25126411 [1,1,0,0,0,0|2,0,0]=4 6011 B11R1.1 CCCOc1ccc(N)cc1 Amb1125044 [1,1,0,0,0,0|2,0,0]=4 6012 B11R1.1 CCCOc1ccc(N)cc1 Amb32409662 [1,1,0,0,0,0|2,0,0]=4 6013 B11R1.1 CCCOc1ccc(O)cc1 Amb1810008 [1,1,0,0,0,0|2,0,0]=4 6014 B11R1.1 CCCOc1ccc(S)cc1 Amb25225762 [1,1,0,0,0,0|2,0,0]=4 6015 B11R1.1 CCCSc1ccc(Br)cc1 Amb28184382 [1,1,0,0,0,0|2,0,0]=4 6016 B11R1.1 CCCSc1ccc(C)cc1 Amb4035211 [1,1,0,0,0,0|2,0,0]=4 6017 B11R1.1 CCCSc1ccc(Cl)cc1 Amb27466470 [1,1,0,0,0,0|2,0,0]=4 6018 B11R1.1 CCCSc1ccc(F)cc1 Amb28365659 [1,1,0,0,0,0|2,0,0]=4 6019 B11R1.1 CCCSc1ccc(N)cc1 Amb22588114 [1,1,0,0,0,0|2,0,0]=4 6020 B11R1.1 CCCSc1ccc(N)cc1 Amb6680313 [1,1,0,0,0,0|2,0,0]=4 6021 B11R1.1 CCCSc1ccc(O)cc1 Amb18180159 [1,1,0,0,0,0|2,0,0]=4 6022 B11R1.1 CCCSc1ccc(S)cc1 Amb24362640 [1,1,0,0,0,0|2,0,0]=4 6023 B11R1.1 CCNCc1ccc(Br)cc1 Amb6864710 [1,1,0,0,0,0|2,0,0]=4 6024 B11R1.1 CCNCc1ccc(Br)cc1 Amb837745 [1,1,0,0,0,0|2,0,0]=4 6025 B11R1.1 CCNCc1ccc(C)cc1 Amb32667090 [1,1,0,0,0,0|2,0,0]=4 6026 B11R1.1 CCNCc1ccc(C)cc1 Amb837583 [1,1,0,0,0,0|2,0,0]=4 6027 B11R1.1 CCNCc1ccc(Cl)cc1 Amb6542591 [1,1,0,0,0,0|2,0,0]=4 6028 B11R1.1 CCNCc1ccc(Cl)cc1 Amb837762 [1,1,0,0,0,0|2,0,0]=4 6029 B11R1.1 CCNCc1ccc(F)cc1 Amb6864711 [1,1,0,0,0,0|2,0,0]=4 6030 B11R1.1 CCNCc1ccc(F)cc1 Amb838198 [1,1,0,0,0,0|2,0,0]=4 6031 B11R1.1 CCNCc1ccc(O)cc1 Amb13952053 [1,1,0,0,0,0|2,0,0]=4 6032 B11R1.1 CCNCc1ccc(O)cc1 Amb6257941 [1,1,0,0,0,0|2,0,0]=4 6033 B11R1.1 CCNCc1ccc(S)cc1 Amb27952729 [1,1,0,0,0,0|2,0,0]=4 6034 B11R1.1 CCOCc1ccc(Br)cc1 Amb19415022 [1,1,0,0,0,0|2,0,0]=4 6035 B11R1.1 CCOCc1ccc(C)cc1 Amb33733834 [1,1,0,0,0,0|2,0,0]=4 6036 B11R1.1 CCOCc1ccc(Cl)cc1 Amb25977812 [1,1,0,0,0,0|2,0,0]=4 6037 B11R1.1 CCOCc1ccc(F)cc1 Amb30594745 [1,1,0,0,0,0|2,0,0]=4 6038 B11R1.1 CCOCc1ccc(N)cc1 Amb1125782 [1,1,0,0,0,0|2,0,0]=4 6039 B11R1.1 CCOCc1ccc(O)cc1 Amb18125402 [1,1,0,0,0,0|2,0,0]=4 6040 B11R1.1 CCSCc1ccc(Br)cc1 Amb25684606 [1,1,0,0,0,0|2,0,0]=4 6041 B11R1.1 CCSCc1ccc(C)cc1 Amb24536616 [1,1,0,0,0,0|2,0,0]=4 6042 B11R1.1 CCSCc1ccc(Cl)cc1 Amb24402210 [1,1,0,0,0,0|2,0,0]=4 6043 B11R1.1 CCSCc1ccc(F)cc1 Amb24486978 [1,1,0,0,0,0|2,0,0]=4 6044 B11R1.1 CCSCc1ccc(N)cc1 Amb6680506 [1,1,0,0,0,0|2,0,0]=4 6045 B11R1.1 CNCCc1ccc(Br)cc1 Amb9214717 [1,1,0,0,0,0|0,0,0]=2 6046 B11R1.1 CNCCc1ccc(Br)cn1 Amb26912040 [1,1,0,0,0,0|1,0,0]=3 6047 B11R1.1 CNCCc1ccc(Br)nc1 Amb33387712 [1,1,0,0,0,0|1,0,0]=3 6048 B11R1.1 CNCCc1ccc(C)cc1 Amb8853647 [1,1,0,0,0,0|0,0,0]=2 6049 B11R1.1 CNCCc1ccc(C)cn1 Amb18125195 [1,1,0,0,0,0|1,0,0]=3 6050 B11R1.1 CNCCc1ccc(C)nc1 Amb26888747 [1,1,0,0,0,0|1,0,0]=3 6051 B11R1.1 CNCCc1ccc(Cl)cc1 Amb32789565 [1,1,0,0,0,0|0,0,0]=2 6052 B11R1.1 CNCCc1ccc(Cl)cc1 Amb5785545 [1,1,0,0,0,0|0,0,0]=2 6053 B11R1.1 CNCCc1ccc(Cl)cn1 Amb28369544 [1,1,0,0,0,0|1,0,0]=3 6054 B11R1.1 CNCCc1ccc(Cl)nc1 Amb33261516 [1,1,0,0,0,0|1,0,0]=3 6055 B11R1.1 CNCCc1ccc(F)cc1 Amb33483732 [1,1,0,0,0,0|0,0,0]=2 6056 B11R1.1 CNCCc1ccc(F)cc1 Amb5785548 [1,1,0,0,0,0|0,0,0]=2 6057 B11R1.1 CNCCc1ccc(F)cn1 Amb26958172 [1,1,0,0,0,0|1,0,0]=3 6058 B11R1.1 CNCCc1ccc(F)nc1 Amb25869882 [1,1,0,0,0,0|1,0,0]=3 6059 B11R1.1 CNCCc1ccc(N)cc1 Amb18290354 [1,1,0,0,0,0|0,0,0]=2 6060 B11R1.1 CNCCc1ccc(O)cc1 Amb15690577 [1,1,0,0,0,0|0,0,0]=2 6061 B11R1.1 CNCCc1ccc(O)cc1 Amb2698071 [1,1,0,0,0,0|0,0,0]=2 6062 B11R1.1 CNCCc1cnc(C)cn1 Amb33377403 [1,1,0,0,0,0|2,0,0]=4 6063 B11R1.1 CNCCc1cnc(C)nc1 Amb27466184 [1,1,0,0,0,0|2,0,0]=4 6064 B11R1.1 CNCCc1cnc(N)nc1 Amb27193859 [1,1,0,0,0,0|2,0,0]=4 6065 B11R1.1 CNCCc1cnc(S)nc1 Amb27209411 [1,1,0,0,0,0|2,0,0]=4 6066 B11R1.1 CNCCc1ncc(Br)cn1 Amb25189084 [1,1,0,0,0,0|2,0,0]=4 6067 B11R1.1 CNCCc1ncc(Br)cn1 Amb31156653 [1,1,0,0,0,0|2,0,0]=4 6068 B11R1.1 CNCCc1ncc(C)cn1 Amb27248049 [1,1,0,0,0,0|2,0,0]=4 6069 B11R1.1 CNCCc1ncc(Cl)cn1 Amb33494233 [1,1,0,0,0,0|2,0,0]=4 6070 B11R1.1 CN\C=N\c1ccc(C)cc1 Amb27596513 [1,1,0,0,0,0|1,0,1]=4 6071 B11R1.1 CN\N=C\c1ccc(Cl)cc1 Amb27484285 [1,1,0,0,0,0|1,0,1]=4 6072 B11R1.1 CN\N=C\c1ccc(F)cc1 Amb17805862 [1,1,0,0,0,0|1,0,1]=4 6073 B11R1.1 CN\N=C\c1ccc(O)cc1 Amb17696985 [1,1,0,0,0,0|1,0,1]=4 6074 B11R1.1 COCC[n+]1ccc(C)cc1 Amb27178652 [1,1,0,0,0,0|2,0,0]=4 6075 B11R1.1 COCCc1ccc(Br)cc1 Amb6257601 [1,1,0,0,0,0|1,0,0]=3 6076 B11R1.1 COCCc1ccc(Br)cn1 Amb27589014 [1,1,0,0,0,0|2,0,0]=4 6077 B11R1.1 COCCc1ccc(Cl)cc1 Amb24118075 [1,1,0,0,0,0|1,0,0]=3 6078 B11R1.1 COCCc1ccc(N)cc1 Amb1139224 [1,1,0,0,0,0|1,0,0]=3 6079 B11R1.1 COCCc1ccc(N)cc1 Amb33551018 [1,1,0,0,0,0|1,0,0]=3 6080 B11R1.1 COCCc1ccc(O)cc1 Amb3939657 [1,1,0,0,0,0|1,0,0]=3 6081 B11R1.1 COCOc1ccc(Br)cc1 Amb22001005 [1,1,0,0,0,0|2,0,0]=4 6082 B11R1.1 COCOc1ccc(Cl)cc1 Amb26860995 [1,1,0,0,0,0|2,0,0]=4 6083 B11R1.1 COCOc1ccc(F)cc1 Amb22546791 [1,1,0,0,0,0|2,0,0]=4 6084 B11R1.1 COCOc1ccc(I)cc1 Amb26900030 [1,1,0,0,0,0|2,0,0]=4 6085 B11R1.1 COCOc1ccc(N)cc1 Amb33547964 [1,1,0,0,0,0|2,0,0]=4 6086 B11R1.1 COCOc1ccc(O)cc1 Amb25268752 [1,1,0,0,0,0|2,0,0]=4 6087 B11R1.1 COCSc1ccc(Br)cc1 Amb24473100 [1,1,0,0,0,0|2,0,0]=4 6088 B11R1.1 CONCc1ccc(Br)cc1 Amb25151171 [1,1,0,0,0,0|2,0,0]=4 6089 B11R1.1 CONCc1ccc(Cl)cc1 Amb27860837 [1,1,0,0,0,0|2,0,0]=4 6090 B11R1.1 CONCc1ccc(F)cc1 Amb26495017 [1,1,0,0,0,0|2,0,0]=4 6091 B11R1.1 CSCCc1ccc(Br)cn1 Amb27867853 [1,1,0,0,0,0|2,0,0]=4 6092 B11R1.1 CSCCc1ccc(C)cc1 Amb27404222 [1,1,0,0,0,0|1,0,0]=3 6093 B11R1.1 CSCCc1ccc(N)cc1 Amb18971649 [1,1,0,0,0,0|1,0,0]=3 6094 B11R1.1 CSCSc1ccc(O)cc1 Amb27762489 [1,1,0,0,0,0|2,0,0]=4 6095 B11R1.1 C\C=C\Cc1ccc(N)cc1 Amb22751067 [1,1,0,0,0,0|1,0,1]=4 6096 B11R1.1 C\C=C\Cc1ccc(O)cc1 Amb18124917 [1,1,0,0,0,0|1,0,1]=4 6097 B11R1.1 Cc1ccc(CCC#N)cc1 Amb17204297 [1,1,0,0,0,0|2,0,0]=4 6098 B11R1.1 Cc1ccc(CCC=O)cc1 Amb5411454 [1,1,0,0,0,0|2,0,0]=4 6099 B11R1.1 Cc1ccc(CCCBr)cc1 Amb17104554 [1,1,0,0,0,0|2,0,0]=4 6100 B11R1.1 Cc1ccc(CCCCl)cc1 Amb17104527 [1,1,0,0,0,0|2,0,0]=4 6101 B11R1.1 Cc1ccc(CCCN)cc1 Amb844761 [1,1,0,0,0,0|2,0,0]=4 6102 B11R1.1 Cc1ccc(CCCO)cc1 Amb3372062 [1,1,0,0,0,0|2,0,0]=4 6103 B11R1.1 Cc1ccc(CCCS)cc1 Amb17400220 [1,1,0,0,0,0|2,0,0]=4 6104 B11R1.1 Cc1ccc(CCNN)cc1 Amb8842845 [1,1,0,0,0,0|1,0,0]=3 6105 B11R1.1 Cc1ccc(CCON)cc1 Amb33373961 [1,1,0,0,0,0|2,0,0]=4 6106 B11R1.1 Cc1ccc(CC[Mg]Br)cc1 Amb6300498 [1,1,0,0,0,0|2,0,0]=4 6107 B11R1.1 ClCCCc1ccc(Br)cc1 Amb17104549 [1,1,0,0,0,0|2,0,0]=4 6108 B11R1.1 ClCCCc1ccc(Cl)cc1 Amb3429107 [1,1,0,0,0,0|2,0,0]=4 6109 B11R1.1 ClCCCc1ccc(I)cc1 Amb27163564 [1,1,0,0,0,0|2,0,0]=4 6110 B11R1.1 Clc1ccc(CCCBr)cc1 Amb17104562 [1,1,0,0,0,0|2,0,0]=4 6111 B11R1.1 Clc1ccc(CC[Mg]Br)cc1 Amb6300494 [1,1,0,0,0,0|2,0,0]=4 6112 B11R1.1 Fc1ccc(CCCBr)cc1 Amb17104556 [1,1,0,0,0,0|2,0,0]=4 6113 B11R1.1 Fc1ccc(CCCCl)cc1 Amb17104529 [1,1,0,0,0,0|2,0,0]=4 6114 B11R1.1 Fc1ccc(CCCS)cc1 Amb17400333 [1,1,0,0,0,0|2,0,0]=4 6115 B11R1.1 Fc1ccc(CC[Mg]Br)cc1 Amb6300496 [1,1,0,0,0,0|2,0,0]=4 6116 B11R1.1 Fc1ccc(CC[Zn]Br)cc1 Amb22000495 [1,1,0,0,0,0|2,0,0]=4 6117 B11R1.1 N#CCCc1ccc(Br)cc1 Amb2685460 [1,1,0,0,0,0|2,0,0]=4 6118 B11R1.1 N#CCCc1ccc(Cl)cc1 Amb2686407 [1,1,0,0,0,0|2,0,0]=4 6119 B11R1.1 N#CCCc1ccc(F)cc1 Amb17204299 [1,1,0,0,0,0|2,0,0]=4 6120 B11R1.1 N#CCCc1ccc(I)cc1 Amb25785381 [1,1,0,0,0,0|2,0,0]=4 6121 B11R1.1 N#CCCc1ccc(N)cc1 Amb26509671 [1,1,0,0,0,0|2,0,0]=4 6122 B11R1.1 N#CCCc1ccc(O)cc1 Amb2688782 [1,1,0,0,0,0|2,0,0]=4 6123 B11R1.1 N#CCCc1ccc(S)cc1 Amb27634330 [1,1,0,0,0,0|2,0,0]=4 6124 B11R1.1 NCCCc1ccc(Br)cc1 Amb9304905 [1,1,0,0,0,0|2,0,0]=4 6125 B11R1.1 NCCCc1ccc(Cl)cc1 Amb1092541 [1,1,0,0,0,0|2,0,0]=4 6126 B11R1.1 NCCCc1ccc(Cl)cc1 Amb13952055 [1,1,0,0,0,0|2,0,0]=4 6127 B11R1.1 NCCCc1ccc(F)cc1 Amb28988628 [1,1,0,0,0,0|2,0,0]=4 6128 B11R1.1 NCCCc1ccc(F)cc1 Amb5400261 [1,1,0,0,0,0|2,0,0]=4 6129 B11R1.1 NCCCc1ccc(N)cc1 Amb17477693 [1,1,0,0,0,0|2,0,0]=4 6130 B11R1.1 NCCCc1ccc(N)cc1 Amb34913304 [1,1,0,0,0,0|2,0,0]=4 6131 B11R1.1 NCCCc1ccc(O)cc1 Amb2695306 [1,1,0,0,0,0|2,0,0]=4 6132 B11R1.1 NCCCc1ccc(O)cc1 Amb33548453 [1,1,0,0,0,0|2,0,0]=4 6133 B11R1.1 NNCCc1ccc(Br)cc1 Amb6243917 [1,1,0,0,0,0|1,0,0]=3 6134 B11R1.1 NNCCc1ccc(Cl)cc1 Amb6257002 [1,1,0,0,0,0|1,0,0]=3 6135 B11R1.1 NNCCc1ccc(F)cc1 Amb6245233 [1,1,0,0,0,0|1,0,0]=3 6136 B11R1.1 NNCCc1ccc(I)cc1 Amb27816617 [1,1,0,0,0,0|1,0,0]=3 6137 B11R1.1 NNCCc1ccc(O)cc1 Amb27802782 [1,1,0,0,0,0|1,0,0]=3 6138 B11R1.1 NOCCc1ccc(Br)cc1 Amb33241028 [1,1,0,0,0,0|2,0,0]=4 6139 B11R1.1 NOCCc1ccc(Cl)cc1 Amb28411635 [1,1,0,0,0,0|2,0,0]=4 6140 B11R1.1 NOCCc1ccc(F)cc1 Amb22896631 [1,1,0,0,0,0|2,0,0]=4 6141 B11R1.1 NOCCc1ccc(O)cc1 Amb25053130 [1,1,0,0,0,0|2,0,0]=4 6142 B11R1.1 Nc1ccc(CCC=O)cc1 Amb27407356 [1,1,0,0,0,0|2,0,0]=4 6143 B11R1.1 Nc1ccc(CCCBr)cc1 Amb27751175 [1,1,0,0,0,0|2,0,0]=4 6144 B11R1.1 Nc1ccc(CCCCl)cc1 Amb17477708 [1,1,0,0,0,0|2,0,0]=4 6145 B11R1.1 Nc1ccc(CCCO)cc1 Amb17477700 [1,1,0,0,0,0|2,0,0]=4 6146 B11R1.1 Nc1ccc(CCCS)cc1 Amb29854940 [1,1,0,0,0,0|2,0,0]=4 6147 B11R1.1 O=CCCc1ccc(Br)cc1 Amb10602155 [1,1,0,0,0,0|2,0,0]=4 6148 B11R1.1 O=CCCc1ccc(Cl)cc1 Amb33531051 [1,1,0,0,0,0|2,0,0]=4 6149 B11R1.1 O=CCCc1ccc(F)cc1 Amb10602156 [1,1,0,0,0,0|2,0,0]=4 6150 B11R1.1 O=CCCc1ccc(I)cc1 Amb27205783 [1,1,0,0,0,0|2,0,0]=4 6151 B11R1.1 O=CCCc1ccc(O)cc1 Amb17081693 [1,1,0,0,0,0|2,0,0]=4 6152 B11R1.1 O=CCCc1ccc(S)cc1 Amb27192456 [1,1,0,0,0,0|2,0,0]=4 6153 B11R1.1 OCCCc1ccc(Br)cc1 Amb13883587 [1,1,0,0,0,0|2,0,0]=4 6154 B11R1.1 OCCCc1ccc(Cl)cc1 Amb2724698 [1,1,0,0,0,0|2,0,0]=4 6155 B11R1.1 OCCCc1ccc(F)cc1 Amb17089497 [1,1,0,0,0,0|2,0,0]=4 6156 B11R1.1 OCCCc1ccc(I)cc1 Amb24406298 [1,1,0,0,0,0|2,0,0]=4 6157 B11R1.1 OCCCc1ccc(O)cc1 Amb9825857 [1,1,0,0,0,0|2,0,0]=4 6158 B11R1.1 ONCCc1ccc(O)cc1 Amb27409616 [1,1,0,0,0,0|1,0,0]=3 6159 B11R1.1 Oc1ccc(CCCBr)cc1 Amb25703932 [1,1,0,0,0,0|2,0,0]=4 6160 B11R1.1 Oc1ccc(CCCCl)cc1 Amb17477722 [1,1,0,0,0,0|2,0,0]=4 6161 B11R1.1 Oc1ccc(CCCS)cc1 Amb26880425 [1,1,0,0,0,0|2,0,0]=4 6162 B11R1.1 SCCCc1ccc(Br)cc1 Amb17407562 [1,1,0,0,0,0|2,0,0]=4 6163 B11R1.1 SCCCc1ccc(Cl)cc1 Amb17401097 [1,1,0,0,0,0|2,0,0]=4 6164 B11R1.1 Sc1ccc(CCCCl)cc1 Amb27233376 [1,1,0,0,0,0|2,0,0]=4 6165 B11R1.1 [C-]#[N+]CCc1ccc(Br)cc1 Amb2685409 [1,1,0,0,0,0|0,0,2]=4 6166 B11R1.1 [C-]#[N+]CCc1ccc(C)cc1 Amb33203684 [1,1,0,0,0,0|0,0,2]=4 6167 B11R1.1 [C-]#[N+]CCc1ccc(Cl)cc1 Amb2686346 [1,1,0,0,0,0|0,0,2]=4 6168 B11R1.1 [C-]#[N+]CCc1ccc(F)cc1 Amb2688287 [1,1,0,0,0,0|0,0,2]=4 6169 B11R1.17 BrCCCc1ccccc1Br Amb26341120 [1,1,0,0,0,0|2,0,0]=4 6170 B11R1.17 C#CCCc1ccccc1Br Amb3991957 [1,1,0,0,0,0|1,0,1]=4 6171 B11R1.17 C#CCCc1ccccc1C Amb18636111 [1,1,0,0,0,0|1,0,1]=4 6172 B11R1.17 C#CCCc1ccccc1Cl Amb18116938 [1,1,0,0,0,0|1,0,1]=4 6173 B11R1.17 C#CCCc1ccccc1F Amb18636110 [1,1,0,0,0,0|1,0,1]=4 6174 B11R1.17 C#CCCc1ccccc1O Amb28253821 [1,1,0,0,0,0|1,0,1]=4 6175 B11R1.17 C=CCCc1ccccc1N Amb18124836 [1,1,0,0,0,0|1,0,1]=4 6176 B11R1.17 CCCCN1C=CC=CC1=S Amb24415294 [1,1,0,0,0,0|2,0,0]=4 6177 B11R1.17 CCCCc1ccccc1Br Amb15690808 [1,1,0,0,0,0|1,0,0]=3 6178 B11R1.17 CCCCc1ccccc1C Amb25825024 [1,1,0,0,0,0|1,0,0]=3 6179 B11R1.17 CCCCc1ccccc1F Amb24426932 [1,1,0,0,0,0|1,0,0]=3 6180 B11R1.17 CCCCc1ccccc1I Amb25955656 [1,1,0,0,0,0|1,0,0]=3 6181 B11R1.17 CCCCc1ccccc1N Amb4037102 [1,1,0,0,0,0|1,0,0]=3 6182 B11R1.17 CCCCc1ccccc1O Amb25744605 [1,1,0,0,0,0|1,0,0]=3 6183 B11R1.17 CCCCc1cccnc1Br Amb33038909 [1,1,0,0,0,0|2,0,0]=4 6184 B11R1.17 CCCCc1cccnc1N Amb8386853 [1,1,0,0,0,0|2,0,0]=4 6185 B11R1.17 CCCCc1ccncc1N Amb27666549 [1,1,0,0,0,0|2,0,0]=4 6186 B11R1.17 CCCCc1cnccc1N Amb25785815 [1,1,0,0,0,0|2,0,0]=4 6187 B11R1.17 CCCCc1cnccc1O Amb33189016 [1,1,0,0,0,0|2,0,0]=4 6188 B11R1.17 CCCCc1ncccc1N Amb26848966 [1,1,0,0,0,0|2,0,0]=4 6189 B11R1.17 CCCCc1ncccc1O Amb27483034 [1,1,0,0,0,0|2,0,0]=4 6190 B11R1.17 CCCNc1ccccc1Br Amb6696451 [1,1,0,0,0,0|2,0,0]=4 6191 B11R1.17 CCCNc1ccccc1C Amb6701222 [1,1,0,0,0,0|2,0,0]=4 6192 B11R1.17 CCCNc1ccccc1Cl Amb4313502 [1,1,0,0,0,0|2,0,0]=4 6193 B11R1.17 CCCNc1ccccc1F Amb6697369 [1,1,0,0,0,0|2,0,0]=4 6194 B11R1.17 CCCNc1ccccc1N Amb440116 [1,1,0,0,0,0|2,0,0]=4 6195 B11R1.17 CCCOc1ccccc1Br Amb6267012 [1,1,0,0,0,0|2,0,0]=4 6196 B11R1.17 CCCOc1ccccc1F Amb21856719 [1,1,0,0,0,0|2,0,0]=4 6197 B11R1.17 CCCOc1ccccc1I Amb27171983 [1,1,0,0,0,0|2,0,0]=4 6198 B11R1.17 CCCOc1ccccc1N Amb1210617 [1,1,0,0,0,0|2,0,0]=4 6199 B11R1.17 CCCOc1ccccc1N Amb840073 [1,1,0,0,0,0|2,0,0]=4 6200 B11R1.17 CCCOc1ccccc1O Amb433886 [1,1,0,0,0,0|2,0,0]=4 6201 B11R1.17 CCCOc1ccccc1S Amb28399283 [1,1,0,0,0,0|2,0,0]=4 6202 B11R1.17 CCCSc1ccccc1Br Amb28046780 [1,1,0,0,0,0|2,0,0]=4 6203 B11R1.17 CCCSc1ccccc1Cl Amb25957434 [1,1,0,0,0,0|2,0,0]=4 6204 B11R1.17 CCCSc1ccccc1F Amb27752807 [1,1,0,0,0,0|2,0,0]=4 6205 B11R1.17 CCCSc1ccccc1N Amb22588094 [1,1,0,0,0,0|2,0,0]=4 6206 B11R1.17 CCCSc1ccccc1N Amb6276699 [1,1,0,0,0,0|2,0,0]=4 6207 B11R1.17 CCCSc1ccccc1S Amb26323053 [1,1,0,0,0,0|2,0,0]=4 6208 B11R1.17 CCNCc1ccccc1Br Amb28872271 [1,1,0,0,0,0|2,0,0]=4 6209 B11R1.17 CCNCc1ccccc1Br Amb6243296 [1,1,0,0,0,0|2,0,0]=4 6210 B11R1.17 CCNCc1ccccc1C Amb5785552 [1,1,0,0,0,0|2,0,0]=4 6211 B11R1.17 CCNCc1ccccc1C Amb6865250 [1,1,0,0,0,0|2,0,0]=4 6212 B11R1.17 CCNCc1ccccc1Cl Amb5785551 [1,1,0,0,0,0|2,0,0]=4 6213 B11R1.17 CCNCc1ccccc1Cl Amb6542581 [1,1,0,0,0,0|2,0,0]=4 6214 B11R1.17 CCNCc1ccccc1F Amb5785550 [1,1,0,0,0,0|2,0,0]=4 6215 B11R1.17 CCNCc1ccccc1F Amb6865249 [1,1,0,0,0,0|2,0,0]=4 6216 B11R1.17 CCNCc1ccccc1N Amb28973216 [1,1,0,0,0,0|2,0,0]=4 6217 B11R1.17 CCNCc1ccccc1N Amb7173571 [1,1,0,0,0,0|2,0,0]=4 6218 B11R1.17 CCNCc1ccccc1O Amb6257868 [1,1,0,0,0,0|2,0,0]=4 6219 B11R1.17 CCOCc1ccccc1Br Amb22227882 [1,1,0,0,0,0|2,0,0]=4 6220 B11R1.17 CCOCc1ccccc1N Amb6245712 [1,1,0,0,0,0|2,0,0]=4 6221 B11R1.17 CCOCc1ccccc1O Amb10560038 [1,1,0,0,0,0|2,0,0]=4 6222 B11R1.17 CCSCc1ccccc1Br Amb22228180 [1,1,0,0,0,0|2,0,0]=4 6223 B11R1.17 CCSCc1ccccc1Cl Amb25676288 [1,1,0,0,0,0|2,0,0]=4 6224 B11R1.17 CCSCc1ccccc1F Amb26622298 [1,1,0,0,0,0|2,0,0]=4 6225 B11R1.17 CNCCC1=CC=CNC1=O Amb27442144 [1,1,0,0,0,0|1,0,0]=3 6226 B11R1.17 CNCCC1=CNC=NC1=O Amb28286925 [1,1,0,0,0,0|2,0,0]=4 6227 B11R1.17 CNCCc1ccccc1Br Amb18299468 [1,1,0,0,0,0|0,0,0]=2 6228 B11R1.17 CNCCc1ccccc1Br Amb33313471 [1,1,0,0,0,0|0,0,0]=2 6229 B11R1.17 CNCCc1ccccc1C Amb19959980 [1,1,0,0,0,0|0,0,0]=2 6230 B11R1.17 CNCCc1ccccc1C Amb8841496 [1,1,0,0,0,0|0,0,0]=2 6231 B11R1.17 CNCCc1ccccc1Cl Amb8853664 [1,1,0,0,0,0|0,0,0]=2 6232 B11R1.17 CNCCc1ccccc1F Amb6710685 [1,1,0,0,0,0|0,0,0]=2 6233 B11R1.17 CNCCc1ccccc1O Amb18560895 [1,1,0,0,0,0|0,0,0]=2 6234 B11R1.17 CNCCc1ccccc1O Amb30584750 [1,1,0,0,0,0|0,0,0]=2 6235 B11R1.17 CNCCc1cccnc1Br Amb33389453 [1,1,0,0,0,0|1,0,0]=3 6236 B11R1.17 CNCCc1cccnc1C Amb24635443 [1,1,0,0,0,0|1,0,0]=3 6237 B11R1.17 CNCCc1cccnc1Cl Amb33256856 [1,1,0,0,0,0|1,0,0]=3 6238 B11R1.17 CNCCc1cccnc1F Amb33377639 [1,1,0,0,0,0|1,0,0]=3 6239 B11R1.17 CNCCc1cccnc1N Amb27170722 [1,1,0,0,0,0|1,0,0]=3 6240 B11R1.17 CNCCc1ccncc1Br Amb33451218 [1,1,0,0,0,0|1,0,0]=3 6241 B11R1.17 CNCCc1ccncc1C Amb25977379 [1,1,0,0,0,0|1,0,0]=3 6242 B11R1.17 CNCCc1ccncc1Cl Amb27804415 [1,1,0,0,0,0|1,0,0]=3 6243 B11R1.17 CNCCc1ccncc1F Amb24593125 [1,1,0,0,0,0|1,0,0]=3 6244 B11R1.17 CNCCc1cnccc1C Amb26933148 [1,1,0,0,0,0|1,0,0]=3 6245 B11R1.17 CNCCc1cncnc1C Amb33472506 [1,1,0,0,0,0|2,0,0]=4 6246 B11R1.17 CNCCc1ncccc1Br Amb18657771 [1,1,0,0,0,0|1,0,0]=3 6247 B11R1.17 CNCCc1ncccc1C Amb18125193 [1,1,0,0,0,0|1,0,0]=3 6248 B11R1.17 CNCCc1ncccc1Cl Amb18126745 [1,1,0,0,0,0|1,0,0]=3 6249 B11R1.17 CNCCc1ncccc1F Amb24636895 [1,1,0,0,0,0|1,0,0]=3 6250 B11R1.17 CNCCc1nccnc1C Amb33142591 [1,1,0,0,0,0|2,0,0]=4 6251 B11R1.17 CN\N=C\c1ccccc1F Amb17704011 [1,1,0,0,0,0|1,0,1]=4 6252 B11R1.17 COCC[n+]1ccccc1Cl Amb27852703 [1,1,0,0,0,0|2,0,0]=4 6253 B11R1.17 COCCc1cccc[n+]1[O-] Amb10573566 [1,1,0,0,0,0|2,0,0]=4 6254 B11R1.17 COCCc1ccccc1Br Amb4021414 [1,1,0,0,0,0|1,0,0]=3 6255 B11R1.17 COCCc1ccccc1N Amb18992153 [1,1,0,0,0,0|1,0,0]=3 6256 B11R1.17 COCCc1ccccc1O Amb33552299 [1,1,0,0,0,0|1,0,0]=3 6257 B11R1.17 COCCc1cccnc1N Amb27459527 [1,1,0,0,0,0|2,0,0]=4 6258 B11R1.17 COCCc1ncccc1O Amb27452504 [1,1,0,0,0,0|2,0,0]=4 6259 B11R1.17 COCOc1ccccc1Br Amb21912438 [1,1,0,0,0,0|2,0,0]=4 6260 B11R1.17 COCOc1ccccc1C Amb10559613 [1,1,0,0,0,0|2,0,0]=4 6261 B11R1.17 COCOc1ccccc1Cl Amb25840223 [1,1,0,0,0,0|2,0,0]=4 6262 B11R1.17 COCOc1ccccc1F Amb22546792 [1,1,0,0,0,0|2,0,0]=4 6263 B11R1.17 COCOc1ccccc1I Amb22284514 [1,1,0,0,0,0|2,0,0]=4 6264 B11R1.17 COCOc1ccccc1N Amb23599107 [1,1,0,0,0,0|2,0,0]=4 6265 B11R1.17 COCSc1ccccc1Br Amb27605149 [1,1,0,0,0,0|2,0,0]=4 6266 B11R1.17 COCSc1ccccc1C Amb27775698 [1,1,0,0,0,0|2,0,0]=4 6267 B11R1.17 COCSc1ccccc1F Amb28282291 [1,1,0,0,0,0|2,0,0]=4 6268 B11R1.17 COCSc1ccccc1O Amb27754976 [1,1,0,0,0,0|2,0,0]=4 6269 B11R1.17 CONCc1ccccc1Br Amb27471699 [1,1,0,0,0,0|2,0,0]=4 6270 B11R1.17 CONCc1ccccc1C Amb28055849 [1,1,0,0,0,0|2,0,0]=4 6271 B11R1.17 CONCc1ccccc1Cl Amb26643050 [1,1,0,0,0,0|2,0,0]=4 6272 B11R1.17 CONCc1ccccc1Cl Amb33552565 [1,1,0,0,0,0|2,0,0]=4 6273 B11R1.17 CONCc1ccccc1F Amb24725975 [1,1,0,0,0,0|2,0,0]=4 6274 B11R1.17 CSCCc1ccccc1N Amb18299122 [1,1,0,0,0,0|1,0,0]=3 6275 B11R1.17 C\C=C\Cc1ccccc1O Amb3940146 [1,1,0,0,0,0|1,0,1]=4 6276 B11R1.17 Cc1ccccc1CCC#N Amb17204295 [1,1,0,0,0,0|2,0,0]=4 6277 B11R1.17 Cc1ccccc1CCC=O Amb6306217 [1,1,0,0,0,0|2,0,0]=4 6278 B11R1.17 Cc1ccccc1CCCBr Amb17104552 [1,1,0,0,0,0|2,0,0]=4 6279 B11R1.17 Cc1ccccc1CCCCl Amb17104525 [1,1,0,0,0,0|2,0,0]=4 6280 B11R1.17 Cc1ccccc1CCCN Amb33743608 [1,1,0,0,0,0|2,0,0]=4 6281 B11R1.17 Cc1ccccc1CCCN Amb5735477 [1,1,0,0,0,0|2,0,0]=4 6282 B11R1.17 Cc1ccccc1CCCO Amb17089494 [1,1,0,0,0,0|2,0,0]=4 6283 B11R1.17 Cc1ccccc1CCCS Amb17400218 [1,1,0,0,0,0|2,0,0]=4 6284 B11R1.17 Cc1ccccc1CCNN Amb6242730 [1,1,0,0,0,0|1,0,0]=3 6285 B11R1.17 Cc1ccccc1CCON Amb26991554 [1,1,0,0,0,0|2,0,0]=4 6286 B11R1.17 Cc1ccccc1CC[Zn]Br Amb22000497 [1,1,0,0,0,0|2,0,0]=4 6287 B11R1.17 Cc1cccnc1CCNN Amb35731469 [1,1,0,0,0,0|2,0,0]=4 6288 B11R1.17 ClCCCc1ccccc1Br Amb26508575 [1,1,0,0,0,0|2,0,0]=4 6289 B11R1.17 ClCCCc1ccccc1Cl Amb17104533 [1,1,0,0,0,0|2,0,0]=4 6290 B11R1.17 Clc1ccccc1CCCBr Amb17104560 [1,1,0,0,0,0|2,0,0]=4 6291 B11R1.17 Fc1ccccc1CCCBr Amb17104555 [1,1,0,0,0,0|2,0,0]=4 6292 B11R1.17 Fc1ccccc1CCCCl Amb17104528 [1,1,0,0,0,0|2,0,0]=4 6293 B11R1.17 Fc1ccccc1CCCS Amb17400332 [1,1,0,0,0,0|2,0,0]=4 6294 B11R1.17 N#CCCc1ccccc1Br Amb17204424 [1,1,0,0,0,0|2,0,0]=4 6295 B11R1.17 N#CCCc1ccccc1Cl Amb2686406 [1,1,0,0,0,0|2,0,0]=4 6296 B11R1.17 N#CCCc1ccccc1F Amb17204298 [1,1,0,0,0,0|2,0,0]=4 6297 B11R1.17 N#CCCc1ccccc1O Amb17509008 [1,1,0,0,0,0|2,0,0]=4 6298 B11R1.17 N#CCCc1ccccc1S Amb28208431 [1,1,0,0,0,0|2,0,0]=4 6299 B11R1.17 NCCCc1ccccc1Br Amb33533965 [1,1,0,0,0,0|2,0,0]=4 6300 B11R1.17 NCCCc1ccccc1Br Amb9304915 [1,1,0,0,0,0|2,0,0]=4 6301 B11R1.17 NCCCc1ccccc1Cl Amb1090913 [1,1,0,0,0,0|2,0,0]=4 6302 B11R1.17 NCCCc1ccccc1Cl Amb19373405 [1,1,0,0,0,0|2,0,0]=4 6303 B11R1.17 NCCCc1ccccc1F Amb13949158 [1,1,0,0,0,0|2,0,0]=4 6304 B11R1.17 NCCCc1ccccc1F Amb5735478 [1,1,0,0,0,0|2,0,0]=4 6305 B11R1.17 NCCCc1ccccc1I Amb27814275 [1,1,0,0,0,0|2,0,0]=4 6306 B11R1.17 NCCCc1ccccc1N Amb17477695 [1,1,0,0,0,0|2,0,0]=4 6307 B11R1.17 NCCCc1ccccc1O Amb2695303 [1,1,0,0,0,0|2,0,0]=4 6308 B11R1.17 NNCCc1ccccc1Cl Amb6243429 [1,1,0,0,0,0|1,0,0]=3 6309 B11R1.17 NNCCc1ccccc1F Amb20668135 [1,1,0,0,0,0|1,0,0]=3 6310 B11R1.17 NNCCc1ccccc1F Amb6480211 [1,1,0,0,0,0|1,0,0]=3 6311 B11R1.17 NNCCc1cnccc1N Amb27474016 [1,1,0,0,0,0|2,0,0]=4 6312 B11R1.17 NOCCc1ccccc1Br Amb18657908 [1,1,0,0,0,0|2,0,0]=4 6313 B11R1.17 NOCCc1ccccc1Cl Amb18647570 [1,1,0,0,0,0|2,0,0]=4 6314 B11R1.17 NOCCc1ccccc1F Amb22896629 [1,1,0,0,0,0|2,0,0]=4 6315 B11R1.17 NOCCc1ccccc1O Amb28063031 [1,1,0,0,0,0|2,0,0]=4 6316 B11R1.17 Nc1ccccc1CCCCl Amb17477710 [1,1,0,0,0,0|2,0,0]=4 6317 B11R1.17 Nc1ccccc1CCCF Amb28059275 [1,1,0,0,0,0|2,0,0]=4 6318 B11R1.17 Nc1ccccc1CCCO Amb17477702 [1,1,0,0,0,0|2,0,0]=4 6319 B11R1.17 O=CCCc1ccccc1Br Amb22498060 [1,1,0,0,0,0|2,0,0]=4 6320 B11R1.17 O=CCCc1ccccc1Cl Amb17081678 [1,1,0,0,0,0|2,0,0]=4 6321 B11R1.17 O=CCCc1ccccc1F Amb10602147 [1,1,0,0,0,0|2,0,0]=4 6322 B11R1.17 O=CCCc1ccccc1O Amb22228954 [1,1,0,0,0,0|2,0,0]=4 6323 B11R1.17 OCCCc1ccccc1Br Amb15692692 [1,1,0,0,0,0|2,0,0]=4 6324 B11R1.17 OCCCc1ccccc1Cl Amb17089499 [1,1,0,0,0,0|2,0,0]=4 6325 B11R1.17 OCCCc1ccccc1F Amb17089496 [1,1,0,0,0,0|2,0,0]=4 6326 B11R1.17 OCCCc1ccccc1I Amb27246348 [1,1,0,0,0,0|2,0,0]=4 6327 B11R1.17 OCCCc1ccccc1O Amb17477714 [1,1,0,0,0,0|2,0,0]=4 6328 B11R1.17 Oc1ccccc1CCCBr Amb27667946 [1,1,0,0,0,0|2,0,0]=4 6329 B11R1.17 Oc1ccccc1CCCCl Amb17477721 [1,1,0,0,0,0|2,0,0]=4 6330 B11R1.17 Oc1ccccc1CCCS Amb26040563 [1,1,0,0,0,0|2,0,0]=4 6331 B11R1.17 SCCCc1ccccc1Br Amb18070447 [1,1,0,0,0,0|2,0,0]=4 6332 B11R1.17 SCCCc1ccccc1Cl Amb17401095 [1,1,0,0,0,0|2,0,0]=4 6333 B11R1.17 [C-]#[N+]CCc1ccccc1Br Amb33387614 [1,1,0,0,0,0|0,0,2]=4 6334 B11R1.17 [C-]#[N+]CCc1ccccc1C Amb2689592 [1,1,0,0,0,0|0,0,2]=4 6335 B11R1.17 [C-]#[N+]CCc1ccccc1Cl Amb2686344 [1,1,0,0,0,0|0,0,2]=4 6336 B11R1.17 [C-]#[N+]CCc1ccccc1F Amb2688285 [1,1,0,0,0,0|0,0,2]=4 6337 B11R1.24 BrCCCc1cccc(Br)c1 Amb17104576 [1,1,0,0,0,0|2,0,0]=4 6338 B11R1.24 C#CCCc1cccc(Br)c1 Amb33451616 [1,1,0,0,0,0|1,0,1]=4 6339 B11R1.24 C#CCCc1cccc(C)c1 Amb33380572 [1,1,0,0,0,0|1,0,1]=4 6340 B11R1.24 C#CCCc1cccc(Cl)c1 Amb18116942 [1,1,0,0,0,0|1,0,1]=4 6341 B11R1.24 C#CCCc1cccc(F)c1 Amb18118085 [1,1,0,0,0,0|1,0,1]=4 6342 B11R1.24 C#CCCc1cccc(O)c1 Amb33312065 [1,1,0,0,0,0|1,0,1]=4 6343 B11R1.24 C=CCCc1cccc(Br)c1 Amb6298948 [1,1,0,0,0,0|1,0,1]=4 6344 B11R1.24 C=CCCc1cccc(Cl)c1 Amb6298971 [1,1,0,0,0,0|1,0,1]=4 6345 B11R1.24 C=CCCc1cccc(O)c1 Amb25275934 [1,1,0,0,0,0|1,0,1]=4 6346 B11R1.24 CCCCC1=CC(=O)C=CS1 Amb27855025 [1,1,0,0,0,0|2,0,0]=4 6347 B11R1.24 CCCCC1=CC(=S)C=CN1 Amb28119415 [1,1,0,0,0,0|2,0,0]=4 6348 B11R1.24 CCCC[n+]1cccc(C)c1 Amb22411627 [1,1,0,0,0,0|2,0,0]=4 6349 B11R1.24 CCCC[n+]1cccc(C)c1 Amb24323548 [1,1,0,0,0,0|2,0,0]=4 6350 B11R1.24 CCCC[n+]1cccc(C)c1 Amb33934312 [1,1,0,0,0,0|2,0,0]=4 6351 B11R1.24 CCCCc1cc(Br)ccn1 Amb24083005 [1,1,0,0,0,0|2,0,0]=4 6352 B11R1.24 CCCCc1cc(N)ccn1 Amb30010808 [1,1,0,0,0,0|2,0,0]=4 6353 B11R1.24 CCCCc1cccc(Br)c1 Amb19944057 [1,1,0,0,0,0|1,0,0]=3 6354 B11R1.24 CCCCc1cccc(C)c1 Amb22730119 [1,1,0,0,0,0|1,0,0]=3 6355 B11R1.24 CCCCc1cccc(Cl)c1 Amb26984112 [1,1,0,0,0,0|1,0,0]=3 6356 B11R1.24 CCCCc1cccc(F)c1 Amb27221595 [1,1,0,0,0,0|1,0,0]=3 6357 B11R1.24 CCCCc1cccc(F)n1 Amb28280759 [1,1,0,0,0,0|2,0,0]=4 6358 B11R1.24 CCCCc1cccc(I)c1 Amb19944046 [1,1,0,0,0,0|1,0,0]=3 6359 B11R1.24 CCCCc1cccc(N)c1 Amb17593719 [1,1,0,0,0,0|1,0,0]=3 6360 B11R1.24 CCCCc1cccc(N)n1 Amb18644442 [1,1,0,0,0,0|2,0,0]=4 6361 B11R1.24 CCCCc1cccc(O)c1 Amb26463186 [1,1,0,0,0,0|1,0,0]=3 6362 B11R1.24 CCCCc1ccnc(C)c1 Amb27176838 [1,1,0,0,0,0|2,0,0]=4 6363 B11R1.24 CCCCc1ccnc(Cl)c1 Amb27250650 [1,1,0,0,0,0|2,0,0]=4 6364 B11R1.24 CCCCc1ccnc(O)c1 Amb22749775 [1,1,0,0,0,0|2,0,0]=4 6365 B11R1.24 CCCCc1cncc(O)c1 Amb28383031 [1,1,0,0,0,0|2,0,0]=4 6366 B11R1.24 CCCCc1cncc(S)c1 Amb33276291 [1,1,0,0,0,0|2,0,0]=4 6367 B11R1.24 CCCNc1cccc(Br)c1 Amb6696672 [1,1,0,0,0,0|2,0,0]=4 6368 B11R1.24 CCCNc1cccc(C)c1 Amb6684516 [1,1,0,0,0,0|2,0,0]=4 6369 B11R1.24 CCCNc1cccc(Cl)c1 Amb6695728 [1,1,0,0,0,0|2,0,0]=4 6370 B11R1.24 CCCNc1cccc(F)c1 Amb6695885 [1,1,0,0,0,0|2,0,0]=4 6371 B11R1.24 CCCNc1cccc(N)c1 Amb8825430 [1,1,0,0,0,0|2,0,0]=4 6372 B11R1.24 CCCOc1cccc(Br)c1 Amb33532692 [1,1,0,0,0,0|2,0,0]=4 6373 B11R1.24 CCCOc1cccc(C)c1 Amb10573406 [1,1,0,0,0,0|2,0,0]=4 6374 B11R1.24 CCCOc1cccc(Cl)c1 Amb25787001 [1,1,0,0,0,0|2,0,0]=4 6375 B11R1.24 CCCOc1cccc(F)c1 Amb25700428 [1,1,0,0,0,0|2,0,0]=4 6376 B11R1.24 CCCOc1cccc(I)c1 Amb27393748 [1,1,0,0,0,0|2,0,0]=4 6377 B11R1.24 CCCOc1cccc(N)c1 Amb1138945 [1,1,0,0,0,0|2,0,0]=4 6378 B11R1.24 CCCOc1cccc(O)c1 Amb8837439 [1,1,0,0,0,0|2,0,0]=4 6379 B11R1.24 CCCOc1cccc(S)c1 Amb26554006 [1,1,0,0,0,0|2,0,0]=4 6380 B11R1.24 CCCSc1cccc(Br)c1 Amb24538191 [1,1,0,0,0,0|2,0,0]=4 6381 B11R1.24 CCCSc1cccc(C)c1 Amb28315009 [1,1,0,0,0,0|2,0,0]=4 6382 B11R1.24 CCCSc1cccc(Cl)c1 Amb25801816 [1,1,0,0,0,0|2,0,0]=4 6383 B11R1.24 CCCSc1cccc(N)c1 Amb18289141 [1,1,0,0,0,0|2,0,0]=4 6384 B11R1.24 CCCSc1cccc(S)c1 Amb26337168 [1,1,0,0,0,0|2,0,0]=4 6385 B11R1.24 CCNCc1cccc(Br)c1 Amb13949217 [1,1,0,0,0,0|2,0,0]=4 6386 B11R1.24 CCNCc1cccc(Br)c1 Amb838402 [1,1,0,0,0,0|2,0,0]=4 6387 B11R1.24 CCNCc1cccc(C)c1 Amb6242953 [1,1,0,0,0,0|2,0,0]=4 6388 B11R1.24 CCNCc1cccc(Cl)c1 Amb29845814 [1,1,0,0,0,0|2,0,0]=4 6389 B11R1.24 CCNCc1cccc(Cl)c1 Amb6245035 [1,1,0,0,0,0|2,0,0]=4 6390 B11R1.24 CCNCc1cccc(F)c1 Amb435909 [1,1,0,0,0,0|2,0,0]=4 6391 B11R1.24 CCNCc1cccc(O)c1 Amb6260672 [1,1,0,0,0,0|2,0,0]=4 6392 B11R1.24 CCOCc1cccc(Br)c1 Amb23512545 [1,1,0,0,0,0|2,0,0]=4 6393 B11R1.24 CCOCc1cccc(Cl)c1 Amb24486866 [1,1,0,0,0,0|2,0,0]=4 6394 B11R1.24 CCOCc1cccc(N)c1 Amb6244214 [1,1,0,0,0,0|2,0,0]=4 6395 B11R1.24 CCOCc1cccc(O)c1 Amb23443319 [1,1,0,0,0,0|2,0,0]=4 6396 B11R1.24 CCSCc1cccc(Br)c1 Amb24476579 [1,1,0,0,0,0|2,0,0]=4 6397 B11R1.24 CCSCc1cccc(Cl)c1 Amb25891456 [1,1,0,0,0,0|2,0,0]=4 6398 B11R1.24 CCSCc1cccc(F)c1 Amb27406048 [1,1,0,0,0,0|2,0,0]=4 6399 B11R1.24 CCSCc1cccc(N)c1 Amb6680425 [1,1,0,0,0,0|2,0,0]=4 6400 B11R1.24 CNCCC1=CC=CC(=O)N1 Amb27847152 [1,1,0,0,0,0|1,0,0]=3 6401 B11R1.24 CNCCc1cc(C)ccn1 Amb18125194 [1,1,0,0,0,0|1,0,0]=3 6402 B11R1.24 CNCCc1cc(C)ncn1 Amb18224297 [1,1,0,0,0,0|2,0,0]=4 6403 B11R1.24 CNCCc1cc(Cl)ccn1 Amb25163179 [1,1,0,0,0,0|1,0,0]=3 6404 B11R1.24 CNCCc1cc(F)ccn1 Amb33415291 [1,1,0,0,0,0|1,0,0]=3 6405 B11R1.24 CNCCc1cc(O)ncn1 Amb18224341 [1,1,0,0,0,0|2,0,0]=4 6406 B11R1.24 CNCCc1cccc(Br)c1 Amb16230486 [1,1,0,0,0,0|0,0,0]=2 6407 B11R1.24 CNCCc1cccc(Br)c1 Amb28652826 [1,1,0,0,0,0|0,0,0]=2 6408 B11R1.24 CNCCc1cccc(Br)n1 Amb25324918 [1,1,0,0,0,0|1,0,0]=3 6409 B11R1.24 CNCCc1cccc(C)c1 Amb16230487 [1,1,0,0,0,0|0,0,0]=2 6410 B11R1.24 CNCCc1cccc(C)n1 Amb18125196 [1,1,0,0,0,0|1,0,0]=3 6411 B11R1.24 CNCCc1cccc(Cl)c1 Amb5785537 [1,1,0,0,0,0|0,0,0]=2 6412 B11R1.24 CNCCc1cccc(Cl)n1 Amb24679236 [1,1,0,0,0,0|1,0,0]=3 6413 B11R1.24 CNCCc1cccc(F)c1 Amb8841505 [1,1,0,0,0,0|0,0,0]=2 6414 B11R1.24 CNCCc1cccc(N)c1 Amb18550411 [1,1,0,0,0,0|0,0,0]=2 6415 B11R1.24 CNCCc1cccc(N)n1 Amb27778638 [1,1,0,0,0,0|1,0,0]=3 6416 B11R1.24 CNCCc1cccc(O)c1 Amb18560894 [1,1,0,0,0,0|0,0,0]=2 6417 B11R1.24 CNCCc1ccnc(C)c1 Amb33227097 [1,1,0,0,0,0|1,0,0]=3 6418 B11R1.24 CNCCc1ccnc(Cl)c1 Amb24407156 [1,1,0,0,0,0|1,0,0]=3 6419 B11R1.24 CNCCc1ccnc(N)c1 Amb27759957 [1,1,0,0,0,0|1,0,0]=3 6420 B11R1.24 CNCCc1cncc(Br)c1 Amb25149055 [1,1,0,0,0,0|1,0,0]=3 6421 B11R1.24 CNCCc1cncc(C)c1 Amb27176243 [1,1,0,0,0,0|1,0,0]=3 6422 B11R1.24 CNCCc1cncc(F)c1 Amb18993612 [1,1,0,0,0,0|1,0,0]=3 6423 B11R1.24 CNCCc1nccc(C)n1 Amb8010523 [1,1,0,0,0,0|2,0,0]=4 6424 B11R1.24 CNCCc1nccc(N)n1 Amb26333065 [1,1,0,0,0,0|2,0,0]=4 6425 B11R1.24 CNCCc1nccc(O)n1 Amb18862495 [1,1,0,0,0,0|2,0,0]=4 6426 B11R1.24 CNCCc1nccc(O)n1 Amb31157054 [1,1,0,0,0,0|2,0,0]=4 6427 B11R1.24 CNOCc1cccc(I)c1 Amb32412842 [1,1,0,0,0,0|1,0,0]=3 6428 B11R1.24 CN\C=N\c1cccc(C)c1 Amb27617263 [1,1,0,0,0,0|1,0,1]=4 6429 B11R1.24 CN\N=C\c1cccc(Cl)c1 Amb27261064 [1,1,0,0,0,0|1,0,1]=4 6430 B11R1.24 COCC[n+]1cccc(Br)c1 Amb28189045 [1,1,0,0,0,0|2,0,0]=4 6431 B11R1.24 COCCc1cccc(O)c1 Amb22055706 [1,1,0,0,0,0|1,0,0]=3 6432 B11R1.24 COCCc1ccnc(C)c1 Amb27606969 [1,1,0,0,0,0|2,0,0]=4 6433 B11R1.24 COCCc1ccnc(N)c1 Amb27665601 [1,1,0,0,0,0|2,0,0]=4 6434 B11R1.24 COCOc1cccc(Br)c1 Amb25810590 [1,1,0,0,0,0|2,0,0]=4 6435 B11R1.24 COCOc1cccc(C)c1 Amb27169027 [1,1,0,0,0,0|2,0,0]=4 6436 B11R1.24 COCOc1cccc(Cl)c1 Amb24551706 [1,1,0,0,0,0|2,0,0]=4 6437 B11R1.24 COCOc1cccc(F)c1 Amb21858121 [1,1,0,0,0,0|2,0,0]=4 6438 B11R1.24 COCOc1cccc(N)c1 Amb25096531 [1,1,0,0,0,0|2,0,0]=4 6439 B11R1.24 COCOc1cccc(O)c1 Amb26575320 [1,1,0,0,0,0|2,0,0]=4 6440 B11R1.24 COCSc1cccc(Br)c1 Amb27196993 [1,1,0,0,0,0|2,0,0]=4 6441 B11R1.24 CONCc1cccc(Cl)c1 Amb27251173 [1,1,0,0,0,0|2,0,0]=4 6442 B11R1.24 CONCc1cccc(F)c1 Amb26643051 [1,1,0,0,0,0|2,0,0]=4 6443 B11R1.24 CSCCC1=CC=CC(=O)N1 Amb28292737 [1,1,0,0,0,0|2,0,0]=4 6444 B11R1.24 CSCSc1cccc(C)c1 Amb27172833 [1,1,0,0,0,0|2,0,0]=4 6445 B11R1.24 CSCSc1cccc(O)c1 Amb28201670 [1,1,0,0,0,0|2,0,0]=4 6446 B11R1.24 Cc1cccc(CCC#N)c1 Amb17204296 [1,1,0,0,0,0|2,0,0]=4 6447 B11R1.24 Cc1cccc(CCC=O)c1 Amb6306216 [1,1,0,0,0,0|2,0,0]=4 6448 B11R1.24 Cc1cccc(CCCBr)c1 Amb17104553 [1,1,0,0,0,0|2,0,0]=4 6449 B11R1.24 Cc1cccc(CCCCl)c1 Amb17104526 [1,1,0,0,0,0|2,0,0]=4 6450 B11R1.24 Cc1cccc(CCCN)c1 Amb844760 [1,1,0,0,0,0|2,0,0]=4 6451 B11R1.24 Cc1cccc(CCCO)c1 Amb17089495 [1,1,0,0,0,0|2,0,0]=4 6452 B11R1.24 Cc1cccc(CCCS)c1 Amb17400219 [1,1,0,0,0,0|2,0,0]=4 6453 B11R1.24 Cc1cccc(CCNN)c1 Amb17399915 [1,1,0,0,0,0|1,0,0]=3 6454 B11R1.24 Cc1cccc(CCNN)n1 Amb27779952 [1,1,0,0,0,0|2,0,0]=4 6455 B11R1.24 Cc1cccc(CCON)c1 Amb25704227 [1,1,0,0,0,0|2,0,0]=4 6456 B11R1.24 Cc1cccc(CC[Zn]Br)c1 Amb6300300 [1,1,0,0,0,0|2,0,0]=4 6457 B11R1.24 ClCCCc1cccc(Br)c1 Amb17104548 [1,1,0,0,0,0|2,0,0]=4 6458 B11R1.24 ClCCCc1cccc(Cl)c1 Amb17104534 [1,1,0,0,0,0|2,0,0]=4 6459 B11R1.24 Clc1cccc(CCCBr)c1 Amb17104561 [1,1,0,0,0,0|2,0,0]=4 6460 B11R1.24 Fc1cccc(CCCBr)c1 Amb22886712 [1,1,0,0,0,0|2,0,0]=4 6461 B11R1.24 Fc1cccc(CCCCl)c1 Amb18803316 [1,1,0,0,0,0|2,0,0]=4 6462 B11R1.24 Fc1cccc(CCCS)c1 Amb18065480 [1,1,0,0,0,0|2,0,0]=4 6463 B11R1.24 N#CCCc1cccc(Br)c1 Amb2685459 [1,1,0,0,0,0|2,0,0]=4 6464 B11R1.24 N#CCCc1cccc(Cl)c1 Amb17204310 [1,1,0,0,0,0|2,0,0]=4 6465 B11R1.24 N#CCCc1cccc(F)c1 Amb10841716 [1,1,0,0,0,0|2,0,0]=4 6466 B11R1.24 N#CCCc1cccc(N)c1 Amb25929710 [1,1,0,0,0,0|2,0,0]=4 6467 B11R1.24 N#CCCc1cccc(O)c1 Amb2609108 [1,1,0,0,0,0|2,0,0]=4 6468 B11R1.24 NCCCc1cccc(Br)c1 Amb19373503 [1,1,0,0,0,0|2,0,0]=4 6469 B11R1.24 NCCCc1cccc(Br)c1 Amb9304906 [1,1,0,0,0,0|2,0,0]=4 6470 B11R1.24 NCCCc1cccc(Cl)c1 Amb13951536 [1,1,0,0,0,0|2,0,0]=4 6471 B11R1.24 NCCCc1cccc(Cl)c1 Amb5735480 [1,1,0,0,0,0|2,0,0]=4 6472 B11R1.24 NCCCc1cccc(F)c1 Amb13949159 [1,1,0,0,0,0|2,0,0]=4 6473 B11R1.24 NCCCc1cccc(F)c1 Amb9304903 [1,1,0,0,0,0|2,0,0]=4 6474 B11R1.24 NCCCc1cccc(I)c1 Amb26471163 [1,1,0,0,0,0|2,0,0]=4 6475 B11R1.24 NCCCc1cccc(N)c1 Amb17477694 [1,1,0,0,0,0|2,0,0]=4 6476 B11R1.24 NCCCc1cccc(O)c1 Amb17101314 [1,1,0,0,0,0|2,0,0]=4 6477 B11R1.24 NCCCc1cccc(O)c1 Amb33552047 [1,1,0,0,0,0|2,0,0]=4 6478 B11R1.24 NCCCc1cccc(O)c1 Amb33719034 [1,1,0,0,0,0|2,0,0]=4 6479 B11R1.24 NNCCc1cccc(Br)c1 Amb17404394 [1,1,0,0,0,0|1,0,0]=3 6480 B11R1.24 NNCCc1cccc(Cl)c1 Amb17400340 [1,1,0,0,0,0|1,0,0]=3 6481 B11R1.24 NNCCc1cccc(F)c1 Amb32661220 [1,1,0,0,0,0|1,0,0]=3 6482 B11R1.24 NNCCc1cccc(F)c1 Amb6250670 [1,1,0,0,0,0|1,0,0]=3 6483 B11R1.24 NNCCc1cncc(Br)c1 Amb28364146 [1,1,0,0,0,0|2,0,0]=4 6484 B11R1.24 NOCCc1cccc(Br)c1 Amb33450765 [1,1,0,0,0,0|2,0,0]=4 6485 B11R1.24 NOCCc1cccc(Cl)c1 Amb25152729 [1,1,0,0,0,0|2,0,0]=4 6486 B11R1.24 NOCCc1cccc(F)c1 Amb22896630 [1,1,0,0,0,0|2,0,0]=4 6487 B11R1.24 NOCCc1cccc(O)c1 Amb33310970 [1,1,0,0,0,0|2,0,0]=4 6488 B11R1.24 Nc1cccc(CCCBr)c1 Amb27475647 [1,1,0,0,0,0|2,0,0]=4 6489 B11R1.24 Nc1cccc(CCCCl)c1 Amb17477709 [1,1,0,0,0,0|2,0,0]=4 6490 B11R1.24 Nc1cccc(CCCO)c1 Amb17477701 [1,1,0,0,0,0|2,0,0]=4 6491 B11R1.24 Nc1cccc(CCCS)c1 Amb35672845 [1,1,0,0,0,0|2,0,0]=4 6492 B11R1.24 O=CCCc1cccc(Br)c1 Amb17081695 [1,1,0,0,0,0|2,0,0]=4 6493 B11R1.24 O=CCCc1cccc(Cl)c1 Amb6306213 [1,1,0,0,0,0|2,0,0]=4 6494 B11R1.24 O=CCCc1cccc(F)c1 Amb6306215 [1,1,0,0,0,0|2,0,0]=4 6495 B11R1.24 O=CCCc1cccc(I)c1 Amb24637998 [1,1,0,0,0,0|2,0,0]=4 6496 B11R1.24 O=CCCc1cccc(O)c1 Amb17081694 [1,1,0,0,0,0|2,0,0]=4 6497 B11R1.24 OCCCc1cccc(Br)c1 Amb17089515 [1,1,0,0,0,0|2,0,0]=4 6498 B11R1.24 OCCCc1cccc(Cl)c1 Amb17089500 [1,1,0,0,0,0|2,0,0]=4 6499 B11R1.24 OCCCc1cccc(F)c1 Amb17605781 [1,1,0,0,0,0|2,0,0]=4 6500 B11R1.24 OCCCc1cccc(O)c1 Amb17089514 [1,1,0,0,0,0|2,0,0]=4 6501 B11R1.24 Oc1cccc(CCCBr)c1 Amb18657769 [1,1,0,0,0,0|2,0,0]=4 6502 B11R1.24 Oc1cccc(CCCCl)c1 Amb17477723 [1,1,0,0,0,0|2,0,0]=4 6503 B11R1.24 Oc1cccc(CCCS)c1 Amb33310794 [1,1,0,0,0,0|2,0,0]=4 6504 B11R1.24 SCCCc1cccc(Br)c1 Amb17407561 [1,1,0,0,0,0|2,0,0]=4 6505 B11R1.24 SCCCc1cccc(Cl)c1 Amb17401096 [1,1,0,0,0,0|2,0,0]=4 6506 B11R1.24 Sc1cccc(CCCBr)c1 Amb27192455 [1,1,0,0,0,0|2,0,0]=4 6507 B11R1.24 Sc1cccc(CCCCl)c1 Amb28196581 [1,1,0,0,0,0|2,0,0]=4 6508 B11R1.24 [C-]#[N+]CCc1cccc(Br)c1 Amb2685408 [1,1,0,0,0,0|0,0,2]=4 6509 B11R1.24 [C-]#[N+]CCc1cccc(C)c1 Amb2689593 [1,1,0,0,0,0|0,0,2]=4 6510 B11R1.24 [C-]#[N+]CCc1cccc(Cl)c1 Amb2686345 [1,1,0,0,0,0|0,0,2]=4 6511 B11R1.24 [C-]#[N+]CCc1cccc(F)c1 Amb2688286 [1,1,0,0,0,0|0,0,2]=4 6512 B11R1.28 BrCCCCc1ccccc1 Amb2685395 [1,1,0,0,0,0|1,0,0]=3 6513 B11R1.28 BrCCCOc1ccccc1 Amb1154134 [1,1,0,0,0,0|2,0,0]=4 6514 B11R1.28 BrCCNCc1ccccc1 Amb18131678 [1,1,0,0,0,0|2,0,0]=4 6515 B11R1.28 BrCCOCc1ccccc1 Amb3941567 [1,1,0,0,0,0|2,0,0]=4 6516 B11R1.28 BrCCSCc1ccccc1 Amb9305028 [1,1,0,0,0,0|2,0,0]=4 6517 B11R1.28 Br[Mg]CCCc1ccccc1 Amb6300511 [1,1,0,0,0,0|2,0,0]=4 6518 B11R1.28 C#CCCCc1ccccc1 Amb10071067 [1,1,0,0,0,0|1,0,1]=4 6519 B11R1.28 C#CCCOc1ccccc1 Amb25885800 [1,1,0,0,0,0|1,0,1]=4 6520 B11R1.28 C#CCNCc1ccccc1 Amb21972217 [1,1,0,0,0,0|1,0,1]=4 6521 B11R1.28 C#CCNCc1ccccc1 Amb4303989 [1,1,0,0,0,0|1,0,1]=4 6522 B11R1.28 C#CCOCc1ccccc1 Amb8517297 [1,1,0,0,0,0|1,0,1]=4 6523 B11R1.28 C=CCCNc1ccccc1 Amb27495374 [1,1,0,0,0,0|1,0,1]=4 6524 B11R1.28 C=CCCOc1ccccc1 Amb27271699 [1,1,0,0,0,0|1,0,1]=4 6525 B11R1.28 C=CCCSc1ccccc1 Amb27270191 [1,1,0,0,0,0|1,0,1]=4 6526 B11R1.28 C=CCNCc1ccccc1 Amb6683954 [1,1,0,0,0,0|1,0,1]=4 6527 B11R1.28 C=CCNCc1ccccc1 Amb6864764 [1,1,0,0,0,0|1,0,1]=4 6528 B11R1.28 C=CCOCc1ccccc1 Amb17933917 [1,1,0,0,0,0|1,0,1]=4 6529 B11R1.28 C=CNOCc1ccccc1 Amb27791078 [1,1,0,0,0,0|1,0,1]=4 6530 B11R1.28 CC#CCOc1ccccc1 Amb25119404 [1,1,0,0,0,0|1,0,1]=4 6531 B11R1.28 CCCC#Cc1ccccc1 Amb2721608 [1,1,0,0,0,0|1,0,1]=4 6532 B11R1.28 CCCCC[n+]1ccccc1 Amb24754723 [1,1,0,0,0,0|2,0,0]=4 6533 B11R1.28 CCCCCc1ccccc1 Amb2722921 [1,1,0,0,0,0|1,0,0]=3 6534 B11R1.28 CCCCCc1ccccn1 Amb533507 [1,1,0,0,0,0|2,0,0]=4 6535 B11R1.28 CCCCCc1cccnc1 Amb17672949 [1,1,0,0,0,0|2,0,0]=4 6536 B11R1.28 CCCCCc1ccncc1 Amb17672950 [1,1,0,0,0,0|2,0,0]=4 6537 B11R1.28 CCCCNc1ccccc1 Amb3940154 [1,1,0,0,0,0|1,0,0]=3 6538 B11R1.28 CCCCNc1ccccn1 Amb6633041 [1,1,0,0,0,0|2,0,0]=4 6539 B11R1.28 CCCCNc1cccnc1 Amb6686633 [1,1,0,0,0,0|2,0,0]=4 6540 B11R1.28 CCCCNc1ccncc1 Amb6648934 [1,1,0,0,0,0|2,0,0]=4 6541 B11R1.28 CCCCOc1ccccc1 Amb2685665 [1,1,0,0,0,0|1,0,0]=3 6542 B11R1.28 CCCCOc1ccccn1 Amb4034584 [1,1,0,0,0,0|2,0,0]=4 6543 B11R1.28 CCCCOc1cccnc1 Amb25382997 [1,1,0,0,0,0|2,0,0]=4 6544 B11R1.28 CCCCSc1ccccc1 Amb3836105 [1,1,0,0,0,0|1,0,0]=3 6545 B11R1.28 CCCNCc1ccccc1 Amb1105937 [1,1,0,0,0,0|1,0,0]=3 6546 B11R1.28 CCCNCc1ccccc1 Amb6537999 [1,1,0,0,0,0|1,0,0]=3 6547 B11R1.28 CCCNCc1ccccn1 Amb19890306 [1,1,0,0,0,0|2,0,0]=4 6548 B11R1.28 CCCNCc1ccccn1 Amb19890563 [1,1,0,0,0,0|2,0,0]=4 6549 B11R1.28 CCCNCc1ccccn1 Amb2592504 [1,1,0,0,0,0|2,0,0]=4 6550 B11R1.28 CCCNCc1cccnc1 Amb19890575 [1,1,0,0,0,0|2,0,0]=4 6551 B11R1.28 CCCNCc1cccnc1 Amb6864723 [1,1,0,0,0,0|2,0,0]=4 6552 B11R1.28 CCCNCc1cccnc1 Amb838293 [1,1,0,0,0,0|2,0,0]=4 6553 B11R1.28 CCCNCc1ccncc1 Amb19890591 [1,1,0,0,0,0|2,0,0]=4 6554 B11R1.28 CCCNCc1ccncc1 Amb6864722 [1,1,0,0,0,0|2,0,0]=4 6555 B11R1.28 CCCNCc1ccncc1 Amb837657 [1,1,0,0,0,0|2,0,0]=4 6556 B11R1.28 CCCSCc1ccccc1 Amb27000631 [1,1,0,0,0,0|1,0,0]=3 6557 B11R1.28 CCC\C=C\c1ccccc1 Amb4017967 [1,1,0,0,0,0|1,0,1]=4 6558 B11R1.28 CCC\C=N\c1ccccc1 Amb16231172 [1,1,0,0,0,0|1,0,1]=4 6559 B11R1.28 CCC\N=C\c1ccccc1 Amb4605889 [1,1,0,0,0,0|1,0,1]=4 6560 B11R1.28 CCNCCc1ccccc1 Amb33551205 [1,1,0,0,0,0|0,0,0]=2 6561 B11R1.28 CCNCCc1ccccc1 Amb6244873 [1,1,0,0,0,0|0,0,0]=2 6562 B11R1.28 CCNCCc1ccccn1 Amb33527538 [1,1,0,0,0,0|1,0,0]=3 6563 B11R1.28 CCNCCc1ccncc1 Amb2592520 [1,1,0,0,0,0|1,0,0]=3 6564 B11R1.28 CCNCCc1ccncn1 Amb27670958 [1,1,0,0,0,0|2,0,0]=4 6565 B11R1.28 CCNCCc1ncccn1 Amb19028710 [1,1,0,0,0,0|2,0,0]=4 6566 B11R1.28 CCNOCc1ccccc1 Amb25923077 [1,1,0,0,0,0|1,0,0]=3 6567 B11R1.28 CCOCCc1ccccc1 Amb4035236 [1,1,0,0,0,0|1,0,0]=3 6568 B11R1.28 CCOCCc1ccccn1 Amb2722907 [1,1,0,0,0,0|2,0,0]=4 6569 B11R1.28 CCOCOc1ccccc1 Amb28388170 [1,1,0,0,0,0|2,0,0]=4 6570 B11R1.28 CCONCc1ccccc1 Amb25151184 [1,1,0,0,0,0|2,0,0]=4 6571 B11R1.28 CCSCCc1ccccn1 Amb27988878 [1,1,0,0,0,0|2,0,0]=4 6572 B11R1.28 CCSCCc1cccnc1 Amb27988879 [1,1,0,0,0,0|2,0,0]=4 6573 B11R1.28 CCSCCc1ccncc1 Amb27988880 [1,1,0,0,0,0|2,0,0]=4 6574 B11R1.28 CNCC#Cc1ccccn1 Amb27761723 [1,1,0,0,0,0|1,0,1]=4 6575 B11R1.28 CNCCCc1ccccc1 Amb21954280 [1,1,0,0,0,0|0,0,0]=2 6576 B11R1.28 CNCCCc1ccccc1 Amb2721795 [1,1,0,0,0,0|0,0,0]=2 6577 B11R1.28 CNCCCc1ccccn1 Amb18312462 [1,1,0,0,0,0|1,0,0]=3 6578 B11R1.28 CNCCNc1ccccc1 Amb6825621 [1,1,0,0,0,0|0,0,0]=2 6579 B11R1.28 CNCCNc1ccccn1 Amb18313466 [1,1,0,0,0,0|1,0,0]=3 6580 B11R1.28 CNCCNc1ccccn1 Amb32757639 [1,1,0,0,0,0|1,0,0]=3 6581 B11R1.28 CNCCOc1ccccc1 Amb1105525 [1,1,0,0,0,0|0,0,0]=2 6582 B11R1.28 CNCCOc1ccccc1 Amb2691365 [1,1,0,0,0,0|0,0,0]=2 6583 B11R1.28 CNCCSc1ccccc1 Amb10608735 [1,1,0,0,0,0|0,0,0]=2 6584 B11R1.28 CNCCSc1ccccc1 Amb17622507 [1,1,0,0,0,0|0,0,0]=2 6585 B11R1.28 CNCCSc1ccccn1 Amb19024669 [1,1,0,0,0,0|1,0,0]=3 6586 B11R1.28 CNCCSc1ccccn1 Amb32662293 [1,1,0,0,0,0|1,0,0]=3 6587 B11R1.28 CNCCSc1ccncc1 Amb27671140 [1,1,0,0,0,0|1,0,0]=3 6588 B11R1.28 CNCCSc1cnccn1 Amb27269175 [1,1,0,0,0,0|2,0,0]=4 6589 B11R1.28 CNCCSc1ncccn1 Amb18312269 [1,1,0,0,0,0|2,0,0]=4 6590 B11R1.28 CNCCSc1ncccn1 Amb32662274 [1,1,0,0,0,0|2,0,0]=4 6591 B11R1.28 CNC\C=C/c1cccnc1 Amb28423371 [1,1,0,0,0,0|1,0,1]=4 6592 B11R1.28 CNC\C=C\c1ccccc1 Amb2114273 [1,1,0,0,0,0|0,0,1]=3 6593 B11R1.28 CNC\C=C\c1ccccn1 Amb26859034 [1,1,0,0,0,0|1,0,1]=4 6594 B11R1.28 CNC\C=C\c1cccnc1 Amb23442752 [1,1,0,0,0,0|1,0,1]=4 6595 B11R1.28 CNC\C=C\c1ccncc1 Amb26859033 [1,1,0,0,0,0|1,0,1]=4 6596 B11R1.28 COCC#Cc1ccccc1 Amb25308232 [1,1,0,0,0,0|1,0,1]=4 6597 B11R1.28 COCCNc1ccccc1 Amb596066 [1,1,0,0,0,0|1,0,0]=3 6598 B11R1.28 COCCNc1cccnc1 Amb18268638 [1,1,0,0,0,0|2,0,0]=4 6599 B11R1.28 COCCNc1ccncc1 Amb6632784 [1,1,0,0,0,0|2,0,0]=4 6600 B11R1.28 COCCOc1ccccc1 Amb4018811 [1,1,0,0,0,0|1,0,0]=3 6601 B11R1.28 COCCSc1ccccn1 Amb17760116 [1,1,0,0,0,0|2,0,0]=4 6602 B11R1.28 COCNCc1ccccc1 Amb25053350 [1,1,0,0,0,0|1,0,0]=3 6603 B11R1.28 CONCCc1cccnc1 Amb27987592 [1,1,0,0,0,0|1,0,0]=3 6604 B11R1.28 CONCCc1ccncc1 Amb27987581 [1,1,0,0,0,0|1,0,0]=3 6605 B11R1.28 CSCCCc1ccccc1 Amb25383748 [1,1,0,0,0,0|1,0,0]=3 6606 B11R1.28 CSCCNc1ccccc1 Amb17307504 [1,1,0,0,0,0|1,0,0]=3 6607 B11R1.28 CSCCOc1ccccc1 Amb4020915 [1,1,0,0,0,0|1,0,0]=3 6608 B11R1.28 CSCCOc1ccccn1 Amb27988044 [1,1,0,0,0,0|2,0,0]=4 6609 B11R1.28 CSCCOc1cccnc1 Amb27492324 [1,1,0,0,0,0|2,0,0]=4 6610 B11R1.28 CSCCOc1ccncc1 Amb28387285 [1,1,0,0,0,0|2,0,0]=4 6611 B11R1.28 CSCCSc1ccccn1 Amb27988049 [1,1,0,0,0,0|2,0,0]=4 6612 B11R1.28 CSCCSc1ccncc1 Amb27988052 [1,1,0,0,0,0|2,0,0]=4 6613 B11R1.28 CSCNCc1ccccc1 Amb26414504 [1,1,0,0,0,0|1,0,0]=3 6614 B11R1.28 CSC\C=C\c1ccccc1 Amb27261145 [1,1,0,0,0,0|1,0,1]=4 6615 B11R1.28 C\C=C\CCc1ccccc1 Amb17940149 [1,1,0,0,0,0|1,0,0]=3 6616 B11R1.28 C\C=C\CCc1ccncc1 Amb25830692 [1,1,0,0,0,0|2,0,0]=4 6617 B11R1.28 C\C=C\CNc1ccccc1 Amb4016349 [1,1,0,0,0,0|1,0,1]=4 6618 B11R1.28 C\C=C\COc1ccccc1 Amb4036065 [1,1,0,0,0,0|1,0,1]=4 6619 B11R1.28 ClCC#CCc1ccccc1 Amb24453719 [1,1,0,0,0,0|1,0,1]=4 6620 B11R1.28 ClCCCCc1ccccc1 Amb3940707 [1,1,0,0,0,0|1,0,0]=3 6621 B11R1.28 ClCCCCc1ccncc1 Amb20622009 [1,1,0,0,0,0|2,0,0]=4 6622 B11R1.28 ClCCCOc1ccccc1 Amb1128627 [1,1,0,0,0,0|2,0,0]=4 6623 B11R1.28 ClCCCSc1ccccc1 Amb1132759 [1,1,0,0,0,0|2,0,0]=4 6624 B11R1.28 ClCCNCc1ccccc1 Amb2880633 [1,1,0,0,0,0|2,0,0]=4 6625 B11R1.28 ClCCNCc1ccccc1 Amb4323279 [1,1,0,0,0,0|2,0,0]=4 6626 B11R1.28 ClCCOCc1ccccc1 Amb8391048 [1,1,0,0,0,0|2,0,0]=4 6627 B11R1.28 ClCCSCc1ccccc1 Amb9270911 [1,1,0,0,0,0|2,0,0]=4 6628 B11R1.28 ClC\C=N\Cc1ccccc1 Amb26887419 [1,1,0,0,0,0|2,0,0]=4 6629 B11R1.28 Cl\C=C\CCc1ccccc1 Amb8392473 [1,1,0,0,0,0|1,0,1]=4 6630 B11R1.28 FCCNCc1ccccc1 Amb24611358 [1,1,0,0,0,0|2,0,0]=4 6631 B11R1.28 FCCSCc1ccccc1 Amb27271863 [1,1,0,0,0,0|2,0,0]=4 6632 B11R1.28 ICCCCc1ccccc1 Amb25380384 [1,1,0,0,0,0|1,0,0]=3 6633 B11R1.28 ICCCOc1ccccc1 Amb27271705 [1,1,0,0,0,0|2,0,0]=4 6634 B11R1.28 ICCOCc1ccccc1 Amb16191915 [1,1,0,0,0,0|2,0,0]=4 6635 B11R1.28 IC\C=C\Cc1ccccc1 Amb28428997 [1,1,0,0,0,0|1,0,1]=4 6636 B11R1.28 N#CCCCc1ccccc1 Amb6251750 [1,1,0,0,0,0|1,0,1]=4 6637 B11R1.28 N#CCCNc1ccccc1 Amb1645915 [1,1,0,0,0,0|2,0,0]=4 6638 B11R1.28 N#CCCOc1ccccc1 Amb1202508 [1,1,0,0,0,0|2,0,0]=4 6639 B11R1.28 N#CCCSc1ccccc1 Amb4018040 [1,1,0,0,0,0|2,0,0]=4 6640 B11R1.28 N#CCNCc1ccccc1 Amb4477202 [1,1,0,0,0,0|2,0,0]=4 6641 B11R1.28 N#CCOCc1ccccc1 Amb4011553 [1,1,0,0,0,0|2,0,0]=4 6642 B11R1.28 N#CCSCc1ccccc1 Amb6677693 [1,1,0,0,0,0|2,0,0]=4 6643 B11R1.28 N#CC[NH2+]Cc1ccccc1 Amb24113886 [1,1,0,0,0,0|2,0,0]=4 6644 B11R1.28 N#CNCCc1ccccc1 Amb27763256 [1,1,0,0,0,0|0,0,1]=3 6645 B11R1.28 N#CNOCc1ccccc1 Amb27245690 [1,1,0,0,0,0|1,0,1]=4 6646 B11R1.28 NCCCCc1ccccc1 Amb1227740 [1,1,0,0,0,0|1,0,0]=3 6647 B11R1.28 NCCCCc1ccccn1 Amb1102767 [1,1,0,0,0,0|2,0,0]=4 6648 B11R1.28 NCCCCc1cccnc1 Amb5735490 [1,1,0,0,0,0|2,0,0]=4 6649 B11R1.28 NCCCCc1ccncc1 Amb17991253 [1,1,0,0,0,0|2,0,0]=4 6650 B11R1.28 NCCCCc1ccncc1 Amb5735491 [1,1,0,0,0,0|2,0,0]=4 6651 B11R1.28 NCCCNc1ccccc1 Amb10086594 [1,1,0,0,0,0|2,0,0]=4 6652 B11R1.28 NCCCOc1ccccc1 Amb1108619 [1,1,0,0,0,0|2,0,0]=4 6653 B11R1.28 NCCCOc1ccccc1 Amb2606353 [1,1,0,0,0,0|2,0,0]=4 6654 B11R1.28 NCCCSc1ccccc1 Amb1089343 [1,1,0,0,0,0|2,0,0]=4 6655 B11R1.28 NCCCSc1ccccc1 Amb2099802 [1,1,0,0,0,0|2,0,0]=4 6656 B11R1.28 NCCNCc1ccccc1 Amb2725583 [1,1,0,0,0,0|2,0,0]=4 6657 B11R1.28 NCCOCc1ccccc1 Amb1081962 [1,1,0,0,0,0|2,0,0]=4 6658 B11R1.28 NCCOCc1ccccc1 Amb2137059 [1,1,0,0,0,0|2,0,0]=4 6659 B11R1.28 NCCOCc1ccccc1 Amb28524733 [1,1,0,0,0,0|2,0,0]=4 6660 B11R1.28 NCCPCc1ccccc1 Amb27990149 [1,1,0,0,0,0|2,0,0]=4 6661 B11R1.28 NCCSCc1ccccc1 Amb432271 [1,1,0,0,0,0|2,0,0]=4 6662 B11R1.28 NCCSCc1ccccc1 Amb6335199 [1,1,0,0,0,0|2,0,0]=4 6663 B11R1.28 NC\C=C\Cc1ccccc1 Amb32951245 [1,1,0,0,0,0|1,0,1]=4 6664 B11R1.28 NNCC#Cc1ccccc1 Amb27409247 [1,1,0,0,0,0|1,0,1]=4 6665 B11R1.28 NNCCCc1ccccc1 Amb19373221 [1,1,0,0,0,0|1,0,0]=3 6666 B11R1.28 NNCCCc1ccccc1 Amb6252219 [1,1,0,0,0,0|1,0,0]=3 6667 B11R1.28 NNCCCc1ccccn1 Amb27671029 [1,1,0,0,0,0|2,0,0]=4 6668 B11R1.28 NNCCCc1cccnc1 Amb18125323 [1,1,0,0,0,0|2,0,0]=4 6669 B11R1.28 NNCCCc1ccncc1 Amb27671030 [1,1,0,0,0,0|2,0,0]=4 6670 B11R1.28 NNCCNc1ccccc1 Amb28365488 [1,1,0,0,0,0|1,0,0]=3 6671 B11R1.28 NNCCOc1ccccc1 Amb2792851 [1,1,0,0,0,0|1,0,0]=3 6672 B11R1.28 NNCCOc1ccccc1 Amb33624872 [1,1,0,0,0,0|1,0,0]=3 6673 B11R1.28 NNCCOc1ccccc1 Amb9677389 [1,1,0,0,0,0|1,0,0]=3 6674 B11R1.28 NNC\C=C\c1ccccc1 Amb33456723 [1,1,0,0,0,0|1,0,1]=4 6675 B11R1.28 NOCCCc1ccccc1 Amb2610651 [1,1,0,0,0,0|2,0,0]=4 6676 B11R1.28 NOCCOc1ccccc1 Amb17088287 [1,1,0,0,0,0|2,0,0]=4 6677 B11R1.28 NOCCOc1ccccc1 Amb19894640 [1,1,0,0,0,0|2,0,0]=4 6678 B11R1.28 NOCOCc1ccccc1 Amb10606697 [1,1,0,0,0,0|2,0,0]=4 6679 B11R1.28 N\N=C\CCc1ccccc1 Amb27649733 [1,1,0,0,0,0|1,0,1]=4 6680 B11R1.28 O=C=NCCc1ccccc1 Amb2092802 [1,1,0,0,0,0|0,0,2]=4 6681 B11R1.28 O=CCCCc1ccccc1 Amb6306225 [1,1,0,0,0,0|1,0,1]=4 6682 B11R1.28 O=CCCOc1ccccc1 Amb5731758 [1,1,0,0,0,0|2,0,0]=4 6683 B11R1.28 O=CCCSc1ccccc1 Amb17082943 [1,1,0,0,0,0|2,0,0]=4 6684 B11R1.28 O=CCNCc1ccccc1 Amb19886524 [1,1,0,0,0,0|2,0,0]=4 6685 B11R1.28 O=CCOCc1ccccc1 Amb3939958 [1,1,0,0,0,0|2,0,0]=4 6686 B11R1.28 O=CCSCc1ccccc1 Amb18801121 [1,1,0,0,0,0|2,0,0]=4 6687 B11R1.28 O=CNOCc1ccccc1 Amb27805476 [1,1,0,0,0,0|1,0,1]=4 6688 B11R1.28 O=COCCc1ccccc1 Amb6357955 [1,1,0,0,0,0|1,0,1]=4 6689 B11R1.28 OCCCCc1ccccc1 Amb3939083 [1,1,0,0,0,0|1,0,0]=3 6690 B11R1.28 OCCCCc1ccccn1 Amb21520414 [1,1,0,0,0,0|2,0,0]=4 6691 B11R1.28 OCCCCc1cccnc1 Amb22732495 [1,1,0,0,0,0|2,0,0]=4 6692 B11R1.28 OCCCCc1ccncc1 Amb17740015 [1,1,0,0,0,0|2,0,0]=4 6693 B11R1.28 OCCCNc1ccccc1 Amb17307125 [1,1,0,0,0,0|2,0,0]=4 6694 B11R1.28 OCCCOc1ccccc1 Amb4476987 [1,1,0,0,0,0|2,0,0]=4 6695 B11R1.28 OCCCSc1ccccc1 Amb4018847 [1,1,0,0,0,0|2,0,0]=4 6696 B11R1.28 OCCC[SiH2]c1ccccc1 Amb27989504 [1,1,0,0,0,0|1,1,0]=4 6697 B11R1.28 OCCNCc1ccccc1 Amb1835287 [1,1,0,0,0,0|2,0,0]=4 6698 B11R1.28 OCCNCc1ccccc1 Amb6537902 [1,1,0,0,0,0|2,0,0]=4 6699 B11R1.28 OCCOCc1ccccc1 Amb3939139 [1,1,0,0,0,0|2,0,0]=4 6700 B11R1.28 OCCSCc1ccccc1 Amb2688740 [1,1,0,0,0,0|2,0,0]=4 6701 B11R1.28 OC\C=C\Cc1ccccc1 Amb32951814 [1,1,0,0,0,0|1,0,1]=4 6702 B11R1.28 ONCCCc1ccccc1 Amb26650950 [1,1,0,0,0,0|1,0,0]=3 6703 B11R1.28 ONCCOc1ccccc1 Amb17088413 [1,1,0,0,0,0|1,0,0]=3 6704 B11R1.28 ONC\C=C\c1ccccc1 Amb33081057 [1,1,0,0,0,0|1,0,1]=4 6705 B11R1.28 S=C=NCCc1ccccc1 Amb6316073 [1,1,0,0,0,0|0,0,2]=4 6706 B11R1.28 SCCCCc1ccccc1 Amb17400224 [1,1,0,0,0,0|1,0,0]=3 6707 B11R1.28 SCCCCc1ccccn1 Amb18563822 [1,1,0,0,0,0|2,0,0]=4 6708 B11R1.28 SCCCCc1cccnc1 Amb18563823 [1,1,0,0,0,0|2,0,0]=4 6709 B11R1.28 SCCCCc1ccncc1 Amb18065469 [1,1,0,0,0,0|2,0,0]=4 6710 B11R1.28 SCCCOc1ccccc1 Amb6255479 [1,1,0,0,0,0|2,0,0]=4 6711 B11R1.28 SCCNCc1ccccc1 Amb4405222 [1,1,0,0,0,0|2,0,0]=4 6712 B11R1.28 SCCOCc1ccccc1 Amb27457406 [1,1,0,0,0,0|2,0,0]=4 6713 B11R1.28 [C-]#[N+]CCCc1ccccc1 Amb2690315 [1,1,0,0,0,0|0,0,2]=4 6714 B11R1.28 [C-]#[N+]CCOc1ccccc1 Amb27428630 [1,1,0,0,0,0|0,0,2]=4 6715 B11R1.28 [N-]=[N+]=NCCc1ccccc1 Amb19149244 [1,1,0,0,0,0|1,0,1]=4 6716 B11R1.40 C#CC(C)Cc1ccccc1 Amb32953156 [1,1,0,0,0,0|1,0,1]=4 6717 B11R1.40 C#CC(O)Cc1ccccc1 Amb8392589 [1,1,0,0,0,0|1,0,1]=4 6718 B11R1.40 C#C[C@H](N)Cc1ccccc1 Amb27468328 [1,1,0,0,0,0|1,0,1]=4 6719 B11R1.40 C=CC(Br)Cc1ccccc1 Amb27176324 [1,1,0,0,0,0|1,0,1]=4 6720 B11R1.40 C=CC(C)Cc1ccccc1 Amb25850978 [1,1,0,0,0,0|1,0,1]=4 6721 B11R1.40 C=CC(Cl)Cc1ccccc1 Amb28056812 [1,1,0,0,0,0|1,0,1]=4 6722 B11R1.40 C=CC(O)Cc1ccccc1 Amb24664362 [1,1,0,0,0,0|1,0,1]=4 6723 B11R1.40 C=C[C@@H](N)Cc1ccccc1 Amb10982592 [1,1,0,0,0,0|1,0,1]=4 6724 B11R1.40 CC(C#N)Cc1ccccc1 Amb24402121 [1,1,0,0,0,0|2,0,0]=4 6725 B11R1.40 CC(C=O)Cc1ccccc1 Amb4035446 [1,1,0,0,0,0|2,0,0]=4 6726 B11R1.40 CC(CBr)Cc1ccccc1 Amb25151397 [1,1,0,0,0,0|2,0,0]=4 6727 B11R1.40 CC(CCl)Cc1ccccc1 Amb17477588 [1,1,0,0,0,0|2,0,0]=4 6728 B11R1.40 CC(CN)Cc1ccccc1 Amb18010535 [1,1,0,0,0,0|2,0,0]=4 6729 B11R1.40 CC(CN)Cc1ccccc1 Amb5743836 [1,1,0,0,0,0|2,0,0]=4 6730 B11R1.40 CC(CO)Cc1ccccc1 Amb17477578 [1,1,0,0,0,0|2,0,0]=4 6731 B11R1.40 CC(Cc1ccccc1)NN Amb31156530 [1,1,0,0,0,0|1,0,0]=3 6732 B11R1.40 CC(Cc1ccccc1)NN Amb4136392 [1,1,0,0,0,0|1,0,0]=3 6733 B11R1.40 CC(Cc1ccccc1)ON Amb32952996 [1,1,0,0,0,0|2,0,0]=4 6734 B11R1.40 CC(Cc1ccccn1)NN Amb27976484 [1,1,0,0,0,0|2,0,0]=4 6735 B11R1.40 CC(Cc1ccncc1)NN Amb27493950 [1,1,0,0,0,0|2,0,0]=4 6736 B11R1.40 CCC(=O)Cc1ccccc1 Amb4605994 [1,1,0,0,0,0|1,0,1]=4 6737 B11R1.40 CCC(Br)Cc1ccccc1 Amb25189250 [1,1,0,0,0,0|1,0,0]=3 6738 B11R1.40 CCC(Br)Cc1ccccn1 Amb28285520 [1,1,0,0,0,0|2,0,0]=4 6739 B11R1.40 CCC(Br)Cc1ccncc1 Amb24353281 [1,1,0,0,0,0|2,0,0]=4 6740 B11R1.40 CCC(Br)Cc1ccncc1 Amb32758727 [1,1,0,0,0,0|2,0,0]=4 6741 B11R1.40 CCC(C)Nc1ccccc1 Amb4017601 [1,1,0,0,0,0|2,0,0]=4 6742 B11R1.40 CCC(C)Oc1ccccc1 Amb24350256 [1,1,0,0,0,0|2,0,0]=4 6743 B11R1.40 CCC(C)Sc1ccccc1 Amb25698974 [1,1,0,0,0,0|2,0,0]=4 6744 B11R1.40 CCC(Cl)Cc1ccccc1 Amb18177890 [1,1,0,0,0,0|1,0,0]=3 6745 B11R1.40 CCC(Cl)Cc1ccncc1 Amb17477712 [1,1,0,0,0,0|2,0,0]=4 6746 B11R1.40 CCC(N)Cc1ccccc1 Amb9428866 [1,1,0,0,0,0|1,0,0]=3 6747 B11R1.40 CCC(N)Cc1ccccn1 Amb7772139 [1,1,0,0,0,0|2,0,0]=4 6748 B11R1.40 CCC(N)Cc1cccnc1 Amb9428899 [1,1,0,0,0,0|2,0,0]=4 6749 B11R1.40 CCC(N)Cc1ccncc1 Amb9428894 [1,1,0,0,0,0|2,0,0]=4 6750 B11R1.40 CCC(O)Cc1ccccc1 Amb4035173 [1,1,0,0,0,0|1,0,0]=3 6751 B11R1.40 CCC(O)Cc1ccccn1 Amb17477703 [1,1,0,0,0,0|2,0,0]=4 6752 B11R1.40 CCC(O)Cc1ccncc1 Amb17477704 [1,1,0,0,0,0|2,0,0]=4 6753 B11R1.40 CCC(S)Cc1ccccc1 Amb26868958 [1,1,0,0,0,0|1,0,0]=3 6754 B11R1.40 CCN(N)Cc1ccccc1 Amb17232076 [1,1,0,0,0,0|2,0,0]=4 6755 B11R1.40 CC[C@@H](N)Cc1ccccc1 Amb25141525 [1,1,0,0,0,0|1,0,0]=3 6756 B11R1.40 CC[C@@H](N)Cc1ccccn1 Amb27471046 [1,1,0,0,0,0|2,0,0]=4 6757 B11R1.40 CC[C@@H](N)Cc1ccncc1 Amb27945734 [1,1,0,0,0,0|2,0,0]=4 6758 B11R1.40 CC[C@@H](O)Cc1ccccc1 Amb19375372 [1,1,0,0,0,0|1,0,0]=3 6759 B11R1.40 CC[C@H](C)Cc1ccccc1 Amb25892475 [1,1,0,0,0,0|1,0,0]=3 6760 B11R1.40 CC[C@H](N)Cc1ccccc1 Amb19929690 [1,1,0,0,0,0|1,0,0]=3 6761 B11R1.40 CC[C@H](O)Cc1ccccc1 Amb27803759 [1,1,0,0,0,0|1,0,0]=3 6762 B11R1.40 CNC(=N)Nc1ccccc1 Amb27656297 [1,1,0,0,0,0|1,0,1]=4 6763 B11R1.40 CNC(=O)C[n+]1ccccc1 Amb10553027 [1,1,0,0,0,0|1,0,1]=4 6764 B11R1.40 CNC(=O)Cc1ccccc1 Amb3099550 [1,1,0,0,0,0|0,0,1]=3 6765 B11R1.40 CNC(=O)Cc1ccccn1 Amb28365941 [1,1,0,0,0,0|1,0,1]=4 6766 B11R1.40 CNC(=O)Cc1cccnc1 Amb16231203 [1,1,0,0,0,0|1,0,1]=4 6767 B11R1.40 CNC(=O)Cc1ccncc1 Amb16231202 [1,1,0,0,0,0|1,0,1]=4 6768 B11R1.40 CNC(=O)Oc1ccccc1 Amb27212784 [1,1,0,0,0,0|1,0,1]=4 6769 B11R1.40 CNC(=O)Sc1ccccc1 Amb4407856 [1,1,0,0,0,0|1,0,1]=4 6770 B11R1.40 CNC(=S)Cc1ccncc1 Amb28119234 [1,1,0,0,0,0|1,0,1]=4 6771 B11R1.40 CNC(=S)Nc1ccccc1 Amb6335232 [1,1,0,0,0,0|1,0,1]=4 6772 B11R1.40 CNC(=S)Oc1ccccc1 Amb28208369 [1,1,0,0,0,0|1,0,1]=4 6773 B11R1.40 CNC(C)Cc1ccccc1 Amb5735450 [1,1,0,0,0,0|0,0,0]=2 6774 B11R1.40 CNC(C)Cc1ccccn1 Amb1995150 [1,1,0,0,0,0|1,0,0]=3 6775 B11R1.40 CNC(C)Cc1cccnc1 Amb5735448 [1,1,0,0,0,0|1,0,0]=3 6776 B11R1.40 CNC(C)Cc1ccncc1 Amb5735449 [1,1,0,0,0,0|1,0,0]=3 6777 B11R1.40 CNC(C)Cc1cnccn1 Amb1995173 [1,1,0,0,0,0|2,0,0]=4 6778 B11R1.40 CNC(O)Cc1ccccc1 Amb34915471 [1,1,0,0,0,0|0,0,0]=2 6779 B11R1.40 CN[C@@H](C)Cc1ccccc1 Amb3939875 [1,1,0,0,0,0|0,0,0]=2 6780 B11R1.40 CN[C@H](C)Cc1ccccc1 Amb8389889 [1,1,0,0,0,0|0,0,0]=2 6781 B11R1.40 CN\C(C)=C\c1ccccc1 Amb32758729 [1,1,0,0,0,0|0,0,2]=4 6782 B11R1.40 COC(=N)Cc1ccccc1 Amb17673180 [1,1,0,0,0,0|1,0,1]=4 6783 B11R1.40 COC(=N)Cc1ccccc1 Amb22366095 [1,1,0,0,0,0|1,0,1]=4 6784 B11R1.40 COC(=O)Cc1ccccc1 Amb6608802 [1,1,0,0,0,0|1,0,1]=4 6785 B11R1.40 C[C@@H](CBr)Cc1ccccc1 Amb27839684 [1,1,0,0,0,0|2,0,0]=4 6786 B11R1.40 C[C@@H](CCl)Cc1ccccc1 Amb28060129 [1,1,0,0,0,0|2,0,0]=4 6787 B11R1.40 C[C@@H](CN)Cc1ccccc1 Amb24615612 [1,1,0,0,0,0|2,0,0]=4 6788 B11R1.40 C[C@@H](CO)Cc1ccccc1 Amb26017714 [1,1,0,0,0,0|2,0,0]=4 6789 B11R1.40 C[C@H](CN)Cc1ccccc1 Amb27595651 [1,1,0,0,0,0|2,0,0]=4 6790 B11R1.40 C[C@H](CO)Cc1ccccc1 Amb25266388 [1,1,0,0,0,0|2,0,0]=4 6791 B11R1.40 C\N=C(\N)Cc1ccccc1 Amb23569051 [1,1,0,0,0,0|0,0,2]=4 6792 B11R1.40 FCC(F)Cc1ccccc1 Amb22641518 [1,1,0,0,0,0|2,0,0]=4 6793 B11R1.40 N#CC(Br)Cc1ccccc1 Amb1154191 [1,1,0,0,0,0|2,0,0]=4 6794 B11R1.40 N#CC(Cl)Cc1ccccc1 Amb1103676 [1,1,0,0,0,0|2,0,0]=4 6795 B11R1.40 N#CC(N)Cc1ccccc1 Amb6892763 [1,1,0,0,0,0|2,0,0]=4 6796 B11R1.40 N#CC(N)Cc1ccccc1 Amb9707863 [1,1,0,0,0,0|2,0,0]=4 6797 B11R1.40 N#C[C@@H](N)Cc1ccccc1 Amb17399902 [1,1,0,0,0,0|2,0,0]=4 6798 B11R1.40 N#C[C@H](N)Cc1ccccc1 Amb26366283 [1,1,0,0,0,0|2,0,0]=4 6799 B11R1.40 N=C(Cc1ccccc1)NN Amb2616207 [1,1,0,0,0,0|1,0,1]=4 6800 B11R1.40 N=C(Cc1ccccc1)NO Amb20671380 [1,1,0,0,0,0|1,0,1]=4 6801 B11R1.40 NC(CBr)Cc1ccccc1 Amb26619555 [1,1,0,0,0,0|2,0,0]=4 6802 B11R1.40 NC(CCl)Cc1ccccc1 Amb28076898 [1,1,0,0,0,0|2,0,0]=4 6803 B11R1.40 NC(CO)Cc1ccccc1 Amb6739795 [1,1,0,0,0,0|2,0,0]=4 6804 B11R1.40 NC(CS)Cc1ccccc1 Amb27401982 [1,1,0,0,0,0|2,0,0]=4 6805 B11R1.40 NCC(N)Cc1ccccc1 Amb9380670 [1,1,0,0,0,0|2,0,0]=4 6806 B11R1.40 NCC(O)Cc1ccccc1 Amb2697590 [1,1,0,0,0,0|2,0,0]=4 6807 B11R1.40 NCC(O)Cc1ccccc1 Amb8630271 [1,1,0,0,0,0|2,0,0]=4 6808 B11R1.40 NC[C@@H](N)Cc1ccccc1 Amb17619360 [1,1,0,0,0,0|2,0,0]=4 6809 B11R1.40 NC[C@@H](O)Cc1ccccc1 Amb22746804 [1,1,0,0,0,0|2,0,0]=4 6810 B11R1.40 NC[C@@H](O)Cc1ccccc1 Amb33456886 [1,1,0,0,0,0|2,0,0]=4 6811 B11R1.40 NC[C@H](N)Cc1ccccc1 Amb17619359 [1,1,0,0,0,0|2,0,0]=4 6812 B11R1.40 NC[C@H](O)Cc1ccccc1 Amb24538166 [1,1,0,0,0,0|2,0,0]=4 6813 B11R1.40 NNC(=O)Cc1ccccc1 Amb6355837 [1,1,0,0,0,0|1,0,1]=4 6814 B11R1.40 N[C@@H](CBr)Cc1ccccc1 Amb27413229 [1,1,0,0,0,0|2,0,0]=4 6815 B11R1.40 N[C@@H](CF)Cc1ccccc1 Amb33624252 [1,1,0,0,0,0|2,0,0]=4 6816 B11R1.40 N[C@@H](CO)Cc1ccccc1 Amb534734 [1,1,0,0,0,0|2,0,0]=4 6817 B11R1.40 N[C@H](C=O)Cc1ccccc1 Amb27810784 [1,1,0,0,0,0|2,0,0]=4 6818 B11R1.40 N[C@H](CBr)Cc1ccccc1 Amb25923127 [1,1,0,0,0,0|2,0,0]=4 6819 B11R1.40 N[C@H](CO)Cc1ccccc1 Amb3939343 [1,1,0,0,0,0|2,0,0]=4 6820 B11R1.40 O=CC(Cl)Cc1ccccc1 Amb17204312 [1,1,0,0,0,0|2,0,0]=4 6821 B11R1.40 O=CC(I)Cc1ccccc1 Amb27839657 [1,1,0,0,0,0|2,0,0]=4 6822 B11R1.40 O=C[C@@H](Cl)Cc1ccccc1 Amb27632499 [1,1,0,0,0,0|2,0,0]=4 6823 B11R1.40 O=C[C@H](Cl)Cc1ccccc1 Amb27955251 [1,1,0,0,0,0|2,0,0]=4 6824 B11R1.40 O=C[C@H](I)Cc1ccccc1 Amb28365493 [1,1,0,0,0,0|2,0,0]=4 6825 B11R1.40 OC(CBr)Cc1ccccc1 Amb17595843 [1,1,0,0,0,0|2,0,0]=4 6826 B11R1.40 OC(CCl)Cc1ccccc1 Amb4035193 [1,1,0,0,0,0|2,0,0]=4 6827 B11R1.40 OC(CF)Cc1ccccc1 Amb24733743 [1,1,0,0,0,0|2,0,0]=4 6828 B11R1.40 OCC(Br)Cc1ccccc1 Amb27225418 [1,1,0,0,0,0|2,0,0]=4 6829 B11R1.40 OCC(Cl)Cc1ccccc1 Amb24373181 [1,1,0,0,0,0|2,0,0]=4 6830 B11R1.40 OCC(O)Cc1ccccc1 Amb17593786 [1,1,0,0,0,0|2,0,0]=4 6831 B11R1.40 OCC(S)Cc1ccccc1 Amb28292008 [1,1,0,0,0,0|2,0,0]=4 6832 B11R1.40 OC[C@@H](Br)Cc1ccccc1 Amb26974518 [1,1,0,0,0,0|2,0,0]=4 6833 B11R1.40 OC[C@@H](Cl)Cc1ccccc1 Amb25984616 [1,1,0,0,0,0|2,0,0]=4 6834 B11R1.40 OC[C@H](F)Cc1ccccc1 Amb27756441 [1,1,0,0,0,0|2,0,0]=4 6835 B11R1.40 O[C@@H](CBr)Cc1ccccc1 Amb28135916 [1,1,0,0,0,0|2,0,0]=4 6836 B11R1.40 O[C@@H](CCl)Cc1ccccc1 Amb19929327 [1,1,0,0,0,0|2,0,0]=4 6837 B11R1.40 O[C@H](CCl)Cc1ccccc1 Amb19929332 [1,1,0,0,0,0|2,0,0]=4 6838 B11R1.40 [C-]#[N+]C(C)Cc1ccccc1 Amb32953158 [1,1,0,0,0,0|0,0,2]=4 6839 B11R1.40 [NH3+]C(CO)Cc1ccccc1 Amb33512954 [1,1,0,0,0,0|2,0,0]=4 6840 B11R1.91 C=C(C)CCc1ccccc1 Amb28199357 [1,1,0,0,0,0|1,0,0]=3 6841 B11R1.91 C=C(C)CNc1ccccc1 Amb4017508 [1,1,0,0,0,0|2,0,0]=4 6842 B11R1.91 C=C(C)COc1ccccc1 Amb10601706 [1,1,0,0,0,0|2,0,0]=4 6843 B11R1.91 C=C(C)CSc1ccccc1 Amb4013110 [1,1,0,0,0,0|2,0,0]=4 6844 B11R1.91 C=C(C)NCc1ccccc1 Amb27174576 [1,1,0,0,0,0|2,0,0]=4 6845 B11R1.91 C=C(C)OCc1ccccc1 Amb22731238 [1,1,0,0,0,0|2,0,0]=4 6846 B11R1.91 C=[ClH](C)COc1ccccc1 Amb28059898 [1,1,0,0,0,0|2,0,0]=4 6847 B11R1.91 CC(=N)NCc1ccccc1 Amb24477667 [1,1,0,0,0,0|2,0,0]=4 6848 B11R1.91 CC(=N)SCc1ccccc1 Amb17609340 [1,1,0,0,0,0|2,0,0]=4 6849 B11R1.91 CC(=O)CCc1ccccc1 Amb4605983 [1,1,0,0,0,0|1,0,0]=3 6850 B11R1.91 CC(=O)CCc1ccccn1 Amb17507163 [1,1,0,0,0,0|2,0,0]=4 6851 B11R1.91 CC(=O)CCc1cccnc1 Amb17507164 [1,1,0,0,0,0|2,0,0]=4 6852 B11R1.91 CC(=O)CCc1ccncc1 Amb17507165 [1,1,0,0,0,0|2,0,0]=4 6853 B11R1.91 CC(=O)CCc1ccncc1 Amb33329478 [1,1,0,0,0,0|2,0,0]=4 6854 B11R1.91 CC(=O)CNc1ccccc1 Amb24447025 [1,1,0,0,0,0|2,0,0]=4 6855 B11R1.91 CC(=O)COc1ccccc1 Amb8515312 [1,1,0,0,0,0|2,0,0]=4 6856 B11R1.91 CC(=O)CSc1ccccc1 Amb3836103 [1,1,0,0,0,0|2,0,0]=4 6857 B11R1.91 CC(=O)NCc1ccccc1 Amb1214455 [1,1,0,0,0,0|2,0,0]=4 6858 B11R1.91 CC(=O)OCc1ccccc1 Amb8513061 [1,1,0,0,0,0|2,0,0]=4 6859 B11R1.91 CC(=O)SCc1ccccc1 Amb26888160 [1,1,0,0,0,0|2,0,0]=4 6860 B11R1.91 CC(=S)NCc1ccccc1 Amb1797002 [1,1,0,0,0,0|2,0,0]=4 6861 B11R1.91 CC(Br)CCc1ccccc1 Amb8835399 [1,1,0,0,0,0|1,0,0]=3 6862 B11R1.91 CC(Br)CCc1cccnc1 Amb28401177 [1,1,0,0,0,0|2,0,0]=4 6863 B11R1.91 CC(Br)CNc1ccccc1 Amb28428528 [1,1,0,0,0,0|2,0,0]=4 6864 B11R1.91 CC(Br)COc1ccccc1 Amb25278262 [1,1,0,0,0,0|2,0,0]=4 6865 B11R1.91 CC(Br)CSc1ccccc1 Amb27628746 [1,1,0,0,0,0|2,0,0]=4 6866 B11R1.91 CC(C)=CCc1ccccc1 Amb2720924 [1,1,0,0,0,0|1,0,1]=4 6867 B11R1.91 CC(C)=NCc1ccccc1 Amb10568469 [1,1,0,0,0,0|2,0,0]=4 6868 B11R1.91 CC(C)CC[n+]1ccccc1 Amb27809209 [1,1,0,0,0,0|2,0,0]=4 6869 B11R1.91 CC(C)CCc1ccccc1 Amb4477358 [1,1,0,0,0,0|1,0,0]=3 6870 B11R1.91 CC(C)CCc1ccccn1 Amb27400236 [1,1,0,0,0,0|2,0,0]=4 6871 B11R1.91 CC(C)CNc1ccccc1 Amb28960302 [1,1,0,0,0,0|2,0,0]=4 6872 B11R1.91 CC(C)CNc1ccccc1 Amb4304155 [1,1,0,0,0,0|2,0,0]=4 6873 B11R1.91 CC(C)COc1ccccc1 Amb27668259 [1,1,0,0,0,0|2,0,0]=4 6874 B11R1.91 CC(C)CSc1ccccc1 Amb4016673 [1,1,0,0,0,0|2,0,0]=4 6875 B11R1.91 CC(C)NCc1ccccc1 Amb4020804 [1,1,0,0,0,0|2,0,0]=4 6876 B11R1.91 CC(C)NCc1ccccc1 Amb6383293 [1,1,0,0,0,0|2,0,0]=4 6877 B11R1.91 CC(C)OCc1ccccc1 Amb3988003 [1,1,0,0,0,0|2,0,0]=4 6878 B11R1.91 CC(C)SCc1ccccc1 Amb25935134 [1,1,0,0,0,0|2,0,0]=4 6879 B11R1.91 CC(Cl)CCc1ccccc1 Amb9205035 [1,1,0,0,0,0|1,0,0]=3 6880 B11R1.91 CC(Cl)CCc1ccccn1 Amb27763955 [1,1,0,0,0,0|2,0,0]=4 6881 B11R1.91 CC(Cl)SCc1ccccc1 Amb27638041 [1,1,0,0,0,0|2,0,0]=4 6882 B11R1.91 CC(F)CNc1ccccc1 Amb27872143 [1,1,0,0,0,0|2,0,0]=4 6883 B11R1.91 CC(N)CCc1ccccc1 Amb5740105 [1,1,0,0,0,0|1,0,0]=3 6884 B11R1.91 CC(N)CCc1ccccc1 Amb6383144 [1,1,0,0,0,0|1,0,0]=3 6885 B11R1.91 CC(N)CCc1ccccn1 Amb17507327 [1,1,0,0,0,0|2,0,0]=4 6886 B11R1.91 CC(N)CCc1cccnc1 Amb17507328 [1,1,0,0,0,0|2,0,0]=4 6887 B11R1.91 CC(N)CCc1ccncc1 Amb17507329 [1,1,0,0,0,0|2,0,0]=4 6888 B11R1.91 CC(N)CNc1ccccc1 Amb18972362 [1,1,0,0,0,0|2,0,0]=4 6889 B11R1.91 CC(N)COc1ccccc1 Amb10609380 [1,1,0,0,0,0|2,0,0]=4 6890 B11R1.91 CC(N)COc1ccccc1 Amb9756346 [1,1,0,0,0,0|2,0,0]=4 6891 B11R1.91 CC(N)CSc1ccccc1 Amb18065472 [1,1,0,0,0,0|2,0,0]=4 6892 B11R1.91 CC(N)CSc1ccccc1 Amb21988436 [1,1,0,0,0,0|2,0,0]=4 6893 B11R1.91 CC(O)CCc1ccccc1 Amb4009672 [1,1,0,0,0,0|1,0,0]=3 6894 B11R1.91 CC(O)CCc1ccccn1 Amb17507263 [1,1,0,0,0,0|2,0,0]=4 6895 B11R1.91 CC(O)CCc1cccnc1 Amb17507264 [1,1,0,0,0,0|2,0,0]=4 6896 B11R1.91 CC(O)CCc1ccncc1 Amb17507265 [1,1,0,0,0,0|2,0,0]=4 6897 B11R1.91 CC(O)CNc1ccccc1 Amb6537763 [1,1,0,0,0,0|2,0,0]=4 6898 B11R1.91 CC(O)COc1ccccc1 Amb6298844 [1,1,0,0,0,0|2,0,0]=4 6899 B11R1.91 CC(O)CPc1ccccc1 Amb27756306 [1,1,0,0,0,0|2,0,0]=4 6900 B11R1.91 CC(O)CSc1ccccc1 Amb18793066 [1,1,0,0,0,0|2,0,0]=4 6901 B11R1.91 CC(S)CCc1ccccc1 Amb7784713 [1,1,0,0,0,0|1,0,0]=3 6902 B11R1.91 CC(S)COc1ccccc1 Amb29854435 [1,1,0,0,0,0|2,0,0]=4 6903 B11R1.91 CN(C)CCc1ccccc1 Amb3428717 [1,1,0,0,0,0|0,0,0]=2 6904 B11R1.91 CN(C)CCc1ccccn1 Amb2725569 [1,1,0,0,0,0|1,0,0]=3 6905 B11R1.91 CN(C)CCc1cccnc1 Amb8484655 [1,1,0,0,0,0|1,0,0]=3 6906 B11R1.91 CN(C)CCc1ccncc1 Amb24073816 [1,1,0,0,0,0|1,0,0]=3 6907 B11R1.91 CN(C)CCc1cnccn1 Amb4005051 [1,1,0,0,0,0|2,0,0]=4 6908 B11R1.91 CN(C)NCc1ccccc1 Amb25921006 [1,1,0,0,0,0|1,0,0]=3 6909 B11R1.91 CN(C)NCc1ccccn1 Amb27831849 [1,1,0,0,0,0|2,0,0]=4 6910 B11R1.91 CN(C)\C=N\c1ccccc1 Amb33512937 [1,1,0,0,0,0|1,0,1]=4 6911 B11R1.91 CN(C)\N=C\c1ccccc1 Amb33512938 [1,1,0,0,0,0|1,0,1]=4 6912 B11R1.91 CN(C)\N=N\c1ccccc1 Amb4016230 [1,1,0,0,0,0|2,0,0]=4 6913 B11R1.91 CN(N)CCc1ccccc1 Amb18064284 [1,1,0,0,0,0|0,0,0]=2 6914 B11R1.91 CN(N)CCc1ccncc1 Amb28187960 [1,1,0,0,0,0|1,0,0]=3 6915 B11R1.91 CN(O)CCc1ccccc1 Amb32953149 [1,1,0,0,0,0|0,0,0]=2 6916 B11R1.91 CN(O)CCc1ccncc1 Amb25684228 [1,1,0,0,0,0|1,0,0]=3 6917 B11R1.91 CN(O)\N=N\c1ccccc1 Amb27185830 [1,1,0,0,0,0|2,0,0]=4 6918 B11R1.91 C[C@@H](N)CCc1ccccc1 Amb8516709 [1,1,0,0,0,0|1,0,0]=3 6919 B11R1.91 C[C@@H](N)CCc1ccccn1 Amb25076768 [1,1,0,0,0,0|2,0,0]=4 6920 B11R1.91 C[C@@H](N)CCc1cccnc1 Amb27461341 [1,1,0,0,0,0|2,0,0]=4 6921 B11R1.91 C[C@@H](N)CCc1ccncc1 Amb24551017 [1,1,0,0,0,0|2,0,0]=4 6922 B11R1.91 C[C@@H](N)COc1ccccc1 Amb18538481 [1,1,0,0,0,0|2,0,0]=4 6923 B11R1.91 C[C@@H](O)CCc1ccccc1 Amb22049565 [1,1,0,0,0,0|1,0,0]=3 6924 B11R1.91 C[C@@H](O)CCc1ccccn1 Amb33360774 [1,1,0,0,0,0|2,0,0]=4 6925 B11R1.91 C[C@@H](O)CCc1cccnc1 Amb33360059 [1,1,0,0,0,0|2,0,0]=4 6926 B11R1.91 C[C@@H](O)CCc1ccncc1 Amb33380653 [1,1,0,0,0,0|2,0,0]=4 6927 B11R1.91 C[C@@H](O)CNc1ccccc1 Amb27400122 [1,1,0,0,0,0|2,0,0]=4 6928 B11R1.91 C[C@@H](O)COc1ccccc1 Amb27776994 [1,1,0,0,0,0|2,0,0]=4 6929 B11R1.91 C[C@H](Br)CCc1ccccc1 Amb27592949 [1,1,0,0,0,0|1,0,0]=3 6930 B11R1.91 C[C@H](N)CCc1ccccc1 Amb8516076 [1,1,0,0,0,0|1,0,0]=3 6931 B11R1.91 C[C@H](N)CCc1ccccn1 Amb27655480 [1,1,0,0,0,0|2,0,0]=4 6932 B11R1.91 C[C@H](N)CCc1cccnc1 Amb27391591 [1,1,0,0,0,0|2,0,0]=4 6933 B11R1.91 C[C@H](N)CCc1ccncc1 Amb24715801 [1,1,0,0,0,0|2,0,0]=4 6934 B11R1.91 C[C@H](N)COc1ccccc1 Amb17232092 [1,1,0,0,0,0|2,0,0]=4 6935 B11R1.91 C[C@H](O)CCc1ccccc1 Amb19929325 [1,1,0,0,0,0|1,0,0]=3 6936 B11R1.91 C[C@H](O)CCc1ccccn1 Amb33360775 [1,1,0,0,0,0|2,0,0]=4 6937 B11R1.91 C[C@H](O)CCc1cccnc1 Amb33360413 [1,1,0,0,0,0|2,0,0]=4 6938 B11R1.91 C[C@H](O)CCc1ccncc1 Amb33380654 [1,1,0,0,0,0|2,0,0]=4 6939 B11R1.91 C[PH](=O)OCc1ccccc1 Amb8391293 [1,1,0,0,0,0|1,1,0]=4 6940 B11R1.91 N=C(N)CCc1ccccc1 Amb6264312 [1,1,0,0,0,0|2,0,0]=4 6941 B11R1.91 N=C(N)CCc1ccccc1 Amb8630659 [1,1,0,0,0,0|2,0,0]=4 6942 B11R1.91 NC(=O)CCc1ccccc1 Amb2708677 [1,1,0,0,0,0|2,0,0]=4 6943 B11R1.91 NC(=S)CCc1ccccc1 Amb1801109 [1,1,0,0,0,0|2,0,0]=4 6944 B11R1.91 O=C(Cl)CCc1ccccc1 Amb2725506 [1,1,0,0,0,0|2,0,0]=4 6945 B11R1.91 O=C(O)CCc1ccccc1 Amb6356505 [1,1,0,0,0,0|2,0,0]=4 6946 B11R1.91 O=S(O)CCc1ccccc1 Amb27860522 [1,1,0,0,0,0|2,0,0]=4 6947 B11R1.91 O=S([O-])CCc1ccccc1 Amb26600239 [1,1,0,0,0,0|2,0,0]=4 6948 B11R1.91 O=[N+]([O-])CCc1ccccc1 Amb16192705 [1,1,0,0,0,0|1,0,1]=4 6949 B11R1.91 O=[PH](O)CCc1ccccc1 Amb27210683 [1,1,0,0,0,0|1,1,0]=4 6950 B11R1.91 OB(O)CCc1ccccc1 Amb2456045 [1,1,0,0,0,0|2,0,0]=4 6951 B11R1.2 CCC(CNC)c1cccs1 Amb17232726 [0,1,0,0,1,0|1,0,0]=3 6952 B11R1.2 CCC(CNC)c1cnco1 Amb33295071 [0,1,0,0,1,0|2,0,0]=4 6953 B11R1.2 CCC(COC)n1cccc1 Amb27987088 [0,1,0,0,1,0|2,0,0]=4 6954 B11R1.2 CCCC(CBr)c1cccs1 Amb17250571 [0,1,0,0,1,0|2,0,0]=4 6955 B11R1.2 CCCC(CCl)c1cccs1 Amb17234618 [0,1,0,0,1,0|2,0,0]=4 6956 B11R1.2 CCCC(CN)c1cccs1 Amb17232728 [0,1,0,0,1,0|2,0,0]=4 6957 B11R1.2 CCCC(CN)n1cccc1 Amb27269862 [0,1,0,0,1,0|2,0,0]=4 6958 B11R1.2 CCCC(CO)c1cccs1 Amb17232754 [0,1,0,0,1,0|2,0,0]=4 6959 B11R1.2 CCCC(NC)c1ccco1 Amb19033674 [0,1,0,0,1,0|2,0,0]=4 6960 B11R1.2 CCCC(NC)c1ccoc1 Amb27266766 [0,1,0,0,1,0|2,0,0]=4 6961 B11R1.2 CCCC(NC)c1ccsc1 Amb18793547 [0,1,0,0,1,0|2,0,0]=4 6962 B11R1.2 CNC(COC)c1ccco1 Amb27266769 [0,1,0,0,1,0|2,0,0]=4 6963 B11R1.2 CNC(COC)c1ccoc1 Amb27266768 [0,1,0,0,1,0|2,0,0]=4 6964 B11R1.2 CNC(COC)c1ccsc1 Amb28386755 [0,1,0,0,1,0|2,0,0]=4 6965 B11R1.2 CNC(CSC)c1ccco1 Amb27269847 [0,1,0,0,1,0|2,0,0]=4 6966 B11R1.2 CNC(CSC)c1ccoc1 Amb27269846 [0,1,0,0,1,0|2,0,0]=4 6967 B11R1.2 CNCC(OC)c1cccs1 Amb18563964 [0,1,0,0,1,0|1,0,0]=3 6968 B11R1.2 CNCC(OC)c1ccsc1 Amb27673236 [0,1,0,0,1,0|1,0,0]=3 6969 B11R1.2 CNCC(OC)c1cncs1 Amb27674292 [0,1,0,0,1,0|2,0,0]=4 6970 B11R1.2 CNCC(OC)c1cscn1 Amb27674294 [0,1,0,0,1,0|2,0,0]=4 6971 B11R1.2 CNCC(OC)c1nccs1 Amb27674291 [0,1,0,0,1,0|2,0,0]=4 6972 B11R1.2 COCC(CN)n1cccc1 Amb28387102 [0,1,0,0,1,0|2,0,0]=4 6973 B11R1.15 CNCC(C)c1cc(C)on1 Amb27968186 [0,1,0,0,1,0|2,0,0]=4 6974 B11R1.15 CNCC(C)c1ccc(Br)s1 Amb17251286 [0,1,0,0,1,0|1,0,0]=3 6975 B11R1.15 CNCC(C)c1ccc(Cl)s1 Amb17234843 [0,1,0,0,1,0|1,0,0]=3 6976 B11R1.15 CNCC(C)c1nc(C)cs1 Amb17232760 [0,1,0,0,1,0|2,0,0]=4 6977 B11R1.15 CNCC(C)c1nc(O)cs1 Amb35710032 [0,1,0,0,1,0|2,0,0]=4 6978 B11R1.15 CNCC(C)n1cc(Cl)cn1 Amb18992884 [0,1,0,0,1,0|2,0,0]=4 6979 B11R1.15 CNCC(O)c1cc(Br)co1 Amb33431203 [0,1,0,0,1,0|2,0,0]=4 6980 B11R1.15 CNCC(O)c1cc(Br)cs1 Amb18301240 [0,1,0,0,1,0|2,0,0]=4 6981 B11R1.15 CNCC(O)c1cc(C)cs1 Amb33427985 [0,1,0,0,1,0|2,0,0]=4 6982 B11R1.15 CNCC(O)c1cc(Cl)cs1 Amb18816862 [0,1,0,0,1,0|2,0,0]=4 6983 B11R1.15 CNCC(O)c1ccc(Br)o1 Amb33452133 [0,1,0,0,1,0|2,0,0]=4 6984 B11R1.15 CNCC(O)c1ccc(Br)s1 Amb17252670 [0,1,0,0,1,0|2,0,0]=4 6985 B11R1.15 CNCC(O)c1ccc(C)o1 Amb26478717 [0,1,0,0,1,0|2,0,0]=4 6986 B11R1.15 CNCC(O)c1ccc(C)s1 Amb18301121 [0,1,0,0,1,0|2,0,0]=4 6987 B11R1.15 CNCC(O)c1ccc(Cl)o1 Amb24488003 [0,1,0,0,1,0|2,0,0]=4 6988 B11R1.15 CNCC(O)c1ccc(Cl)s1 Amb17235307 [0,1,0,0,1,0|2,0,0]=4 6989 B11R1.15 CNCC(O)c1ccn(C)c1 Amb18065414 [0,1,0,0,1,0|2,0,0]=4 6990 B11R1.15 CNCC(O)c1csc(Br)c1 Amb25189577 [0,1,0,0,1,0|2,0,0]=4 6991 B11R1.29 CC(CCCN)c1cccs1 Amb18563916 [0,1,0,0,1,0|2,0,0]=4 6992 B11R1.29 CCCCC(C)n1cccc1 Amb18799394 [0,1,0,0,1,0|2,0,0]=4 6993 B11R1.29 CCCNC(C)c1ccco1 Amb6271977 [0,1,0,0,1,0|2,0,0]=4 6994 B11R1.29 CCCNC(C)c1cccs1 Amb6272252 [0,1,0,0,1,0|2,0,0]=4 6995 B11R1.29 CCCNC(C)c1ccoc1 Amb27266765 [0,1,0,0,1,0|2,0,0]=4 6996 B11R1.29 CCCNC(C)c1ccsc1 Amb18180230 [0,1,0,0,1,0|2,0,0]=4 6997 B11R1.29 CCCSC(C)c1cccs1 Amb28387227 [0,1,0,0,1,0|2,0,0]=4 6998 B11R1.29 CCNCC(C)c1cnco1 Amb33295061 [0,1,0,0,1,0|2,0,0]=4 6999 B11R1.29 CCNCC(C)c1nccs1 Amb27672030 [0,1,0,0,1,0|2,0,0]=4 7000 B11R1.29 CCNCC(O)c1ccco1 Amb17138458 [0,1,0,0,1,0|2,0,0]=4 7001 B11R1.29 CCNCC(O)c1cccs1 Amb17138677 [0,1,0,0,1,0|2,0,0]=4 7002 B11R1.29 CCNCC(O)c1ccsc1 Amb19031259 [0,1,0,0,1,0|2,0,0]=4 7003 B11R1.29 CNCCC(C)c1cccs1 Amb5739285 [0,1,0,0,1,0|1,0,0]=3 7004 B11R1.29 CNCCC(C)c1ccns1 Amb27671832 [0,1,0,0,1,0|2,0,0]=4 7005 B11R1.29 CNCCC(O)c1cccs1 Amb2383141 [0,1,0,0,1,0|2,0,0]=4 7006 B11R1.29 CNCCN(C)c1cccs1 Amb27818806 [0,1,0,0,1,0|2,0,0]=4 7007 B11R1.29 CNCC[C@@H](O)c1cccs1 Amb2383143 [0,1,0,0,1,0|2,0,0]=4 7008 B11R1.29 CNCC[C@H](O)c1cccs1 Amb2383144 [0,1,0,0,1,0|2,0,0]=4 7009 B11R1.29 CNC\C=C(/C)c1cccs1 Amb23555597 [0,1,0,0,1,0|1,0,1]=4 7010 B11R1.29 CONCC(O)c1ccco1 Amb27987591 [0,1,0,0,1,0|2,0,0]=4 7011 B11R1.29 CONCC(O)c1cccs1 Amb27987601 [0,1,0,0,1,0|2,0,0]=4 7012 B11R1.29 CSCCC(C)n1cccc1 Amb27271785 [0,1,0,0,1,0|2,0,0]=4 7013 B11R1.29 C[C@H](CCCCl)n1cccc1 Amb27269186 [0,1,0,0,1,0|2,0,0]=4 7014 B11R1.31 CCC(C)C(C)n1cccc1 Amb18179411 [0,1,0,0,1,0|2,0,0]=4 7015 B11R1.31 CNC(=O)C(C)c1cccs1 Amb27485766 [0,1,0,0,1,0|1,0,1]=4 7016 B11R1.31 CNC(C)C(O)c1ccsc1 Amb27839776 [0,1,0,0,1,0|2,0,0]=4 7017 B11R1.31 CN[C@@H](C)C(O)c1ccco1 Amb35664053 [0,1,0,0,1,0|2,0,0]=4 7018 B11R1.31 CN[C@@H](C)C(O)c1cccs1 Amb35663970 [0,1,0,0,1,0|2,0,0]=4 7019 B11R1.31 CN[C@@H](C)C(O)c1ccoc1 Amb35662600 [0,1,0,0,1,0|2,0,0]=4 7020 B11R1.31 CN[C@@H](C)C(O)c1ccsc1 Amb35662599 [0,1,0,0,1,0|2,0,0]=4 7021 B11R1.31 CN[C@H](C)[C@H](O)c1cccs1 Amb28252214 [0,1,0,0,1,0|2,0,0]=4 7022 B11R1.33 CC(O)(CNN)c1cccs1 Amb17232903 [0,1,0,0,1,0|2,0,0]=4 7023 B11R1.33 CCCC(C)(C)n1cccc1 Amb28062669 [0,1,0,0,1,0|2,0,0]=4 7024 B11R1.33 CCCC(C)(O)c1ccco1 Amb27792431 [0,1,0,0,1,0|2,0,0]=4 7025 B11R1.33 CNCC(C)(C)n1cccn1 Amb35604037 [0,1,0,0,1,0|2,0,0]=4 7026 B11R1.33 CNCC(C)(C)n1ccnc1 Amb35604038 [0,1,0,0,1,0|2,0,0]=4 7027 B11R1.33 CNCC(C)(O)c1ccco1 Amb28187524 [0,1,0,0,1,0|1,0,0]=3 7028 B11R1.33 CNCC(C)(O)c1cccs1 Amb5751081 [0,1,0,0,1,0|1,0,0]=3 7029 B11R1.33 CNCC(C)(O)c1ccns1 Amb27246913 [0,1,0,0,1,0|2,0,0]=4 7030 B11R1.33 CNCC(C)(O)c1ccoc1 Amb28318570 [0,1,0,0,1,0|1,0,0]=3 7031 B11R1.33 CNCC(C)(O)c1ccsn1 Amb27202209 [0,1,0,0,1,0|2,0,0]=4 7032 B11R1.33 CNCC(C)(O)c1cncs1 Amb35640643 [0,1,0,0,1,0|2,0,0]=4 7033 B11R1.33 CNCC(C)(O)c1cnsc1 Amb35711427 [0,1,0,0,1,0|2,0,0]=4 7034 B11R1.33 CNCC(F)(F)c1cccs1 Amb28186722 [0,1,0,0,1,0|2,0,0]=4 7035 B11R1.33 COCC(C)(N)c1cccs1 Amb18299364 [0,1,0,0,1,0|2,0,0]=4 7036 B11R1.33 COCC(C)(O)c1ccco1 Amb27968852 [0,1,0,0,1,0|2,0,0]=4 7037 B11R1.77 CC(=O)CC(C)c1cccs1 Amb5740066 [0,1,0,0,1,0|2,0,0]=4 7038 B11R1.77 CC(=O)C[C@H](C)c1cccs1 Amb27948566 [0,1,0,0,1,0|2,0,0]=4 7039 B11R1.77 CC(Br)CC(C)c1ccco1 Amb27805458 [0,1,0,0,1,0|2,0,0]=4 7040 B11R1.77 CC(Br)CC(C)c1ccoc1 Amb28281344 [0,1,0,0,1,0|2,0,0]=4 7041 B11R1.77 CC(CN(C)C)C1=CC=CC1 Amb27475983 [0,1,0,0,1,0|0,0,1]=3 7042 B11R1.77 CC(CN(C)C)c1nccs1 Amb28293718 [0,1,0,0,1,0|2,0,0]=4 7043 B11R1.77 CC(N)CC(C)c1cccs1 Amb27605952 [0,1,0,0,1,0|2,0,0]=4 7044 B11R1.77 CC(N)CC(C)n1cccc1 Amb27233855 [0,1,0,0,1,0|2,0,0]=4 7045 B11R1.77 CC(NN(C)C)c1ccco1 Amb27207977 [0,1,0,0,1,0|2,0,0]=4 7046 B11R1.77 CC(NN(C)C)c1cccs1 Amb27981245 [0,1,0,0,1,0|2,0,0]=4 7047 B11R1.77 CN(C)CC(Cl)c1cccs1 Amb17547925 [0,1,0,0,1,0|2,0,0]=4 7048 B11R1.77 CN(C)CC(N)c1ccco1 Amb1125377 [0,1,0,0,1,0|2,0,0]=4 7049 B11R1.77 CN(C)CC(N)c1ccco1 Amb33528949 [0,1,0,0,1,0|2,0,0]=4 7050 B11R1.77 CN(C)CC(N)c1cccs1 Amb9758092 [0,1,0,0,1,0|2,0,0]=4 7051 B11R1.77 CN(C)CC(O)c1ccco1 Amb17104280 [0,1,0,0,1,0|2,0,0]=4 7052 B11R1.77 CN(C)CC(O)c1cccs1 Amb508217 [0,1,0,0,1,0|2,0,0]=4 7053 B11R1.77 CN(C)C[C@@H](O)c1ccco1 Amb27588986 [0,1,0,0,1,0|2,0,0]=4 7054 B11R1.77 CN(C)C[C@H](O)c1ccco1 Amb27853194 [0,1,0,0,1,0|2,0,0]=4 7055 B11R1.199 CNCC(O)c1cccn1C Amb26317821 [0,1,0,0,1,0|2,0,0]=4 7056 B11R1.199 CNCC(O)c1ccoc1C Amb33473296 [0,1,0,0,1,0|2,0,0]=4 7057 B11R1.199 CNCC(O)c1ccsc1C Amb27826777 [0,1,0,0,1,0|2,0,0]=4 7058 B11R1.199 CNCC(O)c1cscc1Br Amb27165921 [0,1,0,0,1,0|2,0,0]=4 7059 B11R1.199 CNCC(O)c1cscc1C Amb33147696 [0,1,0,0,1,0|2,0,0]=4 7060 B11R1.199 CNCC(O)c1occc1C Amb33343969 [0,1,0,0,1,0|2,0,0]=4 7061 B11R1.199 CNCC(O)c1sccc1Br Amb26013039 [0,1,0,0,1,0|2,0,0]=4 7062 B11R1.199 CNCC(O)c1sccc1C Amb18301176 [0,1,0,0,1,0|2,0,0]=4 7063 B11R1.199 CNCC(O)c1sccc1Cl Amb27475562 [0,1,0,0,1,0|2,0,0]=4 7064 B13R1.19 C=CCC(C)Nc1ccc(Br)cc1 Amb28208070 [0,1,0,0,0,1|1,0,1]=4 7065 B13R1.19 CC#CC(C)Oc1ccc(N)cc1 Amb27248254 [0,1,0,0,0,1|1,0,1]=4 7066 B13R1.19 CC(CC#N)Nc1ccc(Br)cc1 Amb17158703 [0,1,0,0,0,1|2,0,0]=4 7067 B13R1.19 CC(CC#N)Nc1ccc(Cl)cc1 Amb17139532 [0,1,0,0,0,1|2,0,0]=4 7068 B13R1.19 CC(CC#N)Nc1ccc(F)cc1 Amb17138851 [0,1,0,0,0,1|2,0,0]=4 7069 B13R1.19 CC(CC#N)Oc1ccc(Br)cc1 Amb17255072 [0,1,0,0,0,1|2,0,0]=4 7070 B13R1.19 CC(CC#N)Oc1ccc(Cl)cc1 Amb17236323 [0,1,0,0,0,1|2,0,0]=4 7071 B13R1.19 CC(CC#N)Oc1ccc(F)cc1 Amb17233522 [0,1,0,0,0,1|2,0,0]=4 7072 B13R1.19 CC(CC#N)Oc1ccc(N)cc1 Amb18291147 [0,1,0,0,0,1|2,0,0]=4 7073 B13R1.19 CC(CCN)Cc1ccc(Br)cc1 Amb17255977 [0,1,0,0,0,1|2,0,0]=4 7074 B13R1.19 CC(CCN)Cc1ccc(Cl)cc1 Amb17236696 [0,1,0,0,0,1|2,0,0]=4 7075 B13R1.19 CC(CCN)Cc1ccc(F)cc1 Amb17233830 [0,1,0,0,0,1|2,0,0]=4 7076 B13R1.19 CC(CCN)Oc1ccc(Br)cc1 Amb17256976 [0,1,0,0,0,1|2,0,0]=4 7077 B13R1.19 CC(CCN)Oc1ccc(Cl)cc1 Amb17237053 [0,1,0,0,0,1|2,0,0]=4 7078 B13R1.19 CC(CCN)Oc1ccc(F)cc1 Amb17234005 [0,1,0,0,0,1|2,0,0]=4 7079 B13R1.19 CC(CCO)Cc1ccc(Br)cc1 Amb17256433 [0,1,0,0,0,1|2,0,0]=4 7080 B13R1.19 CC(CCO)Cc1ccc(Cl)cc1 Amb17236862 [0,1,0,0,0,1|2,0,0]=4 7081 B13R1.19 CC(CCO)Cc1ccc(F)cc1 Amb17233915 [0,1,0,0,0,1|2,0,0]=4 7082 B13R1.19 CC(CCO)Nc1ccc(N)cc1 Amb28347620 [0,1,0,0,0,1|2,0,0]=4 7083 B13R1.19 CC(CCO)Oc1ccc(Br)cc1 Amb17257496 [0,1,0,0,0,1|2,0,0]=4 7084 B13R1.19 CC(CCO)Oc1ccc(Cl)cc1 Amb17237193 [0,1,0,0,0,1|2,0,0]=4 7085 B13R1.19 CC(CCO)Oc1ccc(F)cc1 Amb17234074 [0,1,0,0,0,1|2,0,0]=4 7086 B13R1.19 CC(CNN)Oc1ccc(Br)cc1 Amb18070505 [0,1,0,0,0,1|1,0,0]=3 7087 B13R1.19 CC(CNN)Oc1ccc(Cl)cc1 Amb18066553 [0,1,0,0,0,1|1,0,0]=3 7088 B13R1.19 CC(CNN)Oc1ccc(F)cc1 Amb18564286 [0,1,0,0,0,1|1,0,0]=3 7089 B13R1.19 CCCC(Br)Cc1ccc(C)cc1 Amb18049439 [0,1,0,0,0,1|2,0,0]=4 7090 B13R1.19 CCCC(Br)Cc1ccc(Cl)cc1 Amb18049445 [0,1,0,0,0,1|2,0,0]=4 7091 B13R1.19 CCCC(C)NC1=CNC(=O)C=C1 Amb27618062 [0,1,0,0,0,1|2,0,0]=4 7092 B13R1.19 CCCC(C)Nc1ccc(Br)nc1 Amb27955649 [0,1,0,0,0,1|2,0,0]=4 7093 B13R1.19 CCCC(C)Nc1ccc(C)nc1 Amb24356361 [0,1,0,0,0,1|2,0,0]=4 7094 B13R1.19 CCCC(C)Nc1ccc(Cl)cc1 Amb6629146 [0,1,0,0,0,1|1,0,0]=3 7095 B13R1.19 CCCC(C)Nc1ccc(Cl)nc1 Amb26864292 [0,1,0,0,0,1|2,0,0]=4 7096 B13R1.19 CCCC(C)Nc1ccc(F)cc1 Amb6696821 [0,1,0,0,0,1|1,0,0]=3 7097 B13R1.19 CCCC(C)Nc1ccc(O)cc1 Amb9608747 [0,1,0,0,0,1|1,0,0]=3 7098 B13R1.19 CCCC(C)Oc1ccc(N)cc1 Amb840105 [0,1,0,0,0,1|1,0,0]=3 7099 B13R1.19 CCCC(C)Oc1ccc(N)cn1 Amb33035348 [0,1,0,0,0,1|2,0,0]=4 7100 B13R1.19 CCCC(C)Oc1ccc(N)nc1 Amb33035333 [0,1,0,0,0,1|2,0,0]=4 7101 B13R1.19 CCCN(C)Cc1ccc(N)cc1 Amb8898577 [0,1,0,0,0,1|2,0,0]=4 7102 B13R1.19 CCNC(C)Cc1ccc(N)cc1 Amb18050256 [0,1,0,0,0,1|2,0,0]=4 7103 B13R1.19 CCOC(C)Oc1ccc(Br)cc1 Amb2716342 [0,1,0,0,0,1|2,0,0]=4 7104 B13R1.19 CNCC(=O)Nc1ccc(Br)cc1 Amb6248627 [0,1,0,0,0,1|1,0,1]=4 7105 B13R1.19 CNCC(=O)Nc1ccc(C)cc1 Amb1105856 [0,1,0,0,0,1|1,0,1]=4 7106 B13R1.19 CNCC(=O)Nc1ccc(C)cc1 Amb6891769 [0,1,0,0,0,1|1,0,1]=4 7107 B13R1.19 CNCC(=O)Nc1ccc(Cl)cc1 Amb2276036 [0,1,0,0,0,1|1,0,1]=4 7108 B13R1.19 CNCC(=O)Nc1ccc(Cl)cc1 Amb2370653 [0,1,0,0,0,1|1,0,1]=4 7109 B13R1.19 CNCC(=O)Nc1ccc(F)cc1 Amb19372369 [0,1,0,0,0,1|1,0,1]=4 7110 B13R1.19 CNCC(=O)Nc1ccc(F)cc1 Amb2370688 [0,1,0,0,0,1|1,0,1]=4 7111 B13R1.19 CNCC(=O)Nc1ccc(I)cc1 Amb7755133 [0,1,0,0,0,1|1,0,1]=4 7112 B13R1.19 CNCC(=O)Nc1ccc(O)cc1 Amb13951398 [0,1,0,0,0,1|1,0,1]=4 7113 B13R1.19 CNCC(=O)Nc1ccc(O)cc1 Amb9231175 [0,1,0,0,0,1|1,0,1]=4 7114 B13R1.19 CNCC(O)Cc1ccc(Br)cc1 Amb17256962 [0,1,0,0,0,1|1,0,0]=3 7115 B13R1.19 CNCC(O)Cc1ccc(C)cc1 Amb17233571 [0,1,0,0,0,1|1,0,0]=3 7116 B13R1.19 CNCC(O)Cc1ccc(Cl)cc1 Amb17237040 [0,1,0,0,0,1|1,0,0]=3 7117 B13R1.19 CNCC(O)Cc1ccc(F)cc1 Amb17233990 [0,1,0,0,0,1|1,0,0]=3 7118 B13R1.19 CNC\C(C)=C\c1ccc(C)cn1 Amb27609145 [0,1,0,0,0,1|1,0,1]=4 7119 B13R1.19 CNC\C(C)=C\c1ccc(C)nc1 Amb28125199 [0,1,0,0,0,1|1,0,1]=4 7120 B13R1.19 CNC\C(C)=C\c1ccc(F)cc1 Amb28204433 [0,1,0,0,0,1|0,0,1]=3 7121 B13R1.19 CNC\C(C)=C\c1ccc(I)cc1 Amb27169997 [0,1,0,0,0,1|0,0,1]=3 7122 B13R1.19 COCC(C)Nc1ccc(Br)nc1 Amb28317418 [0,1,0,0,0,1|2,0,0]=4 7123 B13R1.19 COCC(C)Nc1ccc(C)cn1 Amb6625845 [0,1,0,0,0,1|2,0,0]=4 7124 B13R1.19 COCC(C)Nc1ccc(C)nc1 Amb27984595 [0,1,0,0,0,1|2,0,0]=4 7125 B13R1.19 COCC(C)Nc1ccc(Cl)nc1 Amb24696318 [0,1,0,0,0,1|2,0,0]=4 7126 B13R1.19 COCC(C)Nc1ccc(N)cc1 Amb7767685 [0,1,0,0,0,1|1,0,0]=3 7127 B13R1.19 COCC(C)Oc1ccc(N)cc1 Amb9701952 [0,1,0,0,0,1|1,0,0]=3 7128 B13R1.19 COCC(C)Oc1ccc(N)cn1 Amb33035235 [0,1,0,0,0,1|2,0,0]=4 7129 B13R1.19 COCC(C)Oc1ccc(N)nc1 Amb33035615 [0,1,0,0,0,1|2,0,0]=4 7130 B13R1.19 C\C=C\C(C)Nc1ccc(N)cc1 Amb18127788 [0,1,0,0,0,1|1,0,1]=4 7131 B13R1.19 Cc1ccc(CC(C)CCN)cc1 Amb17233335 [0,1,0,0,0,1|2,0,0]=4 7132 B13R1.19 Cc1ccc(CC(C)CCO)cc1 Amb17233454 [0,1,0,0,0,1|2,0,0]=4 7133 B13R1.19 Cc1ccc(NC(C)CC#N)cc1 Amb17138750 [0,1,0,0,0,1|2,0,0]=4 7134 B13R1.19 Cc1ccc(OC(C)CC#N)cc1 Amb17233110 [0,1,0,0,0,1|2,0,0]=4 7135 B13R1.19 Cc1ccc(OC(C)CCN)cc1 Amb17233612 [0,1,0,0,0,1|2,0,0]=4 7136 B13R1.19 Cc1ccc(OC(C)CCO)cc1 Amb17233719 [0,1,0,0,0,1|2,0,0]=4 7137 B13R1.19 Cc1ccc(OC(C)CNN)cc1 Amb18065976 [0,1,0,0,0,1|1,0,0]=3 7138 B13R1.19 [C-]#[N+]CC(C)Oc1ccc(F)cc1 Amb28071397 [0,1,0,0,0,1|0,0,2]=4 7139 B13R1.20 CC(CC#N)Nc1cccc(Br)c1 Amb17158705 [0,1,0,0,0,1|2,0,0]=4 7140 B13R1.20 CC(CC#N)Nc1cccc(Cl)c1 Amb17139531 [0,1,0,0,0,1|2,0,0]=4 7141 B13R1.20 CC(CC#N)Nc1cccc(F)c1 Amb17138852 [0,1,0,0,0,1|2,0,0]=4 7142 B13R1.20 CC(CC#N)Nc1cccc(I)c1 Amb28385400 [0,1,0,0,0,1|2,0,0]=4 7143 B13R1.20 CC(CC#N)Oc1cccc(Br)c1 Amb17255071 [0,1,0,0,0,1|2,0,0]=4 7144 B13R1.20 CC(CC#N)Oc1cccc(Cl)c1 Amb17236322 [0,1,0,0,0,1|2,0,0]=4 7145 B13R1.20 CC(CC#N)Oc1cccc(F)c1 Amb17233521 [0,1,0,0,0,1|2,0,0]=4 7146 B13R1.20 CC(CC#N)Sc1cccc(Br)c1 Amb27810601 [0,1,0,0,0,1|2,0,0]=4 7147 B13R1.20 CC(CCN)Cc1cccc(Br)c1 Amb17255972 [0,1,0,0,0,1|2,0,0]=4 7148 B13R1.20 CC(CCN)Cc1cccc(Cl)c1 Amb17236692 [0,1,0,0,0,1|2,0,0]=4 7149 B13R1.20 CC(CCN)Oc1cccc(Br)c1 Amb17256975 [0,1,0,0,0,1|2,0,0]=4 7150 B13R1.20 CC(CCN)Oc1cccc(Cl)c1 Amb17237052 [0,1,0,0,0,1|2,0,0]=4 7151 B13R1.20 CC(CCN)Oc1cccc(F)c1 Amb17234004 [0,1,0,0,0,1|2,0,0]=4 7152 B13R1.20 CC(CCO)Cc1cccc(Br)c1 Amb17256430 [0,1,0,0,0,1|2,0,0]=4 7153 B13R1.20 CC(CCO)Cc1cccc(Cl)c1 Amb17236860 [0,1,0,0,0,1|2,0,0]=4 7154 B13R1.20 CC(CCO)Oc1cccc(Br)c1 Amb17257493 [0,1,0,0,0,1|2,0,0]=4 7155 B13R1.20 CC(CCO)Oc1cccc(Cl)c1 Amb17237190 [0,1,0,0,0,1|2,0,0]=4 7156 B13R1.20 CC(CCO)Oc1cccc(F)c1 Amb17234071 [0,1,0,0,0,1|2,0,0]=4 7157 B13R1.20 CC(CNN)Oc1cccc(Br)c1 Amb18070493 [0,1,0,0,0,1|1,0,0]=3 7158 B13R1.20 CC(CNN)Oc1cccc(F)c1 Amb18066138 [0,1,0,0,0,1|1,0,0]=3 7159 B13R1.20 CCCC(C)Nc1cccc(C)c1 Amb6684527 [0,1,0,0,0,1|1,0,0]=3 7160 B13R1.20 CCCC(C)Nc1cccc(C)n1 Amb19005116 [0,1,0,0,0,1|2,0,0]=4 7161 B13R1.20 CCCC(C)Nc1cccc(Cl)n1 Amb28063109 [0,1,0,0,0,1|2,0,0]=4 7162 B13R1.20 CCCC(C)Nc1cccc(F)c1 Amb6695898 [0,1,0,0,0,1|1,0,0]=3 7163 B13R1.20 CCCC(C)Nc1cccc(F)n1 Amb19011122 [0,1,0,0,0,1|2,0,0]=4 7164 B13R1.20 CCCC(C)Nc1cccc(N)c1 Amb8825444 [0,1,0,0,0,1|1,0,0]=3 7165 B13R1.20 CCCC(C)Nc1ccnc(C)c1 Amb27408756 [0,1,0,0,0,1|2,0,0]=4 7166 B13R1.20 CCCC(C)Nc1cncc(Cl)c1 Amb35706793 [0,1,0,0,0,1|2,0,0]=4 7167 B13R1.20 CCCC(C)Nc1cncc(F)c1 Amb27791358 [0,1,0,0,0,1|2,0,0]=4 7168 B13R1.20 CCCC(C)Oc1cc(Cl)ccn1 Amb22276503 [0,1,0,0,0,1|2,0,0]=4 7169 B13R1.20 CCCC(C)Oc1cc(N)ccn1 Amb33035555 [0,1,0,0,0,1|2,0,0]=4 7170 B13R1.20 CCCC(C)Oc1cccc(Cl)n1 Amb32670736 [0,1,0,0,0,1|2,0,0]=4 7171 B13R1.20 CCCC(C)Oc1cccc(N)c1 Amb20623754 [0,1,0,0,0,1|1,0,0]=3 7172 B13R1.20 CCCC(C)Oc1cccc(N)c1 Amb33309135 [0,1,0,0,0,1|1,0,0]=3 7173 B13R1.20 CCCC(C)Sc1cc(Cl)ccn1 Amb22276504 [0,1,0,0,0,1|2,0,0]=4 7174 B13R1.20 CCCN(C)Cc1cccc(N)c1 Amb8898493 [0,1,0,0,0,1|2,0,0]=4 7175 B13R1.20 CNCC(=O)Nc1cccc(C)c1 Amb6246639 [0,1,0,0,0,1|1,0,1]=4 7176 B13R1.20 CNCC(=O)Nc1cccc(Cl)c1 Amb6251066 [0,1,0,0,0,1|1,0,1]=4 7177 B13R1.20 CNCC(=O)Nc1cccc(Cl)c1 Amb7969469 [0,1,0,0,0,1|1,0,1]=4 7178 B13R1.20 CNCC(=O)Nc1cccc(F)c1 Amb2277698 [0,1,0,0,0,1|1,0,1]=4 7179 B13R1.20 CNCC(=O)Nc1cccc(F)c1 Amb2370682 [0,1,0,0,0,1|1,0,1]=4 7180 B13R1.20 CNCC(=O)Nc1cccc(O)c1 Amb18290512 [0,1,0,0,0,1|1,0,1]=4 7181 B13R1.20 CNCC(C)Nc1cccc(Cl)c1 Amb28187017 [0,1,0,0,0,1|0,0,0]=2 7182 B13R1.20 CNCC(O)Cc1cccc(Br)c1 Amb17256958 [0,1,0,0,0,1|1,0,0]=3 7183 B13R1.20 CNCC(O)Cc1cccc(C)c1 Amb17233567 [0,1,0,0,0,1|1,0,0]=3 7184 B13R1.20 CNCC(O)Cc1cccc(Cl)c1 Amb17237036 [0,1,0,0,0,1|1,0,0]=3 7185 B13R1.20 CNCC(O)Cc1cccc(F)c1 Amb18564245 [0,1,0,0,0,1|1,0,0]=3 7186 B13R1.20 CNC\C(C)=C\c1cccc(C)c1 Amb27761052 [0,1,0,0,0,1|0,0,1]=3 7187 B13R1.20 CNC\C(C)=C\c1cccc(Cl)c1 Amb27224650 [0,1,0,0,0,1|0,0,1]=3 7188 B13R1.20 CNC\C(C)=C\c1cccc(F)c1 Amb28070114 [0,1,0,0,0,1|0,0,1]=3 7189 B13R1.20 CNC\C(C)=C\c1cncc(Br)c1 Amb28366896 [0,1,0,0,0,1|1,0,1]=4 7190 B13R1.20 COCC(C)Nc1cccc(Br)c1 Amb18312246 [0,1,0,0,0,1|1,0,0]=3 7191 B13R1.20 COCC(C)Nc1cccc(C)n1 Amb19005117 [0,1,0,0,0,1|2,0,0]=4 7192 B13R1.20 COCC(C)Nc1cccc(Cl)c1 Amb19024317 [0,1,0,0,0,1|1,0,0]=3 7193 B13R1.20 COCC(C)Nc1cccc(Cl)n1 Amb27632885 [0,1,0,0,0,1|2,0,0]=4 7194 B13R1.20 COCC(C)Nc1cccc(F)c1 Amb19024319 [0,1,0,0,0,1|1,0,0]=3 7195 B13R1.20 COCC(C)Nc1cccc(F)n1 Amb19011123 [0,1,0,0,0,1|2,0,0]=4 7196 B13R1.20 COCC(C)Nc1cccc(I)c1 Amb26476792 [0,1,0,0,0,1|1,0,0]=3 7197 B13R1.20 COCC(C)Nc1cccc(N)n1 Amb27609086 [0,1,0,0,0,1|2,0,0]=4 7198 B13R1.20 COCC(C)Nc1ccnc(C)c1 Amb27591908 [0,1,0,0,0,1|2,0,0]=4 7199 B13R1.20 COCC(C)Nc1ccnc(Cl)c1 Amb25898561 [0,1,0,0,0,1|2,0,0]=4 7200 B13R1.20 COCC(C)Nc1ccnc(F)c1 Amb28073574 [0,1,0,0,0,1|2,0,0]=4 7201 B13R1.20 COCC(C)Nc1cncc(C)c1 Amb28043557 [0,1,0,0,0,1|2,0,0]=4 7202 B13R1.20 COCC(C)Nc1cncc(Cl)c1 Amb29864730 [0,1,0,0,0,1|2,0,0]=4 7203 B13R1.20 COCC(C)Nc1cncc(N)c1 Amb27480313 [0,1,0,0,0,1|2,0,0]=4 7204 B13R1.20 COCC(C)Oc1cc(N)ccn1 Amb33035645 [0,1,0,0,0,1|2,0,0]=4 7205 B13R1.20 COCC(C)Oc1cccc(N)c1 Amb33035355 [0,1,0,0,0,1|1,0,0]=3 7206 B13R1.20 COC[C@@H](C)Nc1cccc(C)n1 Amb28185733 [0,1,0,0,0,1|2,0,0]=4 7207 B13R1.20 CSCC(C)Nc1cc(C)ccn1 Amb27589965 [0,1,0,0,0,1|2,0,0]=4 7208 B13R1.20 CSCC(C)Nc1cccc(C)n1 Amb27233338 [0,1,0,0,0,1|2,0,0]=4 7209 B13R1.20 CSCC(C)Nc1ccnc(C)c1 Amb27772352 [0,1,0,0,0,1|2,0,0]=4 7210 B13R1.20 Cc1cccc(CC(C)CCN)c1 Amb17233331 [0,1,0,0,0,1|2,0,0]=4 7211 B13R1.20 Cc1cccc(CC(C)CCO)c1 Amb17233452 [0,1,0,0,0,1|2,0,0]=4 7212 B13R1.20 Cc1cccc(NC(C)CC#N)c1 Amb17138749 [0,1,0,0,0,1|2,0,0]=4 7213 B13R1.20 Cc1cccc(OC(C)CC#N)c1 Amb17233109 [0,1,0,0,0,1|2,0,0]=4 7214 B13R1.20 Cc1cccc(OC(C)CCN)c1 Amb17233611 [0,1,0,0,0,1|2,0,0]=4 7215 B13R1.20 Cc1cccc(OC(C)CCO)c1 Amb17233716 [0,1,0,0,0,1|2,0,0]=4 7216 B13R1.20 Cc1cccc(OC(C)CNN)c1 Amb18564143 [0,1,0,0,0,1|1,0,0]=3 7217 B13R1.44 C#CCNC(C)Cc1ccccc1 Amb17618673 [0,1,0,0,0,1|1,0,1]=4 7218 B13R1.44 C#CCNC(C)Cc1ccccc1 Amb33549982 [0,1,0,0,0,1|1,0,1]=4 7219 B13R1.44 C=CCCC(C)Nc1ccccc1 Amb33363053 [0,1,0,0,0,1|1,0,1]=4 7220 B13R1.44 CC#CCC(C)Nc1ccccc1 Amb27231838 [0,1,0,0,0,1|1,0,0]=3 7221 B13R1.44 CC(CCC#N)Nc1ccccc1 Amb35661403 [0,1,0,0,0,1|1,0,1]=4 7222 B13R1.44 CC(CCCO)Nc1ccccc1 Amb21984572 [0,1,0,0,0,1|1,0,0]=3 7223 B13R1.44 CCCCC(O)Cc1ccccc1 Amb4034774 [0,1,0,0,0,1|2,0,0]=4 7224 B13R1.44 CCCCN(C)Cc1ccccc1 Amb1828371 [0,1,0,0,0,1|2,0,0]=4 7225 B13R1.44 CCCNC(C)Cc1ccccc1 Amb18180702 [0,1,0,0,0,1|1,0,0]=3 7226 B13R1.44 CCNCC(=O)Nc1ccccc1 Amb28600287 [0,1,0,0,0,1|1,0,1]=4 7227 B13R1.44 CCNCC(=O)Nc1ccccc1 Amb6242927 [0,1,0,0,0,1|1,0,1]=4 7228 B13R1.44 CN(CCCBr)Cc1ccccc1 Amb27235848 [0,1,0,0,0,1|2,0,0]=4 7229 B13R1.44 CN(CCCCl)Cc1ccccc1 Amb17337263 [0,1,0,0,0,1|2,0,0]=4 7230 B13R1.44 CN(CCCN)Cc1ccccc1 Amb22001972 [0,1,0,0,0,1|2,0,0]=4 7231 B13R1.44 CN(CCCN)Cc1ccccc1 Amb2371220 [0,1,0,0,0,1|2,0,0]=4 7232 B13R1.44 CN(CCCO)Cc1ccccc1 Amb9246592 [0,1,0,0,0,1|2,0,0]=4 7233 B13R1.44 CNCCC(=O)Nc1ccccc1 Amb15740952 [0,1,0,0,0,1|1,0,1]=4 7234 B13R1.44 CNCCC(=O)Nc1ccccc1 Amb9833670 [0,1,0,0,0,1|1,0,1]=4 7235 B13R1.44 CNCCN(C)Cc1ccccc1 Amb6715270 [0,1,0,0,0,1|1,0,0]=3 7236 B13R1.44 CNCC\C(C)=C\c1ccccc1 Amb33476406 [0,1,0,0,0,1|0,0,1]=3 7237 B13R1.44 CNNCC(=O)Nc1ccccc1 Amb28251057 [0,1,0,0,0,1|1,0,1]=4 7238 B13R1.44 C\C(=C/c1ccccc1)CCCBr Amb33381474 [0,1,0,0,0,1|1,0,1]=4 7239 B13R1.44 C\C(=C/c1ccccc1)CCCN Amb32951765 [0,1,0,0,0,1|1,0,1]=4 7240 B13R1.44 C\C(=C/c1ccccc1)CCCO Amb33081745 [0,1,0,0,0,1|1,0,1]=4 7241 B13R1.44 C\C(=C/c1ccccc1)CCCS Amb33381252 [0,1,0,0,0,1|1,0,1]=4 7242 B13R1.44 C\C=C\CN(C)Cc1ccccc1 Amb28453964 [0,1,0,0,0,1|2,0,0]=4 7243 B13R1.44 NC(CCCO)Cc1ccccc1 Amb9782428 [0,1,0,0,0,1|2,0,0]=4 7244 B13R1.47 C#CCC(C)C(=O)c1ccccc1 Amb18118075 [0,1,0,0,0,1|1,0,1]=4 7245 B13R1.47 C#CCC(C)C(O)c1ccccc1 Amb27656739 [0,1,0,0,0,1|1,0,1]=4 7246 B13R1.47 CC(CC#N)C(=O)c1ccccc1 Amb2774281 [0,1,0,0,0,1|2,0,0]=4 7247 B13R1.47 CC(CC#N)C(O)c1ccccc1 Amb17335051 [0,1,0,0,0,1|2,0,0]=4 7248 B13R1.47 CC(CC#N)N(C)c1ccccc1 Amb17334999 [0,1,0,0,0,1|2,0,0]=4 7249 B13R1.47 CC(CCN)C(C)c1ccccc1 Amb33081589 [0,1,0,0,0,1|2,0,0]=4 7250 B13R1.47 CC(CCN)C(O)c1ccccc1 Amb18194408 [0,1,0,0,0,1|2,0,0]=4 7251 B13R1.47 CC(CCN)N(C)c1ccccc1 Amb17138895 [0,1,0,0,0,1|2,0,0]=4 7252 B13R1.47 CC(CON)C(C)c1ccccc1 Amb33081866 [0,1,0,0,0,1|2,0,0]=4 7253 B13R1.47 CCCC(Br)C(=O)c1ccccc1 Amb8391599 [0,1,0,0,0,1|2,0,0]=4 7254 B13R1.47 CCCC(N)C(=O)c1ccccc1 Amb17594508 [0,1,0,0,0,1|2,0,0]=4 7255 B13R1.47 CCCC(N)C(=O)c1ccccc1 Amb26304147 [0,1,0,0,0,1|2,0,0]=4 7256 B13R1.47 CCCC(N)C(O)c1ccccc1 Amb18128510 [0,1,0,0,0,1|2,0,0]=4 7257 B13R1.47 CCC[C@@H](O)[C@H](N)c1ccccc1 Amb32412697 [0,1,0,0,0,1|2,0,0]=4 7258 B13R1.47 CCNC(C)C(O)c1ccccc1 Amb17594595 [0,1,0,0,0,1|2,0,0]=4 7259 B13R1.47 CCNC(C)C(O)c1ccccc1 Amb32661029 [0,1,0,0,0,1|2,0,0]=4 7260 B13R1.47 CCSC(C)C(=O)c1ccccc1 Amb9668556 [0,1,0,0,0,1|2,0,0]=4 7261 B13R1.47 CNCC(=O)C(C)c1ccccc1 Amb33223804 [0,1,0,0,0,1|1,0,1]=4 7262 B13R1.47 CNCC(=O)N(C)c1ccccc1 Amb2694351 [0,1,0,0,0,1|1,0,1]=4 7263 B13R1.47 CNCC(=O)N(C)c1ccccc1 Amb6273922 [0,1,0,0,0,1|1,0,1]=4 7264 B13R1.47 CNCC(O)C(C)c1ccccc1 Amb19031257 [0,1,0,0,0,1|1,0,0]=3 7265 B13R1.47 COCC(N)C(=O)c1ccccc1 Amb24106083 [0,1,0,0,0,1|2,0,0]=4 7266 B13R1.47 C\C=C\C(C)C(=O)c1ccccc1 Amb24492785 [0,1,0,0,0,1|1,0,1]=4 7267 B13R1.47 C\C=C\C(C)C(O)c1ccccc1 Amb28207338 [0,1,0,0,0,1|1,0,1]=4 7268 B13R1.47 C\C=C\[C@@H](C)C(O)c1ccccc1 Amb27255266 [0,1,0,0,0,1|1,0,1]=4 7269 B13R1.47 C\C=C\[C@@H](C)[C@@H](O)c1ccccc1 Amb27660881 [0,1,0,0,0,1|1,0,1]=4 7270 B13R1.79 C#CCC(Cc1ccccc1)NC Amb18185789 [0,1,0,0,0,1|1,0,1]=4 7271 B13R1.79 CCC(COC)Nc1ccccn1 Amb32676700 [0,1,0,0,0,1|2,0,0]=4 7272 B13R1.79 CCNC(CC)Cc1ccccc1 Amb18180699 [0,1,0,0,0,1|2,0,0]=4 7273 B13R1.79 CNC(CCO)Cc1ccccc1 Amb32651881 [0,1,0,0,0,1|2,0,0]=4 7274 B13R1.79 CNC(CCO)Cc1ccccc1 Amb32651892 [0,1,0,0,0,1|2,0,0]=4 7275 B13R1.79 CNC(COC)Cc1ccccc1 Amb33552712 [0,1,0,0,0,1|1,0,0]=3 7276 B13R1.79 C\C=C\C(CC)Nc1ccccc1 Amb24417887 [0,1,0,0,0,1|1,0,1]=4 7277 B13R1.135 C#C[C@@H](O)[C@H](C)Cc1ccccc1 Amb28065981 [0,1,0,0,0,1|1,0,1]=4 7278 B13R1.135 CC(Oc1ccccc1)C(=O)NN Amb6361387 [0,1,0,0,0,1|1,0,1]=4 7279 B13R1.135 CC(Oc1ccccc1)C(=O)NO Amb28064721 [0,1,0,0,0,1|1,0,1]=4 7280 B13R1.135 CC(Oc1ccccc1)C(N)C#N Amb30036970 [0,1,0,0,0,1|2,0,0]=4 7281 B13R1.135 CC(Sc1ccccc1)C(=O)NO Amb27790142 [0,1,0,0,0,1|1,0,1]=4 7282 B13R1.135 CC(Sc1ccccc1)C(N)C#N Amb35655811 [0,1,0,0,0,1|2,0,0]=4 7283 B13R1.135 CCC(=O)C(C)Cc1ccccc1 Amb17233202 [0,1,0,0,0,1|1,0,1]=4 7284 B13R1.135 CCC(=O)C(C)Sc1ccccc1 Amb32683032 [0,1,0,0,0,1|1,0,1]=4 7285 B13R1.135 CCC(C)C(C)Nc1ccccc1 Amb6719514 [0,1,0,0,0,1|1,0,0]=3 7286 B13R1.135 CCC(C)C(C)Nc1ccccn1 Amb19016834 [0,1,0,0,0,1|2,0,0]=4 7287 B13R1.135 CCC(C)C(C)Nc1ccncc1 Amb19016841 [0,1,0,0,0,1|2,0,0]=4 7288 B13R1.135 CCC(C)N(C)Cc1ccccc1 Amb28062153 [0,1,0,0,0,1|2,0,0]=4 7289 B13R1.135 CCC(N)C(C)Nc1ccccn1 Amb27858428 [0,1,0,0,0,1|2,0,0]=4 7290 B13R1.135 CC[C@@H](O)\C(C)=C\c1ccccc1 Amb27852767 [0,1,0,0,0,1|1,0,1]=4 7291 B13R1.135 CC[C@H](O)\C(C)=C\c1ccccc1 Amb28281705 [0,1,0,0,0,1|1,0,1]=4 7292 B13R1.135 CNC(=N)N(C)Cc1ccccc1 Amb18804661 [0,1,0,0,0,1|1,0,1]=4 7293 B13R1.135 CNC(=O)C(Br)Cc1ccccc1 Amb27610156 [0,1,0,0,0,1|1,0,1]=4 7294 B13R1.135 CNC(=O)C(C)Nc1ccccn1 Amb18978306 [0,1,0,0,0,1|1,0,1]=4 7295 B13R1.135 CNC(=O)C(C)Oc1ccccc1 Amb3886772 [0,1,0,0,0,1|0,0,1]=3 7296 B13R1.135 CNC(=O)C(C)Sc1ccccc1 Amb8328078 [0,1,0,0,0,1|0,0,1]=3 7297 B13R1.135 CNC(=O)C(C)Sc1ccccn1 Amb10679142 [0,1,0,0,0,1|1,0,1]=4 7298 B13R1.135 CNC(=O)C(N)Cc1ccccc1 Amb21958546 [0,1,0,0,0,1|1,0,1]=4 7299 B13R1.135 CNC(=O)C(N)Cc1ccccc1 Amb6279885 [0,1,0,0,0,1|1,0,1]=4 7300 B13R1.135 CNC(=O)C(O)Cc1ccccc1 Amb27789590 [0,1,0,0,0,1|1,0,1]=4 7301 B13R1.135 CNC(=O)C(S)Cc1ccccc1 Amb27207974 [0,1,0,0,0,1|1,0,1]=4 7302 B13R1.135 CNC(=O)N(C)Cc1ccccc1 Amb27168216 [0,1,0,0,0,1|1,0,1]=4 7303 B13R1.135 CNC(=O)N(C)Nc1ccccc1 Amb28340775 [0,1,0,0,0,1|1,0,1]=4 7304 B13R1.135 CNC(=O)[C@@H](N)Cc1ccccc1 Amb10878601 [0,1,0,0,0,1|1,0,1]=4 7305 B13R1.135 CNC(=O)[C@@H](N)Cc1ccccc1 Amb15740701 [0,1,0,0,0,1|1,0,1]=4 7306 B13R1.135 CNC(=O)[C@H](C)Nc1ccccn1 Amb28051445 [0,1,0,0,0,1|1,0,1]=4 7307 B13R1.135 CNC(=O)[C@H](N)Cc1ccccc1 Amb10608885 [0,1,0,0,0,1|1,0,1]=4 7308 B13R1.135 CNC(=O)[C@H](N)Cc1ccccc1 Amb33801562 [0,1,0,0,0,1|1,0,1]=4 7309 B13R1.135 CNC(=O)\C(C)=C\c1ccccc1 Amb3447584 [0,1,0,0,0,1|0,0,2]=4 7310 B13R1.135 CNC(C)C(=O)Nc1ccccc1 Amb7754252 [0,1,0,0,0,1|1,0,1]=4 7311 B13R1.135 CNC(C)\C(C)=C\c1ccccc1 Amb27610314 [0,1,0,0,0,1|0,0,1]=3 7312 B13R1.135 CNC(C)\C(C)=C\c1ccccn1 Amb27840862 [0,1,0,0,0,1|1,0,1]=4 7313 B13R1.135 COC(=O)C(C)Cc1ccccc1 Amb32412695 [0,1,0,0,0,1|1,0,1]=4 7314 B13R1.135 COC(=O)C(C)Nc1ccccc1 Amb4137936 [0,1,0,0,0,1|1,0,1]=4 7315 B13R1.135 COC(=O)C(C)Oc1ccccc1 Amb2780660 [0,1,0,0,0,1|1,0,1]=4 7316 B13R1.135 COC(C)C(C)Nc1ccccn1 Amb27251175 [0,1,0,0,0,1|2,0,0]=4 7317 B13R1.135 COC(C)C(C)Nc1cccnc1 Amb27414785 [0,1,0,0,0,1|2,0,0]=4 7318 B13R1.135 COC(C)[C@@H](C)Nc1ccccn1 Amb28400506 [0,1,0,0,0,1|2,0,0]=4 7319 B13R1.135 COC(C)[C@@H](C)Nc1ccncc1 Amb27456087 [0,1,0,0,0,1|2,0,0]=4 7320 B13R1.135 COC(C)[C@H](C)Nc1ccncc1 Amb27260039 [0,1,0,0,0,1|2,0,0]=4 7321 B13R1.135 C[C@@H](Cc1ccccc1)[C@@H](O)C#N Amb28123699 [0,1,0,0,0,1|2,0,0]=4 7322 B13R1.135 C[C@@H](Cc1ccccc1)[C@H](O)C#N Amb28188310 [0,1,0,0,0,1|2,0,0]=4 7323 B13R1.135 C[C@@H](NN)[C@@H](C)Nc1ccccc1 Amb27259065 [0,1,0,0,0,1|1,0,0]=3 7324 B13R1.135 C[C@H](NN)[C@@H](C)Nc1ccccc1 Amb27759543 [0,1,0,0,0,1|1,0,0]=3 7325 B13R1.348 CC(=N)NC(C)Cc1ccccc1 Amb27460929 [0,1,0,0,0,1|2,0,0]=4 7326 B13R1.348 CC(=O)CC(C)Sc1ccccc1 Amb32683051 [0,1,0,0,0,1|1,0,0]=3 7327 B13R1.348 CC(=O)CN(C)Cc1ccccc1 Amb18808988 [0,1,0,0,0,1|2,0,0]=4 7328 B13R1.348 CC(=O)C\C(C)=C\c1ccccc1 Amb17778970 [0,1,0,0,0,1|1,0,1]=4 7329 B13R1.348 CC(=O)C\C(C)=N/c1ccccc1 Amb2610547 [0,1,0,0,0,1|1,0,1]=4 7330 B13R1.348 CC(=O)NC(C)Cc1ccccc1 Amb8503527 [0,1,0,0,0,1|2,0,0]=4 7331 B13R1.348 CC(Br)CC(C)Nc1ccccn1 Amb28317989 [0,1,0,0,0,1|2,0,0]=4 7332 B13R1.348 CC(C)CC(Br)Cc1ccccc1 Amb18049557 [0,1,0,0,0,1|2,0,0]=4 7333 B13R1.348 CC(C)CC(C)Nc1ccccc1 Amb6685108 [0,1,0,0,0,1|1,0,0]=3 7334 B13R1.348 CC(C)CC(N)Cc1ccccc1 Amb2237290 [0,1,0,0,0,1|2,0,0]=4 7335 B13R1.348 CC(C)CC(N)Cc1ccccc1 Amb2592669 [0,1,0,0,0,1|2,0,0]=4 7336 B13R1.348 CC(C)CN(C)Cc1ccccc1 Amb17233316 [0,1,0,0,0,1|2,0,0]=4 7337 B13R1.348 CC(CC(=O)O)Cc1ccccc1 Amb17233403 [0,1,0,0,0,1|2,0,0]=4 7338 B13R1.348 CC(CC(=O)O)Nc1ccccc1 Amb9398389 [0,1,0,0,0,1|2,0,0]=4 7339 B13R1.348 CC(CC(=O)O)Oc1ccccc1 Amb9397751 [0,1,0,0,0,1|2,0,0]=4 7340 B13R1.348 CC(CC(N)=O)Nc1ccccc1 Amb17233441 [0,1,0,0,0,1|2,0,0]=4 7341 B13R1.348 CC(CC(N)=O)Oc1ccccc1 Amb17233539 [0,1,0,0,0,1|2,0,0]=4 7342 B13R1.348 CC(CN(C)C)Nc1ccccn1 Amb27618248 [0,1,0,0,0,1|1,0,0]=3 7343 B13R1.348 CC(CN(C)C)Nc1cnccn1 Amb27426979 [0,1,0,0,0,1|2,0,0]=4 7344 B13R1.348 CC(CS(C)=O)Nc1ccccn1 Amb28140939 [0,1,0,0,0,1|2,0,0]=4 7345 B13R1.348 CC(CS(C)=O)Nc1ccncc1 Amb27875799 [0,1,0,0,0,1|2,0,0]=4 7346 B13R1.348 CC(Cl)CN(C)Cc1ccccc1 Amb28454254 [0,1,0,0,0,1|2,0,0]=4 7347 B13R1.348 CC(N)CC(C)Nc1ccncc1 Amb27833927 [0,1,0,0,0,1|2,0,0]=4 7348 B13R1.348 CC(N)CN(C)Cc1ccccc1 Amb6662139 [0,1,0,0,0,1|2,0,0]=4 7349 B13R1.348 CC(O)CC(C)Nc1ccccc1 Amb27415748 [0,1,0,0,0,1|1,0,0]=3 7350 B13R1.348 CC(O)CN(C)Cc1ccccc1 Amb17138921 [0,1,0,0,0,1|2,0,0]=4 7351 B13R1.348 CN(C)CC(=O)Cc1ccccc1 Amb32662835 [0,1,0,0,0,1|1,0,1]=4 7352 B13R1.348 CN(C)CC(=O)Cc1ccccc1 Amb9661094 [0,1,0,0,0,1|1,0,1]=4 7353 B13R1.348 CN(C)CC(N)Cc1ccccc1 Amb34913780 [0,1,0,0,0,1|1,0,0]=3 7354 B13R1.348 CN(C)CC(N)Cc1ccccc1 Amb5493964 [0,1,0,0,0,1|1,0,0]=3 7355 B13R1.348 CN(C)C[C@@H](N)Cc1ccccc1 Amb34198855 [0,1,0,0,0,1|1,0,0]=3 7356 B13R1.348 CN(C)C[C@H](N)Cc1ccccc1 Amb34198854 [0,1,0,0,0,1|1,0,0]=3 7357 B13R1.348 CN(C)C\C(N)=N\c1ccccc1 Amb27430432 [0,1,0,0,0,1|1,0,1]=4 7358 B13R1.348 C[C@@H](CC(=O)O)Nc1ccccc1 Amb26519867 [0,1,0,0,0,1|2,0,0]=4 7359 B13R1.348 C[C@@H](N)CN(C)Cc1ccccc1 Amb18527668 [0,1,0,0,0,1|2,0,0]=4 7360 B13R1.348 C[C@@H](O)C[C@@H](C)Nc1ccccc1 Amb27412431 [0,1,0,0,0,1|1,0,0]=3 7361 B13R1.348 C[C@H](CC(=O)O)Nc1ccccc1 Amb8397199 [0,1,0,0,0,1|2,0,0]=4 7362 B13R1.348 C\C(=C/c1ccccc1)CC(C)Br Amb33476750 [0,1,0,0,0,1|1,0,1]=4 7363 B13R1.348 C\C(=C/c1ccccc1)CC(C)O Amb28190232 [0,1,0,0,0,1|1,0,1]=4 7364 B13R1.348 C\C(=C/c1ccccc1)CN(C)O Amb33476414 [0,1,0,0,0,1|0,0,1]=3 7365 B13R1.348 C\C(=C/c1ccccc1)C[C@@H](C)N Amb33476743 [0,1,0,0,0,1|1,0,1]=4 7366 B13R1.348 C\C(=C/c1ccccc1)C[C@@H](C)O Amb32954504 [0,1,0,0,0,1|1,0,1]=4 7367 B13R1.348 C\C(=C/c1ccccc1)C[C@H](C)N Amb33476746 [0,1,0,0,0,1|1,0,1]=4 7368 B13R1.348 C\C(=C/c1ccccc1)C[C@H](C)O Amb32953325 [0,1,0,0,0,1|1,0,1]=4 7369 B13R1.470 C=CCC(C)Nc1ccccc1N Amb27669595 [0,1,0,0,0,1|1,0,1]=4 7370 B13R1.470 CC(CC#N)Nc1ccccc1Br Amb17158704 [0,1,0,0,0,1|2,0,0]=4 7371 B13R1.470 CC(CC#N)Nc1ccccc1Cl Amb17139530 [0,1,0,0,0,1|2,0,0]=4 7372 B13R1.470 CC(CC#N)Nc1ccccc1F Amb17138850 [0,1,0,0,0,1|2,0,0]=4 7373 B13R1.470 CC(CC#N)Oc1ccccc1Br Amb17255070 [0,1,0,0,0,1|2,0,0]=4 7374 B13R1.470 CC(CC#N)Oc1ccccc1Cl Amb17236321 [0,1,0,0,0,1|2,0,0]=4 7375 B13R1.470 CC(CC#N)Oc1ccccc1F Amb17233520 [0,1,0,0,0,1|2,0,0]=4 7376 B13R1.470 CC(CC#N)Sc1ccccc1F Amb18321335 [0,1,0,0,0,1|2,0,0]=4 7377 B13R1.470 CC(CC#N)Sc1ccccc1N Amb19329903 [0,1,0,0,0,1|2,0,0]=4 7378 B13R1.470 CC(CCN)Cc1ccccc1Cl Amb17236688 [0,1,0,0,0,1|2,0,0]=4 7379 B13R1.470 CC(CCN)Cc1ccccc1F Amb17233826 [0,1,0,0,0,1|2,0,0]=4 7380 B13R1.470 CC(CCN)Oc1ccccc1Br Amb17256974 [0,1,0,0,0,1|2,0,0]=4 7381 B13R1.470 CC(CCN)Oc1ccccc1Cl Amb17237051 [0,1,0,0,0,1|2,0,0]=4 7382 B13R1.470 CC(CCN)Oc1ccccc1F Amb17234003 [0,1,0,0,0,1|2,0,0]=4 7383 B13R1.470 CC(CCO)Cc1ccccc1Cl Amb17236858 [0,1,0,0,0,1|2,0,0]=4 7384 B13R1.470 CC(CCO)Cc1ccccc1F Amb17233913 [0,1,0,0,0,1|2,0,0]=4 7385 B13R1.470 CC(CCO)Oc1ccccc1Br Amb17257490 [0,1,0,0,0,1|2,0,0]=4 7386 B13R1.470 CC(CCO)Oc1ccccc1Cl Amb17237187 [0,1,0,0,0,1|2,0,0]=4 7387 B13R1.470 CC(CCO)Oc1ccccc1F Amb17234068 [0,1,0,0,0,1|2,0,0]=4 7388 B13R1.470 CC(CNN)Oc1ccccc1Br Amb18579101 [0,1,0,0,0,1|1,0,0]=3 7389 B13R1.470 CC(CNN)Oc1ccccc1Cl Amb18066550 [0,1,0,0,0,1|1,0,0]=3 7390 B13R1.470 CC(CNN)Oc1ccccc1F Amb18564284 [0,1,0,0,0,1|1,0,0]=3 7391 B13R1.470 CCCC(C)Nc1ccccc1C Amb6701232 [0,1,0,0,0,1|1,0,0]=3 7392 B13R1.470 CCCC(C)Nc1ccccc1F Amb6697381 [0,1,0,0,0,1|1,0,0]=3 7393 B13R1.470 CCCC(C)Nc1cccnc1C Amb26322109 [0,1,0,0,0,1|2,0,0]=4 7394 B13R1.470 CCCC(C)Nc1cccnc1F Amb35725103 [0,1,0,0,0,1|2,0,0]=4 7395 B13R1.470 CCCC(C)Nc1cccnc1N Amb28280251 [0,1,0,0,0,1|2,0,0]=4 7396 B13R1.470 CCCC(C)Nc1ccncc1F Amb35655193 [0,1,0,0,0,1|2,0,0]=4 7397 B13R1.470 CCCC(C)Nc1cnccc1C Amb27873694 [0,1,0,0,0,1|2,0,0]=4 7398 B13R1.470 CCCC(C)Oc1ccccc1N Amb840083 [0,1,0,0,0,1|1,0,0]=3 7399 B13R1.470 CCCC(C)Oc1ccncc1N Amb33035747 [0,1,0,0,0,1|2,0,0]=4 7400 B13R1.470 CCCC(C)Oc1cnccc1N Amb33035533 [0,1,0,0,0,1|2,0,0]=4 7401 B13R1.470 CCCC(C)Oc1ncccc1N Amb33035347 [0,1,0,0,0,1|2,0,0]=4 7402 B13R1.470 CNCC(=O)Nc1ccccc1Br Amb2277697 [0,1,0,0,0,1|1,0,1]=4 7403 B13R1.470 CNCC(=O)Nc1ccccc1Br Amb2370683 [0,1,0,0,0,1|1,0,1]=4 7404 B13R1.470 CNCC(=O)Nc1ccccc1C Amb6251329 [0,1,0,0,0,1|1,0,1]=4 7405 B13R1.470 CNCC(=O)Nc1ccccc1Cl Amb2281752 [0,1,0,0,0,1|1,0,1]=4 7406 B13R1.470 CNCC(=O)Nc1ccccc1Cl Amb2370637 [0,1,0,0,0,1|1,0,1]=4 7407 B13R1.470 CNCC(=O)Nc1ccccc1I Amb7755136 [0,1,0,0,0,1|1,0,1]=4 7408 B13R1.470 CNCC(=O)Nc1ccccc1N Amb28291835 [0,1,0,0,0,1|1,0,1]=4 7409 B13R1.470 CNCC(O)Cc1ccccc1Br Amb18071609 [0,1,0,0,0,1|1,0,0]=3 7410 B13R1.470 CNCC(O)Cc1ccccc1C Amb17233563 [0,1,0,0,0,1|1,0,0]=3 7411 B13R1.470 CNCC(O)Cc1ccccc1Cl Amb17237032 [0,1,0,0,0,1|1,0,0]=3 7412 B13R1.470 CNCC(O)Cc1ccccc1F Amb17233986 [0,1,0,0,0,1|1,0,0]=3 7413 B13R1.470 CNC\C(C)=C\c1ccccc1C Amb27828991 [0,1,0,0,0,1|0,0,1]=3 7414 B13R1.470 CNC\C(C)=C\c1ccncc1C Amb28200625 [0,1,0,0,0,1|1,0,1]=4 7415 B13R1.470 COCC(C)Nc1ccccc1Br Amb18312244 [0,1,0,0,0,1|1,0,0]=3 7416 B13R1.470 COCC(C)Nc1ccccc1Cl Amb18312248 [0,1,0,0,0,1|1,0,0]=3 7417 B13R1.470 COCC(C)Nc1ccccc1F Amb19024321 [0,1,0,0,0,1|1,0,0]=3 7418 B13R1.470 COCC(C)Nc1ccccc1I Amb28381374 [0,1,0,0,0,1|1,0,0]=3 7419 B13R1.470 COCC(C)Nc1ccccc1N Amb7767687 [0,1,0,0,0,1|1,0,0]=3 7420 B13R1.470 COCC(C)Nc1cccnc1Br Amb28245180 [0,1,0,0,0,1|2,0,0]=4 7421 B13R1.470 COCC(C)Nc1cccnc1C Amb25993183 [0,1,0,0,0,1|2,0,0]=4 7422 B13R1.470 COCC(C)Nc1cccnc1F Amb35725110 [0,1,0,0,0,1|2,0,0]=4 7423 B13R1.470 COCC(C)Nc1ccncc1Br Amb28382409 [0,1,0,0,0,1|2,0,0]=4 7424 B13R1.470 COCC(C)Nc1cnccc1C Amb26425725 [0,1,0,0,0,1|2,0,0]=4 7425 B13R1.470 COCC(C)Nc1cnccc1N Amb28063164 [0,1,0,0,0,1|2,0,0]=4 7426 B13R1.470 COCC(C)Nc1ncccc1Br Amb19015765 [0,1,0,0,0,1|2,0,0]=4 7427 B13R1.470 COCC(C)Nc1ncccc1F Amb18314048 [0,1,0,0,0,1|2,0,0]=4 7428 B13R1.470 COCC(C)Oc1ccccc1N Amb9702192 [0,1,0,0,0,1|1,0,0]=3 7429 B13R1.470 COCC(C)Oc1ccncc1N Amb33035674 [0,1,0,0,0,1|2,0,0]=4 7430 B13R1.470 COCC(C)Oc1cnccc1N Amb33035465 [0,1,0,0,0,1|2,0,0]=4 7431 B13R1.470 COCC(C)Oc1ncccc1N Amb33035697 [0,1,0,0,0,1|2,0,0]=4 7432 B13R1.470 COC[C@@H](C)Nc1ccncc1Cl Amb27605158 [0,1,0,0,0,1|2,0,0]=4 7433 B13R1.470 COC[C@@H](C)Nc1ncccc1Br Amb27218766 [0,1,0,0,0,1|2,0,0]=4 7434 B13R1.470 CSCC(C)Nc1ccncc1Br Amb27236378 [0,1,0,0,0,1|2,0,0]=4 7435 B13R1.470 CSCC(C)Nc1ccncc1C Amb27985529 [0,1,0,0,0,1|2,0,0]=4 7436 B13R1.470 CSCC(C)Nc1ccncc1F Amb35655205 [0,1,0,0,0,1|2,0,0]=4 7437 B13R1.470 CSCC(C)Nc1ncccc1C Amb27414750 [0,1,0,0,0,1|2,0,0]=4 7438 B13R1.470 CSCC(C)Nc1ncccc1F Amb27865385 [0,1,0,0,0,1|2,0,0]=4 7439 B13R1.470 CSCC(C)Nc1ncccc1I Amb27769466 [0,1,0,0,0,1|2,0,0]=4 7440 B13R1.470 CSCC(C)Nc1ncccc1N Amb27791576 [0,1,0,0,0,1|2,0,0]=4 7441 B13R1.470 Cc1ccccc1CC(C)CCN Amb17233327 [0,1,0,0,0,1|2,0,0]=4 7442 B13R1.470 Cc1ccccc1CC(C)CCO Amb17233450 [0,1,0,0,0,1|2,0,0]=4 7443 B13R1.470 Cc1ccccc1NC(C)CC#N Amb17138748 [0,1,0,0,0,1|2,0,0]=4 7444 B13R1.470 Cc1ccccc1OC(C)CC#N Amb17233108 [0,1,0,0,0,1|2,0,0]=4 7445 B13R1.470 Cc1ccccc1OC(C)CCN Amb17233610 [0,1,0,0,0,1|2,0,0]=4 7446 B13R1.470 Cc1ccccc1OC(C)CCO Amb17233713 [0,1,0,0,0,1|2,0,0]=4 7447 B13R1.470 Cc1ccccc1OC(C)CNN Amb18065973 [0,1,0,0,0,1|1,0,0]=3 7448 B13R1.1327 C#CCC(C)(O)Cc1ccccc1 Amb27219293 [0,1,0,0,0,1|1,0,1]=4 7449 B13R1.1327 C=CCC(C)(C)Nc1ccccc1 Amb27224797 [0,1,0,0,0,1|1,0,1]=4 7450 B13R1.1327 CC#CC(C)(O)Cc1ccccc1 Amb28281247 [0,1,0,0,0,1|1,0,1]=4 7451 B13R1.1327 CC(C)(CC#N)Oc1ccccc1 Amb17233106 [0,1,0,0,0,1|2,0,0]=4 7452 B13R1.1327 CC(C)(CC=O)Nc1ccccc1 Amb8392387 [0,1,0,0,0,1|2,0,0]=4 7453 B13R1.1327 CC(C)(CC=O)Sc1ccccc1 Amb18130120 [0,1,0,0,0,1|2,0,0]=4 7454 B13R1.1327 CC(C)(CCN)Cc1ccccc1 Amb17335193 [0,1,0,0,0,1|2,0,0]=4 7455 B13R1.1327 CC(C)(CCN)Oc1ccccc1 Amb17233604 [0,1,0,0,0,1|2,0,0]=4 7456 B13R1.1327 CC(C)(CCO)Cc1ccccc1 Amb17335249 [0,1,0,0,0,1|2,0,0]=4 7457 B13R1.1327 CC(C)(CON)Cc1ccccc1 Amb33224089 [0,1,0,0,0,1|2,0,0]=4 7458 B13R1.1327 CC(N)(CCO)Cc1ccccc1 Amb32946695 [0,1,0,0,0,1|2,0,0]=4 7459 B13R1.1327 CC(O)(CC#N)Cc1ccccc1 Amb27450692 [0,1,0,0,0,1|2,0,0]=4 7460 B13R1.1327 CC(O)(CCN)Cc1ccccc1 Amb32693484 [0,1,0,0,0,1|2,0,0]=4 7461 B13R1.1327 CCCC(C)(C)Nc1cccnc1 Amb27782941 [0,1,0,0,0,1|2,0,0]=4 7462 B13R1.1327 CCCC(C)(C)Nc1ccncc1 Amb27490507 [0,1,0,0,0,1|2,0,0]=4 7463 B13R1.1327 CNCC(C)(O)Cc1ccccc1 Amb17082168 [0,1,0,0,0,1|0,0,0]=2 7464 B13R1.1327 CNCC(C)(O)Cc1ccccn1 Amb17082165 [0,1,0,0,0,1|1,0,0]=3 7465 B13R1.1327 CNCC(C)(O)Cc1cccnc1 Amb17082166 [0,1,0,0,0,1|1,0,0]=3 7466 B13R1.1327 CNCC(C)(O)Cc1ccncc1 Amb17082167 [0,1,0,0,0,1|1,0,0]=3 7467 B13R1.1327 COCC(C)(C)Nc1ccccn1 Amb27798084 [0,1,0,0,0,1|2,0,0]=4 7468 B13R1.1 C#CCC(NC)c1ccc(Br)cc1 Amb27608225 [0,2,0,0,0,0|1,0,1]=4 7469 B13R1.1 C#CCC(NC)c1ccc(Cl)cc1 Amb18330433 [0,2,0,0,0,0|1,0,1]=4 7470 B13R1.1 C#CCC(NC)c1ccc(F)cc1 Amb18808963 [0,2,0,0,0,0|1,0,1]=4 7471 B13R1.1 CCC(CCN)c1ccc(Br)cc1 Amb5739036 [0,2,0,0,0,0|2,0,0]=4 7472 B13R1.1 CCC(CCN)c1ccc(C)cc1 Amb5739027 [0,2,0,0,0,0|2,0,0]=4 7473 B13R1.1 CCC(CCN)c1ccc(Cl)cc1 Amb5739035 [0,2,0,0,0,0|2,0,0]=4 7474 B13R1.1 CCC(CCN)c1ccc(F)cc1 Amb5739034 [0,2,0,0,0,0|2,0,0]=4 7475 B13R1.1 CCC(CCO)c1ccc(Br)cc1 Amb17256436 [0,2,0,0,0,0|2,0,0]=4 7476 B13R1.1 CCC(CCO)c1ccc(C)cc1 Amb17233460 [0,2,0,0,0,0|2,0,0]=4 7477 B13R1.1 CCC(CCO)c1ccc(Cl)cc1 Amb17236865 [0,2,0,0,0,0|2,0,0]=4 7478 B13R1.1 CCC(CCO)c1ccc(F)cc1 Amb17233918 [0,2,0,0,0,0|2,0,0]=4 7479 B13R1.1 CCC(CNC)c1ccc(Br)cc1 Amb17255980 [0,2,0,0,0,0|0,0,0]=2 7480 B13R1.1 CCC(CNC)c1ccc(C)cc1 Amb17233338 [0,2,0,0,0,0|0,0,0]=2 7481 B13R1.1 CCC(CNC)c1ccc(Cl)cc1 Amb17236699 [0,2,0,0,0,0|0,0,0]=2 7482 B13R1.1 CCC(CNC)c1ccc(F)cc1 Amb17233833 [0,2,0,0,0,0|0,0,0]=2 7483 B13R1.1 CCCC(C#N)c1ccc(Br)cc1 Amb17254043 [0,2,0,0,0,0|1,0,1]=4 7484 B13R1.1 CCCC(C#N)c1ccc(C)cc1 Amb17232974 [0,2,0,0,0,0|1,0,1]=4 7485 B13R1.1 CCCC(C#N)c1ccc(Cl)cc1 Amb17235861 [0,2,0,0,0,0|1,0,1]=4 7486 B13R1.1 CCCC(C#N)c1ccc(F)cc1 Amb17233265 [0,2,0,0,0,0|1,0,1]=4 7487 B13R1.1 CCCC(CBr)c1ccc(F)cc1 Amb17257511 [0,2,0,0,0,0|1,0,0]=3 7488 B13R1.1 CCCC(CCl)c1ccc(C)cc1 Amb17236524 [0,2,0,0,0,0|1,0,0]=3 7489 B13R1.1 CCCC(CCl)c1ccc(F)cc1 Amb17237207 [0,2,0,0,0,0|1,0,0]=3 7490 B13R1.1 CCCC(CN)c1ccc(Br)cc1 Amb17255981 [0,2,0,0,0,0|1,0,0]=3 7491 B13R1.1 CCCC(CN)c1ccc(C)cc1 Amb13881881 [0,2,0,0,0,0|1,0,0]=3 7492 B13R1.1 CCCC(CN)c1ccc(Cl)cc1 Amb17236700 [0,2,0,0,0,0|1,0,0]=3 7493 B13R1.1 CCCC(CN)c1ccc(F)cc1 Amb13881880 [0,2,0,0,0,0|1,0,0]=3 7494 B13R1.1 CCCC(CN)c1ccc(F)cc1 Amb22900953 [0,2,0,0,0,0|1,0,0]=3 7495 B13R1.1 CCCC(CO)c1ccc(Br)cc1 Amb17256435 [0,2,0,0,0,0|1,0,0]=3 7496 B13R1.1 CCCC(CO)c1ccc(C)cc1 Amb17233459 [0,2,0,0,0,0|1,0,0]=3 7497 B13R1.1 CCCC(CO)c1ccc(Cl)cc1 Amb17236864 [0,2,0,0,0,0|1,0,0]=3 7498 B13R1.1 CCCC(CO)c1ccc(F)cc1 Amb17233917 [0,2,0,0,0,0|1,0,0]=3 7499 B13R1.1 CCCC(NC)c1ccc(Br)cc1 Amb22042490 [0,2,0,0,0,0|1,0,0]=3 7500 B13R1.1 CCCC(NC)c1ccc(Br)cc1 Amb5716088 [0,2,0,0,0,0|1,0,0]=3 7501 B13R1.1 CCCC(NC)c1ccc(F)cc1 Amb5725113 [0,2,0,0,0,0|1,0,0]=3 7502 B13R1.1 CCNC(CC)c1ccc(Br)cc1 Amb5716087 [0,2,0,0,0,0|2,0,0]=4 7503 B13R1.1 CCNC(CC)c1ccc(Br)cc1 Amb9725287 [0,2,0,0,0,0|2,0,0]=4 7504 B13R1.1 CCNC(CC)c1ccc(C)cc1 Amb10610169 [0,2,0,0,0,0|2,0,0]=4 7505 B13R1.1 CCNC(CC)c1ccc(C)cc1 Amb9721749 [0,2,0,0,0,0|2,0,0]=4 7506 B13R1.1 CCOC(CBr)c1ccc(Br)cc1 Amb33349672 [0,2,0,0,0,0|2,0,0]=4 7507 B13R1.1 CCOC(CBr)c1ccc(C)cc1 Amb32710528 [0,2,0,0,0,0|2,0,0]=4 7508 B13R1.1 CCOC(CBr)c1ccc(Cl)cc1 Amb33348169 [0,2,0,0,0,0|2,0,0]=4 7509 B13R1.1 CCOC(CBr)c1ccc(F)cc1 Amb33348044 [0,2,0,0,0,0|2,0,0]=4 7510 B13R1.1 CCOC(CI)c1ccc(Br)cc1 Amb33347954 [0,2,0,0,0,0|2,0,0]=4 7511 B13R1.1 CCOC(CI)c1ccc(C)cc1 Amb33349010 [0,2,0,0,0,0|2,0,0]=4 7512 B13R1.1 CCOC(CI)c1ccc(Cl)cc1 Amb32710563 [0,2,0,0,0,0|2,0,0]=4 7513 B13R1.1 CCOC(CI)c1ccc(F)cc1 Amb33349165 [0,2,0,0,0,0|2,0,0]=4 7514 B13R1.1 CCOC(CN)c1ccc(Br)cc1 Amb17605996 [0,2,0,0,0,0|2,0,0]=4 7515 B13R1.1 CCOC(CN)c1ccc(C)cc1 Amb17606011 [0,2,0,0,0,0|2,0,0]=4 7516 B13R1.1 CCOC(CN)c1ccc(Cl)cc1 Amb17606012 [0,2,0,0,0,0|2,0,0]=4 7517 B13R1.1 CC\C(=N\NC)c1ccc(Br)cc1 Amb27588266 [0,2,0,0,0,0|1,0,1]=4 7518 B13R1.1 CC\C(=N\NC)c1ccc(Cl)cc1 Amb27761210 [0,2,0,0,0,0|1,0,1]=4 7519 B13R1.1 CNC(CCO)c1ccc(Br)cc1 Amb18071616 [0,2,0,0,0,0|2,0,0]=4 7520 B13R1.1 CNC(CCO)c1ccc(C)cc1 Amb18065869 [0,2,0,0,0,0|2,0,0]=4 7521 B13R1.1 CNC(CCO)c1ccc(Cl)cc1 Amb18066520 [0,2,0,0,0,0|2,0,0]=4 7522 B13R1.1 CNC(CCO)c1ccc(F)cc1 Amb18066112 [0,2,0,0,0,0|2,0,0]=4 7523 B13R1.1 CNC(COC)c1ccc(Cl)cc1 Amb19018141 [0,2,0,0,0,0|1,0,0]=3 7524 B13R1.1 CNC(COC)c1ccc(F)cc1 Amb19018146 [0,2,0,0,0,0|1,0,0]=3 7525 B13R1.1 CNCC(OC)c1ccc(Br)cc1 Amb17605855 [0,2,0,0,0,0|0,0,0]=2 7526 B13R1.1 CNCC(OC)c1ccc(C)cc1 Amb17605881 [0,2,0,0,0,0|0,0,0]=2 7527 B13R1.1 CNCC(OC)c1ccc(Cl)cc1 Amb17605882 [0,2,0,0,0,0|0,0,0]=2 7528 B13R1.1 COC(CCN)c1ccc(Br)cc1 Amb17349687 [0,2,0,0,0,0|2,0,0]=4 7529 B13R1.1 COC(CCN)c1ccc(C)cc1 Amb17335347 [0,2,0,0,0,0|2,0,0]=4 7530 B13R1.1 COC(CCN)c1ccc(Cl)cc1 Amb17337498 [0,2,0,0,0,0|2,0,0]=4 7531 B13R1.1 COC(CCN)c1ccc(F)cc1 Amb17335622 [0,2,0,0,0,0|2,0,0]=4 7532 B13R1.1 COCC(CBr)c1ccc(Br)cc1 Amb32661695 [0,2,0,0,0,0|1,0,0]=3 7533 B13R1.1 COCC(CN)c1ccc(Cl)cc1 Amb32662784 [0,2,0,0,0,0|1,0,0]=3 7534 B13R1.1 C\C=C\C(CC)c1ccc(N)cc1 Amb27180028 [0,2,0,0,0,0|1,0,1]=4 7535 B13R1.1 Cc1ccc(C(CN)CCN)cc1 Amb17233491 [0,2,0,0,0,0|2,0,0]=4 7536 B13R1.1 Cc1ccc(C(CN)CCO)cc1 Amb17233572 [0,2,0,0,0,0|2,0,0]=4 7537 B13R1.1 NCC(CCO)c1ccc(Br)cc1 Amb17256963 [0,2,0,0,0,0|2,0,0]=4 7538 B13R1.1 NCC(CCO)c1ccc(Cl)cc1 Amb17237041 [0,2,0,0,0,0|2,0,0]=4 7539 B13R1.1 NCC(CCO)c1ccc(F)cc1 Amb17233991 [0,2,0,0,0,0|2,0,0]=4 7540 B13R1.1 NCCC(CN)c1ccc(Br)cc1 Amb17256468 [0,2,0,0,0,0|2,0,0]=4 7541 B13R1.1 NCCC(CN)c1ccc(Cl)cc1 Amb17236899 [0,2,0,0,0,0|2,0,0]=4 7542 B13R1.1 NCCC(CN)c1ccc(F)cc1 Amb17233929 [0,2,0,0,0,0|2,0,0]=4 7543 B13R1.2 C#CCC(NC)c1cccc(Br)c1 Amb27231394 [0,2,0,0,0,0|1,0,1]=4 7544 B13R1.2 C#CCC(NC)c1cccc(C)c1 Amb18808005 [0,2,0,0,0,0|1,0,1]=4 7545 B13R1.2 C#CCC(NC)c1cccc(F)c1 Amb18808964 [0,2,0,0,0,0|1,0,1]=4 7546 B13R1.2 CCC(CCN)c1cccc(C)c1 Amb17233364 [0,2,0,0,0,0|2,0,0]=4 7547 B13R1.2 CCC(CCN)c1cccc(Cl)c1 Amb17236709 [0,2,0,0,0,0|2,0,0]=4 7548 B13R1.2 CCC(CCN)c1cccc(F)c1 Amb17233844 [0,2,0,0,0,0|2,0,0]=4 7549 B13R1.2 CCC(CCO)c1cccc(C)c1 Amb17233479 [0,2,0,0,0,0|2,0,0]=4 7550 B13R1.2 CCC(CCO)c1cccc(Cl)c1 Amb17236881 [0,2,0,0,0,0|2,0,0]=4 7551 B13R1.2 CCC(CCO)c1cccc(F)c1 Amb17233925 [0,2,0,0,0,0|2,0,0]=4 7552 B13R1.2 CCCC(CN)c1cccc(C)c1 Amb17233361 [0,2,0,0,0,0|1,0,0]=3 7553 B13R1.2 CCCC(CN)c1cccc(Cl)c1 Amb17236706 [0,2,0,0,0,0|1,0,0]=3 7554 B13R1.2 CCCC(CN)c1cccc(F)c1 Amb17233841 [0,2,0,0,0,0|1,0,0]=3 7555 B13R1.2 CCOC(CBr)c1cccc(Br)c1 Amb32710429 [0,2,0,0,0,0|2,0,0]=4 7556 B13R1.2 CCOC(CBr)c1cccc(C)c1 Amb32710549 [0,2,0,0,0,0|2,0,0]=4 7557 B13R1.2 CCOC(CBr)c1cccc(Cl)c1 Amb33348386 [0,2,0,0,0,0|2,0,0]=4 7558 B13R1.2 CCOC(CBr)c1cccc(F)c1 Amb33347816 [0,2,0,0,0,0|2,0,0]=4 7559 B13R1.2 CCOC(CI)c1cccc(Br)c1 Amb33348068 [0,2,0,0,0,0|2,0,0]=4 7560 B13R1.2 CCOC(CI)c1cccc(C)c1 Amb33348848 [0,2,0,0,0,0|2,0,0]=4 7561 B13R1.2 CCOC(CI)c1cccc(Cl)c1 Amb33347840 [0,2,0,0,0,0|2,0,0]=4 7562 B13R1.2 CCOC(CI)c1cccc(F)c1 Amb33349480 [0,2,0,0,0,0|2,0,0]=4 7563 B13R1.2 CCOC(CN)c1cccc(Br)c1 Amb17606016 [0,2,0,0,0,0|2,0,0]=4 7564 B13R1.2 CCOC(CN)c1cccc(Cl)c1 Amb17605998 [0,2,0,0,0,0|2,0,0]=4 7565 B13R1.2 CCOC(CN)c1cccc(F)c1 Amb17606013 [0,2,0,0,0,0|2,0,0]=4 7566 B13R1.2 CC\C(=N\NC)c1cccc(Cl)c1 Amb27396795 [0,2,0,0,0,0|1,0,1]=4 7567 B13R1.2 CNCC(CN)c1cccc(C)c1 Amb33230577 [0,2,0,0,0,0|0,0,0]=2 7568 B13R1.2 CNCC(OC)c1cccc(Br)c1 Amb17605886 [0,2,0,0,0,0|0,0,0]=2 7569 B13R1.2 CNCC(OC)c1cccc(Cl)c1 Amb17605863 [0,2,0,0,0,0|0,0,0]=2 7570 B13R1.2 CNCC(OC)c1cccc(F)c1 Amb17605883 [0,2,0,0,0,0|0,0,0]=2 7571 B13R1.2 Cc1cccc(C(CN)CCN)c1 Amb17233490 [0,2,0,0,0,0|2,0,0]=4 7572 B13R1.2 Cc1cccc(C(CN)CCO)c1 Amb17233569 [0,2,0,0,0,0|2,0,0]=4 7573 B13R1.2 NCC(CCO)c1cccc(Br)c1 Amb17256960 [0,2,0,0,0,0|2,0,0]=4 7574 B13R1.2 NCC(CCO)c1cccc(Cl)c1 Amb17237038 [0,2,0,0,0,0|2,0,0]=4 7575 B13R1.2 NCCC(CN)c1cccc(Br)c1 Amb17256467 [0,2,0,0,0,0|2,0,0]=4 7576 B13R1.2 NCCC(CN)c1cccc(Cl)c1 Amb17236898 [0,2,0,0,0,0|2,0,0]=4 7577 B13R1.26 C=CCNC(CC)c1ccccc1 Amb6683839 [0,2,0,0,0,0|1,0,1]=4 7578 B13R1.26 CC#CCC(NC)c1cccnc1 Amb18804165 [0,2,0,0,0,0|2,0,0]=4 7579 B13R1.26 CCC(NCCO)c1ccccc1 Amb7809214 [0,2,0,0,0,0|2,0,0]=4 7580 B13R1.26 CCC(OCCBr)c1ccccc1 Amb32664681 [0,2,0,0,0,0|2,0,0]=4 7581 B13R1.26 CCC(OCCN)c1ccccc1 Amb32584154 [0,2,0,0,0,0|2,0,0]=4 7582 B13R1.26 CCC(OCCO)c1ccccc1 Amb28556150 [0,2,0,0,0,0|2,0,0]=4 7583 B13R1.26 CCCCC(C#N)c1ccccc1 Amb4036617 [0,2,0,0,0,0|1,0,1]=4 7584 B13R1.26 CCCCC(NC)c1ccccc1 Amb9341514 [0,2,0,0,0,0|1,0,0]=3 7585 B13R1.26 CCCCC(NC)c1cccnc1 Amb10607966 [0,2,0,0,0,0|2,0,0]=4 7586 B13R1.26 CCCCC(NC)c1cccnc1 Amb13949195 [0,2,0,0,0,0|2,0,0]=4 7587 B13R1.26 CCCNC(C#N)c1ccccc1 Amb7767175 [0,2,0,0,0,0|1,0,1]=4 7588 B13R1.26 CCCNC(CC)c1ccccc1 Amb9720276 [0,2,0,0,0,0|1,0,0]=3 7589 B13R1.26 CCCNC(CO)c1ccccc1 Amb18180973 [0,2,0,0,0,0|1,0,0]=3 7590 B13R1.26 CCCOC(CBr)c1ccccc1 Amb33348514 [0,2,0,0,0,0|1,0,0]=3 7591 B13R1.26 CCCOC(CI)c1ccccc1 Amb33349130 [0,2,0,0,0,0|1,0,0]=3 7592 B13R1.26 CCC\N=C(\NC)c1ccccc1 Amb27253556 [0,2,0,0,0,0|1,0,1]=4 7593 B13R1.26 CCN(CCCN)c1ccccc1 Amb1216937 [0,2,0,0,0,0|2,0,0]=4 7594 B13R1.26 CCNCC(CC)c1ccccc1 Amb8841504 [0,2,0,0,0,0|0,0,0]=2 7595 B13R1.26 CNC(CCOC)c1ccccc1 Amb18178740 [0,2,0,0,0,0|1,0,0]=3 7596 B13R1.26 COC(C#CCO)c1ccccc1 Amb27958529 [0,2,0,0,0,0|1,0,1]=4 7597 B13R1.26 COC(CCC#N)c1ccccc1 Amb4010687 [0,2,0,0,0,0|1,0,1]=4 7598 B13R1.26 NCC(OCCO)c1ccccc1 Amb23580589 [0,2,0,0,0,0|2,0,0]=4 7599 B13R1.173 CCC(CC#N)c1ccccc1O Amb27840896 [0,2,0,0,0,0|2,0,0]=4 7600 B13R1.173 CCC(CCN)c1ccccc1C Amb17233359 [0,2,0,0,0,0|2,0,0]=4 7601 B13R1.173 CCC(CCN)c1ccccc1Cl Amb17236704 [0,2,0,0,0,0|2,0,0]=4 7602 B13R1.173 CCC(CCN)c1ccccc1F Amb17233839 [0,2,0,0,0,0|2,0,0]=4 7603 B13R1.173 CCC(CCO)c1ccccc1C Amb17233477 [0,2,0,0,0,0|2,0,0]=4 7604 B13R1.173 CCC(CCO)c1ccccc1Cl Amb17236879 [0,2,0,0,0,0|2,0,0]=4 7605 B13R1.173 CCC(CCO)c1ccccc1F Amb17233922 [0,2,0,0,0,0|2,0,0]=4 7606 B13R1.173 CCCC(CN)c1ccccc1C Amb17233356 [0,2,0,0,0,0|1,0,0]=3 7607 B13R1.173 CCCC(CN)c1ccccc1Cl Amb17236701 [0,2,0,0,0,0|1,0,0]=3 7608 B13R1.173 CCCC(CN)c1ccccc1F Amb17233836 [0,2,0,0,0,0|1,0,0]=3 7609 B13R1.173 CCOC(CBr)c1ccccc1Br Amb32710281 [0,2,0,0,0,0|2,0,0]=4 7610 B13R1.173 CCOC(CBr)c1ccccc1C Amb32710406 [0,2,0,0,0,0|2,0,0]=4 7611 B13R1.173 CCOC(CBr)c1ccccc1Cl Amb33348551 [0,2,0,0,0,0|2,0,0]=4 7612 B13R1.173 CCOC(CBr)c1ccccc1F Amb33347930 [0,2,0,0,0,0|2,0,0]=4 7613 B13R1.173 CCOC(CI)c1ccccc1Br Amb33348092 [0,2,0,0,0,0|2,0,0]=4 7614 B13R1.173 CCOC(CI)c1ccccc1C Amb33348828 [0,2,0,0,0,0|2,0,0]=4 7615 B13R1.173 CCOC(CI)c1ccccc1Cl Amb32710590 [0,2,0,0,0,0|2,0,0]=4 7616 B13R1.173 CCOC(CI)c1ccccc1F Amb33349334 [0,2,0,0,0,0|2,0,0]=4 7617 B13R1.173 CCOC(CN)c1ccccc1C Amb17606025 [0,2,0,0,0,0|2,0,0]=4 7618 B13R1.173 CCOC(CN)c1ccccc1Cl Amb17606018 [0,2,0,0,0,0|2,0,0]=4 7619 B13R1.173 CCOC(CN)c1ccccc1F Amb17606019 [0,2,0,0,0,0|2,0,0]=4 7620 B13R1.173 CNC(CSC)c1ccccc1Cl Amb19028865 [0,2,0,0,0,0|1,0,0]=3 7621 B13R1.173 CNCC(OC)c1ccccc1C Amb17605895 [0,2,0,0,0,0|0,0,0]=2 7622 B13R1.173 CNCC(OC)c1ccccc1Cl Amb17605888 [0,2,0,0,0,0|0,0,0]=2 7623 B13R1.173 CNCC(OC)c1ccccc1F Amb17605889 [0,2,0,0,0,0|0,0,0]=2 7624 B13R1.173 C\C=C\C(CC)c1ccccc1N Amb26601142 [0,2,0,0,0,0|1,0,1]=4 7625 B13R1.173 Cc1ccccc1C(CN)CCN Amb17233489 [0,2,0,0,0,0|2,0,0]=4 7626 B13R1.173 Cc1ccccc1C(CN)CCO Amb17233565 [0,2,0,0,0,0|2,0,0]=4 7627 B13R1.173 N#CCC(CO)c1ccccc1F Amb28281852 [0,2,0,0,0,0|2,0,0]=4 7628 B13R1.173 N#CC[C@@H](CO)c1ccccc1F Amb28138815 [0,2,0,0,0,0|2,0,0]=4 7629 B13R1.173 NCC(CCO)c1ccccc1Cl Amb17237034 [0,2,0,0,0,0|2,0,0]=4 7630 B13R1.173 NCC(CCO)c1ccccc1F Amb17233988 [0,2,0,0,0,0|2,0,0]=4 7631 B13R1.173 NCCC(CN)c1ccccc1Cl Amb17236897 [0,2,0,0,0,0|2,0,0]=4 7632 B13R1.173 NCCC(CN)c1ccccc1F Amb17233928 [0,2,0,0,0,0|2,0,0]=4 7633 B13R1.398 CC=C=C(CNC)c1ccccc1 Amb28132788 [0,2,0,0,0,0|0,0,1]=3 7634 B13R1.398 CCCP(CCC)c1ccccc1 Amb4017806 [0,2,0,0,0,0|2,0,0]=4 7635 B13R1.398 CCOC(CCCl)c1ccccc1 Amb24093905 [0,2,0,0,0,0|2,0,0]=4 7636 B13R1.398 CCOC(CNC)c1ccccc1 Amb17605900 [0,2,0,0,0,0|0,0,0]=2 7637 B13R1.398 CCOC(OCC)c1ccccc1 Amb10561865 [0,2,0,0,0,0|2,0,0]=4 7638 B13R1.398 NCCC(CCO)c1ccccc1 Amb22643041 [0,2,0,0,0,0|2,0,0]=4 7639 B13R1.398 OCCC(CCO)c1ccccc1 Amb22713413 [0,2,0,0,0,0|2,0,0]=4 7640 B13R1.402 C#CCC(C)(C#N)c1ccccc1 Amb35711321 [0,2,0,0,0,0|1,0,1]=4 7641 B13R1.402 C#CCC(C)(C=O)c1ccccc1 Amb33495020 [0,2,0,0,0,0|1,0,1]=4 7642 B13R1.402 C#CCC(F)(CN)c1ccccc1 Amb27772494 [0,2,0,0,0,0|1,0,1]=4 7643 B13R1.402 C=CCC(C)(C=O)c1ccccc1 Amb18127295 [0,2,0,0,0,0|1,0,1]=4 7644 B13R1.402 CC#CC(O)(CCl)c1ccccc1 Amb28365863 [0,2,0,0,0,0|1,0,1]=4 7645 B13R1.402 CC(C#N)(CC=O)c1ccccc1 Amb27605820 [0,2,0,0,0,0|2,0,0]=4 7646 B13R1.402 CC(C#N)(CCCl)c1ccccc1 Amb18651639 [0,2,0,0,0,0|2,0,0]=4 7647 B13R1.402 CC(C#N)(CCF)c1ccccc1 Amb35711138 [0,2,0,0,0,0|2,0,0]=4 7648 B13R1.402 CC(C=O)(CCCl)c1ccccc1 Amb32943432 [0,2,0,0,0,0|2,0,0]=4 7649 B13R1.402 CC(C=O)(CCF)c1ccccc1 Amb33503878 [0,2,0,0,0,0|2,0,0]=4 7650 B13R1.402 CC(C=O)(CCO)c1ccccc1 Amb33495093 [0,2,0,0,0,0|2,0,0]=4 7651 B13R1.402 CC(CO)(CC#N)c1ccccc1 Amb27833717 [0,2,0,0,0,0|2,0,0]=4 7652 B13R1.402 CCC(O)(CC#N)c1ccccc1 Amb28043609 [0,2,0,0,0,0|2,0,0]=4 7653 B13R1.402 CCC(O)(CCN)c1ccccc1 Amb18194407 [0,2,0,0,0,0|2,0,0]=4 7654 B13R1.402 CCC(O)(CNC)c1ccccc1 Amb17138917 [0,2,0,0,0,0|0,0,0]=2 7655 B13R1.402 CCCC(C)(C#N)c1ccccc1 Amb35702083 [0,2,0,0,0,0|1,0,0]=3 7656 B13R1.402 CCCC(C)(C=O)c1ccccc1 Amb33503697 [0,2,0,0,0,0|1,0,0]=3 7657 B13R1.402 CCCC(O)(CN)c1ccccc1 Amb19031375 [0,2,0,0,0,0|1,0,0]=3 7658 B13R1.402 CCNC(C)(C#N)c1ccccc1 Amb24113639 [0,2,0,0,0,0|2,0,0]=4 7659 B13R1.402 CCOC(C)(CBr)c1ccccc1 Amb32710258 [0,2,0,0,0,0|2,0,0]=4 7660 B13R1.402 CCOC(C)(CI)c1ccccc1 Amb33348660 [0,2,0,0,0,0|2,0,0]=4 7661 B13R1.402 CCSC(C)(C#N)c1ccccc1 Amb17595005 [0,2,0,0,0,0|2,0,0]=4 7662 B13R1.402 COCC(C)(C#N)c1ccccc1 Amb17594447 [0,2,0,0,0,0|1,0,0]=3 7663 B13R1.402 COCC(C)(C=O)c1ccccc1 Amb32943564 [0,2,0,0,0,0|1,0,0]=3 7664 B13R1.402 COCC(N)(CO)c1ccccc1 Amb33330683 [0,2,0,0,0,0|1,0,0]=3 7665 B13R1.402 COCC(N)(CO)c1ccccc1 Amb33330685 [0,2,0,0,0,0|1,0,0]=3 7666 B13R1.405 C#CCC(c1ccccc1)C(C)C Amb33175647 [0,2,0,0,0,0|1,0,1]=4 7667 B13R1.405 C#CCC(c1ccccc1)N(C)C Amb27769554 [0,2,0,0,0,0|1,0,1]=4 7668 B13R1.405 C=CCC(C(C)=O)c1ccccc1 Amb3987749 [0,2,0,0,0,0|1,0,1]=4 7669 B13R1.405 CC(=O)C(CC#N)c1ccccc1 Amb4376268 [0,2,0,0,0,0|2,0,0]=4 7670 B13R1.405 CC(C)C(CC#N)c1ccccc1 Amb33175637 [0,2,0,0,0,0|2,0,0]=4 7671 B13R1.405 CC(C)C(CC=O)c1ccccc1 Amb18647985 [0,2,0,0,0,0|2,0,0]=4 7672 B13R1.405 CC(C)C(CCBr)c1ccccc1 Amb17255496 [0,2,0,0,0,0|2,0,0]=4 7673 B13R1.405 CC(C)C(CCCl)c1ccccc1 Amb17236523 [0,2,0,0,0,0|2,0,0]=4 7674 B13R1.405 CC(C)C(CCN)c1ccccc1 Amb5739066 [0,2,0,0,0,0|2,0,0]=4 7675 B13R1.405 CC(C)C(CCO)c1ccccc1 Amb17233457 [0,2,0,0,0,0|2,0,0]=4 7676 B13R1.405 CC(C)C(CCS)c1ccccc1 Amb33175872 [0,2,0,0,0,0|2,0,0]=4 7677 B13R1.405 CC(C)C(CNN)c1ccccc1 Amb33175597 [0,2,0,0,0,0|1,0,0]=3 7678 B13R1.405 CC(C)C(CNO)c1ccccc1 Amb33081984 [0,2,0,0,0,0|1,0,0]=3 7679 B13R1.405 CC(C)C(CON)c1ccccc1 Amb33175600 [0,2,0,0,0,0|2,0,0]=4 7680 B13R1.405 CC(O)C(CC#N)c1ccccc1 Amb27632823 [0,2,0,0,0,0|2,0,0]=4 7681 B13R1.405 CCCC(C(=O)O)c1ccccc1 Amb374793 [0,2,0,0,0,0|1,0,1]=4 7682 B13R1.405 CN(C)C(CCCl)c1ccccc1 Amb24117903 [0,2,0,0,0,0|2,0,0]=4 7683 B13R1.405 CN(C)C(CCN)c1ccccc1 Amb19373168 [0,2,0,0,0,0|2,0,0]=4 7684 B13R1.405 CN(C)C(CCN)c1ccccc1 Amb5758724 [0,2,0,0,0,0|2,0,0]=4 7685 B13R1.405 CN(C)[C@@H](CCO)c1ccccc1 Amb8396891 [0,2,0,0,0,0|2,0,0]=4 7686 B13R1.405 CNCC(c1ccccc1)C(C)C Amb17233323 [0,2,0,0,0,0|0,0,0]=2 7687 B13R1.405 CNCC(c1ccccc1)N(C)C Amb5785559 [0,2,0,0,0,0|0,0,0]=2 7688 B13R1.405 CSCC(C(=O)O)c1ccccc1 Amb19037338 [0,2,0,0,0,0|1,0,1]=4 7689 B13R1.405 C\C=C\C(C(C)=O)c1ccccc1 Amb26932616 [0,2,0,0,0,0|1,0,1]=4 7690 B13R1.405 FC(F)C(CCBr)c1ccccc1 Amb33804138 [0,2,0,0,0,0|2,0,0]=4 7691 B13R1.405 [C-]#[N+]CC(c1ccccc1)C(C)C Amb3973127 [0,2,0,0,0,0|0,0,2]=4 7692 B13R1.532 C#CC(N)C(OC)c1ccccc1 Amb27952395 [0,2,0,0,0,0|1,0,1]=4 7693 B13R1.532 C#CC(O)C(CN)c1ccccc1 Amb29875686 [0,2,0,0,0,0|1,0,1]=4 7694 B13R1.532 CCC(C(=O)NN)c1ccccc1 Amb9713297 [0,2,0,0,0,0|1,0,1]=4 7695 B13R1.532 CCC(C(=O)NO)c1ccccc1 Amb6258904 [0,2,0,0,0,0|1,0,1]=4 7696 B13R1.532 CCC(C(=O)OC)c1ccccc1 Amb9241825 [0,2,0,0,0,0|1,0,1]=4 7697 B13R1.532 CCC(C)C(C#N)c1ccccc1 Amb4020042 [0,2,0,0,0,0|1,0,1]=4 7698 B13R1.532 CCC(O)C(C#N)c1ccccc1 Amb27763844 [0,2,0,0,0,0|1,0,1]=4 7699 B13R1.532 CCC(c1ccccc1)C(C)CN Amb18195747 [0,2,0,0,0,0|2,0,0]=4 7700 B13R1.532 CCC(c1ccccc1)C(C)CO Amb33745579 [0,2,0,0,0,0|2,0,0]=4 7701 B13R1.532 CCC(c1ccccc1)[C@@H](C)CN Amb33744683 [0,2,0,0,0,0|2,0,0]=4 7702 B13R1.532 CCC(c1ccccc1)[C@@H](C)CO Amb33735562 [0,2,0,0,0,0|2,0,0]=4 7703 B13R1.532 CCC(c1ccccc1)[C@H](C)CN Amb33747433 [0,2,0,0,0,0|2,0,0]=4 7704 B13R1.532 CCC(c1ccccc1)[C@H](C)CO Amb33738172 [0,2,0,0,0,0|2,0,0]=4 7705 B13R1.532 CCN(C(=N)NC)c1ccccc1 Amb18804662 [0,2,0,0,0,0|1,0,1]=4 7706 B13R1.532 CCN(C)C(CN)c1ccccc1 Amb8890621 [0,2,0,0,0,0|2,0,0]=4 7707 B13R1.532 CC[C@@H](O)[C@@H](C#N)c1ccccc1 Amb27853904 [0,2,0,0,0,0|1,0,1]=4 7708 B13R1.532 CNC(=O)C(C#N)c1ccccc1 Amb18790298 [0,2,0,0,0,0|0,0,2]=4 7709 B13R1.532 CNC(=O)C(CN)c1ccccn1 Amb23571969 [0,2,0,0,0,0|1,0,1]=4 7710 B13R1.532 CNC(=O)C(CN)c1cccnc1 Amb23571968 [0,2,0,0,0,0|1,0,1]=4 7711 B13R1.532 CNC(=O)C(NC)c1ccccc1 Amb18128254 [0,2,0,0,0,0|0,0,1]=3 7712 B13R1.532 CNC(=O)C(NO)c1ccccc1 Amb28292806 [0,2,0,0,0,0|1,0,1]=4 7713 B13R1.532 CNC(=O)C(SC)c1ccccc1 Amb27236891 [0,2,0,0,0,0|0,0,1]=3 7714 B13R1.532 CNC(=O)[C@H](OC)c1ccccc1 Amb27810966 [0,2,0,0,0,0|0,0,1]=3 7715 B13R1.532 CNC(=S)N(NC)c1ccccc1 Amb28436654 [0,2,0,0,0,0|1,0,1]=4 7716 B13R1.532 CNC(C(=O)OC)c1ccccc1 Amb18809173 [0,2,0,0,0,0|1,0,1]=4 7717 B13R1.532 CNC(C(=O)OC)c1ccccc1 Amb33548374 [0,2,0,0,0,0|1,0,1]=4 7718 B13R1.532 CN[C@@H](C(=O)OC)c1ccccc1 Amb35805564 [0,2,0,0,0,0|1,0,1]=4 7719 B13R1.532 CN[C@@H](C(=O)OC)c1ccccc1 Amb35825281 [0,2,0,0,0,0|1,0,1]=4 7720 B13R1.532 COC(=O)C(CBr)c1ccccc1 Amb20671515 [0,2,0,0,0,0|1,0,1]=4 7721 B13R1.532 COC(=O)C(CF)c1ccccc1 Amb32668973 [0,2,0,0,0,0|1,0,1]=4 7722 B13R1.532 COC(=O)C(CN)c1ccccc1 Amb17400701 [0,2,0,0,0,0|1,0,1]=4 7723 B13R1.532 COC(=O)C(CN)c1ccccc1 Amb2694061 [0,2,0,0,0,0|1,0,1]=4 7724 B13R1.532 COC(=O)C(OC)c1ccccc1 Amb4379025 [0,2,0,0,0,0|1,0,1]=4 7725 B13R1.532 COC(=O)[C@H](OC)c1ccccc1 Amb22274921 [0,2,0,0,0,0|1,0,1]=4 7726 B13R1.532 COC(C(=O)NN)c1ccccc1 Amb9814616 [0,2,0,0,0,0|1,0,1]=4 7727 B13R1.532 COC(c1ccccc1)C(O)C#N Amb27179599 [0,2,0,0,0,0|2,0,0]=4 7728 B13R1.532 CSC(C(=O)NO)c1ccccc1 Amb27769751 [0,2,0,0,0,0|1,0,1]=4 7729 B13R1.532 C\C=C(/c1ccccc1)C(O)CC Amb27405279 [0,2,0,0,0,0|1,0,1]=4 7730 B13R1.532 C\C=C(/c1ccccc1)[C@H](O)CC Amb28455224 [0,2,0,0,0,0|1,0,1]=4 7731 B13R1.713 C=CC(CC(C)=O)c1ccccc1 Amb17594412 [0,2,0,0,0,0|1,0,1]=4 7732 B13R1.713 CC(=O)NC(CCl)c1ccccc1 Amb27407819 [0,2,0,0,0,0|2,0,0]=4 7733 B13R1.713 CC(=O)NC(CO)c1ccccc1 Amb17138902 [0,2,0,0,0,0|2,0,0]=4 7734 B13R1.713 CC(=O)N[C@@H](CCl)c1ccccc1 Amb27179193 [0,2,0,0,0,0|2,0,0]=4 7735 B13R1.713 CC(=O)N[C@@H](CO)c1ccccc1 Amb22801576 [0,2,0,0,0,0|2,0,0]=4 7736 B13R1.713 CC(C)=CC(CO)c1ccccc1 Amb28320017 [0,2,0,0,0,0|1,0,1]=4 7737 B13R1.713 CC(C)=C[C@H](CO)c1ccccc1 Amb28207187 [0,2,0,0,0,0|1,0,1]=4 7738 B13R1.713 CC(C)=NC(CO)c1ccccc1 Amb27661138 [0,2,0,0,0,0|2,0,0]=4 7739 B13R1.713 CC(C)CC(C#N)c1ccccc1 Amb4017632 [0,2,0,0,0,0|1,0,1]=4 7740 B13R1.713 CC(C)CC(C=O)c1ccccc1 Amb33362241 [0,2,0,0,0,0|1,0,1]=4 7741 B13R1.713 CC(C)CC(CBr)c1ccccc1 Amb17255495 [0,2,0,0,0,0|1,0,0]=3 7742 B13R1.713 CC(C)CC(CCl)c1ccccc1 Amb17236522 [0,2,0,0,0,0|1,0,0]=3 7743 B13R1.713 CC(C)CC(CN)c1ccccc1 Amb8950167 [0,2,0,0,0,0|1,0,0]=3 7744 B13R1.713 CC(C)CC(CN)c1ccccn1 Amb19515161 [0,2,0,0,0,0|2,0,0]=4 7745 B13R1.713 CC(C)CC(CN)c1ccncc1 Amb19515162 [0,2,0,0,0,0|2,0,0]=4 7746 B13R1.713 CC(C)CC(CO)c1ccccc1 Amb17233456 [0,2,0,0,0,0|1,0,0]=3 7747 B13R1.713 CC(C)NC(CO)c1ccccc1 Amb19007719 [0,2,0,0,0,0|2,0,0]=4 7748 B13R1.713 CC(C)OC(CBr)c1ccccc1 Amb32660984 [0,2,0,0,0,0|2,0,0]=4 7749 B13R1.713 CC(C)OC(CI)c1ccccc1 Amb33349129 [0,2,0,0,0,0|2,0,0]=4 7750 B13R1.713 CC(C)OC(CN)c1ccccc1 Amb17605965 [0,2,0,0,0,0|2,0,0]=4 7751 B13R1.713 CC(C)OC(CO)c1ccccc1 Amb28556149 [0,2,0,0,0,0|2,0,0]=4 7752 B13R1.713 CC(N)CC(C#N)c1ccccc1 Amb18825228 [0,2,0,0,0,0|1,0,1]=4 7753 B13R1.713 CC(O)CC(C#N)c1ccccc1 Amb27972532 [0,2,0,0,0,0|1,0,1]=4 7754 B13R1.713 CC(O)CC(CN)c1ccccc1 Amb20668981 [0,2,0,0,0,0|1,0,0]=3 7755 B13R1.713 CCC(CC(=O)O)c1ccccc1 Amb2611660 [0,2,0,0,0,0|2,0,0]=4 7756 B13R1.713 CCC(CC(N)=O)c1ccccc1 Amb17233286 [0,2,0,0,0,0|2,0,0]=4 7757 B13R1.713 CCC(NC(C)=O)c1ccccc1 Amb17844502 [0,2,0,0,0,0|2,0,0]=4 7758 B13R1.713 CCC(NC(C)C)c1ccccc1 Amb6685424 [0,2,0,0,0,0|2,0,0]=4 7759 B13R1.713 CCN(CC(C)C)c1ccccc1 Amb17233317 [0,2,0,0,0,0|2,0,0]=4 7760 B13R1.713 CCN(CC(C)N)c1ccccc1 Amb1136881 [0,2,0,0,0,0|2,0,0]=4 7761 B13R1.713 CCN(CC(C)O)c1ccccc1 Amb17138930 [0,2,0,0,0,0|2,0,0]=4 7762 B13R1.713 CC[C@H](NC(C)=O)c1ccccc1 Amb10559459 [0,2,0,0,0,0|2,0,0]=4 7763 B13R1.713 CC\C(=N\N(C)C)c1ccccc1 Amb27752846 [0,2,0,0,0,0|1,0,1]=4 7764 B13R1.713 CN(C)CC(C#N)c1ccccc1 Amb17233031 [0,2,0,0,0,0|0,0,1]=3 7765 B13R1.713 CN(C)CC(CCl)c1ccccc1 Amb2610620 [0,2,0,0,0,0|0,0,0]=2 7766 B13R1.713 CN(C)CC(CN)c1ccccc1 Amb9393738 [0,2,0,0,0,0|0,0,0]=2 7767 B13R1.713 CN(C)CC(CN)c1ccccn1 Amb17322078 [0,2,0,0,0,0|1,0,0]=3 7768 B13R1.713 CN(C)CC(CN)c1cccnc1 Amb17322092 [0,2,0,0,0,0|1,0,0]=3 7769 B13R1.713 CN(C)CC(CN)c1ccncc1 Amb17322106 [0,2,0,0,0,0|1,0,0]=3 7770 B13R1.713 CN(C)NC(CN)c1ccccc1 Amb18563043 [0,2,0,0,0,0|1,0,0]=3 7771 B13R1.713 CNC(CC(=O)O)c1ccccc1 Amb2698079 [0,2,0,0,0,0|2,0,0]=4 7772 B13R1.713 CNC(CC(N)=O)c1ccccc1 Amb33379116 [0,2,0,0,0,0|2,0,0]=4 7773 B13R1.713 CNC(CC(N)=O)c1ccccc1 Amb33552670 [0,2,0,0,0,0|2,0,0]=4 7774 B13R1.713 CNC(CN(C)C)c1ccccc1 Amb10068793 [0,2,0,0,0,0|0,0,0]=2 7775 B13R1.713 CNC(CN(C)C)c1ccccc1 Amb3938896 [0,2,0,0,0,0|0,0,0]=2 7776 B13R1.713 CN\C(=C\N(C)C)c1ccccc1 Amb27597621 [0,2,0,0,0,0|0,0,2]=4 7777 B13R1.713 COC(CS(=O)[O-])c1ccccc1 Amb32754988 [0,2,0,0,0,0|2,0,0]=4 7778 B13R1.713 CS(=O)CC(C#N)c1ccccc1 Amb27803530 [0,2,0,0,0,0|1,0,1]=4 7779 B13R1.713 C\C=C(\CC(C)N)c1ccccc1 Amb27607649 [0,2,0,0,0,0|1,0,1]=4 7780 B13R1.713 FC(F)CC(CBr)c1ccccc1 Amb33483093 [0,2,0,0,0,0|2,0,0]=4 7781 B13R1.713 NCC(CC(=O)O)c1ccccc1 Amb1033044 [0,2,0,0,0,0|2,0,0]=4 7782 B13R1.713 NCC(CC(=O)O)c1ccccc1 Amb4233664 [0,2,0,0,0,0|2,0,0]=4 7783 B13R1.713 NC[C@@H](CC(=O)O)c1ccccc1 Amb20241745 [0,2,0,0,0,0|2,0,0]=4 7784 B13R1.713 NC[C@@H](CC(=O)O)c1ccccc1 Amb22747178 [0,2,0,0,0,0|2,0,0]=4 7785 B13R1.713 OCC(CC(F)F)c1ccccc1 Amb33483140 [0,2,0,0,0,0|2,0,0]=4 7786 B13R1.713 [NH3+]CC(CC(=O)O)c1ccccc1 Amb5722309 [0,2,0,0,0,0|2,0,0]=4 7787 B13R1.17 C#CCCC(C)c1ccc(F)cc1 Amb33273312 [0,2,0,0,0,0|1,0,1]=4 7788 B13R1.17 C#CCN[C@@H](C)c1ccc(Br)cc1 Amb27772050 [0,2,0,0,0,0|1,0,1]=4 7789 B13R1.17 C#CCN[C@@H](C)c1ccc(C)cc1 Amb27608861 [0,2,0,0,0,0|1,0,1]=4 7790 B13R1.17 C#CCN[C@@H](C)c1ccc(F)cc1 Amb27608826 [0,2,0,0,0,0|1,0,1]=4 7791 B13R1.17 C#CCOC(C)c1ccc(Br)cc1 Amb23443739 [0,2,0,0,0,0|1,0,1]=4 7792 B13R1.17 C=CCNC(C)c1ccc(Cl)cc1 Amb6683843 [0,2,0,0,0,0|1,0,1]=4 7793 B13R1.17 CC#CCC(N)c1ccc(Br)cc1 Amb27459511 [0,2,0,0,0,0|2,0,0]=4 7794 B13R1.17 CC#CCC(O)c1ccc(Br)cc1 Amb27608198 [0,2,0,0,0,0|2,0,0]=4 7795 B13R1.17 CC#CCC(O)c1ccc(C)cc1 Amb18183850 [0,2,0,0,0,0|2,0,0]=4 7796 B13R1.17 CC#CCC(O)c1ccc(F)cc1 Amb18184295 [0,2,0,0,0,0|2,0,0]=4 7797 B13R1.17 CC(CCC#N)c1ccc(F)cc1 Amb33274564 [0,2,0,0,0,0|1,0,1]=4 7798 B13R1.17 CC(CCC=O)c1ccc(F)cc1 Amb33273308 [0,2,0,0,0,0|1,0,1]=4 7799 B13R1.17 CC(CCCBr)c1ccc(F)cc1 Amb33431655 [0,2,0,0,0,0|1,0,0]=3 7800 B13R1.17 CC(CCCN)c1ccc(Br)cc1 Amb18071389 [0,2,0,0,0,0|1,0,0]=3 7801 B13R1.17 CC(CCCN)c1ccc(Cl)cc1 Amb18066474 [0,2,0,0,0,0|1,0,0]=3 7802 B13R1.17 CC(CCCN)c1ccc(F)cc1 Amb18564173 [0,2,0,0,0,0|1,0,0]=3 7803 B13R1.17 CC(CCCO)c1ccc(F)cc1 Amb33273311 [0,2,0,0,0,0|1,0,0]=3 7804 B13R1.17 CC(CCCS)c1ccc(F)cc1 Amb33423590 [0,2,0,0,0,0|1,0,0]=3 7805 B13R1.17 CC(CCON)c1ccc(F)cc1 Amb33274144 [0,2,0,0,0,0|2,0,0]=4 7806 B13R1.17 CC(CN=C=O)c1ccc(Br)cc1 Amb17106007 [0,2,0,0,0,0|0,0,2]=4 7807 B13R1.17 CC(CN=C=O)c1ccc(Cl)cc1 Amb17106006 [0,2,0,0,0,0|0,0,2]=4 7808 B13R1.17 CC(CN=C=O)c1ccc(F)cc1 Amb17106005 [0,2,0,0,0,0|0,0,2]=4 7809 B13R1.17 CC(CN=[N+]=[N-])c1ccc(F)cc1 Amb33273692 [0,2,0,0,0,0|1,0,1]=4 7810 B13R1.17 CC(NCC#N)c1ccc(F)cc1 Amb18977432 [0,2,0,0,0,0|2,0,0]=4 7811 B13R1.17 CC(NCCN)c1ccc(F)cc1 Amb17091033 [0,2,0,0,0,0|2,0,0]=4 7812 B13R1.17 CC(NCCO)c1ccc(Br)cc1 Amb7809217 [0,2,0,0,0,0|2,0,0]=4 7813 B13R1.17 CC(NCCO)c1ccc(Cl)cc1 Amb7809211 [0,2,0,0,0,0|2,0,0]=4 7814 B13R1.17 CC(NCCO)c1ccc(F)cc1 Amb7760654 [0,2,0,0,0,0|2,0,0]=4 7815 B13R1.17 CC(NCCO)c1ccc(I)cc1 Amb9640292 [0,2,0,0,0,0|2,0,0]=4 7816 B13R1.17 CC(OCC#N)c1ccc(Br)cc1 Amb25090252 [0,2,0,0,0,0|2,0,0]=4 7817 B13R1.17 CC(OCCN)c1ccc(Br)cc1 Amb18071618 [0,2,0,0,0,0|2,0,0]=4 7818 B13R1.17 CC(OCCN)c1ccc(Cl)cc1 Amb17079523 [0,2,0,0,0,0|2,0,0]=4 7819 B13R1.17 CC(OCCN)c1ccc(F)cc1 Amb17079492 [0,2,0,0,0,0|2,0,0]=4 7820 B13R1.17 CC(OCCO)c1ccc(Cl)cc1 Amb32410600 [0,2,0,0,0,0|2,0,0]=4 7821 B13R1.17 CC(SCC#N)c1ccc(Cl)cc1 Amb27804800 [0,2,0,0,0,0|2,0,0]=4 7822 B13R1.17 CC(\C=C\CN)c1ccc(F)cc1 Amb33273688 [0,2,0,0,0,0|1,0,1]=4 7823 B13R1.17 CC(\C=C\CO)c1ccc(F)cc1 Amb33273689 [0,2,0,0,0,0|1,0,1]=4 7824 B13R1.17 CCCCC(N)c1ccc(Br)cc1 Amb6257278 [0,2,0,0,0,0|2,0,0]=4 7825 B13R1.17 CCCCC(N)c1ccc(C)cc1 Amb32662397 [0,2,0,0,0,0|2,0,0]=4 7826 B13R1.17 CCCCC(N)c1ccc(C)cc1 Amb6255350 [0,2,0,0,0,0|2,0,0]=4 7827 B13R1.17 CCCCC(N)c1ccc(Cl)cc1 Amb6663529 [0,2,0,0,0,0|2,0,0]=4 7828 B13R1.17 CCCCC(N)c1ccc(F)cc1 Amb9717795 [0,2,0,0,0,0|2,0,0]=4 7829 B13R1.17 CCCCC(O)c1ccc(Br)cc1 Amb17196245 [0,2,0,0,0,0|2,0,0]=4 7830 B13R1.17 CCCCC(O)c1ccc(C)cc1 Amb17194526 [0,2,0,0,0,0|2,0,0]=4 7831 B13R1.17 CCCCC(O)c1ccc(Cl)cc1 Amb17194788 [0,2,0,0,0,0|2,0,0]=4 7832 B13R1.17 CCCCC(O)c1ccc(F)cc1 Amb9358391 [0,2,0,0,0,0|2,0,0]=4 7833 B13R1.17 CCCCC(S)c1ccc(F)cc1 Amb32788436 [0,2,0,0,0,0|2,0,0]=4 7834 B13R1.17 CCCCN(C)c1ccc(N)cc1 Amb6248029 [0,2,0,0,0,0|2,0,0]=4 7835 B13R1.17 CCCNC(C)c1ccc(Br)cc1 Amb6262989 [0,2,0,0,0,0|1,0,0]=3 7836 B13R1.17 CCCNC(C)c1ccc(Cl)cc1 Amb6665858 [0,2,0,0,0,0|1,0,0]=3 7837 B13R1.17 CCCNC(C)c1ccc(F)cc1 Amb6278876 [0,2,0,0,0,0|1,0,0]=3 7838 B13R1.17 CCCNC(C)c1ccc(I)cc1 Amb9621093 [0,2,0,0,0,0|1,0,0]=3 7839 B13R1.17 CCCOC(C)c1ccc(I)cc1 Amb33512233 [0,2,0,0,0,0|1,0,0]=3 7840 B13R1.17 CCNCC(=O)c1ccc(F)cc1 Amb17314099 [0,2,0,0,0,0|1,0,1]=4 7841 B13R1.17 CCNCC(=O)c1ccc(N)cc1 Amb18550894 [0,2,0,0,0,0|1,0,1]=4 7842 B13R1.17 CCNCC(O)c1ccc(Br)cc1 Amb17159562 [0,2,0,0,0,0|1,0,0]=3 7843 B13R1.17 CCNCC(O)c1ccc(C)cc1 Amb17138911 [0,2,0,0,0,0|1,0,0]=3 7844 B13R1.17 CCNCC(O)c1ccc(Cl)cc1 Amb17139773 [0,2,0,0,0,0|1,0,0]=3 7845 B13R1.17 CCNCC(O)c1ccc(F)cc1 Amb17139059 [0,2,0,0,0,0|1,0,0]=3 7846 B13R1.17 CCNCC(O)c1ccc(O)cc1 Amb22733230 [0,2,0,0,0,0|1,0,0]=3 7847 B13R1.17 CN(CCCCl)c1ccc(Br)cc1 Amb17359051 [0,2,0,0,0,0|2,0,0]=4 7848 B13R1.17 CN(CCCCl)c1ccc(Cl)cc1 Amb17340959 [0,2,0,0,0,0|2,0,0]=4 7849 B13R1.17 CN(CCCCl)c1ccc(F)cc1 Amb17337713 [0,2,0,0,0,0|2,0,0]=4 7850 B13R1.17 CN(CCCN)c1ccc(Br)cc1 Amb17059629 [0,2,0,0,0,0|2,0,0]=4 7851 B13R1.17 CN(CCCN)c1ccc(Cl)cc1 Amb17059628 [0,2,0,0,0,0|2,0,0]=4 7852 B13R1.17 CN(CCCN)c1ccc(F)cc1 Amb8829203 [0,2,0,0,0,0|2,0,0]=4 7853 B13R1.17 CN(CCCO)c1ccc(Br)cc1 Amb17349689 [0,2,0,0,0,0|2,0,0]=4 7854 B13R1.17 CN(CCCO)c1ccc(Cl)cc1 Amb17337506 [0,2,0,0,0,0|2,0,0]=4 7855 B13R1.17 CN(CCCO)c1ccc(F)cc1 Amb17335629 [0,2,0,0,0,0|2,0,0]=4 7856 B13R1.17 CNCCC(=O)c1ccc(Br)cc1 Amb17349007 [0,2,0,0,0,0|1,0,1]=4 7857 B13R1.17 CNCCC(=O)c1ccc(C)cc1 Amb17335181 [0,2,0,0,0,0|1,0,1]=4 7858 B13R1.17 CNCCC(=O)c1ccc(Cl)cc1 Amb17337252 [0,2,0,0,0,0|1,0,1]=4 7859 B13R1.17 CNCCC(=O)c1ccc(F)cc1 Amb17335484 [0,2,0,0,0,0|1,0,1]=4 7860 B13R1.17 CNCCC(=O)c1ccc(F)cc1 Amb23458615 [0,2,0,0,0,0|1,0,1]=4 7861 B13R1.17 CNCCC(C)c1ccc(Br)cc1 Amb5739296 [0,2,0,0,0,0|0,0,0]=2 7862 B13R1.17 CNCCC(C)c1ccc(C)cc1 Amb5739287 [0,2,0,0,0,0|0,0,0]=2 7863 B13R1.17 CNCCC(C)c1ccc(Cl)cc1 Amb5739295 [0,2,0,0,0,0|0,0,0]=2 7864 B13R1.17 CNCCC(C)c1ccc(F)cc1 Amb5739294 [0,2,0,0,0,0|0,0,0]=2 7865 B13R1.17 CNCCC(O)c1ccc(Br)cc1 Amb17349681 [0,2,0,0,0,0|1,0,0]=3 7866 B13R1.17 CNCCC(O)c1ccc(C)cc1 Amb17335342 [0,2,0,0,0,0|1,0,0]=3 7867 B13R1.17 CNCCC(O)c1ccc(Cl)cc1 Amb17337495 [0,2,0,0,0,0|1,0,0]=3 7868 B13R1.17 CNCCC(O)c1ccc(F)cc1 Amb4558447 [0,2,0,0,0,0|1,0,0]=3 7869 B13R1.17 CNCCN(C)c1ccc(Br)cc1 Amb18246785 [0,2,0,0,0,0|1,0,0]=3 7870 B13R1.17 CNCCN(C)c1ccc(Cl)cc1 Amb18894610 [0,2,0,0,0,0|1,0,0]=3 7871 B13R1.17 CNC\C=C(/C)c1ccc(Br)cc1 Amb31137993 [0,2,0,0,0,0|0,0,1]=3 7872 B13R1.17 CNC\C=C(/C)c1ccc(C)cc1 Amb31174807 [0,2,0,0,0,0|0,0,1]=3 7873 B13R1.17 CNC\C=C(/C)c1ccc(Cl)cc1 Amb31135084 [0,2,0,0,0,0|0,0,1]=3 7874 B13R1.17 CNC\C=C(/C)c1ccc(F)cc1 Amb31174820 [0,2,0,0,0,0|0,0,1]=3 7875 B13R1.17 CNC\C=C(\C)c1ccc(F)cc1 Amb28256760 [0,2,0,0,0,0|0,0,1]=3 7876 B13R1.17 COCCC(N)c1ccc(Cl)cc1 Amb19025774 [0,2,0,0,0,0|2,0,0]=4 7877 B13R1.17 COCCC(N)c1ccc(Cl)cc1 Amb33549547 [0,2,0,0,0,0|2,0,0]=4 7878 B13R1.17 CO\N=C\C(C)c1ccc(F)cc1 Amb27586163 [0,2,0,0,0,0|0,0,2]=4 7879 B13R1.17 C[C@@H](NCC#N)c1ccc(Cl)cc1 Amb28290927 [0,2,0,0,0,0|2,0,0]=4 7880 B13R1.17 C[C@@H](NCC#N)c1ccc(F)cc1 Amb27855104 [0,2,0,0,0,0|2,0,0]=4 7881 B13R1.17 C[C@H](NCC#N)c1ccc(Cl)cc1 Amb27463868 [0,2,0,0,0,0|2,0,0]=4 7882 B13R1.17 C\C=C\CC(O)c1ccc(Cl)cc1 Amb28139956 [0,2,0,0,0,0|2,0,0]=4 7883 B13R1.17 C\C=C\C[C@@H](O)c1ccc(C)cc1 Amb27588957 [0,2,0,0,0,0|2,0,0]=4 7884 B13R1.17 Cc1ccc(C(C)CCC=O)cc1 Amb17594492 [0,2,0,0,0,0|1,0,1]=4 7885 B13R1.17 Cc1ccc(C(C)CCCN)cc1 Amb18065734 [0,2,0,0,0,0|1,0,0]=3 7886 B13R1.17 Cc1ccc(C(C)CN=C=O)cc1 Amb17105998 [0,2,0,0,0,0|0,0,2]=4 7887 B13R1.17 Cc1ccc(C(C)NCCO)cc1 Amb7809215 [0,2,0,0,0,0|2,0,0]=4 7888 B13R1.17 Cc1ccc(C(C)OCCN)cc1 Amb17079448 [0,2,0,0,0,0|2,0,0]=4 7889 B13R1.17 Cc1ccc(C(O)CCCCl)cc1 Amb17194782 [0,2,0,0,0,0|2,0,0]=4 7890 B13R1.17 Cc1ccc(C(O)CCCN)cc1 Amb17079155 [0,2,0,0,0,0|2,0,0]=4 7891 B13R1.17 Cc1ccc(C(O)CCCN)cc1 Amb21984552 [0,2,0,0,0,0|2,0,0]=4 7892 B13R1.17 Cc1ccc(C(O)CCCO)cc1 Amb17335424 [0,2,0,0,0,0|2,0,0]=4 7893 B13R1.17 Cc1ccc(N(C)CCCCl)cc1 Amb17337271 [0,2,0,0,0,0|2,0,0]=4 7894 B13R1.17 Cc1ccc(N(C)CCCN)cc1 Amb9209862 [0,2,0,0,0,0|2,0,0]=4 7895 B13R1.17 Cc1ccc(N(C)CCCO)cc1 Amb17335362 [0,2,0,0,0,0|2,0,0]=4 7896 B13R1.17 Cc1ccc([C@@H](C)NCC#N)cc1 Amb27771357 [0,2,0,0,0,0|2,0,0]=4 7897 B13R1.17 NCCCC(O)c1ccc(Br)cc1 Amb17079164 [0,2,0,0,0,0|2,0,0]=4 7898 B13R1.17 NCCCC(O)c1ccc(Br)cc1 Amb21984553 [0,2,0,0,0,0|2,0,0]=4 7899 B13R1.17 NCCCC(O)c1ccc(Cl)cc1 Amb17079163 [0,2,0,0,0,0|2,0,0]=4 7900 B13R1.17 NCCCC(O)c1ccc(Cl)cc1 Amb21984478 [0,2,0,0,0,0|2,0,0]=4 7901 B13R1.17 NCCCC(O)c1ccc(F)cc1 Amb17079162 [0,2,0,0,0,0|2,0,0]=4 7902 B13R1.17 NCCCC(O)c1ccc(F)cc1 Amb18564244 [0,2,0,0,0,0|2,0,0]=4 7903 B13R1.17 OC(CCCCl)c1ccc(Br)cc1 Amb17197215 [0,2,0,0,0,0|2,0,0]=4 7904 B13R1.17 OC(CCCCl)c1ccc(Cl)cc1 Amb17195326 [0,2,0,0,0,0|2,0,0]=4 7905 B13R1.17 OC(CCCCl)c1ccc(F)cc1 Amb17194843 [0,2,0,0,0,0|2,0,0]=4 7906 B13R1.17 OCCCC(O)c1ccc(Br)cc1 Amb17350035 [0,2,0,0,0,0|2,0,0]=4 7907 B13R1.17 OCCCC(O)c1ccc(Cl)cc1 Amb17337618 [0,2,0,0,0,0|2,0,0]=4 7908 B13R1.17 OCCCC(O)c1ccc(F)cc1 Amb17335677 [0,2,0,0,0,0|2,0,0]=4 7909 B13R1.17 [C-]#[N+]CCC(C)c1ccc(F)cc1 Amb33274136 [0,2,0,0,0,0|0,0,2]=4 7910 B13R1.21 C#CC(C)C(C)c1ccc(F)cc1 Amb33273702 [0,2,0,0,0,0|1,0,1]=4 7911 B13R1.21 C#CC(O)C(C)c1ccc(N)cc1 Amb35586682 [0,2,0,0,0,0|1,0,1]=4 7912 B13R1.21 C=CC(O)C(C)c1ccc(F)cc1 Amb33274142 [0,2,0,0,0,0|1,0,1]=4 7913 B13R1.21 C=CC(O)C(C)c1ccc(N)cc1 Amb35587013 [0,2,0,0,0,0|1,0,1]=4 7914 B13R1.21 CC(C#N)C(C)c1ccc(F)cc1 Amb33445892 [0,2,0,0,0,0|2,0,0]=4 7915 B13R1.21 CC(C=O)C(C)c1ccc(F)cc1 Amb33273696 [0,2,0,0,0,0|2,0,0]=4 7916 B13R1.21 CC(CBr)C(C)c1ccc(F)cc1 Amb33431602 [0,2,0,0,0,0|2,0,0]=4 7917 B13R1.21 CC(CN)C(C)c1ccc(Br)cc1 Amb18728142 [0,2,0,0,0,0|2,0,0]=4 7918 B13R1.21 CC(CN)C(C)c1ccc(F)cc1 Amb18192870 [0,2,0,0,0,0|2,0,0]=4 7919 B13R1.21 CC(CO)C(C)c1ccc(F)cc1 Amb33748316 [0,2,0,0,0,0|2,0,0]=4 7920 B13R1.21 CC(ON)C(C)c1ccc(F)cc1 Amb33274195 [0,2,0,0,0,0|2,0,0]=4 7921 B13R1.21 CC(c1ccc(F)cc1)C(F)CN Amb33274206 [0,2,0,0,0,0|2,0,0]=4 7922 B13R1.21 CC(c1ccc(F)cc1)C(N)CO Amb24669178 [0,2,0,0,0,0|2,0,0]=4 7923 B13R1.21 CC(c1ccc(F)cc1)C(O)CBr Amb33431608 [0,2,0,0,0,0|2,0,0]=4 7924 B13R1.21 CC(c1ccc(F)cc1)C(O)CF Amb33273694 [0,2,0,0,0,0|2,0,0]=4 7925 B13R1.21 CC(c1ccc(F)cc1)C(O)CN Amb17233999 [0,2,0,0,0,0|2,0,0]=4 7926 B13R1.21 CC(c1ccc(F)cc1)C(O)CO Amb27395976 [0,2,0,0,0,0|2,0,0]=4 7927 B13R1.21 CC(c1ccc(F)cc1)[C@@H](C)CN Amb33727426 [0,2,0,0,0,0|2,0,0]=4 7928 B13R1.21 CC(c1ccc(F)cc1)[C@@H](C)CO Amb33735559 [0,2,0,0,0,0|2,0,0]=4 7929 B13R1.21 CC(c1ccc(F)cc1)[C@@H](N)CO Amb33274493 [0,2,0,0,0,0|2,0,0]=4 7930 B13R1.21 CC(c1ccc(F)cc1)[C@@H](O)CN Amb33274193 [0,2,0,0,0,0|2,0,0]=4 7931 B13R1.21 CC(c1ccc(F)cc1)[C@H](C)CN Amb33743100 [0,2,0,0,0,0|2,0,0]=4 7932 B13R1.21 CC(c1ccc(F)cc1)[C@H](C)CO Amb33730464 [0,2,0,0,0,0|2,0,0]=4 7933 B13R1.21 CC(c1ccc(F)cc1)[C@H](N)CO Amb33274494 [0,2,0,0,0,0|2,0,0]=4 7934 B13R1.21 CC(c1ccc(F)cc1)[C@H](O)CN Amb33274205 [0,2,0,0,0,0|2,0,0]=4 7935 B13R1.21 CCC(=O)C(C)c1ccc(Br)cc1 Amb28367793 [0,2,0,0,0,0|1,0,1]=4 7936 B13R1.21 CCC(=O)C(C)c1ccc(C)cc1 Amb27647442 [0,2,0,0,0,0|1,0,1]=4 7937 B13R1.21 CCC(=O)C(C)c1ccc(I)cc1 Amb28317239 [0,2,0,0,0,0|1,0,1]=4 7938 B13R1.21 CCC(Br)C(C)c1ccc(Br)cc1 Amb27225528 [0,2,0,0,0,0|1,0,0]=3 7939 B13R1.21 CCC(Br)C(C)c1ccc(F)cn1 Amb27814473 [0,2,0,0,0,0|2,0,0]=4 7940 B13R1.21 CCC(C)C(Br)c1ccc(F)cc1 Amb27178990 [0,2,0,0,0,0|2,0,0]=4 7941 B13R1.21 CCC(C)C(N)c1ccc(Br)cc1 Amb6279034 [0,2,0,0,0,0|2,0,0]=4 7942 B13R1.21 CCC(C)C(N)c1ccc(Cl)cc1 Amb6663522 [0,2,0,0,0,0|2,0,0]=4 7943 B13R1.21 CCC(C)C(O)c1ccc(C)cc1 Amb18796057 [0,2,0,0,0,0|2,0,0]=4 7944 B13R1.21 CCC(C)C(O)c1ccc(I)cc1 Amb27594192 [0,2,0,0,0,0|2,0,0]=4 7945 B13R1.21 CCC(C)C(O)c1ccc(N)cc1 Amb27179241 [0,2,0,0,0,0|2,0,0]=4 7946 B13R1.21 CCC(C)[C@@H](N)c1ccc(Br)cc1 Amb27637865 [0,2,0,0,0,0|2,0,0]=4 7947 B13R1.21 CCC(C)[C@@H](N)c1ccc(C)cc1 Amb27195847 [0,2,0,0,0,0|2,0,0]=4 7948 B13R1.21 CCC(C)[C@@H](N)c1ccc(Cl)cc1 Amb28132432 [0,2,0,0,0,0|2,0,0]=4 7949 B13R1.21 CCC(C)[C@@H](N)c1ccc(I)cc1 Amb27635065 [0,2,0,0,0,0|2,0,0]=4 7950 B13R1.21 CCC(C)[C@H](N)c1ccc(Br)cc1 Amb27489116 [0,2,0,0,0,0|2,0,0]=4 7951 B13R1.21 CCC(C)[C@H](N)c1ccc(F)cc1 Amb28384627 [0,2,0,0,0,0|2,0,0]=4 7952 B13R1.21 CCC(C)[C@H](N)c1ccc(I)cc1 Amb28055870 [0,2,0,0,0,0|2,0,0]=4 7953 B13R1.21 CCC(Cl)C(C)c1ccc(Br)cc1 Amb27748783 [0,2,0,0,0,0|1,0,0]=3 7954 B13R1.21 CCC(Cl)C(Cl)c1ccc(C)cc1 Amb27799859 [0,2,0,0,0,0|2,0,0]=4 7955 B13R1.21 CCC(N)C(C)c1ccc(Br)cc1 Amb27951208 [0,2,0,0,0,0|1,0,0]=3 7956 B13R1.21 CCC(N)C(C)c1ccc(C)cc1 Amb18195746 [0,2,0,0,0,0|1,0,0]=3 7957 B13R1.21 CCC(N)C(N)c1ccc(Br)cc1 Amb28429941 [0,2,0,0,0,0|2,0,0]=4 7958 B13R1.21 CCC(N)C(N)c1ccc(C)cc1 Amb27430482 [0,2,0,0,0,0|2,0,0]=4 7959 B13R1.21 CCC(N)C(N)c1ccc(Cl)cc1 Amb27597097 [0,2,0,0,0,0|2,0,0]=4 7960 B13R1.21 CCC(N)C(N)c1ccc(F)cc1 Amb27460212 [0,2,0,0,0,0|2,0,0]=4 7961 B13R1.21 CCC(N)C(O)c1ccc(Cl)cc1 Amb32667543 [0,2,0,0,0,0|2,0,0]=4 7962 B13R1.21 CCC(N)C(O)c1ccc(Cl)cc1 Amb9429055 [0,2,0,0,0,0|2,0,0]=4 7963 B13R1.21 CCC(O)C(C)c1ccc(Br)cc1 Amb27951876 [0,2,0,0,0,0|1,0,0]=3 7964 B13R1.21 CCC(O)C(C)c1ccc(F)cc1 Amb27947781 [0,2,0,0,0,0|1,0,0]=3 7965 B13R1.21 CCC(O)C(C)c1ccc(N)cc1 Amb35622405 [0,2,0,0,0,0|1,0,0]=3 7966 B13R1.21 CCC(O)C(N)c1ccc(Br)cc1 Amb18723288 [0,2,0,0,0,0|2,0,0]=4 7967 B13R1.21 CCC(O)C(N)c1ccc(C)cc1 Amb27448833 [0,2,0,0,0,0|2,0,0]=4 7968 B13R1.21 CCC(O)C(O)c1ccc(Br)cc1 Amb35605442 [0,2,0,0,0,0|2,0,0]=4 7969 B13R1.21 CCC(O)C(O)c1ccc(F)cc1 Amb28248470 [0,2,0,0,0,0|2,0,0]=4 7970 B13R1.21 CCN(C)C(C)c1ccc(I)cc1 Amb27757050 [0,2,0,0,0,0|2,0,0]=4 7971 B13R1.21 CCN(C)C(C)c1ccc(O)cc1 Amb27449769 [0,2,0,0,0,0|2,0,0]=4 7972 B13R1.21 CCS(=O)C(C)c1ccc(Cl)cc1 Amb27206363 [0,2,0,0,0,0|2,0,0]=4 7973 B13R1.21 CC[C@@H](N)C(O)c1ccc(Br)cc1 Amb35659332 [0,2,0,0,0,0|2,0,0]=4 7974 B13R1.21 CC[C@@H](N)C(O)c1ccc(C)cc1 Amb35602698 [0,2,0,0,0,0|2,0,0]=4 7975 B13R1.21 CC[C@@H](N)C(O)c1ccc(Cl)cc1 Amb35602702 [0,2,0,0,0,0|2,0,0]=4 7976 B13R1.21 CC[C@@H](N)C(O)c1ccc(F)cc1 Amb35659378 [0,2,0,0,0,0|2,0,0]=4 7977 B13R1.21 CC[C@@H](N)[C@@H](O)c1ccc(O)cc1 Amb28076041 [0,2,0,0,0,0|2,0,0]=4 7978 B13R1.21 CC[C@@H](N)[C@H](O)c1ccc(C)cc1 Amb28131444 [0,2,0,0,0,0|2,0,0]=4 7979 B13R1.21 CC[C@@H](O)[C@@H](N)c1ccc(Br)cc1 Amb28139568 [0,2,0,0,0,0|2,0,0]=4 7980 B13R1.21 CC[C@@H](O)[C@@H](N)c1ccc(C)cc1 Amb28061303 [0,2,0,0,0,0|2,0,0]=4 7981 B13R1.21 CC[C@@H](O)[C@@H](O)c1ccc(C)cc1 Amb27486584 [0,2,0,0,0,0|2,0,0]=4 7982 B13R1.21 CC[C@H](N)C(O)c1ccc(Br)cc1 Amb35601442 [0,2,0,0,0,0|2,0,0]=4 7983 B13R1.21 CC[C@H](N)C(O)c1ccc(C)cc1 Amb35601300 [0,2,0,0,0,0|2,0,0]=4 7984 B13R1.21 CC[C@H](N)C(O)c1ccc(Cl)cc1 Amb35601167 [0,2,0,0,0,0|2,0,0]=4 7985 B13R1.21 CC[C@H](N)C(O)c1ccc(F)cc1 Amb35601264 [0,2,0,0,0,0|2,0,0]=4 7986 B13R1.21 CC[C@H](N)[C@@H](N)c1ccc(Br)cc1 Amb27430297 [0,2,0,0,0,0|2,0,0]=4 7987 B13R1.21 CC[C@H](N)[C@@H](N)c1ccc(C)cc1 Amb28055948 [0,2,0,0,0,0|2,0,0]=4 7988 B13R1.21 CC[C@H](N)[C@@H](O)c1ccc(Br)cc1 Amb27440461 [0,2,0,0,0,0|2,0,0]=4 7989 B13R1.21 CC[C@H](N)[C@@H](O)c1ccc(F)cc1 Amb28208510 [0,2,0,0,0,0|2,0,0]=4 7990 B13R1.21 CC[C@H](N)[C@H](O)c1ccc(Br)cc1 Amb28384670 [0,2,0,0,0,0|2,0,0]=4 7991 B13R1.21 CC[C@H](N)[C@H](O)c1ccc(N)cc1 Amb28075256 [0,2,0,0,0,0|2,0,0]=4 7992 B13R1.21 CC[C@H](O)[C@H](N)c1ccc(C)cc1 Amb27840975 [0,2,0,0,0,0|2,0,0]=4 7993 B13R1.21 CC[C@H](O)[C@H](N)c1ccc(I)cc1 Amb28315059 [0,2,0,0,0,0|2,0,0]=4 7994 B13R1.21 CNC(=O)C(C)c1ccc(C)cc1 Amb24440896 [0,2,0,0,0,0|0,0,1]=3 7995 B13R1.21 CNC(=O)C(C)c1ccc(Cl)cc1 Amb28255686 [0,2,0,0,0,0|0,0,1]=3 7996 B13R1.21 CNC(=O)C(C)c1ccc(Cl)nc1 Amb27234747 [0,2,0,0,0,0|1,0,1]=4 7997 B13R1.21 CNC(=O)C(Cl)c1ccc(F)cc1 Amb27172058 [0,2,0,0,0,0|1,0,1]=4 7998 B13R1.21 CNC(=O)C(N)c1ccc(Br)cc1 Amb25102382 [0,2,0,0,0,0|1,0,1]=4 7999 B13R1.21 CNC(=O)C(N)c1ccc(C)cc1 Amb26991597 [0,2,0,0,0,0|1,0,1]=4 8000 B13R1.21 CNC(=O)C(N)c1ccc(Cl)cc1 Amb27603587 [0,2,0,0,0,0|1,0,1]=4 8001 B13R1.21 CNC(=O)C(N)c1ccc(F)cc1 Amb26856863 [0,2,0,0,0,0|1,0,1]=4 8002 B13R1.21 CNC(=O)C(N)c1ccc(O)cc1 Amb27179326 [0,2,0,0,0,0|1,0,1]=4 8003 B13R1.21 CNC(=O)C(O)c1ccc(Br)cc1 Amb28317472 [0,2,0,0,0,0|1,0,1]=4 8004 B13R1.21 CNC(=O)C(O)c1ccc(C)cc1 Amb17400709 [0,2,0,0,0,0|1,0,1]=4 8005 B13R1.21 CNC(=O)C(O)c1ccc(Cl)cc1 Amb17402319 [0,2,0,0,0,0|1,0,1]=4 8006 B13R1.21 CNC(=O)C(O)c1ccc(F)cc1 Amb17400966 [0,2,0,0,0,0|1,0,1]=4 8007 B13R1.21 CNC(=O)N(C)c1ccc(C)cc1 Amb27771460 [0,2,0,0,0,0|1,0,1]=4 8008 B13R1.21 CNC(=O)N(C)c1ccc(N)cc1 Amb25702285 [0,2,0,0,0,0|1,0,1]=4 8009 B13R1.21 CNC(=S)N(C)c1ccc(C)cc1 Amb27594630 [0,2,0,0,0,0|1,0,1]=4 8010 B13R1.21 CNC(C)C(=O)c1ccc(Br)cc1 Amb17312906 [0,2,0,0,0,0|1,0,1]=4 8011 B13R1.21 CNC(C)C(=O)c1ccc(C)cc1 Amb18540236 [0,2,0,0,0,0|1,0,1]=4 8012 B13R1.21 CNC(C)C(=O)c1ccc(Cl)cc1 Amb17312952 [0,2,0,0,0,0|1,0,1]=4 8013 B13R1.21 CNC(C)C(=O)c1ccc(F)cc1 Amb17313013 [0,2,0,0,0,0|1,0,1]=4 8014 B13R1.21 CNC(C)C(=O)c1ccc(N)cc1 Amb18051421 [0,2,0,0,0,0|1,0,1]=4 8015 B13R1.21 CNC(C)C(=O)c1ccc(O)cc1 Amb27239640 [0,2,0,0,0,0|1,0,1]=4 8016 B13R1.21 CNC(C)C(C)c1ccc(Br)cc1 Amb28368126 [0,2,0,0,0,0|0,0,0]=2 8017 B13R1.21 CNC(C)C(C)c1ccc(Cl)cc1 Amb20623680 [0,2,0,0,0,0|0,0,0]=2 8018 B13R1.21 CNC(C)C(O)c1ccc(Br)cc1 Amb18071614 [0,2,0,0,0,0|1,0,0]=3 8019 B13R1.21 CNC(C)C(O)c1ccc(C)nc1 Amb35741560 [0,2,0,0,0,0|2,0,0]=4 8020 B13R1.21 CNC(C)C(O)c1ccc(Cl)cc1 Amb18066518 [0,2,0,0,0,0|1,0,0]=3 8021 B13R1.21 CNC(C)C(O)c1ccc(O)cc1 Amb28316376 [0,2,0,0,0,0|1,0,0]=3 8022 B13R1.21 CNC(C)C(O)c1ccc(O)cc1 Amb4021861 [0,2,0,0,0,0|1,0,0]=3 8023 B13R1.21 CN[C@@H](C)C(=O)c1ccc(Br)cc1 Amb35662339 [0,2,0,0,0,0|1,0,1]=4 8024 B13R1.21 CN[C@@H](C)C(=O)c1ccc(C)cc1 Amb35659958 [0,2,0,0,0,0|1,0,1]=4 8025 B13R1.21 CN[C@@H](C)C(=O)c1ccc(Cl)cc1 Amb29891463 [0,2,0,0,0,0|1,0,1]=4 8026 B13R1.21 CN[C@@H](C)C(=O)c1ccc(F)cc1 Amb35659967 [0,2,0,0,0,0|1,0,1]=4 8027 B13R1.21 CN[C@@H](C)C(O)c1ccc(Br)cc1 Amb35662601 [0,2,0,0,0,0|1,0,0]=3 8028 B13R1.21 CN[C@@H](C)C(O)c1ccc(C)cc1 Amb35662449 [0,2,0,0,0,0|1,0,0]=3 8029 B13R1.21 CN[C@@H](C)C(O)c1ccc(C)nc1 Amb30038956 [0,2,0,0,0,0|2,0,0]=4 8030 B13R1.21 CN[C@@H](C)C(O)c1ccc(Cl)cc1 Amb35662198 [0,2,0,0,0,0|1,0,0]=3 8031 B13R1.21 CN[C@@H](C)C(O)c1ccc(F)cc1 Amb35662349 [0,2,0,0,0,0|1,0,0]=3 8032 B13R1.21 CN[C@@H](C)[C@H](O)c1ccc(C)cc1 Amb27204880 [0,2,0,0,0,0|1,0,0]=3 8033 B13R1.21 CN[C@@H](C)[C@H](O)c1ccc(Cl)cc1 Amb27608595 [0,2,0,0,0,0|1,0,0]=3 8034 B13R1.21 CN[C@H](C)[C@@H](O)c1ccc(C)cc1 Amb27771839 [0,2,0,0,0,0|1,0,0]=3 8035 B13R1.21 CN[C@H](C)[C@@H](O)c1ccc(F)cc1 Amb26424302 [0,2,0,0,0,0|1,0,0]=3 8036 B13R1.21 CN[C@H](C)[C@@H](O)c1ccc(O)cc1 Amb27459431 [0,2,0,0,0,0|1,0,0]=3 8037 B13R1.21 CN[C@H](C)[C@H](O)c1ccc(F)cc1 Amb28429623 [0,2,0,0,0,0|1,0,0]=3 8038 B13R1.21 COC(=O)C(C)c1ccc(Br)cc1 Amb26304236 [0,2,0,0,0,0|1,0,1]=4 8039 B13R1.21 COC(=O)C(C)c1ccc(C)cc1 Amb18184314 [0,2,0,0,0,0|1,0,1]=4 8040 B13R1.21 COC(=O)C(C)c1ccc(Cl)cc1 Amb19084562 [0,2,0,0,0,0|1,0,1]=4 8041 B13R1.21 COC(=O)C(C)c1ccc(F)cc1 Amb18185420 [0,2,0,0,0,0|1,0,1]=4 8042 B13R1.21 COC(=O)C(C)c1ccc(N)cc1 Amb18648244 [0,2,0,0,0,0|1,0,1]=4 8043 B13R1.21 COC(=O)C(C)c1ccc(N)cc1 Amb32663645 [0,2,0,0,0,0|1,0,1]=4 8044 B13R1.21 COC(=O)C(C)c1ccc(O)cc1 Amb18128607 [0,2,0,0,0,0|1,0,1]=4 8045 B13R1.21 COC(=O)[C@@H](C)c1ccc(O)cc1 Amb25112603 [0,2,0,0,0,0|1,0,1]=4 8046 B13R1.21 COC(C)C(N)c1ccc(Br)cc1 Amb18155746 [0,2,0,0,0,0|2,0,0]=4 8047 B13R1.21 COC(C)C(N)c1ccc(Cl)cc1 Amb18187532 [0,2,0,0,0,0|2,0,0]=4 8048 B13R1.21 COC(C)C(O)c1ccc(Br)cc1 Amb30021896 [0,2,0,0,0,0|2,0,0]=4 8049 B13R1.21 CSC(=S)C(C)c1ccc(N)cc1 Amb27867347 [0,2,0,0,0,0|1,0,1]=4 8050 B13R1.21 Cc1ccc(C(C)C(=O)NN)cc1 Amb27412617 [0,2,0,0,0,0|1,0,1]=4 8051 B13R1.21 Cc1ccc(C(C)C(C)CN)cc1 Amb18195748 [0,2,0,0,0,0|2,0,0]=4 8052 B13R1.21 Cc1ccc(C(C)C(C)CO)cc1 Amb25846204 [0,2,0,0,0,0|2,0,0]=4 8053 B13R1.21 Cc1ccc(C(C)[C@@H](C)CN)cc1 Amb33729600 [0,2,0,0,0,0|2,0,0]=4 8054 B13R1.21 Cc1ccc(C(C)[C@@H](C)CO)cc1 Amb33739355 [0,2,0,0,0,0|2,0,0]=4 8055 B13R1.21 Cc1ccc(C(C)[C@H](C)CN)cc1 Amb33727709 [0,2,0,0,0,0|2,0,0]=4 8056 B13R1.21 Cc1ccc(C(C)[C@H](C)CO)cc1 Amb33748179 [0,2,0,0,0,0|2,0,0]=4 8057 B13R1.21 Cc1ccc([C@H](C)[C@@H](O)CO)cc1 Amb27981993 [0,2,0,0,0,0|2,0,0]=4 8058 B13R1.21 [C-]#[N+]C(C)C(C)c1ccc(F)cc1 Amb33274137 [0,2,0,0,0,0|0,0,2]=4 8059 B13R1.29 C#CCC(C)(O)c1ccc(Br)cc1 Amb27817100 [0,2,0,0,0,0|1,0,1]=4 8060 B13R1.29 C#CCC(C)(O)c1ccc(C)cc1 Amb25978542 [0,2,0,0,0,0|1,0,1]=4 8061 B13R1.29 C#CCC(C)(O)c1ccc(Cl)cc1 Amb28317860 [0,2,0,0,0,0|1,0,1]=4 8062 B13R1.29 C#CCC(C)(O)c1ccc(F)cc1 Amb25676949 [0,2,0,0,0,0|1,0,1]=4 8063 B13R1.29 C#CCC(C)(O)c1ccc(O)cc1 Amb27464970 [0,2,0,0,0,0|1,0,1]=4 8064 B13R1.29 C=CCC(C)(C)c1ccc(O)cc1 Amb28461233 [0,2,0,0,0,0|1,0,1]=4 8065 B13R1.29 C=CCC(C)(N)c1ccc(Br)cc1 Amb27436617 [0,2,0,0,0,0|1,0,1]=4 8066 B13R1.29 C=CCC(C)(O)c1ccc(Cl)cc1 Amb28435941 [0,2,0,0,0,0|1,0,1]=4 8067 B13R1.29 C=CCC(C)(O)c1ccc(F)cc1 Amb27416078 [0,2,0,0,0,0|1,0,1]=4 8068 B13R1.29 C=CCC(C)(O)c1ccc(I)cc1 Amb28188421 [0,2,0,0,0,0|1,0,1]=4 8069 B13R1.29 C=CCC(C)(O)c1ccc(N)cc1 Amb836788 [0,2,0,0,0,0|1,0,1]=4 8070 B13R1.29 C=CC[C@@](C)(N)c1ccc(O)cc1 Amb27595942 [0,2,0,0,0,0|1,0,1]=4 8071 B13R1.29 C=CC[C@](C)(N)c1ccc(C)cc1 Amb27259248 [0,2,0,0,0,0|1,0,1]=4 8072 B13R1.29 C=CC[C@](C)(N)c1ccc(F)cc1 Amb27951776 [0,2,0,0,0,0|1,0,1]=4 8073 B13R1.29 C=CC[C@](C)(N)c1ccc(N)cc1 Amb27171554 [0,2,0,0,0,0|1,0,1]=4 8074 B13R1.29 CC#CC(C)(O)c1ccc(F)cc1 Amb27188370 [0,2,0,0,0,0|1,0,1]=4 8075 B13R1.29 CC#CC(C)(O)c1ccc(O)cc1 Amb27163618 [0,2,0,0,0,0|1,0,1]=4 8076 B13R1.29 CC(C)(CC#N)c1ccc(Cl)cc1 Amb24401109 [0,2,0,0,0,0|2,0,0]=4 8077 B13R1.29 CC(C)(CC#N)c1ccc(N)cc1 Amb27772109 [0,2,0,0,0,0|2,0,0]=4 8078 B13R1.29 CC(C)(CC#N)c1ccc(S)cc1 Amb27793610 [0,2,0,0,0,0|2,0,0]=4 8079 B13R1.29 CC(C)(CC=O)c1ccc(Cl)cc1 Amb24694228 [0,2,0,0,0,0|2,0,0]=4 8080 B13R1.29 CC(C)(CCBr)c1ccc(Br)cc1 Amb27415864 [0,2,0,0,0,0|2,0,0]=4 8081 B13R1.29 CC(C)(CCBr)c1ccc(Cl)cc1 Amb28200243 [0,2,0,0,0,0|2,0,0]=4 8082 B13R1.29 CC(C)(CCCl)c1ccc(Br)cc1 Amb28144362 [0,2,0,0,0,0|2,0,0]=4 8083 B13R1.29 CC(C)(CCN)c1ccc(Br)cc1 Amb17255978 [0,2,0,0,0,0|2,0,0]=4 8084 B13R1.29 CC(C)(CCN)c1ccc(Cl)cc1 Amb17236697 [0,2,0,0,0,0|2,0,0]=4 8085 B13R1.29 CC(C)(CCN)c1ccc(F)cc1 Amb17233831 [0,2,0,0,0,0|2,0,0]=4 8086 B13R1.29 CC(C)(CCN)c1ccc(O)cc1 Amb33270070 [0,2,0,0,0,0|2,0,0]=4 8087 B13R1.29 CC(C)(CCO)c1ccc(Cl)cc1 Amb26616179 [0,2,0,0,0,0|2,0,0]=4 8088 B13R1.29 CC(C)(CCO)c1ccc(N)cc1 Amb27760354 [0,2,0,0,0,0|2,0,0]=4 8089 B13R1.29 CC(C)(CCO)c1ccc(O)cc1 Amb27244721 [0,2,0,0,0,0|2,0,0]=4 8090 B13R1.29 CC(C)(CNN)c1ccc(F)cc1 Amb28243084 [0,2,0,0,0,0|1,0,0]=3 8091 B13R1.29 CC(C)(CON)c1ccc(Br)cc1 Amb33451502 [0,2,0,0,0,0|2,0,0]=4 8092 B13R1.29 CC(C)(CON)c1ccc(Cl)cc1 Amb33052807 [0,2,0,0,0,0|2,0,0]=4 8093 B13R1.29 CC(C)(CON)c1ccc(F)cc1 Amb33376581 [0,2,0,0,0,0|2,0,0]=4 8094 B13R1.29 CC(C)(CON)c1ccc(O)cc1 Amb33269538 [0,2,0,0,0,0|2,0,0]=4 8095 B13R1.29 CC(F)(CC#N)c1ccc(F)cc1 Amb27451322 [0,2,0,0,0,0|2,0,0]=4 8096 B13R1.29 CC(F)(CCN)c1ccc(Cl)cc1 Amb27963080 [0,2,0,0,0,0|2,0,0]=4 8097 B13R1.29 CC(N)(CCO)c1ccc(Br)cc1 Amb18229200 [0,2,0,0,0,0|2,0,0]=4 8098 B13R1.29 CC(N)(CCO)c1ccc(Cl)cc1 Amb18225029 [0,2,0,0,0,0|2,0,0]=4 8099 B13R1.29 CC(N)(CCO)c1ccc(F)cc1 Amb18224780 [0,2,0,0,0,0|2,0,0]=4 8100 B13R1.29 CC(N)(CCO)c1ccc(I)cc1 Amb28076887 [0,2,0,0,0,0|2,0,0]=4 8101 B13R1.29 CC(N)(CCO)c1ccc(N)cc1 Amb27445010 [0,2,0,0,0,0|2,0,0]=4 8102 B13R1.29 CC(N)(CCO)c1ccc(O)cc1 Amb28143630 [0,2,0,0,0,0|2,0,0]=4 8103 B13R1.29 CC(O)(CC=O)c1ccc(Br)cc1 Amb28061517 [0,2,0,0,0,0|2,0,0]=4 8104 B13R1.29 CC(O)(CC=O)c1ccc(I)cc1 Amb27226333 [0,2,0,0,0,0|2,0,0]=4 8105 B13R1.29 CC(O)(CCCl)c1ccc(Cl)cc1 Amb27439633 [0,2,0,0,0,0|2,0,0]=4 8106 B13R1.29 CC(O)(CCN)c1ccc(Br)cc1 Amb18155765 [0,2,0,0,0,0|2,0,0]=4 8107 B13R1.29 CC(O)(CCN)c1ccc(Cl)cc1 Amb18066534 [0,2,0,0,0,0|2,0,0]=4 8108 B13R1.29 CC(O)(CCN)c1ccc(F)cc1 Amb18066119 [0,2,0,0,0,0|2,0,0]=4 8109 B13R1.29 CC(O)(CCN)c1ccc(I)cc1 Amb24752562 [0,2,0,0,0,0|2,0,0]=4 8110 B13R1.29 CC(O)(CNN)c1ccc(Br)cc1 Amb17257508 [0,2,0,0,0,0|1,0,0]=3 8111 B13R1.29 CC(O)(CNN)c1ccc(Cl)cc1 Amb17237204 [0,2,0,0,0,0|1,0,0]=3 8112 B13R1.29 CC(O)(CNN)c1ccc(F)cc1 Amb17234076 [0,2,0,0,0,0|1,0,0]=3 8113 B13R1.29 CCCC(C)(C)c1ccc(O)cc1 Amb28351363 [0,2,0,0,0,0|1,0,0]=3 8114 B13R1.29 CCCC(C)(O)c1ccc(Br)cn1 Amb35669656 [0,2,0,0,0,0|2,0,0]=4 8115 B13R1.29 CCCC(C)(O)c1ccc(Cl)cc1 Amb9676868 [0,2,0,0,0,0|1,0,0]=3 8116 B13R1.29 CCCC(C)(O)c1ccc(Cl)cn1 Amb35676362 [0,2,0,0,0,0|2,0,0]=4 8117 B13R1.29 CCCC(C)(O)c1ccc(O)cc1 Amb27591989 [0,2,0,0,0,0|1,0,0]=3 8118 B13R1.29 CCCC(F)(F)c1ccc(F)cc1 Amb20669701 [0,2,0,0,0,0|2,0,0]=4 8119 B13R1.29 CCNC(C)(C)c1ccc(Cl)cc1 Amb28207012 [0,2,0,0,0,0|2,0,0]=4 8120 B13R1.29 CNCC(C)(C)c1ccc(Br)cc1 Amb17255979 [0,2,0,0,0,0|0,0,0]=2 8121 B13R1.29 CNCC(C)(C)c1ccc(C)cc1 Amb17233337 [0,2,0,0,0,0|0,0,0]=2 8122 B13R1.29 CNCC(C)(C)c1ccc(Cl)cc1 Amb17236698 [0,2,0,0,0,0|0,0,0]=2 8123 B13R1.29 CNCC(C)(C)c1ccc(F)cc1 Amb17233832 [0,2,0,0,0,0|0,0,0]=2 8124 B13R1.29 CNCC(C)(O)c1ccc(Br)cc1 Amb5751092 [0,2,0,0,0,0|0,0,0]=2 8125 B13R1.29 CNCC(C)(O)c1ccc(C)cc1 Amb5751083 [0,2,0,0,0,0|0,0,0]=2 8126 B13R1.29 CNCC(C)(O)c1ccc(Cl)cc1 Amb5751091 [0,2,0,0,0,0|0,0,0]=2 8127 B13R1.29 CNCC(C)(O)c1ccc(F)cc1 Amb5751090 [0,2,0,0,0,0|0,0,0]=2 8128 B13R1.29 CNCS(=O)(=O)c1ccc(C)cc1 Amb28199433 [0,2,0,0,0,0|2,0,0]=4 8129 B13R1.29 COCC(C)(C)c1ccc(N)cc1 Amb25073268 [0,2,0,0,0,0|1,0,0]=3 8130 B13R1.29 COCC(C)(N)c1ccc(Br)cc1 Amb25128146 [0,2,0,0,0,0|1,0,0]=3 8131 B13R1.29 COCC(C)(N)c1ccc(C)nc1 Amb28242005 [0,2,0,0,0,0|2,0,0]=4 8132 B13R1.29 COCC(C)(O)c1ccc(Br)cn1 Amb35669657 [0,2,0,0,0,0|2,0,0]=4 8133 B13R1.29 COCC(C)(O)c1ccc(C)nc1 Amb28242004 [0,2,0,0,0,0|2,0,0]=4 8134 B13R1.29 COCC(C)(O)c1ccc(Cl)cc1 Amb18333910 [0,2,0,0,0,0|1,0,0]=3 8135 B13R1.29 COCC(C)(O)c1ccc(Cl)cn1 Amb35675779 [0,2,0,0,0,0|2,0,0]=4 8136 B13R1.29 COCC(F)(F)c1ccc(N)cc1 Amb28316681 [0,2,0,0,0,0|2,0,0]=4 8137 B13R1.29 COCC(F)(F)c1ccc(O)cc1 Amb28316615 [0,2,0,0,0,0|2,0,0]=4 8138 B13R1.29 C[C@@](N)(CC#N)c1ccc(Cl)cc1 Amb28322874 [0,2,0,0,0,0|2,0,0]=4 8139 B13R1.29 C[C@@](N)(CCO)c1ccc(I)cc1 Amb27225984 [0,2,0,0,0,0|2,0,0]=4 8140 B13R1.29 C[C@@](N)(CCO)c1ccc(N)cc1 Amb27814600 [0,2,0,0,0,0|2,0,0]=4 8141 B13R1.29 C[C@@](N)(CCO)c1ccc(O)cc1 Amb27949682 [0,2,0,0,0,0|2,0,0]=4 8142 B13R1.29 C[C@@](N)(CCO)c1ccc(S)cc1 Amb27166593 [0,2,0,0,0,0|2,0,0]=4 8143 B13R1.29 C[C@@](O)(CCO)c1ccc(F)cc1 Amb27197566 [0,2,0,0,0,0|2,0,0]=4 8144 B13R1.29 C[C@](N)(CC#N)c1ccc(Cl)cc1 Amb28385428 [0,2,0,0,0,0|2,0,0]=4 8145 B13R1.29 C[C@](N)(CCO)c1ccc(Cl)cc1 Amb27227844 [0,2,0,0,0,0|2,0,0]=4 8146 B13R1.29 C[C@](N)(CCO)c1ccc(F)cc1 Amb27250718 [0,2,0,0,0,0|2,0,0]=4 8147 B13R1.29 C[C@](N)(CCO)c1ccc(N)cc1 Amb27849744 [0,2,0,0,0,0|2,0,0]=4 8148 B13R1.29 Cc1ccc(C(C)(C)CCN)cc1 Amb17233336 [0,2,0,0,0,0|2,0,0]=4 8149 B13R1.29 Cc1ccc(C(C)(C)CON)cc1 Amb33373960 [0,2,0,0,0,0|2,0,0]=4 8150 B13R1.29 Cc1ccc(C(C)(N)CCO)cc1 Amb18862953 [0,2,0,0,0,0|2,0,0]=4 8151 B13R1.29 Cc1ccc(C(C)(O)CCN)cc1 Amb18065882 [0,2,0,0,0,0|2,0,0]=4 8152 B13R1.29 Cc1ccc(C(C)(O)CNN)cc1 Amb17233749 [0,2,0,0,0,0|1,0,0]=3 8153 B13R1.29 Cc1ccc([C@@](C)(N)CCO)cc1 Amb27404341 [0,2,0,0,0,0|2,0,0]=4 8154 B13R1.132 C=C(C)CC(Cl)c1ccc(Cl)cc1 Amb27623871 [0,2,0,0,0,0|2,0,0]=4 8155 B13R1.132 C=C(C)CC(Cl)c1ccc(F)cc1 Amb27179289 [0,2,0,0,0,0|2,0,0]=4 8156 B13R1.132 C=C(C)CC(N)c1ccc(C)cc1 Amb27777784 [0,2,0,0,0,0|2,0,0]=4 8157 B13R1.132 C=C(C)CC(N)c1ccc(F)cc1 Amb28381355 [0,2,0,0,0,0|2,0,0]=4 8158 B13R1.132 C=C(C)CC(N)c1ccc(O)cc1 Amb28131470 [0,2,0,0,0,0|2,0,0]=4 8159 B13R1.132 C=C(C)CC(O)c1ccc(C)cc1 Amb28424197 [0,2,0,0,0,0|2,0,0]=4 8160 B13R1.132 C=C(C)CN(C)c1ccc(I)cc1 Amb27388522 [0,2,0,0,0,0|2,0,0]=4 8161 B13R1.132 C=C(C)C[C@@H](N)c1ccc(C)cc1 Amb28349263 [0,2,0,0,0,0|2,0,0]=4 8162 B13R1.132 C=C(C)C[C@@H](N)c1ccc(Cl)cc1 Amb27818031 [0,2,0,0,0,0|2,0,0]=4 8163 B13R1.132 C=C(C)C[C@@H](O)c1ccc(Cl)cc1 Amb27748861 [0,2,0,0,0,0|2,0,0]=4 8164 B13R1.132 C=C(C)C[C@H](N)c1ccc(C)cc1 Amb28196690 [0,2,0,0,0,0|2,0,0]=4 8165 B13R1.132 C=C(C)C[C@H](N)c1ccc(Cl)cc1 Amb28056208 [0,2,0,0,0,0|2,0,0]=4 8166 B13R1.132 C=C(C)C[C@H](N)c1ccc(F)cc1 Amb27467938 [0,2,0,0,0,0|2,0,0]=4 8167 B13R1.132 C=C(C)C[C@H](N)c1ccc(I)cc1 Amb27818117 [0,2,0,0,0,0|2,0,0]=4 8168 B13R1.132 C=C(C)C[C@H](O)c1ccc(Cl)cc1 Amb27466575 [0,2,0,0,0,0|2,0,0]=4 8169 B13R1.132 CC(=O)CC(C)c1ccc(Br)cc1 Amb5740077 [0,2,0,0,0,0|1,0,0]=3 8170 B13R1.132 CC(=O)CC(C)c1ccc(C)cc1 Amb5740068 [0,2,0,0,0,0|1,0,0]=3 8171 B13R1.132 CC(=O)CC(C)c1ccc(C)nc1 Amb28243581 [0,2,0,0,0,0|2,0,0]=4 8172 B13R1.132 CC(=O)CC(C)c1ccc(Cl)cc1 Amb5740076 [0,2,0,0,0,0|1,0,0]=3 8173 B13R1.132 CC(=O)CC(C)c1ccc(F)cc1 Amb5740075 [0,2,0,0,0,0|1,0,0]=3 8174 B13R1.132 CC(=O)CC(O)c1ccc(Br)cc1 Amb27179586 [0,2,0,0,0,0|2,0,0]=4 8175 B13R1.132 CC(=O)CC(O)c1ccc(Cl)cc1 Amb24346726 [0,2,0,0,0,0|2,0,0]=4 8176 B13R1.132 CC(=O)CC(O)c1ccc(F)cc1 Amb25080847 [0,2,0,0,0,0|2,0,0]=4 8177 B13R1.132 CC(=O)CC(O)c1ccc(N)cc1 Amb28369759 [0,2,0,0,0,0|2,0,0]=4 8178 B13R1.132 CC(=O)C[C@@H](O)c1ccc(Cl)cc1 Amb28205948 [0,2,0,0,0,0|2,0,0]=4 8179 B13R1.132 CC(=O)C[C@@H](O)c1ccc(F)cc1 Amb28315073 [0,2,0,0,0,0|2,0,0]=4 8180 B13R1.132 CC(=O)C[C@H](C)c1ccc(C)cc1 Amb26484306 [0,2,0,0,0,0|1,0,0]=3 8181 B13R1.132 CC(=O)NC(C)c1ccc(Br)cc1 Amb8561898 [0,2,0,0,0,0|2,0,0]=4 8182 B13R1.132 CC(=O)NC(C)c1ccc(C)cc1 Amb8015697 [0,2,0,0,0,0|2,0,0]=4 8183 B13R1.132 CC(=O)NC(C)c1ccc(F)cc1 Amb5455961 [0,2,0,0,0,0|2,0,0]=4 8184 B13R1.132 CC(=O)NC(C)c1ccc(N)cc1 Amb8904195 [0,2,0,0,0,0|2,0,0]=4 8185 B13R1.132 CC(=O)NC(C)c1ccc(O)cc1 Amb1068623 [0,2,0,0,0,0|2,0,0]=4 8186 B13R1.132 CC(=O)N[C@@H](C)c1ccc(Br)cc1 Amb27772051 [0,2,0,0,0,0|2,0,0]=4 8187 B13R1.132 CC(=O)N[C@@H](C)c1ccc(Cl)cc1 Amb27608862 [0,2,0,0,0,0|2,0,0]=4 8188 B13R1.132 CC(=O)N[C@@H](C)c1ccc(O)cc1 Amb24602338 [0,2,0,0,0,0|2,0,0]=4 8189 B13R1.132 CC(=O)N[C@H](C)c1ccc(Br)cc1 Amb27594632 [0,2,0,0,0,0|2,0,0]=4 8190 B13R1.132 CC(=O)N[C@H](C)c1ccc(C)cc1 Amb27771328 [0,2,0,0,0,0|2,0,0]=4 8191 B13R1.132 CC(=O)N[C@H](C)c1ccc(Cl)cc1 Amb26454345 [0,2,0,0,0,0|2,0,0]=4 8192 B13R1.132 CC(=O)OC(C)c1ccc(C)cc1 Amb26887969 [0,2,0,0,0,0|2,0,0]=4 8193 B13R1.132 CC(=O)OC(C)c1ccc(O)cc1 Amb18128606 [0,2,0,0,0,0|2,0,0]=4 8194 B13R1.132 CC(Br)CC(C)c1ccc(Br)cc1 Amb35656676 [0,2,0,0,0,0|1,0,0]=3 8195 B13R1.132 CC(Br)CC(C)c1ccc(F)cc1 Amb24379714 [0,2,0,0,0,0|1,0,0]=3 8196 B13R1.132 CC(C)CC(Br)c1ccc(Br)cc1 Amb28064533 [0,2,0,0,0,0|2,0,0]=4 8197 B13R1.132 CC(C)CC(Cl)c1ccc(Br)cc1 Amb28187794 [0,2,0,0,0,0|2,0,0]=4 8198 B13R1.132 CC(C)CC(N)c1ccc(Br)cc1 Amb6259906 [0,2,0,0,0,0|2,0,0]=4 8199 B13R1.132 CC(C)CC(N)c1ccc(Cl)cc1 Amb6663516 [0,2,0,0,0,0|2,0,0]=4 8200 B13R1.132 CC(C)CC(N)c1ccc(F)cc1 Amb9717428 [0,2,0,0,0,0|2,0,0]=4 8201 B13R1.132 CC(C)CC(N)c1ccc(I)cc1 Amb25961777 [0,2,0,0,0,0|2,0,0]=4 8202 B13R1.132 CC(C)CC(N)c1ccc(I)cc1 Amb32412824 [0,2,0,0,0,0|2,0,0]=4 8203 B13R1.132 CC(C)CC(N)c1ccc(O)cc1 Amb24656146 [0,2,0,0,0,0|2,0,0]=4 8204 B13R1.132 CC(C)CC(O)c1ccc(Br)cc1 Amb17159432 [0,2,0,0,0,0|2,0,0]=4 8205 B13R1.132 CC(C)CC(O)c1ccc(Cl)cc1 Amb17139733 [0,2,0,0,0,0|2,0,0]=4 8206 B13R1.132 CC(C)CC(O)c1ccc(F)cc1 Amb17139022 [0,2,0,0,0,0|2,0,0]=4 8207 B13R1.132 CC(C)CC(O)c1ccc(N)cc1 Amb17101752 [0,2,0,0,0,0|2,0,0]=4 8208 B13R1.132 CC(C)CC(O)c1ccc(O)cc1 Amb24408370 [0,2,0,0,0,0|2,0,0]=4 8209 B13R1.132 CC(C)C[C@@H](N)c1ccc(I)cc1 Amb28457451 [0,2,0,0,0,0|2,0,0]=4 8210 B13R1.132 CC(C)C[C@@H](N)c1ccc(O)cc1 Amb28056118 [0,2,0,0,0,0|2,0,0]=4 8211 B13R1.132 CC(C)C[C@H](N)c1ccc(Cl)cc1 Amb27640676 [0,2,0,0,0,0|2,0,0]=4 8212 B13R1.132 CC(C)C[C@H](O)c1ccc(F)cc1 Amb27835079 [0,2,0,0,0,0|2,0,0]=4 8213 B13R1.132 CC(C)NC(C)c1ccc(Br)cc1 Amb6685420 [0,2,0,0,0,0|2,0,0]=4 8214 B13R1.132 CC(C)NC(C)c1ccc(Cl)cc1 Amb6685428 [0,2,0,0,0,0|2,0,0]=4 8215 B13R1.132 CC(C)NC(C)c1ccc(F)cc1 Amb6685448 [0,2,0,0,0,0|2,0,0]=4 8216 B13R1.132 CC(C)NC(C)c1ccc(I)cc1 Amb9622301 [0,2,0,0,0,0|2,0,0]=4 8217 B13R1.132 CC(C)N[C@H](C)c1ccc(F)cc1 Amb27476639 [0,2,0,0,0,0|2,0,0]=4 8218 B13R1.132 CC(C)OC(C)c1ccc(Br)cc1 Amb23443734 [0,2,0,0,0,0|2,0,0]=4 8219 B13R1.132 CC(C)OC(C)c1ccc(I)cc1 Amb33512231 [0,2,0,0,0,0|2,0,0]=4 8220 B13R1.132 CC(C)SC(C)c1ccc(N)cc1 Amb18974010 [0,2,0,0,0,0|2,0,0]=4 8221 B13R1.132 CC(CC(=N)N)c1ccc(F)cc1 Amb33423657 [0,2,0,0,0,0|2,0,0]=4 8222 B13R1.132 CC(CC(=O)Cl)c1ccc(F)cc1 Amb5738846 [0,2,0,0,0,0|2,0,0]=4 8223 B13R1.132 CC(CC(=O)O)c1ccc(Br)cc1 Amb6382816 [0,2,0,0,0,0|2,0,0]=4 8224 B13R1.132 CC(CC(=O)O)c1ccc(Cl)cc1 Amb4011197 [0,2,0,0,0,0|2,0,0]=4 8225 B13R1.132 CC(CC(=O)O)c1ccc(F)cc1 Amb5738630 [0,2,0,0,0,0|2,0,0]=4 8226 B13R1.132 CC(CC(=O)O)c1ccc(N)cc1 Amb26304198 [0,2,0,0,0,0|2,0,0]=4 8227 B13R1.132 CC(CC(=O)O)c1ccc(O)cc1 Amb540709 [0,2,0,0,0,0|2,0,0]=4 8228 B13R1.132 CC(CC(N)=O)c1ccc(Br)cc1 Amb17255957 [0,2,0,0,0,0|2,0,0]=4 8229 B13R1.132 CC(CC(N)=O)c1ccc(Cl)cc1 Amb17236666 [0,2,0,0,0,0|2,0,0]=4 8230 B13R1.132 CC(CC(N)=O)c1ccc(F)cc1 Amb17233786 [0,2,0,0,0,0|2,0,0]=4 8231 B13R1.132 CC(CC(N)=O)c1ccc(N)cc1 Amb25859609 [0,2,0,0,0,0|2,0,0]=4 8232 B13R1.132 CC(CC(N)=S)c1ccc(F)cc1 Amb33423586 [0,2,0,0,0,0|2,0,0]=4 8233 B13R1.132 CC(CN(C)C)c1ccc(Br)cc1 Amb24727329 [0,2,0,0,0,0|0,0,0]=2 8234 B13R1.132 CC(CN(C)O)c1ccc(F)cc1 Amb33274569 [0,2,0,0,0,0|0,0,0]=2 8235 B13R1.132 CC(C[C@@H](C)N)c1ccc(F)cc1 Amb33273706 [0,2,0,0,0,0|1,0,0]=3 8236 B13R1.132 CC(C[C@@H](C)O)c1ccc(F)cc1 Amb33273703 [0,2,0,0,0,0|1,0,0]=3 8237 B13R1.132 CC(C[C@H](C)N)c1ccc(F)cc1 Amb33273705 [0,2,0,0,0,0|1,0,0]=3 8238 B13R1.132 CC(C[C@H](C)O)c1ccc(F)cc1 Amb33273704 [0,2,0,0,0,0|1,0,0]=3 8239 B13R1.132 CC(C[N+](=O)[O-])c1ccc(F)cc1 Amb33273687 [0,2,0,0,0,0|1,0,1]=4 8240 B13R1.132 CC(Cl)CC(C)c1ccc(Br)cc1 Amb35656674 [0,2,0,0,0,0|1,0,0]=3 8241 B13R1.132 CC(N)CC(C)c1ccc(Br)cc1 Amb30028232 [0,2,0,0,0,0|1,0,0]=3 8242 B13R1.132 CC(N)CC(C)c1ccc(Cl)cc1 Amb28401108 [0,2,0,0,0,0|1,0,0]=3 8243 B13R1.132 CC(N)CC(C)c1ccc(F)cc1 Amb27605429 [0,2,0,0,0,0|1,0,0]=3 8244 B13R1.132 CC(N)CC(O)c1ccc(F)cc1 Amb20669400 [0,2,0,0,0,0|2,0,0]=4 8245 B13R1.132 CC(N)CN(C)c1ccc(Br)cc1 Amb17059706 [0,2,0,0,0,0|2,0,0]=4 8246 B13R1.132 CC(N)CN(C)c1ccc(Cl)cc1 Amb17059705 [0,2,0,0,0,0|2,0,0]=4 8247 B13R1.132 CC(N)CN(C)c1ccc(F)cc1 Amb17059702 [0,2,0,0,0,0|2,0,0]=4 8248 B13R1.132 CC(NN(C)C)c1ccc(Br)cc1 Amb28207826 [0,2,0,0,0,0|1,0,0]=3 8249 B13R1.132 CC(NN(C)C)c1ccc(Br)cn1 Amb35669842 [0,2,0,0,0,0|2,0,0]=4 8250 B13R1.132 CC(NN(C)C)c1ccc(Cl)cc1 Amb27485184 [0,2,0,0,0,0|1,0,0]=3 8251 B13R1.132 CC(NN(C)C)c1ccc(Cl)cn1 Amb35676507 [0,2,0,0,0,0|2,0,0]=4 8252 B13R1.132 CC(NS(C)=O)c1ccc(N)cc1 Amb27862070 [0,2,0,0,0,0|2,0,0]=4 8253 B13R1.132 CC(O)CC(C)c1ccc(Br)cc1 Amb35626023 [0,2,0,0,0,0|1,0,0]=3 8254 B13R1.132 CC(O)CC(C)c1ccc(F)cc1 Amb27805380 [0,2,0,0,0,0|1,0,0]=3 8255 B13R1.132 CC(O)CC(C)c1ccc(N)cc1 Amb35740879 [0,2,0,0,0,0|1,0,0]=3 8256 B13R1.132 CC(O)CN(C)c1ccc(Br)cc1 Amb17349688 [0,2,0,0,0,0|2,0,0]=4 8257 B13R1.132 CC(O)CN(C)c1ccc(Cl)cc1 Amb17337505 [0,2,0,0,0,0|2,0,0]=4 8258 B13R1.132 CC(O)CN(C)c1ccc(F)cc1 Amb17335628 [0,2,0,0,0,0|2,0,0]=4 8259 B13R1.132 CC(O)CN(C)c1ccc(I)cc1 Amb27457308 [0,2,0,0,0,0|2,0,0]=4 8260 B13R1.132 CN(C)CC(=O)c1ccc(Br)cc1 Amb9217327 [0,2,0,0,0,0|1,0,1]=4 8261 B13R1.132 CN(C)CC(=O)c1ccc(Cl)cc1 Amb4442842 [0,2,0,0,0,0|1,0,1]=4 8262 B13R1.132 CN(C)CC(=O)c1ccc(F)cc1 Amb9217326 [0,2,0,0,0,0|1,0,1]=4 8263 B13R1.132 CN(C)CC(=O)c1ccc(N)cc1 Amb17090484 [0,2,0,0,0,0|1,0,1]=4 8264 B13R1.132 CN(C)CC(Cl)c1ccc(Br)cc1 Amb17547049 [0,2,0,0,0,0|1,0,0]=3 8265 B13R1.132 CN(C)CC(Cl)c1ccc(Cl)cc1 Amb17547086 [0,2,0,0,0,0|1,0,0]=3 8266 B13R1.132 CN(C)CC(Cl)c1ccc(F)cc1 Amb17547138 [0,2,0,0,0,0|1,0,0]=3 8267 B13R1.132 CN(C)CC(N)c1ccc(Cl)cc1 Amb33543787 [0,2,0,0,0,0|1,0,0]=3 8268 B13R1.132 CN(C)CC(N)c1ccc(Cl)cc1 Amb33552928 [0,2,0,0,0,0|1,0,0]=3 8269 B13R1.132 CN(C)CC(N)c1ccc(F)cc1 Amb1125585 [0,2,0,0,0,0|1,0,0]=3 8270 B13R1.132 CN(C)CC(O)c1ccc(Br)cc1 Amb17104307 [0,2,0,0,0,0|1,0,0]=3 8271 B13R1.132 CN(C)CC(O)c1ccc(Cl)cc1 Amb17104292 [0,2,0,0,0,0|1,0,0]=3 8272 B13R1.132 CN(C)CC(O)c1ccc(F)cc1 Amb17104286 [0,2,0,0,0,0|1,0,0]=3 8273 B13R1.132 CN(C)CC(O)c1ccc(N)cc1 Amb17090505 [0,2,0,0,0,0|1,0,0]=3 8274 B13R1.132 CN(C)CC(O)c1ccc(O)cc1 Amb17307602 [0,2,0,0,0,0|1,0,0]=3 8275 B13R1.132 C[C@@H](CC(=O)O)c1ccc(Cl)cc1 Amb25924494 [0,2,0,0,0,0|2,0,0]=4 8276 B13R1.132 C[C@@H](CC(=O)O)c1ccc(O)cc1 Amb28320785 [0,2,0,0,0,0|2,0,0]=4 8277 B13R1.132 C[C@@H](N)CN(C)c1ccc(F)cc1 Amb27238230 [0,2,0,0,0,0|2,0,0]=4 8278 B13R1.132 C[C@H](CC(=O)O)c1ccc(Cl)cc1 Amb25288141 [0,2,0,0,0,0|2,0,0]=4 8279 B13R1.132 C[C@H](CC(=O)O)c1ccc(F)cc1 Amb22225229 [0,2,0,0,0,0|2,0,0]=4 8280 B13R1.132 C[C@H](O)CN(C)c1ccc(F)cc1 Amb28240639 [0,2,0,0,0,0|2,0,0]=4 8281 B13R1.132 C[C@H](O)C[C@@H](C)c1ccc(F)cc1 Amb27484776 [0,2,0,0,0,0|1,0,0]=3 8282 B13R1.132 C\C(=N/N(C)C)c1ccc(C)cc1 Amb27224887 [0,2,0,0,0,0|1,0,1]=4 8283 B13R1.132 C\C(=N\N(C)C)c1ccc(C)cc1 Amb27649848 [0,2,0,0,0,0|1,0,1]=4 8284 B13R1.132 C\C(=N\N(C)C)c1ccc(Cl)cc1 Amb27977519 [0,2,0,0,0,0|1,0,1]=4 8285 B13R1.132 Cc1ccc(C(=O)CN(C)C)cc1 Amb9217338 [0,2,0,0,0,0|1,0,1]=4 8286 B13R1.132 Cc1ccc(C(C)CC(=O)O)cc1 Amb33528472 [0,2,0,0,0,0|2,0,0]=4 8287 B13R1.132 Cc1ccc(C(C)CC(=O)[O-])cc1 Amb17843541 [0,2,0,0,0,0|2,0,0]=4 8288 B13R1.132 Cc1ccc(C(C)CC(C)Cl)cn1 Amb28126057 [0,2,0,0,0,0|2,0,0]=4 8289 B13R1.132 Cc1ccc(C(C)CC(C)N)cn1 Amb27238261 [0,2,0,0,0,0|2,0,0]=4 8290 B13R1.132 Cc1ccc(C(C)CC(N)=O)cc1 Amb17233275 [0,2,0,0,0,0|2,0,0]=4 8291 B13R1.132 Cc1ccc(C(C)NC(C)C)cc1 Amb6685423 [0,2,0,0,0,0|2,0,0]=4 8292 B13R1.132 Cc1ccc(C(Cl)CN(C)C)cc1 Amb17546849 [0,2,0,0,0,0|1,0,0]=3 8293 B13R1.132 Cc1ccc(C(N)CC(C)C)cc1 Amb28994525 [0,2,0,0,0,0|2,0,0]=4 8294 B13R1.132 Cc1ccc(C(N)CC(C)C)cc1 Amb6255859 [0,2,0,0,0,0|2,0,0]=4 8295 B13R1.132 Cc1ccc(C(N)CN(C)C)cc1 Amb33543127 [0,2,0,0,0,0|1,0,0]=3 8296 B13R1.132 Cc1ccc(C(O)CC(C)C)cc1 Amb17138882 [0,2,0,0,0,0|2,0,0]=4 8297 B13R1.132 Cc1ccc(C(O)CC(C)N)cc1 Amb28351722 [0,2,0,0,0,0|2,0,0]=4 8298 B13R1.132 Cc1ccc(C(O)CN(C)C)cc1 Amb17104284 [0,2,0,0,0,0|1,0,0]=3 8299 B13R1.132 Cc1ccc(C(O)CN(C)C)cn1 Amb27604821 [0,2,0,0,0,0|2,0,0]=4 8300 B13R1.132 Cc1ccc(N(C)CC(C)C)cc1 Amb27981461 [0,2,0,0,0,0|2,0,0]=4 8301 B13R1.132 Cc1ccc(N(C)CC(C)N)cc1 Amb17059699 [0,2,0,0,0,0|2,0,0]=4 8302 B13R1.132 Cc1ccc(N(C)CC(C)O)cc1 Amb17335361 [0,2,0,0,0,0|2,0,0]=4 8303 B13R1.132 Cc1ccc(N(C)C[C@@H](C)N)cc1 Amb27605677 [0,2,0,0,0,0|2,0,0]=4 8304 B13R1.132 Cc1ccc([C@@H](C)CC(=O)O)cc1 Amb27984685 [0,2,0,0,0,0|2,0,0]=4 8305 B13R1.132 Cc1ccc([C@H](C)NC(C)C)cc1 Amb27454678 [0,2,0,0,0,0|2,0,0]=4 8306 B13R1.132 Cc1ccc([C@H](O)C[C@H](C)O)cc1 Amb27653213 [0,2,0,0,0,0|2,0,0]=4 8307 B13R1.452 C#Cc1ccc(C(=O)CNC)cc1 Amb32877905 [0,2,0,0,0,0|1,0,1]=4 8308 B13R1.452 C#Cc1ccc(C(C)CCN)cc1 Amb32877900 [0,2,0,0,0,0|2,0,0]=4 8309 B13R1.452 C#Cc1ccc(C(C)CON)cc1 Amb32876899 [0,2,0,0,0,0|2,0,0]=4 8310 B13R1.452 C#Cc1ccc(C(C)NCC)cc1 Amb27415262 [0,2,0,0,0,0|2,0,0]=4 8311 B13R1.452 C#Cc1ccc(C(O)CNC)cc1 Amb32877906 [0,2,0,0,0,0|1,0,0]=3 8312 B13R1.452 C#Cc1ccc([C@@H](N)CCC)cc1 Amb28243401 [0,2,0,0,0,0|2,0,0]=4 8313 B13R1.452 C#Cc1ccc([C@H](N)CCC)cc1 Amb27607165 [0,2,0,0,0,0|2,0,0]=4 8314 B13R1.452 CC(CCN)c1ccc(C#N)cc1 Amb33318367 [0,2,0,0,0,0|2,0,0]=4 8315 B13R1.452 CC(CON)c1ccc(C#N)cc1 Amb33318042 [0,2,0,0,0,0|2,0,0]=4 8316 B13R1.452 CCCC(C)c1ccc(NN)cc1 Amb28316381 [0,2,0,0,0,0|1,0,0]=3 8317 B13R1.452 CCCC(Cl)c1ccc(OC)cc1 Amb17139740 [0,2,0,0,0,0|2,0,0]=4 8318 B13R1.452 CCCC(N)c1ccc(CC)cc1 Amb6703708 [0,2,0,0,0,0|2,0,0]=4 8319 B13R1.452 CCCC(N)c1ccc(NC)cc1 Amb27201608 [0,2,0,0,0,0|2,0,0]=4 8320 B13R1.452 CCCC(N)c1ccc(OC)cc1 Amb9717653 [0,2,0,0,0,0|2,0,0]=4 8321 B13R1.452 CCCC(N)c1ccc(SC)cc1 Amb18942914 [0,2,0,0,0,0|2,0,0]=4 8322 B13R1.452 CCCC(N)c1ccc(SC)cc1 Amb32662361 [0,2,0,0,0,0|2,0,0]=4 8323 B13R1.452 CCCC(O)c1ccc(C#N)cc1 Amb27772411 [0,2,0,0,0,0|2,0,0]=4 8324 B13R1.452 CCCC(O)c1ccc(CC)cc1 Amb17138883 [0,2,0,0,0,0|2,0,0]=4 8325 B13R1.452 CCCC(O)c1ccc(OC)cc1 Amb9825850 [0,2,0,0,0,0|2,0,0]=4 8326 B13R1.452 CCCN(C)c1ccc(C=O)cc1 Amb8899139 [0,2,0,0,0,0|2,0,0]=4 8327 B13R1.452 CCC[C@H](N)c1ccc(NC)cc1 Amb28254805 [0,2,0,0,0,0|2,0,0]=4 8328 B13R1.452 CCNC(C)c1ccc(C#N)cc1 Amb6268944 [0,2,0,0,0,0|2,0,0]=4 8329 B13R1.452 CCNC(C)c1ccc(C#N)cc1 Amb9177749 [0,2,0,0,0,0|2,0,0]=4 8330 B13R1.452 CCNC(C)c1ccc(OC)cc1 Amb6264031 [0,2,0,0,0,0|2,0,0]=4 8331 B13R1.452 CCSC(C)c1ccc(C#N)cc1 Amb28064891 [0,2,0,0,0,0|2,0,0]=4 8332 B13R1.452 CCc1ccc(C(=O)CNC)cc1 Amb17233277 [0,2,0,0,0,0|1,0,1]=4 8333 B13R1.452 CCc1ccc(C(C)CC#N)cc1 Amb26003346 [0,2,0,0,0,0|2,0,0]=4 8334 B13R1.452 CCc1ccc(C(C)CCCl)cc1 Amb17236526 [0,2,0,0,0,0|2,0,0]=4 8335 B13R1.452 CCc1ccc(C(C)CCN)cc1 Amb5739008 [0,2,0,0,0,0|2,0,0]=4 8336 B13R1.452 CCc1ccc(C(C)CCO)cc1 Amb17233462 [0,2,0,0,0,0|2,0,0]=4 8337 B13R1.452 CCc1ccc(C(C)CNC)cc1 Amb17233339 [0,2,0,0,0,0|0,0,0]=2 8338 B13R1.452 CCc1ccc(C(C)CON)cc1 Amb33312988 [0,2,0,0,0,0|2,0,0]=4 8339 B13R1.452 CCc1ccc(C(O)CNC)cc1 Amb5750899 [0,2,0,0,0,0|1,0,0]=3 8340 B13R1.452 CCc1ccc(C(O)CNN)cc1 Amb17233734 [0,2,0,0,0,0|2,0,0]=4 8341 B13R1.452 CCc1ccc(C(O)CNO)cc1 Amb17335486 [0,2,0,0,0,0|2,0,0]=4 8342 B13R1.452 CCc1ccc(\C(C)=N\NC)cc1 Amb27452941 [0,2,0,0,0,0|1,0,1]=4 8343 B13R1.452 CNCC(=O)c1ccc(C#N)cc1 Amb26337982 [0,2,0,0,0,0|1,0,1]=4 8344 B13R1.452 CNCC(=O)c1ccc(OC)cc1 Amb17233534 [0,2,0,0,0,0|1,0,1]=4 8345 B13R1.452 CNCC(=O)c1ccc(OC)cc1 Amb33877530 [0,2,0,0,0,0|1,0,1]=4 8346 B13R1.452 CNCC(=O)c1ccc(SC)cc1 Amb18894528 [0,2,0,0,0,0|1,0,1]=4 8347 B13R1.452 CNCC(C)c1ccc(OC)cc1 Amb17233590 [0,2,0,0,0,0|0,0,0]=2 8348 B13R1.452 CNCC(C)c1ccc(SC)cc1 Amb18244078 [0,2,0,0,0,0|0,0,0]=2 8349 B13R1.452 CNCC(O)c1ccc(C#N)cc1 Amb18289720 [0,2,0,0,0,0|1,0,0]=3 8350 B13R1.452 CNCC(O)c1ccc(OC)cc1 Amb6357645 [0,2,0,0,0,0|1,0,0]=3 8351 B13R1.452 CNCC(O)c1ccc(OC)cn1 Amb33314908 [0,2,0,0,0,0|2,0,0]=4 8352 B13R1.452 CNCC(O)c1ccc(OC)nc1 Amb33198481 [0,2,0,0,0,0|2,0,0]=4 8353 B13R1.452 CNCC(O)c1ccc(SC)cc1 Amb18244096 [0,2,0,0,0,0|1,0,0]=3 8354 B13R1.452 COCC(N)c1ccc(C#N)cc1 Amb26046504 [0,2,0,0,0,0|2,0,0]=4 8355 B13R1.452 COC[C@H](N)c1ccc(C#N)cc1 Amb33872247 [0,2,0,0,0,0|2,0,0]=4 8356 B13R1.452 COc1ccc(C(C)CC#N)cc1 Amb27649177 [0,2,0,0,0,0|2,0,0]=4 8357 B13R1.452 COc1ccc(C(C)CCBr)cc1 Amb17256438 [0,2,0,0,0,0|2,0,0]=4 8358 B13R1.452 COc1ccc(C(C)CCCl)cc1 Amb17236867 [0,2,0,0,0,0|2,0,0]=4 8359 B13R1.452 COc1ccc(C(C)CCN)cc1 Amb5739017 [0,2,0,0,0,0|2,0,0]=4 8360 B13R1.452 COc1ccc(C(C)CCO)cc1 Amb17233696 [0,2,0,0,0,0|2,0,0]=4 8361 B13R1.452 COc1ccc(C(C)CON)cc1 Amb33224904 [0,2,0,0,0,0|2,0,0]=4 8362 B13R1.452 COc1ccc(C(O)CNN)cc1 Amb17233905 [0,2,0,0,0,0|2,0,0]=4 8363 B13R1.452 COc1ccc(C(O)CNO)cc1 Amb17335613 [0,2,0,0,0,0|2,0,0]=4 8364 B13R1.452 CSCC(O)c1ccc(C#N)cc1 Amb30018911 [0,2,0,0,0,0|2,0,0]=4 8365 B13R1.452 CSc1ccc(C(C)CCN)cc1 Amb18894538 [0,2,0,0,0,0|2,0,0]=4 8366 B13R1.452 CSc1ccc(C(C)CON)cc1 Amb33376339 [0,2,0,0,0,0|2,0,0]=4 8367 B13R1.466 CC(CC#N)c1ccc(Cl)c(Cl)c1 Amb27972199 [0,2,0,0,0,0|2,0,0]=4 8368 B13R1.466 CC(CC#N)c1ccc(F)c(Cl)c1 Amb25699947 [0,2,0,0,0,0|2,0,0]=4 8369 B13R1.466 CC(CC#N)c1ccc(F)c(F)c1 Amb24645303 [0,2,0,0,0,0|2,0,0]=4 8370 B13R1.466 CC(CCN)c1ccc(Br)c(Cl)c1 Amb33389389 [0,2,0,0,0,0|2,0,0]=4 8371 B13R1.466 CC(CCN)c1ccc(Br)c(F)c1 Amb33007268 [0,2,0,0,0,0|2,0,0]=4 8372 B13R1.466 CC(CCN)c1ccc(Cl)c(Br)c1 Amb33335332 [0,2,0,0,0,0|2,0,0]=4 8373 B13R1.466 CC(CCN)c1ccc(Cl)c(Cl)c1 Amb5739024 [0,2,0,0,0,0|2,0,0]=4 8374 B13R1.466 CC(CCN)c1ccc(F)c(Br)c1 Amb33387901 [0,2,0,0,0,0|2,0,0]=4 8375 B13R1.466 CC(CCN)c1ccc(F)c(Cl)c1 Amb18244121 [0,2,0,0,0,0|2,0,0]=4 8376 B13R1.466 CC(CCN)c1ccc(F)c(F)c1 Amb17234177 [0,2,0,0,0,0|2,0,0]=4 8377 B13R1.466 CC(CCN)c1ccc(O)c(Br)c1 Amb33389499 [0,2,0,0,0,0|2,0,0]=4 8378 B13R1.466 CC(CCN)c1ccc(O)c(Cl)c1 Amb33261370 [0,2,0,0,0,0|2,0,0]=4 8379 B13R1.466 CC(CCN)c1ccc(O)c(F)c1 Amb33421167 [0,2,0,0,0,0|2,0,0]=4 8380 B13R1.466 CC(CCN)c1ccc(O)c(O)c1 Amb33376047 [0,2,0,0,0,0|2,0,0]=4 8381 B13R1.466 CC(CCO)c1ccc(F)c(F)c1 Amb17234278 [0,2,0,0,0,0|2,0,0]=4 8382 B13R1.466 CC(CON)c1ccc(Br)c(Cl)c1 Amb33477289 [0,2,0,0,0,0|2,0,0]=4 8383 B13R1.466 CC(CON)c1ccc(Br)c(F)c1 Amb33005933 [0,2,0,0,0,0|2,0,0]=4 8384 B13R1.466 CC(CON)c1ccc(Cl)c(Br)c1 Amb33335762 [0,2,0,0,0,0|2,0,0]=4 8385 B13R1.466 CC(CON)c1ccc(Cl)c(Cl)c1 Amb33220488 [0,2,0,0,0,0|2,0,0]=4 8386 B13R1.466 CC(CON)c1ccc(F)c(Br)c1 Amb33387933 [0,2,0,0,0,0|2,0,0]=4 8387 B13R1.466 CC(CON)c1ccc(F)c(Cl)c1 Amb33260346 [0,2,0,0,0,0|2,0,0]=4 8388 B13R1.466 CC(CON)c1ccc(F)c(F)c1 Amb33375801 [0,2,0,0,0,0|2,0,0]=4 8389 B13R1.466 CC(CON)c1ccc(O)c(Br)c1 Amb33388572 [0,2,0,0,0,0|2,0,0]=4 8390 B13R1.466 CC(CON)c1ccc(O)c(Cl)c1 Amb33261381 [0,2,0,0,0,0|2,0,0]=4 8391 B13R1.466 CC(CON)c1ccc(O)c(F)c1 Amb33421244 [0,2,0,0,0,0|2,0,0]=4 8392 B13R1.466 CC(CON)c1ccc(O)c(O)c1 Amb33375728 [0,2,0,0,0,0|2,0,0]=4 8393 B13R1.466 CCCC(Br)c1ccc(C)c(C)c1 Amb27662524 [0,2,0,0,0,0|2,0,0]=4 8394 B13R1.466 CCCC(Br)c1ccc(F)c(Br)c1 Amb27416084 [0,2,0,0,0,0|2,0,0]=4 8395 B13R1.466 CCCC(Br)c1ccc(F)c(C)c1 Amb28189806 [0,2,0,0,0,0|2,0,0]=4 8396 B13R1.466 CCCC(C)N1C=CC(=O)C(N)=C1 Amb32699280 [0,2,0,0,0,0|2,0,0]=4 8397 B13R1.466 CCCC(C)c1ccc(O)c(C)c1 Amb28126658 [0,2,0,0,0,0|1,0,0]=3 8398 B13R1.466 CCCC(C)c1ccc(O)c(F)c1 Amb28198623 [0,2,0,0,0,0|1,0,0]=3 8399 B13R1.466 CCCC(Cl)c1ccc(C)c(F)c1 Amb28123910 [0,2,0,0,0,0|2,0,0]=4 8400 B13R1.466 CCCC(Cl)c1ccc(F)c(Br)c1 Amb27227608 [0,2,0,0,0,0|2,0,0]=4 8401 B13R1.466 CCCC(Cl)c1ccc(F)c(C)c1 Amb17139835 [0,2,0,0,0,0|2,0,0]=4 8402 B13R1.466 CCCC(Cl)c1ccc(F)c(Cl)c1 Amb35615649 [0,2,0,0,0,0|2,0,0]=4 8403 B13R1.466 CCCC(N)c1ccc(Br)c(Br)c1 Amb27640120 [0,2,0,0,0,0|2,0,0]=4 8404 B13R1.466 CCCC(N)c1ccc(Br)c(C)c1 Amb18276340 [0,2,0,0,0,0|2,0,0]=4 8405 B13R1.466 CCCC(N)c1ccc(Br)c(Cl)c1 Amb27224110 [0,2,0,0,0,0|2,0,0]=4 8406 B13R1.466 CCCC(N)c1ccc(Br)c(O)c1 Amb27469869 [0,2,0,0,0,0|2,0,0]=4 8407 B13R1.466 CCCC(N)c1ccc(C)c(Br)c1 Amb27961428 [0,2,0,0,0,0|2,0,0]=4 8408 B13R1.466 CCCC(N)c1ccc(C)c(C)c1 Amb7804197 [0,2,0,0,0,0|2,0,0]=4 8409 B13R1.466 CCCC(N)c1ccc(C)c(F)c1 Amb18181398 [0,2,0,0,0,0|2,0,0]=4 8410 B13R1.466 CCCC(N)c1ccc(C)c(O)c1 Amb27190831 [0,2,0,0,0,0|2,0,0]=4 8411 B13R1.466 CCCC(N)c1ccc(Cl)c(Br)c1 Amb27608339 [0,2,0,0,0,0|2,0,0]=4 8412 B13R1.466 CCCC(N)c1ccc(Cl)c(C)c1 Amb18275886 [0,2,0,0,0,0|2,0,0]=4 8413 B13R1.466 CCCC(N)c1ccc(Cl)c(Cl)c1 Amb13951613 [0,2,0,0,0,0|2,0,0]=4 8414 B13R1.466 CCCC(N)c1ccc(Cl)c(Cl)c1 Amb8995846 [0,2,0,0,0,0|2,0,0]=4 8415 B13R1.466 CCCC(N)c1ccc(Cl)c(N)c1 Amb27873391 [0,2,0,0,0,0|2,0,0]=4 8416 B13R1.466 CCCC(N)c1ccc(Cl)c(O)c1 Amb28253106 [0,2,0,0,0,0|2,0,0]=4 8417 B13R1.466 CCCC(N)c1ccc(F)c(Br)c1 Amb27177190 [0,2,0,0,0,0|2,0,0]=4 8418 B13R1.466 CCCC(N)c1ccc(F)c(C)c1 Amb17194548 [0,2,0,0,0,0|2,0,0]=4 8419 B13R1.466 CCCC(N)c1ccc(F)c(F)c1 Amb9755869 [0,2,0,0,0,0|2,0,0]=4 8420 B13R1.466 CCCC(N)c1ccc(F)c(I)c1 Amb28251148 [0,2,0,0,0,0|2,0,0]=4 8421 B13R1.466 CCCC(N)c1ccc(F)c(N)c1 Amb27398661 [0,2,0,0,0,0|2,0,0]=4 8422 B13R1.466 CCCC(N)c1ccc(F)c(O)c1 Amb28423416 [0,2,0,0,0,0|2,0,0]=4 8423 B13R1.466 CCCC(N)c1ccc(I)c(F)c1 Amb27238816 [0,2,0,0,0,0|2,0,0]=4 8424 B13R1.466 CCCC(N)c1ccc(N)c(C)c1 Amb28456540 [0,2,0,0,0,0|2,0,0]=4 8425 B13R1.466 CCCC(N)c1ccc(N)c(O)c1 Amb28040851 [0,2,0,0,0,0|2,0,0]=4 8426 B13R1.466 CCCC(N)c1ccc(O)c(Br)c1 Amb25992191 [0,2,0,0,0,0|2,0,0]=4 8427 B13R1.466 CCCC(N)c1ccc(O)c(C)c1 Amb27643310 [0,2,0,0,0,0|2,0,0]=4 8428 B13R1.466 CCCC(N)c1ccc(O)c(Cl)c1 Amb26036221 [0,2,0,0,0,0|2,0,0]=4 8429 B13R1.466 CCCC(N)c1ccc(O)c(F)c1 Amb27398620 [0,2,0,0,0,0|2,0,0]=4 8430 B13R1.466 CCCC(N)c1ccc(O)c(I)c1 Amb27177235 [0,2,0,0,0,0|2,0,0]=4 8431 B13R1.466 CCCC(O)c1ccc(Br)c(F)c1 Amb27608974 [0,2,0,0,0,0|2,0,0]=4 8432 B13R1.466 CCCC(O)c1ccc(C)c(C)c1 Amb17138884 [0,2,0,0,0,0|2,0,0]=4 8433 B13R1.466 CCCC(O)c1ccc(C)c(Cl)c1 Amb27221063 [0,2,0,0,0,0|2,0,0]=4 8434 B13R1.466 CCCC(O)c1ccc(C)c(F)c1 Amb18796619 [0,2,0,0,0,0|2,0,0]=4 8435 B13R1.466 CCCC(O)c1ccc(C)c(N)c1 Amb30024052 [0,2,0,0,0,0|2,0,0]=4 8436 B13R1.466 CCCC(O)c1ccc(Cl)c(C)c1 Amb18105838 [0,2,0,0,0,0|2,0,0]=4 8437 B13R1.466 CCCC(O)c1ccc(Cl)c(Cl)c1 Amb24531725 [0,2,0,0,0,0|2,0,0]=4 8438 B13R1.466 CCCC(O)c1ccc(Cl)c(F)c1 Amb24450596 [0,2,0,0,0,0|2,0,0]=4 8439 B13R1.466 CCCC(O)c1ccc(Cl)c(N)c1 Amb35620812 [0,2,0,0,0,0|2,0,0]=4 8440 B13R1.466 CCCC(O)c1ccc(F)c(Br)c1 Amb27243141 [0,2,0,0,0,0|2,0,0]=4 8441 B13R1.466 CCCC(O)c1ccc(F)c(C)c1 Amb17139023 [0,2,0,0,0,0|2,0,0]=4 8442 B13R1.466 CCCC(O)c1ccc(F)c(Cl)c1 Amb26619332 [0,2,0,0,0,0|2,0,0]=4 8443 B13R1.466 CCCC(O)c1ccc(F)c(F)c1 Amb17194580 [0,2,0,0,0,0|2,0,0]=4 8444 B13R1.466 CCCC(O)c1ccc(N)c(Br)c1 Amb35740687 [0,2,0,0,0,0|2,0,0]=4 8445 B13R1.466 CCCC(O)c1ccc(N)c(C)c1 Amb35588489 [0,2,0,0,0,0|2,0,0]=4 8446 B13R1.466 CCCC(O)c1ccc(N)c(Cl)c1 Amb35740463 [0,2,0,0,0,0|2,0,0]=4 8447 B13R1.466 CCCC(O)c1ccc(N)c(F)c1 Amb35583340 [0,2,0,0,0,0|2,0,0]=4 8448 B13R1.466 CCCN(C)c1ccc(F)c(F)c1 Amb27749033 [0,2,0,0,0,0|2,0,0]=4 8449 B13R1.466 CCCN(C)c1ccc(N)c(F)c1 Amb26028193 [0,2,0,0,0,0|2,0,0]=4 8450 B13R1.466 CCC[C@@H](N)c1ccc(Br)c(F)c1 Amb27585559 [0,2,0,0,0,0|2,0,0]=4 8451 B13R1.466 CCC[C@@H](N)c1ccc(Br)c(I)c1 Amb27587109 [0,2,0,0,0,0|2,0,0]=4 8452 B13R1.466 CCC[C@@H](N)c1ccc(C)c(F)c1 Amb27442932 [0,2,0,0,0,0|2,0,0]=4 8453 B13R1.466 CCC[C@@H](N)c1ccc(Cl)c(Br)c1 Amb27168846 [0,2,0,0,0,0|2,0,0]=4 8454 B13R1.466 CCC[C@@H](N)c1ccc(Cl)c(Cl)c1 Amb27171781 [0,2,0,0,0,0|2,0,0]=4 8455 B13R1.466 CCC[C@@H](N)c1ccc(Cl)c(F)c1 Amb27393602 [0,2,0,0,0,0|2,0,0]=4 8456 B13R1.466 CCC[C@@H](N)c1ccc(F)c(Br)c1 Amb28241016 [0,2,0,0,0,0|2,0,0]=4 8457 B13R1.466 CCC[C@@H](N)c1ccc(F)c(Cl)c1 Amb28129823 [0,2,0,0,0,0|2,0,0]=4 8458 B13R1.466 CCC[C@@H](N)c1ccc(F)c(I)c1 Amb27485092 [0,2,0,0,0,0|2,0,0]=4 8459 B13R1.466 CCC[C@@H](N)c1ccc(I)c(Br)c1 Amb27629027 [0,2,0,0,0,0|2,0,0]=4 8460 B13R1.466 CCC[C@@H](N)c1ccc(I)c(F)c1 Amb27813269 [0,2,0,0,0,0|2,0,0]=4 8461 B13R1.466 CCC[C@@H](O)c1ccc(Cl)c(Br)c1 Amb27755020 [0,2,0,0,0,0|2,0,0]=4 8462 B13R1.466 CCC[C@@H](O)c1ccc(F)c(Br)c1 Amb27225477 [0,2,0,0,0,0|2,0,0]=4 8463 B13R1.466 CCC[C@@H](O)c1ccc(F)c(Cl)c1 Amb27667684 [0,2,0,0,0,0|2,0,0]=4 8464 B13R1.466 CCC[C@H](N)c1ccc(Br)c(Br)c1 Amb27177353 [0,2,0,0,0,0|2,0,0]=4 8465 B13R1.466 CCC[C@H](N)c1ccc(Br)c(I)c1 Amb28188365 [0,2,0,0,0,0|2,0,0]=4 8466 B13R1.466 CCC[C@H](N)c1ccc(C)c(Cl)c1 Amb27265310 [0,2,0,0,0,0|2,0,0]=4 8467 B13R1.466 CCC[C@H](N)c1ccc(C)c(O)c1 Amb27267968 [0,2,0,0,0,0|2,0,0]=4 8468 B13R1.466 CCC[C@H](N)c1ccc(Cl)c(Cl)c1 Amb27177093 [0,2,0,0,0,0|2,0,0]=4 8469 B13R1.466 CCC[C@H](N)c1ccc(Cl)c(F)c1 Amb27180896 [0,2,0,0,0,0|2,0,0]=4 8470 B13R1.466 CCC[C@H](N)c1ccc(I)c(Br)c1 Amb27217563 [0,2,0,0,0,0|2,0,0]=4 8471 B13R1.466 CCC[C@H](N)c1ccc(I)c(Cl)c1 Amb27618220 [0,2,0,0,0,0|2,0,0]=4 8472 B13R1.466 CCC[C@H](N)c1ccc(O)c(C)c1 Amb27454258 [0,2,0,0,0,0|2,0,0]=4 8473 B13R1.466 CCC[C@H](N)c1ccc(O)c(N)c1 Amb27243846 [0,2,0,0,0,0|2,0,0]=4 8474 B13R1.466 CCC[C@H](O)c1ccc(Br)c(C)c1 Amb27390005 [0,2,0,0,0,0|2,0,0]=4 8475 B13R1.466 CCNC(C)c1ccc(Br)c(F)c1 Amb27464241 [0,2,0,0,0,0|2,0,0]=4 8476 B13R1.466 CCNC(C)c1ccc(C)c(Br)c1 Amb28401310 [0,2,0,0,0,0|2,0,0]=4 8477 B13R1.466 CCNC(C)c1ccc(F)c(Cl)c1 Amb6717381 [0,2,0,0,0,0|2,0,0]=4 8478 B13R1.466 CCNC(C)c1ccc(I)c(Cl)c1 Amb27447690 [0,2,0,0,0,0|2,0,0]=4 8479 B13R1.466 CCN[C@@H](C)c1ccc(F)c(F)c1 Amb28064685 [0,2,0,0,0,0|2,0,0]=4 8480 B13R1.466 CCN[C@H](C)c1ccc(Cl)c(Cl)c1 Amb28051296 [0,2,0,0,0,0|2,0,0]=4 8481 B13R1.466 CCN[C@H](C)c1ccc(F)c(Br)c1 Amb28062149 [0,2,0,0,0,0|2,0,0]=4 8482 B13R1.466 CCSC(C)c1ccc(F)c(Cl)c1 Amb27652460 [0,2,0,0,0,0|2,0,0]=4 8483 B13R1.466 CNCC(=O)c1ccc(Br)c(C)c1 Amb18227887 [0,2,0,0,0,0|1,0,1]=4 8484 B13R1.466 CNCC(=O)c1ccc(Br)c(Cl)c1 Amb24379078 [0,2,0,0,0,0|1,0,1]=4 8485 B13R1.466 CNCC(=O)c1ccc(Br)c(F)c1 Amb25342778 [0,2,0,0,0,0|1,0,1]=4 8486 B13R1.466 CNCC(=O)c1ccc(Br)c(N)c1 Amb18227846 [0,2,0,0,0,0|1,0,1]=4 8487 B13R1.466 CNCC(=O)c1ccc(Br)c(O)c1 Amb27840942 [0,2,0,0,0,0|1,0,1]=4 8488 B13R1.466 CNCC(=O)c1ccc(C)c(Br)c1 Amb18872420 [0,2,0,0,0,0|1,0,1]=4 8489 B13R1.466 CNCC(=O)c1ccc(C)c(C)c1 Amb17233278 [0,2,0,0,0,0|1,0,1]=4 8490 B13R1.466 CNCC(=O)c1ccc(C)c(Cl)c1 Amb18224989 [0,2,0,0,0,0|1,0,1]=4 8491 B13R1.466 CNCC(=O)c1ccc(C)c(F)c1 Amb26026492 [0,2,0,0,0,0|1,0,1]=4 8492 B13R1.466 CNCC(=O)c1ccc(C)c(N)c1 Amb18862930 [0,2,0,0,0,0|1,0,1]=4 8493 B13R1.466 CNCC(=O)c1ccc(C)c(O)c1 Amb25786501 [0,2,0,0,0,0|1,0,1]=4 8494 B13R1.466 CNCC(=O)c1ccc(Cl)c(Br)c1 Amb26607182 [0,2,0,0,0,0|1,0,1]=4 8495 B13R1.466 CNCC(=O)c1ccc(Cl)c(C)c1 Amb17314398 [0,2,0,0,0,0|1,0,1]=4 8496 B13R1.466 CNCC(=O)c1ccc(Cl)c(Cl)c1 Amb17314508 [0,2,0,0,0,0|1,0,1]=4 8497 B13R1.466 CNCC(=O)c1ccc(Cl)c(F)c1 Amb25180475 [0,2,0,0,0,0|1,0,1]=4 8498 B13R1.466 CNCC(=O)c1ccc(Cl)c(N)c1 Amb18864185 [0,2,0,0,0,0|1,0,1]=4 8499 B13R1.466 CNCC(=O)c1ccc(Cl)c(O)c1 Amb27480951 [0,2,0,0,0,0|1,0,1]=4 8500 B13R1.466 CNCC(=O)c1ccc(F)c(Br)c1 Amb25158269 [0,2,0,0,0,0|1,0,1]=4 8501 B13R1.466 CNCC(=O)c1ccc(F)c(C)c1 Amb17233788 [0,2,0,0,0,0|1,0,1]=4 8502 B13R1.466 CNCC(=O)c1ccc(F)c(Cl)c1 Amb18864487 [0,2,0,0,0,0|1,0,1]=4 8503 B13R1.466 CNCC(=O)c1ccc(F)c(F)c1 Amb17335732 [0,2,0,0,0,0|1,0,1]=4 8504 B13R1.466 CNCC(=O)c1ccc(F)c(N)c1 Amb18863009 [0,2,0,0,0,0|1,0,1]=4 8505 B13R1.466 CNCC(=O)c1ccc(F)c(O)c1 Amb28189338 [0,2,0,0,0,0|1,0,1]=4 8506 B13R1.466 CNCC(=O)c1ccc(N)c(O)c1 Amb27876604 [0,2,0,0,0,0|1,0,1]=4 8507 B13R1.466 CNCC(=O)c1ccc(O)c(Br)c1 Amb33388528 [0,2,0,0,0,0|1,0,1]=4 8508 B13R1.466 CNCC(=O)c1ccc(O)c(C)c1 Amb26591394 [0,2,0,0,0,0|1,0,1]=4 8509 B13R1.466 CNCC(=O)c1ccc(O)c(Cl)c1 Amb27866436 [0,2,0,0,0,0|1,0,1]=4 8510 B13R1.466 CNCC(=O)c1ccc(O)c(F)c1 Amb26413911 [0,2,0,0,0,0|1,0,1]=4 8511 B13R1.466 CNCC(=O)c1ccc(O)c(N)c1 Amb27776841 [0,2,0,0,0,0|1,0,1]=4 8512 B13R1.466 CNCC(=O)c1ccc(O)c(O)c1 Amb532937 [0,2,0,0,0,0|1,0,1]=4 8513 B13R1.466 CNCC(=O)c1ccc(O)c(O)c1 Amb9786586 [0,2,0,0,0,0|1,0,1]=4 8514 B13R1.466 CNCC(C)c1ccc(Br)c(C)c1 Amb27610353 [0,2,0,0,0,0|0,0,0]=2 8515 B13R1.466 CNCC(C)c1ccc(Br)c(Cl)c1 Amb27217892 [0,2,0,0,0,0|0,0,0]=2 8516 B13R1.466 CNCC(C)c1ccc(Br)c(F)c1 Amb26035322 [0,2,0,0,0,0|0,0,0]=2 8517 B13R1.466 CNCC(C)c1ccc(Br)c(O)c1 Amb24671459 [0,2,0,0,0,0|0,0,0]=2 8518 B13R1.466 CNCC(C)c1ccc(C)c(Br)c1 Amb27256692 [0,2,0,0,0,0|0,0,0]=2 8519 B13R1.466 CNCC(C)c1ccc(C)c(C)c1 Amb17233341 [0,2,0,0,0,0|0,0,0]=2 8520 B13R1.466 CNCC(C)c1ccc(C)c(Cl)c1 Amb25157030 [0,2,0,0,0,0|0,0,0]=2 8521 B13R1.466 CNCC(C)c1ccc(C)c(F)c1 Amb24582205 [0,2,0,0,0,0|0,0,0]=2 8522 B13R1.466 CNCC(C)c1ccc(C)c(O)c1 Amb24591843 [0,2,0,0,0,0|0,0,0]=2 8523 B13R1.466 CNCC(C)c1ccc(Cl)c(Br)c1 Amb25683070 [0,2,0,0,0,0|0,0,0]=2 8524 B13R1.466 CNCC(C)c1ccc(Cl)c(C)c1 Amb27150086 [0,2,0,0,0,0|0,0,0]=2 8525 B13R1.466 CNCC(C)c1ccc(Cl)c(Cl)c1 Amb26061259 [0,2,0,0,0,0|0,0,0]=2 8526 B13R1.466 CNCC(C)c1ccc(Cl)c(F)c1 Amb26611599 [0,2,0,0,0,0|0,0,0]=2 8527 B13R1.466 CNCC(C)c1ccc(Cl)c(O)c1 Amb27437172 [0,2,0,0,0,0|0,0,0]=2 8528 B13R1.466 CNCC(C)c1ccc(F)c(Br)c1 Amb27589046 [0,2,0,0,0,0|0,0,0]=2 8529 B13R1.466 CNCC(C)c1ccc(F)c(C)c1 Amb17233834 [0,2,0,0,0,0|0,0,0]=2 8530 B13R1.466 CNCC(C)c1ccc(F)c(Cl)c1 Amb18244124 [0,2,0,0,0,0|0,0,0]=2 8531 B13R1.466 CNCC(C)c1ccc(F)c(F)c1 Amb18243850 [0,2,0,0,0,0|0,0,0]=2 8532 B13R1.466 CNCC(C)c1ccc(F)c(O)c1 Amb25372024 [0,2,0,0,0,0|0,0,0]=2 8533 B13R1.466 CNCC(C)c1ccc(O)c(Br)c1 Amb24671364 [0,2,0,0,0,0|0,0,0]=2 8534 B13R1.466 CNCC(C)c1ccc(O)c(C)c1 Amb27755510 [0,2,0,0,0,0|0,0,0]=2 8535 B13R1.466 CNCC(C)c1ccc(O)c(Cl)c1 Amb25158279 [0,2,0,0,0,0|0,0,0]=2 8536 B13R1.466 CNCC(C)c1ccc(O)c(F)c1 Amb25156936 [0,2,0,0,0,0|0,0,0]=2 8537 B13R1.466 CNCC(C)c1ccc(O)c(O)c1 Amb27755475 [0,2,0,0,0,0|0,0,0]=2 8538 B13R1.466 CNCC(C)c1ncc(Br)c(O)n1 Amb33189061 [0,2,0,0,0,0|2,0,0]=4 8539 B13R1.466 CNCC(N)c1ccc(Cl)c(Cl)c1 Amb28121895 [0,2,0,0,0,0|1,0,0]=3 8540 B13R1.466 CNCC(O)c1ccc(Br)c(Br)c1 Amb27655080 [0,2,0,0,0,0|1,0,0]=3 8541 B13R1.466 CNCC(O)c1ccc(Br)c(C)c1 Amb26654054 [0,2,0,0,0,0|1,0,0]=3 8542 B13R1.466 CNCC(O)c1ccc(Br)c(Cl)c1 Amb25158726 [0,2,0,0,0,0|1,0,0]=3 8543 B13R1.466 CNCC(O)c1ccc(Br)c(F)c1 Amb28044385 [0,2,0,0,0,0|1,0,0]=3 8544 B13R1.466 CNCC(O)c1ccc(Br)c(N)c1 Amb18873507 [0,2,0,0,0,0|1,0,0]=3 8545 B13R1.466 CNCC(O)c1ccc(Br)c(O)c1 Amb28317259 [0,2,0,0,0,0|1,0,0]=3 8546 B13R1.466 CNCC(O)c1ccc(C)c(Br)c1 Amb25157401 [0,2,0,0,0,0|1,0,0]=3 8547 B13R1.466 CNCC(O)c1ccc(C)c(C)c1 Amb17233588 [0,2,0,0,0,0|1,0,0]=3 8548 B13R1.466 CNCC(O)c1ccc(C)c(Cl)c1 Amb26071933 [0,2,0,0,0,0|1,0,0]=3 8549 B13R1.466 CNCC(O)c1ccc(C)c(F)c1 Amb27144774 [0,2,0,0,0,0|1,0,0]=3 8550 B13R1.466 CNCC(O)c1ccc(C)c(N)c1 Amb18862980 [0,2,0,0,0,0|1,0,0]=3 8551 B13R1.466 CNCC(O)c1ccc(C)c(O)c1 Amb27478466 [0,2,0,0,0,0|1,0,0]=3 8552 B13R1.466 CNCC(O)c1ccc(Cl)c(Br)c1 Amb26520127 [0,2,0,0,0,0|1,0,0]=3 8553 B13R1.466 CNCC(O)c1ccc(Cl)c(C)c1 Amb18604580 [0,2,0,0,0,0|1,0,0]=3 8554 B13R1.466 CNCC(O)c1ccc(Cl)c(Cl)c1 Amb18997467 [0,2,0,0,0,0|1,0,0]=3 8555 B13R1.466 CNCC(O)c1ccc(Cl)c(F)c1 Amb18997483 [0,2,0,0,0,0|1,0,0]=3 8556 B13R1.466 CNCC(O)c1ccc(Cl)c(N)c1 Amb18225067 [0,2,0,0,0,0|1,0,0]=3 8557 B13R1.466 CNCC(O)c1ccc(Cl)c(O)c1 Amb28369718 [0,2,0,0,0,0|1,0,0]=3 8558 B13R1.466 CNCC(O)c1ccc(Cl)c(O)c1 Amb32670918 [0,2,0,0,0,0|1,0,0]=3 8559 B13R1.466 CNCC(O)c1ccc(F)c(Br)c1 Amb18997465 [0,2,0,0,0,0|1,0,0]=3 8560 B13R1.466 CNCC(O)c1ccc(F)c(C)c1 Amb17234000 [0,2,0,0,0,0|1,0,0]=3 8561 B13R1.466 CNCC(O)c1ccc(F)c(Cl)c1 Amb18244128 [0,2,0,0,0,0|1,0,0]=3 8562 B13R1.466 CNCC(O)c1ccc(F)c(F)c1 Amb17335898 [0,2,0,0,0,0|1,0,0]=3 8563 B13R1.466 CNCC(O)c1ccc(F)c(N)c1 Amb18863085 [0,2,0,0,0,0|1,0,0]=3 8564 B13R1.466 CNCC(O)c1ccc(N)c(Br)c1 Amb27485955 [0,2,0,0,0,0|1,0,0]=3 8565 B13R1.466 CNCC(O)c1ccc(N)c(Cl)c1 Amb27224804 [0,2,0,0,0,0|1,0,0]=3 8566 B13R1.466 CNCC(O)c1ccc(O)c(Br)c1 Amb33388527 [0,2,0,0,0,0|1,0,0]=3 8567 B13R1.466 CNCC(O)c1ccc(O)c(C)c1 Amb24468783 [0,2,0,0,0,0|1,0,0]=3 8568 B13R1.466 CNCC(O)c1ccc(O)c(Cl)c1 Amb28208300 [0,2,0,0,0,0|1,0,0]=3 8569 B13R1.466 CNCC(O)c1ccc(O)c(F)c1 Amb33421166 [0,2,0,0,0,0|1,0,0]=3 8570 B13R1.466 CNCC(O)c1ccc(O)c(O)c1 Amb2714813 [0,2,0,0,0,0|1,0,0]=3 8571 B13R1.466 CNCC(O)c1ccc(O)c(O)c1 Amb4029977 [0,2,0,0,0,0|1,0,0]=3 8572 B13R1.466 CNCC(O)c1ccc(O)c(O)c1 Amb533508 [0,2,0,0,0,0|1,0,0]=3 8573 B13R1.466 CNCC(O)c1cnc(Cl)c(C)c1 Amb33058218 [0,2,0,0,0,0|2,0,0]=4 8574 B13R1.466 CNCC(O)c1cnc(Cl)c(Cl)c1 Amb33413644 [0,2,0,0,0,0|2,0,0]=4 8575 B13R1.466 CNC[C@@H](O)c1ccc(O)c(N)c1 Amb28397960 [0,2,0,0,0,0|1,0,0]=3 8576 B13R1.466 CNC[C@@H](O)c1ccc(O)c(O)c1 Amb10843543 [0,2,0,0,0,0|1,0,0]=3 8577 B13R1.466 CNC[C@@H](O)c1ccc(O)c(O)c1 Amb19132113 [0,2,0,0,0,0|1,0,0]=3 8578 B13R1.466 CNC[C@H](O)c1ccc(O)c(O)c1 Amb2718779 [0,2,0,0,0,0|1,0,0]=3 8579 B13R1.466 CNC[C@H](O)c1ccc(O)c(O)c1 Amb33876204 [0,2,0,0,0,0|1,0,0]=3 8580 B13R1.466 CNC[C@H](O)c1ccc(O)c(O)c1 Amb6357964 [0,2,0,0,0,0|1,0,0]=3 8581 B13R1.466 CN\N=C(\C)c1ccc(F)c(Cl)c1 Amb28050991 [0,2,0,0,0,0|1,0,1]=4 8582 B13R1.466 COCC(C)N1C=CC(=O)C(N)=C1 Amb32699322 [0,2,0,0,0,0|2,0,0]=4 8583 B13R1.466 COCC(N)c1ccc(Br)c(I)c1 Amb27169168 [0,2,0,0,0,0|2,0,0]=4 8584 B13R1.466 COCC(N)c1ccc(C)c(Br)c1 Amb27176992 [0,2,0,0,0,0|2,0,0]=4 8585 B13R1.466 COCC(N)c1ccc(C)c(I)c1 Amb27962922 [0,2,0,0,0,0|2,0,0]=4 8586 B13R1.466 COCC(N)c1ccc(C)c(N)c1 Amb28314238 [0,2,0,0,0,0|2,0,0]=4 8587 B13R1.466 COCC(N)c1ccc(C)c(O)c1 Amb27815051 [0,2,0,0,0,0|2,0,0]=4 8588 B13R1.466 COCC(N)c1ccc(Cl)c(Br)c1 Amb28187033 [0,2,0,0,0,0|2,0,0]=4 8589 B13R1.466 COCC(N)c1ccc(Cl)c(Cl)c1 Amb18992517 [0,2,0,0,0,0|2,0,0]=4 8590 B13R1.466 COCC(N)c1ccc(Cl)c(O)c1 Amb27434893 [0,2,0,0,0,0|2,0,0]=4 8591 B13R1.466 COCC(N)c1ccc(F)c(Cl)c1 Amb25926941 [0,2,0,0,0,0|2,0,0]=4 8592 B13R1.466 COCC(N)c1ccc(F)c(F)c1 Amb1137160 [0,2,0,0,0,0|2,0,0]=4 8593 B13R1.466 COCC(N)c1ccc(F)c(N)c1 Amb27810816 [0,2,0,0,0,0|2,0,0]=4 8594 B13R1.466 COCC(N)c1ccc(I)c(Cl)c1 Amb27663942 [0,2,0,0,0,0|2,0,0]=4 8595 B13R1.466 COCC(N)c1ccc(O)c(Br)c1 Amb28366753 [0,2,0,0,0,0|2,0,0]=4 8596 B13R1.466 COCC(N)c1ccc(O)c(Cl)c1 Amb28312986 [0,2,0,0,0,0|2,0,0]=4 8597 B13R1.466 COCC(O)c1ccc(Br)c(C)c1 Amb27609151 [0,2,0,0,0,0|2,0,0]=4 8598 B13R1.466 COCC(O)c1ccc(Br)c(F)c1 Amb27601794 [0,2,0,0,0,0|2,0,0]=4 8599 B13R1.466 COCC(O)c1ccc(C)c(N)c1 Amb30024118 [0,2,0,0,0,0|2,0,0]=4 8600 B13R1.466 COCC(O)c1ccc(Cl)c(F)c1 Amb27231159 [0,2,0,0,0,0|2,0,0]=4 8601 B13R1.466 COCC(O)c1ccc(Cl)c(N)c1 Amb35620891 [0,2,0,0,0,0|2,0,0]=4 8602 B13R1.466 COCC(O)c1ccc(I)c(Cl)c1 Amb28316750 [0,2,0,0,0,0|2,0,0]=4 8603 B13R1.466 COCC(O)c1ccc(N)c(Br)c1 Amb35740799 [0,2,0,0,0,0|2,0,0]=4 8604 B13R1.466 COCC(O)c1ccc(N)c(C)c1 Amb35588580 [0,2,0,0,0,0|2,0,0]=4 8605 B13R1.466 COCC(O)c1ccc(N)c(Cl)c1 Amb35583040 [0,2,0,0,0,0|2,0,0]=4 8606 B13R1.466 COCC(O)c1ccc(N)c(F)c1 Amb35740411 [0,2,0,0,0,0|2,0,0]=4 8607 B13R1.466 COC[C@@H](N)c1ccc(Br)c(Cl)c1 Amb27459705 [0,2,0,0,0,0|2,0,0]=4 8608 B13R1.466 COC[C@@H](N)c1ccc(Br)c(O)c1 Amb28124704 [0,2,0,0,0,0|2,0,0]=4 8609 B13R1.466 COC[C@@H](N)c1ccc(C)c(Cl)c1 Amb28423523 [0,2,0,0,0,0|2,0,0]=4 8610 B13R1.466 COC[C@@H](N)c1ccc(Cl)c(Br)c1 Amb27793147 [0,2,0,0,0,0|2,0,0]=4 8611 B13R1.466 COC[C@@H](N)c1ccc(Cl)c(C)c1 Amb27810833 [0,2,0,0,0,0|2,0,0]=4 8612 B13R1.466 COC[C@@H](N)c1ccc(Cl)c(Cl)c1 Amb27864956 [0,2,0,0,0,0|2,0,0]=4 8613 B13R1.466 COC[C@@H](N)c1ccc(Cl)c(F)c1 Amb28041141 [0,2,0,0,0,0|2,0,0]=4 8614 B13R1.466 COC[C@@H](N)c1ccc(Cl)c(I)c1 Amb28326020 [0,2,0,0,0,0|2,0,0]=4 8615 B13R1.466 COC[C@@H](N)c1ccc(F)c(Cl)c1 Amb27482822 [0,2,0,0,0,0|2,0,0]=4 8616 B13R1.466 COC[C@@H](N)c1ccc(F)c(F)c1 Amb28346804 [0,2,0,0,0,0|2,0,0]=4 8617 B13R1.466 COC[C@@H](N)c1ccc(O)c(C)c1 Amb27609580 [0,2,0,0,0,0|2,0,0]=4 8618 B13R1.466 COC[C@@H](N)c1ccc(O)c(I)c1 Amb27180640 [0,2,0,0,0,0|2,0,0]=4 8619 B13R1.466 COC[C@@H](N)c1ccc(O)c(O)c1 Amb27254077 [0,2,0,0,0,0|2,0,0]=4 8620 B13R1.466 COC[C@H](N)c1ccc(C)c(F)c1 Amb27874004 [0,2,0,0,0,0|2,0,0]=4 8621 B13R1.466 COC[C@H](N)c1ccc(C)c(I)c1 Amb28398134 [0,2,0,0,0,0|2,0,0]=4 8622 B13R1.466 COC[C@H](N)c1ccc(C)c(N)c1 Amb27413878 [0,2,0,0,0,0|2,0,0]=4 8623 B13R1.466 COC[C@H](N)c1ccc(C)c(O)c1 Amb28073982 [0,2,0,0,0,0|2,0,0]=4 8624 B13R1.466 COC[C@H](N)c1ccc(Cl)c(C)c1 Amb28130913 [0,2,0,0,0,0|2,0,0]=4 8625 B13R1.466 COC[C@H](N)c1ccc(F)c(O)c1 Amb28282703 [0,2,0,0,0,0|2,0,0]=4 8626 B13R1.466 COC[C@H](N)c1ccc(I)c(Br)c1 Amb27436187 [0,2,0,0,0,0|2,0,0]=4 8627 B13R1.466 COC[C@H](N)c1ccc(N)c(Cl)c1 Amb27608488 [0,2,0,0,0,0|2,0,0]=4 8628 B13R1.466 COC[C@H](N)c1ccc(O)c(C)c1 Amb28040895 [0,2,0,0,0,0|2,0,0]=4 8629 B13R1.466 COC[C@H](N)c1ccc(O)c(F)c1 Amb27595602 [0,2,0,0,0,0|2,0,0]=4 8630 B13R1.466 CONC(C)c1ccc(C)c(F)c1 Amb27228593 [0,2,0,0,0,0|2,0,0]=4 8631 B13R1.466 CONC(C)c1ccc(Cl)c(F)c1 Amb27879203 [0,2,0,0,0,0|2,0,0]=4 8632 B13R1.466 CSCC(N)c1ccc(C)c(C)c1 Amb18995357 [0,2,0,0,0,0|2,0,0]=4 8633 B13R1.466 CSCC(N)c1ccc(Cl)c(Cl)c1 Amb27834450 [0,2,0,0,0,0|2,0,0]=4 8634 B13R1.466 CSCC(N)c1ccc(F)c(Cl)c1 Amb35613659 [0,2,0,0,0,0|2,0,0]=4 8635 B13R1.466 CSCC(O)c1ccc(C)c(Cl)c1 Amb27758359 [0,2,0,0,0,0|2,0,0]=4 8636 B13R1.466 CSCC(O)c1ccc(F)c(C)c1 Amb19086357 [0,2,0,0,0,0|2,0,0]=4 8637 B13R1.466 CSCC(O)c1ccc(F)c(Cl)c1 Amb35632916 [0,2,0,0,0,0|2,0,0]=4 8638 B13R1.466 CSCC(O)c1ccc(O)c(O)c1 Amb18653357 [0,2,0,0,0,0|2,0,0]=4 8639 B13R1.466 Cc1cc(C(C)CC#N)ccc1Br Amb27755385 [0,2,0,0,0,0|2,0,0]=4 8640 B13R1.466 Cc1cc(C(C)CCBr)ccc1F Amb17257513 [0,2,0,0,0,0|2,0,0]=4 8641 B13R1.466 Cc1cc(C(C)CCCl)ccc1F Amb17237209 [0,2,0,0,0,0|2,0,0]=4 8642 B13R1.466 Cc1cc(C(C)CCN)ccc1Br Amb25936910 [0,2,0,0,0,0|2,0,0]=4 8643 B13R1.466 Cc1cc(C(C)CCN)ccc1Cl Amb18188139 [0,2,0,0,0,0|2,0,0]=4 8644 B13R1.466 Cc1cc(C(C)CCN)ccc1F Amb5739018 [0,2,0,0,0,0|2,0,0]=4 8645 B13R1.466 Cc1cc(C(C)CCO)ccc1F Amb17233920 [0,2,0,0,0,0|2,0,0]=4 8646 B13R1.466 Cc1cc(C(C)CON)ccc1Br Amb33332389 [0,2,0,0,0,0|2,0,0]=4 8647 B13R1.466 Cc1cc(C(C)CON)ccc1F Amb33316758 [0,2,0,0,0,0|2,0,0]=4 8648 B13R1.466 Cc1cc(C(O)CNN)ccc1F Amb18066135 [0,2,0,0,0,0|2,0,0]=4 8649 B13R1.466 Cc1cc(C(O)CNO)ccc1F Amb17335736 [0,2,0,0,0,0|2,0,0]=4 8650 B13R1.466 Cc1ccc(C(C)CC#N)cc1Br Amb27221942 [0,2,0,0,0,0|2,0,0]=4 8651 B13R1.466 Cc1ccc(C(C)CC#N)cc1C Amb24397128 [0,2,0,0,0,0|2,0,0]=4 8652 B13R1.466 Cc1ccc(C(C)CC#N)cc1Cl Amb25839341 [0,2,0,0,0,0|2,0,0]=4 8653 B13R1.466 Cc1ccc(C(C)CCCl)cc1C Amb17236529 [0,2,0,0,0,0|2,0,0]=4 8654 B13R1.466 Cc1ccc(C(C)CCN)cc1Br Amb25699936 [0,2,0,0,0,0|2,0,0]=4 8655 B13R1.466 Cc1ccc(C(C)CCN)cc1C Amb5739011 [0,2,0,0,0,0|2,0,0]=4 8656 B13R1.466 Cc1ccc(C(C)CCN)cc1Cl Amb25346479 [0,2,0,0,0,0|2,0,0]=4 8657 B13R1.466 Cc1ccc(C(C)CCN)cc1F Amb27446469 [0,2,0,0,0,0|2,0,0]=4 8658 B13R1.466 Cc1ccc(C(C)CCN)cc1O Amb33372654 [0,2,0,0,0,0|2,0,0]=4 8659 B13R1.466 Cc1ccc(C(C)CCO)cc1C Amb17233464 [0,2,0,0,0,0|2,0,0]=4 8660 B13R1.466 Cc1ccc(C(C)CON)cc1Br Amb33334551 [0,2,0,0,0,0|2,0,0]=4 8661 B13R1.466 Cc1ccc(C(C)CON)cc1C Amb33270870 [0,2,0,0,0,0|2,0,0]=4 8662 B13R1.466 Cc1ccc(C(C)CON)cc1F Amb33373777 [0,2,0,0,0,0|2,0,0]=4 8663 B13R1.466 Cc1ccc(C(C)CON)cc1O Amb33428585 [0,2,0,0,0,0|2,0,0]=4 8664 B13R1.466 Cc1ccc(C(O)CNN)cc1C Amb18564141 [0,2,0,0,0,0|2,0,0]=4 8665 B13R1.466 Cc1ccc(C(O)CNO)cc1C Amb17335489 [0,2,0,0,0,0|2,0,0]=4 8666 B13R1.466 NNCC(O)c1ccc(Cl)c(Cl)c1 Amb32415952 [0,2,0,0,0,0|2,0,0]=4 8667 B13R1.466 NNCC(O)c1ccc(F)c(Cl)c1 Amb25079102 [0,2,0,0,0,0|2,0,0]=4 8668 B13R1.466 NNCC(O)c1ccc(F)c(F)c1 Amb18564463 [0,2,0,0,0,0|2,0,0]=4 8669 B13R1.466 ONCC(O)c1ccc(F)c(F)c1 Amb17336065 [0,2,0,0,0,0|2,0,0]=4 8670 B13R1.1511 C=CC[C@H](C)c1ccc(C)cc1O Amb27599440 [0,2,0,0,0,0|1,0,1]=4 8671 B13R1.1511 CC(CC#N)c1ccc(Cl)cc1Cl Amb25802788 [0,2,0,0,0,0|2,0,0]=4 8672 B13R1.1511 CC(CC#N)c1ccc(F)cc1F Amb26877552 [0,2,0,0,0,0|2,0,0]=4 8673 B13R1.1511 CC(CC=O)c1ccc(F)cc1F Amb27240062 [0,2,0,0,0,0|2,0,0]=4 8674 B13R1.1511 CC(CCN)c1ccc(Br)cc1Cl Amb33334303 [0,2,0,0,0,0|2,0,0]=4 8675 B13R1.1511 CC(CCN)c1ccc(Br)cc1F Amb33450265 [0,2,0,0,0,0|2,0,0]=4 8676 B13R1.1511 CC(CCN)c1ccc(Br)cc1O Amb33389498 [0,2,0,0,0,0|2,0,0]=4 8677 B13R1.1511 CC(CCN)c1ccc(Cl)cc1Br Amb33450944 [0,2,0,0,0,0|2,0,0]=4 8678 B13R1.1511 CC(CCN)c1ccc(Cl)cc1Cl Amb22036519 [0,2,0,0,0,0|2,0,0]=4 8679 B13R1.1511 CC(CCN)c1ccc(Cl)cc1F Amb26019289 [0,2,0,0,0,0|2,0,0]=4 8680 B13R1.1511 CC(CCN)c1ccc(Cl)cc1O Amb33259799 [0,2,0,0,0,0|2,0,0]=4 8681 B13R1.1511 CC(CCN)c1ccc(F)cc1Br Amb33336202 [0,2,0,0,0,0|2,0,0]=4 8682 B13R1.1511 CC(CCN)c1ccc(F)cc1Cl Amb33258066 [0,2,0,0,0,0|2,0,0]=4 8683 B13R1.1511 CC(CCN)c1ccc(F)cc1F Amb18293551 [0,2,0,0,0,0|2,0,0]=4 8684 B13R1.1511 CC(CCN)c1ccc(O)cc1Cl Amb33057334 [0,2,0,0,0,0|2,0,0]=4 8685 B13R1.1511 CC(CCN)c1ccc(O)cc1F Amb33377703 [0,2,0,0,0,0|2,0,0]=4 8686 B13R1.1511 CC(CCN)c1ccc(O)cc1O Amb33340451 [0,2,0,0,0,0|2,0,0]=4 8687 B13R1.1511 CC(CON)c1ccc(Br)cc1Cl Amb33334596 [0,2,0,0,0,0|2,0,0]=4 8688 B13R1.1511 CC(CON)c1ccc(Br)cc1F Amb33450291 [0,2,0,0,0,0|2,0,0]=4 8689 B13R1.1511 CC(CON)c1ccc(Br)cc1O Amb33389166 [0,2,0,0,0,0|2,0,0]=4 8690 B13R1.1511 CC(CON)c1ccc(Cl)cc1Br Amb33478353 [0,2,0,0,0,0|2,0,0]=4 8691 B13R1.1511 CC(CON)c1ccc(Cl)cc1Cl Amb33220511 [0,2,0,0,0,0|2,0,0]=4 8692 B13R1.1511 CC(CON)c1ccc(Cl)cc1F Amb33052661 [0,2,0,0,0,0|2,0,0]=4 8693 B13R1.1511 CC(CON)c1ccc(Cl)cc1O Amb33260133 [0,2,0,0,0,0|2,0,0]=4 8694 B13R1.1511 CC(CON)c1ccc(F)cc1Br Amb33336577 [0,2,0,0,0,0|2,0,0]=4 8695 B13R1.1511 CC(CON)c1ccc(F)cc1Cl Amb33258384 [0,2,0,0,0,0|2,0,0]=4 8696 B13R1.1511 CC(CON)c1ccc(F)cc1F Amb33196330 [0,2,0,0,0,0|2,0,0]=4 8697 B13R1.1511 CC(CON)c1ccc(O)cc1Cl Amb33056585 [0,2,0,0,0,0|2,0,0]=4 8698 B13R1.1511 CC(CON)c1ccc(O)cc1F Amb33377243 [0,2,0,0,0,0|2,0,0]=4 8699 B13R1.1511 CC(CON)c1ccc(O)cc1O Amb33270122 [0,2,0,0,0,0|2,0,0]=4 8700 B13R1.1511 CCCC(C)c1ccc(F)cc1O Amb28199960 [0,2,0,0,0,0|1,0,0]=3 8701 B13R1.1511 CCCC(C)c1ccc(O)cc1F Amb27948645 [0,2,0,0,0,0|1,0,0]=3 8702 B13R1.1511 CCCC(Cl)c1ccc(Cl)cc1Cl Amb27833791 [0,2,0,0,0,0|2,0,0]=4 8703 B13R1.1511 CCCC(Cl)c1ccc(Cl)cc1F Amb27589200 [0,2,0,0,0,0|2,0,0]=4 8704 B13R1.1511 CCCC(Cl)c1ccc(F)cc1C Amb27167966 [0,2,0,0,0,0|2,0,0]=4 8705 B13R1.1511 CCCC(N)c1ccc(Br)cc1Cl Amb27813324 [0,2,0,0,0,0|2,0,0]=4 8706 B13R1.1511 CCCC(N)c1ccc(C)cc1C Amb6705028 [0,2,0,0,0,0|2,0,0]=4 8707 B13R1.1511 CCCC(N)c1ccc(C)cc1Cl Amb22642872 [0,2,0,0,0,0|2,0,0]=4 8708 B13R1.1511 CCCC(N)c1ccc(Cl)cc1Br Amb28241046 [0,2,0,0,0,0|2,0,0]=4 8709 B13R1.1511 CCCC(N)c1ccc(Cl)cc1I Amb27958500 [0,2,0,0,0,0|2,0,0]=4 8710 B13R1.1511 CCCC(N)c1ccc(F)cc1Br Amb27654089 [0,2,0,0,0,0|2,0,0]=4 8711 B13R1.1511 CCCC(N)c1ccc(F)cc1C Amb18796470 [0,2,0,0,0,0|2,0,0]=4 8712 B13R1.1511 CCCC(N)c1ccc(F)cc1F Amb9746075 [0,2,0,0,0,0|2,0,0]=4 8713 B13R1.1511 CCCC(N)c1ccc(N)cc1Br Amb27207157 [0,2,0,0,0,0|2,0,0]=4 8714 B13R1.1511 CCCC(N)c1ccc(N)cc1O Amb27967231 [0,2,0,0,0,0|2,0,0]=4 8715 B13R1.1511 CCCC(N)c1ccc(O)cc1Br Amb27410661 [0,2,0,0,0,0|2,0,0]=4 8716 B13R1.1511 CCCC(N)c1ccc(O)cc1C Amb26440133 [0,2,0,0,0,0|2,0,0]=4 8717 B13R1.1511 CCCC(N)c1ccc(O)cc1F Amb28317758 [0,2,0,0,0,0|2,0,0]=4 8718 B13R1.1511 CCCC(N)c1ccc(O)cc1I Amb28323160 [0,2,0,0,0,0|2,0,0]=4 8719 B13R1.1511 CCCC(N)c1ccc(O)cc1O Amb18275065 [0,2,0,0,0,0|2,0,0]=4 8720 B13R1.1511 CCCC(O)c1ccc(Br)cc1Cl Amb27847408 [0,2,0,0,0,0|2,0,0]=4 8721 B13R1.1511 CCCC(O)c1ccc(Br)cc1F Amb28293301 [0,2,0,0,0,0|2,0,0]=4 8722 B13R1.1511 CCCC(O)c1ccc(Br)cc1N Amb35621633 [0,2,0,0,0,0|2,0,0]=4 8723 B13R1.1511 CCCC(O)c1ccc(C)cc1C Amb17194529 [0,2,0,0,0,0|2,0,0]=4 8724 B13R1.1511 CCCC(O)c1ccc(C)cc1Cl Amb28045156 [0,2,0,0,0,0|2,0,0]=4 8725 B13R1.1511 CCCC(O)c1ccc(C)cc1F Amb28421707 [0,2,0,0,0,0|2,0,0]=4 8726 B13R1.1511 CCCC(O)c1ccc(Cl)cc1C Amb27620341 [0,2,0,0,0,0|2,0,0]=4 8727 B13R1.1511 CCCC(O)c1ccc(F)cc1C Amb18805551 [0,2,0,0,0,0|2,0,0]=4 8728 B13R1.1511 CCCC(O)c1ccc(F)cc1I Amb27594911 [0,2,0,0,0,0|2,0,0]=4 8729 B13R1.1511 CCCC(O)c1ccc(N)cc1Br Amb27792523 [0,2,0,0,0,0|2,0,0]=4 8730 B13R1.1511 CCCC(O)c1ccc(N)cc1Cl Amb27646103 [0,2,0,0,0,0|2,0,0]=4 8731 B13R1.1511 CCCN(C)c1ccc(Br)cc1C Amb28206885 [0,2,0,0,0,0|2,0,0]=4 8732 B13R1.1511 CCCN(C)c1ccc(I)cc1N Amb27202581 [0,2,0,0,0,0|2,0,0]=4 8733 B13R1.1511 CCC[C@@H](N)c1ccc(Br)cc1Br Amb27250796 [0,2,0,0,0,0|2,0,0]=4 8734 B13R1.1511 CCC[C@@H](N)c1ccc(Br)cc1F Amb28077088 [0,2,0,0,0,0|2,0,0]=4 8735 B13R1.1511 CCC[C@@H](N)c1ccc(C)cc1C Amb27259077 [0,2,0,0,0,0|2,0,0]=4 8736 B13R1.1511 CCC[C@@H](N)c1ccc(Cl)cc1F Amb27972111 [0,2,0,0,0,0|2,0,0]=4 8737 B13R1.1511 CCC[C@@H](N)c1ccc(Cl)cc1I Amb27180857 [0,2,0,0,0,0|2,0,0]=4 8738 B13R1.1511 CCC[C@@H](N)c1ccc(Cl)cc1O Amb28291514 [0,2,0,0,0,0|2,0,0]=4 8739 B13R1.1511 CCC[C@@H](N)c1ccc(F)cc1Cl Amb27177108 [0,2,0,0,0,0|2,0,0]=4 8740 B13R1.1511 CCC[C@@H](N)c1ccc(F)cc1I Amb27800008 [0,2,0,0,0,0|2,0,0]=4 8741 B13R1.1511 CCC[C@@H](N)c1ccc(N)cc1C Amb27803017 [0,2,0,0,0,0|2,0,0]=4 8742 B13R1.1511 CCC[C@@H](N)c1ccc(N)cc1F Amb28316497 [0,2,0,0,0,0|2,0,0]=4 8743 B13R1.1511 CCC[C@@H](N)c1ccc(O)cc1C Amb27975728 [0,2,0,0,0,0|2,0,0]=4 8744 B13R1.1511 CCC[C@@H](N)c1ccc(O)cc1F Amb27190834 [0,2,0,0,0,0|2,0,0]=4 8745 B13R1.1511 CCC[C@@H](N)c1ccc(O)cc1I Amb27608345 [0,2,0,0,0,0|2,0,0]=4 8746 B13R1.1511 CCC[C@@H](N)c1ccc(S)cc1O Amb28457254 [0,2,0,0,0,0|2,0,0]=4 8747 B13R1.1511 CCC[C@@H](O)c1ccc(Br)cc1C Amb28252319 [0,2,0,0,0,0|2,0,0]=4 8748 B13R1.1511 CCC[C@@H](O)c1ccc(Br)cc1F Amb27472966 [0,2,0,0,0,0|2,0,0]=4 8749 B13R1.1511 CCC[C@H](N)c1ccc(Br)cc1Cl Amb28048837 [0,2,0,0,0,0|2,0,0]=4 8750 B13R1.1511 CCC[C@H](N)c1ccc(C)cc1C Amb27830657 [0,2,0,0,0,0|2,0,0]=4 8751 B13R1.1511 CCC[C@H](N)c1ccc(C)cc1Cl Amb28254806 [0,2,0,0,0,0|2,0,0]=4 8752 B13R1.1511 CCC[C@H](N)c1ccc(C)cc1N Amb28243358 [0,2,0,0,0,0|2,0,0]=4 8753 B13R1.1511 CCC[C@H](N)c1ccc(F)cc1Br Amb28135400 [0,2,0,0,0,0|2,0,0]=4 8754 B13R1.1511 CCC[C@H](N)c1ccc(F)cc1F Amb27800562 [0,2,0,0,0,0|2,0,0]=4 8755 B13R1.1511 CCC[C@H](N)c1ccc(F)cc1I Amb27392627 [0,2,0,0,0,0|2,0,0]=4 8756 B13R1.1511 CCC[C@H](N)c1ccc(F)cc1O Amb28365970 [0,2,0,0,0,0|2,0,0]=4 8757 B13R1.1511 CCC[C@H](N)c1ccc(I)cc1Cl Amb27809005 [0,2,0,0,0,0|2,0,0]=4 8758 B13R1.1511 CCC[C@H](N)c1ccc(N)cc1O Amb28322850 [0,2,0,0,0,0|2,0,0]=4 8759 B13R1.1511 CCC[C@H](N)c1ccc(O)cc1C Amb28282686 [0,2,0,0,0,0|2,0,0]=4 8760 B13R1.1511 CCC[C@H](N)c1ccc(O)cc1Cl Amb27231679 [0,2,0,0,0,0|2,0,0]=4 8761 B13R1.1511 CCC[C@H](N)c1ccc(O)cc1F Amb27228145 [0,2,0,0,0,0|2,0,0]=4 8762 B13R1.1511 CCC[C@H](O)c1ccc(C)cc1C Amb28243316 [0,2,0,0,0,0|2,0,0]=4 8763 B13R1.1511 CCC[C@H](O)c1ccc(C)cc1F Amb27394324 [0,2,0,0,0,0|2,0,0]=4 8764 B13R1.1511 CCC[C@H](O)c1ccc(F)cc1Cl Amb27493934 [0,2,0,0,0,0|2,0,0]=4 8765 B13R1.1511 CCC[C@H](O)c1ccc(F)cc1F Amb28060049 [0,2,0,0,0,0|2,0,0]=4 8766 B13R1.1511 CCNC(C)c1ccc(Br)cc1Cl Amb27481166 [0,2,0,0,0,0|2,0,0]=4 8767 B13R1.1511 CCNC(C)c1ccc(Br)cc1F Amb27776435 [0,2,0,0,0,0|2,0,0]=4 8768 B13R1.1511 CCNC(C)c1ccc(C)cc1C Amb6263642 [0,2,0,0,0,0|2,0,0]=4 8769 B13R1.1511 CCNC(C)c1ccc(C)cc1Cl Amb27603529 [0,2,0,0,0,0|2,0,0]=4 8770 B13R1.1511 CCNC(C)c1ccc(Cl)cc1Br Amb27426550 [0,2,0,0,0,0|2,0,0]=4 8771 B13R1.1511 CCNC(C)c1ccc(Cl)cc1Cl Amb6666167 [0,2,0,0,0,0|2,0,0]=4 8772 B13R1.1511 CCNC(C)c1ccc(Cl)cc1F Amb28366396 [0,2,0,0,0,0|2,0,0]=4 8773 B13R1.1511 CCNC(C)c1ccc(F)cc1Br Amb27861887 [0,2,0,0,0,0|2,0,0]=4 8774 B13R1.1511 CCNC(C)c1ccc(F)cc1F Amb6276267 [0,2,0,0,0,0|2,0,0]=4 8775 B13R1.1511 CCNC(C)c1ccc(O)cc1Br Amb27428517 [0,2,0,0,0,0|2,0,0]=4 8776 B13R1.1511 CCN[C@@H](C)c1ccc(Cl)cc1Cl Amb27604983 [0,2,0,0,0,0|2,0,0]=4 8777 B13R1.1511 CCN[C@H](C)c1ccc(Br)cc1F Amb28051294 [0,2,0,0,0,0|2,0,0]=4 8778 B13R1.1511 CCOC(C)c1ccc(C)cc1C Amb27211082 [0,2,0,0,0,0|2,0,0]=4 8779 B13R1.1511 CNCC(=O)c1ccc(Br)cc1C Amb18227884 [0,2,0,0,0,0|1,0,1]=4 8780 B13R1.1511 CNCC(=O)c1ccc(Br)cc1Cl Amb25066509 [0,2,0,0,0,0|1,0,1]=4 8781 B13R1.1511 CNCC(=O)c1ccc(Br)cc1F Amb27495667 [0,2,0,0,0,0|1,0,1]=4 8782 B13R1.1511 CNCC(=O)c1ccc(Br)cc1O Amb33388517 [0,2,0,0,0,0|1,0,1]=4 8783 B13R1.1511 CNCC(=O)c1ccc(C)cc1Br Amb24533505 [0,2,0,0,0,0|1,0,1]=4 8784 B13R1.1511 CNCC(=O)c1ccc(C)cc1C Amb17233281 [0,2,0,0,0,0|1,0,1]=4 8785 B13R1.1511 CNCC(=O)c1ccc(C)cc1Cl Amb27478735 [0,2,0,0,0,0|1,0,1]=4 8786 B13R1.1511 CNCC(=O)c1ccc(C)cc1F Amb25157233 [0,2,0,0,0,0|1,0,1]=4 8787 B13R1.1511 CNCC(=O)c1ccc(C)cc1O Amb25723071 [0,2,0,0,0,0|1,0,1]=4 8788 B13R1.1511 CNCC(=O)c1ccc(Cl)cc1Br Amb27466526 [0,2,0,0,0,0|1,0,1]=4 8789 B13R1.1511 CNCC(=O)c1ccc(Cl)cc1C Amb18224988 [0,2,0,0,0,0|1,0,1]=4 8790 B13R1.1511 CNCC(=O)c1ccc(Cl)cc1Cl Amb17314180 [0,2,0,0,0,0|1,0,1]=4 8791 B13R1.1511 CNCC(=O)c1ccc(Cl)cc1F Amb25327295 [0,2,0,0,0,0|1,0,1]=4 8792 B13R1.1511 CNCC(=O)c1ccc(Cl)cc1O Amb33260069 [0,2,0,0,0,0|1,0,1]=4 8793 B13R1.1511 CNCC(=O)c1ccc(F)cc1Br Amb27953197 [0,2,0,0,0,0|1,0,1]=4 8794 B13R1.1511 CNCC(=O)c1ccc(F)cc1C Amb26968105 [0,2,0,0,0,0|1,0,1]=4 8795 B13R1.1511 CNCC(=O)c1ccc(F)cc1Cl Amb27840969 [0,2,0,0,0,0|1,0,1]=4 8796 B13R1.1511 CNCC(=O)c1ccc(F)cc1F Amb18564319 [0,2,0,0,0,0|1,0,1]=4 8797 B13R1.1511 CNCC(=O)c1ccc(F)cc1O Amb27831581 [0,2,0,0,0,0|1,0,1]=4 8798 B13R1.1511 CNCC(=O)c1ccc(O)cc1C Amb27466310 [0,2,0,0,0,0|1,0,1]=4 8799 B13R1.1511 CNCC(=O)c1ccc(O)cc1Cl Amb28188889 [0,2,0,0,0,0|1,0,1]=4 8800 B13R1.1511 CNCC(=O)c1ccc(O)cc1F Amb27173019 [0,2,0,0,0,0|1,0,1]=4 8801 B13R1.1511 CNCC(=O)c1ccc(O)cc1O Amb25180646 [0,2,0,0,0,0|1,0,1]=4 8802 B13R1.1511 CNCC(C)c1ccc(Br)cc1C Amb27158010 [0,2,0,0,0,0|0,0,0]=2 8803 B13R1.1511 CNCC(C)c1ccc(Br)cc1Cl Amb26647363 [0,2,0,0,0,0|0,0,0]=2 8804 B13R1.1511 CNCC(C)c1ccc(Br)cc1F Amb25192550 [0,2,0,0,0,0|0,0,0]=2 8805 B13R1.1511 CNCC(C)c1ccc(Br)cc1O Amb27756302 [0,2,0,0,0,0|0,0,0]=2 8806 B13R1.1511 CNCC(C)c1ccc(C)cc1Br Amb24379660 [0,2,0,0,0,0|0,0,0]=2 8807 B13R1.1511 CNCC(C)c1ccc(C)cc1C Amb17233345 [0,2,0,0,0,0|0,0,0]=2 8808 B13R1.1511 CNCC(C)c1ccc(C)cc1Cl Amb28077835 [0,2,0,0,0,0|0,0,0]=2 8809 B13R1.1511 CNCC(C)c1ccc(C)cc1F Amb27449852 [0,2,0,0,0,0|0,0,0]=2 8810 B13R1.1511 CNCC(C)c1ccc(C)cc1O Amb24473330 [0,2,0,0,0,0|0,0,0]=2 8811 B13R1.1511 CNCC(C)c1ccc(Cl)cc1Br Amb25066510 [0,2,0,0,0,0|0,0,0]=2 8812 B13R1.1511 CNCC(C)c1ccc(Cl)cc1C Amb26976228 [0,2,0,0,0,0|0,0,0]=2 8813 B13R1.1511 CNCC(C)c1ccc(Cl)cc1Cl Amb26436814 [0,2,0,0,0,0|0,0,0]=2 8814 B13R1.1511 CNCC(C)c1ccc(Cl)cc1F Amb26493981 [0,2,0,0,0,0|0,0,0]=2 8815 B13R1.1511 CNCC(C)c1ccc(Cl)cc1O Amb27968772 [0,2,0,0,0,0|0,0,0]=2 8816 B13R1.1511 CNCC(C)c1ccc(F)cc1Br Amb24421752 [0,2,0,0,0,0|0,0,0]=2 8817 B13R1.1511 CNCC(C)c1ccc(F)cc1C Amb26605721 [0,2,0,0,0,0|0,0,0]=2 8818 B13R1.1511 CNCC(C)c1ccc(F)cc1Cl Amb24420935 [0,2,0,0,0,0|0,0,0]=2 8819 B13R1.1511 CNCC(C)c1ccc(F)cc1F Amb18243851 [0,2,0,0,0,0|0,0,0]=2 8820 B13R1.1511 CNCC(C)c1ccc(F)cc1O Amb27250732 [0,2,0,0,0,0|0,0,0]=2 8821 B13R1.1511 CNCC(C)c1ccc(O)cc1Br Amb28280905 [0,2,0,0,0,0|0,0,0]=2 8822 B13R1.1511 CNCC(C)c1ccc(O)cc1C Amb25769248 [0,2,0,0,0,0|0,0,0]=2 8823 B13R1.1511 CNCC(C)c1ccc(O)cc1Cl Amb24718302 [0,2,0,0,0,0|0,0,0]=2 8824 B13R1.1511 CNCC(C)c1ccc(O)cc1F Amb25923838 [0,2,0,0,0,0|0,0,0]=2 8825 B13R1.1511 CNCC(O)c1ccc(Br)cc1C Amb26050136 [0,2,0,0,0,0|1,0,0]=3 8826 B13R1.1511 CNCC(O)c1ccc(Br)cc1Cl Amb25741122 [0,2,0,0,0,0|1,0,0]=3 8827 B13R1.1511 CNCC(O)c1ccc(Br)cc1F Amb18997472 [0,2,0,0,0,0|1,0,0]=3 8828 B13R1.1511 CNCC(O)c1ccc(Br)cc1O Amb33388515 [0,2,0,0,0,0|1,0,0]=3 8829 B13R1.1511 CNCC(O)c1ccc(C)cc1Br Amb25695051 [0,2,0,0,0,0|1,0,0]=3 8830 B13R1.1511 CNCC(O)c1ccc(C)cc1C Amb17233596 [0,2,0,0,0,0|1,0,0]=3 8831 B13R1.1511 CNCC(O)c1ccc(C)cc1Cl Amb27642121 [0,2,0,0,0,0|1,0,0]=3 8832 B13R1.1511 CNCC(O)c1ccc(C)cc1F Amb27610239 [0,2,0,0,0,0|1,0,0]=3 8833 B13R1.1511 CNCC(O)c1ccc(C)cc1O Amb33426661 [0,2,0,0,0,0|1,0,0]=3 8834 B13R1.1511 CNCC(O)c1ccc(C)nc1Cl Amb33260141 [0,2,0,0,0,0|2,0,0]=4 8835 B13R1.1511 CNCC(O)c1ccc(Cl)cc1Br Amb25828813 [0,2,0,0,0,0|1,0,0]=3 8836 B13R1.1511 CNCC(O)c1ccc(Cl)cc1C Amb27968617 [0,2,0,0,0,0|1,0,0]=3 8837 B13R1.1511 CNCC(O)c1ccc(Cl)cc1Cl Amb18301235 [0,2,0,0,0,0|1,0,0]=3 8838 B13R1.1511 CNCC(O)c1ccc(Cl)cc1F Amb24388791 [0,2,0,0,0,0|1,0,0]=3 8839 B13R1.1511 CNCC(O)c1ccc(Cl)cc1O Amb33260065 [0,2,0,0,0,0|1,0,0]=3 8840 B13R1.1511 CNCC(O)c1ccc(F)cc1Br Amb27950414 [0,2,0,0,0,0|1,0,0]=3 8841 B13R1.1511 CNCC(O)c1ccc(F)cc1C Amb18997476 [0,2,0,0,0,0|1,0,0]=3 8842 B13R1.1511 CNCC(O)c1ccc(F)cc1Cl Amb25870535 [0,2,0,0,0,0|1,0,0]=3 8843 B13R1.1511 CNCC(O)c1ccc(F)cc1F Amb18289717 [0,2,0,0,0,0|1,0,0]=3 8844 B13R1.1511 CNCC(O)c1ccc(O)cc1Cl Amb25095789 [0,2,0,0,0,0|1,0,0]=3 8845 B13R1.1511 CNCC(O)c1ccc(O)cc1F Amb33377701 [0,2,0,0,0,0|1,0,0]=3 8846 B13R1.1511 CNCC(O)c1ccc(O)cc1O Amb33340448 [0,2,0,0,0,0|1,0,0]=3 8847 B13R1.1511 CNCC(O)c1cnc(Cl)cc1Cl Amb33256865 [0,2,0,0,0,0|2,0,0]=4 8848 B13R1.1511 CN\N=C(\C)c1ccc(C)cc1C Amb27982846 [0,2,0,0,0,0|1,0,1]=4 8849 B13R1.1511 COCC(C)c1ccc(N)cc1C Amb27462107 [0,2,0,0,0,0|1,0,0]=3 8850 B13R1.1511 COCC(N)c1ccc(Br)cc1F Amb27866449 [0,2,0,0,0,0|2,0,0]=4 8851 B13R1.1511 COCC(N)c1ccc(C)cc1N Amb27815052 [0,2,0,0,0,0|2,0,0]=4 8852 B13R1.1511 COCC(N)c1ccc(Cl)cc1Cl Amb27177154 [0,2,0,0,0,0|2,0,0]=4 8853 B13R1.1511 COCC(N)c1ccc(Cl)cc1F Amb28123223 [0,2,0,0,0,0|2,0,0]=4 8854 B13R1.1511 COCC(N)c1ccc(F)cc1I Amb27273072 [0,2,0,0,0,0|2,0,0]=4 8855 B13R1.1511 COCC(N)c1ccc(F)cc1N Amb27494055 [0,2,0,0,0,0|2,0,0]=4 8856 B13R1.1511 COCC(N)c1ccc(I)cc1Cl Amb27951704 [0,2,0,0,0,0|2,0,0]=4 8857 B13R1.1511 COCC(N)c1ccc(I)cc1F Amb27650839 [0,2,0,0,0,0|2,0,0]=4 8858 B13R1.1511 COCC(N)c1ccc(O)cc1Br Amb27952891 [0,2,0,0,0,0|2,0,0]=4 8859 B13R1.1511 COCC(N)c1ccc(O)cc1N Amb28124691 [0,2,0,0,0,0|2,0,0]=4 8860 B13R1.1511 COCC(N)c1ccc(O)cc1O Amb28203801 [0,2,0,0,0,0|2,0,0]=4 8861 B13R1.1511 COCC(O)c1ccc(Br)cc1Cl Amb27651549 [0,2,0,0,0,0|2,0,0]=4 8862 B13R1.1511 COCC(O)c1ccc(Br)cc1N Amb35621244 [0,2,0,0,0,0|2,0,0]=4 8863 B13R1.1511 COCC(O)c1ccc(C)cc1Br Amb27758516 [0,2,0,0,0,0|2,0,0]=4 8864 B13R1.1511 COCC(O)c1ccc(C)cc1C Amb18809341 [0,2,0,0,0,0|2,0,0]=4 8865 B13R1.1511 COCC(O)c1ccc(Cl)cc1Cl Amb27977120 [0,2,0,0,0,0|2,0,0]=4 8866 B13R1.1511 COCC(O)c1ccc(N)cc1Br Amb27635177 [0,2,0,0,0,0|2,0,0]=4 8867 B13R1.1511 COCC(O)c1ccc(N)cc1Cl Amb27769058 [0,2,0,0,0,0|2,0,0]=4 8868 B13R1.1511 COC[C@@H](N)c1ccc(Br)cc1Br Amb27410678 [0,2,0,0,0,0|2,0,0]=4 8869 B13R1.1511 COC[C@@H](N)c1ccc(Br)cc1C Amb28429207 [0,2,0,0,0,0|2,0,0]=4 8870 B13R1.1511 COC[C@@H](N)c1ccc(Br)cc1N Amb27802710 [0,2,0,0,0,0|2,0,0]=4 8871 B13R1.1511 COC[C@@H](N)c1ccc(C)cc1Cl Amb28437298 [0,2,0,0,0,0|2,0,0]=4 8872 B13R1.1511 COC[C@@H](N)c1ccc(C)cc1N Amb27609582 [0,2,0,0,0,0|2,0,0]=4 8873 B13R1.1511 COC[C@@H](N)c1ccc(Cl)cc1C Amb28397916 [0,2,0,0,0,0|2,0,0]=4 8874 B13R1.1511 COC[C@@H](N)c1ccc(Cl)cc1Cl Amb27848185 [0,2,0,0,0,0|2,0,0]=4 8875 B13R1.1511 COC[C@@H](N)c1ccc(Cl)cc1F Amb27813319 [0,2,0,0,0,0|2,0,0]=4 8876 B13R1.1511 COC[C@@H](N)c1ccc(Cl)cc1N Amb27643442 [0,2,0,0,0,0|2,0,0]=4 8877 B13R1.1511 COC[C@@H](N)c1ccc(F)cc1N Amb27175374 [0,2,0,0,0,0|2,0,0]=4 8878 B13R1.1511 COC[C@@H](N)c1ccc(N)cc1F Amb28203753 [0,2,0,0,0,0|2,0,0]=4 8879 B13R1.1511 COC[C@@H](N)c1ccc(N)cc1O Amb27494787 [0,2,0,0,0,0|2,0,0]=4 8880 B13R1.1511 COC[C@H](N)c1ccc(Br)cc1F Amb27800009 [0,2,0,0,0,0|2,0,0]=4 8881 B13R1.1511 COC[C@H](N)c1ccc(Br)cc1N Amb28293084 [0,2,0,0,0,0|2,0,0]=4 8882 B13R1.1511 COC[C@H](N)c1ccc(C)cc1N Amb27173669 [0,2,0,0,0,0|2,0,0]=4 8883 B13R1.1511 COC[C@H](N)c1ccc(F)cc1O Amb26603712 [0,2,0,0,0,0|2,0,0]=4 8884 B13R1.1511 COC[C@H](N)c1ccc(N)cc1Br Amb28203781 [0,2,0,0,0,0|2,0,0]=4 8885 B13R1.1511 COC[C@H](N)c1ccc(N)cc1Cl Amb28340832 [0,2,0,0,0,0|2,0,0]=4 8886 B13R1.1511 COC[C@H](N)c1ccc(O)cc1C Amb28119998 [0,2,0,0,0,0|2,0,0]=4 8887 B13R1.1511 COC[C@H](N)c1ccc(O)cc1F Amb27413086 [0,2,0,0,0,0|2,0,0]=4 8888 B13R1.1511 CONC(C)c1ccc(C)cc1O Amb27834026 [0,2,0,0,0,0|2,0,0]=4 8889 B13R1.1511 CONC(C)c1ccc(O)cc1F Amb27765189 [0,2,0,0,0,0|2,0,0]=4 8890 B13R1.1511 CSCC(O)c1ccc(F)cc1C Amb19086356 [0,2,0,0,0,0|2,0,0]=4 8891 B13R1.1511 CSCC(O)c1ccc(F)cc1F Amb28240854 [0,2,0,0,0,0|2,0,0]=4 8892 B13R1.1511 C\C=C\C(C)c1ccc(Cl)cc1O Amb25821414 [0,2,0,0,0,0|1,0,1]=4 8893 B13R1.1511 C\C=C\C(C)c1ccc(F)cc1N Amb26006817 [0,2,0,0,0,0|1,0,1]=4 8894 B13R1.1511 C\C=C\C(C)c1ccc(N)cc1C Amb18647924 [0,2,0,0,0,0|1,0,1]=4 8895 B13R1.1511 Cc1cc(Br)ccc1C(C)CC#N Amb27476384 [0,2,0,0,0,0|2,0,0]=4 8896 B13R1.1511 Cc1cc(Br)ccc1C(C)CCN Amb24732119 [0,2,0,0,0,0|2,0,0]=4 8897 B13R1.1511 Cc1cc(Br)ccc1C(C)CON Amb33435013 [0,2,0,0,0,0|2,0,0]=4 8898 B13R1.1511 Cc1cc(Cl)ccc1C(C)CC#N Amb25871586 [0,2,0,0,0,0|2,0,0]=4 8899 B13R1.1511 Cc1cc(Cl)ccc1C(C)CCN Amb27751787 [0,2,0,0,0,0|2,0,0]=4 8900 B13R1.1511 Cc1cc(Cl)ccc1C(C)CON Amb33260998 [0,2,0,0,0,0|2,0,0]=4 8901 B13R1.1511 Cc1cc(F)ccc1C(C)CCN Amb25062309 [0,2,0,0,0,0|2,0,0]=4 8902 B13R1.1511 Cc1cc(F)ccc1C(C)CON Amb33374754 [0,2,0,0,0,0|2,0,0]=4 8903 B13R1.1511 Cc1ccc(C(C)CC#N)c(C)c1 Amb24464698 [0,2,0,0,0,0|2,0,0]=4 8904 B13R1.1511 Cc1ccc(C(C)CCBr)c(C)c1 Amb857805 [0,2,0,0,0,0|2,0,0]=4 8905 B13R1.1511 Cc1ccc(C(C)CCCl)c(C)c1 Amb17236533 [0,2,0,0,0,0|2,0,0]=4 8906 B13R1.1511 Cc1ccc(C(C)CCN)c(Br)c1 Amb33450424 [0,2,0,0,0,0|2,0,0]=4 8907 B13R1.1511 Cc1ccc(C(C)CCN)c(C)c1 Amb17233348 [0,2,0,0,0,0|2,0,0]=4 8908 B13R1.1511 Cc1ccc(C(C)CCN)c(Cl)c1 Amb33407733 [0,2,0,0,0,0|2,0,0]=4 8909 B13R1.1511 Cc1ccc(C(C)CCN)c(F)c1 Amb33324340 [0,2,0,0,0,0|2,0,0]=4 8910 B13R1.1511 Cc1ccc(C(C)CCN)c(O)c1 Amb33426663 [0,2,0,0,0,0|2,0,0]=4 8911 B13R1.1511 Cc1ccc(C(C)CCO)c(C)c1 Amb17233468 [0,2,0,0,0,0|2,0,0]=4 8912 B13R1.1511 Cc1ccc(C(C)CCO)c(N)c1 Amb27831559 [0,2,0,0,0,0|2,0,0]=4 8913 B13R1.1511 Cc1ccc(C(C)CON)c(Br)c1 Amb33386362 [0,2,0,0,0,0|2,0,0]=4 8914 B13R1.1511 Cc1ccc(C(C)CON)c(C)c1 Amb33312642 [0,2,0,0,0,0|2,0,0]=4 8915 B13R1.1511 Cc1ccc(C(C)CON)c(Cl)c1 Amb33058484 [0,2,0,0,0,0|2,0,0]=4 8916 B13R1.1511 Cc1ccc(C(C)CON)c(F)c1 Amb33323347 [0,2,0,0,0,0|2,0,0]=4 8917 B13R1.1511 Cc1ccc(C(C)CON)c(O)c1 Amb33426044 [0,2,0,0,0,0|2,0,0]=4 8918 B13R1.1511 Cc1ccc(C(O)CNN)c(C)c1 Amb18065949 [0,2,0,0,0,0|2,0,0]=4 8919 B13R1.1511 Cc1ccc(C(O)CNO)c(C)c1 Amb17335497 [0,2,0,0,0,0|2,0,0]=4 8920 B13R1.1511 Cc1ccc([C@@H](C)CCO)c(N)c1 Amb28129256 [0,2,0,0,0,0|2,0,0]=4 8921 B13R1.1511 NNCC(O)c1ccc(F)cc1F Amb18066217 [0,2,0,0,0,0|2,0,0]=4 8922 B13R1.12 CC(CC#N)c1cccc(Cl)c1Cl Amb25800991 [0,2,0,0,0,0|2,0,0]=4 8923 B13R1.12 CC(CCN)c1cccc(Br)c1F Amb25870599 [0,2,0,0,0,0|2,0,0]=4 8924 B13R1.12 CC(CCN)c1cccc(Br)c1O Amb33332262 [0,2,0,0,0,0|2,0,0]=4 8925 B13R1.12 CC(CCN)c1cccc(Cl)c1Cl Amb27873682 [0,2,0,0,0,0|2,0,0]=4 8926 B13R1.12 CC(CCN)c1cccc(Cl)c1F Amb33222959 [0,2,0,0,0,0|2,0,0]=4 8927 B13R1.12 CC(CCN)c1cccc(Cl)c1O Amb33056856 [0,2,0,0,0,0|2,0,0]=4 8928 B13R1.12 CC(CCN)c1cccc(F)c1Br Amb33450955 [0,2,0,0,0,0|2,0,0]=4 8929 B13R1.12 CC(CCN)c1cccc(F)c1F Amb27258911 [0,2,0,0,0,0|2,0,0]=4 8930 B13R1.12 CC(CCN)c1cccc(F)c1O Amb33311183 [0,2,0,0,0,0|2,0,0]=4 8931 B13R1.12 CC(CCN)c1cccc(O)c1Br Amb33386526 [0,2,0,0,0,0|2,0,0]=4 8932 B13R1.12 CC(CCN)c1cccc(O)c1O Amb33269530 [0,2,0,0,0,0|2,0,0]=4 8933 B13R1.12 CC(CON)c1cccc(Br)c1F Amb33386608 [0,2,0,0,0,0|2,0,0]=4 8934 B13R1.12 CC(CON)c1cccc(Br)c1O Amb33332301 [0,2,0,0,0,0|2,0,0]=4 8935 B13R1.12 CC(CON)c1cccc(Cl)c1Cl Amb33057746 [0,2,0,0,0,0|2,0,0]=4 8936 B13R1.12 CC(CON)c1cccc(Cl)c1F Amb33222731 [0,2,0,0,0,0|2,0,0]=4 8937 B13R1.12 CC(CON)c1cccc(Cl)c1O Amb33056909 [0,2,0,0,0,0|2,0,0]=4 8938 B13R1.12 CC(CON)c1cccc(F)c1Br Amb33450536 [0,2,0,0,0,0|2,0,0]=4 8939 B13R1.12 CC(CON)c1cccc(F)c1F Amb33425941 [0,2,0,0,0,0|2,0,0]=4 8940 B13R1.12 CC(CON)c1cccc(F)c1O Amb33310936 [0,2,0,0,0,0|2,0,0]=4 8941 B13R1.12 CC(CON)c1cccc(O)c1Br Amb33386805 [0,2,0,0,0,0|2,0,0]=4 8942 B13R1.12 CC(CON)c1cccc(O)c1O Amb33268825 [0,2,0,0,0,0|2,0,0]=4 8943 B13R1.12 CCCC(C)N1C=CC=C(N)C1=O Amb32699279 [0,2,0,0,0,0|2,0,0]=4 8944 B13R1.12 CCCC(C)c1cccc(N)c1O Amb28255544 [0,2,0,0,0,0|1,0,0]=3 8945 B13R1.12 CCCC(Cl)c1cccc(F)c1F Amb27458101 [0,2,0,0,0,0|2,0,0]=4 8946 B13R1.12 CCCC(N)c1cccc(Br)c1C Amb27795679 [0,2,0,0,0,0|2,0,0]=4 8947 B13R1.12 CCCC(N)c1cccc(C)c1Br Amb28388813 [0,2,0,0,0,0|2,0,0]=4 8948 B13R1.12 CCCC(N)c1cccc(C)c1C Amb17233372 [0,2,0,0,0,0|2,0,0]=4 8949 B13R1.12 CCCC(N)c1cccc(C)c1F Amb27873452 [0,2,0,0,0,0|2,0,0]=4 8950 B13R1.12 CCCC(N)c1cccc(C)c1O Amb27445025 [0,2,0,0,0,0|2,0,0]=4 8951 B13R1.12 CCCC(N)c1cccc(Cl)c1N Amb27851086 [0,2,0,0,0,0|2,0,0]=4 8952 B13R1.12 CCCC(N)c1cccc(Cl)c1O Amb28397300 [0,2,0,0,0,0|2,0,0]=4 8953 B13R1.12 CCCC(N)c1cccc(F)c1F Amb25691968 [0,2,0,0,0,0|2,0,0]=4 8954 B13R1.12 CCCC(N)c1cccc(F)c1O Amb27184581 [0,2,0,0,0,0|2,0,0]=4 8955 B13R1.12 CCCC(N)c1cccc(I)c1Br Amb27450458 [0,2,0,0,0,0|2,0,0]=4 8956 B13R1.12 CCCC(N)c1cccc(N)c1C Amb27875880 [0,2,0,0,0,0|2,0,0]=4 8957 B13R1.12 CCCC(N)c1cccc(O)c1Br Amb28430514 [0,2,0,0,0,0|2,0,0]=4 8958 B13R1.12 CCCC(O)c1cccc(C)c1Br Amb27177384 [0,2,0,0,0,0|2,0,0]=4 8959 B13R1.12 CCCC(O)c1cccc(C)c1C Amb17233485 [0,2,0,0,0,0|2,0,0]=4 8960 B13R1.12 CCCC(O)c1cccc(Cl)c1C Amb25694315 [0,2,0,0,0,0|2,0,0]=4 8961 B13R1.12 CCCC(O)c1cccc(Cl)c1F Amb28240674 [0,2,0,0,0,0|2,0,0]=4 8962 B13R1.12 CCCC(O)c1cccc(F)c1Br Amb27985197 [0,2,0,0,0,0|2,0,0]=4 8963 B13R1.12 CCCC(O)c1cccc(F)c1C Amb27609576 [0,2,0,0,0,0|2,0,0]=4 8964 B13R1.12 CCCC(O)c1cccc(F)c1F Amb28241855 [0,2,0,0,0,0|2,0,0]=4 8965 B13R1.12 CCCC(O)c1cccc(F)c1N Amb35582027 [0,2,0,0,0,0|2,0,0]=4 8966 B13R1.12 CCCC(O)c1cccc(N)c1C Amb35622576 [0,2,0,0,0,0|2,0,0]=4 8967 B13R1.12 CCCC(O)c1cccc(N)c1F Amb35741060 [0,2,0,0,0,0|2,0,0]=4 8968 B13R1.12 CCC[C@@H](N)c1cccc(Br)c1F Amb28312900 [0,2,0,0,0,0|2,0,0]=4 8969 B13R1.12 CCC[C@@H](N)c1cccc(Br)c1O Amb27758489 [0,2,0,0,0,0|2,0,0]=4 8970 B13R1.12 CCC[C@@H](N)c1cccc(C)c1F Amb28141974 [0,2,0,0,0,0|2,0,0]=4 8971 B13R1.12 CCC[C@@H](N)c1cccc(C)c1N Amb27754772 [0,2,0,0,0,0|2,0,0]=4 8972 B13R1.12 CCC[C@@H](N)c1cccc(C)c1O Amb28243480 [0,2,0,0,0,0|2,0,0]=4 8973 B13R1.12 CCC[C@@H](N)c1cccc(Cl)c1N Amb27240914 [0,2,0,0,0,0|2,0,0]=4 8974 B13R1.12 CCC[C@@H](N)c1cccc(Cl)c1O Amb27590356 [0,2,0,0,0,0|2,0,0]=4 8975 B13R1.12 CCC[C@@H](N)c1cccc(F)c1C Amb27404120 [0,2,0,0,0,0|2,0,0]=4 8976 B13R1.12 CCC[C@@H](N)c1cccc(F)c1Cl Amb28291157 [0,2,0,0,0,0|2,0,0]=4 8977 B13R1.12 CCC[C@@H](N)c1cccc(F)c1N Amb27598053 [0,2,0,0,0,0|2,0,0]=4 8978 B13R1.12 CCC[C@@H](N)c1cccc(I)c1O Amb27462163 [0,2,0,0,0,0|2,0,0]=4 8979 B13R1.12 CCC[C@@H](N)c1cccc(N)c1F Amb27764131 [0,2,0,0,0,0|2,0,0]=4 8980 B13R1.12 CCC[C@@H](N)c1cccc(O)c1Br Amb28187281 [0,2,0,0,0,0|2,0,0]=4 8981 B13R1.12 CCC[C@@H](N)c1cccc(O)c1C Amb28399367 [0,2,0,0,0,0|2,0,0]=4 8982 B13R1.12 CCC[C@@H](N)c1cccc(O)c1F Amb27641224 [0,2,0,0,0,0|2,0,0]=4 8983 B13R1.12 CCC[C@@H](O)c1cccc(Br)c1C Amb27393638 [0,2,0,0,0,0|2,0,0]=4 8984 B13R1.12 CCC[C@H](N)c1cccc(C)c1Br Amb28133933 [0,2,0,0,0,0|2,0,0]=4 8985 B13R1.12 CCC[C@H](N)c1cccc(C)c1C Amb28251775 [0,2,0,0,0,0|2,0,0]=4 8986 B13R1.12 CCC[C@H](N)c1cccc(C)c1Cl Amb28316496 [0,2,0,0,0,0|2,0,0]=4 8987 B13R1.12 CCC[C@H](N)c1cccc(C)c1I Amb27608266 [0,2,0,0,0,0|2,0,0]=4 8988 B13R1.12 CCC[C@H](N)c1cccc(F)c1Br Amb28240901 [0,2,0,0,0,0|2,0,0]=4 8989 B13R1.12 CCC[C@H](N)c1cccc(F)c1F Amb27961485 [0,2,0,0,0,0|2,0,0]=4 8990 B13R1.12 CCC[C@H](N)c1cccc(F)c1N Amb28291511 [0,2,0,0,0,0|2,0,0]=4 8991 B13R1.12 CCC[C@H](N)c1cccc(I)c1Br Amb27784165 [0,2,0,0,0,0|2,0,0]=4 8992 B13R1.12 CCC[C@H](N)c1cccc(I)c1C Amb27230120 [0,2,0,0,0,0|2,0,0]=4 8993 B13R1.12 CCC[C@H](N)c1cccc(O)c1Cl Amb27868259 [0,2,0,0,0,0|2,0,0]=4 8994 B13R1.12 CCC[C@H](O)c1cccc(C)c1F Amb28341160 [0,2,0,0,0,0|2,0,0]=4 8995 B13R1.12 CCC[C@H](O)c1cccc(Cl)c1F Amb27222985 [0,2,0,0,0,0|2,0,0]=4 8996 B13R1.12 CCC[C@H](O)c1cccc(O)c1O Amb28324318 [0,2,0,0,0,0|2,0,0]=4 8997 B13R1.12 CCNC(C)c1cccc(Br)c1Cl Amb27486946 [0,2,0,0,0,0|2,0,0]=4 8998 B13R1.12 CCNC(C)c1cccc(C)c1Br Amb28317429 [0,2,0,0,0,0|2,0,0]=4 8999 B13R1.12 CCNC(C)c1cccc(Cl)c1F Amb27967731 [0,2,0,0,0,0|2,0,0]=4 9000 B13R1.12 CCNC(C)c1cccc(F)c1Cl Amb27766063 [0,2,0,0,0,0|2,0,0]=4 9001 B13R1.12 CCN[C@H](C)c1cccc(Cl)c1F Amb28051327 [0,2,0,0,0,0|2,0,0]=4 9002 B13R1.12 CCSC(C)c1cccc(C)c1O Amb27212442 [0,2,0,0,0,0|2,0,0]=4 9003 B13R1.12 CNCC(=O)c1cccc(Br)c1C Amb27411578 [0,2,0,0,0,0|1,0,1]=4 9004 B13R1.12 CNCC(=O)c1cccc(Br)c1Cl Amb25038829 [0,2,0,0,0,0|1,0,1]=4 9005 B13R1.12 CNCC(=O)c1cccc(Br)c1F Amb25158632 [0,2,0,0,0,0|1,0,1]=4 9006 B13R1.12 CNCC(=O)c1cccc(Br)c1O Amb33332271 [0,2,0,0,0,0|1,0,1]=4 9007 B13R1.12 CNCC(=O)c1cccc(C)c1Br Amb24463728 [0,2,0,0,0,0|1,0,1]=4 9008 B13R1.12 CNCC(=O)c1cccc(C)c1C Amb18224566 [0,2,0,0,0,0|1,0,1]=4 9009 B13R1.12 CNCC(=O)c1cccc(C)c1Cl Amb27213736 [0,2,0,0,0,0|1,0,1]=4 9010 B13R1.12 CNCC(=O)c1cccc(C)c1F Amb24685079 [0,2,0,0,0,0|1,0,1]=4 9011 B13R1.12 CNCC(=O)c1cccc(C)c1O Amb25048342 [0,2,0,0,0,0|1,0,1]=4 9012 B13R1.12 CNCC(=O)c1cccc(Cl)c1Br Amb26502374 [0,2,0,0,0,0|1,0,1]=4 9013 B13R1.12 CNCC(=O)c1cccc(Cl)c1C Amb18224962 [0,2,0,0,0,0|1,0,1]=4 9014 B13R1.12 CNCC(=O)c1cccc(Cl)c1Cl Amb18866812 [0,2,0,0,0,0|1,0,1]=4 9015 B13R1.12 CNCC(=O)c1cccc(Cl)c1F Amb25997945 [0,2,0,0,0,0|1,0,1]=4 9016 B13R1.12 CNCC(=O)c1cccc(Cl)c1O Amb28410502 [0,2,0,0,0,0|1,0,1]=4 9017 B13R1.12 CNCC(=O)c1cccc(F)c1Br Amb27172367 [0,2,0,0,0,0|1,0,1]=4 9018 B13R1.12 CNCC(=O)c1cccc(F)c1C Amb25158393 [0,2,0,0,0,0|1,0,1]=4 9019 B13R1.12 CNCC(=O)c1cccc(F)c1Cl Amb26942698 [0,2,0,0,0,0|1,0,1]=4 9020 B13R1.12 CNCC(=O)c1cccc(F)c1F Amb25795369 [0,2,0,0,0,0|1,0,1]=4 9021 B13R1.12 CNCC(=O)c1cccc(F)c1O Amb25320557 [0,2,0,0,0,0|1,0,1]=4 9022 B13R1.12 CNCC(=O)c1cccc(O)c1Br Amb27610301 [0,2,0,0,0,0|1,0,1]=4 9023 B13R1.12 CNCC(=O)c1cccc(O)c1C Amb26081142 [0,2,0,0,0,0|1,0,1]=4 9024 B13R1.12 CNCC(=O)c1cccc(O)c1Cl Amb26481823 [0,2,0,0,0,0|1,0,1]=4 9025 B13R1.12 CNCC(=O)c1cccc(O)c1F Amb25755292 [0,2,0,0,0,0|1,0,1]=4 9026 B13R1.12 CNCC(=O)c1cccc(O)c1O Amb33269498 [0,2,0,0,0,0|1,0,1]=4 9027 B13R1.12 CNCC(C)c1cccc(Br)c1C Amb28205395 [0,2,0,0,0,0|0,0,0]=2 9028 B13R1.12 CNCC(C)c1cccc(Br)c1Cl Amb26991641 [0,2,0,0,0,0|0,0,0]=2 9029 B13R1.12 CNCC(C)c1cccc(Br)c1F Amb28316666 [0,2,0,0,0,0|0,0,0]=2 9030 B13R1.12 CNCC(C)c1cccc(Br)c1O Amb25266358 [0,2,0,0,0,0|0,0,0]=2 9031 B13R1.12 CNCC(C)c1cccc(C)c1Br Amb25923696 [0,2,0,0,0,0|0,0,0]=2 9032 B13R1.12 CNCC(C)c1cccc(C)c1C Amb25762222 [0,2,0,0,0,0|0,0,0]=2 9033 B13R1.12 CNCC(C)c1cccc(C)c1Cl Amb26035451 [0,2,0,0,0,0|0,0,0]=2 9034 B13R1.12 CNCC(C)c1cccc(C)c1F Amb27143472 [0,2,0,0,0,0|0,0,0]=2 9035 B13R1.12 CNCC(C)c1cccc(C)c1O Amb26058385 [0,2,0,0,0,0|0,0,0]=2 9036 B13R1.12 CNCC(C)c1cccc(Cl)c1Br Amb24408997 [0,2,0,0,0,0|0,0,0]=2 9037 B13R1.12 CNCC(C)c1cccc(Cl)c1C Amb25280153 [0,2,0,0,0,0|0,0,0]=2 9038 B13R1.12 CNCC(C)c1cccc(Cl)c1Cl Amb25217532 [0,2,0,0,0,0|0,0,0]=2 9039 B13R1.12 CNCC(C)c1cccc(Cl)c1F Amb26407384 [0,2,0,0,0,0|0,0,0]=2 9040 B13R1.12 CNCC(C)c1cccc(Cl)c1O Amb24384475 [0,2,0,0,0,0|0,0,0]=2 9041 B13R1.12 CNCC(C)c1cccc(F)c1Br Amb24535375 [0,2,0,0,0,0|0,0,0]=2 9042 B13R1.12 CNCC(C)c1cccc(F)c1C Amb26631610 [0,2,0,0,0,0|0,0,0]=2 9043 B13R1.12 CNCC(C)c1cccc(F)c1Cl Amb27478686 [0,2,0,0,0,0|0,0,0]=2 9044 B13R1.12 CNCC(C)c1cccc(F)c1F Amb25823421 [0,2,0,0,0,0|0,0,0]=2 9045 B13R1.12 CNCC(C)c1cccc(F)c1O Amb25878777 [0,2,0,0,0,0|0,0,0]=2 9046 B13R1.12 CNCC(C)c1cccc(O)c1Br Amb28125815 [0,2,0,0,0,0|0,0,0]=2 9047 B13R1.12 CNCC(C)c1cccc(O)c1C Amb24533736 [0,2,0,0,0,0|0,0,0]=2 9048 B13R1.12 CNCC(C)c1cccc(O)c1Cl Amb26632840 [0,2,0,0,0,0|0,0,0]=2 9049 B13R1.12 CNCC(C)c1cccc(O)c1F Amb24686183 [0,2,0,0,0,0|0,0,0]=2 9050 B13R1.12 CNCC(O)c1cccc(Br)c1C Amb25158740 [0,2,0,0,0,0|1,0,0]=3 9051 B13R1.12 CNCC(O)c1cccc(Br)c1Cl Amb25116690 [0,2,0,0,0,0|1,0,0]=3 9052 B13R1.12 CNCC(O)c1cccc(Br)c1F Amb27143452 [0,2,0,0,0,0|1,0,0]=3 9053 B13R1.12 CNCC(O)c1cccc(Br)c1O Amb33332269 [0,2,0,0,0,0|1,0,0]=3 9054 B13R1.12 CNCC(O)c1cccc(C)c1Br Amb24724264 [0,2,0,0,0,0|1,0,0]=3 9055 B13R1.12 CNCC(O)c1cccc(C)c1C Amb18997480 [0,2,0,0,0,0|1,0,0]=3 9056 B13R1.12 CNCC(O)c1cccc(C)c1Cl Amb26991631 [0,2,0,0,0,0|1,0,0]=3 9057 B13R1.12 CNCC(O)c1cccc(C)c1F Amb25958027 [0,2,0,0,0,0|1,0,0]=3 9058 B13R1.12 CNCC(O)c1cccc(C)c1O Amb26970070 [0,2,0,0,0,0|1,0,0]=3 9059 B13R1.12 CNCC(O)c1cccc(Cl)c1Br Amb25832404 [0,2,0,0,0,0|1,0,0]=3 9060 B13R1.12 CNCC(O)c1cccc(Cl)c1C Amb27629063 [0,2,0,0,0,0|1,0,0]=3 9061 B13R1.12 CNCC(O)c1cccc(Cl)c1Cl Amb18997458 [0,2,0,0,0,0|1,0,0]=3 9062 B13R1.12 CNCC(O)c1cccc(Cl)c1F Amb26639842 [0,2,0,0,0,0|1,0,0]=3 9063 B13R1.12 CNCC(O)c1cccc(Cl)c1O Amb33056868 [0,2,0,0,0,0|1,0,0]=3 9064 B13R1.12 CNCC(O)c1cccc(F)c1Br Amb25851315 [0,2,0,0,0,0|1,0,0]=3 9065 B13R1.12 CNCC(O)c1cccc(F)c1C Amb25142390 [0,2,0,0,0,0|1,0,0]=3 9066 B13R1.12 CNCC(O)c1cccc(F)c1Cl Amb26018030 [0,2,0,0,0,0|1,0,0]=3 9067 B13R1.12 CNCC(O)c1cccc(F)c1F Amb26508304 [0,2,0,0,0,0|1,0,0]=3 9068 B13R1.12 CNCC(O)c1cccc(F)c1O Amb33311164 [0,2,0,0,0,0|1,0,0]=3 9069 B13R1.12 CNCC(O)c1cccc(O)c1Br Amb28188851 [0,2,0,0,0,0|1,0,0]=3 9070 B13R1.12 CNCC(O)c1cccc(O)c1C Amb25848428 [0,2,0,0,0,0|1,0,0]=3 9071 B13R1.12 CNCC(O)c1cccc(O)c1Cl Amb25832391 [0,2,0,0,0,0|1,0,0]=3 9072 B13R1.12 CNCC(O)c1cccc(O)c1F Amb18129513 [0,2,0,0,0,0|1,0,0]=3 9073 B13R1.12 CNCC(O)c1cccc(O)c1O Amb33269528 [0,2,0,0,0,0|1,0,0]=3 9074 B13R1.12 COCC(C)N1C=CC=C(N)C1=O Amb32699321 [0,2,0,0,0,0|2,0,0]=4 9075 B13R1.12 COCC(N)c1cccc(Br)c1Cl Amb27879728 [0,2,0,0,0,0|2,0,0]=4 9076 B13R1.12 COCC(N)c1cccc(Br)c1F Amb27771821 [0,2,0,0,0,0|2,0,0]=4 9077 B13R1.12 COCC(N)c1cccc(C)c1I Amb27450725 [0,2,0,0,0,0|2,0,0]=4 9078 B13R1.12 COCC(N)c1cccc(C)c1O Amb27398219 [0,2,0,0,0,0|2,0,0]=4 9079 B13R1.12 COCC(N)c1cccc(Cl)c1Br Amb27171241 [0,2,0,0,0,0|2,0,0]=4 9080 B13R1.12 COCC(N)c1cccc(F)c1Br Amb28368185 [0,2,0,0,0,0|2,0,0]=4 9081 B13R1.12 COCC(N)c1cccc(I)c1C Amb27794528 [0,2,0,0,0,0|2,0,0]=4 9082 B13R1.12 COCC(N)c1cccc(N)c1C Amb27392957 [0,2,0,0,0,0|2,0,0]=4 9083 B13R1.12 COCC(N)c1cccc(N)c1O Amb27162250 [0,2,0,0,0,0|2,0,0]=4 9084 B13R1.12 COCC(N)c1cccc(O)c1C Amb27592459 [0,2,0,0,0,0|2,0,0]=4 9085 B13R1.12 COCC(O)c1cccc(C)c1Br Amb27873860 [0,2,0,0,0,0|2,0,0]=4 9086 B13R1.12 COCC(O)c1cccc(C)c1Cl Amb27235477 [0,2,0,0,0,0|2,0,0]=4 9087 B13R1.12 COCC(O)c1cccc(C)c1I Amb27805760 [0,2,0,0,0,0|2,0,0]=4 9088 B13R1.12 COCC(O)c1cccc(F)c1C Amb27217129 [0,2,0,0,0,0|2,0,0]=4 9089 B13R1.12 COCC(O)c1cccc(F)c1Cl Amb27663146 [0,2,0,0,0,0|2,0,0]=4 9090 B13R1.12 COCC(O)c1cccc(F)c1N Amb35582034 [0,2,0,0,0,0|2,0,0]=4 9091 B13R1.12 COCC(O)c1cccc(N)c1C Amb35622594 [0,2,0,0,0,0|2,0,0]=4 9092 B13R1.12 COCC(O)c1cccc(N)c1F Amb35741097 [0,2,0,0,0,0|2,0,0]=4 9093 B13R1.12 COC[C@@H](N)c1cccc(Br)c1Br Amb27171485 [0,2,0,0,0,0|2,0,0]=4 9094 B13R1.12 COC[C@@H](N)c1cccc(Br)c1C Amb27814581 [0,2,0,0,0,0|2,0,0]=4 9095 B13R1.12 COC[C@@H](N)c1cccc(Br)c1O Amb27812031 [0,2,0,0,0,0|2,0,0]=4 9096 B13R1.12 COC[C@@H](N)c1cccc(C)c1O Amb28197646 [0,2,0,0,0,0|2,0,0]=4 9097 B13R1.12 COC[C@@H](N)c1cccc(Cl)c1F Amb27180892 [0,2,0,0,0,0|2,0,0]=4 9098 B13R1.12 COC[C@@H](N)c1cccc(Cl)c1N Amb28187252 [0,2,0,0,0,0|2,0,0]=4 9099 B13R1.12 COC[C@@H](N)c1cccc(F)c1Br Amb28129777 [0,2,0,0,0,0|2,0,0]=4 9100 B13R1.12 COC[C@@H](N)c1cccc(F)c1C Amb27655554 [0,2,0,0,0,0|2,0,0]=4 9101 B13R1.12 COC[C@@H](N)c1cccc(F)c1O Amb27593839 [0,2,0,0,0,0|2,0,0]=4 9102 B13R1.12 COC[C@@H](N)c1cccc(N)c1C Amb27817758 [0,2,0,0,0,0|2,0,0]=4 9103 B13R1.12 COC[C@@H](N)c1cccc(O)c1Br Amb27171240 [0,2,0,0,0,0|2,0,0]=4 9104 B13R1.12 COC[C@@H](N)c1cccc(S)c1O Amb27494865 [0,2,0,0,0,0|2,0,0]=4 9105 B13R1.12 COC[C@H](N)c1cccc(Br)c1C Amb27267239 [0,2,0,0,0,0|2,0,0]=4 9106 B13R1.12 COC[C@H](N)c1cccc(C)c1N Amb27234635 [0,2,0,0,0,0|2,0,0]=4 9107 B13R1.12 COC[C@H](N)c1cccc(Cl)c1F Amb27608537 [0,2,0,0,0,0|2,0,0]=4 9108 B13R1.12 COC[C@H](N)c1cccc(F)c1C Amb28316566 [0,2,0,0,0,0|2,0,0]=4 9109 B13R1.12 COC[C@H](N)c1cccc(F)c1N Amb27596131 [0,2,0,0,0,0|2,0,0]=4 9110 B13R1.12 COC[C@H](N)c1cccc(F)c1O Amb27252070 [0,2,0,0,0,0|2,0,0]=4 9111 B13R1.12 COC[C@H](N)c1cccc(O)c1Br Amb28341101 [0,2,0,0,0,0|2,0,0]=4 9112 B13R1.12 CONC(C)c1cccc(F)c1F Amb27195482 [0,2,0,0,0,0|2,0,0]=4 9113 B13R1.12 CSCC(N)c1cccc(C)c1C Amb18300369 [0,2,0,0,0,0|2,0,0]=4 9114 B13R1.12 CSCC(N)c1cccc(F)c1F Amb27589284 [0,2,0,0,0,0|2,0,0]=4 9115 B13R1.12 CSCC(O)c1cccc(C)c1C Amb18325106 [0,2,0,0,0,0|2,0,0]=4 9116 B13R1.12 C\C=C\C(C)c1cccc(Cl)c1O Amb26528424 [0,2,0,0,0,0|1,0,1]=4 9117 B13R1.12 Cc1c(Br)cccc1C(C)CCN Amb33478402 [0,2,0,0,0,0|2,0,0]=4 9118 B13R1.12 Cc1c(Br)cccc1C(C)CON Amb33476899 [0,2,0,0,0,0|2,0,0]=4 9119 B13R1.12 Cc1c(Cl)cccc1C(C)CC#N Amb24359098 [0,2,0,0,0,0|2,0,0]=4 9120 B13R1.12 Cc1c(Cl)cccc1C(C)CCN Amb24645219 [0,2,0,0,0,0|2,0,0]=4 9121 B13R1.12 Cc1c(F)cccc1C(C)CCN Amb33372768 [0,2,0,0,0,0|2,0,0]=4 9122 B13R1.12 Cc1c(F)cccc1C(C)CON Amb33372387 [0,2,0,0,0,0|2,0,0]=4 9123 B13R1.12 Cc1cccc(C(C)CC#N)c1C Amb26876616 [0,2,0,0,0,0|2,0,0]=4 9124 B13R1.12 Cc1cccc(C(C)CCN)c1C Amb17233373 [0,2,0,0,0,0|2,0,0]=4 9125 B13R1.12 Cc1cccc(C(C)CCN)c1F Amb33325402 [0,2,0,0,0,0|2,0,0]=4 9126 B13R1.12 Cc1cccc(C(C)CCO)c1C Amb17233486 [0,2,0,0,0,0|2,0,0]=4 9127 B13R1.12 Cc1cccc(C(C)CON)c1C Amb33197955 [0,2,0,0,0,0|2,0,0]=4 9128 B13R1.12 Cc1cccc(C(C)CON)c1F Amb33325031 [0,2,0,0,0,0|2,0,0]=4 9129 B13R1.18 C#CCN[C@@H](C)c1cccc(O)c1 Amb27771105 [0,2,0,0,0,0|1,0,1]=4 9130 B13R1.18 C=CCNC(C)c1cccc(Br)c1 Amb6683837 [0,2,0,0,0,0|1,0,1]=4 9131 B13R1.18 C=CCNC(C)c1cccc(Cl)c1 Amb6683944 [0,2,0,0,0,0|1,0,1]=4 9132 B13R1.18 CC#CCC(N)c1cccc(C)c1 Amb18183779 [0,2,0,0,0,0|2,0,0]=4 9133 B13R1.18 CC#CCC(N)c1cccc(Cl)c1 Amb19062408 [0,2,0,0,0,0|2,0,0]=4 9134 B13R1.18 CC#CCC(O)c1cccc(Br)c1 Amb27865195 [0,2,0,0,0,0|2,0,0]=4 9135 B13R1.18 CC#CCC(O)c1cccc(I)c1 Amb28382854 [0,2,0,0,0,0|2,0,0]=4 9136 B13R1.18 CC#CCN(C)c1cccc(C)c1 Amb27835779 [0,2,0,0,0,0|2,0,0]=4 9137 B13R1.18 CC#CCN(C)c1cccc(O)c1 Amb27591140 [0,2,0,0,0,0|2,0,0]=4 9138 B13R1.18 CC(CN=C=O)c1cccc(Br)c1 Amb25700029 [0,2,0,0,0,0|0,0,2]=4 9139 B13R1.18 CC(CN=C=O)c1cccc(F)c1 Amb24564951 [0,2,0,0,0,0|0,0,2]=4 9140 B13R1.18 CC(NCC#N)c1cccc(Br)c1 Amb18971223 [0,2,0,0,0,0|2,0,0]=4 9141 B13R1.18 CC(NCCN)c1cccc(F)c1 Amb19005504 [0,2,0,0,0,0|2,0,0]=4 9142 B13R1.18 CC(NCCO)c1cccc(Br)c1 Amb7809216 [0,2,0,0,0,0|2,0,0]=4 9143 B13R1.18 CC(NCCO)c1cccc(Cl)c1 Amb7809125 [0,2,0,0,0,0|2,0,0]=4 9144 B13R1.18 CC(NCCO)c1cccc(F)c1 Amb7809122 [0,2,0,0,0,0|2,0,0]=4 9145 B13R1.18 CC(OCCN)c1cccc(Cl)c1 Amb17079509 [0,2,0,0,0,0|2,0,0]=4 9146 B13R1.18 CC(OCCN)c1cccc(F)c1 Amb17079471 [0,2,0,0,0,0|2,0,0]=4 9147 B13R1.18 CC(SCC#N)c1cccc(Br)c1 Amb28400576 [0,2,0,0,0,0|2,0,0]=4 9148 B13R1.18 CCCCC(N)c1cccc(C)c1 Amb18184248 [0,2,0,0,0,0|2,0,0]=4 9149 B13R1.18 CCCCC(N)c1cccc(C)c1 Amb32662441 [0,2,0,0,0,0|2,0,0]=4 9150 B13R1.18 CCCCC(N)c1cccc(F)c1 Amb18805319 [0,2,0,0,0,0|2,0,0]=4 9151 B13R1.18 CCCCC(N)c1cccc(F)c1 Amb35746818 [0,2,0,0,0,0|2,0,0]=4 9152 B13R1.18 CCCCC(N)c1cccc(N)c1 Amb32697378 [0,2,0,0,0,0|2,0,0]=4 9153 B13R1.18 CCCCC(N)c1cccc(O)c1 Amb24117966 [0,2,0,0,0,0|2,0,0]=4 9154 B13R1.18 CCCNC(C)c1cccc(Br)c1 Amb6259285 [0,2,0,0,0,0|1,0,0]=3 9155 B13R1.18 CCCNC(C)c1cccc(Cl)c1 Amb6665883 [0,2,0,0,0,0|1,0,0]=3 9156 B13R1.18 CCCNC(C)c1cccc(F)c1 Amb6261877 [0,2,0,0,0,0|1,0,0]=3 9157 B13R1.18 CCNCC(=O)c1cccc(Br)c1 Amb17315031 [0,2,0,0,0,0|1,0,1]=4 9158 B13R1.18 CCNCC(=O)c1cccc(N)c1 Amb18550939 [0,2,0,0,0,0|1,0,1]=4 9159 B13R1.18 CCNCC(=O)c1cccc(O)c1 Amb17594589 [0,2,0,0,0,0|1,0,1]=4 9160 B13R1.18 CCNCC(C)c1cccc(Br)c1 Amb33329960 [0,2,0,0,0,0|0,0,0]=2 9161 B13R1.18 CCNCC(C)c1cccc(Br)c1 Amb33329961 [0,2,0,0,0,0|0,0,0]=2 9162 B13R1.18 CCNCC(C)c1cccc(N)c1 Amb33071781 [0,2,0,0,0,0|0,0,0]=2 9163 B13R1.18 CCNCC(N)c1cccc(C)c1 Amb33229797 [0,2,0,0,0,0|1,0,0]=3 9164 B13R1.18 CCNCC(O)c1cccc(Br)c1 Amb17159561 [0,2,0,0,0,0|1,0,0]=3 9165 B13R1.18 CCNCC(O)c1cccc(C)c1 Amb17138910 [0,2,0,0,0,0|1,0,0]=3 9166 B13R1.18 CCNCC(O)c1cccc(Cl)c1 Amb17139772 [0,2,0,0,0,0|1,0,0]=3 9167 B13R1.18 CCNCC(O)c1cccc(N)c1 Amb17594626 [0,2,0,0,0,0|1,0,0]=3 9168 B13R1.18 CCNCC(O)c1cccc(O)c1 Amb1104311 [0,2,0,0,0,0|1,0,0]=3 9169 B13R1.18 CCNCC(O)c1cccc(O)c1 Amb4035737 [0,2,0,0,0,0|1,0,0]=3 9170 B13R1.18 CCONC(C)c1cccc(Br)c1 Amb32655879 [0,2,0,0,0,0|2,0,0]=4 9171 B13R1.18 CC[NH2+]CC(O)c1cccc(O)c1 Amb5638255 [0,2,0,0,0,0|1,0,1]=4 9172 B13R1.18 CN(CCCCl)c1cccc(Br)c1 Amb17359054 [0,2,0,0,0,0|2,0,0]=4 9173 B13R1.18 CN(CCCCl)c1cccc(Cl)c1 Amb17340958 [0,2,0,0,0,0|2,0,0]=4 9174 B13R1.18 CN(CCCCl)c1cccc(F)c1 Amb17337714 [0,2,0,0,0,0|2,0,0]=4 9175 B13R1.18 CN(CCCN)c1cccc(Br)c1 Amb17059827 [0,2,0,0,0,0|2,0,0]=4 9176 B13R1.18 CN(CCCN)c1cccc(Cl)c1 Amb17059627 [0,2,0,0,0,0|2,0,0]=4 9177 B13R1.18 CN(CCCN)c1cccc(F)c1 Amb8829233 [0,2,0,0,0,0|2,0,0]=4 9178 B13R1.18 CN(CCCO)c1cccc(Br)c1 Amb17349694 [0,2,0,0,0,0|2,0,0]=4 9179 B13R1.18 CN(CCCO)c1cccc(Cl)c1 Amb17337504 [0,2,0,0,0,0|2,0,0]=4 9180 B13R1.18 CN(CCCO)c1cccc(F)c1 Amb17335631 [0,2,0,0,0,0|2,0,0]=4 9181 B13R1.18 CNCCC(=O)c1cccc(N)c1 Amb18862931 [0,2,0,0,0,0|1,0,1]=4 9182 B13R1.18 CNCCC(C)c1cccc(C)c1 Amb17233365 [0,2,0,0,0,0|0,0,0]=2 9183 B13R1.18 CNCCC(C)c1cccc(Cl)c1 Amb17236710 [0,2,0,0,0,0|0,0,0]=2 9184 B13R1.18 CNCCC(C)c1cccc(F)c1 Amb17233845 [0,2,0,0,0,0|0,0,0]=2 9185 B13R1.18 CNCCC(O)c1cccc(N)c1 Amb18862981 [0,2,0,0,0,0|1,0,0]=3 9186 B13R1.18 CNCCN(C)c1cccc(Cl)c1 Amb33328806 [0,2,0,0,0,0|1,0,0]=3 9187 B13R1.18 CNCCN(C)c1cccc(Cl)c1 Amb33328808 [0,2,0,0,0,0|1,0,0]=3 9188 B13R1.18 CNC\C=C(/C)c1cccc(Br)c1 Amb31137994 [0,2,0,0,0,0|0,0,1]=3 9189 B13R1.18 CNC\C=C(/C)c1cccc(C)c1 Amb31174809 [0,2,0,0,0,0|0,0,1]=3 9190 B13R1.18 CNC\C=C(/C)c1cccc(F)c1 Amb31174822 [0,2,0,0,0,0|0,0,1]=3 9191 B13R1.18 CNC\C=C(\C)c1cccc(F)c1 Amb27426868 [0,2,0,0,0,0|0,0,1]=3 9192 B13R1.18 C[C@@H](NCC#N)c1cccc(Br)c1 Amb27832955 [0,2,0,0,0,0|2,0,0]=4 9193 B13R1.18 C[C@@H](NCC#N)c1cccc(Cl)c1 Amb28453615 [0,2,0,0,0,0|2,0,0]=4 9194 B13R1.18 C[C@@H](NCC#N)c1cccc(F)c1 Amb27608970 [0,2,0,0,0,0|2,0,0]=4 9195 B13R1.18 C[C@@H](NCC#N)c1cccc(O)c1 Amb27256034 [0,2,0,0,0,0|2,0,0]=4 9196 B13R1.18 C[C@H](NCC#N)c1cccc(F)c1 Amb27197301 [0,2,0,0,0,0|2,0,0]=4 9197 B13R1.18 C\C=C\CN(C)c1cccc(C)c1 Amb28185725 [0,2,0,0,0,0|2,0,0]=4 9198 B13R1.18 C\C=C\CN(C)c1cccc(F)c1 Amb27594336 [0,2,0,0,0,0|2,0,0]=4 9199 B13R1.18 Cc1cccc(C(C)CN=C=O)c1 Amb27840974 [0,2,0,0,0,0|0,0,2]=4 9200 B13R1.18 Cc1cccc(C(C)OCCN)c1 Amb17079426 [0,2,0,0,0,0|2,0,0]=4 9201 B13R1.18 Cc1cccc(C(O)CCCN)c1 Amb17233568 [0,2,0,0,0,0|2,0,0]=4 9202 B13R1.18 Cc1cccc(N(C)CCCCl)c1 Amb17337270 [0,2,0,0,0,0|2,0,0]=4 9203 B13R1.18 Cc1cccc(N(C)CCCN)c1 Amb8828971 [0,2,0,0,0,0|2,0,0]=4 9204 B13R1.18 Cc1cccc(N(C)CCCO)c1 Amb17335360 [0,2,0,0,0,0|2,0,0]=4 9205 B13R1.18 NCCCC(O)c1cccc(Br)c1 Amb17256959 [0,2,0,0,0,0|2,0,0]=4 9206 B13R1.18 NCCCC(O)c1cccc(Cl)c1 Amb17237037 [0,2,0,0,0,0|2,0,0]=4 9207 B13R1.18 NCCCC(O)c1cccc(F)c1 Amb18066107 [0,2,0,0,0,0|2,0,0]=4 9208 B13R1.22 CC(CN)C(C)c1cccc(Br)c1 Amb30021559 [0,2,0,0,0,0|2,0,0]=4 9209 B13R1.22 CC(CN)C(C)c1cccc(F)c1 Amb25117804 [0,2,0,0,0,0|2,0,0]=4 9210 B13R1.22 CC(CO)C(C)c1cccc(F)c1 Amb33745865 [0,2,0,0,0,0|2,0,0]=4 9211 B13R1.22 CC(c1cccc(F)c1)[C@@H](C)CN Amb33730577 [0,2,0,0,0,0|2,0,0]=4 9212 B13R1.22 CC(c1cccc(F)c1)[C@@H](C)CO Amb33747157 [0,2,0,0,0,0|2,0,0]=4 9213 B13R1.22 CC(c1cccc(F)c1)[C@H](C)CN Amb33748023 [0,2,0,0,0,0|2,0,0]=4 9214 B13R1.22 CC(c1cccc(F)c1)[C@H](C)CO Amb33744405 [0,2,0,0,0,0|2,0,0]=4 9215 B13R1.22 CCC(=O)C(C)c1cccc(Br)c1 Amb26340515 [0,2,0,0,0,0|1,0,1]=4 9216 B13R1.22 CCC(=O)C(C)c1cccc(C)c1 Amb27809835 [0,2,0,0,0,0|1,0,1]=4 9217 B13R1.22 CCC(Br)C(C)c1cccc(Br)c1 Amb27254018 [0,2,0,0,0,0|1,0,0]=3 9218 B13R1.22 CCC(C)C(Cl)c1cccc(Br)c1 Amb29880793 [0,2,0,0,0,0|2,0,0]=4 9219 B13R1.22 CCC(C)C(Cl)c1cccc(Cl)c1 Amb27260606 [0,2,0,0,0,0|2,0,0]=4 9220 B13R1.22 CCC(C)C(N)c1cccc(F)c1 Amb27877654 [0,2,0,0,0,0|2,0,0]=4 9221 B13R1.22 CCC(C)C(N)c1cccc(N)c1 Amb32697381 [0,2,0,0,0,0|2,0,0]=4 9222 B13R1.22 CCC(C)C(O)c1cccc(Br)c1 Amb27947820 [0,2,0,0,0,0|2,0,0]=4 9223 B13R1.22 CCC(C)C(O)c1cccc(Cl)c1 Amb27623788 [0,2,0,0,0,0|2,0,0]=4 9224 B13R1.22 CCC(C)C(O)c1cccc(F)c1 Amb27795478 [0,2,0,0,0,0|2,0,0]=4 9225 B13R1.22 CCC(C)N(C)c1cccc(C)c1 Amb27456312 [0,2,0,0,0,0|2,0,0]=4 9226 B13R1.22 CCC(C)N(C)c1cccc(F)c1 Amb27858150 [0,2,0,0,0,0|2,0,0]=4 9227 B13R1.22 CCC(C)[C@@H](N)c1cccc(Br)c1 Amb28055866 [0,2,0,0,0,0|2,0,0]=4 9228 B13R1.22 CCC(C)[C@@H](N)c1cccc(I)c1 Amb28434724 [0,2,0,0,0,0|2,0,0]=4 9229 B13R1.22 CCC(C)[C@H](N)c1cccc(F)c1 Amb27789955 [0,2,0,0,0,0|2,0,0]=4 9230 B13R1.22 CCC(N)C(C)c1cccc(Br)c1 Amb18156155 [0,2,0,0,0,0|1,0,0]=3 9231 B13R1.22 CCC(N)C(C)c1cccc(C)c1 Amb18195745 [0,2,0,0,0,0|1,0,0]=3 9232 B13R1.22 CCC(N)C(C)c1cccc(F)c1 Amb28047094 [0,2,0,0,0,0|1,0,0]=3 9233 B13R1.22 CCC(N)C(N)c1cccc(I)c1 Amb28075244 [0,2,0,0,0,0|2,0,0]=4 9234 B13R1.22 CCC(N)C(O)c1cccc(O)c1 Amb9429033 [0,2,0,0,0,0|2,0,0]=4 9235 B13R1.22 CCC(O)C(C)c1cccc(Br)c1 Amb27618121 [0,2,0,0,0,0|1,0,0]=3 9236 B13R1.22 CCC(O)C(C)c1cccc(Cl)c1 Amb27947782 [0,2,0,0,0,0|1,0,0]=3 9237 B13R1.22 CCC(O)C(N)c1cccc(C)c1 Amb27415220 [0,2,0,0,0,0|2,0,0]=4 9238 B13R1.22 CCC(O)C(N)c1cccc(F)c1 Amb27857873 [0,2,0,0,0,0|2,0,0]=4 9239 B13R1.22 CCC(O)C(O)c1cccc(Br)c1 Amb30021902 [0,2,0,0,0,0|2,0,0]=4 9240 B13R1.22 CCC(O)C(O)c1cccc(C)c1 Amb28388241 [0,2,0,0,0,0|2,0,0]=4 9241 B13R1.22 CCN(C)C(C)c1cccc(Br)c1 Amb27665161 [0,2,0,0,0,0|2,0,0]=4 9242 B13R1.22 CCN(C)C(C)c1cccc(C)c1 Amb28282359 [0,2,0,0,0,0|2,0,0]=4 9243 B13R1.22 CCN(C)C(C)c1cccc(Cl)c1 Amb28064779 [0,2,0,0,0,0|2,0,0]=4 9244 B13R1.22 CCN(C)C(C)c1cccc(O)c1 Amb28314839 [0,2,0,0,0,0|2,0,0]=4 9245 B13R1.22 CCS(=O)C(C)c1cccc(Cl)c1 Amb28318644 [0,2,0,0,0,0|2,0,0]=4 9246 B13R1.22 CC[C@@H](N)C(O)c1cccc(Br)c1 Amb35659336 [0,2,0,0,0,0|2,0,0]=4 9247 B13R1.22 CC[C@@H](N)C(O)c1cccc(C)c1 Amb35659374 [0,2,0,0,0,0|2,0,0]=4 9248 B13R1.22 CC[C@@H](N)C(O)c1cccc(Cl)c1 Amb35659327 [0,2,0,0,0,0|2,0,0]=4 9249 B13R1.22 CC[C@@H](N)C(O)c1cccc(F)c1 Amb35659451 [0,2,0,0,0,0|2,0,0]=4 9250 B13R1.22 CC[C@@H](N)[C@@H](O)c1cccc(Br)c1 Amb27201425 [0,2,0,0,0,0|2,0,0]=4 9251 B13R1.22 CC[C@@H](N)[C@@H](O)c1cccc(Cl)c1 Amb27818125 [0,2,0,0,0,0|2,0,0]=4 9252 B13R1.22 CC[C@@H](N)[C@@H](O)c1cccc(O)c1 Amb27875530 [0,2,0,0,0,0|2,0,0]=4 9253 B13R1.22 CC[C@@H](N)[C@H](O)c1cccc(F)c1 Amb28077235 [0,2,0,0,0,0|2,0,0]=4 9254 B13R1.22 CC[C@@H](N)[C@H](O)c1cccc(N)c1 Amb28411242 [0,2,0,0,0,0|2,0,0]=4 9255 B13R1.22 CC[C@@H](O)[C@@H](N)c1cccc(C)c1 Amb27480928 [0,2,0,0,0,0|2,0,0]=4 9256 B13R1.22 CC[C@@H](O)[C@@H](N)c1cccc(I)c1 Amb27436803 [0,2,0,0,0,0|2,0,0]=4 9257 B13R1.22 CC[C@H](N)C(O)c1cccc(Br)c1 Amb35601447 [0,2,0,0,0,0|2,0,0]=4 9258 B13R1.22 CC[C@H](N)C(O)c1cccc(C)c1 Amb35601242 [0,2,0,0,0,0|2,0,0]=4 9259 B13R1.22 CC[C@H](N)C(O)c1cccc(Cl)c1 Amb35601439 [0,2,0,0,0,0|2,0,0]=4 9260 B13R1.22 CC[C@H](N)C(O)c1cccc(F)c1 Amb35601351 [0,2,0,0,0,0|2,0,0]=4 9261 B13R1.22 CC[C@H](N)[C@@H](N)c1cccc(F)c1 Amb27816583 [0,2,0,0,0,0|2,0,0]=4 9262 B13R1.22 CC[C@H](N)[C@@H](O)c1cccc(Br)c1 Amb27818116 [0,2,0,0,0,0|2,0,0]=4 9263 B13R1.22 CC[C@H](N)[C@@H](O)c1cccc(Cl)c1 Amb27195878 [0,2,0,0,0,0|2,0,0]=4 9264 B13R1.22 CC[C@H](N)[C@H](O)c1cccc(C)c1 Amb28434748 [0,2,0,0,0,0|2,0,0]=4 9265 B13R1.22 CC[C@H](N)[C@H](O)c1cccc(Cl)c1 Amb27620370 [0,2,0,0,0,0|2,0,0]=4 9266 B13R1.22 CC[C@H](N)[C@H](O)c1cccc(N)c1 Amb27234020 [0,2,0,0,0,0|2,0,0]=4 9267 B13R1.22 CC[C@H](O)[C@H](N)c1cccc(Cl)c1 Amb28316607 [0,2,0,0,0,0|2,0,0]=4 9268 B13R1.22 CC[C@H](O)[C@H](N)c1cccc(F)c1 Amb27858322 [0,2,0,0,0,0|2,0,0]=4 9269 B13R1.22 CNC(=N)N(C)c1cccc(C)c1 Amb18184203 [0,2,0,0,0,0|1,0,1]=4 9270 B13R1.22 CNC(=O)C(C)c1cccc(F)c1 Amb28285619 [0,2,0,0,0,0|0,0,1]=3 9271 B13R1.22 CNC(=O)C(Cl)c1cccc(Br)c1 Amb28249748 [0,2,0,0,0,0|1,0,1]=4 9272 B13R1.22 CNC(=O)C(Cl)c1cccc(C)c1 Amb19083266 [0,2,0,0,0,0|1,0,1]=4 9273 B13R1.22 CNC(=O)C(N)c1cccc(Br)c1 Amb27840878 [0,2,0,0,0,0|1,0,1]=4 9274 B13R1.22 CNC(=O)C(N)c1cccc(C)c1 Amb25873323 [0,2,0,0,0,0|1,0,1]=4 9275 B13R1.22 CNC(=O)C(N)c1cccc(Cl)c1 Amb27841021 [0,2,0,0,0,0|1,0,1]=4 9276 B13R1.22 CNC(=O)C(N)c1cccc(F)c1 Amb24459874 [0,2,0,0,0,0|1,0,1]=4 9277 B13R1.22 CNC(=O)C(O)c1cccc(Br)c1 Amb24704267 [0,2,0,0,0,0|1,0,1]=4 9278 B13R1.22 CNC(=O)C(O)c1cccc(C)c1 Amb25695140 [0,2,0,0,0,0|1,0,1]=4 9279 B13R1.22 CNC(=O)C(O)c1cccc(F)c1 Amb24439436 [0,2,0,0,0,0|1,0,1]=4 9280 B13R1.22 CNC(=O)N(C)c1cccc(Br)c1 Amb27834722 [0,2,0,0,0,0|1,0,1]=4 9281 B13R1.22 CNC(=O)N(C)c1cccc(F)c1 Amb27261174 [0,2,0,0,0,0|1,0,1]=4 9282 B13R1.22 CNC(=O)N(C)c1cccc(N)c1 Amb25052138 [0,2,0,0,0,0|1,0,1]=4 9283 B13R1.22 CNC(=S)N(C)c1cccc(Br)c1 Amb27756933 [0,2,0,0,0,0|1,0,1]=4 9284 B13R1.22 CNC(=S)N(C)c1cccc(C)c1 Amb27449116 [0,2,0,0,0,0|1,0,1]=4 9285 B13R1.22 CNC(C)C(=O)c1cccc(Br)c1 Amb26877485 [0,2,0,0,0,0|1,0,1]=4 9286 B13R1.22 CNC(C)C(=O)c1cccc(C)c1 Amb27873898 [0,2,0,0,0,0|1,0,1]=4 9287 B13R1.22 CNC(C)C(=O)c1cccc(Cl)c1 Amb19889606 [0,2,0,0,0,0|1,0,1]=4 9288 B13R1.22 CNC(C)C(=O)c1cccc(F)c1 Amb28282705 [0,2,0,0,0,0|1,0,1]=4 9289 B13R1.22 CNC(C)C(=O)c1cccc(N)c1 Amb28140764 [0,2,0,0,0,0|1,0,1]=4 9290 B13R1.22 CNC(C)C(C)c1cccc(Br)c1 Amb27947314 [0,2,0,0,0,0|0,0,0]=2 9291 B13R1.22 CNC(C)C(O)c1cccc(Br)c1 Amb35621405 [0,2,0,0,0,0|1,0,0]=3 9292 B13R1.22 CNC(C)C(O)c1cccc(C)c1 Amb35741408 [0,2,0,0,0,0|1,0,0]=3 9293 B13R1.22 CNC(C)C(O)c1cccc(Cl)c1 Amb35741309 [0,2,0,0,0,0|1,0,0]=3 9294 B13R1.22 CNC(C)C(O)c1cncc(C)c1 Amb35621104 [0,2,0,0,0,0|2,0,0]=4 9295 B13R1.22 CNC(C)C(O)c1cncc(F)c1 Amb35741562 [0,2,0,0,0,0|2,0,0]=4 9296 B13R1.22 CN[C@@H](C)C(=O)c1cccc(Br)c1 Amb35662340 [0,2,0,0,0,0|1,0,1]=4 9297 B13R1.22 CN[C@@H](C)C(=O)c1cccc(C)c1 Amb35659957 [0,2,0,0,0,0|1,0,1]=4 9298 B13R1.22 CN[C@@H](C)C(=O)c1cccc(Cl)c1 Amb29891462 [0,2,0,0,0,0|1,0,1]=4 9299 B13R1.22 CN[C@@H](C)C(=O)c1cccc(F)c1 Amb35659966 [0,2,0,0,0,0|1,0,1]=4 9300 B13R1.22 CN[C@@H](C)C(O)c1cccc(Br)c1 Amb35662604 [0,2,0,0,0,0|1,0,0]=3 9301 B13R1.22 CN[C@@H](C)C(O)c1cccc(C)c1 Amb35662344 [0,2,0,0,0,0|1,0,0]=3 9302 B13R1.22 CN[C@@H](C)C(O)c1cccc(Cl)c1 Amb35662598 [0,2,0,0,0,0|1,0,0]=3 9303 B13R1.22 CN[C@@H](C)C(O)c1cccc(F)c1 Amb35662613 [0,2,0,0,0,0|1,0,0]=3 9304 B13R1.22 CN[C@@H](C)C(O)c1cncc(C)c1 Amb35664060 [0,2,0,0,0,0|2,0,0]=4 9305 B13R1.22 CN[C@@H](C)C(O)c1cncc(F)c1 Amb35664054 [0,2,0,0,0,0|2,0,0]=4 9306 B13R1.22 CN[C@@H](C)[C@@H](O)c1cccc(O)c1 Amb27597057 [0,2,0,0,0,0|1,0,0]=3 9307 B13R1.22 CN[C@H](C)[C@@H](O)c1cccc(O)c1 Amb27647578 [0,2,0,0,0,0|1,0,0]=3 9308 B13R1.22 CN[C@H](C)[C@H](O)c1cccc(O)c1 Amb28240477 [0,2,0,0,0,0|1,0,0]=3 9309 B13R1.22 COC(=O)C(C)c1cccc(Br)c1 Amb24183608 [0,2,0,0,0,0|1,0,1]=4 9310 B13R1.22 COC(=O)C(C)c1cccc(C)c1 Amb18804749 [0,2,0,0,0,0|1,0,1]=4 9311 B13R1.22 COC(=O)C(C)c1cccc(Cl)c1 Amb18331146 [0,2,0,0,0,0|1,0,1]=4 9312 B13R1.22 COC(=O)C(C)c1cccc(F)c1 Amb18185421 [0,2,0,0,0,0|1,0,1]=4 9313 B13R1.22 COC(=O)C(C)c1cccc(N)c1 Amb18128401 [0,2,0,0,0,0|1,0,1]=4 9314 B13R1.22 COC(=O)C(C)c1cccc(N)c1 Amb26304209 [0,2,0,0,0,0|1,0,1]=4 9315 B13R1.22 COC(=O)[C@@H](C)c1cccc(N)c1 Amb24182085 [0,2,0,0,0,0|1,0,1]=4 9316 B13R1.22 COC(C)C(N)c1cccc(Br)c1 Amb35626162 [0,2,0,0,0,0|2,0,0]=4 9317 B13R1.22 COC(C)C(N)c1cccc(C)c1 Amb27416131 [0,2,0,0,0,0|2,0,0]=4 9318 B13R1.22 COC(C)C(N)c1cccc(Cl)c1 Amb27416130 [0,2,0,0,0,0|2,0,0]=4 9319 B13R1.22 COC(C)C(O)c1cccc(Br)c1 Amb30028049 [0,2,0,0,0,0|2,0,0]=4 9320 B13R1.22 COC(C)C(O)c1cccc(Cl)c1 Amb27272688 [0,2,0,0,0,0|2,0,0]=4 9321 B13R1.22 Cc1cccc(C(C)C(C)CN)c1 Amb27609096 [0,2,0,0,0,0|2,0,0]=4 9322 B13R1.30 C#CCC(C)(O)c1cccc(Br)c1 Amb24437875 [0,2,0,0,0,0|1,0,1]=4 9323 B13R1.30 C#CCC(C)(O)c1cccc(Cl)c1 Amb28289763 [0,2,0,0,0,0|1,0,1]=4 9324 B13R1.30 C=CCC(C)(C)c1cccc(C)c1 Amb24493822 [0,2,0,0,0,0|1,0,1]=4 9325 B13R1.30 C=CCC(C)(C)c1cccc(O)c1 Amb26477388 [0,2,0,0,0,0|1,0,1]=4 9326 B13R1.30 C=CCC(C)(N)c1cccc(C)c1 Amb28248556 [0,2,0,0,0,0|1,0,1]=4 9327 B13R1.30 C=CCC(C)(O)c1cccc(Br)c1 Amb27595158 [0,2,0,0,0,0|1,0,1]=4 9328 B13R1.30 C=CCC(C)(O)c1cccc(C)c1 Amb27175270 [0,2,0,0,0,0|1,0,1]=4 9329 B13R1.30 C=CCC(C)(O)c1cccc(F)c1 Amb27395165 [0,2,0,0,0,0|1,0,1]=4 9330 B13R1.30 C=CC[C@@](C)(N)c1cccc(Br)c1 Amb28042290 [0,2,0,0,0,0|1,0,1]=4 9331 B13R1.30 C=CC[C@@](C)(N)c1cccc(Cl)c1 Amb28187491 [0,2,0,0,0,0|1,0,1]=4 9332 B13R1.30 CC(C)(CC=O)c1cccc(F)c1 Amb28436700 [0,2,0,0,0,0|2,0,0]=4 9333 B13R1.30 CC(C)(CCN)c1cccc(Br)c1 Amb17255973 [0,2,0,0,0,0|2,0,0]=4 9334 B13R1.30 CC(C)(CCN)c1cccc(Cl)c1 Amb17236693 [0,2,0,0,0,0|2,0,0]=4 9335 B13R1.30 CC(C)(CCN)c1cccc(F)c1 Amb27830779 [0,2,0,0,0,0|2,0,0]=4 9336 B13R1.30 CC(C)(CCN)c1cccc(O)c1 Amb33312129 [0,2,0,0,0,0|2,0,0]=4 9337 B13R1.30 CC(C)(CON)c1cccc(Br)c1 Amb33451591 [0,2,0,0,0,0|2,0,0]=4 9338 B13R1.30 CC(C)(CON)c1cccc(Cl)c1 Amb33223331 [0,2,0,0,0,0|2,0,0]=4 9339 B13R1.30 CC(C)(CON)c1cccc(F)c1 Amb33316041 [0,2,0,0,0,0|2,0,0]=4 9340 B13R1.30 CC(C)(CON)c1cccc(O)c1 Amb33310969 [0,2,0,0,0,0|2,0,0]=4 9341 B13R1.30 CC(F)(CCN)c1cccc(Cl)c1 Amb28286772 [0,2,0,0,0,0|2,0,0]=4 9342 B13R1.30 CC(N)(CC#N)c1cccc(Cl)c1 Amb27777285 [0,2,0,0,0,0|2,0,0]=4 9343 B13R1.30 CC(N)(CC#N)c1cccc(F)c1 Amb27771940 [0,2,0,0,0,0|2,0,0]=4 9344 B13R1.30 CC(N)(CCO)c1cccc(Br)c1 Amb18872958 [0,2,0,0,0,0|2,0,0]=4 9345 B13R1.30 CC(N)(CCO)c1cccc(Cl)c1 Amb18225027 [0,2,0,0,0,0|2,0,0]=4 9346 B13R1.30 CC(N)(CCO)c1cccc(F)c1 Amb27794195 [0,2,0,0,0,0|2,0,0]=4 9347 B13R1.30 CC(N)(CCO)c1cccc(I)c1 Amb27873463 [0,2,0,0,0,0|2,0,0]=4 9348 B13R1.30 CC(N)(CCO)c1cccc(N)c1 Amb28250975 [0,2,0,0,0,0|2,0,0]=4 9349 B13R1.30 CC(O)(CC=O)c1cccc(F)c1 Amb27260556 [0,2,0,0,0,0|2,0,0]=4 9350 B13R1.30 CC(O)(CCN)c1cccc(Br)c1 Amb26333273 [0,2,0,0,0,0|2,0,0]=4 9351 B13R1.30 CC(O)(CCN)c1cccc(Cl)c1 Amb18066532 [0,2,0,0,0,0|2,0,0]=4 9352 B13R1.30 CC(O)(CCN)c1cccc(F)c1 Amb18066117 [0,2,0,0,0,0|2,0,0]=4 9353 B13R1.30 CC(O)(CNN)c1cccc(Br)c1 Amb32415956 [0,2,0,0,0,0|1,0,0]=3 9354 B13R1.30 CC(O)(CNN)c1cccc(Cl)c1 Amb32415953 [0,2,0,0,0,0|1,0,0]=3 9355 B13R1.30 CC(O)(CNN)c1cccc(F)c1 Amb32415954 [0,2,0,0,0,0|1,0,0]=3 9356 B13R1.30 CCCC(C)(O)c1cccc(C)c1 Amb9676819 [0,2,0,0,0,0|1,0,0]=3 9357 B13R1.30 CCCC(C)(O)c1cccc(F)c1 Amb9676834 [0,2,0,0,0,0|1,0,0]=3 9358 B13R1.30 CCCC(C)(O)c1cncc(Br)c1 Amb35669646 [0,2,0,0,0,0|2,0,0]=4 9359 B13R1.30 CNCC(C)(C)c1cccc(Br)c1 Amb17255975 [0,2,0,0,0,0|0,0,0]=2 9360 B13R1.30 CNCC(C)(C)c1cccc(C)c1 Amb17233333 [0,2,0,0,0,0|0,0,0]=2 9361 B13R1.30 CNCC(C)(C)c1cccc(Cl)c1 Amb17236694 [0,2,0,0,0,0|0,0,0]=2 9362 B13R1.30 CNCC(C)(N)c1cccc(Br)c1 Amb27946878 [0,2,0,0,0,0|0,0,0]=2 9363 B13R1.30 CNCC(C)(O)c1cccc(C)c1 Amb18997534 [0,2,0,0,0,0|0,0,0]=2 9364 B13R1.30 CNCC(C)(O)c1cccc(Cl)c1 Amb18301258 [0,2,0,0,0,0|0,0,0]=2 9365 B13R1.30 CNCC(C)(O)c1cncc(C)c1 Amb28293348 [0,2,0,0,0,0|1,0,0]=3 9366 B13R1.30 CNCC(F)(F)c1cccc(C)c1 Amb27476881 [0,2,0,0,0,0|1,0,0]=3 9367 B13R1.30 COCC(C)(N)c1cccc(Br)c1 Amb24685075 [0,2,0,0,0,0|1,0,0]=3 9368 B13R1.30 COCC(C)(N)c1cccc(C)c1 Amb18992594 [0,2,0,0,0,0|1,0,0]=3 9369 B13R1.30 COCC(C)(N)c1cccc(F)c1 Amb18299357 [0,2,0,0,0,0|1,0,0]=3 9370 B13R1.30 COCC(C)(O)c1cncc(Br)c1 Amb35669647 [0,2,0,0,0,0|2,0,0]=4 9371 B13R1.30 C[C@@](N)(CC#N)c1cccc(Cl)c1 Amb28243309 [0,2,0,0,0,0|2,0,0]=4 9372 B13R1.30 C[C@@](N)(CC#N)c1cccc(F)c1 Amb27878502 [0,2,0,0,0,0|2,0,0]=4 9373 B13R1.30 C[C@@](N)(CCO)c1cccc(F)c1 Amb28061499 [0,2,0,0,0,0|2,0,0]=4 9374 B13R1.30 C[C@](N)(CC#N)c1cccc(Br)c1 Amb27403658 [0,2,0,0,0,0|2,0,0]=4 9375 B13R1.30 C[C@](N)(CC#N)c1cccc(Cl)c1 Amb28200847 [0,2,0,0,0,0|2,0,0]=4 9376 B13R1.30 C[C@](N)(CCO)c1cccc(Br)c1 Amb27608299 [0,2,0,0,0,0|2,0,0]=4 9377 B13R1.30 C[C@](N)(CCO)c1cccc(I)c1 Amb28346641 [0,2,0,0,0,0|2,0,0]=4 9378 B13R1.30 C[C@](N)(CCO)c1cccc(N)c1 Amb27207907 [0,2,0,0,0,0|2,0,0]=4 9379 B13R1.30 C[C@](N)(CCO)c1cccc(O)c1 Amb28120656 [0,2,0,0,0,0|2,0,0]=4 9380 B13R1.30 Cc1cccc(C(C)(C)CCN)c1 Amb17233332 [0,2,0,0,0,0|2,0,0]=4 9381 B13R1.30 Cc1cccc(C(C)(C)CON)c1 Amb33203926 [0,2,0,0,0,0|2,0,0]=4 9382 B13R1.30 Cc1cccc(C(C)(N)CC#N)c1 Amb27491467 [0,2,0,0,0,0|2,0,0]=4 9383 B13R1.30 Cc1cccc(C(C)(N)CCO)c1 Amb18862952 [0,2,0,0,0,0|2,0,0]=4 9384 B13R1.30 Cc1cccc(C(C)(O)CCN)c1 Amb18564113 [0,2,0,0,0,0|2,0,0]=4 9385 B13R1.30 Cc1cccc(C(C)(O)CNN)c1 Amb32415957 [0,2,0,0,0,0|1,0,0]=3 9386 B13R1.30 Cc1cccc([C@@](C)(N)CCO)c1 Amb28243557 [0,2,0,0,0,0|2,0,0]=4 9387 B13R1.147 C=C(C)CC(Cl)c1cccc(C)c1 Amb27863421 [0,2,0,0,0,0|2,0,0]=4 9388 B13R1.147 C=C(C)CN(C)c1cccc(Br)c1 Amb27187979 [0,2,0,0,0,0|2,0,0]=4 9389 B13R1.147 C=C(C)CN(C)c1cccc(N)c1 Amb27964746 [0,2,0,0,0,0|2,0,0]=4 9390 B13R1.147 C=C(C)CN(C)c1cccc(O)c1 Amb27188157 [0,2,0,0,0,0|2,0,0]=4 9391 B13R1.147 C=C(C)C[C@@H](N)c1cccc(O)c1 Amb27253616 [0,2,0,0,0,0|2,0,0]=4 9392 B13R1.147 C=C(C)C[C@@H](O)c1cccc(C)c1 Amb27598595 [0,2,0,0,0,0|2,0,0]=4 9393 B13R1.147 C=C(C)C[C@H](N)c1cccc(C)c1 Amb28056113 [0,2,0,0,0,0|2,0,0]=4 9394 B13R1.147 CC(=N)NC(C)c1cccc(Cl)c1 Amb27458409 [0,2,0,0,0,0|2,0,0]=4 9395 B13R1.147 CC(=O)CC(C)c1cccc(Br)c1 Amb30021785 [0,2,0,0,0,0|1,0,0]=3 9396 B13R1.147 CC(=O)CC(O)c1cccc(Cl)c1 Amb27604414 [0,2,0,0,0,0|2,0,0]=4 9397 B13R1.147 CC(=O)CN(C)c1cccc(F)c1 Amb18791228 [0,2,0,0,0,0|2,0,0]=4 9398 B13R1.147 CC(=O)C[C@@H](O)c1cccc(Br)c1 Amb28065049 [0,2,0,0,0,0|2,0,0]=4 9399 B13R1.147 CC(=O)C[C@@H](O)c1cccc(Cl)c1 Amb27748864 [0,2,0,0,0,0|2,0,0]=4 9400 B13R1.147 CC(=O)C[C@@H](O)c1cccc(F)c1 Amb27660941 [0,2,0,0,0,0|2,0,0]=4 9401 B13R1.147 CC(=O)NC(C)c1cccc(Cl)c1 Amb10666947 [0,2,0,0,0,0|2,0,0]=4 9402 B13R1.147 CC(=O)NC(C)c1cccc(F)c1 Amb10667278 [0,2,0,0,0,0|2,0,0]=4 9403 B13R1.147 CC(=O)NC(C)c1cccc(N)c1 Amb1089732 [0,2,0,0,0,0|2,0,0]=4 9404 B13R1.147 CC(=O)NC(C)c1cccc(N)c1 Amb2099817 [0,2,0,0,0,0|2,0,0]=4 9405 B13R1.147 CC(=O)N[C@@H](C)c1cccc(C)c1 Amb27608694 [0,2,0,0,0,0|2,0,0]=4 9406 B13R1.147 CC(=O)N[C@@H](C)c1cccc(Cl)c1 Amb27608918 [0,2,0,0,0,0|2,0,0]=4 9407 B13R1.147 CC(=O)N[C@H](C)c1cccc(Cl)c1 Amb27608917 [0,2,0,0,0,0|2,0,0]=4 9408 B13R1.147 CC(=O)N[C@H](C)c1cccc(F)c1 Amb27455854 [0,2,0,0,0,0|2,0,0]=4 9409 B13R1.147 CC(=O)OC(C)c1cccc(Br)c1 Amb28206969 [0,2,0,0,0,0|2,0,0]=4 9410 B13R1.147 CC(=O)O[C@H](C)c1cccc(Br)c1 Amb27982633 [0,2,0,0,0,0|2,0,0]=4 9411 B13R1.147 CC(=O)O[C@H](C)c1cccc(C)c1 Amb28065775 [0,2,0,0,0,0|2,0,0]=4 9412 B13R1.147 CC(Br)CC(C)c1cccc(Br)c1 Amb29880766 [0,2,0,0,0,0|1,0,0]=3 9413 B13R1.147 CC(Br)CC(C)c1cncc(F)c1 Amb28243767 [0,2,0,0,0,0|2,0,0]=4 9414 B13R1.147 CC(C)CC(Cl)c1cccc(Br)c1 Amb29880794 [0,2,0,0,0,0|2,0,0]=4 9415 B13R1.147 CC(C)CC(Cl)c1cccc(F)c1 Amb28123905 [0,2,0,0,0,0|2,0,0]=4 9416 B13R1.147 CC(C)CC(N)c1cccc(Cl)c1 Amb17236707 [0,2,0,0,0,0|2,0,0]=4 9417 B13R1.147 CC(C)CC(N)c1cccc(Cl)c1 Amb28994523 [0,2,0,0,0,0|2,0,0]=4 9418 B13R1.147 CC(C)CC(N)c1cccc(F)c1 Amb17233842 [0,2,0,0,0,0|2,0,0]=4 9419 B13R1.147 CC(C)CC(N)c1cccc(F)c1 Amb30982555 [0,2,0,0,0,0|2,0,0]=4 9420 B13R1.147 CC(C)CC(O)c1cccc(Br)c1 Amb17256425 [0,2,0,0,0,0|2,0,0]=4 9421 B13R1.147 CC(C)CC(O)c1cccc(Cl)c1 Amb17236853 [0,2,0,0,0,0|2,0,0]=4 9422 B13R1.147 CC(C)CC(O)c1cccc(F)c1 Amb17233923 [0,2,0,0,0,0|2,0,0]=4 9423 B13R1.147 CC(C)C[C@@H](N)c1cccc(O)c1 Amb27195450 [0,2,0,0,0,0|2,0,0]=4 9424 B13R1.147 CC(C)C[C@@H](O)c1cccc(Cl)c1 Amb28206211 [0,2,0,0,0,0|2,0,0]=4 9425 B13R1.147 CC(C)C[C@H](N)c1cccc(Cl)c1 Amb27467811 [0,2,0,0,0,0|2,0,0]=4 9426 B13R1.147 CC(C)NC(C)c1cccc(Br)c1 Amb6685422 [0,2,0,0,0,0|2,0,0]=4 9427 B13R1.147 CC(C)NC(C)c1cccc(Cl)c1 Amb6685526 [0,2,0,0,0,0|2,0,0]=4 9428 B13R1.147 CC(C)NC(C)c1cccc(F)c1 Amb6685532 [0,2,0,0,0,0|2,0,0]=4 9429 B13R1.147 CC(C)N[C@@H](C)c1cccc(Br)c1 Amb27608969 [0,2,0,0,0,0|2,0,0]=4 9430 B13R1.147 CC(C)N[C@@H](C)c1cccc(F)c1 Amb27761049 [0,2,0,0,0,0|2,0,0]=4 9431 B13R1.147 CC(CC(=O)O)c1cccc(Br)c1 Amb10844377 [0,2,0,0,0,0|2,0,0]=4 9432 B13R1.147 CC(CC(=O)O)c1cccc(Cl)c1 Amb17236836 [0,2,0,0,0,0|2,0,0]=4 9433 B13R1.147 CC(CC(=O)O)c1cccc(F)c1 Amb6749201 [0,2,0,0,0,0|2,0,0]=4 9434 B13R1.147 CC(CC(=O)O)c1cccc(N)c1 Amb27751686 [0,2,0,0,0,0|2,0,0]=4 9435 B13R1.147 CC(CC(=O)O)c1cccc(O)c1 Amb18128622 [0,2,0,0,0,0|2,0,0]=4 9436 B13R1.147 CC(CC(N)=O)c1cccc(Cl)c1 Amb17236669 [0,2,0,0,0,0|2,0,0]=4 9437 B13R1.147 CC(CC(N)=O)c1cccc(F)c1 Amb17233790 [0,2,0,0,0,0|2,0,0]=4 9438 B13R1.147 CC(Cl)CC(C)c1cccc(Br)c1 Amb29880765 [0,2,0,0,0,0|1,0,0]=3 9439 B13R1.147 CC(Cl)CC(C)c1cccc(F)c1 Amb28243716 [0,2,0,0,0,0|1,0,0]=3 9440 B13R1.147 CC(Cl)CC(C)c1cncc(F)c1 Amb27826808 [0,2,0,0,0,0|2,0,0]=4 9441 B13R1.147 CC(N)CC(C)c1cccc(Br)c1 Amb30028206 [0,2,0,0,0,0|1,0,0]=3 9442 B13R1.147 CC(N)CC(C)c1cccc(F)c1 Amb27397077 [0,2,0,0,0,0|1,0,0]=3 9443 B13R1.147 CC(N)CC(C)c1cncc(F)c1 Amb27829915 [0,2,0,0,0,0|2,0,0]=4 9444 B13R1.147 CC(N)CC(O)c1cccc(Cl)c1 Amb27750606 [0,2,0,0,0,0|2,0,0]=4 9445 B13R1.147 CC(N)CN(C)c1cccc(Br)c1 Amb25854978 [0,2,0,0,0,0|2,0,0]=4 9446 B13R1.147 CC(N)CN(C)c1cccc(Br)c1 Amb27425716 [0,2,0,0,0,0|2,0,0]=4 9447 B13R1.147 CC(N)CN(C)c1cccc(Cl)c1 Amb17059704 [0,2,0,0,0,0|2,0,0]=4 9448 B13R1.147 CC(N)CN(C)c1cccc(F)c1 Amb17059701 [0,2,0,0,0,0|2,0,0]=4 9449 B13R1.147 CC(NN(C)C)c1cccc(F)c1 Amb28314998 [0,2,0,0,0,0|1,0,0]=3 9450 B13R1.147 CC(NN(C)C)c1cccc(O)c1 Amb28059426 [0,2,0,0,0,0|1,0,0]=3 9451 B13R1.147 CC(NN(C)C)c1cncc(Br)c1 Amb35702509 [0,2,0,0,0,0|2,0,0]=4 9452 B13R1.147 CC(NN(C)C)c1cncc(F)c1 Amb27979787 [0,2,0,0,0,0|2,0,0]=4 9453 B13R1.147 CC(O)CC(C)c1cccc(Br)c1 Amb35626031 [0,2,0,0,0,0|1,0,0]=3 9454 B13R1.147 CC(O)CN(C)c1cccc(Br)c1 Amb17349693 [0,2,0,0,0,0|2,0,0]=4 9455 B13R1.147 CC(O)CN(C)c1cccc(Cl)c1 Amb17337503 [0,2,0,0,0,0|2,0,0]=4 9456 B13R1.147 CC(O)CN(C)c1cccc(F)c1 Amb17335630 [0,2,0,0,0,0|2,0,0]=4 9457 B13R1.147 CC(O)CN(C)c1cccc(N)c1 Amb18296386 [0,2,0,0,0,0|2,0,0]=4 9458 B13R1.147 CC(O)CN(C)c1cccc(O)c1 Amb28207024 [0,2,0,0,0,0|2,0,0]=4 9459 B13R1.147 CN(C)CC(=O)c1cccc(N)c1 Amb17090521 [0,2,0,0,0,0|1,0,1]=4 9460 B13R1.147 CN(C)CC(N)c1cccc(Br)c1 Amb27163293 [0,2,0,0,0,0|1,0,0]=3 9461 B13R1.147 CN(C)CC(N)c1cccc(F)c1 Amb6661467 [0,2,0,0,0,0|1,0,0]=3 9462 B13R1.147 CN(C)CC(O)c1cccc(Br)c1 Amb17104306 [0,2,0,0,0,0|1,0,0]=3 9463 B13R1.147 CN(C)CC(O)c1cccc(Cl)c1 Amb17104291 [0,2,0,0,0,0|1,0,0]=3 9464 B13R1.147 CN(C)CC(O)c1cccc(N)c1 Amb17090543 [0,2,0,0,0,0|1,0,0]=3 9465 B13R1.147 CN(C)CC(O)c1cccc(O)c1 Amb17307593 [0,2,0,0,0,0|1,0,0]=3 9466 B13R1.147 CN(C)CC(O)c1cncc(F)c1 Amb27397224 [0,2,0,0,0,0|2,0,0]=4 9467 B13R1.147 C[C@@H](O)CN(C)c1cccc(F)c1 Amb27241924 [0,2,0,0,0,0|2,0,0]=4 9468 B13R1.147 C\C(=N\N(C)C)c1cccc(Cl)c1 Amb28185619 [0,2,0,0,0,0|1,0,1]=4 9469 B13R1.147 C\C(=N\N(C)C)c1cccc(F)c1 Amb28284055 [0,2,0,0,0,0|1,0,1]=4 9470 B13R1.147 Cc1cccc(C(C)CC(=O)O)c1 Amb17233412 [0,2,0,0,0,0|2,0,0]=4 9471 B13R1.147 Cc1cccc(C(C)CC(C)Br)c1 Amb27760947 [0,2,0,0,0,0|1,0,0]=3 9472 B13R1.147 Cc1cccc(C(C)CC(N)=O)c1 Amb17233288 [0,2,0,0,0,0|2,0,0]=4 9473 B13R1.147 Cc1cccc(C(C)NN(C)C)c1 Amb27244648 [0,2,0,0,0,0|1,0,0]=3 9474 B13R1.147 Cc1cccc(C(C)SC(C)C)c1 Amb27588863 [0,2,0,0,0,0|2,0,0]=4 9475 B13R1.147 Cc1cccc(C(N)CC(C)C)c1 Amb17233362 [0,2,0,0,0,0|2,0,0]=4 9476 B13R1.147 Cc1cccc(C(N)CC(C)C)c1 Amb32662183 [0,2,0,0,0,0|2,0,0]=4 9477 B13R1.147 Cc1cccc(C(N)CN(C)C)c1 Amb18975548 [0,2,0,0,0,0|1,0,0]=3 9478 B13R1.147 Cc1cccc(C(O)CC(C)C)c1 Amb17233448 [0,2,0,0,0,0|2,0,0]=4 9479 B13R1.147 Cc1cccc(C(O)CC(C)N)c1 Amb27409716 [0,2,0,0,0,0|2,0,0]=4 9480 B13R1.147 Cc1cccc(C(O)CN(C)C)c1 Amb17104283 [0,2,0,0,0,0|1,0,0]=3 9481 B13R1.147 Cc1cccc(N(C)CC(C)N)c1 Amb17059698 [0,2,0,0,0,0|2,0,0]=4 9482 B13R1.147 Cc1cccc(N(C)CC(C)O)c1 Amb17335359 [0,2,0,0,0,0|2,0,0]=4 9483 B13R1.147 Cc1cccc(N(C)C[C@@H](C)O)c1 Amb27454392 [0,2,0,0,0,0|2,0,0]=4 9484 B13R1.147 Cc1cccc([C@H](N)CC(C)C)c1 Amb28422787 [0,2,0,0,0,0|2,0,0]=4 9485 B13R1.147 Cc1cncc(C(C)CC(C)Br)c1 Amb28341955 [0,2,0,0,0,0|2,0,0]=4 9486 B13R1.147 Cc1cncc(C(C)CC(C)Cl)c1 Amb27193765 [0,2,0,0,0,0|2,0,0]=4 9487 B13R1.147 Cc1cncc(C(C)CC(C)N)c1 Amb27817594 [0,2,0,0,0,0|2,0,0]=4 9488 B13R1.446 CC(CC#N)c1cc(Cl)ccc1Cl Amb24449978 [0,2,0,0,0,0|2,0,0]=4 9489 B13R1.446 CC(CCN)c1cc(Br)ccc1Cl Amb33450950 [0,2,0,0,0,0|2,0,0]=4 9490 B13R1.446 CC(CCN)c1cc(Br)ccc1F Amb25090197 [0,2,0,0,0,0|2,0,0]=4 9491 B13R1.446 CC(CCN)c1cc(Br)ccc1O Amb33333194 [0,2,0,0,0,0|2,0,0]=4 9492 B13R1.446 CC(CCN)c1cc(Cl)ccc1Br Amb33450947 [0,2,0,0,0,0|2,0,0]=4 9493 B13R1.446 CC(CCN)c1cc(Cl)ccc1Cl Amb26019288 [0,2,0,0,0,0|2,0,0]=4 9494 B13R1.446 CC(CCN)c1cc(Cl)ccc1F Amb18894779 [0,2,0,0,0,0|2,0,0]=4 9495 B13R1.446 CC(CCN)c1cc(Cl)ccc1O Amb33052462 [0,2,0,0,0,0|2,0,0]=4 9496 B13R1.446 CC(CCN)c1cc(F)ccc1Br Amb33008289 [0,2,0,0,0,0|2,0,0]=4 9497 B13R1.446 CC(CCN)c1cc(F)ccc1Cl Amb24471865 [0,2,0,0,0,0|2,0,0]=4 9498 B13R1.446 CC(CCN)c1cc(F)ccc1F Amb18981391 [0,2,0,0,0,0|2,0,0]=4 9499 B13R1.446 CC(CCN)c1cc(F)ccc1O Amb33380305 [0,2,0,0,0,0|2,0,0]=4 9500 B13R1.446 CC(CCN)c1cc(O)ccc1Br Amb33478656 [0,2,0,0,0,0|2,0,0]=4 9501 B13R1.446 CC(CCN)c1cc(O)ccc1O Amb33269246 [0,2,0,0,0,0|2,0,0]=4 9502 B13R1.446 CC(CON)c1cc(Br)ccc1Cl Amb33450486 [0,2,0,0,0,0|2,0,0]=4 9503 B13R1.446 CC(CON)c1cc(Br)ccc1F Amb33478742 [0,2,0,0,0,0|2,0,0]=4 9504 B13R1.446 CC(CON)c1cc(Br)ccc1O Amb33333255 [0,2,0,0,0,0|2,0,0]=4 9505 B13R1.446 CC(CON)c1cc(Cl)ccc1Br Amb33477938 [0,2,0,0,0,0|2,0,0]=4 9506 B13R1.446 CC(CON)c1cc(Cl)ccc1O Amb33484782 [0,2,0,0,0,0|2,0,0]=4 9507 B13R1.446 CC(CON)c1cc(F)ccc1Br Amb33008583 [0,2,0,0,0,0|2,0,0]=4 9508 B13R1.446 CC(CON)c1cc(F)ccc1F Amb32873965 [0,2,0,0,0,0|2,0,0]=4 9509 B13R1.446 CC(CON)c1cc(F)ccc1O Amb33379924 [0,2,0,0,0,0|2,0,0]=4 9510 B13R1.446 CC(CON)c1cc(O)ccc1Br Amb33450377 [0,2,0,0,0,0|2,0,0]=4 9511 B13R1.446 CC(CON)c1cc(O)ccc1O Amb33268912 [0,2,0,0,0,0|2,0,0]=4 9512 B13R1.446 CCCC(Br)c1cc(C)ccc1C Amb28455436 [0,2,0,0,0,0|2,0,0]=4 9513 B13R1.446 CCCC(Br)c1cc(Cl)ccc1Cl Amb28455437 [0,2,0,0,0,0|2,0,0]=4 9514 B13R1.446 CCCC(Br)c1cc(F)ccc1F Amb27756669 [0,2,0,0,0,0|2,0,0]=4 9515 B13R1.446 CCCC(C)N1C=C(N)C=CC1=O Amb32699281 [0,2,0,0,0,0|2,0,0]=4 9516 B13R1.446 CCCC(C)c1cc(C)cnc1N Amb27447986 [0,2,0,0,0,0|2,0,0]=4 9517 B13R1.446 CCCC(Cl)c1cc(C)ccc1C Amb17139644 [0,2,0,0,0,0|2,0,0]=4 9518 B13R1.446 CCCC(Cl)c1cc(Cl)ccc1Cl Amb27598807 [0,2,0,0,0,0|2,0,0]=4 9519 B13R1.446 CCCC(Cl)c1cc(F)ccc1Cl Amb27760059 [0,2,0,0,0,0|2,0,0]=4 9520 B13R1.446 CCCC(N)c1cc(Br)ccc1F Amb18940359 [0,2,0,0,0,0|2,0,0]=4 9521 B13R1.446 CCCC(N)c1cc(Br)ccc1N Amb27665648 [0,2,0,0,0,0|2,0,0]=4 9522 B13R1.446 CCCC(N)c1cc(Br)ccc1O Amb27950671 [0,2,0,0,0,0|2,0,0]=4 9523 B13R1.446 CCCC(N)c1cc(C)ccc1Br Amb27460213 [0,2,0,0,0,0|2,0,0]=4 9524 B13R1.446 CCCC(N)c1cc(C)ccc1C Amb6705101 [0,2,0,0,0,0|2,0,0]=4 9525 B13R1.446 CCCC(N)c1cc(C)ccc1O Amb18940456 [0,2,0,0,0,0|2,0,0]=4 9526 B13R1.446 CCCC(N)c1cc(Cl)ccc1Br Amb28323247 [0,2,0,0,0,0|2,0,0]=4 9527 B13R1.446 CCCC(N)c1cc(Cl)ccc1O Amb18275472 [0,2,0,0,0,0|2,0,0]=4 9528 B13R1.446 CCCC(N)c1cc(F)ccc1Br Amb28196343 [0,2,0,0,0,0|2,0,0]=4 9529 B13R1.446 CCCC(N)c1cc(F)ccc1Cl Amb27808257 [0,2,0,0,0,0|2,0,0]=4 9530 B13R1.446 CCCC(N)c1cc(F)ccc1F Amb9746336 [0,2,0,0,0,0|2,0,0]=4 9531 B13R1.446 CCCC(N)c1cc(F)ccc1N Amb27168622 [0,2,0,0,0,0|2,0,0]=4 9532 B13R1.446 CCCC(N)c1cc(F)ccc1O Amb18941520 [0,2,0,0,0,0|2,0,0]=4 9533 B13R1.446 CCCC(N)c1cc(I)ccc1I Amb28120665 [0,2,0,0,0,0|2,0,0]=4 9534 B13R1.446 CCCC(N)c1cc(I)ccc1O Amb27644649 [0,2,0,0,0,0|2,0,0]=4 9535 B13R1.446 CCCC(N)c1cc(N)ccc1Cl Amb27173411 [0,2,0,0,0,0|2,0,0]=4 9536 B13R1.446 CCCC(N)c1cc(O)ccc1Cl Amb27465561 [0,2,0,0,0,0|2,0,0]=4 9537 B13R1.446 CCCC(N)c1cc(O)ccc1N Amb28317760 [0,2,0,0,0,0|2,0,0]=4 9538 B13R1.446 CCCC(N)c1cc(O)ccc1O Amb27445026 [0,2,0,0,0,0|2,0,0]=4 9539 B13R1.446 CCCC(O)c1cc(C)ccc1C Amb17138885 [0,2,0,0,0,0|2,0,0]=4 9540 B13R1.446 CCCC(O)c1cc(C)ccc1Cl Amb28121275 [0,2,0,0,0,0|2,0,0]=4 9541 B13R1.446 CCCC(O)c1cc(C)ccc1F Amb18805552 [0,2,0,0,0,0|2,0,0]=4 9542 B13R1.446 CCCC(O)c1cc(C)ccc1N Amb35583088 [0,2,0,0,0,0|2,0,0]=4 9543 B13R1.446 CCCC(O)c1cc(Cl)ccc1Br Amb27606589 [0,2,0,0,0,0|2,0,0]=4 9544 B13R1.446 CCCC(O)c1cc(Cl)ccc1C Amb27609575 [0,2,0,0,0,0|2,0,0]=4 9545 B13R1.446 CCCC(O)c1cc(Cl)ccc1Cl Amb27395019 [0,2,0,0,0,0|2,0,0]=4 9546 B13R1.446 CCCC(O)c1cc(Cl)ccc1N Amb29875755 [0,2,0,0,0,0|2,0,0]=4 9547 B13R1.446 CCCC(O)c1cc(F)ccc1C Amb18185536 [0,2,0,0,0,0|2,0,0]=4 9548 B13R1.446 CCCC(O)c1cc(F)ccc1F Amb17194583 [0,2,0,0,0,0|2,0,0]=4 9549 B13R1.446 CCCC(O)c1cc(N)ccc1Br Amb29884670 [0,2,0,0,0,0|2,0,0]=4 9550 B13R1.446 CCCC(O)c1cc(N)ccc1F Amb35622289 [0,2,0,0,0,0|2,0,0]=4 9551 B13R1.446 CCCN(C)c1cc(C)ccc1N Amb27772065 [0,2,0,0,0,0|2,0,0]=4 9552 B13R1.446 CCC[C@@H](N)c1cc(Br)ccc1C Amb27950117 [0,2,0,0,0,0|2,0,0]=4 9553 B13R1.446 CCC[C@@H](N)c1cc(Br)ccc1Cl Amb27441127 [0,2,0,0,0,0|2,0,0]=4 9554 B13R1.446 CCC[C@@H](N)c1cc(C)ccc1C Amb28346828 [0,2,0,0,0,0|2,0,0]=4 9555 B13R1.446 CCC[C@@H](N)c1cc(C)ccc1F Amb27468607 [0,2,0,0,0,0|2,0,0]=4 9556 B13R1.446 CCC[C@@H](N)c1cc(Cl)ccc1I Amb27465517 [0,2,0,0,0,0|2,0,0]=4 9557 B13R1.446 CCC[C@@H](N)c1cc(F)ccc1I Amb27606485 [0,2,0,0,0,0|2,0,0]=4 9558 B13R1.446 CCC[C@@H](N)c1cc(I)ccc1O Amb27226000 [0,2,0,0,0,0|2,0,0]=4 9559 B13R1.446 CCC[C@@H](N)c1cc(N)ccc1Cl Amb27426693 [0,2,0,0,0,0|2,0,0]=4 9560 B13R1.446 CCC[C@@H](N)c1cc(O)ccc1Br Amb27868264 [0,2,0,0,0,0|2,0,0]=4 9561 B13R1.446 CCC[C@@H](N)c1cc(O)ccc1F Amb27488684 [0,2,0,0,0,0|2,0,0]=4 9562 B13R1.446 CCC[C@@H](O)c1cc(Br)ccc1C Amb28065140 [0,2,0,0,0,0|2,0,0]=4 9563 B13R1.446 CCC[C@@H](O)c1cc(C)ccc1C Amb28243753 [0,2,0,0,0,0|2,0,0]=4 9564 B13R1.446 CCC[C@@H](O)c1cc(Cl)ccc1F Amb27393944 [0,2,0,0,0,0|2,0,0]=4 9565 B13R1.446 CCC[C@@H](O)c1cc(F)ccc1F Amb28368046 [0,2,0,0,0,0|2,0,0]=4 9566 B13R1.446 CCC[C@H](N)c1cc(Br)ccc1Br Amb28058383 [0,2,0,0,0,0|2,0,0]=4 9567 B13R1.446 CCC[C@H](N)c1cc(Br)ccc1C Amb28323157 [0,2,0,0,0,0|2,0,0]=4 9568 B13R1.446 CCC[C@H](N)c1cc(Br)ccc1O Amb27618202 [0,2,0,0,0,0|2,0,0]=4 9569 B13R1.446 CCC[C@H](N)c1cc(C)ccc1O Amb27647135 [0,2,0,0,0,0|2,0,0]=4 9570 B13R1.446 CCC[C@H](N)c1cc(Cl)ccc1I Amb27608314 [0,2,0,0,0,0|2,0,0]=4 9571 B13R1.446 CCC[C@H](N)c1cc(Cl)ccc1N Amb27668890 [0,2,0,0,0,0|2,0,0]=4 9572 B13R1.446 CCC[C@H](N)c1cc(F)ccc1Cl Amb27258802 [0,2,0,0,0,0|2,0,0]=4 9573 B13R1.446 CCC[C@H](N)c1cc(F)ccc1F Amb27640258 [0,2,0,0,0,0|2,0,0]=4 9574 B13R1.446 CCC[C@H](N)c1cc(I)ccc1Br Amb27412419 [0,2,0,0,0,0|2,0,0]=4 9575 B13R1.446 CCC[C@H](N)c1cc(I)ccc1N Amb27748651 [0,2,0,0,0,0|2,0,0]=4 9576 B13R1.446 CCC[C@H](N)c1cc(N)ccc1F Amb27860237 [0,2,0,0,0,0|2,0,0]=4 9577 B13R1.446 CCC[C@H](N)c1cc(O)ccc1C Amb27831978 [0,2,0,0,0,0|2,0,0]=4 9578 B13R1.446 CCC[C@H](N)c1cc(O)ccc1O Amb28457276 [0,2,0,0,0,0|2,0,0]=4 9579 B13R1.446 CCC[C@H](O)c1cc(Br)ccc1C Amb27196845 [0,2,0,0,0,0|2,0,0]=4 9580 B13R1.446 CCC[C@H](O)c1cc(C)ccc1C Amb28243754 [0,2,0,0,0,0|2,0,0]=4 9581 B13R1.446 CCC[C@H](O)c1cc(C)ccc1F Amb27595821 [0,2,0,0,0,0|2,0,0]=4 9582 B13R1.446 CCC[C@H](O)c1cc(F)ccc1C Amb27975536 [0,2,0,0,0,0|2,0,0]=4 9583 B13R1.446 CCNC(C)c1cc(Br)ccc1Br Amb9349682 [0,2,0,0,0,0|2,0,0]=4 9584 B13R1.446 CCNC(C)c1cc(Br)ccc1F Amb27453113 [0,2,0,0,0,0|2,0,0]=4 9585 B13R1.446 CCNC(C)c1cc(Br)ccc1O Amb18297285 [0,2,0,0,0,0|2,0,0]=4 9586 B13R1.446 CCNC(C)c1cc(C)ccc1O Amb9365007 [0,2,0,0,0,0|2,0,0]=4 9587 B13R1.446 CCNC(C)c1cc(Cl)ccc1F Amb27647837 [0,2,0,0,0,0|2,0,0]=4 9588 B13R1.446 CCNC(C)c1cc(Cl)ccc1O Amb18294996 [0,2,0,0,0,0|2,0,0]=4 9589 B13R1.446 CCNC(C)c1cc(F)ccc1Br Amb28119411 [0,2,0,0,0,0|2,0,0]=4 9590 B13R1.446 CCN[C@@H](C)c1cc(C)ccc1C Amb27804710 [0,2,0,0,0,0|2,0,0]=4 9591 B13R1.446 CNCC(=O)c1cc(Br)ccc1C Amb27147599 [0,2,0,0,0,0|1,0,1]=4 9592 B13R1.446 CNCC(=O)c1cc(Br)ccc1Cl Amb25936939 [0,2,0,0,0,0|1,0,1]=4 9593 B13R1.446 CNCC(=O)c1cc(Br)ccc1F Amb25153485 [0,2,0,0,0,0|1,0,1]=4 9594 B13R1.446 CNCC(=O)c1cc(Br)ccc1O Amb33333206 [0,2,0,0,0,0|1,0,1]=4 9595 B13R1.446 CNCC(=O)c1cc(C)ccc1Br Amb26607203 [0,2,0,0,0,0|1,0,1]=4 9596 B13R1.446 CNCC(=O)c1cc(C)ccc1C Amb17233279 [0,2,0,0,0,0|1,0,1]=4 9597 B13R1.446 CNCC(=O)c1cc(C)ccc1Cl Amb27840874 [0,2,0,0,0,0|1,0,1]=4 9598 B13R1.446 CNCC(=O)c1cc(C)ccc1F Amb28423075 [0,2,0,0,0,0|1,0,1]=4 9599 B13R1.446 CNCC(=O)c1cc(C)ccc1O Amb27607699 [0,2,0,0,0,0|1,0,1]=4 9600 B13R1.446 CNCC(=O)c1cc(Cl)ccc1Br Amb27808526 [0,2,0,0,0,0|1,0,1]=4 9601 B13R1.446 CNCC(=O)c1cc(Cl)ccc1C Amb18864129 [0,2,0,0,0,0|1,0,1]=4 9602 B13R1.446 CNCC(=O)c1cc(Cl)ccc1Cl Amb18225699 [0,2,0,0,0,0|1,0,1]=4 9603 B13R1.446 CNCC(=O)c1cc(Cl)ccc1F Amb18894775 [0,2,0,0,0,0|1,0,1]=4 9604 B13R1.446 CNCC(=O)c1cc(Cl)ccc1O Amb33052474 [0,2,0,0,0,0|1,0,1]=4 9605 B13R1.446 CNCC(=O)c1cc(F)ccc1Br Amb25191402 [0,2,0,0,0,0|1,0,1]=4 9606 B13R1.446 CNCC(=O)c1cc(F)ccc1C Amb25820145 [0,2,0,0,0,0|1,0,1]=4 9607 B13R1.446 CNCC(=O)c1cc(F)ccc1Cl Amb27639643 [0,2,0,0,0,0|1,0,1]=4 9608 B13R1.446 CNCC(=O)c1cc(F)ccc1F Amb17335731 [0,2,0,0,0,0|1,0,1]=4 9609 B13R1.446 CNCC(=O)c1cc(F)ccc1O Amb26611607 [0,2,0,0,0,0|1,0,1]=4 9610 B13R1.446 CNCC(=O)c1cc(O)ccc1Br Amb27762933 [0,2,0,0,0,0|1,0,1]=4 9611 B13R1.446 CNCC(=O)c1cc(O)ccc1C Amb26502184 [0,2,0,0,0,0|1,0,1]=4 9612 B13R1.446 CNCC(=O)c1cc(O)ccc1Cl Amb26026154 [0,2,0,0,0,0|1,0,1]=4 9613 B13R1.446 CNCC(=O)c1cc(O)ccc1F Amb26478016 [0,2,0,0,0,0|1,0,1]=4 9614 B13R1.446 CNCC(=O)c1cc(O)ccc1O Amb28187132 [0,2,0,0,0,0|1,0,1]=4 9615 B13R1.446 CNCC(C)c1cc(Br)ccc1C Amb27610342 [0,2,0,0,0,0|0,0,0]=2 9616 B13R1.446 CNCC(C)c1cc(Br)ccc1Cl Amb26502269 [0,2,0,0,0,0|0,0,0]=2 9617 B13R1.446 CNCC(C)c1cc(Br)ccc1F Amb25357943 [0,2,0,0,0,0|0,0,0]=2 9618 B13R1.446 CNCC(C)c1cc(Br)ccc1O Amb27666848 [0,2,0,0,0,0|0,0,0]=2 9619 B13R1.446 CNCC(C)c1cc(C)ccc1Br Amb27495572 [0,2,0,0,0,0|0,0,0]=2 9620 B13R1.446 CNCC(C)c1cc(C)ccc1C Amb17233343 [0,2,0,0,0,0|0,0,0]=2 9621 B13R1.446 CNCC(C)c1cc(C)ccc1Cl Amb25781805 [0,2,0,0,0,0|0,0,0]=2 9622 B13R1.446 CNCC(C)c1cc(C)ccc1F Amb25177554 [0,2,0,0,0,0|0,0,0]=2 9623 B13R1.446 CNCC(C)c1cc(C)ccc1O Amb25121987 [0,2,0,0,0,0|0,0,0]=2 9624 B13R1.446 CNCC(C)c1cc(Cl)ccc1Br Amb26055669 [0,2,0,0,0,0|0,0,0]=2 9625 B13R1.446 CNCC(C)c1cc(Cl)ccc1C Amb24533700 [0,2,0,0,0,0|0,0,0]=2 9626 B13R1.446 CNCC(C)c1cc(Cl)ccc1Cl Amb26510359 [0,2,0,0,0,0|0,0,0]=2 9627 B13R1.446 CNCC(C)c1cc(Cl)ccc1F Amb18244125 [0,2,0,0,0,0|0,0,0]=2 9628 B13R1.446 CNCC(C)c1cc(Cl)ccc1O Amb28044072 [0,2,0,0,0,0|0,0,0]=2 9629 B13R1.446 CNCC(C)c1cc(F)ccc1Br Amb27270873 [0,2,0,0,0,0|0,0,0]=2 9630 B13R1.446 CNCC(C)c1cc(F)ccc1C Amb26876595 [0,2,0,0,0,0|0,0,0]=2 9631 B13R1.446 CNCC(C)c1cc(F)ccc1Cl Amb25802013 [0,2,0,0,0,0|0,0,0]=2 9632 B13R1.446 CNCC(C)c1cc(F)ccc1F Amb18243849 [0,2,0,0,0,0|0,0,0]=2 9633 B13R1.446 CNCC(C)c1cc(F)ccc1O Amb25079100 [0,2,0,0,0,0|0,0,0]=2 9634 B13R1.446 CNCC(C)c1cc(O)ccc1Br Amb25341505 [0,2,0,0,0,0|0,0,0]=2 9635 B13R1.446 CNCC(C)c1cc(O)ccc1C Amb27219435 [0,2,0,0,0,0|0,0,0]=2 9636 B13R1.446 CNCC(C)c1cc(O)ccc1Cl Amb24361969 [0,2,0,0,0,0|0,0,0]=2 9637 B13R1.446 CNCC(C)c1cc(O)ccc1F Amb25119955 [0,2,0,0,0,0|0,0,0]=2 9638 B13R1.446 CNCC(O)c1cc(Br)ccc1C Amb25135385 [0,2,0,0,0,0|1,0,0]=3 9639 B13R1.446 CNCC(O)c1cc(Br)ccc1Cl Amb26860063 [0,2,0,0,0,0|1,0,0]=3 9640 B13R1.446 CNCC(O)c1cc(Br)ccc1F Amb18997464 [0,2,0,0,0,0|1,0,0]=3 9641 B13R1.446 CNCC(O)c1cc(Br)ccc1O Amb33333203 [0,2,0,0,0,0|1,0,0]=3 9642 B13R1.446 CNCC(O)c1cc(Br)cnc1Cl Amb33009439 [0,2,0,0,0,0|2,0,0]=4 9643 B13R1.446 CNCC(O)c1cc(Br)cnc1F Amb33477704 [0,2,0,0,0,0|2,0,0]=4 9644 B13R1.446 CNCC(O)c1cc(C)ccc1Br Amb26647498 [0,2,0,0,0,0|1,0,0]=3 9645 B13R1.446 CNCC(O)c1cc(C)ccc1C Amb17233589 [0,2,0,0,0,0|1,0,0]=3 9646 B13R1.446 CNCC(O)c1cc(C)ccc1Cl Amb24450049 [0,2,0,0,0,0|1,0,0]=3 9647 B13R1.446 CNCC(O)c1cc(C)ccc1F Amb24583855 [0,2,0,0,0,0|1,0,0]=3 9648 B13R1.446 CNCC(O)c1cc(C)ccc1O Amb27415816 [0,2,0,0,0,0|1,0,0]=3 9649 B13R1.446 CNCC(O)c1cc(Cl)ccc1Br Amb28289758 [0,2,0,0,0,0|1,0,0]=3 9650 B13R1.446 CNCC(O)c1cc(Cl)ccc1C Amb28316732 [0,2,0,0,0,0|1,0,0]=3 9651 B13R1.446 CNCC(O)c1cc(Cl)ccc1Cl Amb18289716 [0,2,0,0,0,0|1,0,0]=3 9652 B13R1.446 CNCC(O)c1cc(Cl)ccc1F Amb18244129 [0,2,0,0,0,0|1,0,0]=3 9653 B13R1.446 CNCC(O)c1cc(Cl)ccc1O Amb33052470 [0,2,0,0,0,0|1,0,0]=3 9654 B13R1.446 CNCC(O)c1cc(Cl)cnc1F Amb33257194 [0,2,0,0,0,0|2,0,0]=4 9655 B13R1.446 CNCC(O)c1cc(Cl)ncc1Br Amb33477814 [0,2,0,0,0,0|2,0,0]=4 9656 B13R1.446 CNCC(O)c1cc(F)ccc1Br Amb24715440 [0,2,0,0,0,0|1,0,0]=3 9657 B13R1.446 CNCC(O)c1cc(F)ccc1C Amb26068182 [0,2,0,0,0,0|1,0,0]=3 9658 B13R1.446 CNCC(O)c1cc(F)ccc1Cl Amb26604986 [0,2,0,0,0,0|1,0,0]=3 9659 B13R1.446 CNCC(O)c1cc(F)ccc1F Amb17335897 [0,2,0,0,0,0|1,0,0]=3 9660 B13R1.446 CNCC(O)c1cc(F)ccc1O Amb33380303 [0,2,0,0,0,0|1,0,0]=3 9661 B13R1.446 CNCC(O)c1cc(O)ccc1Br Amb25720409 [0,2,0,0,0,0|1,0,0]=3 9662 B13R1.446 CNCC(O)c1cc(O)ccc1C Amb25204267 [0,2,0,0,0,0|1,0,0]=3 9663 B13R1.446 CNCC(O)c1cc(O)ccc1Cl Amb28429764 [0,2,0,0,0,0|1,0,0]=3 9664 B13R1.446 CNCC(O)c1cc(O)ccc1Cl Amb32655880 [0,2,0,0,0,0|1,0,0]=3 9665 B13R1.446 CNCC(O)c1cc(O)ccc1O Amb33269244 [0,2,0,0,0,0|1,0,0]=3 9666 B13R1.446 CN\N=C(\C)c1cc(Cl)ccc1Cl Amb27750644 [0,2,0,0,0,0|1,0,1]=4 9667 B13R1.446 CN\N=C(\C)c1cc(O)ccc1O Amb27762286 [0,2,0,0,0,0|1,0,1]=4 9668 B13R1.446 COCC(C)N1C=C(N)C=CC1=O Amb32699323 [0,2,0,0,0,0|2,0,0]=4 9669 B13R1.446 COCC(N)c1cc(Br)ccc1Br Amb28066207 [0,2,0,0,0,0|2,0,0]=4 9670 B13R1.446 COCC(N)c1cc(Br)ccc1C Amb27156675 [0,2,0,0,0,0|2,0,0]=4 9671 B13R1.446 COCC(N)c1cc(Br)ccc1Cl Amb27167729 [0,2,0,0,0,0|2,0,0]=4 9672 B13R1.446 COCC(N)c1cc(Br)ccc1F Amb25858707 [0,2,0,0,0,0|2,0,0]=4 9673 B13R1.446 COCC(N)c1cc(C)ccc1I Amb27273488 [0,2,0,0,0,0|2,0,0]=4 9674 B13R1.446 COCC(N)c1cc(C)ccc1O Amb27461468 [0,2,0,0,0,0|2,0,0]=4 9675 B13R1.446 COCC(N)c1cc(Cl)ccc1F Amb24741694 [0,2,0,0,0,0|2,0,0]=4 9676 B13R1.446 COCC(N)c1cc(Cl)ccc1I Amb28204536 [0,2,0,0,0,0|2,0,0]=4 9677 B13R1.446 COCC(N)c1cc(Cl)ccc1N Amb27239836 [0,2,0,0,0,0|2,0,0]=4 9678 B13R1.446 COCC(N)c1cc(F)ccc1F Amb10610140 [0,2,0,0,0,0|2,0,0]=4 9679 B13R1.446 COCC(N)c1cc(F)ccc1F Amb1131932 [0,2,0,0,0,0|2,0,0]=4 9680 B13R1.446 COCC(N)c1cc(F)ccc1N Amb28314237 [0,2,0,0,0,0|2,0,0]=4 9681 B13R1.446 COCC(N)c1cc(F)ccc1O Amb27413863 [0,2,0,0,0,0|2,0,0]=4 9682 B13R1.446 COCC(N)c1cc(I)ccc1Br Amb28187983 [0,2,0,0,0,0|2,0,0]=4 9683 B13R1.446 COCC(N)c1cc(I)ccc1N Amb27619712 [0,2,0,0,0,0|2,0,0]=4 9684 B13R1.446 COCC(N)c1cc(N)ccc1Cl Amb27467386 [0,2,0,0,0,0|2,0,0]=4 9685 B13R1.446 COCC(N)c1cc(N)ccc1O Amb27969165 [0,2,0,0,0,0|2,0,0]=4 9686 B13R1.446 COCC(N)c1cc(O)ccc1Br Amb27827747 [0,2,0,0,0,0|2,0,0]=4 9687 B13R1.446 COCC(N)c1cc(O)ccc1F Amb27596599 [0,2,0,0,0,0|2,0,0]=4 9688 B13R1.446 COCC(O)c1cc(Br)ccc1Br Amb28256237 [0,2,0,0,0,0|2,0,0]=4 9689 B13R1.446 COCC(O)c1cc(C)ccc1N Amb35583192 [0,2,0,0,0,0|2,0,0]=4 9690 B13R1.446 COCC(O)c1cc(Cl)ccc1N Amb29875757 [0,2,0,0,0,0|2,0,0]=4 9691 B13R1.446 COCC(O)c1cc(F)ccc1F Amb18324057 [0,2,0,0,0,0|2,0,0]=4 9692 B13R1.446 COCC(O)c1cc(N)ccc1Br Amb35740837 [0,2,0,0,0,0|2,0,0]=4 9693 B13R1.446 COCC(O)c1cc(N)ccc1F Amb35622398 [0,2,0,0,0,0|2,0,0]=4 9694 B13R1.446 COC[C@@H](N)c1cc(Br)ccc1Br Amb28280035 [0,2,0,0,0,0|2,0,0]=4 9695 B13R1.446 COC[C@@H](N)c1cc(C)ccc1I Amb27600140 [0,2,0,0,0,0|2,0,0]=4 9696 B13R1.446 COC[C@@H](N)c1cc(C)ccc1O Amb27252145 [0,2,0,0,0,0|2,0,0]=4 9697 B13R1.446 COC[C@@H](N)c1cc(Cl)ccc1Br Amb27814406 [0,2,0,0,0,0|2,0,0]=4 9698 B13R1.446 COC[C@@H](N)c1cc(Cl)ccc1O Amb27633186 [0,2,0,0,0,0|2,0,0]=4 9699 B13R1.446 COC[C@@H](N)c1cc(F)ccc1C Amb28317770 [0,2,0,0,0,0|2,0,0]=4 9700 B13R1.446 COC[C@@H](N)c1cc(F)ccc1O Amb28193525 [0,2,0,0,0,0|2,0,0]=4 9701 B13R1.446 COC[C@@H](N)c1cc(I)ccc1C Amb27807436 [0,2,0,0,0,0|2,0,0]=4 9702 B13R1.446 COC[C@@H](N)c1cc(I)ccc1N Amb27177210 [0,2,0,0,0,0|2,0,0]=4 9703 B13R1.446 COC[C@@H](N)c1cc(N)ccc1Cl Amb27224099 [0,2,0,0,0,0|2,0,0]=4 9704 B13R1.446 COC[C@@H](N)c1cc(N)ccc1F Amb27609581 [0,2,0,0,0,0|2,0,0]=4 9705 B13R1.446 COC[C@@H](N)c1cc(O)ccc1C Amb27874025 [0,2,0,0,0,0|2,0,0]=4 9706 B13R1.446 COC[C@@H](N)c1cc(O)ccc1F Amb27849932 [0,2,0,0,0,0|2,0,0]=4 9707 B13R1.446 COC[C@H](N)c1cc(Br)ccc1F Amb27608281 [0,2,0,0,0,0|2,0,0]=4 9708 B13R1.446 COC[C@H](N)c1cc(C)ccc1F Amb27831884 [0,2,0,0,0,0|2,0,0]=4 9709 B13R1.446 COC[C@H](N)c1cc(N)ccc1O Amb27602192 [0,2,0,0,0,0|2,0,0]=4 9710 B13R1.446 CSCC(N)c1cc(C)ccc1C Amb18995355 [0,2,0,0,0,0|2,0,0]=4 9711 B13R1.446 CSCC(O)c1cc(C)ccc1Cl Amb27262810 [0,2,0,0,0,0|2,0,0]=4 9712 B13R1.446 CSCC(O)c1cc(Cl)ccc1Cl Amb28282108 [0,2,0,0,0,0|2,0,0]=4 9713 B13R1.446 CSCC(O)c1cc(F)ccc1Cl Amb27263465 [0,2,0,0,0,0|2,0,0]=4 9714 B13R1.446 C\C=C\C(C)c1cc(Cl)ccc1N Amb27847580 [0,2,0,0,0,0|1,0,1]=4 9715 B13R1.446 C\C=C\C(C)c1cc(N)ccc1N Amb18127789 [0,2,0,0,0,0|1,0,1]=4 9716 B13R1.446 Cc1ccc(Br)c(C(C)CCN)c1 Amb33478403 [0,2,0,0,0,0|2,0,0]=4 9717 B13R1.446 Cc1ccc(Br)c(C(C)CON)c1 Amb33477514 [0,2,0,0,0,0|2,0,0]=4 9718 B13R1.446 Cc1ccc(Br)cc1C(C)CCN Amb24680832 [0,2,0,0,0,0|2,0,0]=4 9719 B13R1.446 Cc1ccc(Br)cc1C(C)CON Amb33450334 [0,2,0,0,0,0|2,0,0]=4 9720 B13R1.446 Cc1ccc(C)c(C(C)CC#N)c1 Amb27172405 [0,2,0,0,0,0|2,0,0]=4 9721 B13R1.446 Cc1ccc(C)c(C(C)CCBr)c1 Amb857804 [0,2,0,0,0,0|2,0,0]=4 9722 B13R1.446 Cc1ccc(C)c(C(C)CCCl)c1 Amb17236531 [0,2,0,0,0,0|2,0,0]=4 9723 B13R1.446 Cc1ccc(C)c(C(C)CCN)c1 Amb5739012 [0,2,0,0,0,0|2,0,0]=4 9724 B13R1.446 Cc1ccc(C)c(C(C)CCO)c1 Amb17233466 [0,2,0,0,0,0|2,0,0]=4 9725 B13R1.446 Cc1ccc(C)c(C(C)CON)c1 Amb33224873 [0,2,0,0,0,0|2,0,0]=4 9726 B13R1.446 Cc1ccc(C)c(C(O)CNN)c1 Amb18065948 [0,2,0,0,0,0|2,0,0]=4 9727 B13R1.446 Cc1ccc(C)c(C(O)CNO)c1 Amb17335491 [0,2,0,0,0,0|2,0,0]=4 9728 B13R1.446 Cc1ccc(Cl)c(C(C)CCN)c1 Amb26336286 [0,2,0,0,0,0|2,0,0]=4 9729 B13R1.446 Cc1ccc(Cl)c(C(C)CON)c1 Amb33260509 [0,2,0,0,0,0|2,0,0]=4 9730 B13R1.446 Cc1ccc(Cl)cc1C(C)CC#N Amb27610241 [0,2,0,0,0,0|2,0,0]=4 9731 B13R1.446 Cc1ccc(Cl)cc1C(C)CCN Amb27629388 [0,2,0,0,0,0|2,0,0]=4 9732 B13R1.446 Cc1ccc(F)c(C(C)CCN)c1 Amb24520713 [0,2,0,0,0,0|2,0,0]=4 9733 B13R1.446 Cc1ccc(F)c(C(C)CON)c1 Amb33271259 [0,2,0,0,0,0|2,0,0]=4 9734 B13R1.446 Cc1ccc(F)cc1C(C)CCN Amb25068207 [0,2,0,0,0,0|2,0,0]=4 9735 B13R1.446 Cc1ccc(F)cc1C(C)CON Amb33200103 [0,2,0,0,0,0|2,0,0]=4 9736 B13R1.446 Cc1ccc(O)c(C(C)CCN)c1 Amb33269059 [0,2,0,0,0,0|2,0,0]=4 9737 B13R1.446 Cc1ccc(O)c(C(C)CON)c1 Amb33268994 [0,2,0,0,0,0|2,0,0]=4 9738 B13R1.446 NNCC(O)c1cc(Cl)ccc1F Amb24686949 [0,2,0,0,0,0|2,0,0]=4 9739 B13R1.446 NNCC(O)c1cc(F)ccc1F Amb18564462 [0,2,0,0,0,0|2,0,0]=4 9740 B13R1.446 ONCC(O)c1cc(F)ccc1F Amb17336063 [0,2,0,0,0,0|2,0,0]=4 9741 B13R1.450 CC(CC#N)c1cc(Cl)cc(Cl)c1 Amb28061347 [0,2,0,0,0,0|2,0,0]=4 9742 B13R1.450 CC(CCN)c1cc(Cl)cc(Br)c1 Amb33435154 [0,2,0,0,0,0|2,0,0]=4 9743 B13R1.450 CC(CCN)c1cc(Cl)cc(Cl)c1 Amb27610226 [0,2,0,0,0,0|2,0,0]=4 9744 B13R1.450 CC(CCN)c1cc(F)cc(Br)c1 Amb33434966 [0,2,0,0,0,0|2,0,0]=4 9745 B13R1.450 CC(CCN)c1cc(F)cc(Cl)c1 Amb33256673 [0,2,0,0,0,0|2,0,0]=4 9746 B13R1.450 CC(CCN)c1cc(F)cc(F)c1 Amb17234181 [0,2,0,0,0,0|2,0,0]=4 9747 B13R1.450 CC(CCO)c1cc(F)cc(F)c1 Amb17234281 [0,2,0,0,0,0|2,0,0]=4 9748 B13R1.450 CC(CON)c1cc(Cl)cc(Br)c1 Amb33435597 [0,2,0,0,0,0|2,0,0]=4 9749 B13R1.450 CC(CON)c1cc(Cl)cc(Cl)c1 Amb33259162 [0,2,0,0,0,0|2,0,0]=4 9750 B13R1.450 CC(CON)c1cc(F)cc(Br)c1 Amb33334132 [0,2,0,0,0,0|2,0,0]=4 9751 B13R1.450 CC(CON)c1cc(F)cc(Cl)c1 Amb33256721 [0,2,0,0,0,0|2,0,0]=4 9752 B13R1.450 CC(CON)c1cc(F)cc(F)c1 Amb33313619 [0,2,0,0,0,0|2,0,0]=4 9753 B13R1.450 CCCC(N)c1cc(C)cc(C)c1 Amb17233368 [0,2,0,0,0,0|2,0,0]=4 9754 B13R1.450 CCCC(N)c1cc(C)cc(F)c1 Amb28057760 [0,2,0,0,0,0|2,0,0]=4 9755 B13R1.450 CCCC(N)c1cc(C)cc(O)c1 Amb27628971 [0,2,0,0,0,0|2,0,0]=4 9756 B13R1.450 CCCC(N)c1cc(F)cc(F)c1 Amb17234180 [0,2,0,0,0,0|2,0,0]=4 9757 B13R1.450 CCCC(N)c1cc(N)cc(F)c1 Amb27811896 [0,2,0,0,0,0|2,0,0]=4 9758 B13R1.450 CCCC(N)c1cc(O)cc(O)c1 Amb27404544 [0,2,0,0,0,0|2,0,0]=4 9759 B13R1.450 CCCC(O)c1cc(Br)cc(Br)c1 Amb28048650 [0,2,0,0,0,0|2,0,0]=4 9760 B13R1.450 CCCC(O)c1cc(C)cc(C)c1 Amb17233482 [0,2,0,0,0,0|2,0,0]=4 9761 B13R1.450 CCCC(O)c1cc(C)cc(Cl)c1 Amb27780447 [0,2,0,0,0,0|2,0,0]=4 9762 B13R1.450 CCCC(O)c1cc(C)cc(F)c1 Amb25872713 [0,2,0,0,0,0|2,0,0]=4 9763 B13R1.450 CCCC(O)c1cc(Cl)cc(Br)c1 Amb27456899 [0,2,0,0,0,0|2,0,0]=4 9764 B13R1.450 CCCC(O)c1cc(Cl)cc(Cl)c1 Amb24429210 [0,2,0,0,0,0|2,0,0]=4 9765 B13R1.450 CCCC(O)c1cc(F)cc(Cl)c1 Amb25773917 [0,2,0,0,0,0|2,0,0]=4 9766 B13R1.450 CCCC(O)c1cc(F)cc(F)c1 Amb17234280 [0,2,0,0,0,0|2,0,0]=4 9767 B13R1.450 CCCC(O)c1cc(N)cc(Br)c1 Amb35584641 [0,2,0,0,0,0|2,0,0]=4 9768 B13R1.450 CCCC(O)c1cc(N)cc(Cl)c1 Amb35741444 [0,2,0,0,0,0|2,0,0]=4 9769 B13R1.450 CCCN(C)c1cc(C)cc(N)c1 Amb27228453 [0,2,0,0,0,0|2,0,0]=4 9770 B13R1.450 CCC[C@@H](N)c1cc(C)cc(F)c1 Amb27870980 [0,2,0,0,0,0|2,0,0]=4 9771 B13R1.450 CCC[C@@H](N)c1cc(C)cc(N)c1 Amb27958511 [0,2,0,0,0,0|2,0,0]=4 9772 B13R1.450 CCC[C@@H](N)c1cc(C)cc(O)c1 Amb27436561 [0,2,0,0,0,0|2,0,0]=4 9773 B13R1.450 CCC[C@@H](N)c1cc(Cl)cc(Br)c1 Amb27166669 [0,2,0,0,0,0|2,0,0]=4 9774 B13R1.450 CCC[C@@H](N)c1cc(Cl)cc(Cl)c1 Amb27866261 [0,2,0,0,0,0|2,0,0]=4 9775 B13R1.450 CCC[C@@H](N)c1cc(F)cc(Cl)c1 Amb27963702 [0,2,0,0,0,0|2,0,0]=4 9776 B13R1.450 CCC[C@@H](N)c1cc(I)cc(I)c1 Amb28383442 [0,2,0,0,0,0|2,0,0]=4 9777 B13R1.450 CCC[C@@H](N)c1cc(N)cc(F)c1 Amb27600820 [0,2,0,0,0,0|2,0,0]=4 9778 B13R1.450 CCC[C@@H](N)c1cc(O)cc(F)c1 Amb28316498 [0,2,0,0,0,0|2,0,0]=4 9779 B13R1.450 CCC[C@@H](O)c1cc(Cl)cc(Cl)c1 Amb27756731 [0,2,0,0,0,0|2,0,0]=4 9780 B13R1.450 CCC[C@@H](O)c1cc(F)cc(F)c1 Amb27966007 [0,2,0,0,0,0|2,0,0]=4 9781 B13R1.450 CCC[C@H](N)c1cc(C)cc(Cl)c1 Amb28057693 [0,2,0,0,0,0|2,0,0]=4 9782 B13R1.450 CCC[C@H](N)c1cc(F)cc(Br)c1 Amb27180867 [0,2,0,0,0,0|2,0,0]=4 9783 B13R1.450 CCC[C@H](N)c1cc(F)cc(Cl)c1 Amb27239929 [0,2,0,0,0,0|2,0,0]=4 9784 B13R1.450 CCC[C@H](N)c1cc(F)cc(I)c1 Amb27411256 [0,2,0,0,0,0|2,0,0]=4 9785 B13R1.450 CCC[C@H](N)c1cc(I)cc(I)c1 Amb27180858 [0,2,0,0,0,0|2,0,0]=4 9786 B13R1.450 CCC[C@H](N)c1cc(O)cc(F)c1 Amb27803018 [0,2,0,0,0,0|2,0,0]=4 9787 B13R1.450 CCC[C@H](N)c1cc(O)cc(O)c1 Amb27592434 [0,2,0,0,0,0|2,0,0]=4 9788 B13R1.450 CCC[C@H](O)c1cc(C)cc(C)c1 Amb28366058 [0,2,0,0,0,0|2,0,0]=4 9789 B13R1.450 CCC[C@H](O)c1cc(Cl)cc(Cl)c1 Amb27604714 [0,2,0,0,0,0|2,0,0]=4 9790 B13R1.450 CCNC(C)c1cc(Br)cc(Br)c1 Amb27225546 [0,2,0,0,0,0|2,0,0]=4 9791 B13R1.450 CCNC(C)c1cc(C)cc(F)c1 Amb28241101 [0,2,0,0,0,0|2,0,0]=4 9792 B13R1.450 CCNC(C)c1cc(Cl)cc(Cl)c1 Amb28194753 [0,2,0,0,0,0|2,0,0]=4 9793 B13R1.450 CCNC(C)c1cc(F)cc(Br)c1 Amb28059948 [0,2,0,0,0,0|2,0,0]=4 9794 B13R1.450 CNCC(=O)c1cc(C)cc(Br)c1 Amb27398419 [0,2,0,0,0,0|1,0,1]=4 9795 B13R1.450 CNCC(=O)c1cc(C)cc(C)c1 Amb18862918 [0,2,0,0,0,0|1,0,1]=4 9796 B13R1.450 CNCC(=O)c1cc(C)cc(Cl)c1 Amb26026490 [0,2,0,0,0,0|1,0,1]=4 9797 B13R1.450 CNCC(=O)c1cc(C)cc(F)c1 Amb25155763 [0,2,0,0,0,0|1,0,1]=4 9798 B13R1.450 CNCC(=O)c1cc(C)cc(O)c1 Amb24379656 [0,2,0,0,0,0|1,0,1]=4 9799 B13R1.450 CNCC(=O)c1cc(Cl)cc(Br)c1 Amb24456871 [0,2,0,0,0,0|1,0,1]=4 9800 B13R1.450 CNCC(=O)c1cc(Cl)cc(Cl)c1 Amb18225701 [0,2,0,0,0,0|1,0,1]=4 9801 B13R1.450 CNCC(=O)c1cc(F)cc(Br)c1 Amb24472526 [0,2,0,0,0,0|1,0,1]=4 9802 B13R1.450 CNCC(=O)c1cc(F)cc(Cl)c1 Amb26633466 [0,2,0,0,0,0|1,0,1]=4 9803 B13R1.450 CNCC(=O)c1cc(F)cc(F)c1 Amb25698006 [0,2,0,0,0,0|1,0,1]=4 9804 B13R1.450 CNCC(=O)c1cc(O)cc(Br)c1 Amb27481059 [0,2,0,0,0,0|1,0,1]=4 9805 B13R1.450 CNCC(=O)c1cc(O)cc(Cl)c1 Amb25180539 [0,2,0,0,0,0|1,0,1]=4 9806 B13R1.450 CNCC(=O)c1cc(O)cc(F)c1 Amb25094521 [0,2,0,0,0,0|1,0,1]=4 9807 B13R1.450 CNCC(=O)c1cc(O)cc(O)c1 Amb27224027 [0,2,0,0,0,0|1,0,1]=4 9808 B13R1.450 CNCC(C)c1cc(C)cc(Br)c1 Amb26561285 [0,2,0,0,0,0|0,0,0]=2 9809 B13R1.450 CNCC(C)c1cc(C)cc(C)c1 Amb27264491 [0,2,0,0,0,0|0,0,0]=2 9810 B13R1.450 CNCC(C)c1cc(C)cc(Cl)c1 Amb25119977 [0,2,0,0,0,0|0,0,0]=2 9811 B13R1.450 CNCC(C)c1cc(C)cc(F)c1 Amb26605828 [0,2,0,0,0,0|0,0,0]=2 9812 B13R1.450 CNCC(C)c1cc(C)cc(O)c1 Amb24685051 [0,2,0,0,0,0|0,0,0]=2 9813 B13R1.450 CNCC(C)c1cc(Cl)cc(Br)c1 Amb26632869 [0,2,0,0,0,0|0,0,0]=2 9814 B13R1.450 CNCC(C)c1cc(Cl)cc(Cl)c1 Amb26484839 [0,2,0,0,0,0|0,0,0]=2 9815 B13R1.450 CNCC(C)c1cc(F)cc(Br)c1 Amb26058070 [0,2,0,0,0,0|0,0,0]=2 9816 B13R1.450 CNCC(C)c1cc(F)cc(Cl)c1 Amb26507385 [0,2,0,0,0,0|0,0,0]=2 9817 B13R1.450 CNCC(C)c1cc(F)cc(F)c1 Amb26620608 [0,2,0,0,0,0|0,0,0]=2 9818 B13R1.450 CNCC(C)c1cc(O)cc(Br)c1 Amb27751688 [0,2,0,0,0,0|0,0,0]=2 9819 B13R1.450 CNCC(C)c1cc(O)cc(Cl)c1 Amb26035422 [0,2,0,0,0,0|0,0,0]=2 9820 B13R1.450 CNCC(C)c1cc(O)cc(F)c1 Amb28316761 [0,2,0,0,0,0|0,0,0]=2 9821 B13R1.450 CNCC(O)c1cc(C)cc(Br)c1 Amb27840943 [0,2,0,0,0,0|1,0,0]=3 9822 B13R1.450 CNCC(O)c1cc(C)cc(C)c1 Amb18997481 [0,2,0,0,0,0|1,0,0]=3 9823 B13R1.450 CNCC(O)c1cc(C)cc(Cl)c1 Amb27478720 [0,2,0,0,0,0|1,0,0]=3 9824 B13R1.450 CNCC(O)c1cc(C)cc(F)c1 Amb28290102 [0,2,0,0,0,0|1,0,0]=3 9825 B13R1.450 CNCC(O)c1cc(C)cc(O)c1 Amb27772032 [0,2,0,0,0,0|1,0,0]=3 9826 B13R1.450 CNCC(O)c1cc(C)nc(Cl)c1 Amb33221910 [0,2,0,0,0,0|2,0,0]=4 9827 B13R1.450 CNCC(O)c1cc(Cl)cc(Br)c1 Amb24689229 [0,2,0,0,0,0|1,0,0]=3 9828 B13R1.450 CNCC(O)c1cc(Cl)cc(Cl)c1 Amb18997474 [0,2,0,0,0,0|1,0,0]=3 9829 B13R1.450 CNCC(O)c1cc(Cl)nc(Cl)c1 Amb33257789 [0,2,0,0,0,0|2,0,0]=4 9830 B13R1.450 CNCC(O)c1cc(F)cc(Br)c1 Amb25306117 [0,2,0,0,0,0|1,0,0]=3 9831 B13R1.450 CNCC(O)c1cc(F)cc(Cl)c1 Amb25700516 [0,2,0,0,0,0|1,0,0]=3 9832 B13R1.450 CNCC(O)c1cc(F)cc(F)c1 Amb25954457 [0,2,0,0,0,0|1,0,0]=3 9833 B13R1.450 CNCC(O)c1cc(O)cc(Br)c1 Amb27610335 [0,2,0,0,0,0|1,0,0]=3 9834 B13R1.450 CNCC(O)c1cc(O)cc(Cl)c1 Amb25800875 [0,2,0,0,0,0|1,0,0]=3 9835 B13R1.450 CNCC(O)c1cc(O)cc(F)c1 Amb26499343 [0,2,0,0,0,0|1,0,0]=3 9836 B13R1.450 COCC(N)c1cc(C)cc(C)c1 Amb18979035 [0,2,0,0,0,0|2,0,0]=4 9837 B13R1.450 COCC(N)c1cc(Cl)cc(I)c1 Amb27163080 [0,2,0,0,0,0|2,0,0]=4 9838 B13R1.450 COCC(N)c1cc(F)cc(Br)c1 Amb28368463 [0,2,0,0,0,0|2,0,0]=4 9839 B13R1.450 COCC(N)c1cc(O)cc(O)c1 Amb27810815 [0,2,0,0,0,0|2,0,0]=4 9840 B13R1.450 COCC(O)c1cc(Br)cc(Br)c1 Amb27413493 [0,2,0,0,0,0|2,0,0]=4 9841 B13R1.450 COCC(O)c1cc(C)cc(F)c1 Amb28042080 [0,2,0,0,0,0|2,0,0]=4 9842 B13R1.450 COCC(O)c1cc(F)cc(Br)c1 Amb27748725 [0,2,0,0,0,0|2,0,0]=4 9843 B13R1.450 COCC(O)c1cc(N)cc(Br)c1 Amb35741691 [0,2,0,0,0,0|2,0,0]=4 9844 B13R1.450 COCC(O)c1cc(N)cc(Cl)c1 Amb35621840 [0,2,0,0,0,0|2,0,0]=4 9845 B13R1.450 COC[C@@H](N)c1cc(C)cc(Br)c1 Amb27209512 [0,2,0,0,0,0|2,0,0]=4 9846 B13R1.450 COC[C@@H](N)c1cc(C)cc(F)c1 Amb28365830 [0,2,0,0,0,0|2,0,0]=4 9847 B13R1.450 COC[C@@H](N)c1cc(Cl)cc(Cl)c1 Amb27408035 [0,2,0,0,0,0|2,0,0]=4 9848 B13R1.450 COC[C@@H](N)c1cc(F)cc(Br)c1 Amb27608499 [0,2,0,0,0,0|2,0,0]=4 9849 B13R1.450 COC[C@@H](N)c1cc(O)cc(F)c1 Amb27587810 [0,2,0,0,0,0|2,0,0]=4 9850 B13R1.450 COC[C@@H](N)c1cc(O)cc(O)c1 Amb27592416 [0,2,0,0,0,0|2,0,0]=4 9851 B13R1.450 COC[C@H](N)c1cc(Br)cc(Br)c1 Amb27950539 [0,2,0,0,0,0|2,0,0]=4 9852 B13R1.450 COC[C@H](N)c1cc(C)cc(F)c1 Amb27881711 [0,2,0,0,0,0|2,0,0]=4 9853 B13R1.450 COC[C@H](N)c1cc(Cl)cc(Cl)c1 Amb27468138 [0,2,0,0,0,0|2,0,0]=4 9854 B13R1.450 COC[C@H](N)c1cc(F)cc(Br)c1 Amb27393125 [0,2,0,0,0,0|2,0,0]=4 9855 B13R1.450 COC[C@H](N)c1cc(F)cc(Cl)c1 Amb27194336 [0,2,0,0,0,0|2,0,0]=4 9856 B13R1.450 COC[C@H](N)c1cc(O)cc(F)c1 Amb28282704 [0,2,0,0,0,0|2,0,0]=4 9857 B13R1.450 CONC(C)c1cc(C)cc(C)c1 Amb27862199 [0,2,0,0,0,0|2,0,0]=4 9858 B13R1.450 CONC(C)c1cc(O)cc(O)c1 Amb27443442 [0,2,0,0,0,0|2,0,0]=4 9859 B13R1.450 CSCC(N)c1cc(C)cc(C)c1 Amb18995343 [0,2,0,0,0,0|2,0,0]=4 9860 B13R1.450 CSCC(O)c1cc(C)cc(C)c1 Amb19065315 [0,2,0,0,0,0|2,0,0]=4 9861 B13R1.450 CSCC(O)c1cc(F)cc(F)c1 Amb27857681 [0,2,0,0,0,0|2,0,0]=4 9862 B13R1.450 Cc1cc(Br)cc(C(C)CCN)c1 Amb33436146 [0,2,0,0,0,0|2,0,0]=4 9863 B13R1.450 Cc1cc(Br)cc(C(C)CON)c1 Amb33430264 [0,2,0,0,0,0|2,0,0]=4 9864 B13R1.450 Cc1cc(C)cc(C(C)CC#N)c1 Amb27217905 [0,2,0,0,0,0|2,0,0]=4 9865 B13R1.450 Cc1cc(C)cc(C(C)CCN)c1 Amb17233369 [0,2,0,0,0,0|2,0,0]=4 9866 B13R1.450 Cc1cc(C)cc(C(C)CCO)c1 Amb17233483 [0,2,0,0,0,0|2,0,0]=4 9867 B13R1.450 Cc1cc(C)cc(C(C)CON)c1 Amb33375868 [0,2,0,0,0,0|2,0,0]=4 9868 B13R1.450 Cc1cc(C)cc([C@@H](C)CCO)c1 Amb27651851 [0,2,0,0,0,0|2,0,0]=4 9869 B13R1.450 Cc1cc(F)cc(C(C)CCN)c1 Amb24715351 [0,2,0,0,0,0|2,0,0]=4 9870 B13R1.450 Cc1cc(F)cc(C(C)CON)c1 Amb33343467 [0,2,0,0,0,0|2,0,0]=4 9871 B13R1.460 C#Cc1cccc(C(=O)CNC)c1 Amb33267704 [0,2,0,0,0,0|1,0,1]=4 9872 B13R1.460 C#Cc1cccc(C(C)CCN)c1 Amb33267709 [0,2,0,0,0,0|2,0,0]=4 9873 B13R1.460 C#Cc1cccc(C(C)CON)c1 Amb33272821 [0,2,0,0,0,0|2,0,0]=4 9874 B13R1.460 C#Cc1cccc(C(O)CNC)c1 Amb33267706 [0,2,0,0,0,0|1,0,0]=3 9875 B13R1.460 CC(CCN)c1cccc(C#N)c1 Amb33417622 [0,2,0,0,0,0|2,0,0]=4 9876 B13R1.460 CC(CON)c1cccc(C#N)c1 Amb33424603 [0,2,0,0,0,0|2,0,0]=4 9877 B13R1.460 CCCC(N)c1cccc(C#N)c1 Amb27817802 [0,2,0,0,0,0|2,0,0]=4 9878 B13R1.460 CCCC(N)c1cccc(OC)c1 Amb17233601 [0,2,0,0,0,0|2,0,0]=4 9879 B13R1.460 CCCC(O)c1cccc(OC)c1 Amb17233693 [0,2,0,0,0,0|2,0,0]=4 9880 B13R1.460 CCC[C@@H](N)c1cccc(C#N)c1 Amb27398586 [0,2,0,0,0,0|2,0,0]=4 9881 B13R1.460 CCNC(C)c1cccc(OC)c1 Amb6267028 [0,2,0,0,0,0|2,0,0]=4 9882 B13R1.460 CCNC(C)c1cccc(OC)c1 Amb7969804 [0,2,0,0,0,0|2,0,0]=4 9883 B13R1.460 CCc1cccc(C(=O)CNC)c1 Amb32953387 [0,2,0,0,0,0|1,0,1]=4 9884 B13R1.460 CCc1cccc(C(C)CCN)c1 Amb33171656 [0,2,0,0,0,0|2,0,0]=4 9885 B13R1.460 CCc1cccc(C(C)CON)c1 Amb32875786 [0,2,0,0,0,0|2,0,0]=4 9886 B13R1.460 CCc1cccc(C(O)CNC)c1 Amb33473902 [0,2,0,0,0,0|1,0,0]=3 9887 B13R1.460 CNCC(=O)c1cccc(C#N)c1 Amb33318842 [0,2,0,0,0,0|1,0,1]=4 9888 B13R1.460 CNCC(=O)c1cccc(OC)c1 Amb17233536 [0,2,0,0,0,0|1,0,1]=4 9889 B13R1.460 CNCC(=O)c1cccc(SC)c1 Amb33144875 [0,2,0,0,0,0|1,0,1]=4 9890 B13R1.460 CNCC(C)c1cccc(OC)c1 Amb17233594 [0,2,0,0,0,0|0,0,0]=2 9891 B13R1.460 CNCC(O)c1cc(OC)ccn1 Amb33319066 [0,2,0,0,0,0|2,0,0]=4 9892 B13R1.460 CNCC(O)c1cccc(C#N)c1 Amb27863531 [0,2,0,0,0,0|1,0,0]=3 9893 B13R1.460 CNCC(O)c1cccc(OC)c1 Amb6357648 [0,2,0,0,0,0|1,0,0]=3 9894 B13R1.460 CNCC(O)c1cccc(OC)n1 Amb33202195 [0,2,0,0,0,0|2,0,0]=4 9895 B13R1.460 CNCC(O)c1cccc(SC)c1 Amb33143797 [0,2,0,0,0,0|1,0,0]=3 9896 B13R1.460 CNCC(O)c1ccnc(OC)c1 Amb33320579 [0,2,0,0,0,0|2,0,0]=4 9897 B13R1.460 CNCC(O)c1cncc(OC)c1 Amb33079108 [0,2,0,0,0,0|2,0,0]=4 9898 B13R1.460 CN\N=C(\C)c1cccc(OC)c1 Amb28454913 [0,2,0,0,0,0|1,0,1]=4 9899 B13R1.460 COCC(N)c1cccc(C#N)c1 Amb25930329 [0,2,0,0,0,0|2,0,0]=4 9900 B13R1.460 COCC(N)c1cccc(C#N)c1 Amb32683354 [0,2,0,0,0,0|2,0,0]=4 9901 B13R1.460 COCC(N)c1cccc(OC)c1 Amb33543013 [0,2,0,0,0,0|2,0,0]=4 9902 B13R1.460 CONC(C)c1cccc(C#N)c1 Amb27490546 [0,2,0,0,0,0|2,0,0]=4 9903 B13R1.460 COc1cccc(C(C)CC#N)c1 Amb25042867 [0,2,0,0,0,0|2,0,0]=4 9904 B13R1.460 COc1cccc(C(C)CCBr)c1 Amb17256444 [0,2,0,0,0,0|2,0,0]=4 9905 B13R1.460 COc1cccc(C(C)CCCl)c1 Amb17236873 [0,2,0,0,0,0|2,0,0]=4 9906 B13R1.460 COc1cccc(C(C)CCN)c1 Amb17233595 [0,2,0,0,0,0|2,0,0]=4 9907 B13R1.460 COc1cccc(C(C)CCO)c1 Amb17233702 [0,2,0,0,0,0|2,0,0]=4 9908 B13R1.460 COc1cccc(C(C)CON)c1 Amb33200631 [0,2,0,0,0,0|2,0,0]=4 9909 B13R1.460 COc1cccc(C(O)CNN)c1 Amb17233904 [0,2,0,0,0,0|2,0,0]=4 9910 B13R1.460 COc1cccc(C(O)CNO)c1 Amb17335612 [0,2,0,0,0,0|2,0,0]=4 9911 B13R1.460 CSCC(O)c1cccc(C#N)c1 Amb30012085 [0,2,0,0,0,0|2,0,0]=4 9912 B13R1.460 CSc1cccc(C(C)CCN)c1 Amb33143800 [0,2,0,0,0,0|2,0,0]=4 9913 B13R1.460 CSc1cccc(C(C)CON)c1 Amb33142878 [0,2,0,0,0,0|2,0,0]=4 9914 B13R1.11 C#C[C@H](C)N[C@H](C)c1ccccc1 Amb27751216 [0,2,0,0,0,0|1,0,1]=4 9915 B13R1.11 CC(C#N)CC(Cl)c1ccccc1 Amb27179201 [0,2,0,0,0,0|2,0,0]=4 9916 B13R1.11 CC(C#N)CN(C)c1ccccc1 Amb9024607 [0,2,0,0,0,0|2,0,0]=4 9917 B13R1.11 CC(C#N)N[C@H](C)c1ccccc1 Amb27216574 [0,2,0,0,0,0|2,0,0]=4 9918 B13R1.11 CC(CC(=O)NN)c1ccccc1 Amb27481474 [0,2,0,0,0,0|1,0,0]=3 9919 B13R1.11 CC(CC(=O)NO)c1ccncc1 Amb27981463 [0,2,0,0,0,0|2,0,0]=4 9920 B13R1.11 CC(CC(N)C#N)c1ccccc1 Amb18979389 [0,2,0,0,0,0|1,0,1]=4 9921 B13R1.11 CC(CC(N)CO)c1ccccc1 Amb19018569 [0,2,0,0,0,0|1,0,0]=3 9922 B13R1.11 CC(CC(O)CN)c1ccccc1 Amb18184539 [0,2,0,0,0,0|1,0,0]=3 9923 B13R1.11 CC(CN)CC(C)c1ccccc1 Amb33727754 [0,2,0,0,0,0|1,0,0]=3 9924 B13R1.11 CC(CN)CN(C)c1ccccc1 Amb8868685 [0,2,0,0,0,0|2,0,0]=4 9925 B13R1.11 CC(CO)CC(C)c1ccccc1 Amb22733184 [0,2,0,0,0,0|1,0,0]=3 9926 B13R1.11 CC(CO)NC(C)c1ccccc1 Amb9359811 [0,2,0,0,0,0|2,0,0]=4 9927 B13R1.11 CC(C[C@@H](C)CN)c1ccccc1 Amb33743135 [0,2,0,0,0,0|1,0,0]=3 9928 B13R1.11 CC(C[C@@H](C)CO)c1ccccc1 Amb33736433 [0,2,0,0,0,0|1,0,0]=3 9929 B13R1.11 CC(C[C@H](C)CN)c1ccccc1 Amb33726992 [0,2,0,0,0,0|1,0,0]=3 9930 B13R1.11 CC(C[C@H](C)CO)c1ccccc1 Amb33729468 [0,2,0,0,0,0|1,0,0]=3 9931 B13R1.11 CC(NC(=O)CBr)c1ccccc1 Amb9778939 [0,2,0,0,0,0|2,0,0]=4 9932 B13R1.11 CC(NC(=O)CCl)c1ccccc1 Amb1643934 [0,2,0,0,0,0|2,0,0]=4 9933 B13R1.11 CC(NC(=O)CI)c1ccccc1 Amb22340599 [0,2,0,0,0,0|2,0,0]=4 9934 B13R1.11 CC(NC(=O)CN)c1ccccc1 Amb6278096 [0,2,0,0,0,0|2,0,0]=4 9935 B13R1.11 CC(NC(=O)CO)c1ccccc1 Amb1110697 [0,2,0,0,0,0|2,0,0]=4 9936 B13R1.11 CC(NC(=O)CS)c1ccccc1 Amb27807303 [0,2,0,0,0,0|2,0,0]=4 9937 B13R1.11 CC(NC(=S)NN)c1ccccc1 Amb7771591 [0,2,0,0,0,0|1,0,1]=4 9938 B13R1.11 CC(OC(=O)NN)c1ccccc1 Amb27758899 [0,2,0,0,0,0|1,0,1]=4 9939 B13R1.11 CC(\C=C(\F)CO)c1ccccc1 Amb27662130 [0,2,0,0,0,0|1,0,1]=4 9940 B13R1.11 CCC(=O)CC(C)c1ccccc1 Amb17594493 [0,2,0,0,0,0|1,0,0]=3 9941 B13R1.11 CCC(=O)N[C@@H](C)c1ccccc1 Amb23091317 [0,2,0,0,0,0|1,0,1]=4 9942 B13R1.11 CCC(=O)OC(C)c1ccccc1 Amb6357162 [0,2,0,0,0,0|1,0,1]=4 9943 B13R1.11 CCC(C)NC(C)c1ccccc1 Amb2612137 [0,2,0,0,0,0|1,0,0]=3 9944 B13R1.11 CCC(C)NC(C)c1ccccn1 Amb6685835 [0,2,0,0,0,0|2,0,0]=4 9945 B13R1.11 CCC(C)NC(C)c1cccnc1 Amb6685837 [0,2,0,0,0,0|2,0,0]=4 9946 B13R1.11 CCC(C)NC(C)c1ccncc1 Amb6685836 [0,2,0,0,0,0|2,0,0]=4 9947 B13R1.11 CC[C@H](O)\C=C(\C)c1ccccc1 Amb27255183 [0,2,0,0,0,0|1,0,1]=4 9948 B13R1.11 CN(CC(=O)NO)c1ccccc1 Amb28284032 [0,2,0,0,0,0|2,0,0]=4 9949 B13R1.11 CN(CC(O)CN)c1ccccc1 Amb1137408 [0,2,0,0,0,0|2,0,0]=4 9950 B13R1.11 CN(CC(O)CO)c1ccccc1 Amb17335487 [0,2,0,0,0,0|2,0,0]=4 9951 B13R1.11 CNC(=N)NC(C)c1ccccc1 Amb18184205 [0,2,0,0,0,0|0,0,1]=3 9952 B13R1.11 CNC(=N)NC(C)c1cccnc1 Amb18184394 [0,2,0,0,0,0|1,0,1]=4 9953 B13R1.11 CNC(=N)NC(C)c1ccncc1 Amb18184395 [0,2,0,0,0,0|1,0,1]=4 9954 B13R1.11 CNC(=N)N[C@H](C)c1ccccc1 Amb27883590 [0,2,0,0,0,0|0,0,1]=3 9955 B13R1.11 CNC(=N)N[C@H](C)c1cccnc1 Amb27813376 [0,2,0,0,0,0|1,0,1]=4 9956 B13R1.11 CNC(=O)CC(=O)c1ccccc1 Amb24361603 [0,2,0,0,0,0|1,0,1]=4 9957 B13R1.11 CNC(=O)CC(C)c1ccccc1 Amb6846870 [0,2,0,0,0,0|0,0,0]=2 9958 B13R1.11 CNC(=O)CC(N)c1ccccc1 Amb6274807 [0,2,0,0,0,0|1,0,0]=3 9959 B13R1.11 CNC(=O)CC(N)c1cccnc1 Amb17233543 [0,2,0,0,0,0|2,0,0]=4 9960 B13R1.11 CNC(=O)C[C@@H](C)c1ccccc1 Amb27624580 [0,2,0,0,0,0|0,0,0]=2 9961 B13R1.11 CNC(=O)NN(C)c1ccccc1 Amb25137162 [0,2,0,0,0,0|1,0,1]=4 9962 B13R1.11 CNC(=O)SC(C)c1ccccc1 Amb27442996 [0,2,0,0,0,0|0,0,1]=3 9963 B13R1.11 CNC(=O)\C=C(/C)c1ccccc1 Amb27860376 [0,2,0,0,0,0|0,0,2]=4 9964 B13R1.11 CNC(=S)CC(=O)c1ccccc1 Amb27394060 [0,2,0,0,0,0|1,0,1]=4 9965 B13R1.11 CNC(=S)NC(C)c1cccnc1 Amb27222009 [0,2,0,0,0,0|1,0,1]=4 9966 B13R1.11 CNC(=S)NN(C)c1ccccc1 Amb9822334 [0,2,0,0,0,0|1,0,1]=4 9967 B13R1.11 CNC(=S)N[C@@H](C)c1ccccn1 Amb27479552 [0,2,0,0,0,0|1,0,1]=4 9968 B13R1.11 CNC(=S)N[C@@H](C)c1cccnc1 Amb27586191 [0,2,0,0,0,0|1,0,1]=4 9969 B13R1.11 CNC(=S)N[C@H](C)c1ccccc1 Amb27179079 [0,2,0,0,0,0|0,0,1]=3 9970 B13R1.11 CNC(C)\C=C(\C)c1ccccc1 Amb28247465 [0,2,0,0,0,0|0,0,1]=3 9971 B13R1.11 COC(=O)CC(C)c1ccccc1 Amb17843427 [0,2,0,0,0,0|1,0,0]=3 9972 B13R1.11 COC(=O)CC(N)c1ccccc1 Amb1221582 [0,2,0,0,0,0|2,0,0]=4 9973 B13R1.11 COC(=O)CC(N)c1ccccc1 Amb2371447 [0,2,0,0,0,0|2,0,0]=4 9974 B13R1.11 COC(=O)CC(O)c1ccccc1 Amb22731500 [0,2,0,0,0,0|2,0,0]=4 9975 B13R1.11 COC(=O)C[C@@H](N)c1ccccc1 Amb18796125 [0,2,0,0,0,0|2,0,0]=4 9976 B13R1.11 COC(=O)C[C@@H](N)c1ccccc1 Amb19373681 [0,2,0,0,0,0|2,0,0]=4 9977 B13R1.11 COC(=O)C[C@@H](O)c1ccccc1 Amb6357238 [0,2,0,0,0,0|2,0,0]=4 9978 B13R1.11 COC(=O)C[C@H](N)c1ccccc1 Amb17617178 [0,2,0,0,0,0|2,0,0]=4 9979 B13R1.11 COC(=O)C[C@H](N)c1ccccc1 Amb22268691 [0,2,0,0,0,0|2,0,0]=4 9980 B13R1.11 COC(=O)C[C@H](N)c1ccccc1 Amb33801673 [0,2,0,0,0,0|2,0,0]=4 9981 B13R1.11 COC(=O)C[C@H](O)c1ccccc1 Amb8516703 [0,2,0,0,0,0|2,0,0]=4 9982 B13R1.11 CSC(=S)NC(C)c1ccccc1 Amb27222375 [0,2,0,0,0,0|1,0,1]=4 9983 B13R1.11 C[C@@H](CC(=O)NN)c1ccccc1 Amb22357025 [0,2,0,0,0,0|1,0,0]=3 9984 B13R1.11 C[C@@H](C[C@@H](O)C#N)c1ccccc1 Amb27589721 [0,2,0,0,0,0|1,0,1]=4 9985 B13R1.11 C[C@@H](NC(=O)CBr)c1ccccc1 Amb28427909 [0,2,0,0,0,0|2,0,0]=4 9986 B13R1.11 C[C@@H](NC(=O)CCl)c1ccccc1 Amb10844688 [0,2,0,0,0,0|2,0,0]=4 9987 B13R1.11 C[C@@H](NC(=O)CN)c1ccccc1 Amb27646023 [0,2,0,0,0,0|2,0,0]=4 9988 B13R1.11 C[C@@H](NC(=O)NN)c1ccccc1 Amb27196255 [0,2,0,0,0,0|1,0,1]=4 9989 B13R1.11 C[C@H](NC(=O)CN)c1ccccc1 Amb28427910 [0,2,0,0,0,0|2,0,0]=4 9990 B13R1.11 C[C@H](NC(=O)NN)c1ccccc1 Amb22356343 [0,2,0,0,0,0|1,0,1]=4 9991 B13R1.11 C[C@H](NC(=S)NN)c1ccccc1 Amb27642344 [0,2,0,0,0,0|1,0,1]=4 9992 B13R1.11 C\C(=C\C(C)c1ccccc1)CN Amb27391934 [0,2,0,0,0,0|1,0,1]=4 9993 B13R1.11 C\C(C=O)=C/C(C)c1ccccc1 Amb18647861 [0,2,0,0,0,0|1,0,1]=4 9994 B13R1.11 C\C=C(/F)CN(C)c1ccccc1 Amb22546801 [0,2,0,0,0,0|2,0,0]=4 9995 B13R1.11 NC(CO)CC(O)c1ccccc1 Amb32681151 [0,2,0,0,0,0|2,0,0]=4 9996 B13R1.11 NNC(=O)CC(O)c1ccccc1 Amb24720262 [0,2,0,0,0,0|2,0,0]=4 9997 B13R1.11 NNC(=O)C[C@H](O)c1ccccc1 Amb27980624 [0,2,0,0,0,0|2,0,0]=4 9998 B13R1.11 O=C(CC(Cl)c1ccccc1)NO Amb28121077 [0,2,0,0,0,0|2,0,0]=4 9999 B13R1.11 O=C(CC(O)c1ccccc1)NO Amb27213884 [0,2,0,0,0,0|2,0,0]=4 10000 B13R1.24 C#CCNCC(O)c1ccccc1 Amb5262817 [0,2,0,0,0,0|1,0,0]=3 10001 B13R1.24 C=CCCCC(N)c1ccccc1 Amb18127534 [0,2,0,0,0,0|2,0,0]=4 10002 B13R1.24 C=CCCN[C@H](C)c1ccccc1 Amb33624938 [0,2,0,0,0,0|1,0,1]=4 10003 B13R1.24 C=CCNCC(C)c1ccccc1 Amb2119615 [0,2,0,0,0,0|0,0,0]=2 10004 B13R1.24 C=CCNCC(C)c1ccccc1 Amb6719269 [0,2,0,0,0,0|0,0,0]=2 10005 B13R1.24 CC#CCCC(N)c1ccccc1 Amb27617693 [0,2,0,0,0,0|2,0,0]=4 10006 B13R1.24 CC#CCCN(C)c1ccccc1 Amb28454714 [0,2,0,0,0,0|2,0,0]=4 10007 B13R1.24 CC#CCNC(C)c1ccccn1 Amb18804162 [0,2,0,0,0,0|2,0,0]=4 10008 B13R1.24 CC#CCNC(C)c1cccnc1 Amb18183864 [0,2,0,0,0,0|2,0,0]=4 10009 B13R1.24 CC#CCNC(C)c1ccncc1 Amb18804161 [0,2,0,0,0,0|2,0,0]=4 10010 B13R1.24 CC#CCN[C@H](C)c1ccccc1 Amb28119750 [0,2,0,0,0,0|1,0,0]=3 10011 B13R1.24 CC(CCN=C=O)c1ccccc1 Amb32953286 [0,2,0,0,0,0|0,0,2]=4 10012 B13R1.24 CC(CCN=[N+]=[N-])c1ccccc1 Amb32954525 [0,2,0,0,0,0|1,0,1]=4 10013 B13R1.24 CC(CNCCO)c1ccccc1 Amb1851160 [0,2,0,0,0,0|0,0,0]=2 10014 B13R1.24 CC(NCCC#N)c1ccccc1 Amb6736425 [0,2,0,0,0,0|1,0,1]=4 10015 B13R1.24 CC(NCCCN)c1ccccc1 Amb17315288 [0,2,0,0,0,0|1,0,0]=3 10016 B13R1.24 CC(NCCCO)c1ccccc1 Amb4422879 [0,2,0,0,0,0|1,0,0]=3 10017 B13R1.24 CC(NCCCO)c1ccccn1 Amb1071370 [0,2,0,0,0,0|2,0,0]=4 10018 B13R1.24 CC(NCCCO)c1cccnc1 Amb1070102 [0,2,0,0,0,0|2,0,0]=4 10019 B13R1.24 CC(NCCCO)c1ccncc1 Amb6356073 [0,2,0,0,0,0|2,0,0]=4 10020 B13R1.24 CC(OCCC#N)c1ccccc1 Amb6259524 [0,2,0,0,0,0|1,0,1]=4 10021 B13R1.24 CC(OCCCN)c1ccccc1 Amb9729503 [0,2,0,0,0,0|1,0,0]=3 10022 B13R1.24 CC(SCCCN)c1ccccc1 Amb17500696 [0,2,0,0,0,0|1,0,0]=3 10023 B13R1.24 CC([NH2+]CCCO)c1cccnc1 Amb4262407 [0,2,0,0,0,0|2,0,0]=4 10024 B13R1.24 CC(\C=N\NC=O)c1ccccc1 Amb27835712 [0,2,0,0,0,0|0,0,2]=4 10025 B13R1.24 CCCC#CC(O)c1ccccc1 Amb27826395 [0,2,0,0,0,0|2,0,0]=4 10026 B13R1.24 CCCC#C[C@@H](O)c1ccccc1 Amb27981923 [0,2,0,0,0,0|2,0,0]=4 10027 B13R1.24 CCCCCC(N)c1ccccc1 Amb7764725 [0,2,0,0,0,0|2,0,0]=4 10028 B13R1.24 CCCCCC(O)c1ccccc1 Amb9619574 [0,2,0,0,0,0|2,0,0]=4 10029 B13R1.24 CCCCCC(S)c1ccccc1 Amb32788166 [0,2,0,0,0,0|2,0,0]=4 10030 B13R1.24 CCCCNC(C)c1ccccc1 Amb33548283 [0,2,0,0,0,0|1,0,0]=3 10031 B13R1.24 CCCCNC(C)c1ccccc1 Amb4313706 [0,2,0,0,0,0|1,0,0]=3 10032 B13R1.24 CCCCNC(C)c1ccccn1 Amb6691018 [0,2,0,0,0,0|2,0,0]=4 10033 B13R1.24 CCCCNC(C)c1cccnc1 Amb6691020 [0,2,0,0,0,0|2,0,0]=4 10034 B13R1.24 CCCCNC(C)c1ccncc1 Amb6691019 [0,2,0,0,0,0|2,0,0]=4 10035 B13R1.24 CCCNCC(C)c1ccccc1 Amb2119487 [0,2,0,0,0,0|0,0,0]=2 10036 B13R1.24 CCCNCC(C)c1ccccc1 Amb6719090 [0,2,0,0,0,0|0,0,0]=2 10037 B13R1.24 CN(CCCCN)c1ccccc1 Amb5782374 [0,2,0,0,0,0|2,0,0]=4 10038 B13R1.24 CN(CCCCO)c1ccccc1 Amb9370155 [0,2,0,0,0,0|2,0,0]=4 10039 B13R1.24 CNCCNC(=O)c1ccccc1 Amb19028050 [0,2,0,0,0,0|1,0,1]=4 10040 B13R1.24 COCCNC(C)c1ccccc1 Amb6685616 [0,2,0,0,0,0|1,0,0]=3 10041 B13R1.24 COCCNC(C)c1ccccn1 Amb6685634 [0,2,0,0,0,0|2,0,0]=4 10042 B13R1.24 COCCNC(C)c1cccnc1 Amb6685636 [0,2,0,0,0,0|2,0,0]=4 10043 B13R1.24 C\C(=C/CCCN)c1ccccc1 Amb18065585 [0,2,0,0,0,0|1,0,1]=4 10044 B13R1.24 N#CCCCC(N)c1ccccc1 Amb26304186 [0,2,0,0,0,0|2,0,0]=4 10045 B13R1.24 N#CCCCC(N)c1ccccc1 Amb32661175 [0,2,0,0,0,0|2,0,0]=4 10046 B13R1.24 OC(CC#CCCl)c1ccccc1 Amb27179148 [0,2,0,0,0,0|2,0,0]=4 10047 B13R1.24 OCCNCC(O)c1ccccc1 Amb9242094 [0,2,0,0,0,0|1,0,0]=3 10048 B13R1.24 OCCNCC(O)c1cccnc1 Amb30623419 [0,2,0,0,0,0|2,0,0]=4 10049 B13R1.45 C=C(C)CNC(C)c1ccccc1 Amb17308958 [0,2,0,0,0,0|1,0,0]=3 10050 B13R1.45 C=C(C)CNC(C)c1ccccn1 Amb18186022 [0,2,0,0,0,0|2,0,0]=4 10051 B13R1.45 C=C(C)CNC(C)c1cccnc1 Amb18186023 [0,2,0,0,0,0|2,0,0]=4 10052 B13R1.45 C=C(C)CNC(C)c1ccncc1 Amb18808908 [0,2,0,0,0,0|2,0,0]=4 10053 B13R1.45 CC(=N)NCC(C)c1ccccn1 Amb35694001 [0,2,0,0,0,0|1,0,0]=3 10054 B13R1.45 CC(=O)CCC(C)c1ccccc1 Amb33082106 [0,2,0,0,0,0|1,0,0]=3 10055 B13R1.45 CC(=O)CCC(Cl)c1ccccc1 Amb17402167 [0,2,0,0,0,0|2,0,0]=4 10056 B13R1.45 CC(=O)CCN(C)c1ccccc1 Amb8388281 [0,2,0,0,0,0|2,0,0]=4 10057 B13R1.45 CC(=O)C\C=C(/C)c1ccccc1 Amb27169026 [0,2,0,0,0,0|1,0,1]=4 10058 B13R1.45 CC(=O)NCC(=O)c1ccccc1 Amb17335159 [0,2,0,0,0,0|1,0,1]=4 10059 B13R1.45 CC(=O)NCC(Br)c1ccccc1 Amb27809645 [0,2,0,0,0,0|1,0,0]=3 10060 B13R1.45 CC(=O)NCC(C)c1ccccc1 Amb8384388 [0,2,0,0,0,0|0,0,0]=2 10061 B13R1.45 CC(=O)NCC(C)c1ccccn1 Amb35694000 [0,2,0,0,0,0|1,0,0]=3 10062 B13R1.45 CC(=O)NCC(O)c1ccccc1 Amb9244841 [0,2,0,0,0,0|1,0,0]=3 10063 B13R1.45 CC(=O)NCC(O)c1ccccn1 Amb27268413 [0,2,0,0,0,0|2,0,0]=4 10064 B13R1.45 CC(=O)NCC(O)c1ccncc1 Amb27591120 [0,2,0,0,0,0|2,0,0]=4 10065 B13R1.45 CC(=O)NCN(C)c1ccccc1 Amb27946390 [0,2,0,0,0,0|1,0,0]=3 10066 B13R1.45 CC(=O)NC[C@H](O)c1ccccc1 Amb27427139 [0,2,0,0,0,0|1,0,0]=3 10067 B13R1.45 CC(=O)NC[PH](=O)c1ccccc1 Amb27174263 [0,2,0,0,0,0|2,0,0]=4 10068 B13R1.45 CC(=O)NNC(C)c1cccnc1 Amb28206897 [0,2,0,0,0,0|2,0,0]=4 10069 B13R1.45 CC(=O)NNC(C)c1ccncc1 Amb27598396 [0,2,0,0,0,0|2,0,0]=4 10070 B13R1.45 CC(=O)N\N=C(/C)c1ccccc1 Amb1834900 [0,2,0,0,0,0|1,0,1]=4 10071 B13R1.45 CC(=O)N\N=C(\C)c1ccccc1 Amb8506418 [0,2,0,0,0,0|1,0,1]=4 10072 B13R1.45 CC(=O)OCC(C)c1ccccc1 Amb4020115 [0,2,0,0,0,0|1,0,0]=3 10073 B13R1.45 CC(=O)\C=C\C(C)c1ccccc1 Amb24090253 [0,2,0,0,0,0|1,0,1]=4 10074 B13R1.45 CC(C)=CCC(O)c1ccccc1 Amb27945977 [0,2,0,0,0,0|2,0,0]=4 10075 B13R1.45 CC(C)=CCN(C)c1ccccc1 Amb22546825 [0,2,0,0,0,0|2,0,0]=4 10076 B13R1.45 CC(C)=CC[C@H](O)c1ccccc1 Amb27757376 [0,2,0,0,0,0|2,0,0]=4 10077 B13R1.45 CC(C)=CNC(C)c1ccccc1 Amb28243457 [0,2,0,0,0,0|1,0,1]=4 10078 B13R1.45 CC(C)CCC(N)c1ccccc1 Amb35745830 [0,2,0,0,0,0|2,0,0]=4 10079 B13R1.45 CC(C)CCC(N)c1ccccc1 Amb6744642 [0,2,0,0,0,0|2,0,0]=4 10080 B13R1.45 CC(C)CNC(C)c1ccccc1 Amb6684804 [0,2,0,0,0,0|1,0,0]=3 10081 B13R1.45 CC(C)CNC(C)c1cccnc1 Amb6686022 [0,2,0,0,0,0|2,0,0]=4 10082 B13R1.45 CC(C)CNC(C)c1ccncc1 Amb6686021 [0,2,0,0,0,0|2,0,0]=4 10083 B13R1.45 CC(C)NCC(=O)c1ccccc1 Amb6357665 [0,2,0,0,0,0|1,0,1]=4 10084 B13R1.45 CC(C)NCC(C)c1ccccc1 Amb2119052 [0,2,0,0,0,0|0,0,0]=2 10085 B13R1.45 CC(C)NCC(C)c1ccccc1 Amb6729184 [0,2,0,0,0,0|0,0,0]=2 10086 B13R1.45 CC(C)NCC(N)c1ccccc1 Amb18305273 [0,2,0,0,0,0|1,0,0]=3 10087 B13R1.45 CC(C)NCC(O)c1ccccc1 Amb2612899 [0,2,0,0,0,0|1,0,0]=3 10088 B13R1.45 CC(C)NCC(O)c1ccccn1 Amb17138984 [0,2,0,0,0,0|2,0,0]=4 10089 B13R1.45 CC(C)NCC(O)c1cccnc1 Amb17138985 [0,2,0,0,0,0|2,0,0]=4 10090 B13R1.45 CC(C)NCC(O)c1ccncc1 Amb17138987 [0,2,0,0,0,0|2,0,0]=4 10091 B13R1.45 CC(C)OC[C@@H](N)c1ccccc1 Amb17061653 [0,2,0,0,0,0|2,0,0]=4 10092 B13R1.45 CC(C)\C=N\C(C)c1ccccc1 Amb27174489 [0,2,0,0,0,0|1,0,1]=4 10093 B13R1.45 CC(CCC(=O)O)c1ccccc1 Amb857806 [0,2,0,0,0,0|1,0,1]=4 10094 B13R1.45 CC(CC[C@@H](C)N)c1ccccc1 Amb33081846 [0,2,0,0,0,0|1,0,0]=3 10095 B13R1.45 CC(CC[C@@H](C)O)c1ccccc1 Amb33081845 [0,2,0,0,0,0|1,0,0]=3 10096 B13R1.45 CC(CC[C@H](C)N)c1ccccc1 Amb33081850 [0,2,0,0,0,0|1,0,0]=3 10097 B13R1.45 CC(CC[C@H](C)O)c1ccccc1 Amb33081839 [0,2,0,0,0,0|1,0,0]=3 10098 B13R1.45 CC(CC[N+](=O)[O-])c1ccccc1 Amb33081885 [0,2,0,0,0,0|1,0,1]=4 10099 B13R1.45 CC(CNC(=N)N)c1ccccn1 Amb30010309 [0,2,0,0,0,0|1,0,1]=4 10100 B13R1.45 CC(CNC(=O)Cl)c1ccccc1 Amb35609815 [0,2,0,0,0,0|0,0,1]=3 10101 B13R1.45 CC(CNC(=O)Cl)c1ccccn1 Amb35625901 [0,2,0,0,0,0|1,0,1]=4 10102 B13R1.45 CC(CNC(N)=O)c1ccccc1 Amb25156032 [0,2,0,0,0,0|0,0,1]=3 10103 B13R1.45 CC(CNC(N)=O)c1ccccn1 Amb35685998 [0,2,0,0,0,0|1,0,1]=4 10104 B13R1.45 CC(CNC(N)=S)c1ccccc1 Amb27605852 [0,2,0,0,0,0|0,0,1]=3 10105 B13R1.45 CC(CNC(N)=S)c1ccccn1 Amb30010269 [0,2,0,0,0,0|1,0,1]=4 10106 B13R1.45 CC(COC(=O)Cl)c1ccccc1 Amb33297204 [0,2,0,0,0,0|1,0,1]=4 10107 B13R1.45 CC(CSC(=N)N)c1ccccc1 Amb20676022 [0,2,0,0,0,0|1,0,1]=4 10108 B13R1.45 CC(N)CCC(C)c1ccccc1 Amb32953212 [0,2,0,0,0,0|1,0,0]=3 10109 B13R1.45 CC(N)\C=C\C(C)c1ccccc1 Amb27599683 [0,2,0,0,0,0|1,0,1]=4 10110 B13R1.45 CC(NCC(=O)O)c1ccccc1 Amb7766412 [0,2,0,0,0,0|2,0,0]=4 10111 B13R1.45 CC(NCC(F)F)c1ccccc1 Amb16229907 [0,2,0,0,0,0|2,0,0]=4 10112 B13R1.45 CC(NCC(N)=O)c1ccccc1 Amb33541973 [0,2,0,0,0,0|2,0,0]=4 10113 B13R1.45 CC(O)CCC(C)c1ccccc1 Amb33081451 [0,2,0,0,0,0|1,0,0]=3 10114 B13R1.45 CC(O)CNC(C)c1ccccc1 Amb9247487 [0,2,0,0,0,0|1,0,0]=3 10115 B13R1.45 CC(O)CNC(C)c1ccccn1 Amb9359512 [0,2,0,0,0,0|2,0,0]=4 10116 B13R1.45 CC(O)CNC(C)c1cccnc1 Amb9359510 [0,2,0,0,0,0|2,0,0]=4 10117 B13R1.45 CC(O)CNC(C)c1ccncc1 Amb9359511 [0,2,0,0,0,0|2,0,0]=4 10118 B13R1.45 CC(OCC(=O)O)c1ccccc1 Amb6269624 [0,2,0,0,0,0|2,0,0]=4 10119 B13R1.45 CC(ONC(N)=O)c1ccccc1 Amb28126291 [0,2,0,0,0,0|1,0,1]=4 10120 B13R1.45 CC(\C=N\N(C)C)c1ccccc1 Amb27652821 [0,2,0,0,0,0|0,0,1]=3 10121 B13R1.45 CC(\C=N\S(C)=O)c1ccccc1 Amb29858790 [0,2,0,0,0,0|0,0,2]=4 10122 B13R1.45 CC(\N=C\C(F)F)c1ccccc1 Amb27873414 [0,2,0,0,0,0|2,0,0]=4 10123 B13R1.45 CC(\N=C\N(C)C)c1ccccn1 Amb28205104 [0,2,0,0,0,0|1,0,1]=4 10124 B13R1.45 CC(\N=C\N(C)C)c1ccncc1 Amb28293797 [0,2,0,0,0,0|1,0,1]=4 10125 B13R1.45 CN(C)CCC(=O)c1ccccc1 Amb1106335 [0,2,0,0,0,0|1,0,1]=4 10126 B13R1.45 CN(C)CCC(=O)c1ccccc1 Amb1197569 [0,2,0,0,0,0|1,0,1]=4 10127 B13R1.45 CN(C)CCC(=O)c1ccccc1 Amb4421073 [0,2,0,0,0,0|1,0,1]=4 10128 B13R1.45 CN(C)CCC(Cl)c1ccccc1 Amb1108005 [0,2,0,0,0,0|1,0,0]=3 10129 B13R1.45 CN(C)CCC(Cl)c1ccccc1 Amb22754498 [0,2,0,0,0,0|1,0,0]=3 10130 B13R1.45 CN(C)CCC(N)c1ccccc1 Amb13949100 [0,2,0,0,0,0|1,0,0]=3 10131 B13R1.45 CN(C)CCC(N)c1ccccc1 Amb30622860 [0,2,0,0,0,0|1,0,0]=3 10132 B13R1.45 CN(C)CCC(N)c1ccccc1 Amb9751862 [0,2,0,0,0,0|1,0,0]=3 10133 B13R1.45 CN(C)CCC(N)c1cccnc1 Amb32684271 [0,2,0,0,0,0|2,0,0]=4 10134 B13R1.45 CN(C)CCC(O)c1ccccc1 Amb671497 [0,2,0,0,0,0|1,0,0]=3 10135 B13R1.45 CN(C)CCN(C)c1ccccc1 Amb17233495 [0,2,0,0,0,0|1,0,0]=3 10136 B13R1.45 CN(C)CNC(=O)c1ccccc1 Amb10565604 [0,2,0,0,0,0|1,0,1]=4 10137 B13R1.45 CN(C)C\C=C(/N)c1ccccc1 Amb27180265 [0,2,0,0,0,0|1,0,1]=4 10138 B13R1.45 CN(C)C\C=C(\N)c1ccccc1 Amb28051772 [0,2,0,0,0,0|1,0,1]=4 10139 B13R1.45 CN(C)\C=C\C(O)c1ccccc1 Amb27598552 [0,2,0,0,0,0|1,0,1]=4 10140 B13R1.45 C[C@@H](NCC(=O)O)c1ccccc1 Amb17935709 [0,2,0,0,0,0|2,0,0]=4 10141 B13R1.45 C[C@@H](NCC(N)=O)c1ccccc1 Amb24271280 [0,2,0,0,0,0|2,0,0]=4 10142 B13R1.45 C[C@@H](O)\C=C\[C@@H](C)c1ccccc1 Amb27662285 [0,2,0,0,0,0|1,0,1]=4 10143 B13R1.45 C[C@@H](OCC(=O)O)c1ccccc1 Amb32946281 [0,2,0,0,0,0|2,0,0]=4 10144 B13R1.45 C[C@@H](\N=C\C(F)F)c1ccccc1 Amb19883867 [0,2,0,0,0,0|2,0,0]=4 10145 B13R1.45 C[C@H](CNC(N)=S)c1ccccc1 Amb28121696 [0,2,0,0,0,0|0,0,1]=3 10146 B13R1.45 C[C@H](NCC(=O)O)c1ccccc1 Amb17935708 [0,2,0,0,0,0|2,0,0]=4 10147 B13R1.45 C[C@H](O)\C=C\[C@@H](C)c1ccccc1 Amb27790379 [0,2,0,0,0,0|1,0,1]=4 10148 B13R1.45 C[C@H](OCC(=O)O)c1ccccc1 Amb32946283 [0,2,0,0,0,0|2,0,0]=4 10149 B13R1.45 C[C@H](\N=C\C(F)F)c1ccccc1 Amb19883868 [0,2,0,0,0,0|2,0,0]=4 10150 B13R1.45 C\C(=C\NC(C)C)c1ccccc1 Amb28247065 [0,2,0,0,0,0|0,0,2]=4 10151 B13R1.45 N=C(N)NCC(O)c1ccccc1 Amb18804880 [0,2,0,0,0,0|1,0,1]=4 10152 B13R1.45 NC(=O)NCC(O)c1ccccc1 Amb9248137 [0,2,0,0,0,0|1,0,1]=4 10153 B13R1.122 C#CCCC(C)(C)c1ccccc1 Amb33176099 [0,2,0,0,0,0|1,0,1]=4 10154 B13R1.122 C#CCCC(C)(N)c1ccccc1 Amb35658030 [0,2,0,0,0,0|1,0,1]=4 10155 B13R1.122 C#CCNC(C)(C)c1ccccc1 Amb27876605 [0,2,0,0,0,0|1,0,1]=4 10156 B13R1.122 CC#CCC(C)(N)c1ccccc1 Amb35615100 [0,2,0,0,0,0|1,0,0]=3 10157 B13R1.122 CC(C)(CCC#N)c1ccccc1 Amb18127124 [0,2,0,0,0,0|1,0,1]=4 10158 B13R1.122 CC(C)(CCC=O)c1ccccc1 Amb32954721 [0,2,0,0,0,0|1,0,1]=4 10159 B13R1.122 CC(C)(CCCBr)c1ccccc1 Amb33176114 [0,2,0,0,0,0|1,0,0]=3 10160 B13R1.122 CC(C)(CCCN)c1ccccc1 Amb17078754 [0,2,0,0,0,0|1,0,0]=3 10161 B13R1.122 CC(C)(CCCO)c1ccccc1 Amb32950399 [0,2,0,0,0,0|1,0,0]=3 10162 B13R1.122 CC(C)(CCCS)c1ccccc1 Amb33176153 [0,2,0,0,0,0|1,0,0]=3 10163 B13R1.122 CC(C)(CCON)c1ccccc1 Amb33175826 [0,2,0,0,0,0|2,0,0]=4 10164 B13R1.122 CC(C)(CN=C=O)c1ccccc1 Amb10071838 [0,2,0,0,0,0|0,0,2]=4 10165 B13R1.122 CC(C)(CN=C=S)c1ccccc1 Amb10071836 [0,2,0,0,0,0|0,0,2]=4 10166 B13R1.122 CC(C)(CN=[N+]=[N-])c1ccccc1 Amb27841890 [0,2,0,0,0,0|1,0,1]=4 10167 B13R1.122 CC(C)(CNC=O)c1ccccc1 Amb17940315 [0,2,0,0,0,0|0,0,1]=3 10168 B13R1.122 CC(C)(OCCN)c1ccccc1 Amb10790060 [0,2,0,0,0,0|2,0,0]=4 10169 B13R1.122 CC(C)(\C=C\CN)c1ccccc1 Amb33175807 [0,2,0,0,0,0|1,0,1]=4 10170 B13R1.122 CC(C)(\C=C\CO)c1ccccc1 Amb33175805 [0,2,0,0,0,0|1,0,1]=4 10171 B13R1.122 CC(F)(CN=[N+]=[N-])c1ccccc1 Amb27794680 [0,2,0,0,0,0|1,0,1]=4 10172 B13R1.122 CC(N)(C\C=C\Cl)c1ccccc1 Amb35657886 [0,2,0,0,0,0|1,0,1]=4 10173 B13R1.122 CCCOC(C)(C)c1ccccc1 Amb24079810 [0,2,0,0,0,0|1,0,0]=3 10174 B13R1.122 CCNCC(C)(O)c1ccccc1 Amb17138914 [0,2,0,0,0,0|0,0,0]=2 10175 B13R1.122 CCNCC(C)(O)c1ccccn1 Amb18064959 [0,2,0,0,0,0|1,0,0]=3 10176 B13R1.122 CCNCC(C)(O)c1cccnc1 Amb18064574 [0,2,0,0,0,0|1,0,0]=3 10177 B13R1.122 CCNCC(C)(O)c1ccncc1 Amb18064912 [0,2,0,0,0,0|1,0,0]=3 10178 B13R1.122 CNCCC(C)(C)c1ccccc1 Amb19035621 [0,2,0,0,0,0|0,0,0]=2 10179 B13R1.122 CNCCC(F)(F)c1ccccc1 Amb32954281 [0,2,0,0,0,0|1,0,0]=3 10180 B13R1.122 CNCCS(=O)(=O)c1ccccc1 Amb3940948 [0,2,0,0,0,0|2,0,0]=4 10181 B13R1.122 C[Si](C)(CCCO)c1ccccc1 Amb2389336 [0,2,0,0,0,0|1,1,0]=4 10182 B13R1.122 C\C=C\CC(C)(N)c1ccccc1 Amb35643044 [0,2,0,0,0,0|1,0,0]=3 10183 B13R1.122 FC(F)(CCCBr)c1ccccc1 Amb32951252 [0,2,0,0,0,0|2,0,0]=4 10184 B13R1.122 FC(F)(CCCS)c1ccccc1 Amb33082520 [0,2,0,0,0,0|2,0,0]=4 10185 B13R1.122 NCCCC(F)(F)c1ccccc1 Amb33082097 [0,2,0,0,0,0|2,0,0]=4 10186 B13R1.122 OCCCC(F)(F)c1ccccc1 Amb32945090 [0,2,0,0,0,0|2,0,0]=4 10187 B13R1.122 [C-]#[N+]CCC(C)(C)c1ccccc1 Amb33475557 [0,2,0,0,0,0|0,0,2]=4 10188 B13R1.674 C#CCNC(C)c1ccccc1Cl Amb6683613 [0,2,0,0,0,0|1,0,1]=4 10189 B13R1.674 C#CCN[C@H](C)c1ccccc1F Amb27609227 [0,2,0,0,0,0|1,0,1]=4 10190 B13R1.674 C#CCSC(C)c1ccccc1F Amb27605030 [0,2,0,0,0,0|1,0,1]=4 10191 B13R1.674 C=CCNC(C)c1ccccc1Br Amb6683866 [0,2,0,0,0,0|1,0,1]=4 10192 B13R1.674 C=CCNC(C)c1ccccc1C Amb6683905 [0,2,0,0,0,0|1,0,1]=4 10193 B13R1.674 CC#CCC(N)c1ccccc1Br Amb27759149 [0,2,0,0,0,0|2,0,0]=4 10194 B13R1.674 CC#CCC(N)c1ccccc1Cl Amb19062409 [0,2,0,0,0,0|2,0,0]=4 10195 B13R1.674 CC#CCC(O)c1ccccc1Br Amb27210595 [0,2,0,0,0,0|2,0,0]=4 10196 B13R1.674 CC#CCC(O)c1ccccc1C Amb18183852 [0,2,0,0,0,0|2,0,0]=4 10197 B13R1.674 CC#CCN(C)c1ccccc1F Amb27810110 [0,2,0,0,0,0|2,0,0]=4 10198 B13R1.674 CC(CN=C=O)c1ccccc1Br Amb25039031 [0,2,0,0,0,0|0,0,2]=4 10199 B13R1.674 CC(CN=C=O)c1ccccc1F Amb27840944 [0,2,0,0,0,0|0,0,2]=4 10200 B13R1.674 CC(NCCO)c1ccccc1Br Amb7809193 [0,2,0,0,0,0|2,0,0]=4 10201 B13R1.674 CC(NCCO)c1ccccc1F Amb7809196 [0,2,0,0,0,0|2,0,0]=4 10202 B13R1.674 CC(NCCO)c1ccccc1O Amb2721932 [0,2,0,0,0,0|2,0,0]=4 10203 B13R1.674 CC(SCC#N)c1ccccc1Cl Amb27650000 [0,2,0,0,0,0|2,0,0]=4 10204 B13R1.674 CC(SCC#N)c1ccccc1F Amb27397528 [0,2,0,0,0,0|2,0,0]=4 10205 B13R1.674 CCCCC(N)c1ccccc1C Amb18184247 [0,2,0,0,0,0|2,0,0]=4 10206 B13R1.674 CCCCC(N)c1ccccc1C Amb32662438 [0,2,0,0,0,0|2,0,0]=4 10207 B13R1.674 CCCCC(N)c1ccccc1F Amb18791291 [0,2,0,0,0,0|2,0,0]=4 10208 B13R1.674 CCCCN(C)c1ccccc1N Amb6246643 [0,2,0,0,0,0|2,0,0]=4 10209 B13R1.674 CCCNC(C)c1ccccc1Br Amb6264990 [0,2,0,0,0,0|1,0,0]=3 10210 B13R1.674 CCCNC(C)c1ccccc1C Amb6274398 [0,2,0,0,0,0|1,0,0]=3 10211 B13R1.674 CCCNC(C)c1ccccc1Cl Amb6665859 [0,2,0,0,0,0|1,0,0]=3 10212 B13R1.674 CCCNC(C)c1ccccc1F Amb6257107 [0,2,0,0,0,0|1,0,0]=3 10213 B13R1.674 CCC\N=C(\C)c1ccccc1O Amb4020297 [0,2,0,0,0,0|1,0,1]=4 10214 B13R1.674 CCNCC(O)c1ccccc1C Amb17138909 [0,2,0,0,0,0|1,0,0]=3 10215 B13R1.674 CCNCC(O)c1ccccc1Cl Amb17139771 [0,2,0,0,0,0|1,0,0]=3 10216 B13R1.674 CCNCC(O)c1ccccc1F Amb17139058 [0,2,0,0,0,0|1,0,0]=3 10217 B13R1.674 CN(CCCCl)c1ccccc1Br Amb17359053 [0,2,0,0,0,0|2,0,0]=4 10218 B13R1.674 CN(CCCCl)c1ccccc1Cl Amb17340957 [0,2,0,0,0,0|2,0,0]=4 10219 B13R1.674 CN(CCCCl)c1ccccc1F Amb17337712 [0,2,0,0,0,0|2,0,0]=4 10220 B13R1.674 CN(CCCN)c1ccccc1Br Amb17059826 [0,2,0,0,0,0|2,0,0]=4 10221 B13R1.674 CN(CCCN)c1ccccc1Cl Amb17059626 [0,2,0,0,0,0|2,0,0]=4 10222 B13R1.674 CN(CCCN)c1ccccc1F Amb8829264 [0,2,0,0,0,0|2,0,0]=4 10223 B13R1.674 CN(CCCO)c1ccccc1Br Amb17349692 [0,2,0,0,0,0|2,0,0]=4 10224 B13R1.674 CN(CCCO)c1ccccc1Cl Amb17337502 [0,2,0,0,0,0|2,0,0]=4 10225 B13R1.674 CN(CCCO)c1ccccc1F Amb17335627 [0,2,0,0,0,0|2,0,0]=4 10226 B13R1.674 CNCCC(C)c1ccccc1C Amb17233360 [0,2,0,0,0,0|0,0,0]=2 10227 B13R1.674 CNCCC(C)c1ccccc1Cl Amb17236705 [0,2,0,0,0,0|0,0,0]=2 10228 B13R1.674 CNCCC(C)c1ccccc1F Amb17233840 [0,2,0,0,0,0|0,0,0]=2 10229 B13R1.674 CNC\C=C(/C)c1ccccc1C Amb31174808 [0,2,0,0,0,0|0,0,1]=3 10230 B13R1.674 CNC\C=C(/C)c1ccccc1F Amb31174821 [0,2,0,0,0,0|0,0,1]=3 10231 B13R1.674 CNC\C=C(\C)c1ccccc1C Amb27610365 [0,2,0,0,0,0|0,0,1]=3 10232 B13R1.674 CSCCC(O)c1ccccc1Cl Amb32661739 [0,2,0,0,0,0|2,0,0]=4 10233 B13R1.674 C[C@@H](NCC#N)c1ccccc1F Amb27601640 [0,2,0,0,0,0|2,0,0]=4 10234 B13R1.674 C[C@H](NCC#N)c1ccccc1Br Amb27453109 [0,2,0,0,0,0|2,0,0]=4 10235 B13R1.674 C\C=C\CN(C)c1ccccc1F Amb27449034 [0,2,0,0,0,0|2,0,0]=4 10236 B13R1.674 C\C=C\CN(C)c1ccccc1O Amb28400579 [0,2,0,0,0,0|2,0,0]=4 10237 B13R1.674 Cc1ccccc1C(C)CN=C=O Amb26605861 [0,2,0,0,0,0|0,0,2]=4 10238 B13R1.674 Cc1ccccc1C(C)NCCO Amb7809163 [0,2,0,0,0,0|2,0,0]=4 10239 B13R1.674 Cc1ccccc1C(O)CCCN Amb17233564 [0,2,0,0,0,0|2,0,0]=4 10240 B13R1.674 Cc1ccccc1N(C)CCCCl Amb17337269 [0,2,0,0,0,0|2,0,0]=4 10241 B13R1.674 Cc1ccccc1N(C)CCCN Amb9209871 [0,2,0,0,0,0|2,0,0]=4 10242 B13R1.674 Cc1ccccc1N(C)CCCO Amb17335358 [0,2,0,0,0,0|2,0,0]=4 10243 B13R1.674 NCCCC(O)c1ccccc1Br Amb18577254 [0,2,0,0,0,0|2,0,0]=4 10244 B13R1.674 NCCCC(O)c1ccccc1Cl Amb17237033 [0,2,0,0,0,0|2,0,0]=4 10245 B13R1.674 NCCCC(O)c1ccccc1F Amb17233987 [0,2,0,0,0,0|2,0,0]=4 10246 B13R1.86 C#CC(NN)C(C)c1ccccc1 Amb35711148 [0,2,0,0,0,0|1,0,0]=3 10247 B13R1.86 CC(c1ccccc1)C(CN)CO Amb33362234 [0,2,0,0,0,0|2,0,0]=4 10248 B13R1.86 CCC(CC)C(N)c1ccccc1 Amb6255035 [0,2,0,0,0,0|2,0,0]=4 10249 B13R1.86 CCC(CN)C(O)c1ccccc1 Amb32693635 [0,2,0,0,0,0|2,0,0]=4 10250 B13R1.86 CCC(NC)C(=O)c1ccccc1 Amb17621424 [0,2,0,0,0,0|1,0,1]=4 10251 B13R1.86 CCC(NC)C(O)c1ccccc1 Amb18604539 [0,2,0,0,0,0|1,0,0]=3 10252 B13R1.86 CC[C@@H](C#N)[C@@H](O)c1ccccc1 Amb27484816 [0,2,0,0,0,0|2,0,0]=4 10253 B13R1.86 CNC(C#N)C(C)c1ccccc1 Amb18975499 [0,2,0,0,0,0|0,0,0]=2 10254 B13R1.86 COC(OC)C(N)c1ccccc1 Amb33548321 [0,2,0,0,0,0|2,0,0]=4 10255 B13R1.86 COC(OC)C(O)c1ccccc1 Amb29845522 [0,2,0,0,0,0|2,0,0]=4 10256 B13R1.86 C\N=C(\NC)N(C)c1ccccc1 Amb28130495 [0,2,0,0,0,0|1,0,1]=4 10257 B13R1.152 BN(C)C(C)C(Cl)c1ccccc1 Amb27169118 [0,2,0,0,0,0|1,0,0]=3 10258 B13R1.152 BN(C)[C@H](C)[C@@H](Cl)c1ccccc1 Amb27876394 [0,2,0,0,0,0|1,0,0]=3 10259 B13R1.152 C=C(C)C(=O)C(C)c1ccccc1 Amb27267154 [0,2,0,0,0,0|1,0,1]=4 10260 B13R1.152 C=C(C)C(O)C(N)c1ccccc1 Amb29875677 [0,2,0,0,0,0|2,0,0]=4 10261 B13R1.152 C=C(C)[C@@H](C)[C@H](O)c1ccccc1 Amb27486556 [0,2,0,0,0,0|2,0,0]=4 10262 B13R1.152 C=C(C)[C@H](C)[C@@H](O)c1ccccc1 Amb28061921 [0,2,0,0,0,0|2,0,0]=4 10263 B13R1.152 C=C(C)[C@H](C)[C@H](O)c1ccccc1 Amb27394813 [0,2,0,0,0,0|2,0,0]=4 10264 B13R1.152 C=C(C)[C@H](O)[C@@H](C)c1ccccc1 Amb27761634 [0,2,0,0,0,0|1,0,0]=3 10265 B13R1.152 CC(=O)C(Br)C(Br)c1ccccc1 Amb2610167 [0,2,0,0,0,0|2,0,0]=4 10266 B13R1.152 CC(=O)C(Br)C(C)c1cccnc1 Amb27475734 [0,2,0,0,0,0|2,0,0]=4 10267 B13R1.152 CC(=O)C(Cl)C(Cl)c1ccccc1 Amb27623863 [0,2,0,0,0,0|2,0,0]=4 10268 B13R1.152 CC(=O)C(F)C(O)c1ccccc1 Amb28294136 [0,2,0,0,0,0|2,0,0]=4 10269 B13R1.152 CC(=O)[C@@H](Cl)[C@@H](O)c1ccccc1 Amb28076748 [0,2,0,0,0,0|2,0,0]=4 10270 B13R1.152 CC(=O)[C@@H](Cl)[C@H](O)c1ccccc1 Amb28252413 [0,2,0,0,0,0|2,0,0]=4 10271 B13R1.152 CC(=O)[C@H](Cl)[C@H](Cl)c1ccccc1 Amb27390157 [0,2,0,0,0,0|2,0,0]=4 10272 B13R1.152 CC(=O)[C@H](Cl)[C@H](O)c1ccccc1 Amb28121183 [0,2,0,0,0,0|2,0,0]=4 10273 B13R1.152 CC(=O)[C@H](O)[C@@H](O)c1ccccc1 Amb27660884 [0,2,0,0,0,0|2,0,0]=4 10274 B13R1.152 CC(C(=N)N(C)C)c1ccccc1 Amb35715675 [0,2,0,0,0,0|0,0,1]=3 10275 B13R1.152 CC(C(=O)O)C(C)c1ccccc1 Amb6360544 [0,2,0,0,0,0|2,0,0]=4 10276 B13R1.152 CC(C(=O)c1ccccc1)N(C)C Amb8384821 [0,2,0,0,0,0|1,0,1]=4 10277 B13R1.152 CC(C(Cl)c1ccccc1)N(C)C Amb27392377 [0,2,0,0,0,0|1,0,0]=3 10278 B13R1.152 CC(C(O)c1ccccc1)N(C)O Amb28189465 [0,2,0,0,0,0|1,0,0]=3 10279 B13R1.152 CC(C(O)c1ccccc1)[NH+](C)C Amb2388354 [0,2,0,0,0,0|1,0,1]=4 10280 B13R1.152 CC(C)C(Br)C(C)c1ccccc1 Amb27951183 [0,2,0,0,0,0|1,0,0]=3 10281 B13R1.152 CC(C)C(N)C(O)c1ccccc1 Amb17138913 [0,2,0,0,0,0|2,0,0]=4 10282 B13R1.152 CC(C)C(O)C(C)c1ccncc1 Amb27771422 [0,2,0,0,0,0|2,0,0]=4 10283 B13R1.152 CC(C)C(O)C(N)c1ccccc1 Amb33531271 [0,2,0,0,0,0|2,0,0]=4 10284 B13R1.152 CC(C)[C@@H](N)C(O)c1ccccc1 Amb35623667 [0,2,0,0,0,0|2,0,0]=4 10285 B13R1.152 CC(C)[C@@H](O)[C@@H](O)c1ccccc1 Amb27617821 [0,2,0,0,0,0|2,0,0]=4 10286 B13R1.152 CC(C)[C@H](C)[C@@H](O)c1ccccc1 Amb27484757 [0,2,0,0,0,0|2,0,0]=4 10287 B13R1.152 CC(C)[C@H](C)[C@H](O)c1ccccc1 Amb28207390 [0,2,0,0,0,0|2,0,0]=4 10288 B13R1.152 CC(C)[C@H](N)C(O)c1ccccc1 Amb27201305 [0,2,0,0,0,0|2,0,0]=4 10289 B13R1.152 CC(C)[C@H](N)[C@H](O)c1ccccc1 Amb27180072 [0,2,0,0,0,0|2,0,0]=4 10290 B13R1.152 CC(C)[C@H](O)[C@@H](O)c1ccccc1 Amb27486212 [0,2,0,0,0,0|2,0,0]=4 10291 B13R1.152 CC(N)C(=O)C(C)c1ccccc1 Amb26459039 [0,2,0,0,0,0|1,0,1]=4 10292 B13R1.152 CC(N)C(C)C(O)c1ccccc1 Amb35624683 [0,2,0,0,0,0|2,0,0]=4 10293 B13R1.152 CC(N)C(N)C(O)c1ccccc1 Amb25189862 [0,2,0,0,0,0|2,0,0]=4 10294 B13R1.152 CC(N)C(N)C(O)c1ccccc1 Amb32662531 [0,2,0,0,0,0|2,0,0]=4 10295 B13R1.152 CC(c1ccccc1)C(N)C(=O)O Amb10072242 [0,2,0,0,0,0|2,0,0]=4 10296 B13R1.152 CC(c1ccccc1)C(N)C(=O)O Amb2696733 [0,2,0,0,0,0|2,0,0]=4 10297 B13R1.152 CC(c1ccccc1)C(N)C(F)F Amb28318298 [0,2,0,0,0,0|2,0,0]=4 10298 B13R1.152 CC(c1ccccc1)C(N)C(N)=O Amb18975500 [0,2,0,0,0,0|2,0,0]=4 10299 B13R1.152 CC(c1ccccc1)C(N)C(N)=O Amb33552324 [0,2,0,0,0,0|2,0,0]=4 10300 B13R1.152 CC(c1ccccc1)C(O)C(=O)O Amb33537959 [0,2,0,0,0,0|2,0,0]=4 10301 B13R1.152 CC(c1ccccc1)C(O)C(F)F Amb26376487 [0,2,0,0,0,0|2,0,0]=4 10302 B13R1.152 CC(c1ccccc1)[C@@H](C)C(=O)O Amb33744674 [0,2,0,0,0,0|2,0,0]=4 10303 B13R1.152 CC(c1ccccc1)[C@H](C)C(=O)O Amb33744350 [0,2,0,0,0,0|2,0,0]=4 10304 B13R1.152 CC(c1ccccc1)[C@H](N)C(=O)O Amb2694835 [0,2,0,0,0,0|2,0,0]=4 10305 B13R1.152 CN(C)C(=O)C(Cl)c1ccccc1 Amb1106097 [0,2,0,0,0,0|1,0,1]=4 10306 B13R1.152 CN(C)C(=O)C(F)c1ccccc1 Amb2614493 [0,2,0,0,0,0|1,0,1]=4 10307 B13R1.152 CN(C)C(=O)C(N)c1ccccc1 Amb10609379 [0,2,0,0,0,0|1,0,1]=4 10308 B13R1.152 CN(C)C(=O)C(N)c1ccccc1 Amb9718610 [0,2,0,0,0,0|1,0,1]=4 10309 B13R1.152 CN(C)C(=O)C(O)c1ccccc1 Amb17400708 [0,2,0,0,0,0|1,0,1]=4 10310 B13R1.152 CN(C)C(=O)[C@@H](N)c1ccccc1 Amb17233442 [0,2,0,0,0,0|1,0,1]=4 10311 B13R1.152 CN(C)C(=O)[C@@H](O)c1ccccc1 Amb25795435 [0,2,0,0,0,0|1,0,1]=4 10312 B13R1.152 CN(C)C(=O)[C@H](Cl)c1ccccc1 Amb28193702 [0,2,0,0,0,0|1,0,1]=4 10313 B13R1.152 CN(C)C(=O)[C@H](O)c1ccccc1 Amb27980458 [0,2,0,0,0,0|1,0,1]=4 10314 B13R1.152 CN(C)C(O)C(=O)c1ccccc1 Amb27599342 [0,2,0,0,0,0|1,0,1]=4 10315 B13R1.152 CN(O)C(=O)C(O)c1ccccc1 Amb28077821 [0,2,0,0,0,0|1,0,1]=4 10316 B13R1.152 CN(O)C(=O)[C@@H](N)c1ccccc1 Amb27216398 [0,2,0,0,0,0|1,0,1]=4 10317 B13R1.152 CN(O)C(=O)[C@H](N)c1ccccc1 Amb27216399 [0,2,0,0,0,0|1,0,1]=4 10318 B13R1.152 C[C@@H](C(=O)O)[C@@H](C)c1ccccc1 Amb27407054 [0,2,0,0,0,0|2,0,0]=4 10319 B13R1.152 C[C@@H](C(=O)c1ccccc1)N(C)C Amb27861373 [0,2,0,0,0,0|1,0,1]=4 10320 B13R1.152 C[C@@H](O)[C@@H](C)[C@@H](O)c1ccccc1 Amb27665209 [0,2,0,0,0,0|2,0,0]=4 10321 B13R1.152 C[C@@H]([C@@H](C)O)[C@@H](O)c1ccccc1 Amb27406983 [0,2,0,0,0,0|2,0,0]=4 10322 B13R1.152 C[C@@H]([C@@H](N)c1ccccc1)N(C)C Amb27180205 [0,2,0,0,0,0|1,0,0]=3 10323 B13R1.152 C[C@@H]([C@@H](O)c1ccccc1)N(C)C Amb10844736 [0,2,0,0,0,0|1,0,0]=3 10324 B13R1.152 C[C@@H]([C@H](Cl)c1ccccc1)N(C)C Amb27955200 [0,2,0,0,0,0|1,0,0]=3 10325 B13R1.152 C[C@@H]([C@H](O)c1ccccc1)N(C)C Amb3940113 [0,2,0,0,0,0|1,0,0]=3 10326 B13R1.152 C[C@@H]([C@H](O)c1ccccc1)N(C)N Amb27753054 [0,2,0,0,0,0|1,0,0]=3 10327 B13R1.152 C[C@@H]([C@H](O)c1ccccc1)N(C)O Amb27972558 [0,2,0,0,0,0|1,0,0]=3 10328 B13R1.152 C[C@@H]([C@H](O)c1ccccc1)[NH+](C)C Amb28463793 [0,2,0,0,0,0|1,0,1]=4 10329 B13R1.152 C[C@@H](c1ccccc1)C(N)C(=O)O Amb27645474 [0,2,0,0,0,0|2,0,0]=4 10330 B13R1.152 C[C@@H](c1ccccc1)[C@H](N)C(=O)O Amb4021752 [0,2,0,0,0,0|2,0,0]=4 10331 B13R1.152 C[C@H](C(=O)O)[C@H](C)c1ccccc1 Amb28244756 [0,2,0,0,0,0|2,0,0]=4 10332 B13R1.152 C[C@H](O)[C@@H](C)[C@H](O)c1ccccc1 Amb27197964 [0,2,0,0,0,0|2,0,0]=4 10333 B13R1.152 C[C@H](O)[C@H](C)[C@@H](N)c1ccccc1 Amb27179082 [0,2,0,0,0,0|2,0,0]=4 10334 B13R1.152 C[C@H]([C@@H](C)O)[C@@H](N)c1ccccc1 Amb27777185 [0,2,0,0,0,0|2,0,0]=4 10335 B13R1.152 C[C@H]([C@@H](O)c1ccccc1)N(C)C Amb6357237 [0,2,0,0,0,0|1,0,0]=3 10336 B13R1.152 C[C@H]([C@H](O)c1ccccc1)N(C)C Amb8387313 [0,2,0,0,0,0|1,0,0]=3 10337 B13R1.152 C[C@H](c1ccccc1)[C@@H](N)C(=O)O Amb22801136 [0,2,0,0,0,0|2,0,0]=4 10338 B13R1.152 C[C@H](c1ccccc1)[C@H](N)C(=O)O Amb28243568 [0,2,0,0,0,0|2,0,0]=4 10339 B13R1.263 C#CC(C)(C)C(C)c1ccccc1 Amb33081867 [0,2,0,0,0,0|1,0,1]=4 10340 B13R1.263 CC(C)(NO)C(O)c1ccccc1 Amb24376632 [0,2,0,0,0,0|2,0,0]=4 10341 B13R1.263 CC(c1ccccc1)C(C)(C)C#N Amb17333812 [0,2,0,0,0,0|2,0,0]=4 10342 B13R1.263 CC(c1ccccc1)C(C)(C)C=O Amb25125280 [0,2,0,0,0,0|2,0,0]=4 10343 B13R1.263 CC(c1ccccc1)C(C)(C)CBr Amb33081861 [0,2,0,0,0,0|2,0,0]=4 10344 B13R1.263 CC(c1ccccc1)C(C)(C)CN Amb17333855 [0,2,0,0,0,0|2,0,0]=4 10345 B13R1.263 CC(c1ccccc1)C(C)(C)CO Amb28341231 [0,2,0,0,0,0|2,0,0]=4 10346 B13R1.263 CC(c1ccccc1)C(C)(C)ON Amb33081870 [0,2,0,0,0,0|2,0,0]=4 10347 B13R1.263 CC(c1ccccc1)C(C)(N)CO Amb33081891 [0,2,0,0,0,0|2,0,0]=4 10348 B13R1.263 CC(c1ccccc1)C(C)(O)CN Amb33081889 [0,2,0,0,0,0|2,0,0]=4 10349 B13R1.263 CC(c1ccccc1)C(F)(F)CN Amb33081834 [0,2,0,0,0,0|2,0,0]=4 10350 B13R1.263 CC(c1ccccc1)C(F)(F)CO Amb33081616 [0,2,0,0,0,0|2,0,0]=4 10351 B13R1.263 CCC(C)(C)C(Cl)c1ccccc1 Amb27208277 [0,2,0,0,0,0|2,0,0]=4 10352 B13R1.263 CCC(C)(F)C(N)c1ccccc1 Amb27587277 [0,2,0,0,0,0|2,0,0]=4 10353 B13R1.263 CCC(C)(F)[C@H](N)c1ccccc1 Amb27752028 [0,2,0,0,0,0|2,0,0]=4 10354 B13R1.263 CCC(C)(N)C(O)c1ccccc1 Amb35587088 [0,2,0,0,0,0|2,0,0]=4 10355 B13R1.263 CCC(C)(O)C(O)c1ccccc1 Amb28041348 [0,2,0,0,0,0|2,0,0]=4 10356 B13R1.263 CCC(F)(F)C(Br)c1ccccc1 Amb35609812 [0,2,0,0,0,0|2,0,0]=4 10357 B13R1.263 CCC(F)(F)C(Cl)c1ccccc1 Amb35609823 [0,2,0,0,0,0|2,0,0]=4 10358 B13R1.263 CCC(F)(F)C(N)c1ccccc1 Amb27404603 [0,2,0,0,0,0|2,0,0]=4 10359 B13R1.263 CCC(F)(F)C(O)c1ccccc1 Amb35645005 [0,2,0,0,0,0|2,0,0]=4 10360 B13R1.263 CCS(=O)(=O)C(C)c1ccccc1 Amb27982757 [0,2,0,0,0,0|2,0,0]=4 10361 B13R1.263 CC[C@@](C)(F)[C@H](N)c1ccccc1 Amb28243532 [0,2,0,0,0,0|2,0,0]=4 10362 B13R1.263 CNC(C)(C)C(C)c1ccccc1 Amb33081912 [0,2,0,0,0,0|0,0,0]=2 10363 B13R1.263 CNS(=O)(=O)C(C)c1ccccc1 Amb26571049 [0,2,0,0,0,0|1,0,0]=3 10364 B13R1.263 CNS(=O)(=O)C(C)c1ccccn1 Amb22301399 [0,2,0,0,0,0|2,0,0]=4 10365 B13R1.263 CNS(=O)(=O)C(C)c1cccnc1 Amb32691939 [0,2,0,0,0,0|2,0,0]=4 10366 B13R1.263 CNS(=O)(=O)C(C)c1ccncc1 Amb32691936 [0,2,0,0,0,0|2,0,0]=4 10367 B13R1.263 COS(=O)(=O)C(C)c1ccccc1 Amb4035765 [0,2,0,0,0,0|2,0,0]=4 10368 B13R1.696 CC(CN)C(C)c1ccccc1F Amb27873695 [0,2,0,0,0,0|2,0,0]=4 10369 B13R1.696 CC(CO)C(C)c1ccccc1F Amb33743276 [0,2,0,0,0,0|2,0,0]=4 10370 B13R1.696 CC(c1ccccc1Br)C(N)CO Amb27636544 [0,2,0,0,0,0|2,0,0]=4 10371 B13R1.696 CC(c1ccccc1Cl)C(N)CO Amb28286765 [0,2,0,0,0,0|2,0,0]=4 10372 B13R1.696 CC(c1ccccc1F)[C@@H](C)CN Amb33727855 [0,2,0,0,0,0|2,0,0]=4 10373 B13R1.696 CC(c1ccccc1F)[C@@H](C)CO Amb33746685 [0,2,0,0,0,0|2,0,0]=4 10374 B13R1.696 CC(c1ccccc1F)[C@H](C)CN Amb33739861 [0,2,0,0,0,0|2,0,0]=4 10375 B13R1.696 CC(c1ccccc1F)[C@H](C)CO Amb33730471 [0,2,0,0,0,0|2,0,0]=4 10376 B13R1.696 CCC(C)C(Cl)c1ccccc1C Amb27658972 [0,2,0,0,0,0|2,0,0]=4 10377 B13R1.696 CCC(C)N(C)c1ccccc1F Amb27826203 [0,2,0,0,0,0|2,0,0]=4 10378 B13R1.696 CCC(C)N(C)c1ccccc1O Amb27749774 [0,2,0,0,0,0|2,0,0]=4 10379 B13R1.696 CCC(C)[C@@H](N)c1ccccc1Br Amb27985363 [0,2,0,0,0,0|2,0,0]=4 10380 B13R1.696 CCC(C)[C@@H](N)c1ccccc1Cl Amb28055869 [0,2,0,0,0,0|2,0,0]=4 10381 B13R1.696 CCC(C)[C@H](N)c1ccccc1O Amb28384636 [0,2,0,0,0,0|2,0,0]=4 10382 B13R1.696 CCC(N)C(C)c1ccccc1Cl Amb27807135 [0,2,0,0,0,0|1,0,0]=3 10383 B13R1.696 CCC(N)C(C)n1ccccc1=O Amb1137295 [0,2,0,0,0,0|2,0,0]=4 10384 B13R1.696 CCC(N)C(N)c1ccccc1Br Amb27776919 [0,2,0,0,0,0|2,0,0]=4 10385 B13R1.696 CCC(N)C(N)c1ccccc1C Amb27874518 [0,2,0,0,0,0|2,0,0]=4 10386 B13R1.696 CCC(N)C(N)c1ccccc1F Amb27792163 [0,2,0,0,0,0|2,0,0]=4 10387 B13R1.696 CCC(N)C(N)c1ccccc1I Amb27430385 [0,2,0,0,0,0|2,0,0]=4 10388 B13R1.696 CCC(N)C(N)c1ccccc1O Amb27430308 [0,2,0,0,0,0|2,0,0]=4 10389 B13R1.696 CCC(N)C(O)c1ccccc1F Amb19149127 [0,2,0,0,0,0|2,0,0]=4 10390 B13R1.696 CCC(N)C(O)c1ccccc1F Amb9429017 [0,2,0,0,0,0|2,0,0]=4 10391 B13R1.696 CCC(O)C(N)c1ccccc1Br Amb28281808 [0,2,0,0,0,0|2,0,0]=4 10392 B13R1.696 CCC(O)C(N)c1ccccc1Cl Amb27617875 [0,2,0,0,0,0|2,0,0]=4 10393 B13R1.696 CC[C@@H](N)C(O)c1ccccc1C Amb35659373 [0,2,0,0,0,0|2,0,0]=4 10394 B13R1.696 CC[C@@H](N)C(O)c1ccccc1Cl Amb35659338 [0,2,0,0,0,0|2,0,0]=4 10395 B13R1.696 CC[C@@H](N)C(O)c1ccccc1F Amb35659339 [0,2,0,0,0,0|2,0,0]=4 10396 B13R1.696 CC[C@@H](N)[C@@H](O)c1ccccc1Br Amb27445501 [0,2,0,0,0,0|2,0,0]=4 10397 B13R1.696 CC[C@@H](N)[C@@H](O)c1ccccc1C Amb27445509 [0,2,0,0,0,0|2,0,0]=4 10398 B13R1.696 CC[C@@H](N)[C@H](O)c1ccccc1Br Amb27205110 [0,2,0,0,0,0|2,0,0]=4 10399 B13R1.696 CC[C@@H](N)[C@H](O)c1ccccc1C Amb27430242 [0,2,0,0,0,0|2,0,0]=4 10400 B13R1.696 CC[C@@H](N)[C@H](O)c1ccccc1N Amb27964149 [0,2,0,0,0,0|2,0,0]=4 10401 B13R1.696 CC[C@@H](O)[C@@H](N)c1ccccc1Br Amb28289649 [0,2,0,0,0,0|2,0,0]=4 10402 B13R1.696 CC[C@@H](O)[C@@H](N)c1ccccc1F Amb28256732 [0,2,0,0,0,0|2,0,0]=4 10403 B13R1.696 CC[C@H](N)C(O)c1ccccc1C Amb35601234 [0,2,0,0,0,0|2,0,0]=4 10404 B13R1.696 CC[C@H](N)C(O)c1ccccc1Cl Amb35601342 [0,2,0,0,0,0|2,0,0]=4 10405 B13R1.696 CC[C@H](N)C(O)c1ccccc1F Amb35601343 [0,2,0,0,0,0|2,0,0]=4 10406 B13R1.696 CC[C@H](N)[C@@H](N)c1ccccc1C Amb28384672 [0,2,0,0,0,0|2,0,0]=4 10407 B13R1.696 CC[C@H](N)[C@@H](N)c1ccccc1Cl Amb27430304 [0,2,0,0,0,0|2,0,0]=4 10408 B13R1.696 CC[C@H](N)[C@@H](N)c1ccccc1I Amb27785046 [0,2,0,0,0,0|2,0,0]=4 10409 B13R1.696 CC[C@H](N)[C@@H](N)c1ccccc1O Amb27620451 [0,2,0,0,0,0|2,0,0]=4 10410 B13R1.696 CC[C@H](N)[C@@H](O)c1ccccc1Cl Amb27430474 [0,2,0,0,0,0|2,0,0]=4 10411 B13R1.696 CC[C@H](N)[C@@H](O)c1ccccc1F Amb27630528 [0,2,0,0,0,0|2,0,0]=4 10412 B13R1.696 CC[C@H](N)[C@H](O)c1ccccc1Br Amb27792205 [0,2,0,0,0,0|2,0,0]=4 10413 B13R1.696 CC[C@H](O)[C@H](N)c1ccccc1C Amb28348708 [0,2,0,0,0,0|2,0,0]=4 10414 B13R1.696 CNC(=N)N(C)c1ccccc1C Amb18184202 [0,2,0,0,0,0|1,0,1]=4 10415 B13R1.696 CNC(=O)C(C)c1ccccc1C Amb27179428 [0,2,0,0,0,0|0,0,1]=3 10416 B13R1.696 CNC(=O)C(C)c1ccccc1Cl Amb2444727 [0,2,0,0,0,0|0,0,1]=3 10417 B13R1.696 CNC(=O)C(Cl)c1ccccc1F Amb27812873 [0,2,0,0,0,0|1,0,1]=4 10418 B13R1.696 CNC(=O)C(N)c1ccccc1Br Amb27143467 [0,2,0,0,0,0|1,0,1]=4 10419 B13R1.696 CNC(=O)C(N)c1ccccc1C Amb25127837 [0,2,0,0,0,0|1,0,1]=4 10420 B13R1.696 CNC(=O)C(N)c1ccccc1Cl Amb24733869 [0,2,0,0,0,0|1,0,1]=4 10421 B13R1.696 CNC(=O)C(N)c1ccccc1F Amb28188743 [0,2,0,0,0,0|1,0,1]=4 10422 B13R1.696 CNC(=O)C(O)c1ccccc1Br Amb27196729 [0,2,0,0,0,0|1,0,1]=4 10423 B13R1.696 CNC(=O)C(O)c1ccccc1C Amb25949513 [0,2,0,0,0,0|1,0,1]=4 10424 B13R1.696 CNC(=O)C(O)c1ccccc1F Amb25936901 [0,2,0,0,0,0|1,0,1]=4 10425 B13R1.696 CNC(=O)N(C)c1ccccc1N Amb27250412 [0,2,0,0,0,0|1,0,1]=4 10426 B13R1.696 CNC(=O)[C@H](O)c1ccccc1Cl Amb27457359 [0,2,0,0,0,0|1,0,1]=4 10427 B13R1.696 CNC(=S)N(C)c1ccccc1I Amb12197138 [0,2,0,0,0,0|1,0,1]=4 10428 B13R1.696 CNC(C)C(=O)c1ccccc1Br Amb26514902 [0,2,0,0,0,0|1,0,1]=4 10429 B13R1.696 CNC(C)C(=O)c1ccccc1C Amb25836669 [0,2,0,0,0,0|1,0,1]=4 10430 B13R1.696 CNC(C)C(=O)c1ccccc1F Amb25228402 [0,2,0,0,0,0|1,0,1]=4 10431 B13R1.696 CNC(C)C(C)c1ccccc1Br Amb27949357 [0,2,0,0,0,0|0,0,0]=2 10432 B13R1.696 CNC(C)C(O)c1ccccc1C Amb35741407 [0,2,0,0,0,0|1,0,0]=3 10433 B13R1.696 CNC(C)C(O)c1ccccc1F Amb35621407 [0,2,0,0,0,0|1,0,0]=3 10434 B13R1.696 CNC(C)C(O)c1cccnc1N Amb35621615 [0,2,0,0,0,0|2,0,0]=4 10435 B13R1.696 CNC(C)C(O)c1ccncc1F Amb35624559 [0,2,0,0,0,0|2,0,0]=4 10436 B13R1.696 CNC(C)C(O)c1cnccc1C Amb35741400 [0,2,0,0,0,0|2,0,0]=4 10437 B13R1.696 CNC(C)C(O)c1cnccc1N Amb35621603 [0,2,0,0,0,0|2,0,0]=4 10438 B13R1.696 CN[C@@H](C)C(=O)c1ccccc1C Amb35659960 [0,2,0,0,0,0|1,0,1]=4 10439 B13R1.696 CN[C@@H](C)C(=O)c1ccccc1Cl Amb29891464 [0,2,0,0,0,0|1,0,1]=4 10440 B13R1.696 CN[C@@H](C)C(=O)c1ccccc1F Amb35659965 [0,2,0,0,0,0|1,0,1]=4 10441 B13R1.696 CN[C@@H](C)C(O)c1ccccc1C Amb35662207 [0,2,0,0,0,0|1,0,0]=3 10442 B13R1.696 CN[C@@H](C)C(O)c1ccccc1Cl Amb35662568 [0,2,0,0,0,0|1,0,0]=3 10443 B13R1.696 CN[C@@H](C)C(O)c1ccccc1F Amb35662596 [0,2,0,0,0,0|1,0,0]=3 10444 B13R1.696 CN[C@@H](C)C(O)c1cccnc1N Amb29891490 [0,2,0,0,0,0|2,0,0]=4 10445 B13R1.696 CN[C@@H](C)C(O)c1ccncc1F Amb35659714 [0,2,0,0,0,0|2,0,0]=4 10446 B13R1.696 CN[C@@H](C)C(O)c1cnccc1C Amb30038954 [0,2,0,0,0,0|2,0,0]=4 10447 B13R1.696 CN[C@@H](C)C(O)c1cnccc1N Amb29891489 [0,2,0,0,0,0|2,0,0]=4 10448 B13R1.696 CN[C@@H](C)[C@H](O)c1ccccc1Cl Amb27793498 [0,2,0,0,0,0|1,0,0]=3 10449 B13R1.696 CN[C@H](C)[C@@H](O)c1ccccc1Cl Amb28123192 [0,2,0,0,0,0|1,0,0]=3 10450 B13R1.696 COC(=O)C(C)c1ccccc1Br Amb24597051 [0,2,0,0,0,0|1,0,1]=4 10451 B13R1.696 COC(=O)C(C)c1ccccc1C Amb18184315 [0,2,0,0,0,0|1,0,1]=4 10452 B13R1.696 COC(=O)C(C)c1ccccc1Cl Amb19084563 [0,2,0,0,0,0|1,0,1]=4 10453 B13R1.696 COC(=O)C(C)c1ccccc1F Amb18187069 [0,2,0,0,0,0|1,0,1]=4 10454 B13R1.696 COC(=O)C(C)c1ccccc1O Amb24343860 [0,2,0,0,0,0|1,0,1]=4 10455 B13R1.696 COC(C)C(C)c1ccccc1N Amb27864034 [0,2,0,0,0,0|1,0,0]=3 10456 B13R1.696 COC(C)C(O)c1ccccc1C Amb27458098 [0,2,0,0,0,0|2,0,0]=4 10457 B13R1.696 Cc1ccccc1C(C)C(C)CN Amb25068214 [0,2,0,0,0,0|2,0,0]=4 10458 B13R1.696 Cc1ccccc1C(C)C(C)CO Amb26963342 [0,2,0,0,0,0|2,0,0]=4 10459 B13R1.696 Cc1ccccc1C(C)C(N)CO Amb27438722 [0,2,0,0,0,0|2,0,0]=4 10460 B13R1.696 Cc1ccccc1C(C)C(O)CN Amb27621648 [0,2,0,0,0,0|2,0,0]=4 10461 B13R1.696 Cc1ccccc1C(C)[C@@H](C)CN Amb33744943 [0,2,0,0,0,0|2,0,0]=4 10462 B13R1.696 Cc1ccccc1C(C)[C@@H](C)CO Amb33736431 [0,2,0,0,0,0|2,0,0]=4 10463 B13R1.696 Cc1ccccc1C(C)[C@H](C)CN Amb33730085 [0,2,0,0,0,0|2,0,0]=4 10464 B13R1.696 Cc1ccccc1C(C)[C@H](C)CO Amb33738439 [0,2,0,0,0,0|2,0,0]=4 10465 B13R1.708 C#CC(C)C(C)(C)c1ccccc1 Amb33175840 [0,2,0,0,0,0|1,0,1]=4 10466 B13R1.708 C#CC(O)C(C)(C)c1ccccc1 Amb27853335 [0,2,0,0,0,0|1,0,1]=4 10467 B13R1.708 C#CC(O)C(C)(N)c1ccccc1 Amb35621397 [0,2,0,0,0,0|1,0,1]=4 10468 B13R1.708 C=CC(O)C(C)(C)c1ccccc1 Amb27452117 [0,2,0,0,0,0|1,0,1]=4 10469 B13R1.708 C=C[C@@H](C)[C@@](C)(N)c1ccccc1 Amb27415676 [0,2,0,0,0,0|1,0,1]=4 10470 B13R1.708 C=C[C@H](C)[C@@](C)(N)c1ccccc1 Amb27389997 [0,2,0,0,0,0|1,0,1]=4 10471 B13R1.708 CC(C#N)C(C)(C)c1ccccc1 Amb18127125 [0,2,0,0,0,0|2,0,0]=4 10472 B13R1.708 CC(C#N)C(C)(O)c1ccccc1 Amb598103 [0,2,0,0,0,0|2,0,0]=4 10473 B13R1.708 CC(C)(C(=O)NN)c1ccccc1 Amb6252519 [0,2,0,0,0,0|1,0,1]=4 10474 B13R1.708 CC(C)(C(=O)NO)c1ccccc1 Amb6258583 [0,2,0,0,0,0|1,0,1]=4 10475 B13R1.708 CC(C)(c1ccccc1)C(F)CN Amb33475526 [0,2,0,0,0,0|2,0,0]=4 10476 B13R1.708 CC(C)(c1ccccc1)C(N)CO Amb25829518 [0,2,0,0,0,0|2,0,0]=4 10477 B13R1.708 CC(C)(c1ccccc1)C(O)CBr Amb33175847 [0,2,0,0,0,0|2,0,0]=4 10478 B13R1.708 CC(C)(c1ccccc1)C(O)CCl Amb33175845 [0,2,0,0,0,0|2,0,0]=4 10479 B13R1.708 CC(C)(c1ccccc1)C(O)CF Amb33175850 [0,2,0,0,0,0|2,0,0]=4 10480 B13R1.708 CC(C)(c1ccccc1)C(O)CN Amb27772654 [0,2,0,0,0,0|2,0,0]=4 10481 B13R1.708 CC(C)(c1ccccc1)C(O)CO Amb27775456 [0,2,0,0,0,0|2,0,0]=4 10482 B13R1.708 CC(C)(c1ccccc1)[C@@H](N)CO Amb33175801 [0,2,0,0,0,0|2,0,0]=4 10483 B13R1.708 CC(C)(c1ccccc1)[C@@H](O)CN Amb33175797 [0,2,0,0,0,0|2,0,0]=4 10484 B13R1.708 CC(C)(c1ccccc1)[C@H](N)CO Amb26563715 [0,2,0,0,0,0|2,0,0]=4 10485 B13R1.708 CC(C)(c1ccccc1)[C@H](O)CN Amb33175800 [0,2,0,0,0,0|2,0,0]=4 10486 B13R1.708 CC(C=O)C(C)(C)c1ccccc1 Amb27949663 [0,2,0,0,0,0|2,0,0]=4 10487 B13R1.708 CC(CBr)C(C)(C)c1ccccc1 Amb33175833 [0,2,0,0,0,0|2,0,0]=4 10488 B13R1.708 CC(CN)C(C)(C)c1ccccc1 Amb33475497 [0,2,0,0,0,0|2,0,0]=4 10489 B13R1.708 CC(CN)C(C)(O)c1ccccc1 Amb27207211 [0,2,0,0,0,0|2,0,0]=4 10490 B13R1.708 CC(CO)C(C)(C)c1ccccc1 Amb26943202 [0,2,0,0,0,0|2,0,0]=4 10491 B13R1.708 CC(CO)C(C)(N)c1ccccc1 Amb35648872 [0,2,0,0,0,0|2,0,0]=4 10492 B13R1.708 CC(CO)C(C)(O)c1ccccc1 Amb27485895 [0,2,0,0,0,0|2,0,0]=4 10493 B13R1.708 CC(F)(c1ccccc1)C(N)C#N Amb27984751 [0,2,0,0,0,0|2,0,0]=4 10494 B13R1.708 CC(F)(c1ccccc1)C(O)C#N Amb27169945 [0,2,0,0,0,0|2,0,0]=4 10495 B13R1.708 CC(F)(c1ccccc1)C(O)CN Amb27618446 [0,2,0,0,0,0|2,0,0]=4 10496 B13R1.708 CC(N)(C(=O)NN)c1ccccc1 Amb27765439 [0,2,0,0,0,0|1,0,1]=4 10497 B13R1.708 CC(O)(C(=O)NN)c1ccccc1 Amb28410448 [0,2,0,0,0,0|1,0,1]=4 10498 B13R1.708 CC(ON)C(C)(C)c1ccccc1 Amb33175839 [0,2,0,0,0,0|2,0,0]=4 10499 B13R1.708 CCC(=O)C(C)(C)c1ccccc1 Amb18790765 [0,2,0,0,0,0|1,0,1]=4 10500 B13R1.708 CCC(C)C(C)(O)c1ccccn1 Amb27781185 [0,2,0,0,0,0|2,0,0]=4 10501 B13R1.708 CCC(N)C(C)(C)c1ccccc1 Amb18303249 [0,2,0,0,0,0|1,0,0]=3 10502 B13R1.708 CCC(N)[Si](C)(C)c1ccccc1 Amb28123465 [0,2,0,0,0,0|1,1,0]=4 10503 B13R1.708 CCC(O)C(C)(C)c1ccccc1 Amb18178607 [0,2,0,0,0,0|1,0,0]=3 10504 B13R1.708 CCC(O)C(C)(N)c1ccccc1 Amb35584277 [0,2,0,0,0,0|1,0,0]=3 10505 B13R1.708 CCC(O)C(C)(O)c1cccnc1 Amb27617828 [0,2,0,0,0,0|2,0,0]=4 10506 B13R1.708 CNC(=N)C(C)(C)c1ccccc1 Amb27460930 [0,2,0,0,0,0|0,0,1]=3 10507 B13R1.708 CNC(=O)C(C)(C)c1ccccc1 Amb8333371 [0,2,0,0,0,0|0,0,1]=3 10508 B13R1.708 CNC(=O)C(C)(C)c1cccnc1 Amb27599056 [0,2,0,0,0,0|1,0,1]=4 10509 B13R1.708 CNC(=O)C(C)(O)c1ccccc1 Amb28068753 [0,2,0,0,0,0|0,0,1]=3 10510 B13R1.708 CNC(C)C(C)(O)c1ccccc1 Amb27209525 [0,2,0,0,0,0|0,0,0]=2 10511 B13R1.708 CN[C@H](C)[C@@](C)(O)c1ccccc1 Amb27848220 [0,2,0,0,0,0|0,0,0]=2 10512 B13R1.708 COC(=N)C(C)(C)c1ccccc1 Amb18790848 [0,2,0,0,0,0|1,0,1]=4 10513 B13R1.708 COC(=O)C(C)(C)c1ccccc1 Amb8386963 [0,2,0,0,0,0|1,0,1]=4 10514 B13R1.708 COC(=O)C(C)(N)c1ccccc1 Amb17400717 [0,2,0,0,0,0|1,0,1]=4 10515 B13R1.708 COC(=O)C(C)(N)c1ccccc1 Amb19373026 [0,2,0,0,0,0|1,0,1]=4 10516 B13R1.708 COC(=O)C(C)(O)c1ccccc1 Amb18186543 [0,2,0,0,0,0|1,0,1]=4 10517 B13R1.708 COC(=O)[C@@](C)(N)c1ccccc1 Amb25251449 [0,2,0,0,0,0|1,0,1]=4 10518 B13R1.708 COC(=O)[C@](C)(N)c1ccccc1 Amb27426844 [0,2,0,0,0,0|1,0,1]=4 10519 B13R1.708 COC(C)C(C)(O)c1cccnc1 Amb28077579 [0,2,0,0,0,0|2,0,0]=4 10520 B13R1.708 COC(O)C(F)(F)c1ccccc1 Amb27456654 [0,2,0,0,0,0|2,0,0]=4 10521 B13R1.708 C[C@@H](CN)C(C)(C)c1ccccc1 Amb33727428 [0,2,0,0,0,0|2,0,0]=4 10522 B13R1.708 C[C@@H](CO)C(C)(C)c1ccccc1 Amb33735561 [0,2,0,0,0,0|2,0,0]=4 10523 B13R1.708 C[C@@H](CO)[C@](C)(O)c1ccccc1 Amb28207310 [0,2,0,0,0,0|2,0,0]=4 10524 B13R1.708 C[C@H](CN)C(C)(C)c1ccccc1 Amb33747425 [0,2,0,0,0,0|2,0,0]=4 10525 B13R1.708 C[C@H](CO)C(C)(C)c1ccccc1 Amb33730455 [0,2,0,0,0,0|2,0,0]=4 10526 B13R1.708 [C-]#[N+]C(C)C(C)(C)c1ccccc1 Amb33481074 [0,2,0,0,0,0|0,0,2]=4 10527 B13R1.347 C=C(C)CC(C)(N)c1ccccc1 Amb35634479 [0,2,0,0,0,0|1,0,0]=3 10528 B13R1.347 CC(=O)CC(C)(C)c1ccccc1 Amb811346 [0,2,0,0,0,0|1,0,0]=3 10529 B13R1.347 CC(=O)CC(C)(C)c1cccnc1 Amb27410188 [0,2,0,0,0,0|2,0,0]=4 10530 B13R1.347 CC(=O)CC(F)(F)c1ccccc1 Amb26566665 [0,2,0,0,0,0|2,0,0]=4 10531 B13R1.347 CC(=O)C[C@@](C)(O)c1ccccc1 Amb27272759 [0,2,0,0,0,0|1,0,0]=3 10532 B13R1.347 CC(Br)CC(C)(C)c1ccccc1 Amb25900694 [0,2,0,0,0,0|1,0,0]=3 10533 B13R1.347 CC(Br)CC(F)(F)c1ccccc1 Amb33082219 [0,2,0,0,0,0|2,0,0]=4 10534 B13R1.347 CC(C)(CC(=N)N)c1ccccc1 Amb33176133 [0,2,0,0,0,0|2,0,0]=4 10535 B13R1.347 CC(C)(CC(=O)O)c1ccccc1 Amb2796286 [0,2,0,0,0,0|2,0,0]=4 10536 B13R1.347 CC(C)(CC(N)=O)c1ccccc1 Amb27415506 [0,2,0,0,0,0|2,0,0]=4 10537 B13R1.347 CC(C)(CC(N)=S)c1ccccc1 Amb33176135 [0,2,0,0,0,0|2,0,0]=4 10538 B13R1.347 CC(C)(C[N+](=O)[O-])c1ccccc1 Amb33175809 [0,2,0,0,0,0|1,0,1]=4 10539 B13R1.347 CC(C)CC(C)(O)c1ccccn1 Amb2694620 [0,2,0,0,0,0|2,0,0]=4 10540 B13R1.347 CC(C)C[C@@](C)(N)c1ccccc1 Amb28195640 [0,2,0,0,0,0|1,0,0]=3 10541 B13R1.347 CC(C)SC(C)(C)c1ccccc1 Amb28454155 [0,2,0,0,0,0|2,0,0]=4 10542 B13R1.347 CC(Cl)CC(C)(C)c1cccnc1 Amb27180443 [0,2,0,0,0,0|2,0,0]=4 10543 B13R1.347 CC(F)(CC(=O)O)c1ccccc1 Amb27209896 [0,2,0,0,0,0|2,0,0]=4 10544 B13R1.347 CC(N)(CC(=O)O)c1ccccc1 Amb17470595 [0,2,0,0,0,0|2,0,0]=4 10545 B13R1.347 CC(N)(CC(F)F)c1ccccc1 Amb35702426 [0,2,0,0,0,0|2,0,0]=4 10546 B13R1.347 CC(N)(CC(N)=O)c1ccccc1 Amb33253965 [0,2,0,0,0,0|2,0,0]=4 10547 B13R1.347 CC(N)CC(C)(C)c1ccccc1 Amb17622184 [0,2,0,0,0,0|1,0,0]=3 10548 B13R1.347 CC(N)CC(C)(C)c1ccccc1 Amb5740122 [0,2,0,0,0,0|1,0,0]=3 10549 B13R1.347 CC(N)CC(C)(O)c1ccccc1 Amb30029429 [0,2,0,0,0,0|1,0,0]=3 10550 B13R1.347 CC(N)CC(F)(F)c1ccccc1 Amb27786058 [0,2,0,0,0,0|2,0,0]=4 10551 B13R1.347 CC(O)(CC(=O)O)c1ccccc1 Amb17138952 [0,2,0,0,0,0|2,0,0]=4 10552 B13R1.347 CC(O)(CC(N)=S)c1ccccc1 Amb28384362 [0,2,0,0,0,0|2,0,0]=4 10553 B13R1.347 CC(O)CC(C)(C)c1ccccc1 Amb4020671 [0,2,0,0,0,0|1,0,0]=3 10554 B13R1.347 CC(O)CC(C)(N)c1ccccc1 Amb30030899 [0,2,0,0,0,0|1,0,0]=3 10555 B13R1.347 CC(O)CC(F)(F)c1ccccc1 Amb27169919 [0,2,0,0,0,0|2,0,0]=4 10556 B13R1.347 CC(S)CC(C)(C)c1ccccc1 Amb32788621 [0,2,0,0,0,0|1,0,0]=3 10557 B13R1.347 CN(O)CC(C)(C)c1ccccc1 Amb33475503 [0,2,0,0,0,0|0,0,0]=2 10558 B13R1.347 CN(O)CC(F)(F)c1ccccc1 Amb33081931 [0,2,0,0,0,0|1,0,0]=3 10559 B13R1.347 C[C@@H](N)CC(C)(C)c1ccccc1 Amb33175818 [0,2,0,0,0,0|1,0,0]=3 10560 B13R1.347 C[C@@H](N)CC(F)(F)c1ccccc1 Amb33082386 [0,2,0,0,0,0|2,0,0]=4 10561 B13R1.347 C[C@@H](O)CC(C)(C)c1ccccc1 Amb33175830 [0,2,0,0,0,0|1,0,0]=3 10562 B13R1.347 C[C@@H](O)CC(C)(O)c1ccccc1 Amb27164429 [0,2,0,0,0,0|1,0,0]=3 10563 B13R1.347 C[C@@H](O)CC(F)(F)c1ccccc1 Amb33082389 [0,2,0,0,0,0|2,0,0]=4 10564 B13R1.347 C[C@@H](O)C[C@](C)(O)c1ccccc1 Amb27653211 [0,2,0,0,0,0|1,0,0]=3 10565 B13R1.347 C[C@H](N)CC(C)(C)c1ccccc1 Amb33175825 [0,2,0,0,0,0|1,0,0]=3 10566 B13R1.347 C[C@H](N)CC(F)(F)c1ccccc1 Amb33082387 [0,2,0,0,0,0|2,0,0]=4 10567 B13R1.347 C[C@H](O)CC(C)(C)c1ccccc1 Amb33175828 [0,2,0,0,0,0|1,0,0]=3 10568 B13R1.347 C[C@H](O)CC(F)(F)c1ccccc1 Amb33082388 [0,2,0,0,0,0|2,0,0]=4 10569 B13R1.347 C[C@](N)(CC(=O)O)c1ccccc1 Amb27471858 [0,2,0,0,0,0|2,0,0]=4 10570 B13R1.2819 C#CCC(C)(O)c1ccccc1C Amb25070803 [0,2,0,0,0,0|1,0,1]=4 10571 B13R1.2819 C#CCC(C)(O)c1ccccc1Cl Amb27475456 [0,2,0,0,0,0|1,0,1]=4 10572 B13R1.2819 C#CCC(C)(O)c1ccccc1F Amb24554529 [0,2,0,0,0,0|1,0,1]=4 10573 B13R1.2819 C=CCC(C)(N)c1ccccc1Br Amb27494784 [0,2,0,0,0,0|1,0,1]=4 10574 B13R1.2819 C=CCC(C)(N)c1ccccc1Cl Amb28293016 [0,2,0,0,0,0|1,0,1]=4 10575 B13R1.2819 C=CCC(C)(N)c1ccccc1F Amb27410660 [0,2,0,0,0,0|1,0,1]=4 10576 B13R1.2819 C=CCC(C)(O)c1ccccc1C Amb27772068 [0,2,0,0,0,0|1,0,1]=4 10577 B13R1.2819 C=CCC(C)(O)c1ccccc1F Amb27982214 [0,2,0,0,0,0|1,0,1]=4 10578 B13R1.2819 C=CC[C@@](C)(N)c1ccccc1Br Amb27236987 [0,2,0,0,0,0|1,0,1]=4 10579 B13R1.2819 C=CC[C@@](C)(N)c1ccccc1O Amb27852460 [0,2,0,0,0,0|1,0,1]=4 10580 B13R1.2819 C=CC[C@@](C)(O)c1ccccc1O Amb28202350 [0,2,0,0,0,0|1,0,1]=4 10581 B13R1.2819 C=CC[C@](C)(N)c1ccccc1C Amb27851146 [0,2,0,0,0,0|1,0,1]=4 10582 B13R1.2819 CC(C)(CC=O)c1ccccc1Cl Amb28252349 [0,2,0,0,0,0|2,0,0]=4 10583 B13R1.2819 CC(C)(CCN)c1ccccc1Br Amb33387589 [0,2,0,0,0,0|2,0,0]=4 10584 B13R1.2819 CC(C)(CCN)c1ccccc1Cl Amb17236689 [0,2,0,0,0,0|2,0,0]=4 10585 B13R1.2819 CC(C)(CCN)c1ccccc1F Amb17233827 [0,2,0,0,0,0|2,0,0]=4 10586 B13R1.2819 CC(C)(CCN)c1ccccc1O Amb27173676 [0,2,0,0,0,0|2,0,0]=4 10587 B13R1.2819 CC(C)(CCO)c1ccccc1O Amb25130610 [0,2,0,0,0,0|2,0,0]=4 10588 B13R1.2819 CC(C)(CON)c1ccccc1Br Amb27463635 [0,2,0,0,0,0|2,0,0]=4 10589 B13R1.2819 CC(C)(CON)c1ccccc1Cl Amb28369913 [0,2,0,0,0,0|2,0,0]=4 10590 B13R1.2819 CC(C)(CON)c1ccccc1F Amb26563236 [0,2,0,0,0,0|2,0,0]=4 10591 B13R1.2819 CC(C)(CON)c1ccccc1O Amb33196418 [0,2,0,0,0,0|2,0,0]=4 10592 B13R1.2819 CC(F)(CC#N)c1ccccc1F Amb27977727 [0,2,0,0,0,0|2,0,0]=4 10593 B13R1.2819 CC(F)(CCN)c1ccccc1Br Amb28436449 [0,2,0,0,0,0|2,0,0]=4 10594 B13R1.2819 CC(F)(CCN)c1ccccc1O Amb27646897 [0,2,0,0,0,0|2,0,0]=4 10595 B13R1.2819 CC(N)(CC#N)c1ccccc1Br Amb27654103 [0,2,0,0,0,0|2,0,0]=4 10596 B13R1.2819 CC(N)(CCO)c1ccccc1Cl Amb18864252 [0,2,0,0,0,0|2,0,0]=4 10597 B13R1.2819 CC(N)(CCO)c1ccccc1F Amb18224778 [0,2,0,0,0,0|2,0,0]=4 10598 B13R1.2819 CC(N)(CCO)c1ccccc1N Amb28342357 [0,2,0,0,0,0|2,0,0]=4 10599 B13R1.2819 CC(O)(CC#N)c1ccccc1Br Amb27812960 [0,2,0,0,0,0|2,0,0]=4 10600 B13R1.2819 CC(O)(CC#N)c1ccccc1F Amb28043608 [0,2,0,0,0,0|2,0,0]=4 10601 B13R1.2819 CC(O)(CC=O)c1ccccc1Br Amb28140387 [0,2,0,0,0,0|2,0,0]=4 10602 B13R1.2819 CC(O)(CC=O)c1ccccc1F Amb28249920 [0,2,0,0,0,0|2,0,0]=4 10603 B13R1.2819 CC(O)(CCN)c1ccccc1Br Amb26869885 [0,2,0,0,0,0|2,0,0]=4 10604 B13R1.2819 CC(O)(CCN)c1ccccc1Cl Amb18066530 [0,2,0,0,0,0|2,0,0]=4 10605 B13R1.2819 CC(O)(CCN)c1ccccc1F Amb18909327 [0,2,0,0,0,0|2,0,0]=4 10606 B13R1.2819 CC(O)(CCN)c1ccccc1O Amb27879120 [0,2,0,0,0,0|2,0,0]=4 10607 B13R1.2819 CCCC(C)(O)c1ccccc1C Amb9676788 [0,2,0,0,0,0|1,0,0]=3 10608 B13R1.2819 CCCC(C)(O)c1cccnc1Br Amb35702775 [0,2,0,0,0,0|2,0,0]=4 10609 B13R1.2819 CCCC(C)(O)c1cccnc1N Amb28128670 [0,2,0,0,0,0|2,0,0]=4 10610 B13R1.2819 CCCC(C)(O)c1cnccc1C Amb27609472 [0,2,0,0,0,0|2,0,0]=4 10611 B13R1.2819 CCNC(C)(C)c1ccccc1Br Amb28453918 [0,2,0,0,0,0|2,0,0]=4 10612 B13R1.2819 CNCC(C)(C)c1ccccc1C Amb17233329 [0,2,0,0,0,0|0,0,0]=2 10613 B13R1.2819 CNCC(C)(C)c1ccccc1Cl Amb17236690 [0,2,0,0,0,0|0,0,0]=2 10614 B13R1.2819 CNCC(C)(C)c1ccccc1F Amb17233828 [0,2,0,0,0,0|0,0,0]=2 10615 B13R1.2819 CNCC(C)(O)c1ccccc1C Amb18997533 [0,2,0,0,0,0|0,0,0]=2 10616 B13R1.2819 CNCC(C)(O)c1cccnc1N Amb28189635 [0,2,0,0,0,0|1,0,0]=3 10617 B13R1.2819 CNCC(F)(F)c1ccccc1Br Amb28145551 [0,2,0,0,0,0|1,0,0]=3 10618 B13R1.2819 CNCC(F)(F)c1ccccc1Cl Amb27618547 [0,2,0,0,0,0|1,0,0]=3 10619 B13R1.2819 COCC(C)(N)c1ccccc1Br Amb27663724 [0,2,0,0,0,0|1,0,0]=3 10620 B13R1.2819 COCC(C)(N)c1ccccc1Cl Amb18299363 [0,2,0,0,0,0|1,0,0]=3 10621 B13R1.2819 COCC(C)(O)c1ccccc1Cl Amb18333908 [0,2,0,0,0,0|1,0,0]=3 10622 B13R1.2819 COCC(C)(O)c1ccccc1F Amb19074708 [0,2,0,0,0,0|1,0,0]=3 10623 B13R1.2819 COCC(C)(O)c1ccccc1O Amb27826424 [0,2,0,0,0,0|1,0,0]=3 10624 B13R1.2819 COCC(C)(O)c1cccnc1Br Amb35702792 [0,2,0,0,0,0|2,0,0]=4 10625 B13R1.2819 COCC(C)(O)c1cccnc1N Amb27244979 [0,2,0,0,0,0|2,0,0]=4 10626 B13R1.2819 COCC(C)(O)c1ccncc1F Amb27610146 [0,2,0,0,0,0|2,0,0]=4 10627 B13R1.2819 COCC(C)(O)c1cnccc1C Amb27800484 [0,2,0,0,0,0|2,0,0]=4 10628 B13R1.2819 COCC(F)(F)c1ccccc1N Amb27205659 [0,2,0,0,0,0|2,0,0]=4 10629 B13R1.2819 C[C@@](N)(CC#N)c1ccccc1Br Amb27402622 [0,2,0,0,0,0|2,0,0]=4 10630 B13R1.2819 C[C@@](N)(CC#N)c1ccccc1Cl Amb27972040 [0,2,0,0,0,0|2,0,0]=4 10631 B13R1.2819 C[C@@](N)(CCO)c1ccccc1Cl Amb27162663 [0,2,0,0,0,0|2,0,0]=4 10632 B13R1.2819 C[C@@](N)(CCO)c1ccccc1S Amb28124749 [0,2,0,0,0,0|2,0,0]=4 10633 B13R1.2819 C[C@](N)(CCO)c1ccccc1Br Amb27401074 [0,2,0,0,0,0|2,0,0]=4 10634 B13R1.2819 C[C@](N)(CCO)c1ccccc1Cl Amb27749948 [0,2,0,0,0,0|2,0,0]=4 10635 B13R1.2819 C[C@](N)(CCO)c1ccccc1O Amb27827902 [0,2,0,0,0,0|2,0,0]=4 10636 B13R1.2819 Cc1ccccc1C(C)(C)CCN Amb17233328 [0,2,0,0,0,0|2,0,0]=4 10637 B13R1.2819 Cc1ccccc1C(C)(C)CCO Amb28061693 [0,2,0,0,0,0|2,0,0]=4 10638 B13R1.2819 Cc1ccccc1C(C)(C)CON Amb27946791 [0,2,0,0,0,0|2,0,0]=4 10639 B13R1.2819 Cc1ccccc1C(C)(F)CCN Amb28434784 [0,2,0,0,0,0|2,0,0]=4 10640 B13R1.2819 Cc1ccccc1C(C)(N)CCO Amb18862950 [0,2,0,0,0,0|2,0,0]=4 10641 B13R1.2819 Cc1ccccc1C(C)(O)CCN Amb18065880 [0,2,0,0,0,0|2,0,0]=4 10642 B13R1.201 C=C(C)CC(Cl)c1ccccc1Cl Amb28042893 [0,2,0,0,0,0|2,0,0]=4 10643 B13R1.201 C=C(C)CC(O)c1ccccc1Br Amb28454898 [0,2,0,0,0,0|2,0,0]=4 10644 B13R1.201 C=C(C)CN(C)c1ccccc1N Amb27245341 [0,2,0,0,0,0|2,0,0]=4 10645 B13R1.201 C=C(C)C[C@@H](N)c1ccccc1Cl Amb27447313 [0,2,0,0,0,0|2,0,0]=4 10646 B13R1.201 C=C(C)C[C@@H](N)c1ccccc1I Amb27788457 [0,2,0,0,0,0|2,0,0]=4 10647 B13R1.201 C=C(C)C[C@H](N)c1ccccc1C Amb28132463 [0,2,0,0,0,0|2,0,0]=4 10648 B13R1.201 C=C(C)C[C@H](N)c1ccccc1O Amb27620372 [0,2,0,0,0,0|2,0,0]=4 10649 B13R1.201 CC(=O)CC(C)c1ccccc1F Amb28243768 [0,2,0,0,0,0|1,0,0]=3 10650 B13R1.201 CC(=O)CC(C)c1ccccc1O Amb28054397 [0,2,0,0,0,0|1,0,0]=3 10651 B13R1.201 CC(=O)CC(C)c1ccncc1C Amb28141301 [0,2,0,0,0,0|2,0,0]=4 10652 B13R1.201 CC(=O)CC(C)c1ccncc1F Amb27948253 [0,2,0,0,0,0|2,0,0]=4 10653 B13R1.201 CC(=O)CC(C)c1cnccc1N Amb28243718 [0,2,0,0,0,0|2,0,0]=4 10654 B13R1.201 CC(=O)CC(O)c1ccccc1F Amb27432175 [0,2,0,0,0,0|2,0,0]=4 10655 B13R1.201 CC(=O)CN(C)c1ccccc1C Amb18790845 [0,2,0,0,0,0|2,0,0]=4 10656 B13R1.201 CC(=O)CN(C)c1ccccc1F Amb18791227 [0,2,0,0,0,0|2,0,0]=4 10657 B13R1.201 CC(=O)NC(C)c1ccccc1Br Amb13955929 [0,2,0,0,0,0|2,0,0]=4 10658 B13R1.201 CC(=O)NC(C)c1ccccc1O Amb25275237 [0,2,0,0,0,0|2,0,0]=4 10659 B13R1.201 CC(=O)N[C@H](C)c1ccccc1F Amb28315366 [0,2,0,0,0,0|2,0,0]=4 10660 B13R1.201 CC(=O)OC(C)c1ccccc1Br Amb28206970 [0,2,0,0,0,0|2,0,0]=4 10661 B13R1.201 CC(=O)OC(C)c1ccccc1F Amb27220410 [0,2,0,0,0,0|2,0,0]=4 10662 B13R1.201 CC(=O)O[C@@H](C)c1ccccc1Cl Amb27255128 [0,2,0,0,0,0|2,0,0]=4 10663 B13R1.201 CC(Br)CC(C)c1ccccc1F Amb28324627 [0,2,0,0,0,0|1,0,0]=3 10664 B13R1.201 CC(C)=CC(C)c1ccccc1N Amb28368209 [0,2,0,0,0,0|1,0,1]=4 10665 B13R1.201 CC(C)CC(C)c1ccccc1N Amb27152226 [0,2,0,0,0,0|1,0,0]=3 10666 B13R1.201 CC(C)CC(C)c1cnccc1N Amb27853302 [0,2,0,0,0,0|2,0,0]=4 10667 B13R1.201 CC(C)CC(C)c1ncccc1N Amb28242817 [0,2,0,0,0,0|2,0,0]=4 10668 B13R1.201 CC(C)CC(N)c1ccccc1Cl Amb17236702 [0,2,0,0,0,0|2,0,0]=4 10669 B13R1.201 CC(C)CC(N)c1ccccc1F Amb17233837 [0,2,0,0,0,0|2,0,0]=4 10670 B13R1.201 CC(C)CC(N)c1ccccc1N Amb17608154 [0,2,0,0,0,0|2,0,0]=4 10671 B13R1.201 CC(C)CC(O)c1ccccc1Cl Amb17236852 [0,2,0,0,0,0|2,0,0]=4 10672 B13R1.201 CC(C)CC(O)c1ccccc1F Amb17233911 [0,2,0,0,0,0|2,0,0]=4 10673 B13R1.201 CC(C)CN(C)c1ccccc1F Amb27388390 [0,2,0,0,0,0|2,0,0]=4 10674 B13R1.201 CC(C)C[C@@H](N)c1ccccc1Cl Amb27440515 [0,2,0,0,0,0|2,0,0]=4 10675 B13R1.201 CC(C)C[C@@H](N)c1ccccc1I Amb28142334 [0,2,0,0,0,0|2,0,0]=4 10676 B13R1.201 CC(C)C[C@@H](N)c1ccccc1O Amb27489189 [0,2,0,0,0,0|2,0,0]=4 10677 B13R1.201 CC(C)C[C@H](N)c1ccccc1I Amb27440431 [0,2,0,0,0,0|2,0,0]=4 10678 B13R1.201 CC(C)NC(C)c1ccccc1Br Amb6685450 [0,2,0,0,0,0|2,0,0]=4 10679 B13R1.201 CC(C)NC(C)c1ccccc1Cl Amb6685429 [0,2,0,0,0,0|2,0,0]=4 10680 B13R1.201 CC(C)NC(C)c1ccccc1F Amb6685445 [0,2,0,0,0,0|2,0,0]=4 10681 B13R1.201 CC(C)NC(C)c1ccccc1O Amb6685434 [0,2,0,0,0,0|2,0,0]=4 10682 B13R1.201 CC(C)N[C@@H](C)c1ccccc1Cl Amb28383995 [0,2,0,0,0,0|2,0,0]=4 10683 B13R1.201 CC(C)N[C@H](C)c1ccccc1F Amb27166941 [0,2,0,0,0,0|2,0,0]=4 10684 B13R1.201 CC(C)OC(C)c1ccccc1O Amb27256530 [0,2,0,0,0,0|2,0,0]=4 10685 B13R1.201 CC(C)SC(C)c1ccccc1Br Amb27586094 [0,2,0,0,0,0|2,0,0]=4 10686 B13R1.201 CC(C)SC(C)c1ccccc1F Amb27586095 [0,2,0,0,0,0|2,0,0]=4 10687 B13R1.201 CC(CC(=O)O)c1ccccc1Br Amb19293241 [0,2,0,0,0,0|2,0,0]=4 10688 B13R1.201 CC(CC(=O)O)c1ccccc1Cl Amb17236833 [0,2,0,0,0,0|2,0,0]=4 10689 B13R1.201 CC(CC(=O)O)c1ccccc1F Amb6749215 [0,2,0,0,0,0|2,0,0]=4 10690 B13R1.201 CC(CC(=O)O)c1ccccc1I Amb16210922 [0,2,0,0,0,0|2,0,0]=4 10691 B13R1.201 CC(CC(=O)O)c1ccccc1N Amb27398428 [0,2,0,0,0,0|2,0,0]=4 10692 B13R1.201 CC(CC(=O)O)c1ccccc1O Amb25779942 [0,2,0,0,0,0|2,0,0]=4 10693 B13R1.201 CC(CC(N)=O)c1ccccc1Br Amb28345259 [0,2,0,0,0,0|2,0,0]=4 10694 B13R1.201 CC(CC(N)=O)c1ccccc1Cl Amb17236668 [0,2,0,0,0,0|2,0,0]=4 10695 B13R1.201 CC(CC(N)=O)c1ccccc1F Amb17233789 [0,2,0,0,0,0|2,0,0]=4 10696 B13R1.201 CC(Cl)CC(C)c1ccccc1Cl Amb28243717 [0,2,0,0,0,0|1,0,0]=3 10697 B13R1.201 CC(Cl)CC(C)c1cccnc1N Amb27857659 [0,2,0,0,0,0|2,0,0]=4 10698 B13R1.201 CC(N)CC(C)c1cccnc1N Amb28318830 [0,2,0,0,0,0|2,0,0]=4 10699 B13R1.201 CC(N)CC(C)c1cnccc1N Amb27606098 [0,2,0,0,0,0|2,0,0]=4 10700 B13R1.201 CC(N)CC(O)c1ccccc1Br Amb28122640 [0,2,0,0,0,0|2,0,0]=4 10701 B13R1.201 CC(N)CC(O)c1ccccc1Cl Amb27609230 [0,2,0,0,0,0|2,0,0]=4 10702 B13R1.201 CC(N)CN(C)c1ccccc1Br Amb26907335 [0,2,0,0,0,0|2,0,0]=4 10703 B13R1.201 CC(N)CN(C)c1ccccc1Cl Amb17059703 [0,2,0,0,0,0|2,0,0]=4 10704 B13R1.201 CC(N)CN(C)c1ccccc1F Amb17059700 [0,2,0,0,0,0|2,0,0]=4 10705 B13R1.201 CC(NN(C)C)c1ccccc1Cl Amb28059427 [0,2,0,0,0,0|1,0,0]=3 10706 B13R1.201 CC(NN(C)C)c1ccccc1F Amb27825965 [0,2,0,0,0,0|1,0,0]=3 10707 B13R1.201 CC(O)CC(C)c1ccccc1Cl Amb28069703 [0,2,0,0,0,0|1,0,0]=3 10708 B13R1.201 CC(O)CC(C)c1cnccc1N Amb28138683 [0,2,0,0,0,0|2,0,0]=4 10709 B13R1.201 CC(O)CN(C)c1ccccc1Br Amb17349691 [0,2,0,0,0,0|2,0,0]=4 10710 B13R1.201 CC(O)CN(C)c1ccccc1Cl Amb17337501 [0,2,0,0,0,0|2,0,0]=4 10711 B13R1.201 CC(O)CN(C)c1ccccc1F Amb17335626 [0,2,0,0,0,0|2,0,0]=4 10712 B13R1.201 CC(O)CN(C)c1ccccc1I Amb27188638 [0,2,0,0,0,0|2,0,0]=4 10713 B13R1.201 CN(C)CC(=O)c1ccccc1N Amb27954261 [0,2,0,0,0,0|1,0,1]=4 10714 B13R1.201 CN(C)CC(Cl)c1ccccc1F Amb2608953 [0,2,0,0,0,0|1,0,0]=3 10715 B13R1.201 CN(C)CC(Cl)c1ccccc1I Amb2614506 [0,2,0,0,0,0|1,0,0]=3 10716 B13R1.201 CN(C)CC(F)c1ccccc1N Amb28189413 [0,2,0,0,0,0|1,0,0]=3 10717 B13R1.201 CN(C)CC(F)c1ccccc1O Amb27448126 [0,2,0,0,0,0|1,0,0]=3 10718 B13R1.201 CN(C)CC(N)c1ccccc1Br Amb25071594 [0,2,0,0,0,0|1,0,0]=3 10719 B13R1.201 CN(C)CC(N)c1ccccc1F Amb1130761 [0,2,0,0,0,0|1,0,0]=3 10720 B13R1.201 CN(C)CC(N)c1cccnc1N Amb27238333 [0,2,0,0,0,0|2,0,0]=4 10721 B13R1.201 CN(C)CC(O)c1ccccc1Cl Amb2614499 [0,2,0,0,0,0|1,0,0]=3 10722 B13R1.201 CN(C)CC(O)c1ccccc1F Amb17104285 [0,2,0,0,0,0|1,0,0]=3 10723 B13R1.201 CN(C)CC(O)c1ccccc1I Amb2614508 [0,2,0,0,0,0|1,0,0]=3 10724 B13R1.201 C[C@@H](N)CN(C)c1ccccc1F Amb27772489 [0,2,0,0,0,0|2,0,0]=4 10725 B13R1.201 C[C@H](N)CN(C)c1ccccc1F Amb27411667 [0,2,0,0,0,0|2,0,0]=4 10726 B13R1.201 C\C(=N\N(C)C)c1ccccc1Br Amb27977520 [0,2,0,0,0,0|1,0,1]=4 10727 B13R1.201 C\C(=N\N(C)C)c1ccccc1F Amb27809360 [0,2,0,0,0,0|1,0,1]=4 10728 B13R1.201 Cc1ccccc1C(C)CC(=O)O Amb33528476 [0,2,0,0,0,0|2,0,0]=4 10729 B13R1.201 Cc1ccccc1C(C)CC(C)O Amb27397078 [0,2,0,0,0,0|1,0,0]=3 10730 B13R1.201 Cc1ccccc1C(C)CC(N)=O Amb17233287 [0,2,0,0,0,0|2,0,0]=4 10731 B13R1.201 Cc1ccccc1C(C)NC(C)C Amb6685487 [0,2,0,0,0,0|2,0,0]=4 10732 B13R1.201 Cc1ccccc1C(Cl)CC(C)C Amb27589204 [0,2,0,0,0,0|2,0,0]=4 10733 B13R1.201 Cc1ccccc1C(N)CC(C)C Amb17233357 [0,2,0,0,0,0|2,0,0]=4 10734 B13R1.201 Cc1ccccc1C(N)CN(C)C Amb1125486 [0,2,0,0,0,0|1,0,0]=3 10735 B13R1.201 Cc1ccccc1C(N)CN(C)C Amb31217565 [0,2,0,0,0,0|1,0,0]=3 10736 B13R1.201 Cc1ccccc1C(O)CC(C)C Amb17233447 [0,2,0,0,0,0|2,0,0]=4 10737 B13R1.201 Cc1ccccc1C(O)CC(C)N Amb28201410 [0,2,0,0,0,0|2,0,0]=4 10738 B13R1.201 Cc1ccccc1C(O)CN(C)C Amb17104282 [0,2,0,0,0,0|1,0,0]=3 10739 B13R1.201 Cc1ccccc1N(C)CC(C)N Amb17059697 [0,2,0,0,0,0|2,0,0]=4 10740 B13R1.201 Cc1ccccc1N(C)CC(C)O Amb17335357 [0,2,0,0,0,0|2,0,0]=4 10741 B13R1.201 Cc1ccccc1N(C)C[C@@H](C)O Amb27482237 [0,2,0,0,0,0|2,0,0]=4 10742 B13R1.201 Cc1ccccc1[C@@H](C)CC(=O)O Amb27863498 [0,2,0,0,0,0|2,0,0]=4 10743 B13R1.201 Cc1ccccc1[C@@H](C)NC(C)C Amb27811740 [0,2,0,0,0,0|2,0,0]=4 10744 B13R1.201 Cc1ccccc1[C@@H](N)CC(C)C Amb27850037 [0,2,0,0,0,0|2,0,0]=4 10745 B13R1.201 Cc1ccccc1[C@H](C)CC(=O)O Amb27179250 [0,2,0,0,0,0|2,0,0]=4 10746 B13R1.201 Cc1ccccc1[C@H](N)CC(C)C Amb28142407 [0,2,0,0,0,0|2,0,0]=4 10747 B13R1.201 Cc1ccncc1C(C)CC(C)Br Amb27170141 [0,2,0,0,0,0|2,0,0]=4 10748 B13R1.201 Cc1ccncc1C(N)CN(C)C Amb28249298 [0,2,0,0,0,0|2,0,0]=4 10749 B13R1.352 CC(C)(C)CC(N)c1ccccc1 Amb6255921 [0,2,0,0,0,0|2,0,0]=4 10750 B13R1.352 CC(C)(C)CC(S)c1ccccc1 Amb4013282 [0,2,0,0,0,0|2,0,0]=4 10751 B13R1.352 CC(C)(C)C[C@H](N)c1ccccc1 Amb28243482 [0,2,0,0,0,0|2,0,0]=4 10752 B13R1.352 CC(C)(N)CC(F)c1ccccc1 Amb27451156 [0,2,0,0,0,0|2,0,0]=4 10753 B13R1.352 CC(C)(N)C[C@@H](O)c1ccccc1 Amb28060134 [0,2,0,0,0,0|2,0,0]=4 10754 B13R1.352 CC(C)(O)CC(O)c1ccccc1 Amb26068305 [0,2,0,0,0,0|2,0,0]=4 10755 B13R1.352 CC(C)(O)C[C@@H](O)c1ccccc1 Amb27662185 [0,2,0,0,0,0|2,0,0]=4 10756 B13R1.352 CC(CC(C)(C)C)c1ccccc1 Amb27779167 [0,2,0,0,0,0|1,0,0]=3 10757 B13R1.352 CC(CC(C)(C)N)c1ccccc1 Amb28193315 [0,2,0,0,0,0|1,0,0]=3 10758 B13R1.352 CC(CC(C)(C)N)c1ccccn1 Amb30010283 [0,2,0,0,0,0|2,0,0]=4 10759 B13R1.352 CC(CC(C)(C)O)c1ccccc1 Amb25175754 [0,2,0,0,0,0|1,0,0]=3 10760 B13R1.352 CC(CC(F)(F)F)c1ccccc1 Amb20669795 [0,2,0,0,0,0|2,0,0]=4 10761 B13R1.352 CC(CS(=O)(=O)Cl)c1ccccc1 Amb18985655 [0,2,0,0,0,0|2,0,0]=4 10762 B13R1.352 CC(CS(=O)(=O)F)c1ccccc1 Amb32717138 [0,2,0,0,0,0|2,0,0]=4 10763 B13R1.352 CC(CS(=O)(=O)[O-])c1ccccc1 Amb27454633 [0,2,0,0,0,0|2,0,0]=4 10764 B13R1.352 CC(CS(C)(=O)=O)c1ccccc1 Amb27188628 [0,2,0,0,0,0|1,0,0]=3 10765 B13R1.352 CC(CS(N)(=O)=O)c1ccccc1 Amb18332333 [0,2,0,0,0,0|2,0,0]=4 10766 B13R1.352 CC(NS(C)(=N)=O)c1ccccc1 Amb29851636 [0,2,0,0,0,0|2,0,0]=4 10767 B13R1.352 CC(NS(C)(=O)=O)c1ccccc1 Amb6877429 [0,2,0,0,0,0|2,0,0]=4 10768 B13R1.352 CN(CC(C)(C)C)c1ccccc1 Amb17233321 [0,2,0,0,0,0|2,0,0]=4 10769 B13R1.352 CN(CC(C)(C)N)c1ccccc1 Amb17082659 [0,2,0,0,0,0|2,0,0]=4 10770 B13R1.352 CN(CC(C)(C)O)c1ccccc1 Amb17138934 [0,2,0,0,0,0|2,0,0]=4 10771 B13R1.352 CN(C[Si](C)(C)C)c1ccccc1 Amb27804758 [0,2,0,0,0,0|2,0,0]=4 10772 B13R1.352 CS(=O)(=O)CC(N)c1ccccc1 Amb13951879 [0,2,0,0,0,0|2,0,0]=4 10773 B13R1.352 CS(=O)(=O)CC(N)c1ccccc1 Amb20623795 [0,2,0,0,0,0|2,0,0]=4 10774 B13R1.352 CS(=O)(=O)CC(O)c1ccccc1 Amb4019887 [0,2,0,0,0,0|2,0,0]=4 10775 B13R1.352 C[C@@H](NS(C)(=N)=O)c1ccccc1 Amb29867219 [0,2,0,0,0,0|2,0,0]=4 10776 B13R1.352 C[C@@H](NS(C)(=O)=O)c1ccccc1 Amb27205571 [0,2,0,0,0,0|2,0,0]=4 10777 B13R1.352 C[C@H](NC(C)(C)C)c1ccccc1 Amb27415564 [0,2,0,0,0,0|2,0,0]=4 10778 B13R1.352 C[C@H](NS(C)(=N)=O)c1ccccc1 Amb29867218 [0,2,0,0,0,0|2,0,0]=4 10779 B13R1.352 C[Si](C)(C)CC(N)c1ccccc1 Amb27777168 [0,2,0,0,0,0|2,0,0]=4 10780 B13R1.464 C#Cc1ccccc1C(=O)CNC Amb33204325 [0,2,0,0,0,0|1,0,1]=4 10781 B13R1.464 C#Cc1ccccc1C(C)CCN Amb33314758 [0,2,0,0,0,0|2,0,0]=4 10782 B13R1.464 C#Cc1ccccc1C(C)CON Amb33203602 [0,2,0,0,0,0|2,0,0]=4 10783 B13R1.464 C#Cc1ccccc1C(C)NCC Amb27248014 [0,2,0,0,0,0|2,0,0]=4 10784 B13R1.464 C#Cc1ccccc1C(O)CNC Amb33204326 [0,2,0,0,0,0|1,0,0]=3 10785 B13R1.464 CC(CCN)c1ccccc1C#N Amb33314708 [0,2,0,0,0,0|2,0,0]=4 10786 B13R1.464 CC(CON)c1ccccc1C#N Amb33314672 [0,2,0,0,0,0|2,0,0]=4 10787 B13R1.464 CCCC(Cl)c1ccccc1OC Amb17139741 [0,2,0,0,0,0|2,0,0]=4 10788 B13R1.464 CCCC(N)c1ccccc1OC Amb17233600 [0,2,0,0,0,0|2,0,0]=4 10789 B13R1.464 CCCC(N)c1ccccc1OC Amb35746798 [0,2,0,0,0,0|2,0,0]=4 10790 B13R1.464 CCCC(O)c1ccccc1OC Amb17138973 [0,2,0,0,0,0|2,0,0]=4 10791 B13R1.464 CCNC(C)c1ccccc1C#N Amb28324231 [0,2,0,0,0,0|2,0,0]=4 10792 B13R1.464 CCc1ccccc1C(=O)CNC Amb33449013 [0,2,0,0,0,0|1,0,1]=4 10793 B13R1.464 CCc1ccccc1C(C)CCN Amb33171959 [0,2,0,0,0,0|2,0,0]=4 10794 B13R1.464 CCc1ccccc1C(C)CON Amb33198997 [0,2,0,0,0,0|2,0,0]=4 10795 B13R1.464 CCc1ccccc1C(O)CNC Amb19031256 [0,2,0,0,0,0|1,0,0]=3 10796 B13R1.464 CNCC(=O)c1ccccc1C#N Amb26444206 [0,2,0,0,0,0|1,0,1]=4 10797 B13R1.464 CNCC(=O)c1ccccc1OC Amb17233535 [0,2,0,0,0,0|1,0,1]=4 10798 B13R1.464 CNCC(=O)c1ccccc1SC Amb33448730 [0,2,0,0,0,0|1,0,1]=4 10799 B13R1.464 CNCC(C)c1ccccc1OC Amb17233593 [0,2,0,0,0,0|0,0,0]=2 10800 B13R1.464 CNCC(O)c1ccccc1C#N Amb26965088 [0,2,0,0,0,0|1,0,0]=3 10801 B13R1.464 CNCC(O)c1ccccc1OC Amb5750900 [0,2,0,0,0,0|1,0,0]=3 10802 B13R1.464 CNCC(O)c1ccccc1SC Amb33079000 [0,2,0,0,0,0|1,0,0]=3 10803 B13R1.464 CNCC(O)c1cccnc1OC Amb33359153 [0,2,0,0,0,0|2,0,0]=4 10804 B13R1.464 CNCC(O)c1ncccc1OC Amb33429479 [0,2,0,0,0,0|2,0,0]=4 10805 B13R1.464 COC[C@@H](N)c1ccccc1C#N Amb27205094 [0,2,0,0,0,0|2,0,0]=4 10806 B13R1.464 CONC(C)c1ccccc1OC Amb32653520 [0,2,0,0,0,0|2,0,0]=4 10807 B13R1.464 COc1ccccc1C(C)CC#N Amb28315129 [0,2,0,0,0,0|2,0,0]=4 10808 B13R1.464 COc1ccccc1C(C)CCBr Amb17256442 [0,2,0,0,0,0|2,0,0]=4 10809 B13R1.464 COc1ccccc1C(C)CCCl Amb17236871 [0,2,0,0,0,0|2,0,0]=4 10810 B13R1.464 COc1ccccc1C(C)CCN Amb17226682 [0,2,0,0,0,0|2,0,0]=4 10811 B13R1.464 COc1ccccc1C(C)CCO Amb17233700 [0,2,0,0,0,0|2,0,0]=4 10812 B13R1.464 COc1ccccc1C(C)CON Amb33362092 [0,2,0,0,0,0|2,0,0]=4 10813 B13R1.464 COc1ccccc1C(O)CNN Amb17233903 [0,2,0,0,0,0|2,0,0]=4 10814 B13R1.464 COc1ccccc1C(O)CNO Amb17335611 [0,2,0,0,0,0|2,0,0]=4 10815 B13R1.464 CSc1ccccc1C(C)CCN Amb33266276 [0,2,0,0,0,0|2,0,0]=4 10816 B13R1.464 CSc1ccccc1C(C)CON Amb33465861 [0,2,0,0,0,0|2,0,0]=4 10817 B13R1.4453 CC(CCN)c1c(Cl)cccc1Br Amb24444131 [0,2,0,0,0,0|2,0,0]=4 10818 B13R1.4453 CC(CCN)c1c(Cl)cccc1Cl Amb33256475 [0,2,0,0,0,0|2,0,0]=4 10819 B13R1.4453 CC(CCN)c1c(F)cccc1Br Amb33452248 [0,2,0,0,0,0|2,0,0]=4 10820 B13R1.4453 CC(CCN)c1c(F)cccc1Cl Amb28186872 [0,2,0,0,0,0|2,0,0]=4 10821 B13R1.4453 CC(CCN)c1c(F)cccc1F Amb27609051 [0,2,0,0,0,0|2,0,0]=4 10822 B13R1.4453 CC(CCN)c1c(O)cccc1Br Amb33331528 [0,2,0,0,0,0|2,0,0]=4 10823 B13R1.4453 CC(CCN)c1c(O)cccc1Cl Amb33260726 [0,2,0,0,0,0|2,0,0]=4 10824 B13R1.4453 CC(CON)c1c(Cl)cccc1Br Amb33336241 [0,2,0,0,0,0|2,0,0]=4 10825 B13R1.4453 CC(CON)c1c(Cl)cccc1Cl Amb33256481 [0,2,0,0,0,0|2,0,0]=4 10826 B13R1.4453 CC(CON)c1c(F)cccc1Br Amb33430014 [0,2,0,0,0,0|2,0,0]=4 10827 B13R1.4453 CC(CON)c1c(F)cccc1Cl Amb33256135 [0,2,0,0,0,0|2,0,0]=4 10828 B13R1.4453 CC(CON)c1c(F)cccc1F Amb33315047 [0,2,0,0,0,0|2,0,0]=4 10829 B13R1.4453 CC(CON)c1c(O)cccc1Br Amb33431146 [0,2,0,0,0,0|2,0,0]=4 10830 B13R1.4453 CC(CON)c1c(O)cccc1Cl Amb33260768 [0,2,0,0,0,0|2,0,0]=4 10831 B13R1.4453 CCCC(C)c1c(C)cccc1O Amb27854989 [0,2,0,0,0,0|1,0,0]=3 10832 B13R1.4453 CCCC(N)c1c(Br)cccc1Br Amb27467581 [0,2,0,0,0,0|2,0,0]=4 10833 B13R1.4453 CCCC(N)c1c(C)cccc1F Amb28282692 [0,2,0,0,0,0|2,0,0]=4 10834 B13R1.4453 CCCC(N)c1c(C)cccc1O Amb27405788 [0,2,0,0,0,0|2,0,0]=4 10835 B13R1.4453 CCCC(N)c1c(F)cccc1Br Amb28398159 [0,2,0,0,0,0|2,0,0]=4 10836 B13R1.4453 CCCC(N)c1c(F)cccc1F Amb18191402 [0,2,0,0,0,0|2,0,0]=4 10837 B13R1.4453 CCCC(N)c1c(F)cccc1F Amb35745604 [0,2,0,0,0,0|2,0,0]=4 10838 B13R1.4453 CCCC(N)c1c(N)cccc1Cl Amb27663489 [0,2,0,0,0,0|2,0,0]=4 10839 B13R1.4453 CCCC(N)c1c(O)cccc1Cl Amb27483615 [0,2,0,0,0,0|2,0,0]=4 10840 B13R1.4453 CCCC(N)c1c(O)cccc1F Amb27491500 [0,2,0,0,0,0|2,0,0]=4 10841 B13R1.4453 CCCC(N)c1c(O)cccc1O Amb27168788 [0,2,0,0,0,0|2,0,0]=4 10842 B13R1.4453 CCCC(O)c1c(F)cccc1Br Amb27405786 [0,2,0,0,0,0|2,0,0]=4 10843 B13R1.4453 CCCC(O)c1c(F)cccc1Cl Amb17237578 [0,2,0,0,0,0|2,0,0]=4 10844 B13R1.4453 CCCN(C)c1c(N)cccc1Br Amb35645868 [0,2,0,0,0,0|2,0,0]=4 10845 B13R1.4453 CCCN(C)c1c(N)cccc1F Amb28382989 [0,2,0,0,0,0|2,0,0]=4 10846 B13R1.4453 CCC[C@@H](N)c1c(C)cccc1Br Amb28401455 [0,2,0,0,0,0|2,0,0]=4 10847 B13R1.4453 CCC[C@@H](N)c1c(C)cccc1C Amb28250048 [0,2,0,0,0,0|2,0,0]=4 10848 B13R1.4453 CCC[C@@H](N)c1c(Cl)cccc1Cl Amb27652691 [0,2,0,0,0,0|2,0,0]=4 10849 B13R1.4453 CCC[C@@H](N)c1c(Cl)cccc1I Amb27174375 [0,2,0,0,0,0|2,0,0]=4 10850 B13R1.4453 CCC[C@@H](N)c1c(F)cccc1Br Amb27794527 [0,2,0,0,0,0|2,0,0]=4 10851 B13R1.4453 CCC[C@@H](N)c1c(F)cccc1Cl Amb27203956 [0,2,0,0,0,0|2,0,0]=4 10852 B13R1.4453 CCC[C@@H](N)c1c(O)cccc1Br Amb28060680 [0,2,0,0,0,0|2,0,0]=4 10853 B13R1.4453 CCC[C@@H](N)c1c(O)cccc1O Amb27215275 [0,2,0,0,0,0|2,0,0]=4 10854 B13R1.4453 CCC[C@H](N)c1c(Br)cccc1Br Amb27181207 [0,2,0,0,0,0|2,0,0]=4 10855 B13R1.4453 CCC[C@H](N)c1c(C)cccc1Br Amb27180579 [0,2,0,0,0,0|2,0,0]=4 10856 B13R1.4453 CCC[C@H](N)c1c(C)cccc1C Amb27597953 [0,2,0,0,0,0|2,0,0]=4 10857 B13R1.4453 CCC[C@H](N)c1c(C)cccc1F Amb27434422 [0,2,0,0,0,0|2,0,0]=4 10858 B13R1.4453 CCC[C@H](N)c1c(Cl)cccc1Br Amb27180627 [0,2,0,0,0,0|2,0,0]=4 10859 B13R1.4453 CCC[C@H](N)c1c(F)cccc1Br Amb27771811 [0,2,0,0,0,0|2,0,0]=4 10860 B13R1.4453 CCC[C@H](N)c1c(F)cccc1Cl Amb27608436 [0,2,0,0,0,0|2,0,0]=4 10861 B13R1.4453 CCC[C@H](N)c1c(N)cccc1Br Amb28197580 [0,2,0,0,0,0|2,0,0]=4 10862 B13R1.4453 CCC[C@H](N)c1c(O)cccc1Br Amb28060207 [0,2,0,0,0,0|2,0,0]=4 10863 B13R1.4453 CCC[C@H](N)c1c(O)cccc1O Amb27471901 [0,2,0,0,0,0|2,0,0]=4 10864 B13R1.4453 CCC[C@H](O)c1c(C)cccc1C Amb28200905 [0,2,0,0,0,0|2,0,0]=4 10865 B13R1.4453 CCC[C@H](O)c1c(C)cccc1F Amb27482972 [0,2,0,0,0,0|2,0,0]=4 10866 B13R1.4453 CCNC(C)c1c(C)cccc1C Amb28317206 [0,2,0,0,0,0|2,0,0]=4 10867 B13R1.4453 CCNC(C)c1c(O)cccc1O Amb27985354 [0,2,0,0,0,0|2,0,0]=4 10868 B13R1.4453 CCSC(C)c1c(F)cccc1F Amb27804936 [0,2,0,0,0,0|2,0,0]=4 10869 B13R1.4453 CNCC(=O)c1c(C)cccc1C Amb32727957 [0,2,0,0,0,0|1,0,1]=4 10870 B13R1.4453 CNCC(=O)c1c(C)cccc1Cl Amb33259444 [0,2,0,0,0,0|1,0,1]=4 10871 B13R1.4453 CNCC(=O)c1c(C)cccc1F Amb24578587 [0,2,0,0,0,0|1,0,1]=4 10872 B13R1.4453 CNCC(=O)c1c(Cl)cccc1Br Amb25845605 [0,2,0,0,0,0|1,0,1]=4 10873 B13R1.4453 CNCC(=O)c1c(Cl)cccc1Cl Amb33256482 [0,2,0,0,0,0|1,0,1]=4 10874 B13R1.4453 CNCC(=O)c1c(F)cccc1Br Amb33452256 [0,2,0,0,0,0|1,0,1]=4 10875 B13R1.4453 CNCC(=O)c1c(F)cccc1Cl Amb25381392 [0,2,0,0,0,0|1,0,1]=4 10876 B13R1.4453 CNCC(=O)c1c(F)cccc1F Amb27760183 [0,2,0,0,0,0|1,0,1]=4 10877 B13R1.4453 CNCC(=O)c1c(O)cccc1Br Amb33331539 [0,2,0,0,0,0|1,0,1]=4 10878 B13R1.4453 CNCC(=O)c1c(O)cccc1Cl Amb33260738 [0,2,0,0,0,0|1,0,1]=4 10879 B13R1.4453 CNCC(C)c1c(C)ncnc1C Amb18998104 [0,2,0,0,0,0|2,0,0]=4 10880 B13R1.4453 CNCC(C)c1c(Cl)cccc1Cl Amb27874409 [0,2,0,0,0,0|0,0,0]=2 10881 B13R1.4453 CNCC(O)c1c(C)cccc1C Amb24534303 [0,2,0,0,0,0|1,0,0]=3 10882 B13R1.4453 CNCC(O)c1c(C)cccc1Cl Amb33259440 [0,2,0,0,0,0|1,0,0]=3 10883 B13R1.4453 CNCC(O)c1c(C)cccc1F Amb27238887 [0,2,0,0,0,0|1,0,0]=3 10884 B13R1.4453 CNCC(O)c1c(C)ccnc1N Amb27180717 [0,2,0,0,0,0|2,0,0]=4 10885 B13R1.4453 CNCC(O)c1c(Cl)cccc1Br Amb24399691 [0,2,0,0,0,0|1,0,0]=3 10886 B13R1.4453 CNCC(O)c1c(Cl)cccc1Cl Amb18997469 [0,2,0,0,0,0|1,0,0]=3 10887 B13R1.4453 CNCC(O)c1c(Cl)cncc1Cl Amb33260865 [0,2,0,0,0,0|2,0,0]=4 10888 B13R1.4453 CNCC(O)c1c(F)cccc1Br Amb24536637 [0,2,0,0,0,0|1,0,0]=3 10889 B13R1.4453 CNCC(O)c1c(F)cccc1Cl Amb5750908 [0,2,0,0,0,0|1,0,0]=3 10890 B13R1.4453 CNCC(O)c1c(F)cccc1F Amb18289719 [0,2,0,0,0,0|1,0,0]=3 10891 B13R1.4453 CNCC(O)c1c(F)cncc1F Amb32882363 [0,2,0,0,0,0|2,0,0]=4 10892 B13R1.4453 CNCC(O)c1c(O)cccc1Br Amb33331536 [0,2,0,0,0,0|1,0,0]=3 10893 B13R1.4453 CNCC(O)c1c(O)cccc1Cl Amb33260733 [0,2,0,0,0,0|1,0,0]=3 10894 B13R1.4453 COCC(N)c1c(Cl)cccc1I Amb28203582 [0,2,0,0,0,0|2,0,0]=4 10895 B13R1.4453 COCC(N)c1c(F)cccc1Br Amb28119060 [0,2,0,0,0,0|2,0,0]=4 10896 B13R1.4453 COCC(N)c1c(F)cccc1Cl Amb27239752 [0,2,0,0,0,0|2,0,0]=4 10897 B13R1.4453 COCC(N)c1c(N)cccc1Br Amb27273172 [0,2,0,0,0,0|2,0,0]=4 10898 B13R1.4453 COCC(O)c1c(Cl)cccc1Cl Amb27399163 [0,2,0,0,0,0|2,0,0]=4 10899 B13R1.4453 COCC(O)c1c(F)cccc1Cl Amb28140204 [0,2,0,0,0,0|2,0,0]=4 10900 B13R1.4453 COC[C@@H](N)c1c(Br)cccc1Br Amb28068908 [0,2,0,0,0,0|2,0,0]=4 10901 B13R1.4453 COC[C@@H](N)c1c(C)cccc1Br Amb27405944 [0,2,0,0,0,0|2,0,0]=4 10902 B13R1.4453 COC[C@@H](N)c1c(C)cccc1Cl Amb27435622 [0,2,0,0,0,0|2,0,0]=4 10903 B13R1.4453 COC[C@@H](N)c1c(C)cccc1F Amb27473302 [0,2,0,0,0,0|2,0,0]=4 10904 B13R1.4453 COC[C@@H](N)c1c(Cl)cccc1Cl Amb27390050 [0,2,0,0,0,0|2,0,0]=4 10905 B13R1.4453 COC[C@@H](N)c1c(F)cccc1Cl Amb28252318 [0,2,0,0,0,0|2,0,0]=4 10906 B13R1.4453 COC[C@@H](N)c1c(F)cccc1I Amb27436601 [0,2,0,0,0,0|2,0,0]=4 10907 B13R1.4453 COC[C@@H](N)c1c(N)cccc1F Amb28057155 [0,2,0,0,0,0|2,0,0]=4 10908 B13R1.4453 COC[C@@H](N)c1c(O)cccc1Br Amb27450422 [0,2,0,0,0,0|2,0,0]=4 10909 B13R1.4453 COC[C@@H](N)c1c(O)cccc1O Amb27166596 [0,2,0,0,0,0|2,0,0]=4 10910 B13R1.4453 COC[C@H](N)c1c(C)cccc1C Amb27473414 [0,2,0,0,0,0|2,0,0]=4 10911 B13R1.4453 COC[C@H](N)c1c(F)cccc1F Amb27259071 [0,2,0,0,0,0|2,0,0]=4 10912 B13R1.4453 COC[C@H](N)c1c(N)cccc1F Amb27391701 [0,2,0,0,0,0|2,0,0]=4 10913 B13R1.4453 C\C=C\C(C)c1c(C)cccc1N Amb28119217 [0,2,0,0,0,0|1,0,1]=4 10914 B13R1.4453 Cc1cccc(C)c1C(C)CCN Amb32727959 [0,2,0,0,0,0|2,0,0]=4 10915 B13R1.4453 Cc1cccc(C)c1C(C)CON Amb33224355 [0,2,0,0,0,0|2,0,0]=4 10916 B13R1.4453 Cc1cccc(Cl)c1C(C)CCN Amb33259418 [0,2,0,0,0,0|2,0,0]=4 10917 B13R1.4453 Cc1cccc(Cl)c1C(C)CON Amb33259461 [0,2,0,0,0,0|2,0,0]=4 10918 B13R1.4453 Cc1cccc(F)c1C(C)CCN Amb27792335 [0,2,0,0,0,0|2,0,0]=4 10919 B13R1.4453 Cc1cccc(F)c1C(C)CON Amb33143403 [0,2,0,0,0,0|2,0,0]=4 10920 B13R1.4453 NNCC(O)c1c(F)cccc1Cl Amb17238276 [0,2,0,0,0,0|2,0,0]=4 10921 B13R1.4453 ONCC(O)c1c(F)cccc1Cl Amb17338415 [0,2,0,0,0,0|2,0,0]=4 10922 B11R1.30 CNCC(C)Cc1ccco1 Amb18315958 [0,0,1,1,0,0|1,0,1]=4 10923 B11R1.30 CNCC(C)Cc1cccs1 Amb19023880 [0,0,1,1,0,0|1,0,1]=4 10924 B11R1.30 CNCC(C)Cc1ccsc1 Amb19023884 [0,0,1,1,0,0|1,0,1]=4 10925 B11R1.30 CNCC(C)Cn1cccc1 Amb27673294 [0,0,1,1,0,0|1,0,1]=4 10926 B11R1.30 CNC\C(C)=C\c1ccco1 Amb27241573 [0,0,1,1,0,0|1,0,1]=4 10927 B11R1.30 CNC\C(C)=C\c1cccs1 Amb28047552 [0,0,1,1,0,0|1,0,1]=4 10928 B11R1.30 CNC\C(C)=C\c1ccoc1 Amb27242939 [0,0,1,1,0,0|1,0,1]=4 10929 B11R1.189 C=Cc1cccc(CNC)c1 Amb27389559 [0,0,1,1,0,0|0,0,2]=4 10930 B11R1.229 C=C\C=C/C=C/[C@@H]1C[C@@H]1C=O Amb24766800 [0,0,1,1,0,0|2,0,0]=4 10931 B11R1.229 C=C\C=C\C=C\C1CC1CO Amb27673923 [0,0,1,1,0,0|2,0,0]=4 10932 B11R2.1 BrC1CCc2ccccc21 Amb33528718 [1,0,0,1,0,0|1,0,0]=3 10933 B11R2.1 C=C1CCc2ccccc21 Amb24458532 [1,0,0,1,0,0|0,0,2]=4 10934 B11R2.1 C=C1CNc2ccccc21 Amb27203251 [1,0,0,1,0,0|0,0,2]=4 10935 B11R2.1 CC1=CCc2ccccc21 Amb17778909 [1,0,0,1,0,0|0,0,2]=4 10936 B11R2.1 CC1C=Cc2ccccc21 Amb17844052 [1,0,0,1,0,0|0,0,2]=4 10937 B11R2.1 CC1CCc2ccccc21 Amb28050187 [1,0,0,1,0,0|0,0,0]=2 10938 B11R2.1 CC1CCc2cccnc21 Amb28050279 [1,0,0,1,0,0|1,0,0]=3 10939 B11R2.1 CC1CCc2nccnc21 Amb8392838 [1,0,0,1,0,0|2,0,0]=4 10940 B11R2.1 CC1CNc2ccccc21 Amb20241016 [1,0,0,1,0,0|0,0,0]=2 10941 B11R2.1 CC1CNc2ccccc21 Amb9197981 [1,0,0,1,0,0|0,0,0]=2 10942 B11R2.1 CC1CNc2cnccc21 Amb33742877 [1,0,0,1,0,0|1,0,0]=3 10943 B11R2.1 CC1COc2ccccc21 Amb27617216 [1,0,0,1,0,0|1,0,0]=3 10944 B11R2.1 CC1NCc2ccccc21 Amb20623497 [1,0,0,1,0,0|0,0,0]=2 10945 B11R2.1 CC1NCc2ccccc21 Amb32751285 [1,0,0,1,0,0|0,0,0]=2 10946 B11R2.1 CC1NCc2ncncc21 Amb24071597 [1,0,0,1,0,0|2,0,0]=4 10947 B11R2.1 CC1NCc2ncncc21 Amb28401559 [1,0,0,1,0,0|2,0,0]=4 10948 B11R2.1 CC1OCc2ccccc21 Amb25913589 [1,0,0,1,0,0|1,0,0]=3 10949 B11R2.1 CN1CCc2ccccc21 Amb15691717 [1,0,0,1,0,0|1,0,0]=3 10950 B11R2.1 CN1CCc2cccnc21 Amb28434380 [1,0,0,1,0,0|2,0,0]=4 10951 B11R2.1 CN1CCc2cnccc21 Amb25836379 [1,0,0,1,0,0|2,0,0]=4 10952 B11R2.1 C[C@@H]1NCc2ccccc21 Amb25353679 [1,0,0,1,0,0|0,0,0]=2 10953 B11R2.1 C[C@@H]1NCc2ccccc21 Amb32668091 [1,0,0,1,0,0|0,0,0]=2 10954 B11R2.1 C[C@H]1CNc2ccccc21 Amb27222357 [1,0,0,1,0,0|0,0,0]=2 10955 B11R2.1 C[C@H]1NCc2ccccc21 Amb28206726 [1,0,0,1,0,0|0,0,0]=2 10956 B11R2.1 C[C@H]1NCc2ccccc21 Amb32667894 [1,0,0,1,0,0|0,0,0]=2 10957 B11R2.1 ClC1CCc2ccccc21 Amb8630739 [1,0,0,1,0,0|1,0,0]=3 10958 B11R2.1 ClC1CCc2cccnc21 Amb28128210 [1,0,0,1,0,0|2,0,0]=4 10959 B11R2.1 ClC1COc2ccccc21 Amb27233528 [1,0,0,1,0,0|2,0,0]=4 10960 B11R2.1 FC1NCc2ccccc21 Amb28197417 [1,0,0,1,0,0|1,0,0]=3 10961 B11R2.1 IC1CCc2cccnc21 Amb32685580 [1,0,0,1,0,0|2,0,0]=4 10962 B11R2.1 N=C1NCc2ccccc21 Amb7174277 [1,0,0,1,0,0|1,0,1]=4 10963 B11R2.1 NC1CCc2ccccc21 Amb1158023 [1,0,0,1,0,0|1,0,0]=3 10964 B11R2.1 NC1CCc2ccccc21 Amb16233857 [1,0,0,1,0,0|1,0,0]=3 10965 B11R2.1 NC1CCc2ccccc21 Amb24078253 [1,0,0,1,0,0|1,0,0]=3 10966 B11R2.1 NC1CCc2ccccc21 Amb9677422 [1,0,0,1,0,0|1,0,0]=3 10967 B11R2.1 NC1CCc2cccnc21 Amb22436792 [1,0,0,1,0,0|2,0,0]=4 10968 B11R2.1 NC1CCc2ccncc21 Amb24738463 [1,0,0,1,0,0|2,0,0]=4 10969 B11R2.1 NC1CCc2cnccc21 Amb22900659 [1,0,0,1,0,0|2,0,0]=4 10970 B11R2.1 NC1CCc2ncccc21 Amb21858247 [1,0,0,1,0,0|2,0,0]=4 10971 B11R2.1 NC1CCc2ncccc21 Amb22490383 [1,0,0,1,0,0|2,0,0]=4 10972 B11R2.1 NC1COc2ccccc21 Amb13951643 [1,0,0,1,0,0|2,0,0]=4 10973 B11R2.1 NC1COc2ccccc21 Amb2383232 [1,0,0,1,0,0|2,0,0]=4 10974 B11R2.1 NC1CSc2ccccc21 Amb33531788 [1,0,0,1,0,0|2,0,0]=4 10975 B11R2.1 NN1CCc2ccccc21 Amb2691266 [1,0,0,1,0,0|2,0,0]=4 10976 B11R2.1 NN1CCc2ccccc21 Amb836793 [1,0,0,1,0,0|2,0,0]=4 10977 B11R2.1 N[C@@H]1CCc2ccccc21 Amb16233854 [1,0,0,1,0,0|1,0,0]=3 10978 B11R2.1 N[C@@H]1CCc2ccccc21 Amb3940189 [1,0,0,1,0,0|1,0,0]=3 10979 B11R2.1 N[C@@H]1CCc2cccnc21 Amb22748121 [1,0,0,1,0,0|2,0,0]=4 10980 B11R2.1 N[C@@H]1CCc2cnccc21 Amb26498012 [1,0,0,1,0,0|2,0,0]=4 10981 B11R2.1 N[C@@H]1CCc2ncccc21 Amb27461409 [1,0,0,1,0,0|2,0,0]=4 10982 B11R2.1 N[C@@H]1COc2ccccc21 Amb23440344 [1,0,0,1,0,0|2,0,0]=4 10983 B11R2.1 N[C@@H]1COc2ccccc21 Amb24426876 [1,0,0,1,0,0|2,0,0]=4 10984 B11R2.1 N[C@@H]1CSc2ccccc21 Amb27192844 [1,0,0,1,0,0|2,0,0]=4 10985 B11R2.1 N[C@H]1CCc2ccccc21 Amb20242239 [1,0,0,1,0,0|1,0,0]=3 10986 B11R2.1 N[C@H]1CCc2ccccc21 Amb3940190 [1,0,0,1,0,0|1,0,0]=3 10987 B11R2.1 N[C@H]1CCc2cccnc21 Amb26398859 [1,0,0,1,0,0|2,0,0]=4 10988 B11R2.1 N[C@H]1CCc2cccnc21 Amb33872522 [1,0,0,1,0,0|2,0,0]=4 10989 B11R2.1 N[C@H]1CCc2cnccc21 Amb27173220 [1,0,0,1,0,0|2,0,0]=4 10990 B11R2.1 N[C@H]1COc2ccccc21 Amb25147252 [1,0,0,1,0,0|2,0,0]=4 10991 B11R2.1 N[C@H]1COc2ccccc21 Amb33813746 [1,0,0,1,0,0|2,0,0]=4 10992 B11R2.1 N[C@H]1COc2ccccc21 Amb33872471 [1,0,0,1,0,0|2,0,0]=4 10993 B11R2.1 N[C@H]1CSc2ccccc21 Amb27487071 [1,0,0,1,0,0|2,0,0]=4 10994 B11R2.1 O=C1CCc2ccccc21 Amb6458950 [1,0,0,1,0,0|1,0,1]=4 10995 B11R2.1 O=C1CNc2ccccc21 Amb17593399 [1,0,0,1,0,0|1,0,1]=4 10996 B11R2.1 O=C1NCc2ccccc21 Amb773532 [1,0,0,1,0,0|1,0,1]=4 10997 B11R2.1 OC1CCc2ccccc21 Amb9703194 [1,0,0,1,0,0|1,0,0]=3 10998 B11R2.1 OC1CCc2cccnc21 Amb19958431 [1,0,0,1,0,0|2,0,0]=4 10999 B11R2.1 OC1CCc2ncccc21 Amb16231393 [1,0,0,1,0,0|2,0,0]=4 11000 B11R2.1 OC1COc2ccccc21 Amb33548779 [1,0,0,1,0,0|2,0,0]=4 11001 B11R2.1 OC1CSc2ccccc21 Amb27174921 [1,0,0,1,0,0|2,0,0]=4 11002 B11R2.1 OC1OCc2ccccc21 Amb21858794 [1,0,0,1,0,0|2,0,0]=4 11003 B11R2.1 O[C@@H]1CCc2ccccc21 Amb13953023 [1,0,0,1,0,0|1,0,0]=3 11004 B11R2.1 O[C@@H]1CCc2cnccc21 Amb33715207 [1,0,0,1,0,0|2,0,0]=4 11005 B11R2.1 O[C@@H]1CCc2ncccc21 Amb24511690 [1,0,0,1,0,0|2,0,0]=4 11006 B11R2.1 O[C@@H]1COc2ccccc21 Amb27191568 [1,0,0,1,0,0|2,0,0]=4 11007 B11R2.1 O[C@@H]1CSc2ccccc21 Amb28315859 [1,0,0,1,0,0|2,0,0]=4 11008 B11R2.1 O[C@H]1CCc2ccccc21 Amb13953022 [1,0,0,1,0,0|1,0,0]=3 11009 B11R2.1 O[C@H]1CCc2cccnc21 Amb26350485 [1,0,0,1,0,0|2,0,0]=4 11010 B11R2.1 O[C@H]1CCc2ncccc21 Amb26530510 [1,0,0,1,0,0|2,0,0]=4 11011 B11R2.1 O[C@H]1COc2ccccc21 Amb27946875 [1,0,0,1,0,0|2,0,0]=4 11012 B11R2.1 S=C1CNc2ccccc21 Amb27791107 [1,0,0,1,0,0|1,0,1]=4 11013 B11R2.1 SC1CCc2ccccc21 Amb9208023 [1,0,0,1,0,0|1,0,0]=3 11014 B11R2.1 SC1CCc2cccnc21 Amb24071779 [1,0,0,1,0,0|2,0,0]=4 11015 B11R2.1 SC1CSc2ccccc21 Amb32788664 [1,0,0,1,0,0|2,0,0]=4 11016 B11R2.4 BrC1CC1c2ccccc2 Amb23454923 [1,0,0,1,0,0|1,0,0]=3 11017 B11R2.4 BrC1CC1c2ccncc2 Amb27460923 [1,0,0,1,0,0|2,0,0]=4 11018 B11R2.4 BrC1C[C@H]1c2ccccc2 Amb27392259 [1,0,0,1,0,0|1,0,0]=3 11019 B11R2.4 Br[C@@H]1C[C@@H]1c2ccccc2 Amb28383883 [1,0,0,1,0,0|1,0,0]=3 11020 B11R2.4 Br[C@@H]1C[C@H]1c2ccccc2 Amb25791511 [1,0,0,1,0,0|1,0,0]=3 11021 B11R2.4 Br[C@@H]1C[C@H]1c2cccnc2 Amb27190974 [1,0,0,1,0,0|2,0,0]=4 11022 B11R2.4 CC1CC1c2ccncc2 Amb2694644 [1,0,0,1,0,0|1,0,0]=3 11023 B11R2.4 CC1OC1c2ccccc2 Amb1129298 [1,0,0,1,0,0|1,0,0]=3 11024 B11R2.4 CN1C[C@@H]1c2ccccc2 Amb33621244 [1,0,0,1,0,0|0,0,0]=2 11025 B11R2.4 CN1C[C@H]1c2ccccc2 Amb33621243 [1,0,0,1,0,0|0,0,0]=2 11026 B11R2.4 CN1OC1c2ccccn2 Amb24586710 [1,0,0,1,0,0|2,0,0]=4 11027 B11R2.4 C[C@@H]1O[C@H]1c2ccccc2 Amb22367029 [1,0,0,1,0,0|1,0,0]=3 11028 B11R2.4 C[C@H]1O[C@@H]1c2ccccc2 Amb22224838 [1,0,0,1,0,0|1,0,0]=3 11029 B11R2.4 Cl[C@@H]1O[C@H]1c2ccccc2 Amb27845481 [1,0,0,1,0,0|2,0,0]=4 11030 B11R2.4 Cl[C@H]1C[C@@H]1c2ccccc2 Amb28142329 [1,0,0,1,0,0|1,0,0]=3 11031 B11R2.4 Cl[C@H]1O[C@H]1c2ccccc2 Amb27252240 [1,0,0,1,0,0|2,0,0]=4 11032 B11R2.4 NC1CC1c2ccccc2 Amb22729761 [1,0,0,1,0,0|0,0,0]=2 11033 B11R2.4 NC1CC1c2ccccc2 Amb33548983 [1,0,0,1,0,0|0,0,0]=2 11034 B11R2.4 NC1CC1c2ccccc2 Amb9284785 [1,0,0,1,0,0|0,0,0]=2 11035 B11R2.4 NC1CC1c2ccccn2 Amb9677173 [1,0,0,1,0,0|1,0,0]=3 11036 B11R2.4 NC1CC1c2cccnc2 Amb33447000 [1,0,0,1,0,0|1,0,0]=3 11037 B11R2.4 NC1CC1c2cccnc2 Amb9677232 [1,0,0,1,0,0|1,0,0]=3 11038 B11R2.4 NC1CC1c2ccncc2 Amb9677222 [1,0,0,1,0,0|1,0,0]=3 11039 B11R2.4 NC1CC1c2ccncn2 Amb27955658 [1,0,0,1,0,0|2,0,0]=4 11040 B11R2.4 NC1CC1c2cnccn2 Amb33360008 [1,0,0,1,0,0|2,0,0]=4 11041 B11R2.4 NC1CC1c2cncnc2 Amb26944302 [1,0,0,1,0,0|2,0,0]=4 11042 B11R2.4 NC1CC1c2ncccn2 Amb33270683 [1,0,0,1,0,0|2,0,0]=4 11043 B11R2.4 NN1CC1c2ccccc2 Amb17593419 [1,0,0,1,0,0|1,0,0]=3 11044 B11R2.4 N[C@@H]1CC1c2ccccc2 Amb25077262 [1,0,0,1,0,0|0,0,0]=2 11045 B11R2.4 N[C@@H]1C[C@@H]1c2ccccc2 Amb24183509 [1,0,0,1,0,0|0,0,0]=2 11046 B11R2.4 N[C@@H]1C[C@@H]1c2ccccc2 Amb24579866 [1,0,0,1,0,0|0,0,0]=2 11047 B11R2.4 N[C@@H]1C[C@H]1c2ccccc2 Amb22231696 [1,0,0,1,0,0|0,0,0]=2 11048 B11R2.4 N[C@@H]1C[C@H]1c2ccccc2 Amb2720223 [1,0,0,1,0,0|0,0,0]=2 11049 B11R2.4 N[C@@H]1C[C@H]1c2ccccc2 Amb8387302 [1,0,0,1,0,0|0,0,0]=2 11050 B11R2.4 N[C@@H]1C[C@H]1c2ccccn2 Amb33361299 [1,0,0,1,0,0|1,0,0]=3 11051 B11R2.4 N[C@@H]1C[C@H]1c2cccnc2 Amb26947679 [1,0,0,1,0,0|1,0,0]=3 11052 B11R2.4 N[C@@H]1C[C@H]1c2cccnc2 Amb33473670 [1,0,0,1,0,0|1,0,0]=3 11053 B11R2.4 N[C@@H]1C[C@H]1c2ccncc2 Amb33380669 [1,0,0,1,0,0|1,0,0]=3 11054 B11R2.4 N[C@@H]1C[C@H]1c2ccncn2 Amb33269038 [1,0,0,1,0,0|2,0,0]=4 11055 B11R2.4 N[C@@H]1C[C@H]1c2cnccn2 Amb33360018 [1,0,0,1,0,0|2,0,0]=4 11056 B11R2.4 N[C@@H]1C[C@H]1c2cncnc2 Amb33465660 [1,0,0,1,0,0|2,0,0]=4 11057 B11R2.4 N[C@@H]1C[C@H]1c2ncccn2 Amb33270684 [1,0,0,1,0,0|2,0,0]=4 11058 B11R2.4 N[C@H]1CC1c2ccccc2 Amb34916480 [1,0,0,1,0,0|0,0,0]=2 11059 B11R2.4 N[C@H]1C[C@@H]1c2ccccc2 Amb22735917 [1,0,0,1,0,0|0,0,0]=2 11060 B11R2.4 N[C@H]1C[C@@H]1c2ccccc2 Amb597420 [1,0,0,1,0,0|0,0,0]=2 11061 B11R2.4 N[C@H]1C[C@@H]1c2cccnc2 Amb24604839 [1,0,0,1,0,0|1,0,0]=3 11062 B11R2.4 N[C@H]1C[C@H]1c2ccccc2 Amb33806281 [1,0,0,1,0,0|0,0,0]=2 11063 B11R2.4 OC1CC1c2ccccc2 Amb17593413 [1,0,0,1,0,0|1,0,0]=3 11064 B11R2.4 O[C@@H]1C[C@@H]1c2ccccc2 Amb27486613 [1,0,0,1,0,0|1,0,0]=3 11065 B11R2.4 O[C@H]1C[C@H]1c2ccccc2 Amb27972540 [1,0,0,1,0,0|1,0,0]=3 11066 B11R2.40 BrC1(c2ccccc2)CC1 Amb24743023 [1,0,0,1,0,0|1,0,0]=3 11067 B11R2.40 CC1(c2ccccc2)CC1 Amb24613075 [1,0,0,1,0,0|0,0,0]=2 11068 B11R2.40 CC1(c2ccccc2)CN1 Amb9782222 [1,0,0,1,0,0|0,0,0]=2 11069 B11R2.40 CC1(c2ccccc2)CO1 Amb7094910 [1,0,0,1,0,0|1,0,0]=3 11070 B11R2.40 CC1(c2ccccn2)CC1 Amb28434889 [1,0,0,1,0,0|1,0,0]=3 11071 B11R2.40 CC1(c2ccccn2)CO1 Amb24070157 [1,0,0,1,0,0|2,0,0]=4 11072 B11R2.40 CC1(c2cccnc2)CO1 Amb25683724 [1,0,0,1,0,0|2,0,0]=4 11073 B11R2.40 CC1(c2ccncc2)CC1 Amb2694623 [1,0,0,1,0,0|1,0,0]=3 11074 B11R2.40 CC1(c2ccncc2)CO1 Amb26450845 [1,0,0,1,0,0|2,0,0]=4 11075 B11R2.40 ClC1(c2ccccc2)CC1 Amb17872674 [1,0,0,1,0,0|1,0,0]=3 11076 B11R2.40 ClC1(c2ccccc2)CO1 Amb27210141 [1,0,0,1,0,0|2,0,0]=4 11077 B11R2.40 NC1(c2ccccc2)CC1 Amb1095038 [1,0,0,1,0,0|1,0,0]=3 11078 B11R2.40 NC1(c2ccccc2)CC1 Amb2721355 [1,0,0,1,0,0|1,0,0]=3 11079 B11R2.40 NC1(c2ccccn2)CC1 Amb21858032 [1,0,0,1,0,0|2,0,0]=4 11080 B11R2.40 NC1(c2ccccn2)CC1 Amb21963993 [1,0,0,1,0,0|2,0,0]=4 11081 B11R2.40 NC1(c2ccccn2)CC1 Amb33531336 [1,0,0,1,0,0|2,0,0]=4 11082 B11R2.40 NC1(c2cccnc2)CC1 Amb10602476 [1,0,0,1,0,0|2,0,0]=4 11083 B11R2.40 NC1(c2cccnc2)CC1 Amb22490380 [1,0,0,1,0,0|2,0,0]=4 11084 B11R2.40 NC1(c2ccncc2)CC1 Amb18280388 [1,0,0,1,0,0|2,0,0]=4 11085 B11R2.40 NC1(c2ccncc2)CC1 Amb22736629 [1,0,0,1,0,0|2,0,0]=4 11086 B11R2.40 OC1(c2ccccc2)CC1 Amb19374887 [1,0,0,1,0,0|1,0,0]=3 11087 B11R2.40 OC1(c2ccccn2)CC1 Amb25682150 [1,0,0,1,0,0|2,0,0]=4 11088 B11R2.40 OC1(c2cccnc2)CC1 Amb27161989 [1,0,0,1,0,0|2,0,0]=4 11089 B11R2.40 OC1(c2ccncc2)CC1 Amb25235214 [1,0,0,1,0,0|2,0,0]=4 11090 B11R2.40 SC1(c2ccccc2)CC1 Amb33081559 [1,0,0,1,0,0|1,0,0]=3 11091 B11R2.54 CC1C(=O)c2ccccc21 Amb27602983 [1,0,0,1,0,0|1,0,1]=4 11092 B11R2.54 C[C@H]1c2ccccc2[C@@H]1O Amb27484595 [1,0,0,1,0,0|1,0,0]=3 11093 B11R2.54 O[C@H]1c2ccccc2[C@H]1O Amb27406819 [1,0,0,1,0,0|2,0,0]=4 11094 B11R2.239 c1cc(C2CCC2)ccn1 Amb22898826 [1,0,0,1,0,0|1,0,0]=3 11095 B11R2.239 c1cc(C2CCC2)ncn1 Amb33070125 [1,0,0,1,0,0|2,0,0]=4 11096 B11R2.239 c1cc(C2CCN2)ccn1 Amb26960403 [1,0,0,1,0,0|1,0,0]=3 11097 B11R2.239 c1cc(C2CCN2)ncn1 Amb25274242 [1,0,0,1,0,0|2,0,0]=4 11098 B11R2.239 c1cc(C2CNC2)ccn1 Amb19516821 [1,0,0,1,0,0|1,0,0]=3 11099 B11R2.239 c1cc(C2CNC2)ccn1 Amb20620350 [1,0,0,1,0,0|1,0,0]=3 11100 B11R2.239 c1cc(C2CNC2)ncn1 Amb23401381 [1,0,0,1,0,0|2,0,0]=4 11101 B11R2.239 c1cc(C2CNC2)ncn1 Amb26509224 [1,0,0,1,0,0|2,0,0]=4 11102 B11R2.239 c1cc(C2CNC2)ncn1 Amb28990041 [1,0,0,1,0,0|2,0,0]=4 11103 B11R2.239 c1cc(C2COC2)ccn1 Amb27623779 [1,0,0,1,0,0|2,0,0]=4 11104 B11R2.239 c1ccc(C2CCC2)cc1 Amb27466141 [1,0,0,1,0,0|0,0,0]=2 11105 B11R2.239 c1ccc(C2CCC2)nc1 Amb27796341 [1,0,0,1,0,0|1,0,0]=3 11106 B11R2.239 c1ccc(C2CCN2)cc1 Amb34912959 [1,0,0,1,0,0|0,0,0]=2 11107 B11R2.239 c1ccc(C2CCN2)cc1 Amb6893889 [1,0,0,1,0,0|0,0,0]=2 11108 B11R2.239 c1ccc(C2CCN2)nc1 Amb25849292 [1,0,0,1,0,0|1,0,0]=3 11109 B11R2.239 c1ccc(C2CCS2)cc1 Amb27839415 [1,0,0,1,0,0|1,0,0]=3 11110 B11R2.239 c1ccc(C2CNC2)cc1 Amb10603719 [1,0,0,1,0,0|0,0,0]=2 11111 B11R2.239 c1ccc(C2CNC2)cc1 Amb4124710 [1,0,0,1,0,0|0,0,0]=2 11112 B11R2.239 c1ccc(C2CNC2)nc1 Amb15695195 [1,0,0,1,0,0|1,0,0]=3 11113 B11R2.239 c1ccc(C2CNC2)nc1 Amb19516701 [1,0,0,1,0,0|1,0,0]=3 11114 B11R2.239 c1ccc(C2CNC2)nc1 Amb32410214 [1,0,0,1,0,0|1,0,0]=3 11115 B11R2.239 c1ccc(C2COC2)nc1 Amb24100566 [1,0,0,1,0,0|2,0,0]=4 11116 B11R2.239 c1ccc([C@@H]2CCO2)cc1 Amb25721124 [1,0,0,1,0,0|1,0,0]=3 11117 B11R2.239 c1ccc([C@H]2CCN2)cc1 Amb27874787 [1,0,0,1,0,0|0,0,0]=2 11118 B11R2.239 c1cnc(C2CCN2)cn1 Amb26026804 [1,0,0,1,0,0|2,0,0]=4 11119 B11R2.239 c1cnc(C2CCN2)nc1 Amb32716223 [1,0,0,1,0,0|2,0,0]=4 11120 B11R2.239 c1cnc(C2CNC2)cn1 Amb26946675 [1,0,0,1,0,0|2,0,0]=4 11121 B11R2.239 c1cnc(C2CNC2)nc1 Amb25935062 [1,0,0,1,0,0|2,0,0]=4 11122 B11R2.239 c1cnc(C2CNC2)nc1 Amb30868005 [1,0,0,1,0,0|2,0,0]=4 11123 B11R2.239 c1cnc(C2CNC2)nc1 Amb32412175 [1,0,0,1,0,0|2,0,0]=4 11124 B11R2.239 c1cncc(C2CCN2)c1 Amb8010869 [1,0,0,1,0,0|1,0,0]=3 11125 B11R2.239 c1cncc(C2CNC2)c1 Amb19516797 [1,0,0,1,0,0|1,0,0]=3 11126 B11R2.239 c1cncc(C2CNC2)c1 Amb20620349 [1,0,0,1,0,0|1,0,0]=3 11127 B11R2.239 c1cncc(C2CNC2)c1 Amb32410212 [1,0,0,1,0,0|1,0,0]=3 11128 B11R2.239 c1cncc([C@H]2CCN2)c1 Amb27241453 [1,0,0,1,0,0|1,0,0]=3 11129 B11R2.239 c1ncc(C2CCN2)cn1 Amb27173286 [1,0,0,1,0,0|2,0,0]=4 11130 B11R2.239 c1ncc(C2CNC2)cn1 Amb26369795 [1,0,0,1,0,0|2,0,0]=4 11131 B11R2.239 c1ncc(C2CNC2)cn1 Amb34931999 [1,0,0,1,0,0|2,0,0]=4 11132 B11R2.988 C=CC1Cc2ccccc21 Amb17778869 [1,0,0,1,0,0|0,0,2]=4 11133 B11R2.988 CCC1=Cc2ccccc21 Amb27641412 [1,0,0,1,0,0|0,0,2]=4 11134 B11R2.988 CCC1Cc2ccccc21 Amb24647895 [1,0,0,1,0,0|0,0,0]=2 11135 B11R2.988 CNC1Cc2ccccc21 Amb28315966 [1,0,0,1,0,0|0,0,0]=2 11136 B11R2.988 COC1Cc2ccccc21 Amb24455687 [1,0,0,1,0,0|1,0,0]=3 11137 B11R2.988 N#CC1Cc2ccccc21 Amb2778424 [1,0,0,1,0,0|0,0,2]=4 11138 B11R2.988 NCC1Cc2ccccc21 Amb10609227 [1,0,0,1,0,0|0,0,0]=2 11139 B11R2.988 O=CC1Cc2ccccc21 Amb16230472 [1,0,0,1,0,0|1,0,1]=4 11140 B11R2.988 OCC1Cc2ccccc21 Amb8395939 [1,0,0,1,0,0|1,0,0]=3 11141 B11R2.988 SCC1Cc2ccccc21 Amb27866792 [1,0,0,1,0,0|1,0,0]=3 11142 B11R2.20 C1=CCc2ccccc2C1 Amb8392372 [1,0,0,1,0,0|1,0,1]=4 11143 B11R2.20 C1=Cc2ccccc2CC1 Amb1162229 [1,0,0,1,0,0|1,0,1]=4 11144 B11R2.20 C1=Cc2ccccc2CN1 Amb25999205 [1,0,0,1,0,0|0,0,2]=4 11145 B11R2.20 C1=NCCc2ccccc21 Amb10603654 [1,0,0,1,0,0|0,0,2]=4 11146 B11R2.20 c1cc2c(cn1)CCCC2 Amb5399109 [1,0,0,1,0,0|2,0,0]=4 11147 B11R2.20 c1cc2c(cn1)CCNC2 Amb18124435 [1,0,0,1,0,0|1,0,0]=3 11148 B11R2.20 c1cc2c(cn1)CCNC2 Amb20075877 [1,0,0,1,0,0|1,0,0]=3 11149 B11R2.20 c1cc2c(cn1)CCNC2 Amb22752076 [1,0,0,1,0,0|1,0,0]=3 11150 B11R2.20 c1cc2c(cn1)CCOC2 Amb26845927 [1,0,0,1,0,0|2,0,0]=4 11151 B11R2.20 c1cc2c(cn1)CNCC2 Amb19958148 [1,0,0,1,0,0|1,0,0]=3 11152 B11R2.20 c1cc2c(cn1)CNCC2 Amb21858409 [1,0,0,1,0,0|1,0,0]=3 11153 B11R2.20 c1cc2c(cn1)CNCC2 Amb8011539 [1,0,0,1,0,0|1,0,0]=3 11154 B11R2.20 c1cc2c(cn1)CNNC2 Amb26354898 [1,0,0,1,0,0|2,0,0]=4 11155 B11R2.20 c1cc2c(cn1)COCC2 Amb28255495 [1,0,0,1,0,0|2,0,0]=4 11156 B11R2.20 c1cc2c(nn1)CCNC2 Amb27757760 [1,0,0,1,0,0|2,0,0]=4 11157 B11R2.20 c1cc2c(nn1)CCNC2 Amb33804624 [1,0,0,1,0,0|2,0,0]=4 11158 B11R2.20 c1ccc2c(c1)CCCC2 Amb6608921 [1,0,0,1,0,0|1,0,0]=3 11159 B11R2.20 c1ccc2c(c1)CCCN2 Amb1869492 [1,0,0,1,0,0|2,0,0]=4 11160 B11R2.20 c1ccc2c(c1)CCCO2 Amb9677672 [1,0,0,1,0,0|2,0,0]=4 11161 B11R2.20 c1ccc2c(c1)CCNC2 Amb2383348 [1,0,0,1,0,0|0,0,0]=2 11162 B11R2.20 c1ccc2c(c1)CCNC2 Amb2720224 [1,0,0,1,0,0|0,0,0]=2 11163 B11R2.20 c1ccc2c(c1)CCNS2 Amb27421368 [1,0,0,1,0,0|1,0,0]=3 11164 B11R2.20 c1ccc2c(c1)CCOC2 Amb2725513 [1,0,0,1,0,0|1,0,0]=3 11165 B11R2.20 c1ccc2c(c1)CCSO2 Amb27965466 [1,0,0,1,0,0|2,0,0]=4 11166 B11R2.20 c1ccc2c(c1)CNCN2 Amb25147572 [1,0,0,1,0,0|1,0,0]=3 11167 B11R2.20 c1ccc2c(c1)CNNC2 Amb22497223 [1,0,0,1,0,0|1,0,0]=3 11168 B11R2.20 c1ccc2c(c1)CNNC2 Amb28985797 [1,0,0,1,0,0|1,0,0]=3 11169 B11R2.20 c1ccc2c(c1)CNNC2 Amb32661310 [1,0,0,1,0,0|1,0,0]=3 11170 B11R2.20 c1ccc2c(c1)CNOC2 Amb25997729 [1,0,0,1,0,0|1,0,0]=3 11171 B11R2.20 c1ccc2c(c1)CNOC2 Amb28555648 [1,0,0,1,0,0|1,0,0]=3 11172 B11R2.20 c1ccc2c(c1)CSCN2 Amb27412411 [1,0,0,1,0,0|2,0,0]=4 11173 B11R2.20 c1ccc2c(c1)CSSC2 Amb25839327 [1,0,0,1,0,0|2,0,0]=4 11174 B11R2.20 c1cnc2c(c1)CCCC2 Amb2390042 [1,0,0,1,0,0|2,0,0]=4 11175 B11R2.20 c1cnc2c(c1)CCNC2 Amb21858385 [1,0,0,1,0,0|1,0,0]=3 11176 B11R2.20 c1cnc2c(c1)CCNC2 Amb22436767 [1,0,0,1,0,0|1,0,0]=3 11177 B11R2.20 c1cnc2c(c1)CCNC2 Amb8011540 [1,0,0,1,0,0|1,0,0]=3 11178 B11R2.20 c1cnc2c(c1)CNCC2 Amb10608993 [1,0,0,1,0,0|1,0,0]=3 11179 B11R2.20 c1cnc2c(c1)CNCC2 Amb19373278 [1,0,0,1,0,0|1,0,0]=3 11180 B11R2.20 c1cnc2c(c1)CNCC2 Amb19958501 [1,0,0,1,0,0|1,0,0]=3 11181 B11R2.20 c1cnc2c(c1)CNCC2 Amb22002369 [1,0,0,1,0,0|1,0,0]=3 11182 B11R2.20 c1cnc2c(c1)CNCC2 Amb6892842 [1,0,0,1,0,0|1,0,0]=3 11183 B11R2.20 c1cnc2c(n1)CCNC2 Amb32661126 [1,0,0,1,0,0|2,0,0]=4 11184 B11R2.20 c1cnc2c(n1)CCNC2 Amb33544098 [1,0,0,1,0,0|2,0,0]=4 11185 B11R2.20 c1ncc2c(n1)CCNC2 Amb17072186 [1,0,0,1,0,0|2,0,0]=4 11186 B11R2.20 c1ncc2c(n1)CCNC2 Amb19515826 [1,0,0,1,0,0|2,0,0]=4 11187 B11R2.20 c1ncc2c(n1)CCNC2 Amb19957549 [1,0,0,1,0,0|2,0,0]=4 11188 B11R2.20 c1ncc2c(n1)CCNC2 Amb22728973 [1,0,0,1,0,0|2,0,0]=4 11189 B11R2.20 c1ncc2c(n1)CCNC2 Amb28991254 [1,0,0,1,0,0|2,0,0]=4 11190 B11R2.20 c1ncc2c(n1)CNCC2 Amb18832496 [1,0,0,1,0,0|2,0,0]=4 11191 B11R2.20 c1ncc2c(n1)CNCC2 Amb22494240 [1,0,0,1,0,0|2,0,0]=4 11192 B11R2.238 C1=C(Cc2ccccc2)C1 Amb27421346 [1,0,0,1,0,0|1,0,1]=4 11193 B11R2.238 c1cc(CC2CC2)ccn1 Amb28050219 [1,0,0,1,0,0|2,0,0]=4 11194 B11R2.238 c1cc(CC2CO2)ccn1 Amb24677560 [1,0,0,1,0,0|2,0,0]=4 11195 B11R2.238 c1ccc(CC2CC2)cc1 Amb22490220 [1,0,0,1,0,0|1,0,0]=3 11196 B11R2.238 c1ccc(CC2CO2)cc1 Amb3940775 [1,0,0,1,0,0|1,0,0]=3 11197 B11R2.238 c1ccc(CC2CO2)nc1 Amb24649901 [1,0,0,1,0,0|2,0,0]=4 11198 B11R2.238 c1ccc(C[C@@H]2CO2)cc1 Amb25916397 [1,0,0,1,0,0|1,0,0]=3 11199 B11R2.238 c1ccc(C[C@H]2CN2)cc1 Amb15690958 [1,0,0,1,0,0|0,0,0]=2 11200 B11R2.238 c1ccc(C[C@H]2CO2)cc1 Amb27150158 [1,0,0,1,0,0|1,0,0]=3 11201 B11R2.238 c1ccc(NC2CC2)cc1 Amb18270529 [1,0,0,1,0,0|2,0,0]=4 11202 B11R2.238 c1ccc(NC2CC2)cc1 Amb32663098 [1,0,0,1,0,0|2,0,0]=4 11203 B11R2.238 c1ccc(SC2CC2)cc1 Amb8514420 [1,0,0,1,0,0|2,0,0]=4 11204 B11R2.238 c1cncc(CC2CO2)c1 Amb28397057 [1,0,0,1,0,0|2,0,0]=4 11205 B11R2.2 c1cc(C2CCNC2)co1 Amb18203044 [0,0,0,1,1,0|1,0,0]=3 11206 B11R2.2 c1cc(C2CCNC2)cs1 Amb18200904 [0,0,0,1,1,0|1,0,0]=3 11207 B11R2.2 c1cc(C2CCNC2)no1 Amb18832175 [0,0,0,1,1,0|2,0,0]=4 11208 B11R2.2 c1cc(C2CCNC2)no1 Amb33329028 [0,0,0,1,1,0|2,0,0]=4 11209 B11R2.2 c1cc(C2CCNC2)on1 Amb18832199 [0,0,0,1,1,0|2,0,0]=4 11210 B11R2.2 c1cc(C2CCNC2)on1 Amb33621080 [0,0,0,1,1,0|2,0,0]=4 11211 B11R2.2 c1ccn(C2CCNC2)c1 Amb18947347 [0,0,0,1,1,0|1,0,0]=3 11212 B11R2.2 c1ccn(C2CCNC2)c1 Amb28555454 [0,0,0,1,1,0|1,0,0]=3 11213 B11R2.2 c1ccn(C2CCOC2)c1 Amb27630012 [0,0,0,1,1,0|2,0,0]=4 11214 B11R2.2 c1cn(C2CCNC2)cn1 Amb10607851 [0,0,0,1,1,0|2,0,0]=4 11215 B11R2.2 c1cn(C2CCNC2)cn1 Amb22587032 [0,0,0,1,1,0|2,0,0]=4 11216 B11R2.2 c1cn([C@@H]2CCNC2)cn1 Amb27759963 [0,0,0,1,1,0|2,0,0]=4 11217 B11R2.2 c1cnn(C2CCNC2)c1 Amb16186649 [0,0,0,1,1,0|2,0,0]=4 11218 B11R2.2 c1cnn(C2CCNC2)c1 Amb19889137 [0,0,0,1,1,0|2,0,0]=4 11219 B11R2.2 c1cnn([C@@H]2CCNC2)c1 Amb27486735 [0,0,0,1,1,0|2,0,0]=4 11220 B11R2.2 c1coc(C2CCNC2)c1 Amb17104482 [0,0,0,1,1,0|1,0,0]=3 11221 B11R2.2 c1coc(C2CCNC2)c1 Amb18364064 [0,0,0,1,1,0|1,0,0]=3 11222 B11R2.2 c1coc(C2CCNC2)n1 Amb18832173 [0,0,0,1,1,0|2,0,0]=4 11223 B11R2.2 c1coc(C2CNCO2)c1 Amb18064797 [0,0,0,1,1,0|2,0,0]=4 11224 B11R2.2 c1csc(C2CCNC2)c1 Amb8009463 [0,0,0,1,1,0|1,0,0]=3 11225 B11R2.2 c1csc(C2CCNC2)n1 Amb18830930 [0,0,0,1,1,0|2,0,0]=4 11226 B11R2.2 c1csc(C2CCNC2)n1 Amb29083252 [0,0,0,1,1,0|2,0,0]=4 11227 B11R2.2 c1csc(C2CNCO2)c1 Amb18065443 [0,0,0,1,1,0|2,0,0]=4 11228 B11R2.2 c1nc(C2CCNC2)co1 Amb18832171 [0,0,0,1,1,0|2,0,0]=4 11229 B11R2.2 c1nc(C2CCNC2)cs1 Amb18830943 [0,0,0,1,1,0|2,0,0]=4 11230 B11R2.2 c1ncc(C2CCNC2)o1 Amb18832174 [0,0,0,1,1,0|2,0,0]=4 11231 B11R2.2 c1ncc(C2CCNC2)s1 Amb18200460 [0,0,0,1,1,0|2,0,0]=4 11232 B11R2.2 c1nocc1C2CCNC2 Amb18832172 [0,0,0,1,1,0|2,0,0]=4 11233 B11R2.57 CC1(c2cccs2)CCC1 Amb24527761 [0,0,0,1,1,0|2,0,0]=4 11234 B11R2.57 FC1(c2ccoc2)CNC1 Amb27263323 [0,0,0,1,1,0|2,0,0]=4 11235 B11R2.57 OC1(c2ccco2)CNC1 Amb28315718 [0,0,0,1,1,0|2,0,0]=4 11236 B11R2.57 OC1(c2cccs2)CNC1 Amb26475181 [0,0,0,1,1,0|2,0,0]=4 11237 B11R2.57 OC1(c2ccoc2)CNC1 Amb28383025 [0,0,0,1,1,0|2,0,0]=4 11238 B11R2.57 OC1(c2ccsc2)CNC1 Amb24529328 [0,0,0,1,1,0|2,0,0]=4 11239 B11R2.106 CC1CNCc2ccnn21 Amb23439510 [0,0,0,1,1,0|2,0,0]=4 11240 B11R2.106 CC1CNCc2ccsc21 Amb24092193 [0,0,0,1,1,0|1,0,0]=3 11241 B11R2.106 CC1CNCc2sccc21 Amb18200895 [0,0,0,1,1,0|1,0,0]=3 11242 B11R2.106 C[C@@H]1CNCc2cccn21 Amb33482805 [0,0,0,1,1,0|1,0,0]=3 11243 B11R2.106 C[C@H]1CNCc2cccn21 Amb33457914 [0,0,0,1,1,0|1,0,0]=3 11244 B11R2.106 FC1CNCc2ccsc21 Amb24403033 [0,0,0,1,1,0|2,0,0]=4 11245 B11R2.106 OC1CNCc2ccsc21 Amb18644751 [0,0,0,1,1,0|2,0,0]=4 11246 B11R2.106 OC1CNCc2sccc21 Amb17194237 [0,0,0,1,1,0|2,0,0]=4 11247 B13R2.15 BrC1CCCC1c2ccccc2 Amb27487943 [0,0,0,1,0,1|2,0,0]=4 11248 B13R2.15 BrC1COCC1c2ccccc2 Amb35736911 [0,0,0,1,0,1|2,0,0]=4 11249 B13R2.15 CC1CCCC1c2ccccc2 Amb28060308 [0,0,0,1,0,1|1,0,0]=3 11250 B13R2.15 CC1CCCN1c2ccccn2 Amb27765835 [0,0,0,1,0,1|2,0,0]=4 11251 B13R2.15 CC1CCN=C1c2ccccc2 Amb26867229 [0,0,0,1,0,1|2,0,0]=4 11252 B13R2.15 CC1CCNC1c2ccccc2 Amb33533836 [0,0,0,1,0,1|2,0,0]=4 11253 B13R2.15 CC1CNCC1c2ccccc2 Amb24312553 [0,0,0,1,0,1|0,0,0]=2 11254 B13R2.15 CC1CNCC1c2ccccn2 Amb28056498 [0,0,0,1,0,1|1,0,0]=3 11255 B13R2.15 CC1CNCC1c2ccncc2 Amb27811235 [0,0,0,1,0,1|1,0,0]=3 11256 B13R2.15 CC1CNCC1c2ccncn2 Amb28056499 [0,0,0,1,0,1|2,0,0]=4 11257 B13R2.15 CC1CNCC1c2cnccn2 Amb35600833 [0,0,0,1,0,1|2,0,0]=4 11258 B13R2.15 CC1NCCC1c2ccccc2 Amb18279882 [0,0,0,1,0,1|2,0,0]=4 11259 B13R2.15 CN1CCC[C@@H]1c2ccccc2 Amb25817229 [0,0,0,1,0,1|2,0,0]=4 11260 B13R2.15 CN1CCC[C@H]1c2ccccc2 Amb27603452 [0,0,0,1,0,1|2,0,0]=4 11261 B13R2.15 C[C@@H]1CCN[C@H]1c2ccccc2 Amb18829884 [0,0,0,1,0,1|2,0,0]=4 11262 B13R2.15 C[C@@H]1NCCC1c2ccccc2 Amb27616689 [0,0,0,1,0,1|2,0,0]=4 11263 B13R2.15 C[C@@H]1NCC[C@H]1c2ccccc2 Amb27420012 [0,0,0,1,0,1|2,0,0]=4 11264 B13R2.15 C[C@H]1CCN[C@@H]1c2ccccc2 Amb27252946 [0,0,0,1,0,1|2,0,0]=4 11265 B13R2.15 ClC1CCCC1c2ccccc2 Amb18184968 [0,0,0,1,0,1|2,0,0]=4 11266 B13R2.15 ClC1COCC1c2ccccc2 Amb35735020 [0,0,0,1,0,1|2,0,0]=4 11267 B13R2.15 FC1CNCC1c2cccnc2 Amb27621394 [0,0,0,1,0,1|2,0,0]=4 11268 B13R2.15 F[C@@H]1CNC[C@@H]1c2ccccc2 Amb32904432 [0,0,0,1,0,1|1,0,0]=3 11269 B13R2.15 F[C@@H]1CNC[C@@H]1c2ccccc2 Amb33330912 [0,0,0,1,0,1|1,0,0]=3 11270 B13R2.15 NC1CCCC1c2ccccc2 Amb17506307 [0,0,0,1,0,1|2,0,0]=4 11271 B13R2.15 NC1CCCC1c2ccccc2 Amb32652751 [0,0,0,1,0,1|2,0,0]=4 11272 B13R2.15 NC1CNCC1c2ccccc2 Amb24432765 [0,0,0,1,0,1|1,0,0]=3 11273 B13R2.15 NC1CNCC1c2ccccn2 Amb32756029 [0,0,0,1,0,1|2,0,0]=4 11274 B13R2.15 NC1CNCC1c2cccnc2 Amb32756031 [0,0,0,1,0,1|2,0,0]=4 11275 B13R2.15 NC1CNCC1c2ccncc2 Amb32756033 [0,0,0,1,0,1|2,0,0]=4 11276 B13R2.15 N[C@@H]1CCC[C@@H]1c2ccccc2 Amb22745600 [0,0,0,1,0,1|2,0,0]=4 11277 B13R2.15 N[C@@H]1CCC[C@@H]1c2ccccc2 Amb32655988 [0,0,0,1,0,1|2,0,0]=4 11278 B13R2.15 N[C@@H]1CCC[C@H]1c2ccccc2 Amb25168925 [0,0,0,1,0,1|2,0,0]=4 11279 B13R2.15 N[C@@H]1CCC[C@H]1c2ccccc2 Amb28617037 [0,0,0,1,0,1|2,0,0]=4 11280 B13R2.15 N[C@@H]1CNC[C@H]1c2ccccc2 Amb27788278 [0,0,0,1,0,1|1,0,0]=3 11281 B13R2.15 N[C@H]1CCC[C@H]1c2ccccc2 Amb27419894 [0,0,0,1,0,1|2,0,0]=4 11282 B13R2.15 N[C@H]1CCC[C@H]1c2ccccc2 Amb33804658 [0,0,0,1,0,1|2,0,0]=4 11283 B13R2.15 N[C@H]1COC[C@H]1c2ccccc2 Amb28245212 [0,0,0,1,0,1|2,0,0]=4 11284 B13R2.15 O=C1CNCN1c2ccccc2 Amb24664160 [0,0,0,1,0,1|1,0,1]=4 11285 B13R2.15 OC1CCCC1c2ccccc2 Amb18798120 [0,0,0,1,0,1|2,0,0]=4 11286 B13R2.15 OC1CNCC1c2ccccc2 Amb18829263 [0,0,0,1,0,1|1,0,0]=3 11287 B13R2.15 OC1CNCC1c2cccnc2 Amb33212793 [0,0,0,1,0,1|2,0,0]=4 11288 B13R2.15 OC1CNN=C1c2ccccc2 Amb28048274 [0,0,0,1,0,1|2,0,0]=4 11289 B13R2.15 OC1COCC1c2ccccc2 Amb23448389 [0,0,0,1,0,1|2,0,0]=4 11290 B13R2.15 O[C@@H]1CCC[C@@H]1c2ccccc2 Amb27255257 [0,0,0,1,0,1|2,0,0]=4 11291 B13R2.15 O[C@@H]1CCC[C@H]1c2ccccc2 Amb24678146 [0,0,0,1,0,1|2,0,0]=4 11292 B13R2.15 O[C@@H]1CNC[C@H]1c2ccccc2 Amb10603153 [0,0,0,1,0,1|1,0,0]=3 11293 B13R2.15 O[C@@H]1CNC[C@H]1c2ccccc2 Amb22405991 [0,0,0,1,0,1|1,0,0]=3 11294 B13R2.15 O[C@@H]1CNC[C@H]1c2ccccc2 Amb22899740 [0,0,0,1,0,1|1,0,0]=3 11295 B13R2.15 O[C@@H]1CNC[C@H]1c2cccnc2 Amb32944729 [0,0,0,1,0,1|2,0,0]=4 11296 B13R2.15 O[C@@H]1COC[C@H]1c2ccccc2 Amb27981628 [0,0,0,1,0,1|2,0,0]=4 11297 B13R2.15 O[C@H]1CCC[C@@H]1c2ccccc2 Amb25236019 [0,0,0,1,0,1|2,0,0]=4 11298 B13R2.15 O[C@H]1CCC[C@H]1c2ccccc2 Amb28053441 [0,0,0,1,0,1|2,0,0]=4 11299 B13R2.15 O[C@H]1CNC[C@@H]1c2ccccc2 Amb26440363 [0,0,0,1,0,1|1,0,0]=3 11300 B13R2.15 O[C@H]1CNC[C@H]1c2ccccc2 Amb24725624 [0,0,0,1,0,1|1,0,0]=3 11301 B13R2.15 O[C@H]1COC[C@@H]1c2ccccc2 Amb27457647 [0,0,0,1,0,1|2,0,0]=4 11302 B13R2.25 BrCCC1CC1c2ccccc2 Amb24525097 [0,0,0,1,0,1|2,0,0]=4 11303 B13R2.25 C=CCC1CC1c2ccccc2 Amb26386415 [0,0,0,1,0,1|1,0,1]=4 11304 B13R2.25 C=CC[C@@H]1C[C@H]1c2ccccc2 Amb32667547 [0,0,0,1,0,1|1,0,1]=4 11305 B13R2.25 CCNC1CC1c2ccccc2 Amb18983170 [0,0,0,1,0,1|2,0,0]=4 11306 B13R2.25 CCN[C@@H]1C[C@H]1c2ccccc2 Amb27814227 [0,0,0,1,0,1|2,0,0]=4 11307 B13R2.25 CCN[C@H]1C[C@@H]1c2ccccc2 Amb28457419 [0,0,0,1,0,1|2,0,0]=4 11308 B13R2.25 CNCC1CC1c2ccccc2 Amb17568106 [0,0,0,1,0,1|0,0,0]=2 11309 B13R2.25 CNCC1CC1c2ccncn2 Amb28322405 [0,0,0,1,0,1|2,0,0]=4 11310 B13R2.25 CNCC1CC1c2cnccn2 Amb35601056 [0,0,0,1,0,1|2,0,0]=4 11311 B13R2.25 CNCC1CC1c2cncnc2 Amb27443903 [0,0,0,1,0,1|2,0,0]=4 11312 B13R2.25 CNC[C@@H]1C[C@@H]1c2ccccc2 Amb27434473 [0,0,0,1,0,1|0,0,0]=2 11313 B13R2.25 CNC[C@@H]1C[C@H]1c2ccccc2 Amb29837831 [0,0,0,1,0,1|0,0,0]=2 11314 B13R2.25 CONC1CC1c2ccccc2 Amb28126379 [0,0,0,1,0,1|2,0,0]=4 11315 B13R2.25 CSC[C@@H]1C[C@H]1c2ccccc2 Amb28183079 [0,0,0,1,0,1|1,0,0]=3 11316 B13R2.25 ClCCC1CC1c2ccccc2 Amb24442277 [0,0,0,1,0,1|2,0,0]=4 11317 B13R2.25 N#CCC1CC1c2ccccc2 Amb23539347 [0,0,0,1,0,1|2,0,0]=4 11318 B13R2.25 N#CC[C@@H]1C[C@@H]1c2ccccc2 Amb34915364 [0,0,0,1,0,1|2,0,0]=4 11319 B13R2.25 N#CC[C@@H]1C[C@H]1c2ccccc2 Amb25968290 [0,0,0,1,0,1|2,0,0]=4 11320 B13R2.25 NCCC1CC1c2ccccc2 Amb23539326 [0,0,0,1,0,1|2,0,0]=4 11321 B13R2.25 NNCC1CC1c2ccccc2 Amb23539331 [0,0,0,1,0,1|1,0,0]=3 11322 B13R2.25 O=CCC1CC1c2ccccc2 Amb28243837 [0,0,0,1,0,1|2,0,0]=4 11323 B13R2.25 O=CC[C@@H]1C[C@@H]1c2ccccc2 Amb34915327 [0,0,0,1,0,1|2,0,0]=4 11324 B13R2.25 O=CC[C@@H]1C[C@H]1c2ccccc2 Amb32667655 [0,0,0,1,0,1|2,0,0]=4 11325 B13R2.25 OCCC1CC1c2ccccc2 Amb26860518 [0,0,0,1,0,1|2,0,0]=4 11326 B13R2.25 OCC[C@H]1C[C@H]1c2ccccc2 Amb27252343 [0,0,0,1,0,1|2,0,0]=4 11327 B13R2.26 BrCCC1Cc2ccccc2C1 Amb26508757 [0,0,0,1,0,1|2,0,0]=4 11328 B13R2.26 C#CCC1Cc2ccccc2C1 Amb33342621 [0,0,0,1,0,1|1,0,1]=4 11329 B13R2.26 C=CC[C@@H]1Cc2ccccc2N1 Amb27201300 [0,0,0,1,0,1|1,0,1]=4 11330 B13R2.26 CCCC1=Cc2ccccc2C1 Amb15692407 [0,0,0,1,0,1|1,0,1]=4 11331 B13R2.26 CCCC1Cc2ccccc2N1 Amb27464141 [0,0,0,1,0,1|1,0,0]=3 11332 B13R2.26 CCCC1Cc2cccnc2N1 Amb27858778 [0,0,0,1,0,1|2,0,0]=4 11333 B13R2.26 CCCC1Nc2ccccc2N1 Amb27831400 [0,0,0,1,0,1|2,0,0]=4 11334 B13R2.26 CCNC1Cc2ccccc2C1 Amb2182885 [0,0,0,1,0,1|2,0,0]=4 11335 B13R2.26 CCNC1Cc2ccccc2C1 Amb2209241 [0,0,0,1,0,1|2,0,0]=4 11336 B13R2.26 CNCC1Cc2ccccc2C1 Amb27390766 [0,0,0,1,0,1|0,0,0]=2 11337 B13R2.26 CNCC1Cc2ccccc2N1 Amb28347865 [0,0,0,1,0,1|0,0,0]=2 11338 B13R2.26 CNCC1Cc2ccccc2O1 Amb3941164 [0,0,0,1,0,1|0,0,0]=2 11339 B13R2.26 CNCC1Cc2ccccc2S1 Amb27245558 [0,0,0,1,0,1|0,0,0]=2 11340 B13R2.26 CNCc1cc2ccccc2o1 Amb10813873 [0,0,0,1,0,1|0,0,2]=4 11341 B13R2.26 CNCc1cc2ccccc2o1 Amb5494061 [0,0,0,1,0,1|0,0,2]=4 11342 B13R2.26 CNCc1cc2ccccc2s1 Amb1792462 [0,0,0,1,0,1|0,0,2]=4 11343 B13R2.26 CNCc1cc2ccccc2s1 Amb6344858 [0,0,0,1,0,1|0,0,2]=4 11344 B13R2.26 CNCc1nc2ccccc2o1 Amb6316127 [0,0,0,1,0,1|1,0,1]=4 11345 B13R2.26 CNCc1nc2ccccc2s1 Amb21959881 [0,0,0,1,0,1|1,0,1]=4 11346 B13R2.26 CNCc1nc2ccccc2s1 Amb440118 [0,0,0,1,0,1|1,0,1]=4 11347 B13R2.26 COCC1Cc2ccccc2N1 Amb25148607 [0,0,0,1,0,1|1,0,0]=3 11348 B13R2.26 C\C=C\C1Cc2ccccc2N1 Amb24636958 [0,0,0,1,0,1|1,0,1]=4 11349 B13R2.26 N#CCC1Cc2ccccc2C1 Amb33143524 [0,0,0,1,0,1|2,0,0]=4 11350 B13R2.26 NCCC1Cc2ccccc2C1 Amb17334539 [0,0,0,1,0,1|2,0,0]=4 11351 B13R2.26 NCCC1Cc2ccccc2C1 Amb33536790 [0,0,0,1,0,1|2,0,0]=4 11352 B13R2.26 NCCC1Cc2ccccc2O1 Amb18829251 [0,0,0,1,0,1|2,0,0]=4 11353 B13R2.26 NCCC1Cc2ccccc2O1 Amb33330257 [0,0,0,1,0,1|2,0,0]=4 11354 B13R2.26 NCCC1Cc2ccccc2S1 Amb18194202 [0,0,0,1,0,1|2,0,0]=4 11355 B13R2.26 NNCC1Cc2ccccc2C1 Amb25763204 [0,0,0,1,0,1|1,0,0]=3 11356 B13R2.26 NNCC1Cc2ccccc2S1 Amb27633135 [0,0,0,1,0,1|1,0,0]=3 11357 B13R2.26 NOCC1Cc2ccccc2C1 Amb33342869 [0,0,0,1,0,1|2,0,0]=4 11358 B13R2.26 O=CCC1Cc2ccccc2C1 Amb27804233 [0,0,0,1,0,1|2,0,0]=4 11359 B13R2.26 O=CCC1Cc2ccccc2N1 Amb27186234 [0,0,0,1,0,1|2,0,0]=4 11360 B13R2.26 OCCC1Cc2ccccc2C1 Amb17334570 [0,0,0,1,0,1|2,0,0]=4 11361 B13R2.26 OCCC1Cc2ccccc2N1 Amb25228077 [0,0,0,1,0,1|2,0,0]=4 11362 B13R2.26 ONCC1Cc2ccccc2C1 Amb33143935 [0,0,0,1,0,1|1,0,0]=3 11363 B13R2.26 SCCC1Cc2ccccc2C1 Amb33342308 [0,0,0,1,0,1|2,0,0]=4 11364 B13R2.26 [C-]#[N+]CC1Cc2ccccc2C1 Amb33342896 [0,0,0,1,0,1|0,0,2]=4 11365 B13R2.31 BrC1CC(Oc2ccccc2)C1 Amb26546680 [0,0,0,1,0,1|2,0,0]=4 11366 B13R2.31 Br[C@H]1C[C@@H](Oc2ccccc2)C1 Amb32668536 [0,0,0,1,0,1|2,0,0]=4 11367 B13R2.31 CC1CC(Nc2ccccc2)C1 Amb27229615 [0,0,0,1,0,1|1,0,0]=3 11368 B13R2.31 CC1CC(Nc2ccccn2)C1 Amb28064433 [0,0,0,1,0,1|2,0,0]=4 11369 B13R2.31 CC1CC(Nc2cccnc2)C1 Amb28246306 [0,0,0,1,0,1|2,0,0]=4 11370 B13R2.31 ClC1CC(Oc2ccccc2)C1 Amb28323824 [0,0,0,1,0,1|2,0,0]=4 11371 B13R2.31 NC1CC(Cc2ccccc2)C1 Amb23401475 [0,0,0,1,0,1|2,0,0]=4 11372 B13R2.31 NC1CC(Cc2ccccc2)C1 Amb27237117 [0,0,0,1,0,1|2,0,0]=4 11373 B13R2.31 NC1CC(Nc2ccccc2)C1 Amb30585007 [0,0,0,1,0,1|2,0,0]=4 11374 B13R2.31 NC1CC(Oc2ccccc2)C1 Amb25148808 [0,0,0,1,0,1|2,0,0]=4 11375 B13R2.31 NC1CC(Oc2ccccc2)C1 Amb32665363 [0,0,0,1,0,1|2,0,0]=4 11376 B13R2.31 NC1CC(Sc2ccccc2)C1 Amb32663438 [0,0,0,1,0,1|2,0,0]=4 11377 B13R2.31 NC1CC(Sc2ccccc2)C1 Amb32668952 [0,0,0,1,0,1|2,0,0]=4 11378 B13R2.31 N[C@H]1C[C@@H](Oc2ccccc2)C1 Amb25350924 [0,0,0,1,0,1|2,0,0]=4 11379 B13R2.31 N[C@H]1C[C@@H](Oc2ccccc2)C1 Amb32665452 [0,0,0,1,0,1|2,0,0]=4 11380 B13R2.31 N[C@H]1C[C@H](Oc2ccccc2)C1 Amb24439570 [0,0,0,1,0,1|2,0,0]=4 11381 B13R2.31 N[C@H]1C[C@H](Oc2ccccc2)C1 Amb32666880 [0,0,0,1,0,1|2,0,0]=4 11382 B13R2.31 N[C@H]1C[C@H](Sc2ccccc2)C1 Amb32664872 [0,0,0,1,0,1|2,0,0]=4 11383 B13R2.31 N[C@H]1C[C@H](Sc2ccccc2)C1 Amb32664874 [0,0,0,1,0,1|2,0,0]=4 11384 B13R2.31 O=C1CC(Cc2ccccc2)C1 Amb23401474 [0,0,0,1,0,1|2,0,0]=4 11385 B13R2.31 O=C1CC(Oc2ccccc2)C1 Amb23439309 [0,0,0,1,0,1|2,0,0]=4 11386 B13R2.31 O=C1CC(Sc2ccccc2)C1 Amb32670640 [0,0,0,1,0,1|2,0,0]=4 11387 B13R2.31 OC1CC(Cc2ccccc2)C1 Amb23401472 [0,0,0,1,0,1|2,0,0]=4 11388 B13R2.31 OC1CC(Oc2ccccc2)C1 Amb27243330 [0,0,0,1,0,1|2,0,0]=4 11389 B13R2.31 OC1CC(Sc2ccccc2)C1 Amb32668950 [0,0,0,1,0,1|2,0,0]=4 11390 B13R2.31 O[C@H]1C[C@@H](Sc2ccccc2)C1 Amb28723619 [0,0,0,1,0,1|2,0,0]=4 11391 B13R2.31 O[C@H]1C[C@H](Oc2ccccc2)C1 Amb32665396 [0,0,0,1,0,1|2,0,0]=4 11392 B13R2.50 NCC1CC1Cc2ccccc2 Amb19001477 [0,0,0,1,0,1|2,0,0]=4 11393 B13R2.50 NCC1CC1Cc2ccccc2 Amb31156084 [0,0,0,1,0,1|2,0,0]=4 11394 B13R2.50 NCC1CC1Oc2ccccc2 Amb27453566 [0,0,0,1,0,1|2,0,0]=4 11395 B13R2.50 NC[C@@H]1C[C@H]1Cc2ccccc2 Amb33249760 [0,0,0,1,0,1|2,0,0]=4 11396 B13R2.50 NC[C@@H]1C[C@H]1Cc2ccccc2 Amb33249761 [0,0,0,1,0,1|2,0,0]=4 11397 B13R2.50 O=CC1CC1Cc2ccccc2 Amb24537604 [0,0,0,1,0,1|2,0,0]=4 11398 B13R2.50 O=C[C@@H]1C[C@H]1Oc2ccccc2 Amb27257945 [0,0,0,1,0,1|2,0,0]=4 11399 B13R2.50 O=C[C@@H]1C[C@H]1Sc2ccccc2 Amb28400027 [0,0,0,1,0,1|2,0,0]=4 11400 B13R2.50 OCC1CC1Cc2ccccc2 Amb25234915 [0,0,0,1,0,1|2,0,0]=4 11401 B13R2.50 OC[C@@H]1C[C@@H]1Sc2ccccc2 Amb27472753 [0,0,0,1,0,1|2,0,0]=4 11402 B13R2.50 OC[C@@H]1C[C@H]1Oc2ccccc2 Amb27619228 [0,0,0,1,0,1|2,0,0]=4 11403 B13R2.64 C(=C1/CCNC1)/c2ccccc2 Amb26544410 [0,0,0,1,0,1|0,0,1]=3 11404 B13R2.64 C(=C1CCCC1)c2ccccc2 Amb10606582 [0,0,0,1,0,1|1,0,1]=4 11405 B13R2.64 C1=CC(Sc2ccccc2)CC1 Amb17939289 [0,0,0,1,0,1|1,0,1]=4 11406 B13R2.64 C1=CCC(Cc2ccccc2)C1 Amb29888235 [0,0,0,1,0,1|1,0,1]=4 11407 B13R2.64 C1=N[C@@H](Cc2ccccc2)CN1 Amb27475965 [0,0,0,1,0,1|1,0,1]=4 11408 B13R2.64 C1=N[C@H](Cc2ccccc2)CN1 Amb27834345 [0,0,0,1,0,1|1,0,1]=4 11409 B13R2.64 C1=[N+](Cc2ccccc2)CCN1 Amb27608681 [0,0,0,1,0,1|1,0,1]=4 11410 B13R2.64 c1cc(CC2CCNC2)ccn1 Amb33546033 [0,0,0,1,0,1|1,0,0]=3 11411 B13R2.64 c1cc(CC2CCNC2)ncn1 Amb24714436 [0,0,0,1,0,1|2,0,0]=4 11412 B13R2.64 c1cc(NC2CCCC2)ccn1 Amb6619218 [0,0,0,1,0,1|2,0,0]=4 11413 B13R2.64 c1cc(NC2CCNC2)ccn1 Amb18961189 [0,0,0,1,0,1|1,0,0]=3 11414 B13R2.64 c1cc(NC2CCNC2)ncn1 Amb18961196 [0,0,0,1,0,1|2,0,0]=4 11415 B13R2.64 c1cc(N[C@@H]2CCNC2)ncn1 Amb27445458 [0,0,0,1,0,1|2,0,0]=4 11416 B13R2.64 c1cc(N[C@H]2CCNC2)ncn1 Amb27195395 [0,0,0,1,0,1|2,0,0]=4 11417 B13R2.64 c1cc(OC2CCNC2)ccn1 Amb18285255 [0,0,0,1,0,1|1,0,0]=3 11418 B13R2.64 c1cc(OC2CCNC2)ccn1 Amb22899481 [0,0,0,1,0,1|1,0,0]=3 11419 B13R2.64 c1cc(OC2CCNC2)ccn1 Amb32666166 [0,0,0,1,0,1|1,0,0]=3 11420 B13R2.64 c1cc(OC2CCNC2)ncn1 Amb18285229 [0,0,0,1,0,1|2,0,0]=4 11421 B13R2.64 c1cc(OC2CCOC2)ccn1 Amb27267499 [0,0,0,1,0,1|2,0,0]=4 11422 B13R2.64 c1cc(O[C@@H]2CCNC2)ccn1 Amb22274090 [0,0,0,1,0,1|1,0,0]=3 11423 B13R2.64 c1cc(O[C@@H]2CCNC2)ccn1 Amb26865766 [0,0,0,1,0,1|1,0,0]=3 11424 B13R2.64 c1cc(O[C@H]2CCNC2)ccn1 Amb22274091 [0,0,0,1,0,1|1,0,0]=3 11425 B13R2.64 c1cc(O[C@H]2CCNC2)ccn1 Amb26967468 [0,0,0,1,0,1|1,0,0]=3 11426 B13R2.64 c1cc(SC2CCCC2)ccn1 Amb27653928 [0,0,0,1,0,1|2,0,0]=4 11427 B13R2.64 c1cc(SC2CCNC2)ccn1 Amb27389200 [0,0,0,1,0,1|1,0,0]=3 11428 B13R2.64 c1ccc(CC2CCCN2)cc1 Amb17659145 [0,0,0,1,0,1|2,0,0]=4 11429 B13R2.64 c1ccc(CC2CCNC2)cc1 Amb24097496 [0,0,0,1,0,1|0,0,0]=2 11430 B13R2.64 c1ccc(CC2CCNC2)cc1 Amb3940960 [0,0,0,1,0,1|0,0,0]=2 11431 B13R2.64 c1ccc(CC2CCNC2)nc1 Amb18563559 [0,0,0,1,0,1|1,0,0]=3 11432 B13R2.64 c1ccc(CC2CCNC2)nc1 Amb21960663 [0,0,0,1,0,1|1,0,0]=3 11433 B13R2.64 c1ccc(CC2CCOC2)cc1 Amb27770987 [0,0,0,1,0,1|1,0,0]=3 11434 B13R2.64 c1ccc(CC2COCN2)cc1 Amb18563410 [0,0,0,1,0,1|2,0,0]=4 11435 B13R2.64 c1ccc(CN2CCCC2)cc1 Amb1829831 [0,0,0,1,0,1|2,0,0]=4 11436 B13R2.64 c1ccc(CN2CCNC2)cc1 Amb22494689 [0,0,0,1,0,1|1,0,0]=3 11437 B13R2.64 c1ccc(CN2CCOC2)cc1 Amb22229191 [0,0,0,1,0,1|2,0,0]=4 11438 B13R2.64 c1ccc(C[C@@H]2CCCN2)cc1 Amb19883945 [0,0,0,1,0,1|2,0,0]=4 11439 B13R2.64 c1ccc(C[C@@H]2CCCN2)cc1 Amb30586559 [0,0,0,1,0,1|2,0,0]=4 11440 B13R2.64 c1ccc(C[C@@H]2CCNC2)nc1 Amb35825217 [0,0,0,1,0,1|1,0,0]=3 11441 B13R2.64 c1ccc(C[C@H]2CCCN2)cc1 Amb27160705 [0,0,0,1,0,1|2,0,0]=4 11442 B13R2.64 c1ccc(C[C@H]2CCCN2)cc1 Amb33877453 [0,0,0,1,0,1|2,0,0]=4 11443 B13R2.64 c1ccc(C[C@H]2CCNC2)nc1 Amb35825216 [0,0,0,1,0,1|1,0,0]=3 11444 B13R2.64 c1ccc(C[C@H]2COCN2)cc1 Amb27634861 [0,0,0,1,0,1|2,0,0]=4 11445 B13R2.64 c1ccc(C[S+]2CCCC2)cc1 Amb24730066 [0,0,0,1,0,1|2,0,0]=4 11446 B13R2.64 c1ccc(N=C2CCCC2)cc1 Amb27986023 [0,0,0,1,0,1|1,0,1]=4 11447 B13R2.64 c1ccc(NC2CCCC2)cc1 Amb33527378 [0,0,0,1,0,1|1,0,0]=3 11448 B13R2.64 c1ccc(NC2CCCC2)nc1 Amb6610845 [0,0,0,1,0,1|2,0,0]=4 11449 B13R2.64 c1ccc(NC2CCCO2)cc1 Amb27614715 [0,0,0,1,0,1|2,0,0]=4 11450 B13R2.64 c1ccc(NC2CCNC2)cc1 Amb9768320 [0,0,0,1,0,1|0,0,0]=2 11451 B13R2.64 c1ccc(NC2CCNC2)nc1 Amb22272341 [0,0,0,1,0,1|1,0,0]=3 11452 B13R2.64 c1ccc(NC2CCNC2)nc1 Amb33530316 [0,0,0,1,0,1|1,0,0]=3 11453 B13R2.64 c1ccc(NC2CCOC2)cc1 Amb25310936 [0,0,0,1,0,1|1,0,0]=3 11454 B13R2.64 c1ccc(NC2CCOC2)cc1 Amb32729444 [0,0,0,1,0,1|1,0,0]=3 11455 B13R2.64 c1ccc(NC2CCOC2)nc1 Amb27214103 [0,0,0,1,0,1|2,0,0]=4 11456 B13R2.64 c1ccc(NC2CCSC2)cc1 Amb6685079 [0,0,0,1,0,1|1,0,0]=3 11457 B13R2.64 c1ccc(NC2CCSC2)nc1 Amb27964961 [0,0,0,1,0,1|2,0,0]=4 11458 B13R2.64 c1ccc(N[C@H]2CCNC2)nc1 Amb22736983 [0,0,0,1,0,1|1,0,0]=3 11459 B13R2.64 c1ccc(OC2CCCC2)cc1 Amb17672970 [0,0,0,1,0,1|1,0,0]=3 11460 B13R2.64 c1ccc(OC2CCCC2)nc1 Amb26036595 [0,0,0,1,0,1|2,0,0]=4 11461 B13R2.64 c1ccc(OC2CCCO2)cc1 Amb22752483 [0,0,0,1,0,1|2,0,0]=4 11462 B13R2.64 c1ccc(OC2CCNC2)cc1 Amb21955028 [0,0,0,1,0,1|0,0,0]=2 11463 B13R2.64 c1ccc(OC2CCNC2)cc1 Amb33552314 [0,0,0,1,0,1|0,0,0]=2 11464 B13R2.64 c1ccc(OC2CCNC2)nc1 Amb18285220 [0,0,0,1,0,1|1,0,0]=3 11465 B13R2.64 c1ccc(OC2CCNC2)nc1 Amb32411746 [0,0,0,1,0,1|1,0,0]=3 11466 B13R2.64 c1ccc(OC2CCOC2)nc1 Amb31193829 [0,0,0,1,0,1|2,0,0]=4 11467 B13R2.64 c1ccc(OC2CCSC2)cc1 Amb35705130 [0,0,0,1,0,1|1,0,0]=3 11468 B13R2.64 c1ccc(OC2CCSC2)nc1 Amb31193689 [0,0,0,1,0,1|2,0,0]=4 11469 B13R2.64 c1ccc(O[C@@H]2CCNC2)cc1 Amb25048825 [0,0,0,1,0,1|0,0,0]=2 11470 B13R2.64 c1ccc(O[C@@H]2CCNC2)cc1 Amb30526957 [0,0,0,1,0,1|0,0,0]=2 11471 B13R2.64 c1ccc(O[C@@H]2CCNC2)nc1 Amb26956088 [0,0,0,1,0,1|1,0,0]=3 11472 B13R2.64 c1ccc(O[C@@H]2CCNC2)nc1 Amb33812487 [0,0,0,1,0,1|1,0,0]=3 11473 B13R2.64 c1ccc(O[C@H]2CCNC2)cc1 Amb26011960 [0,0,0,1,0,1|0,0,0]=2 11474 B13R2.64 c1ccc(O[C@H]2CCNC2)cc1 Amb30526964 [0,0,0,1,0,1|0,0,0]=2 11475 B13R2.64 c1ccc(O[C@H]2CCNC2)nc1 Amb22745639 [0,0,0,1,0,1|1,0,0]=3 11476 B13R2.64 c1ccc(O[C@H]2CCNC2)nc1 Amb24400606 [0,0,0,1,0,1|1,0,0]=3 11477 B13R2.64 c1ccc(SC2CCCC2)nc1 Amb27397434 [0,0,0,1,0,1|2,0,0]=4 11478 B13R2.64 c1ccc(SC2CCCO2)cc1 Amb28042934 [0,0,0,1,0,1|2,0,0]=4 11479 B13R2.64 c1ccc(SC2CCNC2)cc1 Amb17191396 [0,0,0,1,0,1|0,0,0]=2 11480 B13R2.64 c1ccc(SC2CCNC2)cc1 Amb35745750 [0,0,0,1,0,1|0,0,0]=2 11481 B13R2.64 c1ccc(SC2CCNC2)nc1 Amb18960214 [0,0,0,1,0,1|1,0,0]=3 11482 B13R2.64 c1ccc(S[C@H]2CCNC2)nc1 Amb27405850 [0,0,0,1,0,1|1,0,0]=3 11483 B13R2.64 c1cnc(CC2CCNC2)cn1 Amb24616900 [0,0,0,1,0,1|2,0,0]=4 11484 B13R2.64 c1cnc(CC2CCNC2)nc1 Amb20062033 [0,0,0,1,0,1|2,0,0]=4 11485 B13R2.64 c1cnc(NC2CCNC2)cn1 Amb17515647 [0,0,0,1,0,1|2,0,0]=4 11486 B13R2.64 c1cnc(NC2CCNC2)nc1 Amb17515609 [0,0,0,1,0,1|2,0,0]=4 11487 B13R2.64 c1cnc(NC2CCNC2)nc1 Amb22272342 [0,0,0,1,0,1|2,0,0]=4 11488 B13R2.64 c1cnc(N[C@H]2CCNC2)nc1 Amb27626987 [0,0,0,1,0,1|2,0,0]=4 11489 B13R2.64 c1cnc(OC2CCNC2)cn1 Amb18285264 [0,0,0,1,0,1|2,0,0]=4 11490 B13R2.64 c1cnc(OC2CCNC2)nc1 Amb18285265 [0,0,0,1,0,1|2,0,0]=4 11491 B13R2.64 c1cnc(O[C@H]2CCNC2)cn1 Amb22272733 [0,0,0,1,0,1|2,0,0]=4 11492 B13R2.64 c1cnc(SC2CCNC2)cn1 Amb27656833 [0,0,0,1,0,1|2,0,0]=4 11493 B13R2.64 c1cnc(SC2CCNC2)nc1 Amb18960217 [0,0,0,1,0,1|2,0,0]=4 11494 B13R2.64 c1cnc(S[C@@H]2CCNC2)cn1 Amb27430298 [0,0,0,1,0,1|2,0,0]=4 11495 B13R2.64 c1cnc(S[C@@H]2CCNC2)nc1 Amb27881776 [0,0,0,1,0,1|2,0,0]=4 11496 B13R2.64 c1cnc(S[C@H]2CCNC2)nc1 Amb27969340 [0,0,0,1,0,1|2,0,0]=4 11497 B13R2.64 c1cncc(CC2CCNC2)c1 Amb10808478 [0,0,0,1,0,1|1,0,0]=3 11498 B13R2.64 c1cncc(CC2CCNC2)c1 Amb33869822 [0,0,0,1,0,1|1,0,0]=3 11499 B13R2.64 c1cncc(CC2CCNC2)c1 Amb8009647 [0,0,0,1,0,1|1,0,0]=3 11500 B13R2.64 c1cncc(NC2CCCC2)c1 Amb6686489 [0,0,0,1,0,1|2,0,0]=4 11501 B13R2.64 c1cncc(OC2CCNC2)c1 Amb20634441 [0,0,0,1,0,1|1,0,0]=3 11502 B13R2.64 c1cncc(OC2CCNC2)c1 Amb21955070 [0,0,0,1,0,1|1,0,0]=3 11503 B13R2.64 c1cncc(OC2CCNC2)c1 Amb21957625 [0,0,0,1,0,1|1,0,0]=3 11504 B13R2.64 c1cncc(OC2CCSC2)c1 Amb35705131 [0,0,0,1,0,1|2,0,0]=4 11505 B13R2.64 c1cncc(O[C@@H]2CCNC2)c1 Amb33871542 [0,0,0,1,0,1|1,0,0]=3 11506 B13R2.64 c1cncc(O[C@@H]2CCNC2)c1 Amb34913483 [0,0,0,1,0,1|1,0,0]=3 11507 B13R2.64 c1cnnc(NC2CCNC2)c1 Amb18286148 [0,0,0,1,0,1|2,0,0]=4 11508 B13R2.64 c1cnnc(NC2CCNC2)c1 Amb34913880 [0,0,0,1,0,1|2,0,0]=4 11509 B13R2.64 c1ncc(CC2CCNC2)cn1 Amb24428239 [0,0,0,1,0,1|2,0,0]=4 11510 B13R2.64 c1ncc(NC2CCNC2)cn1 Amb27270787 [0,0,0,1,0,1|2,0,0]=4 11511 B13R2.64 c1ncc(OC2CCNC2)cn1 Amb33224166 [0,0,0,1,0,1|2,0,0]=4 11512 B13R2.135 CC1Oc2ccccc2C1CN Amb27419840 [0,0,0,1,0,1|2,0,0]=4 11513 B13R2.135 CCC1c2ccccc2CC1O Amb28077897 [0,0,0,1,0,1|2,0,0]=4 11514 B13R2.135 CCC1c2ccccc2NC1C Amb24308998 [0,0,0,1,0,1|1,0,0]=3 11515 B13R2.135 CC[C@H]1c2ccccc2N[C@H]1C Amb27441788 [0,0,0,1,0,1|1,0,0]=3 11516 B13R2.135 CNC1C(=O)Nc2ccccc21 Amb1113865 [0,0,0,1,0,1|1,0,1]=4 11517 B13R2.135 CNC1C(=O)Oc2ccccc21 Amb2795868 [0,0,0,1,0,1|1,0,1]=4 11518 B13R2.135 CNC1c2ccccc2CC1C Amb18279352 [0,0,0,1,0,1|0,0,0]=2 11519 B13R2.135 CNC1c2ccccc2CC1O Amb25772931 [0,0,0,1,0,1|1,0,0]=3 11520 B13R2.135 CNC1c2ccccc2SC1C Amb18279380 [0,0,0,1,0,1|0,0,0]=2 11521 B13R2.135 CN[C@@H]1c2ccccc2C[C@H]1O Amb28457545 [0,0,0,1,0,1|1,0,0]=3 11522 B13R2.135 CN[C@H]1c2ccccc2C[C@@H]1O Amb28132798 [0,0,0,1,0,1|1,0,0]=3 11523 B13R2.135 CN[C@H]1c2ccccc2C[C@H]1O Amb27471118 [0,0,0,1,0,1|1,0,0]=3 11524 B13R2.135 COC1c2ccccc2CC1Br Amb27845219 [0,0,0,1,0,1|2,0,0]=4 11525 B13R2.135 COC1c2ccccc2CC1N Amb9677486 [0,0,0,1,0,1|2,0,0]=4 11526 B13R2.135 COC1c2ccccc2CC1O Amb22227971 [0,0,0,1,0,1|2,0,0]=4 11527 B13R2.135 CO[C@H]1c2ccccc2C[C@@H]1Br Amb26493433 [0,0,0,1,0,1|2,0,0]=4 11528 B13R2.135 CO[C@H]1c2ccccc2C[C@@H]1O Amb22757738 [0,0,0,1,0,1|2,0,0]=4 11529 B13R2.135 CO[C@H]1c2ccccc2C[C@H]1N Amb25162040 [0,0,0,1,0,1|2,0,0]=4 11530 B13R2.135 CO[C@H]1c2ccccc2C[C@H]1O Amb539569 [0,0,0,1,0,1|2,0,0]=4 11531 B13R2.135 CS[C@H]1c2ccccc2C[C@@H]1Cl Amb27630537 [0,0,0,1,0,1|2,0,0]=4 11532 B13R2.138 CC1C(C=O)C1c2ccccc2 Amb28388674 [0,0,0,1,0,1|2,0,0]=4 11533 B13R2.138 CC1C(CN)C1c2ccccc2 Amb28286560 [0,0,0,1,0,1|2,0,0]=4 11534 B13R2.138 C[C@@H]1[C@@H](CO)[C@@H]1c2ccccc2 Amb27194376 [0,0,0,1,0,1|2,0,0]=4 11535 B13R2.138 C[C@@H]1[C@H](CO)[C@H]1c2ccccc2 Amb28350202 [0,0,0,1,0,1|2,0,0]=4 11536 B13R2.138 C[C@H]1[C@@H](C=O)[C@@H]1c2ccccc2 Amb25302243 [0,0,0,1,0,1|2,0,0]=4 11537 B13R2.163 CC1CCNc2ccccc2N1 Amb19337570 [0,0,0,1,0,1|2,0,0]=4 11538 B13R2.163 CC1CCNc2ccccc2O1 Amb17570089 [0,0,0,1,0,1|2,0,0]=4 11539 B13R2.163 CC1CCNc2ccccc2S1 Amb435747 [0,0,0,1,0,1|2,0,0]=4 11540 B13R2.163 CC1CNCc2ccccc2O1 Amb24177077 [0,0,0,1,0,1|0,0,0]=2 11541 B13R2.163 CC1CNCc2ccccc2O1 Amb28600272 [0,0,0,1,0,1|0,0,0]=2 11542 B13R2.163 C[C@@H]1Cc2ccccc2CCN1 Amb24456422 [0,0,0,1,0,1|2,0,0]=4 11543 B13R2.163 C[C@H]1Cc2ccccc2CCN1 Amb28201756 [0,0,0,1,0,1|2,0,0]=4 11544 B13R2.163 FC1CNCc2ccccc2C1 Amb27795712 [0,0,0,1,0,1|1,0,0]=3 11545 B13R2.163 NC1CCCc2ccccc2C1 Amb24355951 [0,0,0,1,0,1|2,0,0]=4 11546 B13R2.163 O=C1CNCc2ccccc2N1 Amb17606145 [0,0,0,1,0,1|1,0,1]=4 11547 B13R2.163 O=C1CNCc2ccccc2N1 Amb28872408 [0,0,0,1,0,1|1,0,1]=4 11548 B13R2.163 OC1CCCc2ccccc2C1 Amb3987828 [0,0,0,1,0,1|2,0,0]=4 11549 B13R2.163 OC1CNCc2ccccc2C1 Amb25148562 [0,0,0,1,0,1|1,0,0]=3 11550 B13R2.197 CC1CC1(N)Cc2ccccc2 Amb28239731 [0,0,0,1,0,1|2,0,0]=4 11551 B13R2.197 CC1CC1(O)Cc2ccccc2 Amb27197240 [0,0,0,1,0,1|2,0,0]=4 11552 B13R2.197 C[C@@H]1C[C@@]1(N)Cc2ccccc2 Amb33804455 [0,0,0,1,0,1|2,0,0]=4 11553 B13R2.197 C[C@@H]1C[C@@]1(N)Cc2ccccc2 Amb33804487 [0,0,0,1,0,1|2,0,0]=4 11554 B13R2.221 CC1(Cc2ccccc2)CNC1 Amb17334538 [0,0,0,1,0,1|0,0,0]=2 11555 B13R2.221 CC1(Cc2ccccc2)CNC1 Amb33141015 [0,0,0,1,0,1|0,0,0]=2 11556 B13R2.221 CC1(Nc2ccccn2)CCC1 Amb27236390 [0,0,0,1,0,1|2,0,0]=4 11557 B13R2.221 CC1(Nc2ccncc2)CNC1 Amb28345920 [0,0,0,1,0,1|1,0,0]=3 11558 B13R2.221 CC1(Oc2ccccc2)CNC1 Amb24077480 [0,0,0,1,0,1|0,0,0]=2 11559 B13R2.221 CC1(Oc2ccccc2)CNC1 Amb25713338 [0,0,0,1,0,1|0,0,0]=2 11560 B13R2.221 CC1(Oc2ccccn2)CNC1 Amb33360125 [0,0,0,1,0,1|1,0,0]=3 11561 B13R2.221 CC1(Oc2cccnc2)CNC1 Amb33429594 [0,0,0,1,0,1|1,0,0]=3 11562 B13R2.221 CC1(Oc2ccncc2)CNC1 Amb33380620 [0,0,0,1,0,1|1,0,0]=3 11563 B13R2.221 CC1(Oc2ccncn2)CNC1 Amb33267928 [0,0,0,1,0,1|2,0,0]=4 11564 B13R2.221 CC1(Oc2cnccn2)CNC1 Amb33429611 [0,0,0,1,0,1|2,0,0]=4 11565 B13R2.221 CC1(Oc2cncnc2)CNC1 Amb32875715 [0,0,0,1,0,1|2,0,0]=4 11566 B13R2.221 CC1(Oc2ncccn2)CNC1 Amb33269610 [0,0,0,1,0,1|2,0,0]=4 11567 B13R2.221 FC1(Cc2ccccc2)CNC1 Amb28381559 [0,0,0,1,0,1|1,0,0]=3 11568 B13R2.221 FC1(Cc2ccccn2)CNC1 Amb27817423 [0,0,0,1,0,1|2,0,0]=4 11569 B13R2.221 NC1(Cc2ccccc2)CCC1 Amb20669182 [0,0,0,1,0,1|2,0,0]=4 11570 B13R2.221 NC1(Cc2ccccc2)CCC1 Amb5737566 [0,0,0,1,0,1|2,0,0]=4 11571 B13R2.221 NC1(Cc2ccccc2)COC1 Amb23439404 [0,0,0,1,0,1|2,0,0]=4 11572 B13R2.221 NC1(Cc2ccccc2)COC1 Amb30869340 [0,0,0,1,0,1|2,0,0]=4 11573 B13R2.221 OC1(Cc2ccccc2)CNC1 Amb24416845 [0,0,0,1,0,1|1,0,0]=3 11574 B13R2.221 OC1(Cc2ccccc2)COC1 Amb35658902 [0,0,0,1,0,1|2,0,0]=4 11575 B13R2.221 OC1(Cc2ccccn2)CNC1 Amb26499016 [0,0,0,1,0,1|2,0,0]=4 11576 B13R2.221 OC1(Cc2cccnc2)CNC1 Amb24463303 [0,0,0,1,0,1|2,0,0]=4 11577 B13R2.221 OC1(Cc2ccncc2)CNC1 Amb27748560 [0,0,0,1,0,1|2,0,0]=4 11578 B13R2.328 CC1=CN(C)c2ccccc2N1 Amb27620722 [0,0,0,1,0,1|0,0,2]=4 11579 B13R2.328 CC1=N[C@@H](C)Cc2ccccc21 Amb27221957 [0,0,0,1,0,1|2,0,0]=4 11580 B13R2.328 CC1=Nc2ccccc2N(C)C1 Amb24591845 [0,0,0,1,0,1|0,0,1]=3 11581 B13R2.328 CC1CC(=O)c2ccccc2C1 Amb17594003 [0,0,0,1,0,1|2,0,0]=4 11582 B13R2.328 CC1CC(=O)c2ccccc2N1 Amb18560059 [0,0,0,1,0,1|2,0,0]=4 11583 B13R2.328 CC1CC(=O)c2ccccc2O1 Amb9398195 [0,0,0,1,0,1|2,0,0]=4 11584 B13R2.328 CC1CC(=O)c2ccccc2S1 Amb9398275 [0,0,0,1,0,1|2,0,0]=4 11585 B13R2.328 CC1CC(C)c2ccccc2N1 Amb26967461 [0,0,0,1,0,1|1,0,0]=3 11586 B13R2.328 CC1CC(N)c2ccccc2O1 Amb32666312 [0,0,0,1,0,1|2,0,0]=4 11587 B13R2.328 CC1CC(N)c2ccccc2O1 Amb9398792 [0,0,0,1,0,1|2,0,0]=4 11588 B13R2.328 CC1CC(O)Oc2ccccc21 Amb27397053 [0,0,0,1,0,1|2,0,0]=4 11589 B13R2.328 CC1CC(O)c2ccccc2O1 Amb24669760 [0,0,0,1,0,1|2,0,0]=4 11590 B13R2.328 CC1CN(C)Cc2ccccc21 Amb17971060 [0,0,0,1,0,1|2,0,0]=4 11591 B13R2.328 CC1CN(C)c2ccccc2N1 Amb18061952 [0,0,0,1,0,1|0,0,0]=2 11592 B13R2.328 CC1CN(C)c2ccccc2O1 Amb27587596 [0,0,0,1,0,1|0,0,0]=2 11593 B13R2.328 CC1Cc2ccccc2C(C)N1 Amb18829882 [0,0,0,1,0,1|2,0,0]=4 11594 B13R2.328 CN1CC(=O)Nc2ccccc21 Amb21864918 [0,0,0,1,0,1|1,0,1]=4 11595 B13R2.328 CN1CC(N)Cc2ccccc21 Amb25667266 [0,0,0,1,0,1|1,0,0]=3 11596 B13R2.328 CN1CC(N)Cc2ccccc21 Amb28555753 [0,0,0,1,0,1|1,0,0]=3 11597 B13R2.328 CN1CC(O)=Cc2ccccc21 Amb27827527 [0,0,0,1,0,1|1,0,1]=4 11598 B13R2.328 C[C@@H]1CC(=O)c2ccccc2N1 Amb26940694 [0,0,0,1,0,1|2,0,0]=4 11599 B13R2.328 C[C@@H]1CC(=O)c2ccccc2O1 Amb25713529 [0,0,0,1,0,1|2,0,0]=4 11600 B13R2.328 C[C@@H]1C[C@@H](C)c2ccccc2N1 Amb27446578 [0,0,0,1,0,1|1,0,0]=3 11601 B13R2.328 C[C@@H]1C[C@@H](N)c2ccccc2O1 Amb26008330 [0,0,0,1,0,1|2,0,0]=4 11602 B13R2.328 C[C@@H]1C[C@@H](N)c2ccccc2O1 Amb32661709 [0,0,0,1,0,1|2,0,0]=4 11603 B13R2.328 C[C@@H]1C[C@@H](O)c2ccccc2O1 Amb24579780 [0,0,0,1,0,1|2,0,0]=4 11604 B13R2.328 C[C@@H]1C[C@H](N)c2ccccc2O1 Amb25175782 [0,0,0,1,0,1|2,0,0]=4 11605 B13R2.328 C[C@@H]1C[C@H](N)c2ccccc2O1 Amb32661736 [0,0,0,1,0,1|2,0,0]=4 11606 B13R2.328 C[C@@H]1C[C@H](O)c2ccccc2N1 Amb27238767 [0,0,0,1,0,1|2,0,0]=4 11607 B13R2.328 C[C@@H]1C[C@H](O)c2ccccc2O1 Amb26849920 [0,0,0,1,0,1|2,0,0]=4 11608 B13R2.328 C[C@@H]1Cc2ccccc2[C@@H](O)C1 Amb27438494 [0,0,0,1,0,1|2,0,0]=4 11609 B13R2.328 C[C@@H]1Cc2ccccc2[C@H](O)C1 Amb28344692 [0,0,0,1,0,1|2,0,0]=4 11610 B13R2.328 C[C@@H]1N[C@@H](C)Oc2ccccc21 Amb28051938 [0,0,0,1,0,1|2,0,0]=4 11611 B13R2.328 C[C@@H]1N[C@H](C)Cc2ccccc21 Amb27420003 [0,0,0,1,0,1|2,0,0]=4 11612 B13R2.328 C[C@H]1CC(O)c2ccccc2O1 Amb28350093 [0,0,0,1,0,1|2,0,0]=4 11613 B13R2.328 C[C@H]1C[C@@H](C)Nc2ccccc21 Amb33330460 [0,0,0,1,0,1|1,0,0]=3 11614 B13R2.328 C[C@H]1C[C@@H](O)c2ccccc2O1 Amb25317640 [0,0,0,1,0,1|2,0,0]=4 11615 B13R2.328 C[C@H]1Cc2ccccc2[C@@H](O)C1 Amb28435717 [0,0,0,1,0,1|2,0,0]=4 11616 B13R2.328 N[C@H]1Cc2ccccc2N(O)C1 Amb27840413 [0,0,0,1,0,1|2,0,0]=4 11617 B13R2.444 CC(Nc1ccccc1)C2CC2 Amb2760825 [0,0,0,1,0,1|1,0,0]=3 11618 B13R2.444 CC(Nc1ccccc1)C2CC2 Amb6685121 [0,0,0,1,0,1|1,0,0]=3 11619 B13R2.444 CC(Nc1ccncc1)C2CC2 Amb9395245 [0,0,0,1,0,1|2,0,0]=4 11620 B13R2.444 CC(Oc1ccccn1)C2CC2 Amb31198127 [0,0,0,1,0,1|2,0,0]=4 11621 B13R2.444 C\C(=C/c1ccccc1)C2CO2 Amb32953224 [0,0,0,1,0,1|1,0,1]=4 11622 B13R2.444 C\C(=C/c1ccccc1)[C@@H]2CO2 Amb33381484 [0,0,0,1,0,1|1,0,1]=4 11623 B13R2.444 C\C(=C/c1ccccc1)[C@H]2CO2 Amb33381508 [0,0,0,1,0,1|1,0,1]=4 11624 B13R2.444 NC(Cc1ccccc1)C2CC2 Amb17138534 [0,0,0,1,0,1|2,0,0]=4 11625 B13R2.444 NC(Cc1ccccc1)C2CC2 Amb33548408 [0,0,0,1,0,1|2,0,0]=4 11626 B13R2.444 NC(Cc1ccccc1)C2CO2 Amb27178072 [0,0,0,1,0,1|2,0,0]=4 11627 B13R2.444 N[C@@H](Cc1ccccc1)C2CC2 Amb27253031 [0,0,0,1,0,1|2,0,0]=4 11628 B13R2.444 N[C@@H](Cc1ccccc1)[C@@H]2CO2 Amb27453506 [0,0,0,1,0,1|2,0,0]=4 11629 B13R2.444 OC(Cc1ccccc1)C2CC2 Amb17138544 [0,0,0,1,0,1|2,0,0]=4 11630 B13R2.444 O[C@@H](Cc1ccccc1)[C@H]2CO2 Amb28194254 [0,0,0,1,0,1|2,0,0]=4 11631 B13R2.2959 C=CCC1(C)Cc2ccccc21 Amb17844032 [0,0,0,1,0,1|1,0,1]=4 11632 B13R2.2959 CC1(CCO)Cc2ccccc21 Amb27835892 [0,0,0,1,0,1|2,0,0]=4 11633 B13R2.2959 CCCC1(N)Cc2ccccc21 Amb27469683 [0,0,0,1,0,1|2,0,0]=4 11634 B13R2.1 BrCCC1CCc2ccccc21 Amb25175768 [0,1,0,1,0,0|2,0,0]=4 11635 B13R2.1 C#CCC1CCc2ccccc21 Amb33145116 [0,1,0,1,0,0|1,0,1]=4 11636 B13R2.1 C#CCC1NCc2ccccc21 Amb27235672 [0,1,0,1,0,0|1,0,1]=4 11637 B13R2.1 C=CCC1NCc2ccccc21 Amb27656928 [0,1,0,1,0,0|1,0,1]=4 11638 B13R2.1 CCCC1CNc2ccccc21 Amb25882717 [0,1,0,1,0,0|1,0,0]=3 11639 B13R2.1 CCCN1CCc2ccccc21 Amb4036579 [0,1,0,1,0,0|2,0,0]=4 11640 B13R2.1 CCNC1CCc2ccccc21 Amb10610131 [0,1,0,1,0,0|2,0,0]=4 11641 B13R2.1 CCNC1CCc2ccccc21 Amb9722140 [0,1,0,1,0,0|2,0,0]=4 11642 B13R2.1 CCNC1CNc2ccccc21 Amb27642737 [0,1,0,1,0,0|2,0,0]=4 11643 B13R2.1 CCSC1CCc2ccccc21 Amb27220071 [0,1,0,1,0,0|2,0,0]=4 11644 B13R2.1 CNCC1C=Cc2ccccc21 Amb27463630 [0,1,0,1,0,0|0,0,1]=3 11645 B13R2.1 CNCC1CCc2ccccc21 Amb17470428 [0,1,0,1,0,0|0,0,0]=2 11646 B13R2.1 CNCC1CCc2cncnc21 Amb27636417 [0,1,0,1,0,0|2,0,0]=4 11647 B13R2.1 CNCC1CNc2ccccc21 Amb27864740 [0,1,0,1,0,0|0,0,0]=2 11648 B13R2.1 CNCC1COc2ccccc21 Amb23586279 [0,1,0,1,0,0|0,0,0]=2 11649 B13R2.1 CNCC1OCc2ccccc21 Amb34915058 [0,1,0,1,0,0|0,0,0]=2 11650 B13R2.1 CNCc1coc2ccccc12 Amb19649828 [0,1,0,1,0,0|0,0,2]=4 11651 B13R2.1 CNCc1csc2ccccc12 Amb18286790 [0,1,0,1,0,0|0,0,2]=4 11652 B13R2.1 CNCc1csc2ccccc12 Amb9147582 [0,1,0,1,0,0|0,0,2]=4 11653 B13R2.1 CN\N=C1\CCc2ccccc21 Amb28122233 [0,1,0,1,0,0|1,0,1]=4 11654 B13R2.1 COCC1CSc2ccccc21 Amb27410794 [0,1,0,1,0,0|1,0,0]=3 11655 B13R2.1 COCC1NCc2ccccc21 Amb27457641 [0,1,0,1,0,0|1,0,0]=3 11656 B13R2.1 CONC1CCc2ccccc21 Amb27470590 [0,1,0,1,0,0|2,0,0]=4 11657 B13R2.1 CONC1COc2ccccc21 Amb27868132 [0,1,0,1,0,0|2,0,0]=4 11658 B13R2.1 ICCC1CNc2ccccc21 Amb27463520 [0,1,0,1,0,0|2,0,0]=4 11659 B13R2.1 N#CCC1CCc2ccccc21 Amb18644935 [0,1,0,1,0,0|2,0,0]=4 11660 B13R2.1 N#CCC1CNc2ccccc21 Amb18063500 [0,1,0,1,0,0|2,0,0]=4 11661 B13R2.1 N#CCC1COc2ccccc21 Amb26370957 [0,1,0,1,0,0|2,0,0]=4 11662 B13R2.1 NCCC1CCc2ccccc21 Amb17232390 [0,1,0,1,0,0|2,0,0]=4 11663 B13R2.1 NCCC1CNc2ccccc21 Amb18560682 [0,1,0,1,0,0|2,0,0]=4 11664 B13R2.1 NCCC1COc2ccccc21 Amb18829250 [0,1,0,1,0,0|2,0,0]=4 11665 B13R2.1 NCCC1CSc2ccccc21 Amb18194201 [0,1,0,1,0,0|2,0,0]=4 11666 B13R2.1 NCCC1OCc2ccccc21 Amb18829221 [0,1,0,1,0,0|2,0,0]=4 11667 B13R2.1 NNCC1CCc2ccccc21 Amb26474283 [0,1,0,1,0,0|1,0,0]=3 11668 B13R2.1 NOCC1CCc2ccccc21 Amb33145741 [0,1,0,1,0,0|2,0,0]=4 11669 B13R2.1 NOCC1COc2ccccc21 Amb27759143 [0,1,0,1,0,0|2,0,0]=4 11670 B13R2.1 O=CCC1CCc2ccccc21 Amb26865434 [0,1,0,1,0,0|2,0,0]=4 11671 B13R2.1 OCCC1CCc2ccccc21 Amb10605019 [0,1,0,1,0,0|2,0,0]=4 11672 B13R2.1 OCCC1CNc2ccccc21 Amb9776213 [0,1,0,1,0,0|2,0,0]=4 11673 B13R2.1 OCCC1NCc2ccccc21 Amb33212838 [0,1,0,1,0,0|2,0,0]=4 11674 B13R2.1 OCC[C@@H]1CNc2ccccc21 Amb28255652 [0,1,0,1,0,0|2,0,0]=4 11675 B13R2.1 OCC[C@H]1CNc2ccccc21 Amb28137928 [0,1,0,1,0,0|2,0,0]=4 11676 B13R2.1 ONCC1CCc2ccccc21 Amb33146411 [0,1,0,1,0,0|1,0,0]=3 11677 B13R2.1 SCCC1CCc2ccccc21 Amb33144216 [0,1,0,1,0,0|2,0,0]=4 11678 B13R2.1 [C-]#[N+]CC1CCc2ccccc21 Amb33145755 [0,1,0,1,0,0|0,0,2]=4 11679 B13R2.3 C1=C(c2ccccc2)CCCC1 Amb8513291 [0,1,0,1,0,0|1,0,1]=4 11680 B13R2.3 C1=C(c2ccccc2)CCNC1 Amb1153094 [0,1,0,1,0,0|0,0,1]=3 11681 B13R2.3 C1=C(c2ccccc2)CCNC1 Amb535503 [0,1,0,1,0,0|0,0,1]=3 11682 B13R2.3 C1=C(c2ccccc2)CCOC1 Amb21960770 [0,1,0,1,0,0|1,0,1]=4 11683 B13R2.3 C1=C(c2ccccc2)CNCC1 Amb18645223 [0,1,0,1,0,0|0,0,1]=3 11684 B13R2.3 C1=C(c2ccccc2)CNCC1 Amb28600223 [0,1,0,1,0,0|0,0,1]=3 11685 B13R2.3 C1=C(c2ccccn2)CCNC1 Amb32662079 [0,1,0,1,0,0|1,0,1]=4 11686 B13R2.3 C1=C(c2ccccn2)CCNC1 Amb6667297 [0,1,0,1,0,0|1,0,1]=4 11687 B13R2.3 C1=C(c2ccccn2)CNCC1 Amb28185946 [0,1,0,1,0,0|1,0,1]=4 11688 B13R2.3 C1=C(c2ccccn2)CNCC1 Amb28600235 [0,1,0,1,0,0|1,0,1]=4 11689 B13R2.3 C1=C(c2cccnc2)CCNC1 Amb30584828 [0,1,0,1,0,0|1,0,1]=4 11690 B13R2.3 C1=C(c2cccnc2)CCNC1 Amb6667299 [0,1,0,1,0,0|1,0,1]=4 11691 B13R2.3 C1=C(c2cccnc2)CNCC1 Amb25680273 [0,1,0,1,0,0|1,0,1]=4 11692 B13R2.3 C1=C(c2cccnc2)CNCC1 Amb28600278 [0,1,0,1,0,0|1,0,1]=4 11693 B13R2.3 C1=C(c2ccncc2)CCNC1 Amb32662081 [0,1,0,1,0,0|1,0,1]=4 11694 B13R2.3 C1=C(c2ccncc2)CCNC1 Amb6667298 [0,1,0,1,0,0|1,0,1]=4 11695 B13R2.3 C1=C(c2ccncc2)CNCC1 Amb24746559 [0,1,0,1,0,0|1,0,1]=4 11696 B13R2.3 C1=C(c2ccncc2)CNCC1 Amb28963389 [0,1,0,1,0,0|1,0,1]=4 11697 B13R2.3 C1=C(c2ccncc2)CNCC1 Amb32664246 [0,1,0,1,0,0|1,0,1]=4 11698 B13R2.3 C1=CC(c2ccccc2)CCC1 Amb4035356 [0,1,0,1,0,0|1,0,1]=4 11699 B13R2.3 C1=CC(c2ccccc2)CC[NH2+]1 Amb24080270 [0,1,0,1,0,0|0,0,2]=4 11700 B13R2.3 C1=CC(c2ccccc2)NCC1 Amb28119182 [0,1,0,1,0,0|1,0,1]=4 11701 B13R2.3 C1=CCN(C2CNCCN2)C=C1 Amb27619091 [0,1,0,1,0,0|1,0,1]=4 11702 B13R2.3 C1=COC(c2ccccc2)CC1 Amb26038784 [0,1,0,1,0,0|1,0,1]=4 11703 B13R2.3 C1=CSC(c2ccccc2)CN1 Amb28056045 [0,1,0,1,0,0|0,0,2]=4 11704 B13R2.3 C1=NCC(c2ccccc2)CN1 Amb22536298 [0,1,0,1,0,0|0,0,1]=3 11705 B13R2.3 c1cc(C2CCCCC2)ccn1 Amb2694597 [0,1,0,1,0,0|2,0,0]=4 11706 B13R2.3 c1cc(C2CCCCC2)ccn1 Amb32653426 [0,1,0,1,0,0|2,0,0]=4 11707 B13R2.3 c1cc(C2CCCCN2)ccn1 Amb17659185 [0,1,0,1,0,0|2,0,0]=4 11708 B13R2.3 c1cc(C2CCCNC2)ccn1 Amb17400120 [0,1,0,1,0,0|1,0,0]=3 11709 B13R2.3 c1cc(C2CCCNC2)ccn1 Amb22899069 [0,1,0,1,0,0|1,0,0]=3 11710 B13R2.3 c1cc(C2CCCNC2)ncn1 Amb18946434 [0,1,0,1,0,0|2,0,0]=4 11711 B13R2.3 c1cc(C2CCCNC2)ncn1 Amb19372871 [0,1,0,1,0,0|2,0,0]=4 11712 B13R2.3 c1cc(C2CCCNC2)ncn1 Amb32410419 [0,1,0,1,0,0|2,0,0]=4 11713 B13R2.3 c1cc(C2CCCOC2)ccn1 Amb24320761 [0,1,0,1,0,0|2,0,0]=4 11714 B13R2.3 c1cc(C2CCNCC2)ccn1 Amb33533010 [0,1,0,1,0,0|1,0,0]=3 11715 B13R2.3 c1cc(C2CCNCC2)ccn1 Amb8503276 [0,1,0,1,0,0|1,0,0]=3 11716 B13R2.3 c1cc(C2CCNCC2)cnn1 Amb27607705 [0,1,0,1,0,0|2,0,0]=4 11717 B13R2.3 c1cc(C2CCNCC2)cnn1 Amb31217541 [0,1,0,1,0,0|2,0,0]=4 11718 B13R2.3 c1cc(C2CCNCC2)ncn1 Amb18279425 [0,1,0,1,0,0|2,0,0]=4 11719 B13R2.3 c1cc(C2CCNCC2)ncn1 Amb21955897 [0,1,0,1,0,0|2,0,0]=4 11720 B13R2.3 c1cc(C2CCNCC2)ncn1 Amb32663566 [0,1,0,1,0,0|2,0,0]=4 11721 B13R2.3 c1cc(C2CNCCN2)ccn1 Amb24319003 [0,1,0,1,0,0|1,0,0]=3 11722 B13R2.3 c1cc(C2CNCCN2)ccn1 Amb32652099 [0,1,0,1,0,0|1,0,0]=3 11723 B13R2.3 c1cc(C2CNCCO2)ccn1 Amb17063308 [0,1,0,1,0,0|1,0,0]=3 11724 B13R2.3 c1cc(C2CNCCO2)ccn1 Amb22034687 [0,1,0,1,0,0|1,0,0]=3 11725 B13R2.3 c1cc(C2CNCCO2)ncn1 Amb20062272 [0,1,0,1,0,0|2,0,0]=4 11726 B13R2.3 c1cc(C2CNCCS2)ccn1 Amb18824330 [0,1,0,1,0,0|1,0,0]=3 11727 B13R2.3 c1cc(C2CNCCS2)ncn1 Amb18823968 [0,1,0,1,0,0|2,0,0]=4 11728 B13R2.3 c1cc(C2COCCN2)ccn1 Amb18563619 [0,1,0,1,0,0|2,0,0]=4 11729 B13R2.3 c1cc(N2CCNCC2)ccn1 Amb1157798 [0,1,0,1,0,0|2,0,0]=4 11730 B13R2.3 c1cc([C@H]2CCCCN2)ccn1 Amb27978711 [0,1,0,1,0,0|2,0,0]=4 11731 B13R2.3 c1cc([C@H]2CNCCN2)ccn1 Amb27873955 [0,1,0,1,0,0|1,0,0]=3 11732 B13R2.3 c1cc([C@H]2COCCN2)ccn1 Amb25324236 [0,1,0,1,0,0|2,0,0]=4 11733 B13R2.3 c1ccc(C2=NNCCO2)cc1 Amb27808595 [0,1,0,1,0,0|1,0,1]=4 11734 B13R2.3 c1ccc(C2CCCCC2)cc1 Amb6357376 [0,1,0,1,0,0|1,0,0]=3 11735 B13R2.3 c1ccc(C2CCCCC2)nc1 Amb23589742 [0,1,0,1,0,0|2,0,0]=4 11736 B13R2.3 c1ccc(C2CCCCN2)cc1 Amb10068914 [0,1,0,1,0,0|1,0,0]=3 11737 B13R2.3 c1ccc(C2CCCCN2)cc1 Amb9725835 [0,1,0,1,0,0|1,0,0]=3 11738 B13R2.3 c1ccc(C2CCCCN2)nc1 Amb2234698 [0,1,0,1,0,0|2,0,0]=4 11739 B13R2.3 c1ccc(C2CCCCN2)nc1 Amb2237208 [0,1,0,1,0,0|2,0,0]=4 11740 B13R2.3 c1ccc(C2CCCCS2)nc1 Amb28244289 [0,1,0,1,0,0|2,0,0]=4 11741 B13R2.3 c1ccc(C2CCCNC2)cc1 Amb1995213 [0,1,0,1,0,0|0,0,0]=2 11742 B13R2.3 c1ccc(C2CCCNC2)cc1 Amb2236473 [0,1,0,1,0,0|0,0,0]=2 11743 B13R2.3 c1ccc(C2CCCNC2)nc1 Amb21960404 [0,1,0,1,0,0|1,0,0]=3 11744 B13R2.3 c1ccc(C2CCCNC2)nc1 Amb8009677 [0,1,0,1,0,0|1,0,0]=3 11745 B13R2.3 c1ccc(C2CCNCC2)cc1 Amb1019521 [0,1,0,1,0,0|0,0,0]=2 11746 B13R2.3 c1ccc(C2CCNCC2)cc1 Amb2099643 [0,1,0,1,0,0|0,0,0]=2 11747 B13R2.3 c1ccc(C2CCNCC2)nc1 Amb15695238 [0,1,0,1,0,0|1,0,0]=3 11748 B13R2.3 c1ccc(C2CCNCC2)nc1 Amb21857657 [0,1,0,1,0,0|1,0,0]=3 11749 B13R2.3 c1ccc(C2CCNCC2)nc1 Amb33533009 [0,1,0,1,0,0|1,0,0]=3 11750 B13R2.3 c1ccc(C2CCNCO2)cc1 Amb26517864 [0,1,0,1,0,0|0,0,0]=2 11751 B13R2.3 c1ccc(C2CCOCC2)cc1 Amb21856446 [0,1,0,1,0,0|1,0,0]=3 11752 B13R2.3 c1ccc(C2CCOCC2)nc1 Amb10573557 [0,1,0,1,0,0|2,0,0]=4 11753 B13R2.3 c1ccc(C2CCOCN2)cc1 Amb32751745 [0,1,0,1,0,0|1,0,0]=3 11754 B13R2.3 c1ccc(C2CCOCO2)cc1 Amb6357160 [0,1,0,1,0,0|1,0,0]=3 11755 B13R2.3 c1ccc(C2CNCCN2)cc1 Amb10068867 [0,1,0,1,0,0|0,0,0]=2 11756 B13R2.3 c1ccc(C2CNCCN2)cc1 Amb2690307 [0,1,0,1,0,0|0,0,0]=2 11757 B13R2.3 c1ccc(C2CNCCN2)cc1 Amb32663253 [0,1,0,1,0,0|0,0,0]=2 11758 B13R2.3 c1ccc(C2CNCCN2)nc1 Amb24319001 [0,1,0,1,0,0|1,0,0]=3 11759 B13R2.3 c1ccc(C2CNCCO2)cc1 Amb1782012 [0,1,0,1,0,0|0,0,0]=2 11760 B13R2.3 c1ccc(C2CNCCO2)cc1 Amb7085744 [0,1,0,1,0,0|0,0,0]=2 11761 B13R2.3 c1ccc(C2CNCCO2)nc1 Amb17063307 [0,1,0,1,0,0|1,0,0]=3 11762 B13R2.3 c1ccc(C2CNCCO2)nc1 Amb22034685 [0,1,0,1,0,0|1,0,0]=3 11763 B13R2.3 c1ccc(C2CNCCS2)cc1 Amb10068810 [0,1,0,1,0,0|0,0,0]=2 11764 B13R2.3 c1ccc(C2CNCCS2)cc1 Amb3940988 [0,1,0,1,0,0|0,0,0]=2 11765 B13R2.3 c1ccc(C2COCCN2)cc1 Amb10068848 [0,1,0,1,0,0|1,0,0]=3 11766 B13R2.3 c1ccc(C2COCCN2)cc1 Amb18528726 [0,1,0,1,0,0|1,0,0]=3 11767 B13R2.3 c1ccc(C2COCCN2)cc1 Amb5750999 [0,1,0,1,0,0|1,0,0]=3 11768 B13R2.3 c1ccc(C2COCCN2)nc1 Amb18563618 [0,1,0,1,0,0|2,0,0]=4 11769 B13R2.3 c1ccc(C2CSCCN2)cc1 Amb3940996 [0,1,0,1,0,0|1,0,0]=3 11770 B13R2.3 c1ccc(C2CSCC[NH2+]2)cc1 Amb33513153 [0,1,0,1,0,0|1,0,0]=3 11771 B13R2.3 c1ccc(C2NCCCN2)cc1 Amb27229973 [0,1,0,1,0,0|2,0,0]=4 11772 B13R2.3 c1ccc(C2NCCCO2)cc1 Amb17334580 [0,1,0,1,0,0|2,0,0]=4 11773 B13R2.3 c1ccc(C2NCCCO2)cc1 Amb22901047 [0,1,0,1,0,0|2,0,0]=4 11774 B13R2.3 c1ccc(C2OCCCO2)cc1 Amb9787462 [0,1,0,1,0,0|2,0,0]=4 11775 B13R2.3 c1ccc(C2OCCCS2)cc1 Amb26967490 [0,1,0,1,0,0|2,0,0]=4 11776 B13R2.3 c1ccc(C2SCCCS2)cc1 Amb4017359 [0,1,0,1,0,0|2,0,0]=4 11777 B13R2.3 c1ccc(N2CCCCC2)cc1 Amb8391955 [0,1,0,1,0,0|2,0,0]=4 11778 B13R2.3 c1ccc(N2CCNCC2)cc1 Amb2583391 [0,1,0,1,0,0|1,0,0]=3 11779 B13R2.3 c1ccc(N2CCNCC2)cc1 Amb2720123 [0,1,0,1,0,0|1,0,0]=3 11780 B13R2.3 c1ccc(N2CCNCC2)cc1 Amb32405391 [0,1,0,1,0,0|1,0,0]=3 11781 B13R2.3 c1ccc(N2CCNCC2)nc1 Amb1160212 [0,1,0,1,0,0|2,0,0]=4 11782 B13R2.3 c1ccc(N2CCNCC2)nc1 Amb6298105 [0,1,0,1,0,0|2,0,0]=4 11783 B13R2.3 c1ccc(N2CCOCC2)cc1 Amb1019547 [0,1,0,1,0,0|2,0,0]=4 11784 B13R2.3 c1ccc(N2CCSCC2)cc1 Amb23534640 [0,1,0,1,0,0|2,0,0]=4 11785 B13R2.3 c1ccc(N2CC[NH2+]CC2)cc1 Amb4004979 [0,1,0,1,0,0|1,0,1]=4 11786 B13R2.3 c1ccc(P2CCCCC2)cc1 Amb25940581 [0,1,0,1,0,0|2,0,0]=4 11787 B13R2.3 c1ccc([C@@H]2CCCCN2)cc1 Amb24471915 [0,1,0,1,0,0|1,0,0]=3 11788 B13R2.3 c1ccc([C@@H]2CCCCN2)cc1 Amb33871590 [0,1,0,1,0,0|1,0,0]=3 11789 B13R2.3 c1ccc([C@@H]2CCCCN2)nc1 Amb27817769 [0,1,0,1,0,0|2,0,0]=4 11790 B13R2.3 c1ccc([C@@H]2CCCCN2)nc1 Amb33872076 [0,1,0,1,0,0|2,0,0]=4 11791 B13R2.3 c1ccc([C@@H]2CCCNC2)cc1 Amb19888364 [0,1,0,1,0,0|0,0,0]=2 11792 B13R2.3 c1ccc([C@@H]2CCCNC2)nc1 Amb27401883 [0,1,0,1,0,0|1,0,0]=3 11793 B13R2.3 c1ccc([C@@H]2CCOCO2)cc1 Amb22226715 [0,1,0,1,0,0|1,0,0]=3 11794 B13R2.3 c1ccc([C@@H]2CNCCN2)cc1 Amb28119934 [0,1,0,1,0,0|0,0,0]=2 11795 B13R2.3 c1ccc([C@@H]2CNCCO2)cc1 Amb19889425 [0,1,0,1,0,0|0,0,0]=2 11796 B13R2.3 c1ccc([C@@H]2CNCCO2)cc1 Amb22899094 [0,1,0,1,0,0|0,0,0]=2 11797 B13R2.3 c1ccc([C@@H]2CNCCO2)nc1 Amb28060528 [0,1,0,1,0,0|1,0,0]=3 11798 B13R2.3 c1ccc([C@@H]2COCCN2)cc1 Amb20242902 [0,1,0,1,0,0|1,0,0]=3 11799 B13R2.3 c1ccc([C@@H]2COCCN2)cc1 Amb22274558 [0,1,0,1,0,0|1,0,0]=3 11800 B13R2.3 c1ccc([C@@H]2CSCCN2)cc1 Amb24652809 [0,1,0,1,0,0|1,0,0]=3 11801 B13R2.3 c1ccc([C@H]2CCCCN2)cc1 Amb24181809 [0,1,0,1,0,0|1,0,0]=3 11802 B13R2.3 c1ccc([C@H]2CCCCN2)nc1 Amb22751938 [0,1,0,1,0,0|2,0,0]=4 11803 B13R2.3 c1ccc([C@H]2CCCNC2)cc1 Amb19888168 [0,1,0,1,0,0|0,0,0]=2 11804 B13R2.3 c1ccc([C@H]2CCCNC2)cc1 Amb22755507 [0,1,0,1,0,0|0,0,0]=2 11805 B13R2.3 c1ccc([C@H]2CCCNC2)nc1 Amb22751791 [0,1,0,1,0,0|1,0,0]=3 11806 B13R2.3 c1ccc([C@H]2CCOCO2)cc1 Amb27425306 [0,1,0,1,0,0|1,0,0]=3 11807 B13R2.3 c1ccc([C@H]2CNCCN2)cc1 Amb25149925 [0,1,0,1,0,0|0,0,0]=2 11808 B13R2.3 c1ccc([C@H]2CNCCO2)cc1 Amb27809067 [0,1,0,1,0,0|0,0,0]=2 11809 B13R2.3 c1ccc([C@H]2CNCCO2)cc1 Amb34913338 [0,1,0,1,0,0|0,0,0]=2 11810 B13R2.3 c1ccc([C@H]2COCCN2)cc1 Amb20242901 [0,1,0,1,0,0|1,0,0]=3 11811 B13R2.3 c1ccc([C@H]2COCCN2)cc1 Amb24077482 [0,1,0,1,0,0|1,0,0]=3 11812 B13R2.3 c1ccc([C@H]2COCCN2)nc1 Amb26958442 [0,1,0,1,0,0|2,0,0]=4 11813 B13R2.3 c1ccc([C@H]2CSCCN2)cc1 Amb27964190 [0,1,0,1,0,0|1,0,0]=3 11814 B13R2.3 c1ccc([SiH]2CCCCC2)cc1 Amb22366575 [0,1,0,1,0,0|1,1,0]=4 11815 B13R2.3 c1cnc(C2CCCNC2)cn1 Amb18829158 [0,1,0,1,0,0|2,0,0]=4 11816 B13R2.3 c1cnc(C2CCCNC2)nc1 Amb18064228 [0,1,0,1,0,0|2,0,0]=4 11817 B13R2.3 c1cnc(C2CCCNC2)nc1 Amb30086550 [0,1,0,1,0,0|2,0,0]=4 11818 B13R2.3 c1cnc(C2CCNCC2)cn1 Amb18829168 [0,1,0,1,0,0|2,0,0]=4 11819 B13R2.3 c1cnc(C2CCNCC2)cn1 Amb31379190 [0,1,0,1,0,0|2,0,0]=4 11820 B13R2.3 c1cnc(C2CCNCC2)nc1 Amb10602503 [0,1,0,1,0,0|2,0,0]=4 11821 B13R2.3 c1cnc(C2CCNCC2)nc1 Amb19958019 [0,1,0,1,0,0|2,0,0]=4 11822 B13R2.3 c1cnc(C2CCNCC2)nc1 Amb30584884 [0,1,0,1,0,0|2,0,0]=4 11823 B13R2.3 c1cnc(C2CNCCN2)nc1 Amb32716230 [0,1,0,1,0,0|2,0,0]=4 11824 B13R2.3 c1cnc(C2CNCCO2)cn1 Amb26034514 [0,1,0,1,0,0|2,0,0]=4 11825 B13R2.3 c1cnc(C2CNCCO2)nc1 Amb26414579 [0,1,0,1,0,0|2,0,0]=4 11826 B13R2.3 c1cncc(C2CCCCN2)c1 Amb17659186 [0,1,0,1,0,0|2,0,0]=4 11827 B13R2.3 c1cncc(C2CCCCN2)c1 Amb22741090 [0,1,0,1,0,0|2,0,0]=4 11828 B13R2.3 c1cncc(C2CCCCN2)c1 Amb532939 [0,1,0,1,0,0|2,0,0]=4 11829 B13R2.3 c1cncc(C2CCCNC2)c1 Amb26864942 [0,1,0,1,0,0|1,0,0]=3 11830 B13R2.3 c1cncc(C2CCCNC2)c1 Amb28600203 [0,1,0,1,0,0|1,0,0]=3 11831 B13R2.3 c1cncc(C2CCCNC2)c1 Amb8009656 [0,1,0,1,0,0|1,0,0]=3 11832 B13R2.3 c1cncc(C2CCCOC2)c1 Amb24320762 [0,1,0,1,0,0|2,0,0]=4 11833 B13R2.3 c1cncc(C2CCNCC2)c1 Amb22756469 [0,1,0,1,0,0|1,0,0]=3 11834 B13R2.3 c1cncc(C2CCNCC2)c1 Amb22756575 [0,1,0,1,0,0|1,0,0]=3 11835 B13R2.3 c1cncc(C2CCNCC2)c1 Amb3933569 [0,1,0,1,0,0|1,0,0]=3 11836 B13R2.3 c1cncc(C2CCOCC2)c1 Amb24320765 [0,1,0,1,0,0|2,0,0]=4 11837 B13R2.3 c1cncc(C2CNCCN2)c1 Amb10068869 [0,1,0,1,0,0|1,0,0]=3 11838 B13R2.3 c1cncc(C2CNCCN2)c1 Amb2696382 [0,1,0,1,0,0|1,0,0]=3 11839 B13R2.3 c1cncc(C2CNCCO2)c1 Amb10068842 [0,1,0,1,0,0|1,0,0]=3 11840 B13R2.3 c1cncc(C2CNCCO2)c1 Amb22034686 [0,1,0,1,0,0|1,0,0]=3 11841 B13R2.3 c1cncc(C2CNCCO2)c1 Amb8009635 [0,1,0,1,0,0|1,0,0]=3 11842 B13R2.3 c1cncc(C2CNCCS2)c1 Amb10808442 [0,1,0,1,0,0|1,0,0]=3 11843 B13R2.3 c1cncc(C2COCCN2)c1 Amb29083352 [0,1,0,1,0,0|2,0,0]=4 11844 B13R2.3 c1cncc(C2COCCN2)c1 Amb8009630 [0,1,0,1,0,0|2,0,0]=4 11845 B13R2.3 c1cncc(C2CSCCN2)c1 Amb10068814 [0,1,0,1,0,0|2,0,0]=4 11846 B13R2.3 c1cncc(N2CCNCC2)c1 Amb10603457 [0,1,0,1,0,0|2,0,0]=4 11847 B13R2.3 c1cncc(N2CCNCC2)c1 Amb1102180 [0,1,0,1,0,0|2,0,0]=4 11848 B13R2.3 c1cncc(N2CCNCC2)c1 Amb19958646 [0,1,0,1,0,0|2,0,0]=4 11849 B13R2.3 c1cncc(N2CCNCC2)c1 Amb8503272 [0,1,0,1,0,0|2,0,0]=4 11850 B13R2.3 c1cncc([C@@H]2CCCCN2)c1 Amb1043454 [0,1,0,1,0,0|2,0,0]=4 11851 B13R2.3 c1cncc([C@@H]2CCCCN2)c1 Amb1980982 [0,1,0,1,0,0|2,0,0]=4 11852 B13R2.3 c1cncc([C@@H]2CCCNC2)c1 Amb27875522 [0,1,0,1,0,0|1,0,0]=3 11853 B13R2.3 c1cncc([C@H]2CCCCN2)c1 Amb16229320 [0,1,0,1,0,0|2,0,0]=4 11854 B13R2.3 c1cncc([C@H]2CCCCN2)c1 Amb9756072 [0,1,0,1,0,0|2,0,0]=4 11855 B13R2.3 c1cncc([C@H]2CCCNC2)c1 Amb25269640 [0,1,0,1,0,0|1,0,0]=3 11856 B13R2.3 c1cncc([C@H]2COCCN2)c1 Amb26415236 [0,1,0,1,0,0|2,0,0]=4 11857 B13R2.3 c1ncc(C2CCCNC2)cn1 Amb18829147 [0,1,0,1,0,0|2,0,0]=4 11858 B13R2.3 c1ncc(C2CCNCC2)cn1 Amb18280659 [0,1,0,1,0,0|2,0,0]=4 11859 B13R2.3 c1ncc(C2CCNCC2)cn1 Amb35745493 [0,1,0,1,0,0|2,0,0]=4 11860 B13R2.3 c1ncc(C2CNCCO2)cn1 Amb33266869 [0,1,0,1,0,0|2,0,0]=4 11861 B13R2.10 BrC1CCC(c2ccccc2)C1 Amb28123862 [0,1,0,1,0,0|1,0,0]=3 11862 B13R2.10 CC1=CCP(c2ccccc2)C1 Amb22734694 [0,1,0,1,0,0|2,0,0]=4 11863 B13R2.10 CC1=NC(c2ccccc2)CN1 Amb28071281 [0,1,0,1,0,0|1,0,0]=3 11864 B13R2.10 CC1CC(c2ccccc2)CN1 Amb18563524 [0,1,0,1,0,0|0,0,0]=2 11865 B13R2.10 CC1CC(c2cnccn2)CN1 Amb35602971 [0,1,0,1,0,0|2,0,0]=4 11866 B13R2.10 CC1CNC(c2ccccc2)C1 Amb32652669 [0,1,0,1,0,0|1,0,0]=3 11867 B13R2.10 CC1CNC(c2ccccc2)C1 Amb33546403 [0,1,0,1,0,0|1,0,0]=3 11868 B13R2.10 CC1CNC(c2cccnc2)C1 Amb3788166 [0,1,0,1,0,0|2,0,0]=4 11869 B13R2.10 CC1COC(c2ccccc2)O1 Amb576780 [0,1,0,1,0,0|2,0,0]=4 11870 B13R2.10 CC1NC(c2ccccc2)CO1 Amb27790805 [0,1,0,1,0,0|2,0,0]=4 11871 B13R2.10 CN1CC(c2ccccc2)C=N1 Amb28244325 [0,1,0,1,0,0|0,0,1]=3 11872 B13R2.10 CN1CC=C(c2ccccc2)C1 Amb22235338 [0,1,0,1,0,0|0,0,1]=3 11873 B13R2.10 CN1CCC(c2cccnc2)C1 Amb17616208 [0,1,0,1,0,0|1,0,0]=3 11874 B13R2.10 CN1CC[C@@H](c2ccccc2)C1 Amb26877498 [0,1,0,1,0,0|0,0,0]=2 11875 B13R2.10 CN1CC[C@H](c2ccccc2)C1 Amb27227886 [0,1,0,1,0,0|0,0,0]=2 11876 B13R2.10 CN1CNC(c2ccccc2)C1 Amb18645727 [0,1,0,1,0,0|0,0,0]=2 11877 B13R2.10 C[C@@H]1CCC(c2ccccc2)N1 Amb30633699 [0,1,0,1,0,0|2,0,0]=4 11878 B13R2.10 C[C@@H]1CC[C@H](c2ccccc2)N1 Amb28135456 [0,1,0,1,0,0|2,0,0]=4 11879 B13R2.10 C[C@@H]1CN[C@H](c2ccccc2)C1 Amb27844321 [0,1,0,1,0,0|1,0,0]=3 11880 B13R2.10 C[C@@H]1C[C@@H](c2ccccc2)CN1 Amb27657747 [0,1,0,1,0,0|0,0,0]=2 11881 B13R2.10 C[C@H]1CCC(c2ccccc2)N1 Amb33801332 [0,1,0,1,0,0|2,0,0]=4 11882 B13R2.10 C[C@H]1CC[C@H](c2ccccc2)N1 Amb27631396 [0,1,0,1,0,0|2,0,0]=4 11883 B13R2.10 C[C@H]1CNC(c2ccccc2)C1 Amb27632407 [0,1,0,1,0,0|1,0,0]=3 11884 B13R2.10 C[C@H]1CN[C@@H](c2ccccc2)C1 Amb18829883 [0,1,0,1,0,0|1,0,0]=3 11885 B13R2.10 C[C@H]1CN[C@@H](c2ccccn2)C1 Amb18829580 [0,1,0,1,0,0|2,0,0]=4 11886 B13R2.10 C[C@H]1CN[C@@H](c2cccnc2)C1 Amb18829579 [0,1,0,1,0,0|2,0,0]=4 11887 B13R2.10 C[C@H]1CN[C@@H](c2ccncc2)C1 Amb18829581 [0,1,0,1,0,0|2,0,0]=4 11888 B13R2.10 C[C@H]1CO[C@@H](c2ccccc2)N1 Amb28399456 [0,1,0,1,0,0|2,0,0]=4 11889 B13R2.10 C[C@H]1C[C@H](c2ccccc2)CN1 Amb27796181 [0,1,0,1,0,0|0,0,0]=2 11890 B13R2.10 ClC1CCC(c2cccnc2)C1 Amb27595146 [0,1,0,1,0,0|2,0,0]=4 11891 B13R2.10 ClC1CCN(c2ccccc2)C1 Amb27816164 [0,1,0,1,0,0|2,0,0]=4 11892 B13R2.10 ClC1COC(c2ccccc2)C1 Amb27770148 [0,1,0,1,0,0|2,0,0]=4 11893 B13R2.10 Cl[C@@H]1CO[C@@H](c2ccccc2)C1 Amb27478037 [0,1,0,1,0,0|2,0,0]=4 11894 B13R2.10 Cl[C@@H]1CO[C@H](c2ccccc2)C1 Amb28458554 [0,1,0,1,0,0|2,0,0]=4 11895 B13R2.10 FC1CCC(c2ccccc2)C1 Amb27163345 [0,1,0,1,0,0|1,0,0]=3 11896 B13R2.10 FC1CNC(c2ccccc2)C1 Amb25045554 [0,1,0,1,0,0|2,0,0]=4 11897 B13R2.10 FC1CNC(c2ccccc2)C1 Amb35750585 [0,1,0,1,0,0|2,0,0]=4 11898 B13R2.10 NC1CCC(c2ccccc2)C1 Amb17400101 [0,1,0,1,0,0|1,0,0]=3 11899 B13R2.10 NC1CCC(c2ccccc2)C1 Amb28555798 [0,1,0,1,0,0|1,0,0]=3 11900 B13R2.10 NC1CCN(c2ccccc2)C1 Amb32665474 [0,1,0,1,0,0|2,0,0]=4 11901 B13R2.10 NC1CCN(c2ccccc2)C1 Amb32665475 [0,1,0,1,0,0|2,0,0]=4 11902 B13R2.10 NC1CCN(c2ccccc2)C1 Amb8948587 [0,1,0,1,0,0|2,0,0]=4 11903 B13R2.10 NN1CCC(c2ccccc2)C1 Amb26605785 [0,1,0,1,0,0|0,0,0]=2 11904 B13R2.10 NN1CCC(c2ccccn2)C1 Amb28249557 [0,1,0,1,0,0|1,0,0]=3 11905 B13R2.10 NN1CCC(c2cccnc2)C1 Amb25915150 [0,1,0,1,0,0|1,0,0]=3 11906 B13R2.10 NN1CCC(c2ccncc2)C1 Amb26883554 [0,1,0,1,0,0|1,0,0]=3 11907 B13R2.10 N[C@@H]1CCN(c2ccccc2)C1 Amb27783759 [0,1,0,1,0,0|2,0,0]=4 11908 B13R2.10 N[C@@H]1CC[C@H](c2ccccc2)C1 Amb26394038 [0,1,0,1,0,0|1,0,0]=3 11909 B13R2.10 N[C@H]1CCN(c2ccccc2)C1 Amb28282799 [0,1,0,1,0,0|2,0,0]=4 11910 B13R2.10 N[C@H]1CCN(c2ccccc2)C1 Amb32661001 [0,1,0,1,0,0|2,0,0]=4 11911 B13R2.10 N[C@H]1CCN(c2ccccc2)C1 Amb32664237 [0,1,0,1,0,0|2,0,0]=4 11912 B13R2.10 N[C@H]1CC[C@@H](c2ccccc2)C1 Amb27660989 [0,1,0,1,0,0|1,0,0]=3 11913 B13R2.10 N[C@H]1CC[C@@H](c2ccccc2)C1 Amb32663166 [0,1,0,1,0,0|1,0,0]=3 11914 B13R2.10 N[C@H]1CC[C@H](c2ccccc2)C1 Amb27449247 [0,1,0,1,0,0|1,0,0]=3 11915 B13R2.10 N[C@H]1CC[C@H](c2ccccn2)C1 Amb27814356 [0,1,0,1,0,0|2,0,0]=4 11916 B13R2.10 O=C1CC(c2ccccc2)CN1 Amb1772919 [0,1,0,1,0,0|0,0,1]=3 11917 B13R2.10 O=C1CC(c2ccccc2)CO1 Amb28280068 [0,1,0,1,0,0|1,0,1]=4 11918 B13R2.10 O=C1CC(c2ccccc2)NN1 Amb9798684 [0,1,0,1,0,0|1,0,1]=4 11919 B13R2.10 O=C1CC(c2ccccn2)CN1 Amb13952281 [0,1,0,1,0,0|1,0,1]=4 11920 B13R2.10 O=C1CC(c2cccnc2)CN1 Amb13783612 [0,1,0,1,0,0|1,0,1]=4 11921 B13R2.10 O=C1CC(c2ccncc2)CN1 Amb17400108 [0,1,0,1,0,0|1,0,1]=4 11922 B13R2.10 O=C1CCC(c2ccccc2)C1 Amb17138497 [0,1,0,1,0,0|1,0,0]=3 11923 B13R2.10 O=C1CCC(c2ccccc2)N1 Amb17470413 [0,1,0,1,0,0|2,0,0]=4 11924 B13R2.10 O=C1CCC(c2ccccc2)O1 Amb4393092 [0,1,0,1,0,0|2,0,0]=4 11925 B13R2.10 O=C1CCC(c2ccccn2)C1 Amb17138526 [0,1,0,1,0,0|2,0,0]=4 11926 B13R2.10 O=C1CCC(c2cccnc2)C1 Amb17138527 [0,1,0,1,0,0|2,0,0]=4 11927 B13R2.10 O=C1CCC(c2ccncc2)C1 Amb17138528 [0,1,0,1,0,0|2,0,0]=4 11928 B13R2.10 O=C1CCN(c2ccccc2)C1 Amb32410134 [0,1,0,1,0,0|2,0,0]=4 11929 B13R2.10 O=C1CCN(c2ccccc2)C1 Amb33528256 [0,1,0,1,0,0|2,0,0]=4 11930 B13R2.10 O=C1CC[C@@H](c2ccccc2)C1 Amb24323281 [0,1,0,1,0,0|1,0,0]=3 11931 B13R2.10 O=C1CC[C@@H](c2ccccc2)N1 Amb27242426 [0,1,0,1,0,0|2,0,0]=4 11932 B13R2.10 O=C1CC[C@H](c2ccccc2)C1 Amb24484347 [0,1,0,1,0,0|1,0,0]=3 11933 B13R2.10 O=C1CC[C@H](c2ccccc2)N1 Amb27227911 [0,1,0,1,0,0|2,0,0]=4 11934 B13R2.10 O=C1CC[C@H](c2ccccc2)O1 Amb28437127 [0,1,0,1,0,0|2,0,0]=4 11935 B13R2.10 O=C1C[C@@H](c2ccccc2)CN1 Amb25277165 [0,1,0,1,0,0|0,0,1]=3 11936 B13R2.10 O=C1C[C@@H](c2ccccc2)CO1 Amb27451585 [0,1,0,1,0,0|1,0,1]=4 11937 B13R2.10 O=C1C[C@H](c2ccccc2)CN1 Amb23401452 [0,1,0,1,0,0|0,0,1]=3 11938 B13R2.10 O=C1NCC(c2ccccc2)N1 Amb22056050 [0,1,0,1,0,0|1,0,1]=4 11939 B13R2.10 O=C1NCC(c2ccccc2)O1 Amb16232576 [0,1,0,1,0,0|1,0,1]=4 11940 B13R2.10 O=C1NCC(c2ccccc2)S1 Amb27614799 [0,1,0,1,0,0|1,0,1]=4 11941 B13R2.10 O=C1NC[C@@H](c2ccccc2)O1 Amb24574681 [0,1,0,1,0,0|1,0,1]=4 11942 B13R2.10 O=S1CCC(c2ccccc2)C1 Amb27404989 [0,1,0,1,0,0|1,0,0]=3 11943 B13R2.10 OC1=NCC(c2ccccc2)C1 Amb19866679 [0,1,0,1,0,0|0,0,2]=4 11944 B13R2.10 OC1CC(c2ccccc2)CO1 Amb22752509 [0,1,0,1,0,0|1,0,0]=3 11945 B13R2.10 OC1CCC(c2ccccc2)C1 Amb17400115 [0,1,0,1,0,0|1,0,0]=3 11946 B13R2.10 OC1CCC(c2ccccc2)O1 Amb22752551 [0,1,0,1,0,0|2,0,0]=4 11947 B13R2.10 OC1CCN(c2ccccc2)C1 Amb8391947 [0,1,0,1,0,0|2,0,0]=4 11948 B13R2.10 OC1CC[C@@H](c2ccccc2)O1 Amb26320377 [0,1,0,1,0,0|2,0,0]=4 11949 B13R2.10 OC1CNC(c2ccccc2)C1 Amb24710004 [0,1,0,1,0,0|2,0,0]=4 11950 B13R2.10 OC1CNC(c2ccccc2)C1 Amb28555783 [0,1,0,1,0,0|2,0,0]=4 11951 B13R2.10 OC1COC(c2ccccc2)C1 Amb27951078 [0,1,0,1,0,0|2,0,0]=4 11952 B13R2.10 OC1CO[C@H](c2ccccc2)C1 Amb27983221 [0,1,0,1,0,0|2,0,0]=4 11953 B13R2.10 O[C@@H]1CCN(c2ccccc2)C1 Amb24423353 [0,1,0,1,0,0|2,0,0]=4 11954 B13R2.10 O[C@@H]1CC[C@@H](c2ccccc2)C1 Amb27218901 [0,1,0,1,0,0|1,0,0]=3 11955 B13R2.10 O[C@@H]1CC[C@H](c2ccccc2)C1 Amb27431425 [0,1,0,1,0,0|1,0,0]=3 11956 B13R2.10 O[C@H]1C=C[C@@H](c2ccccc2)C1 Amb27208211 [0,1,0,1,0,0|1,0,1]=4 11957 B13R2.10 O[C@H]1CC[C@H](c2ccccc2)C1 Amb27420311 [0,1,0,1,0,0|1,0,0]=3 11958 B13R2.10 S=C1NCC(c2ccccc2)N1 Amb26517983 [0,1,0,1,0,0|1,0,1]=4 11959 B13R2.10 S=C1NCC(c2ccccc2)O1 Amb27817813 [0,1,0,1,0,0|1,0,1]=4 11960 B13R2.10 SC1NCC(c2ccccc2)N1 Amb27985939 [0,1,0,1,0,0|1,0,0]=3 11961 B13R2.56 CCC1CNC1c2ccccc2 Amb27779050 [0,1,0,1,0,0|1,0,0]=3 11962 B13R2.56 CNC1CCC1c2ccccc2 Amb27858960 [0,1,0,1,0,0|0,0,0]=2 11963 B13R2.56 NCC1CCC1c2ccccc2 Amb27615402 [0,1,0,1,0,0|2,0,0]=4 11964 B13R2.56 O=CC1CCC1c2ccccc2 Amb28290504 [0,1,0,1,0,0|2,0,0]=4 11965 B13R2.56 O=C[C@@H]1CC[C@@H]1c2ccccc2 Amb26951878 [0,1,0,1,0,0|2,0,0]=4 11966 B13R2.56 O=C[C@@H]1CC[C@H]1c2ccccc2 Amb26935631 [0,1,0,1,0,0|2,0,0]=4 11967 B13R2.56 O=C[C@H]1CC[C@H]1c2ccccc2 Amb26388586 [0,1,0,1,0,0|2,0,0]=4 11968 B13R2.56 OCC1CCC1c2ccccc2 Amb23453480 [0,1,0,1,0,0|2,0,0]=4 11969 B13R2.56 OC[C@@H]1NC[C@H]1c2ccccc2 Amb35788435 [0,1,0,1,0,0|2,0,0]=4 11970 B13R2.56 OC[C@@H]1NC[C@H]1c2ccccc2 Amb35788924 [0,1,0,1,0,0|2,0,0]=4 11971 B13R2.373 CC1C(=O)CC1c2ccccc2 Amb20668234 [0,1,0,1,0,0|2,0,0]=4 11972 B13R2.373 CC1C(N)CC1c2ccccc2 Amb20669477 [0,1,0,1,0,0|2,0,0]=4 11973 B13R2.373 CC1C(N)CC1c2ccccc2 Amb22157239 [0,1,0,1,0,0|2,0,0]=4 11974 B13R2.453 BrCCC1(c2ccccc2)CC1 Amb33081233 [0,1,0,1,0,0|2,0,0]=4 11975 B13R2.453 C#CCC1(c2ccccc2)CC1 Amb33081231 [0,1,0,1,0,0|1,0,1]=4 11976 B13R2.453 C=CCC1(c2ccccc2)CO1 Amb27257987 [0,1,0,1,0,0|1,0,1]=4 11977 B13R2.453 CCCC1(c2ccccc2)CO1 Amb18798139 [0,1,0,1,0,0|1,0,0]=3 11978 B13R2.453 CNCC1(c2ccccc2)CC1 Amb18998943 [0,1,0,1,0,0|0,0,0]=2 11979 B13R2.453 CNCC1(c2ccccn2)CC1 Amb26605894 [0,1,0,1,0,0|1,0,0]=3 11980 B13R2.453 CNCC1(c2cccnc2)CC1 Amb25082320 [0,1,0,1,0,0|1,0,0]=3 11981 B13R2.453 CNCC1(c2ccncc2)CC1 Amb24487455 [0,1,0,1,0,0|1,0,0]=3 11982 B13R2.453 N#CCC1(c2ccccc2)CC1 Amb27615636 [0,1,0,1,0,0|2,0,0]=4 11983 B13R2.453 NCCC1(c2ccccc2)CC1 Amb17232383 [0,1,0,1,0,0|2,0,0]=4 11984 B13R2.453 NCCC1(c2ccccc2)CC1 Amb30584950 [0,1,0,1,0,0|2,0,0]=4 11985 B13R2.453 NNCC1(c2ccccc2)CC1 Amb18788139 [0,1,0,1,0,0|1,0,0]=3 11986 B13R2.453 NOCC1(c2ccccc2)CC1 Amb33082333 [0,1,0,1,0,0|2,0,0]=4 11987 B13R2.453 O=CCC1(c2ccccc2)CC1 Amb26850970 [0,1,0,1,0,0|2,0,0]=4 11988 B13R2.453 OCCC1(c2ccccc2)CC1 Amb25306464 [0,1,0,1,0,0|2,0,0]=4 11989 B13R2.453 OCC[C@@]1(c2ccccc2)CO1 Amb27164441 [0,1,0,1,0,0|2,0,0]=4 11990 B13R2.453 ONCC1(c2ccccc2)CC1 Amb33080709 [0,1,0,1,0,0|1,0,0]=3 11991 B13R2.453 SCCC1(c2ccccc2)CC1 Amb33081549 [0,1,0,1,0,0|2,0,0]=4 11992 B13R2.453 [C-]#[N+]CC1(c2ccccc2)CC1 Amb27237863 [0,1,0,1,0,0|0,0,2]=4 11993 B13R2.679 BrCC(c1ccccc1)C2CC2 Amb17246874 [0,1,0,1,0,0|1,0,0]=3 11994 B13R2.679 CNC(c1ccccc1)C2CC2 Amb9341571 [0,1,0,1,0,0|1,0,0]=3 11995 B13R2.679 CNC(c1ccccn1)C2CC2 Amb10607920 [0,1,0,1,0,0|2,0,0]=4 11996 B13R2.679 CNC(c1ccccn1)C2CC2 Amb13949180 [0,1,0,1,0,0|2,0,0]=4 11997 B13R2.679 CNC(c1cccnc1)C2CC2 Amb18970023 [0,1,0,1,0,0|2,0,0]=4 11998 B13R2.679 CNC(c1cccnc1)C2CC2 Amb19373210 [0,1,0,1,0,0|2,0,0]=4 11999 B13R2.679 COC(c1ccccc1)C2CO2 Amb28120677 [0,1,0,1,0,0|1,0,0]=3 12000 B13R2.679 ClCC(c1ccccc1)C2CC2 Amb17233774 [0,1,0,1,0,0|1,0,0]=3 12001 B13R2.679 N#CC(c1ccccc1)C2CC2 Amb33544224 [0,1,0,1,0,0|1,0,1]=4 12002 B13R2.679 NCC(c1ccccc1)C2CC2 Amb17087329 [0,1,0,1,0,0|1,0,0]=3 12003 B13R2.679 NCC(c1ccccc1)C2CC2 Amb28555803 [0,1,0,1,0,0|1,0,0]=3 12004 B13R2.679 NCC(c1ccccn1)C2CC2 Amb25135322 [0,1,0,1,0,0|2,0,0]=4 12005 B13R2.679 NCC(c1cccnc1)C2CC2 Amb26026260 [0,1,0,1,0,0|2,0,0]=4 12006 B13R2.679 NCC(c1ccncc1)C2CC2 Amb25952781 [0,1,0,1,0,0|2,0,0]=4 12007 B13R2.679 O=CC(c1ccccc1)C2CC2 Amb17232322 [0,1,0,1,0,0|1,0,1]=4 12008 B13R2.679 OCC(c1ccccc1)C2CC2 Amb17232411 [0,1,0,1,0,0|1,0,0]=3 12009 B13R2.679 ONC(c1ccccc1)C2CC2 Amb10606514 [0,1,0,1,0,0|2,0,0]=4 12010 B13R2.1613 BrCC1CCCc2ccccc21 Amb19514960 [0,1,0,1,0,0|1,0,0]=3 12011 B13R2.1613 BrCC1CCNc2ccccc21 Amb27959101 [0,1,0,1,0,0|2,0,0]=4 12012 B13R2.1613 BrCC1NCCc2ccccc21 Amb8631542 [0,1,0,1,0,0|2,0,0]=4 12013 B13R2.1613 BrCC1OCCc2ccccc21 Amb19373964 [0,1,0,1,0,0|2,0,0]=4 12014 B13R2.1613 C#CC1CCCc2ccccc21 Amb33379631 [0,1,0,1,0,0|1,0,1]=4 12015 B13R2.1613 C=CC1CCCc2ccccc21 Amb33358312 [0,1,0,1,0,0|1,0,1]=4 12016 B13R2.1613 C=C[C@H]1CNCc2ccccc21 Amb27616675 [0,1,0,1,0,0|0,0,1]=3 12017 B13R2.1613 CCC1CCCc2ncccc21 Amb33328510 [0,1,0,1,0,0|2,0,0]=4 12018 B13R2.1613 CCC1CCNc2ccccc21 Amb18829886 [0,1,0,1,0,0|2,0,0]=4 12019 B13R2.1613 CCC1CCNc2ccccc21 Amb29083418 [0,1,0,1,0,0|2,0,0]=4 12020 B13R2.1613 CCC1CNCc2ccccc21 Amb2606133 [0,1,0,1,0,0|0,0,0]=2 12021 B13R2.1613 CCC1NCCc2ccccc21 Amb19308514 [0,1,0,1,0,0|2,0,0]=4 12022 B13R2.1613 CCC1NCCc2ccccc21 Amb5735599 [0,1,0,1,0,0|2,0,0]=4 12023 B13R2.1613 CNC1CCCc2ccccc21 Amb6892384 [0,1,0,1,0,0|1,0,0]=3 12024 B13R2.1613 CNC1CCCc2ccccc21 Amb9703046 [0,1,0,1,0,0|1,0,0]=3 12025 B13R2.1613 CNC1CCCc2cccnc21 Amb33548214 [0,1,0,1,0,0|2,0,0]=4 12026 B13R2.1613 CNC1CCCc2ccncc21 Amb27259414 [0,1,0,1,0,0|2,0,0]=4 12027 B13R2.1613 CNC1CCCc2ncccc21 Amb27213238 [0,1,0,1,0,0|2,0,0]=4 12028 B13R2.1613 CNC1CSCc2ccccc21 Amb9620986 [0,1,0,1,0,0|1,0,0]=3 12029 B13R2.1613 CNC1OCCc2ccccc21 Amb27462176 [0,1,0,1,0,0|2,0,0]=4 12030 B13R2.1613 CN[C@@H]1CCCc2ccccc21 Amb20241467 [0,1,0,1,0,0|1,0,0]=3 12031 B13R2.1613 CN[C@@H]1CCCc2cccnc21 Amb27666992 [0,1,0,1,0,0|2,0,0]=4 12032 B13R2.1613 CN[C@H]1CCCc2cccnc21 Amb27647580 [0,1,0,1,0,0|2,0,0]=4 12033 B13R2.1613 COC1CCCc2ccccc21 Amb2228261 [0,1,0,1,0,0|1,0,0]=3 12034 B13R2.1613 COC1CCNc2ccccc21 Amb18062248 [0,1,0,1,0,0|2,0,0]=4 12035 B13R2.1613 COC1CNCc2ccccc21 Amb32410200 [0,1,0,1,0,0|0,0,0]=2 12036 B13R2.1613 COC1OCCc2ccccc21 Amb22284603 [0,1,0,1,0,0|2,0,0]=4 12037 B13R2.1613 CSC1CCSc2ccccc21 Amb27432422 [0,1,0,1,0,0|2,0,0]=4 12038 B13R2.1613 ClCC1CCCc2ccccc21 Amb18184969 [0,1,0,1,0,0|1,0,0]=3 12039 B13R2.1613 ClCC1COCc2ccccc21 Amb27409444 [0,1,0,1,0,0|1,0,0]=3 12040 B13R2.1613 ClCC1NCCc2ccccc21 Amb17506196 [0,1,0,1,0,0|2,0,0]=4 12041 B13R2.1613 ClCC1NCCc2ccccc21 Amb17506197 [0,1,0,1,0,0|2,0,0]=4 12042 B13R2.1613 ClCC1OCCc2ccccc21 Amb25238351 [0,1,0,1,0,0|2,0,0]=4 12043 B13R2.1613 ClCC1SCCc2ccccc21 Amb27478088 [0,1,0,1,0,0|2,0,0]=4 12044 B13R2.1613 ClNC1CCCc2ccccc21 Amb27164504 [0,1,0,1,0,0|2,0,0]=4 12045 B13R2.1613 FCC1NCCc2ccccc21 Amb27495542 [0,1,0,1,0,0|2,0,0]=4 12046 B13R2.1613 ICC1CCCc2ccccc21 Amb27263349 [0,1,0,1,0,0|1,0,0]=3 12047 B13R2.1613 ICC1OCCc2ccccc21 Amb27769994 [0,1,0,1,0,0|2,0,0]=4 12048 B13R2.1613 N#CC1CCCc2ccccc21 Amb6892326 [0,1,0,1,0,0|1,0,1]=4 12049 B13R2.1613 NCC1CCCc2ccccc21 Amb22749479 [0,1,0,1,0,0|1,0,0]=3 12050 B13R2.1613 NCC1CCCc2ccccc21 Amb6892360 [0,1,0,1,0,0|1,0,0]=3 12051 B13R2.1613 NCC1CCCc2cccnc21 Amb25892271 [0,1,0,1,0,0|2,0,0]=4 12052 B13R2.1613 NCC1CCCc2cccnc21 Amb33535148 [0,1,0,1,0,0|2,0,0]=4 12053 B13R2.1613 NCC1CCCc2ccncc21 Amb27463627 [0,1,0,1,0,0|2,0,0]=4 12054 B13R2.1613 NCC1CCCc2ncccc21 Amb27463628 [0,1,0,1,0,0|2,0,0]=4 12055 B13R2.1613 NCC1CCNc2ccccc21 Amb18560249 [0,1,0,1,0,0|2,0,0]=4 12056 B13R2.1613 NCC1CCNc2ccccc21 Amb32661791 [0,1,0,1,0,0|2,0,0]=4 12057 B13R2.1613 NCC1CCOc2ccccc21 Amb33528302 [0,1,0,1,0,0|2,0,0]=4 12058 B13R2.1613 NCC1CCSc2ccccc21 Amb18824588 [0,1,0,1,0,0|2,0,0]=4 12059 B13R2.1613 NCC1CNCc2ccccc21 Amb17400116 [0,1,0,1,0,0|0,0,0]=2 12060 B13R2.1613 NCC1CNCc2ccccc21 Amb32667713 [0,1,0,1,0,0|0,0,0]=2 12061 B13R2.1613 NCC1COCc2ccccc21 Amb27828233 [0,1,0,1,0,0|1,0,0]=3 12062 B13R2.1613 NCC1COCc2ccccc21 Amb33743519 [0,1,0,1,0,0|1,0,0]=3 12063 B13R2.1613 NCC1NCCc2ccccc21 Amb10068079 [0,1,0,1,0,0|2,0,0]=4 12064 B13R2.1613 NCC1NCCc2ccccc21 Amb1033009 [0,1,0,1,0,0|2,0,0]=4 12065 B13R2.1613 NCC1NCCc2ccccc21 Amb17777905 [0,1,0,1,0,0|2,0,0]=4 12066 B13R2.1613 NCC1NCCc2ccccc21 Amb17777906 [0,1,0,1,0,0|2,0,0]=4 12067 B13R2.1613 NCC1OCCc2ccccc21 Amb4241964 [0,1,0,1,0,0|2,0,0]=4 12068 B13R2.1613 NCC1OCCc2ccccc21 Amb6565445 [0,1,0,1,0,0|2,0,0]=4 12069 B13R2.1613 NCC1SCCc2ccccc21 Amb18648291 [0,1,0,1,0,0|2,0,0]=4 12070 B13R2.1613 NNC1CCCc2ccccc21 Amb6278687 [0,1,0,1,0,0|2,0,0]=4 12071 B13R2.1613 O=CC1CCCc2ccccc21 Amb18787961 [0,1,0,1,0,0|1,0,1]=4 12072 B13R2.1613 O=CC1COCc2ccccc21 Amb25992611 [0,1,0,1,0,0|1,0,1]=4 12073 B13R2.1613 OCC1=CNCc2ccccc21 Amb27228922 [0,1,0,1,0,0|0,0,2]=4 12074 B13R2.1613 OCC1CCCc2ccccc21 Amb18798135 [0,1,0,1,0,0|1,0,0]=3 12075 B13R2.1613 OCC1CCCc2cccnc21 Amb24691669 [0,1,0,1,0,0|2,0,0]=4 12076 B13R2.1613 OCC1CCNc2ccccc21 Amb24756520 [0,1,0,1,0,0|2,0,0]=4 12077 B13R2.1613 OCC1CCOc2ccccc21 Amb27250372 [0,1,0,1,0,0|2,0,0]=4 12078 B13R2.1613 OCC1CCSc2ccccc21 Amb28248803 [0,1,0,1,0,0|2,0,0]=4 12079 B13R2.1613 OCC1CNCc2ccccc21 Amb24468799 [0,1,0,1,0,0|0,0,0]=2 12080 B13R2.1613 OCC1COCc2ccccc21 Amb27652931 [0,1,0,1,0,0|1,0,0]=3 12081 B13R2.1613 OCC1NCCc2ccccc21 Amb20667766 [0,1,0,1,0,0|2,0,0]=4 12082 B13R2.1613 OCC1OCCc2ccccc21 Amb1094003 [0,1,0,1,0,0|2,0,0]=4 12083 B13R2.1613 OC[C@H]1CCCc2ccccc21 Amb27981718 [0,1,0,1,0,0|1,0,0]=3 12084 B13R2.1613 SCC1CCCc2ccccc21 Amb26073521 [0,1,0,1,0,0|1,0,0]=3 12085 B13R2.1613 SCC1OCCc2ccccc21 Amb25152461 [0,1,0,1,0,0|2,0,0]=4 12086 B13R2.1613 [C-]#[N+]C1CCCc2ccccc21 Amb2235814 [0,1,0,1,0,0|1,0,1]=4 12087 B13R2.1613 [C-]#[N+][C@@H]1CCCc2ccccc21 Amb19944624 [0,1,0,1,0,0|1,0,1]=4 12088 B13R2.1613 [NH3+]CC1NCCc2ccccc21 Amb17777904 [0,1,0,1,0,0|2,0,0]=4 12089 B13R2.1613 [NH3+]CC1OCCc2ccccc21 Amb5363177 [0,1,0,1,0,0|2,0,0]=4 12090 B13R2.2532 CC1CC1(C#N)c2ccccc2 Amb27416562 [0,1,0,1,0,0|1,0,1]=4 12091 B13R2.2532 CC1CC1(CN)c2cccnc2 Amb27416560 [0,1,0,1,0,0|2,0,0]=4 12092 B13R2.2532 CC1CC1(CN)c2ccncc2 Amb27416561 [0,1,0,1,0,0|2,0,0]=4 12093 B13R2.2532 CCC1(c2ccccc2)CC1N Amb18961263 [0,1,0,1,0,0|2,0,0]=4 12094 B13R2.2532 COC1(c2ccccc2)CC1N Amb23538753 [0,1,0,1,0,0|2,0,0]=4 12095 B13R2.2532 C[C@@H]1C[C@@]1(CO)c2ccccc2 Amb27220255 [0,1,0,1,0,0|1,0,0]=3 12096 B13R2.2532 C[C@H]1C[C@]1(CO)c2ccccc2 Amb27197925 [0,1,0,1,0,0|1,0,0]=3 12097 B13R2.2532 NC[C@]1(c2ccccc2)C[C@@H]1F Amb27864365 [0,1,0,1,0,0|2,0,0]=4 12098 B13R2.2532 NC[C@]1(c2ccccc2)C[C@H]1F Amb24420022 [0,1,0,1,0,0|2,0,0]=4 12099 B13R2.2532 OC[C@@]1(c2ccccc2)CC1F Amb27616367 [0,1,0,1,0,0|2,0,0]=4 12100 B13R2.2532 OC[C@@]1(c2ccccc2)C[C@@H]1F Amb27775954 [0,1,0,1,0,0|2,0,0]=4 12101 B13R2.2532 OC[C@]1(c2ccccc2)C[C@@H]1F Amb26033899 [0,1,0,1,0,0|2,0,0]=4 12102 B13R2.2532 OC[C@]1(c2ccccc2)C[C@H]1F Amb27828242 [0,1,0,1,0,0|2,0,0]=4 12103 B13R2.2539 BrCC1(c2ccccc2)COC1 Amb22737348 [0,1,0,1,0,0|1,0,0]=3 12104 B13R2.2539 C#CC1(c2ccccc2)CCC1 Amb27983526 [0,1,0,1,0,0|1,0,1]=4 12105 B13R2.2539 CCC1(c2ccccc2)CNC1 Amb25828959 [0,1,0,1,0,0|0,0,0]=2 12106 B13R2.2539 CCC1(c2ccccc2)CNC1 Amb32663370 [0,1,0,1,0,0|0,0,0]=2 12107 B13R2.2539 CNC1(c2ccccc2)CCC1 Amb24747455 [0,1,0,1,0,0|1,0,0]=3 12108 B13R2.2539 COC1(c2ccccc2)CNC1 Amb13951134 [0,1,0,1,0,0|0,0,0]=2 12109 B13R2.2539 COC1(c2ccccc2)CNC1 Amb17605451 [0,1,0,1,0,0|0,0,0]=2 12110 B13R2.2539 COC1(c2ccccc2)COC1 Amb22497352 [0,1,0,1,0,0|1,0,0]=3 12111 B13R2.2539 ClCC1(c2ccccc2)CCC1 Amb27425244 [0,1,0,1,0,0|1,0,0]=3 12112 B13R2.2539 ClCC1(c2ccncc2)CCC1 Amb27232789 [0,1,0,1,0,0|2,0,0]=4 12113 B13R2.2539 FCC1(c2ccccc2)CCC1 Amb27794934 [0,1,0,1,0,0|1,0,0]=3 12114 B13R2.2539 ICC1(c2ccccc2)COC1 Amb26471868 [0,1,0,1,0,0|1,0,0]=3 12115 B13R2.2539 N#CC1(c2ccccc2)CCC1 Amb4034637 [0,1,0,1,0,0|1,0,1]=4 12116 B13R2.2539 N#CC1(c2ccccc2)CNC1 Amb24395630 [0,1,0,1,0,0|0,0,1]=3 12117 B13R2.2539 N#CC1(c2ccccc2)COC1 Amb27601010 [0,1,0,1,0,0|1,0,1]=4 12118 B13R2.2539 N#CC1(c2ccccn2)CNC1 Amb27843561 [0,1,0,1,0,0|1,0,1]=4 12119 B13R2.2539 N#CC1(c2ccccn2)CNC1 Amb32651836 [0,1,0,1,0,0|1,0,1]=4 12120 B13R2.2539 NCC1(c2ccccc2)CCC1 Amb33774610 [0,1,0,1,0,0|1,0,0]=3 12121 B13R2.2539 NCC1(c2ccccc2)CCC1 Amb493863 [0,1,0,1,0,0|1,0,0]=3 12122 B13R2.2539 NCC1(c2ccccc2)CCO1 Amb32680389 [0,1,0,1,0,0|2,0,0]=4 12123 B13R2.2539 NCC1(c2ccccc2)COC1 Amb19958669 [0,1,0,1,0,0|1,0,0]=3 12124 B13R2.2539 NCC1(c2ccccn2)CCC1 Amb25090004 [0,1,0,1,0,0|2,0,0]=4 12125 B13R2.2539 NCC1(c2ccccn2)CCC1 Amb32652987 [0,1,0,1,0,0|2,0,0]=4 12126 B13R2.2539 NCC1(c2cccnc2)CCC1 Amb25844855 [0,1,0,1,0,0|2,0,0]=4 12127 B13R2.2539 NCC1(c2ccncc2)CCC1 Amb27258646 [0,1,0,1,0,0|2,0,0]=4 12128 B13R2.2539 O=CC1(c2ccccc2)CCC1 Amb17594006 [0,1,0,1,0,0|1,0,1]=4 12129 B13R2.2539 O=CC1(c2ccccc2)COC1 Amb27804297 [0,1,0,1,0,0|1,0,1]=4 12130 B13R2.2539 OCC1(c2ccccc2)CCC1 Amb27665240 [0,1,0,1,0,0|1,0,0]=3 12131 B13R2.2539 OCC1(c2ccccc2)CNC1 Amb25958388 [0,1,0,1,0,0|0,0,0]=2 12132 B13R2.2539 OCC1(c2ccccc2)CNC1 Amb33535908 [0,1,0,1,0,0|0,0,0]=2 12133 B13R2.2539 OCC1(c2ccccc2)COC1 Amb21960823 [0,1,0,1,0,0|1,0,0]=3 12134 B13R2.2539 OCC1(c2ccccn2)CCC1 Amb26638112 [0,1,0,1,0,0|2,0,0]=4 12135 B13R2.2539 OCC1(c2cccnc2)CCC1 Amb24698704 [0,1,0,1,0,0|2,0,0]=4 12136 B13R2.2539 OCC1(c2ccncc2)CCC1 Amb26642900 [0,1,0,1,0,0|2,0,0]=4 12137 B13R2.2931 CC1CC(CO)c2ccccc21 Amb27981672 [0,1,0,1,0,0|1,0,0]=3 12138 B13R2.2931 CC1CC(NN)c2ccccc21 Amb28127887 [0,1,0,1,0,0|1,0,0]=3 12139 B13R2.2931 CC1CN(C#N)c2ccccc21 Amb28343960 [0,1,0,1,0,0|0,0,1]=3 12140 B13R2.2931 CCC1CC(=O)c2ccccc21 Amb17232326 [0,1,0,1,0,0|2,0,0]=4 12141 B13R2.2931 CCC1CN(C)c2ccccc21 Amb28199115 [0,1,0,1,0,0|0,0,0]=2 12142 B13R2.2931 CCN1CC(C)c2ccccc21 Amb28064810 [0,1,0,1,0,0|0,0,0]=2 12143 B13R2.2931 CCN1CC(N)c2ccccc21 Amb24554552 [0,1,0,1,0,0|1,0,0]=3 12144 B13R2.2931 CC[C@H]1C[C@H](O)c2ccccc21 Amb28350014 [0,1,0,1,0,0|2,0,0]=4 12145 B13R2.2931 CC[C@H]1OC(O)c2ccccc21 Amb27805063 [0,1,0,1,0,0|2,0,0]=4 12146 B13R2.2931 CCc1nn(C)c2ccccc12 Amb26954394 [0,1,0,1,0,0|1,0,1]=4 12147 B13R2.2931 CCn1cc(C)c2ccccc21 Amb17672668 [0,1,0,1,0,0|0,0,2]=4 12148 B13R2.2931 CCn1nc(C)c2ccccc21 Amb27201266 [0,1,0,1,0,0|1,0,1]=4 12149 B13R2.2931 CN1CC(C=O)c2ccccc21 Amb23586335 [0,1,0,1,0,0|0,0,1]=3 12150 B13R2.2931 CN1CC(CN)c2ccccc21 Amb18062999 [0,1,0,1,0,0|0,0,0]=2 12151 B13R2.2931 CN1CC(CO)c2ccccc21 Amb27466355 [0,1,0,1,0,0|0,0,0]=2 12152 B13R2.2931 CNC1CC(N)c2ccccc21 Amb27623060 [0,1,0,1,0,0|1,0,0]=3 12153 B13R2.2931 CNC1CN(C)c2ccccc21 Amb26631655 [0,1,0,1,0,0|0,0,0]=2 12154 B13R2.2931 CN[C@@H]1C[C@@H](C)c2ccccc21 Amb27623331 [0,1,0,1,0,0|0,0,0]=2 12155 B13R2.2931 CNc1cn(C)c2ccccc12 Amb18563501 [0,1,0,1,0,0|0,0,2]=4 12156 B13R2.2931 CNc1cn(C)c2ccccc12 Amb33734222 [0,1,0,1,0,0|0,0,2]=4 12157 B13R2.2931 COC1=CC(C)c2ccccc21 Amb17778898 [0,1,0,1,0,0|1,0,1]=4 12158 B13R2.2931 COC1C=C(C)c2ccccc21 Amb17844048 [0,1,0,1,0,0|1,0,1]=4 12159 B13R2.2931 COC1CC(=O)c2ccccc21 Amb26625933 [0,1,0,1,0,0|2,0,0]=4 12160 B13R2.2931 COC1CC(N)c2ccccc21 Amb32667070 [0,1,0,1,0,0|2,0,0]=4 12161 B13R2.2931 COc1cn(C)c2ccccc12 Amb22751003 [0,1,0,1,0,0|0,0,2]=4 12162 B13R2.2931 C[C@@H]1C[C@@H](CO)c2ccccc21 Amb27420345 [0,1,0,1,0,0|1,0,0]=3 12163 B13R2.2931 Cn1cc(CBr)c2ccccc21 Amb23401677 [0,1,0,1,0,0|0,0,2]=4 12164 B13R2.2931 Cn1cc(CCl)c2ccccc21 Amb18862963 [0,1,0,1,0,0|0,0,2]=4 12165 B13R2.2931 Cn1cc(CN)c2ccccc21 Amb33527052 [0,1,0,1,0,0|0,0,2]=4 12166 B13R2.2931 Cn1cc(CN)c2ccccc21 Amb5494124 [0,1,0,1,0,0|0,0,2]=4 12167 B13R2.2931 Cn1cc(CO)c2ccccc21 Amb837472 [0,1,0,1,0,0|0,0,2]=4 12168 B13R2.2931 Cn1cc(CS)c2ccccc21 Amb24643924 [0,1,0,1,0,0|0,0,2]=4 12169 B13R2.2931 Cn1nc(CBr)c2ccccc21 Amb22492458 [0,1,0,1,0,0|1,0,1]=4 12170 B13R2.2931 Cn1nc(CCl)c2ccccc21 Amb2723103 [0,1,0,1,0,0|1,0,1]=4 12171 B13R2.2931 Cn1nc(CN)c2ccccc21 Amb2723101 [0,1,0,1,0,0|1,0,1]=4 12172 B13R2.2931 Cn1nc(CN)c2ccccc21 Amb9677569 [0,1,0,1,0,0|1,0,1]=4 12173 B13R2.2931 Cn1nc(CO)c2ccccc21 Amb2723100 [0,1,0,1,0,0|1,0,1]=4 12174 B13R2.2931 Cn1nc(CS)c2ccccc21 Amb25831461 [0,1,0,1,0,0|1,0,1]=4 12175 B13R2.2931 NC1CC(CO)c2ccccc21 Amb25976513 [0,1,0,1,0,0|2,0,0]=4 12176 B13R2.2931 NC1CC(CO)c2ccccc21 Amb28963326 [0,1,0,1,0,0|2,0,0]=4 12177 B13R2.2931 NCC1CC(=O)c2ccccc21 Amb17400089 [0,1,0,1,0,0|2,0,0]=4 12178 B13R2.2931 NCC1CC(F)c2ccccc21 Amb27221964 [0,1,0,1,0,0|2,0,0]=4 12179 B13R2.2931 NC[C@@H]1C[C@H](O)c2ccccc21 Amb28320736 [0,1,0,1,0,0|2,0,0]=4 12180 B13R2.2931 N[C@@H]1C[C@H](CO)c2ccccc21 Amb25941257 [0,1,0,1,0,0|2,0,0]=4 12181 B13R2.2931 N[C@@H]1C[C@H](CO)c2ccccc21 Amb32679412 [0,1,0,1,0,0|2,0,0]=4 12182 B13R2.2931 O=C1CC(CBr)c2ccccc21 Amb22489708 [0,1,0,1,0,0|2,0,0]=4 12183 B13R2.2931 O=C1C[C@H](CO)c2ccccc21 Amb27199082 [0,1,0,1,0,0|2,0,0]=4 12184 B13R2.2931 OCC1CC(O)c2ccccc21 Amb28143612 [0,1,0,1,0,0|2,0,0]=4 12185 B13R2.2931 OC[C@@H]1C[C@@H](O)c2ccccc21 Amb28321463 [0,1,0,1,0,0|2,0,0]=4 12186 B13R2.2931 OC[C@@H]1C[C@H](O)c2ccccc21 Amb28351334 [0,1,0,1,0,0|2,0,0]=4 12187 B13R2.12 Brc1ccc(C2=CCNC2)cc1 Amb35591803 [0,1,0,1,0,0|0,0,2]=4 12188 B13R2.12 Brc1ccc(C2CCCC2)cc1 Amb18163151 [0,1,0,1,0,0|1,0,0]=3 12189 B13R2.12 Brc1ccc(C2CCCC2)cn1 Amb10600542 [0,1,0,1,0,0|2,0,0]=4 12190 B13R2.12 Brc1ccc(C2CCCC2)nc1 Amb10600816 [0,1,0,1,0,0|2,0,0]=4 12191 B13R2.12 Brc1ccc(C2CCCN2)cc1 Amb20623816 [0,1,0,1,0,0|2,0,0]=4 12192 B13R2.12 Brc1ccc(C2CCCN2)cc1 Amb2234648 [0,1,0,1,0,0|2,0,0]=4 12193 B13R2.12 Brc1ccc(C2CCCO2)cc1 Amb17343724 [0,1,0,1,0,0|2,0,0]=4 12194 B13R2.12 Brc1ccc(C2CCNC2)cc1 Amb17104497 [0,1,0,1,0,0|0,0,0]=2 12195 B13R2.12 Brc1ccc(C2CCNC2)cc1 Amb22234760 [0,1,0,1,0,0|0,0,0]=2 12196 B13R2.12 Brc1ccc(C2CCNC2)nc1 Amb24083314 [0,1,0,1,0,0|1,0,0]=3 12197 B13R2.12 Brc1ccc(C2CCOC2)cc1 Amb20617111 [0,1,0,1,0,0|1,0,0]=3 12198 B13R2.12 Brc1ccc(C2CCOC2)cn1 Amb10600931 [0,1,0,1,0,0|2,0,0]=4 12199 B13R2.12 Brc1ccc(C2CCOC2)nc1 Amb20617690 [0,1,0,1,0,0|2,0,0]=4 12200 B13R2.12 Brc1ccc(C2CNCO2)cc1 Amb18070328 [0,1,0,1,0,0|1,0,0]=3 12201 B13R2.12 Brc1ccc(C2CNCS2)cn1 Amb26647380 [0,1,0,1,0,0|2,0,0]=4 12202 B13R2.12 Brc1ccc(N2CCCC2)cc1 Amb2723462 [0,1,0,1,0,0|2,0,0]=4 12203 B13R2.12 Brc1ccc([C@@H]2CCCN2)cc1 Amb23440338 [0,1,0,1,0,0|2,0,0]=4 12204 B13R2.12 Brc1ccc([C@@H]2CCCN2)cc1 Amb8397162 [0,1,0,1,0,0|2,0,0]=4 12205 B13R2.12 Brc1ccc([C@H]2CCCN2)cc1 Amb33872495 [0,1,0,1,0,0|2,0,0]=4 12206 B13R2.12 Brc1ccc([C@H]2CCCN2)cc1 Amb8397163 [0,1,0,1,0,0|2,0,0]=4 12207 B13R2.12 Brc1ccc([C@H]2CCNC2)cc1 Amb27482857 [0,1,0,1,0,0|0,0,0]=2 12208 B13R2.12 Brc1cnc(C2CCNC2)cn1 Amb10600976 [0,1,0,1,0,0|2,0,0]=4 12209 B13R2.12 Brc1cnc(C2CCNC2)nc1 Amb24321499 [0,1,0,1,0,0|2,0,0]=4 12210 B13R2.12 Cc1ccc(C2=CCNC2)cc1 Amb28410720 [0,1,0,1,0,0|0,0,2]=4 12211 B13R2.12 Cc1ccc(C2=NNCC2)cc1 Amb28048187 [0,1,0,1,0,0|1,0,1]=4 12212 B13R2.12 Cc1ccc(C2CCCC2)cc1 Amb22436841 [0,1,0,1,0,0|1,0,0]=3 12213 B13R2.12 Cc1ccc(C2CCCN2)cc1 Amb9713679 [0,1,0,1,0,0|2,0,0]=4 12214 B13R2.12 Cc1ccc(C2CCCO2)cc1 Amb17334569 [0,1,0,1,0,0|2,0,0]=4 12215 B13R2.12 Cc1ccc(C2CCNC2)cc1 Amb10068900 [0,1,0,1,0,0|0,0,0]=2 12216 B13R2.12 Cc1ccc(C2CCNC2)cc1 Amb29744324 [0,1,0,1,0,0|0,0,0]=2 12217 B13R2.12 Cc1ccc(C2CCNC2)cc1 Amb33529471 [0,1,0,1,0,0|0,0,0]=2 12218 B13R2.12 Cc1ccc(C2CCNC2)cn1 Amb18829563 [0,1,0,1,0,0|1,0,0]=3 12219 B13R2.12 Cc1ccc(C2CCNC2)cn1 Amb32662547 [0,1,0,1,0,0|1,0,0]=3 12220 B13R2.12 Cc1ccc(C2CCNC2)nc1 Amb27165082 [0,1,0,1,0,0|1,0,0]=3 12221 B13R2.12 Cc1ccc(C2CCNC2)nc1 Amb32662550 [0,1,0,1,0,0|1,0,0]=3 12222 B13R2.12 Cc1ccc(C2CNCO2)cc1 Amb18563578 [0,1,0,1,0,0|1,0,0]=3 12223 B13R2.12 Cc1ccc(N2CCCC2)cc1 Amb26315388 [0,1,0,1,0,0|2,0,0]=4 12224 B13R2.12 Cc1ccc([C@@H]2CCCN2)cc1 Amb28342978 [0,1,0,1,0,0|2,0,0]=4 12225 B13R2.12 Cc1ccc([C@H]2CCCN2)cc1 Amb27397644 [0,1,0,1,0,0|2,0,0]=4 12226 B13R2.12 Cc1cnc(C2CCNC2)cn1 Amb25067227 [0,1,0,1,0,0|2,0,0]=4 12227 B13R2.12 Cc1cnc(C2CCNC2)nc1 Amb24428941 [0,1,0,1,0,0|2,0,0]=4 12228 B13R2.12 Cc1ncc(C2CCNC2)cn1 Amb18829146 [0,1,0,1,0,0|2,0,0]=4 12229 B13R2.12 Clc1ccc(C2CCCC2)cc1 Amb27595598 [0,1,0,1,0,0|1,0,0]=3 12230 B13R2.12 Clc1ccc(C2CCCN2)cc1 Amb13951478 [0,1,0,1,0,0|2,0,0]=4 12231 B13R2.12 Clc1ccc(C2CCCN2)cc1 Amb2234462 [0,1,0,1,0,0|2,0,0]=4 12232 B13R2.12 Clc1ccc(C2CCCO2)cc1 Amb17335592 [0,1,0,1,0,0|2,0,0]=4 12233 B13R2.12 Clc1ccc(C2CCCS2)cc1 Amb28120266 [0,1,0,1,0,0|2,0,0]=4 12234 B13R2.12 Clc1ccc(C2CCNC2)cc1 Amb10068898 [0,1,0,1,0,0|0,0,0]=2 12235 B13R2.12 Clc1ccc(C2CCNC2)cc1 Amb10603642 [0,1,0,1,0,0|0,0,0]=2 12236 B13R2.12 Clc1ccc(C2CCNC2)cc1 Amb19342018 [0,1,0,1,0,0|0,0,0]=2 12237 B13R2.12 Clc1ccc(C2CCNC2)cn1 Amb26464062 [0,1,0,1,0,0|1,0,0]=3 12238 B13R2.12 Clc1ccc(C2CCNC2)cn1 Amb32668371 [0,1,0,1,0,0|1,0,0]=3 12239 B13R2.12 Clc1ccc(C2CCNC2)cn1 Amb33734221 [0,1,0,1,0,0|1,0,0]=3 12240 B13R2.12 Clc1ccc(C2CCNC2)nc1 Amb18192238 [0,1,0,1,0,0|1,0,0]=3 12241 B13R2.12 Clc1ccc(C2CCON2)cc1 Amb35826256 [0,1,0,1,0,0|2,0,0]=4 12242 B13R2.12 Clc1ccc(C2CNC=N2)cc1 Amb27228814 [0,1,0,1,0,0|1,0,1]=4 12243 B13R2.12 Clc1ccc(C2CNCO2)cc1 Amb18564265 [0,1,0,1,0,0|1,0,0]=3 12244 B13R2.12 Clc1ccc(N2CCCC2)cc1 Amb8394245 [0,1,0,1,0,0|2,0,0]=4 12245 B13R2.12 Clc1ccc([C@@H]2CCCN2)cc1 Amb24061830 [0,1,0,1,0,0|2,0,0]=4 12246 B13R2.12 Clc1ccc([C@@H]2CCCN2)cc1 Amb8397168 [0,1,0,1,0,0|2,0,0]=4 12247 B13R2.12 Clc1ccc([C@@H]2CCNC2)cc1 Amb24061665 [0,1,0,1,0,0|0,0,0]=2 12248 B13R2.12 Clc1ccc([C@H]2CCCN2)cc1 Amb24078653 [0,1,0,1,0,0|2,0,0]=4 12249 B13R2.12 Clc1ccc([C@H]2CCCN2)cc1 Amb8397169 [0,1,0,1,0,0|2,0,0]=4 12250 B13R2.12 Clc1ccc([C@H]2CCNC2)cc1 Amb24078510 [0,1,0,1,0,0|0,0,0]=2 12251 B13R2.12 Clc1cnc(C2CCNC2)nc1 Amb26024952 [0,1,0,1,0,0|2,0,0]=4 12252 B13R2.12 Fc1ccc(C2=CCNC2)cc1 Amb26518960 [0,1,0,1,0,0|0,0,2]=4 12253 B13R2.12 Fc1ccc(C2=CCNC2)cc1 Amb32708541 [0,1,0,1,0,0|0,0,2]=4 12254 B13R2.12 Fc1ccc(C2CCCN2)cc1 Amb1162827 [0,1,0,1,0,0|2,0,0]=4 12255 B13R2.12 Fc1ccc(C2CCCN2)cc1 Amb24100665 [0,1,0,1,0,0|2,0,0]=4 12256 B13R2.12 Fc1ccc(C2CCCO2)cc1 Amb17334671 [0,1,0,1,0,0|2,0,0]=4 12257 B13R2.12 Fc1ccc(C2CCCS2)cc1 Amb27756238 [0,1,0,1,0,0|2,0,0]=4 12258 B13R2.12 Fc1ccc(C2CCNC2)cc1 Amb10073032 [0,1,0,1,0,0|0,0,0]=2 12259 B13R2.12 Fc1ccc(C2CCNC2)cc1 Amb10808472 [0,1,0,1,0,0|0,0,0]=2 12260 B13R2.12 Fc1ccc(C2CCNC2)cc1 Amb4390828 [0,1,0,1,0,0|0,0,0]=2 12261 B13R2.12 Fc1ccc(C2CCNC2)cn1 Amb18199644 [0,1,0,1,0,0|1,0,0]=3 12262 B13R2.12 Fc1ccc(C2CCNC2)cn1 Amb33733864 [0,1,0,1,0,0|1,0,0]=3 12263 B13R2.12 Fc1ccc(C2CCNC2)nc1 Amb18199643 [0,1,0,1,0,0|1,0,0]=3 12264 B13R2.12 Fc1ccc(C2CCNC2)nc1 Amb32662792 [0,1,0,1,0,0|1,0,0]=3 12265 B13R2.12 Fc1ccc(C2CNCO2)cc1 Amb18563792 [0,1,0,1,0,0|1,0,0]=3 12266 B13R2.12 Fc1ccc(C2COCN2)cc1 Amb27616871 [0,1,0,1,0,0|2,0,0]=4 12267 B13R2.12 Fc1ccc(N2CCCC2)cc1 Amb18269494 [0,1,0,1,0,0|2,0,0]=4 12268 B13R2.12 Fc1ccc([C@@H]2CCCN2)cc1 Amb22225502 [0,1,0,1,0,0|2,0,0]=4 12269 B13R2.12 Fc1ccc([C@@H]2CCCN2)cc1 Amb8397174 [0,1,0,1,0,0|2,0,0]=4 12270 B13R2.12 Fc1ccc([C@@H]2CCNC2)cc1 Amb24097390 [0,1,0,1,0,0|0,0,0]=2 12271 B13R2.12 Fc1ccc([C@@H]2CCNC2)cc1 Amb27249602 [0,1,0,1,0,0|0,0,0]=2 12272 B13R2.12 Fc1ccc([C@@H]2COCN2)cc1 Amb24117849 [0,1,0,1,0,0|2,0,0]=4 12273 B13R2.12 Fc1ccc([C@H]2CCCN2)cc1 Amb22265444 [0,1,0,1,0,0|2,0,0]=4 12274 B13R2.12 Fc1ccc([C@H]2CCCN2)cc1 Amb8397175 [0,1,0,1,0,0|2,0,0]=4 12275 B13R2.12 Fc1ccc([C@H]2CCNC2)cc1 Amb23401410 [0,1,0,1,0,0|0,0,0]=2 12276 B13R2.12 Fc1ccc([C@H]2CCNC2)cc1 Amb26944856 [0,1,0,1,0,0|0,0,0]=2 12277 B13R2.12 Ic1ccc(C2CCCN2)cc1 Amb32681223 [0,1,0,1,0,0|2,0,0]=4 12278 B13R2.12 Ic1ccc(C2CCCN2)cc1 Amb3794099 [0,1,0,1,0,0|2,0,0]=4 12279 B13R2.12 Ic1ccc(C2CCNC2)cc1 Amb27592233 [0,1,0,1,0,0|0,0,0]=2 12280 B13R2.12 Ic1ccc([C@@H]2CCCN2)cc1 Amb27597082 [0,1,0,1,0,0|2,0,0]=4 12281 B13R2.12 Ic1ccc([C@H]2CCCN2)cc1 Amb27268234 [0,1,0,1,0,0|2,0,0]=4 12282 B13R2.12 Ic1ccc([C@H]2CCNC2)cc1 Amb27467520 [0,1,0,1,0,0|0,0,0]=2 12283 B13R2.12 Nc1ccc(C2CCCC2)cc1 Amb17106961 [0,1,0,1,0,0|1,0,0]=3 12284 B13R2.12 Nc1ccc(C2CCCC2)cn1 Amb10600543 [0,1,0,1,0,0|2,0,0]=4 12285 B13R2.12 Nc1ccc(C2CCCC2)nc1 Amb10600817 [0,1,0,1,0,0|2,0,0]=4 12286 B13R2.12 Nc1ccc(C2CCCN2)cc1 Amb18562044 [0,1,0,1,0,0|2,0,0]=4 12287 B13R2.12 Nc1ccc(C2CCCO2)cc1 Amb17334584 [0,1,0,1,0,0|2,0,0]=4 12288 B13R2.12 Nc1ccc(C2CCNC2)cc1 Amb18829567 [0,1,0,1,0,0|0,0,0]=2 12289 B13R2.12 Nc1ccc(C2CCNC2)cn1 Amb10600926 [0,1,0,1,0,0|1,0,0]=3 12290 B13R2.12 Nc1ccc(C2CCOC2)cc1 Amb20617112 [0,1,0,1,0,0|1,0,0]=3 12291 B13R2.12 Nc1ccc(C2CCOC2)cn1 Amb10600932 [0,1,0,1,0,0|2,0,0]=4 12292 B13R2.12 Nc1ccc(C2CCOC2)nc1 Amb27851112 [0,1,0,1,0,0|2,0,0]=4 12293 B13R2.12 Nc1ccc(N2CCCC2)cc1 Amb10576349 [0,1,0,1,0,0|2,0,0]=4 12294 B13R2.12 Nc1ccc(N2CCCC2)cc1 Amb1834286 [0,1,0,1,0,0|2,0,0]=4 12295 B13R2.12 Nc1ccc(N2CCCC2)cc1 Amb434012 [0,1,0,1,0,0|2,0,0]=4 12296 B13R2.12 Nc1ccc([C@@H]2CCCN2)cc1 Amb27412992 [0,1,0,1,0,0|2,0,0]=4 12297 B13R2.12 Nc1ccc([C@@H]2CCNC2)cc1 Amb27623126 [0,1,0,1,0,0|0,0,0]=2 12298 B13R2.12 Nc1ccc([C@H]2CCNC2)cc1 Amb27492969 [0,1,0,1,0,0|0,0,0]=2 12299 B13R2.12 Nc1cnc(C2CCNC2)cn1 Amb10600977 [0,1,0,1,0,0|2,0,0]=4 12300 B13R2.12 Nc1cnc(C2CCNC2)nc1 Amb18828742 [0,1,0,1,0,0|2,0,0]=4 12301 B13R2.12 Nc1ncc(C2CCNC2)cn1 Amb18199766 [0,1,0,1,0,0|2,0,0]=4 12302 B13R2.12 O=C1C=CC(C2CCNC2)=CN1 Amb26919447 [0,1,0,1,0,0|1,0,0]=3 12303 B13R2.12 O=C1C=CC(C2CCNC2)=NN1 Amb26898565 [0,1,0,1,0,0|2,0,0]=4 12304 B13R2.12 Oc1ccc(C2C=CCC2)cc1 Amb3318583 [0,1,0,1,0,0|1,0,1]=4 12305 B13R2.12 Oc1ccc(C2CCCC2)cc1 Amb3939130 [0,1,0,1,0,0|1,0,0]=3 12306 B13R2.12 Oc1ccc(C2CCCC2)cn1 Amb10600544 [0,1,0,1,0,0|2,0,0]=4 12307 B13R2.12 Oc1ccc(C2CCCC2)nc1 Amb10600818 [0,1,0,1,0,0|2,0,0]=4 12308 B13R2.12 Oc1ccc(C2CCCN2)cc1 Amb10610042 [0,1,0,1,0,0|2,0,0]=4 12309 B13R2.12 Oc1ccc(C2CCCN2)cc1 Amb34932370 [0,1,0,1,0,0|2,0,0]=4 12310 B13R2.12 Oc1ccc(C2CCCN2)cc1 Amb6249119 [0,1,0,1,0,0|2,0,0]=4 12311 B13R2.12 Oc1ccc(C2CCCO2)cc1 Amb8439670 [0,1,0,1,0,0|2,0,0]=4 12312 B13R2.12 Oc1ccc(C2CCNC2)cc1 Amb18560463 [0,1,0,1,0,0|0,0,0]=2 12313 B13R2.12 Oc1ccc(C2CCNC2)cc1 Amb28555816 [0,1,0,1,0,0|0,0,0]=2 12314 B13R2.12 Oc1ccc(C2CCOC2)cc1 Amb20617113 [0,1,0,1,0,0|1,0,0]=3 12315 B13R2.12 Oc1ccc(C2COCO2)cc1 Amb27646735 [0,1,0,1,0,0|2,0,0]=4 12316 B13R2.12 Oc1ccc(N2CCCC2)cc1 Amb20622450 [0,1,0,1,0,0|2,0,0]=4 12317 B13R2.12 Oc1ccc([C@@H]2CCCN2)cc1 Amb27240377 [0,1,0,1,0,0|2,0,0]=4 12318 B13R2.12 Oc1ccc([C@@H]2CCNC2)cc1 Amb27169540 [0,1,0,1,0,0|0,0,0]=2 12319 B13R2.12 Oc1ccc([C@H]2CCCN2)cc1 Amb25977004 [0,1,0,1,0,0|2,0,0]=4 12320 B13R2.12 Oc1ccc([C@H]2CCCN2)cc1 Amb31291287 [0,1,0,1,0,0|2,0,0]=4 12321 B13R2.12 Oc1cnc(C2CCNC2)cn1 Amb27244496 [0,1,0,1,0,0|2,0,0]=4 12322 B13R2.12 Oc1ncc(C2CCNC2)cn1 Amb18828289 [0,1,0,1,0,0|2,0,0]=4 12323 B13R2.12 Sc1ccc(C2CCCN2)cc1 Amb27170671 [0,1,0,1,0,0|2,0,0]=4 12324 B13R2.12 Sc1ccc(C2CCNC2)cn1 Amb27482891 [0,1,0,1,0,0|1,0,0]=3 12325 B13R2.12 Sc1ccc(N2CCCC2)cc1 Amb33324133 [0,1,0,1,0,0|2,0,0]=4 12326 B13R2.42 C=CC1CC1c2ccc(O)cc2 Amb27175893 [0,1,0,1,0,0|1,0,1]=4 12327 B13R2.42 CNC1CC1c2ccc(Cl)cc2 Amb27430563 [0,1,0,1,0,0|0,0,0]=2 12328 B13R2.42 Cc1ccc(C2CC2C=O)cc1 Amb18118196 [0,1,0,1,0,0|2,0,0]=4 12329 B13R2.42 Cc1ccc(C2CC2CN)cc1 Amb17232381 [0,1,0,1,0,0|2,0,0]=4 12330 B13R2.42 Cc1ccc([C@@H]2C[C@@H]2CO)cc1 Amb27790298 [0,1,0,1,0,0|2,0,0]=4 12331 B13R2.42 Cc1ccc([C@@H]2C[C@H]2C=O)cc1 Amb27421987 [0,1,0,1,0,0|2,0,0]=4 12332 B13R2.42 Cc1ccc([C@@H]2C[C@H]2CN)cc1 Amb25219862 [0,1,0,1,0,0|2,0,0]=4 12333 B13R2.42 Cc1ccc([C@@H]2C[C@H]2CO)cc1 Amb27625660 [0,1,0,1,0,0|2,0,0]=4 12334 B13R2.42 N#CC1CC1c2ccc(Cl)cc2 Amb17233376 [0,1,0,1,0,0|2,0,0]=4 12335 B13R2.42 N#CC1CC1c2ccc(F)cc2 Amb17232354 [0,1,0,1,0,0|2,0,0]=4 12336 B13R2.42 N#C[C@@H]1C[C@@H]1c2ccc(F)cc2 Amb27421934 [0,1,0,1,0,0|2,0,0]=4 12337 B13R2.42 N#C[C@@H]1C[C@H]1c2ccc(F)cc2 Amb27215028 [0,1,0,1,0,0|2,0,0]=4 12338 B13R2.42 NCC1CC1c2ccc(Br)cc2 Amb17247245 [0,1,0,1,0,0|2,0,0]=4 12339 B13R2.42 NCC1CC1c2ccc(Cl)cc2 Amb17233872 [0,1,0,1,0,0|2,0,0]=4 12340 B13R2.42 NCC1CC1c2ccc(F)cc2 Amb17232529 [0,1,0,1,0,0|2,0,0]=4 12341 B13R2.42 NCC1CC1c2ccc(F)cc2 Amb19353866 [0,1,0,1,0,0|2,0,0]=4 12342 B13R2.42 NCC1CC1c2ccc(I)cc2 Amb27470714 [0,1,0,1,0,0|2,0,0]=4 12343 B13R2.42 NCC1CC1c2ccc(O)cc2 Amb17568134 [0,1,0,1,0,0|2,0,0]=4 12344 B13R2.42 NC[C@@H]1C[C@H]1c2ccc(Br)cc2 Amb28056028 [0,1,0,1,0,0|2,0,0]=4 12345 B13R2.42 NC[C@@H]1C[C@H]1c2ccc(Cl)cc2 Amb24629824 [0,1,0,1,0,0|2,0,0]=4 12346 B13R2.42 NC[C@@H]1C[C@H]1c2ccc(F)cc2 Amb28594263 [0,1,0,1,0,0|2,0,0]=4 12347 B13R2.42 NC[C@@H]1C[C@H]1c2ccc(O)cc2 Amb25978098 [0,1,0,1,0,0|2,0,0]=4 12348 B13R2.42 NC[C@H]1C[C@@H]1c2ccc(F)cc2 Amb27437421 [0,1,0,1,0,0|2,0,0]=4 12349 B13R2.42 O=CC1CC1c2ccc(F)cc2 Amb18636299 [0,1,0,1,0,0|2,0,0]=4 12350 B13R2.42 O=C[C@@H]1C[C@@H]1c2ccc(F)cc2 Amb34915466 [0,1,0,1,0,0|2,0,0]=4 12351 B13R2.42 O=C[C@@H]1C[C@H]1c2ccc(F)cc2 Amb25694932 [0,1,0,1,0,0|2,0,0]=4 12352 B13R2.42 OCC1CC1c2ccc(Cl)cc2 Amb17605541 [0,1,0,1,0,0|2,0,0]=4 12353 B13R2.42 OCC1CC1c2ccc(F)cc2 Amb17605552 [0,1,0,1,0,0|2,0,0]=4 12354 B13R2.42 OC[C@@H]1C[C@@H]1c2ccc(Cl)cc2 Amb27815183 [0,1,0,1,0,0|2,0,0]=4 12355 B13R2.42 OC[C@@H]1C[C@@H]1c2ccc(F)cc2 Amb34915366 [0,1,0,1,0,0|2,0,0]=4 12356 B13R2.42 OC[C@@H]1C[C@H]1c2ccc(Cl)cc2 Amb28455626 [0,1,0,1,0,0|2,0,0]=4 12357 B13R2.42 OC[C@@H]1C[C@H]1c2ccc(F)cc2 Amb25345004 [0,1,0,1,0,0|2,0,0]=4 12358 B13R2.147 CN1CC(c2ccc(N)cc2)C1 Amb27238916 [0,1,0,1,0,0|0,0,0]=2 12359 B13R2.147 Cc1ccc(C2CC(=O)C2)cc1 Amb13951128 [0,1,0,1,0,0|2,0,0]=4 12360 B13R2.147 Cc1ccc(C2CC(N)C2)cc1 Amb9497081 [0,1,0,1,0,0|2,0,0]=4 12361 B13R2.147 Cc1ccc(C2CC(S)C2)cc1 Amb32788472 [0,1,0,1,0,0|2,0,0]=4 12362 B13R2.147 Cc1ccc([C@H]2C[C@@H](O)C2)cc1 Amb28455611 [0,1,0,1,0,0|2,0,0]=4 12363 B13R2.147 FC1CC(c2ccc(Br)cc2)C1 Amb31378220 [0,1,0,1,0,0|2,0,0]=4 12364 B13R2.147 Fc1ccc(C2CC(S)C2)cc1 Amb32788226 [0,1,0,1,0,0|2,0,0]=4 12365 B13R2.147 NC1CC(c2ccc(Br)cc2)C1 Amb19373627 [0,1,0,1,0,0|2,0,0]=4 12366 B13R2.147 NC1CC(c2ccc(Br)cc2)C1 Amb9497087 [0,1,0,1,0,0|2,0,0]=4 12367 B13R2.147 NC1CC(c2ccc(Cl)cc2)C1 Amb33362282 [0,1,0,1,0,0|2,0,0]=4 12368 B13R2.147 NC1CC(c2ccc(Cl)cc2)C1 Amb9497085 [0,1,0,1,0,0|2,0,0]=4 12369 B13R2.147 NC1CC(c2ccc(F)cc2)C1 Amb19373526 [0,1,0,1,0,0|2,0,0]=4 12370 B13R2.147 NC1CC(c2ccc(F)cc2)C1 Amb9497077 [0,1,0,1,0,0|2,0,0]=4 12371 B13R2.147 N[C@H]1C[C@H](c2ccc(Br)cc2)C1 Amb26353092 [0,1,0,1,0,0|2,0,0]=4 12372 B13R2.147 N[C@H]1C[C@H](c2ccc(Br)cc2)C1 Amb33473590 [0,1,0,1,0,0|2,0,0]=4 12373 B13R2.147 N[C@H]1C[C@H](c2ccc(Cl)cc2)C1 Amb25949132 [0,1,0,1,0,0|2,0,0]=4 12374 B13R2.147 N[C@H]1C[C@H](c2ccc(Cl)cc2)C1 Amb28600267 [0,1,0,1,0,0|2,0,0]=4 12375 B13R2.147 N[C@H]1C[C@H](c2ccc(F)cc2)C1 Amb25713103 [0,1,0,1,0,0|2,0,0]=4 12376 B13R2.147 N[C@H]1C[C@H](c2ccc(F)cc2)C1 Amb32661145 [0,1,0,1,0,0|2,0,0]=4 12377 B13R2.147 Nc1ccc(C2CC(F)C2)cc1 Amb31378225 [0,1,0,1,0,0|2,0,0]=4 12378 B13R2.147 Nc1ccc(C2CC(O)C2)cc1 Amb27949517 [0,1,0,1,0,0|2,0,0]=4 12379 B13R2.147 O=C1CC(c2ccc(Br)cc2)C1 Amb9774975 [0,1,0,1,0,0|2,0,0]=4 12380 B13R2.147 O=C1CC(c2ccc(Cl)cc2)C1 Amb10071665 [0,1,0,1,0,0|2,0,0]=4 12381 B13R2.147 O=C1CC(c2ccc(F)cc2)C1 Amb20622977 [0,1,0,1,0,0|2,0,0]=4 12382 B13R2.147 OC1CC(c2ccc(Br)cc2)C1 Amb19514794 [0,1,0,1,0,0|2,0,0]=4 12383 B13R2.147 OC1CC(c2ccc(Cl)cc2)C1 Amb19057040 [0,1,0,1,0,0|2,0,0]=4 12384 B13R2.147 OC1CC(c2ccc(F)cc2)C1 Amb18792756 [0,1,0,1,0,0|2,0,0]=4 12385 B13R2.147 O[C@H]1C[C@@H](c2ccc(Br)cc2)C1 Amb22754760 [0,1,0,1,0,0|2,0,0]=4 12386 B13R2.147 O[C@H]1C[C@@H](c2ccc(F)cc2)C1 Amb32655854 [0,1,0,1,0,0|2,0,0]=4 12387 B13R2.147 O[C@H]1C[C@H](c2ccc(Br)cc2)C1 Amb22748903 [0,1,0,1,0,0|2,0,0]=4 12388 B13R2.147 SC1CC(c2ccc(Br)cc2)C1 Amb32788010 [0,1,0,1,0,0|2,0,0]=4 12389 B13R2.147 SC1CC(c2ccc(Cl)cc2)C1 Amb32788276 [0,1,0,1,0,0|2,0,0]=4 12390 B13R2.520 Brc1ccc(C(Br)C2CC2)cc1 Amb27656668 [0,1,0,1,0,0|2,0,0]=4 12391 B13R2.520 CC(c1ccc(F)cc1)C2CO2 Amb33274549 [0,1,0,1,0,0|1,0,0]=3 12392 B13R2.520 CC(c1ccc(F)cc1)[C@@H]2CO2 Amb33423565 [0,1,0,1,0,0|1,0,0]=3 12393 B13R2.520 CC(c1ccc(F)cc1)[C@H]2CO2 Amb33423566 [0,1,0,1,0,0|1,0,0]=3 12394 B13R2.520 CN(c1ccc(F)cc1)C2CC2 Amb27668917 [0,1,0,1,0,0|2,0,0]=4 12395 B13R2.520 CN(c1ccc(N)cc1)C2CC2 Amb8892114 [0,1,0,1,0,0|2,0,0]=4 12396 B13R2.520 Cc1ccc(C(C)C2CO2)cc1 Amb28437259 [0,1,0,1,0,0|1,0,0]=3 12397 B13R2.520 Cc1ccc(C(Cl)C2CC2)cc1 Amb18181273 [0,1,0,1,0,0|2,0,0]=4 12398 B13R2.520 Cc1ccc(C(N)C2CC2)cc1 Amb488374 [0,1,0,1,0,0|2,0,0]=4 12399 B13R2.520 Cc1ccc(C(N)C2CC2)cc1 Amb6892809 [0,1,0,1,0,0|2,0,0]=4 12400 B13R2.520 Cc1ccc(C(O)C2CC2)cc1 Amb1110339 [0,1,0,1,0,0|2,0,0]=4 12401 B13R2.520 Cc1ccc(C(S)C2CC2)cc1 Amb32788168 [0,1,0,1,0,0|2,0,0]=4 12402 B13R2.520 Cc1ccc([C@H](N)C2CC2)cc1 Amb24599385 [0,1,0,1,0,0|2,0,0]=4 12403 B13R2.520 Clc1ccc(C(Br)C2CC2)cc1 Amb27796915 [0,1,0,1,0,0|2,0,0]=4 12404 B13R2.520 Fc1ccc(C(S)C2CC2)cc1 Amb32788336 [0,1,0,1,0,0|2,0,0]=4 12405 B13R2.520 NC(c1ccc(Br)cc1)C2CC2 Amb3789748 [0,1,0,1,0,0|2,0,0]=4 12406 B13R2.520 NC(c1ccc(Cl)cc1)C2CC2 Amb426303 [0,1,0,1,0,0|2,0,0]=4 12407 B13R2.520 NC(c1ccc(Cl)cc1)C2CC2 Amb8226879 [0,1,0,1,0,0|2,0,0]=4 12408 B13R2.520 NC(c1ccc(F)cc1)C2CC2 Amb33527156 [0,1,0,1,0,0|2,0,0]=4 12409 B13R2.520 NC(c1ccc(F)cc1)C2CC2 Amb9718103 [0,1,0,1,0,0|2,0,0]=4 12410 B13R2.520 NC(c1ccc(O)cc1)C2CC2 Amb18829216 [0,1,0,1,0,0|2,0,0]=4 12411 B13R2.520 NC(c1ccc(S)cc1)C2CC2 Amb28043051 [0,1,0,1,0,0|2,0,0]=4 12412 B13R2.520 N[C@@H](c1ccc(Br)cc1)C2CC2 Amb28187086 [0,1,0,1,0,0|2,0,0]=4 12413 B13R2.520 N[C@@H](c1ccc(Cl)cc1)C2CC2 Amb26490571 [0,1,0,1,0,0|2,0,0]=4 12414 B13R2.520 N[C@@H](c1ccc(F)cc1)C2CC2 Amb27655661 [0,1,0,1,0,0|2,0,0]=4 12415 B13R2.520 N[C@@H](c1ccc(O)cc1)C2CC2 Amb28341796 [0,1,0,1,0,0|2,0,0]=4 12416 B13R2.520 N[C@@H](c1ccc(S)cc1)C2CC2 Amb27228247 [0,1,0,1,0,0|2,0,0]=4 12417 B13R2.520 N[C@H](c1ccc(Br)cc1)C2CC2 Amb27866478 [0,1,0,1,0,0|2,0,0]=4 12418 B13R2.520 N[C@H](c1ccc(Cl)cc1)C2CC2 Amb28341735 [0,1,0,1,0,0|2,0,0]=4 12419 B13R2.520 N[C@H](c1ccc(F)cc1)C2CC2 Amb22284331 [0,1,0,1,0,0|2,0,0]=4 12420 B13R2.520 N[C@H](c1ccc(F)cc1)C2CC2 Amb22744982 [0,1,0,1,0,0|2,0,0]=4 12421 B13R2.520 N[C@H](c1ccc(I)cc1)C2CC2 Amb28398139 [0,1,0,1,0,0|2,0,0]=4 12422 B13R2.520 N[C@H](c1ccc(O)cc1)C2CC2 Amb24746683 [0,1,0,1,0,0|2,0,0]=4 12423 B13R2.520 OC(c1ccc(Br)cc1)C2CC2 Amb2726295 [0,1,0,1,0,0|2,0,0]=4 12424 B13R2.520 OC(c1ccc(Cl)cc1)C2CC2 Amb4011678 [0,1,0,1,0,0|2,0,0]=4 12425 B13R2.520 OC(c1ccc(F)cc1)C2CC2 Amb2726294 [0,1,0,1,0,0|2,0,0]=4 12426 B13R2.520 OC(c1ccc(I)cc1)C2CC2 Amb24457376 [0,1,0,1,0,0|2,0,0]=4 12427 B13R2.520 O[C@@H](c1ccc(Cl)cc1)C2CC2 Amb28321495 [0,1,0,1,0,0|2,0,0]=4 12428 B13R2.520 O[C@H](c1ccc(Br)cc1)C2CC2 Amb24182162 [0,1,0,1,0,0|2,0,0]=4 12429 B13R2.520 O[C@H](c1ccc(Cl)cc1)[C@H]2CO2 Amb27197654 [0,1,0,1,0,0|2,0,0]=4 12430 B13R2.520 O[C@H](c1ccc(F)cc1)C2CC2 Amb25132744 [0,1,0,1,0,0|2,0,0]=4 12431 B13R2.520 O[C@H](c1ccc(F)cc1)[C@H]2CO2 Amb27422238 [0,1,0,1,0,0|2,0,0]=4 12432 B13R2.520 Oc1ccc(C(F)C2CC2)cc1 Amb28422263 [0,1,0,1,0,0|2,0,0]=4 12433 B13R2.520 SC(c1ccc(Cl)cc1)C2CC2 Amb19056199 [0,1,0,1,0,0|2,0,0]=4 12434 B13R2.2986 CC1(c2ccc(Br)cc2)CCC1 Amb25248550 [0,1,0,1,0,0|1,0,0]=3 12435 B13R2.2986 CC1(c2ccc(Br)cc2)CCN1 Amb27859770 [0,1,0,1,0,0|2,0,0]=4 12436 B13R2.2986 CC1(c2ccc(Br)cc2)CCO1 Amb25292728 [0,1,0,1,0,0|2,0,0]=4 12437 B13R2.2986 CC1(c2ccc(Br)cc2)CNC1 Amb18070096 [0,1,0,1,0,0|0,0,0]=2 12438 B13R2.2986 CC1(c2ccc(Br)cc2)CNC1 Amb32670788 [0,1,0,1,0,0|0,0,0]=2 12439 B13R2.2986 CC1(c2ccc(Br)cc2)COC1 Amb22737356 [0,1,0,1,0,0|1,0,0]=3 12440 B13R2.2986 CC1(c2ccc(Cl)cc2)CCC1 Amb27856089 [0,1,0,1,0,0|1,0,0]=3 12441 B13R2.2986 CC1(c2ccc(Cl)cc2)CCN1 Amb28290345 [0,1,0,1,0,0|2,0,0]=4 12442 B13R2.2986 CC1(c2ccc(Cl)cc2)CCO1 Amb32946040 [0,1,0,1,0,0|2,0,0]=4 12443 B13R2.2986 CC1(c2ccc(Cl)cc2)CNC1 Amb18564193 [0,1,0,1,0,0|0,0,0]=2 12444 B13R2.2986 CC1(c2ccc(Cl)nc2)CCC1 Amb24578655 [0,1,0,1,0,0|2,0,0]=4 12445 B13R2.2986 CC1(c2ccc(F)cc2)CCC1 Amb26444210 [0,1,0,1,0,0|1,0,0]=3 12446 B13R2.2986 CC1(c2ccc(F)cc2)CCO1 Amb32642027 [0,1,0,1,0,0|2,0,0]=4 12447 B13R2.2986 CC1(c2ccc(F)cc2)CNC1 Amb18563685 [0,1,0,1,0,0|0,0,0]=2 12448 B13R2.2986 CC1(c2ccc(I)cc2)CCC1 Amb27964337 [0,1,0,1,0,0|1,0,0]=3 12449 B13R2.2986 CC1(c2ccc(N)cc2)CCC1 Amb24497250 [0,1,0,1,0,0|1,0,0]=3 12450 B13R2.2986 CC1(c2ccc(N)cc2)CNC1 Amb27814446 [0,1,0,1,0,0|0,0,0]=2 12451 B13R2.2986 CC1(c2ccc(N)cc2)COC1 Amb22388447 [0,1,0,1,0,0|1,0,0]=3 12452 B13R2.2986 CC1(c2ccc(O)cc2)CCC1 Amb28386599 [0,1,0,1,0,0|1,0,0]=3 12453 B13R2.2986 CC1(c2ccc(O)cn2)CCC1 Amb26394340 [0,1,0,1,0,0|2,0,0]=4 12454 B13R2.2986 C[Si]1(c2ccc(O)cc2)CCC1 Amb27861370 [0,1,0,1,0,0|1,1,0]=4 12455 B13R2.2986 Cc1ccc(C2(C)CCC2)cc1 Amb24627464 [0,1,0,1,0,0|1,0,0]=3 12456 B13R2.2986 Cc1ccc(C2(C)CNC2)cc1 Amb18563527 [0,1,0,1,0,0|0,0,0]=2 12457 B13R2.2986 Cc1ccc(C2(F)CNC2)cn1 Amb28046547 [0,1,0,1,0,0|2,0,0]=4 12458 B13R2.2986 Cc1ccc(C2(N)CCC2)cc1 Amb28555686 [0,1,0,1,0,0|2,0,0]=4 12459 B13R2.2986 Cc1ccc(C2(N)CCC2)cc1 Amb8858131 [0,1,0,1,0,0|2,0,0]=4 12460 B13R2.2986 Cc1ccc(C2(N)COC2)cc1 Amb19892688 [0,1,0,1,0,0|2,0,0]=4 12461 B13R2.2986 Cc1ccc(C2(N)COC2)cc1 Amb22386898 [0,1,0,1,0,0|2,0,0]=4 12462 B13R2.2986 Cc1ccc(C2(O)CCC2)cc1 Amb28249316 [0,1,0,1,0,0|2,0,0]=4 12463 B13R2.2986 Cc1ccc(C2(O)CNC2)cc1 Amb25843096 [0,1,0,1,0,0|1,0,0]=3 12464 B13R2.2986 Cc1ccc(C2(O)CNC2)cn1 Amb27257492 [0,1,0,1,0,0|2,0,0]=4 12465 B13R2.2986 Cc1ccc(C2(O)CNC2)nc1 Amb33198095 [0,1,0,1,0,0|2,0,0]=4 12466 B13R2.2986 Cc1ccc(C2(O)COC2)cc1 Amb35658901 [0,1,0,1,0,0|2,0,0]=4 12467 B13R2.2986 FC1(c2ccc(Br)cc2)CCC1 Amb27149133 [0,1,0,1,0,0|2,0,0]=4 12468 B13R2.2986 FC1(c2ccc(Br)cc2)CNC1 Amb33715756 [0,1,0,1,0,0|1,0,0]=3 12469 B13R2.2986 FC1(c2ccc(Br)cc2)CNC1 Amb34913238 [0,1,0,1,0,0|1,0,0]=3 12470 B13R2.2986 NC1(c2ccc(Br)cc2)CCC1 Amb10609476 [0,1,0,1,0,0|2,0,0]=4 12471 B13R2.2986 NC1(c2ccc(Br)cc2)CCC1 Amb8840539 [0,1,0,1,0,0|2,0,0]=4 12472 B13R2.2986 NC1(c2ccc(Br)cc2)CNC1 Amb23401382 [0,1,0,1,0,0|1,0,0]=3 12473 B13R2.2986 NC1(c2ccc(Br)cc2)CNC1 Amb25326615 [0,1,0,1,0,0|1,0,0]=3 12474 B13R2.2986 NC1(c2ccc(Br)cc2)COC1 Amb19893279 [0,1,0,1,0,0|2,0,0]=4 12475 B13R2.2986 NC1(c2ccc(Br)cc2)COC1 Amb26406084 [0,1,0,1,0,0|2,0,0]=4 12476 B13R2.2986 NC1(c2ccc(Cl)cc2)CCC1 Amb22499156 [0,1,0,1,0,0|2,0,0]=4 12477 B13R2.2986 NC1(c2ccc(Cl)cc2)CCC1 Amb5753574 [0,1,0,1,0,0|2,0,0]=4 12478 B13R2.2986 NC1(c2ccc(Cl)cc2)COC1 Amb19892679 [0,1,0,1,0,0|2,0,0]=4 12479 B13R2.2986 NC1(c2ccc(Cl)cc2)COC1 Amb24738563 [0,1,0,1,0,0|2,0,0]=4 12480 B13R2.2986 NC1(c2ccc(F)cc2)CCC1 Amb17991303 [0,1,0,1,0,0|2,0,0]=4 12481 B13R2.2986 NC1(c2ccc(F)cc2)CCC1 Amb5753945 [0,1,0,1,0,0|2,0,0]=4 12482 B13R2.2986 NC1(c2ccc(F)cc2)COC1 Amb22386899 [0,1,0,1,0,0|2,0,0]=4 12483 B13R2.2986 NC1(c2ccc(F)cc2)COC1 Amb33527426 [0,1,0,1,0,0|2,0,0]=4 12484 B13R2.2986 NC1(c2ccc(I)cc2)CCC1 Amb24392267 [0,1,0,1,0,0|2,0,0]=4 12485 B13R2.2986 NC1(c2ccc(I)cc2)COC1 Amb26421874 [0,1,0,1,0,0|2,0,0]=4 12486 B13R2.2986 NC1(c2ccc(I)cc2)COC1 Amb28989497 [0,1,0,1,0,0|2,0,0]=4 12487 B13R2.2986 NC1(c2ccc(O)cc2)CCC1 Amb27184583 [0,1,0,1,0,0|2,0,0]=4 12488 B13R2.2986 Nc1ccc(C2(F)CCC2)cc1 Amb28319554 [0,1,0,1,0,0|2,0,0]=4 12489 B13R2.2986 Nc1ccc(C2(N)CCC2)cc1 Amb26841095 [0,1,0,1,0,0|2,0,0]=4 12490 B13R2.2986 Nc1ccc(C2(O)CCC2)cc1 Amb27421378 [0,1,0,1,0,0|2,0,0]=4 12491 B13R2.2986 Nc1ccc(C2(O)COC2)cc1 Amb25135740 [0,1,0,1,0,0|2,0,0]=4 12492 B13R2.2986 OC1(c2ccc(Br)cc2)CCC1 Amb22292373 [0,1,0,1,0,0|2,0,0]=4 12493 B13R2.2986 OC1(c2ccc(Br)cc2)CNC1 Amb25875837 [0,1,0,1,0,0|1,0,0]=3 12494 B13R2.2986 OC1(c2ccc(Br)cc2)CNC1 Amb28963318 [0,1,0,1,0,0|1,0,0]=3 12495 B13R2.2986 OC1(c2ccc(Br)cc2)COC1 Amb22386872 [0,1,0,1,0,0|2,0,0]=4 12496 B13R2.2986 OC1(c2ccc(Br)cc2)CSC1 Amb35614305 [0,1,0,1,0,0|2,0,0]=4 12497 B13R2.2986 OC1(c2ccc(Br)cn2)CNC1 Amb33477425 [0,1,0,1,0,0|2,0,0]=4 12498 B13R2.2986 OC1(c2ccc(Br)nc2)CNC1 Amb33388524 [0,1,0,1,0,0|2,0,0]=4 12499 B13R2.2986 OC1(c2ccc(Cl)cc2)CCC1 Amb25942286 [0,1,0,1,0,0|2,0,0]=4 12500 B13R2.2986 OC1(c2ccc(Cl)cc2)CNC1 Amb26464102 [0,1,0,1,0,0|1,0,0]=3 12501 B13R2.2986 OC1(c2ccc(Cl)cc2)CNC1 Amb33292438 [0,1,0,1,0,0|1,0,0]=3 12502 B13R2.2986 OC1(c2ccc(Cl)cc2)COC1 Amb29871341 [0,1,0,1,0,0|2,0,0]=4 12503 B13R2.2986 OC1(c2ccc(Cl)cn2)CNC1 Amb33058806 [0,1,0,1,0,0|2,0,0]=4 12504 B13R2.2986 OC1(c2ccc(Cl)nc2)CNC1 Amb33261686 [0,1,0,1,0,0|2,0,0]=4 12505 B13R2.2986 OC1(c2ccc(F)cc2)CCC1 Amb27636361 [0,1,0,1,0,0|2,0,0]=4 12506 B13R2.2986 OC1(c2ccc(F)cc2)CNC1 Amb32674993 [0,1,0,1,0,0|1,0,0]=3 12507 B13R2.2986 OC1(c2ccc(F)cc2)CNC1 Amb33553018 [0,1,0,1,0,0|1,0,0]=3 12508 B13R2.2986 OC1(c2ccc(F)cc2)COC1 Amb22386874 [0,1,0,1,0,0|2,0,0]=4 12509 B13R2.2986 OC1(c2ccc(F)cc2)CSC1 Amb27440326 [0,1,0,1,0,0|2,0,0]=4 12510 B13R2.2986 OC1(c2ccc(F)cn2)CNC1 Amb33315572 [0,1,0,1,0,0|2,0,0]=4 12511 B13R2.2986 OC1(c2ccc(F)nc2)CNC1 Amb33425500 [0,1,0,1,0,0|2,0,0]=4 12512 B13R2.2986 Oc1ccc(C2(F)CCC2)cc1 Amb27642020 [0,1,0,1,0,0|2,0,0]=4 12513 B13R2.2986 Oc1ccc(C2(O)CNC2)cc1 Amb33269511 [0,1,0,1,0,0|1,0,0]=3 12514 B13R2.2987 CC1(c2ccc(Cl)cc2)CC1N Amb18280086 [0,1,0,1,0,0|2,0,0]=4 12515 B13R2.2987 CC1(c2ccc(F)cc2)CC1N Amb18947384 [0,1,0,1,0,0|2,0,0]=4 12516 B13R2.2987 CC1(c2ccc(F)cc2)CC1N Amb33550664 [0,1,0,1,0,0|2,0,0]=4 12517 B13R2.2987 CC1CC1(N)c2ccc(Cl)cc2 Amb5753569 [0,1,0,1,0,0|2,0,0]=4 12518 B13R2.2987 CC1CC1(N)c2ccc(F)cc2 Amb32712073 [0,1,0,1,0,0|2,0,0]=4 12519 B13R2.2987 CC1CC1(N)c2ccc(F)cc2 Amb5753940 [0,1,0,1,0,0|2,0,0]=4 12520 B13R2.2987 C[C@@H]1C[C@@]1(N)c2ccc(F)cc2 Amb25949597 [0,1,0,1,0,0|2,0,0]=4 12521 B13R2.2987 C[C@@H]1C[C@@]1(N)c2ccc(F)cc2 Amb33362349 [0,1,0,1,0,0|2,0,0]=4 12522 B13R2.2987 C[C@@H]1C[C@]1(N)c2ccc(F)cc2 Amb32664518 [0,1,0,1,0,0|2,0,0]=4 12523 B13R2.2987 C[C@@H]1C[C@]1(N)c2ccc(F)cc2 Amb32664519 [0,1,0,1,0,0|2,0,0]=4 12524 B13R2.2987 C[C@H]1C[C@@]1(N)c2ccc(F)cc2 Amb26409776 [0,1,0,1,0,0|2,0,0]=4 12525 B13R2.2987 C[C@H]1C[C@@]1(N)c2ccc(F)cc2 Amb33362297 [0,1,0,1,0,0|2,0,0]=4 12526 B13R2.2987 Cc1ccc(C2(N)CC2C)cc1 Amb27766104 [0,1,0,1,0,0|2,0,0]=4 12527 B13R2.5179 CC1CCNc2cc(Cl)ccc21 Amb23589604 [0,1,0,1,0,0|2,0,0]=4 12528 B13R2.5179 CC1CCNc2cc(F)ccc21 Amb18828264 [0,1,0,1,0,0|2,0,0]=4 12529 B13R2.5179 CC1CCNc2cc(O)ccc21 Amb26875516 [0,1,0,1,0,0|2,0,0]=4 12530 B13R2.5179 CC1CCOc2cc(N)ccc21 Amb27814321 [0,1,0,1,0,0|2,0,0]=4 12531 B13R2.5179 CC1CNCc2cc(Br)ccc21 Amb22230132 [0,1,0,1,0,0|0,0,0]=2 12532 B13R2.5179 CC1CNCc2cc(Br)ccc21 Amb31308103 [0,1,0,1,0,0|0,0,0]=2 12533 B13R2.5179 CC1CNCc2cc(Cl)ccc21 Amb17400900 [0,1,0,1,0,0|0,0,0]=2 12534 B13R2.5179 CC1CNCc2cc(Cl)nnc21 Amb27643478 [0,1,0,1,0,0|2,0,0]=4 12535 B13R2.5179 CC1CNCc2cc(F)ccc21 Amb17400184 [0,1,0,1,0,0|0,0,0]=2 12536 B13R2.5179 CC1NCCc2cc(Cl)ccc21 Amb27954699 [0,1,0,1,0,0|2,0,0]=4 12537 B13R2.5179 CC1NCCc2cc(F)ccc21 Amb19374659 [0,1,0,1,0,0|2,0,0]=4 12538 B13R2.5179 CC1NCCc2cc(F)ccc21 Amb22058745 [0,1,0,1,0,0|2,0,0]=4 12539 B13R2.5179 CC1NCCc2cc(I)ccc21 Amb27426616 [0,1,0,1,0,0|2,0,0]=4 12540 B13R2.5179 CC1NCCc2cc(N)ccc21 Amb27453535 [0,1,0,1,0,0|2,0,0]=4 12541 B13R2.5179 CC1NCCc2cc(O)ccc21 Amb18063932 [0,1,0,1,0,0|2,0,0]=4 12542 B13R2.5179 CC1NCCc2cc(O)ccc21 Amb33189351 [0,1,0,1,0,0|2,0,0]=4 12543 B13R2.5179 CN1CCCc2cc(Br)ccc21 Amb17134512 [0,1,0,1,0,0|2,0,0]=4 12544 B13R2.5179 CN1CCCc2cc(N)ccc21 Amb6683457 [0,1,0,1,0,0|2,0,0]=4 12545 B13R2.5179 CN1CCCc2cc(O)ccc21 Amb24465126 [0,1,0,1,0,0|2,0,0]=4 12546 B13R2.5179 C[C@@H]1CCCC2=C1C=CC(=O)N2 Amb27178128 [0,1,0,1,0,0|2,0,0]=4 12547 B13R2.5179 C[C@@H]1NCCc2cc(Br)ccc21 Amb27752106 [0,1,0,1,0,0|2,0,0]=4 12548 B13R2.5179 C[C@@H]1NCCc2cc(Cl)ccc21 Amb27648947 [0,1,0,1,0,0|2,0,0]=4 12549 B13R2.5179 C[C@@H]1NCCc2cc(F)ccc21 Amb27602703 [0,1,0,1,0,0|2,0,0]=4 12550 B13R2.5179 C[C@@H]1NCCc2cc(O)ccc21 Amb27469897 [0,1,0,1,0,0|2,0,0]=4 12551 B13R2.5179 C[C@H]1NCCc2cc(Br)ccc21 Amb28340872 [0,1,0,1,0,0|2,0,0]=4 12552 B13R2.5179 Cc1ccc2c(c1)CCCC2C Amb27199409 [0,1,0,1,0,0|1,0,0]=3 12553 B13R2.5179 Cc1ccc2c(c1)CCCC2F Amb27793846 [0,1,0,1,0,0|2,0,0]=4 12554 B13R2.5179 Cc1ccc2c(c1)CCCC2N Amb27159590 [0,1,0,1,0,0|2,0,0]=4 12555 B13R2.5179 Cc1ccc2c(c1)CCCC2N Amb30982093 [0,1,0,1,0,0|2,0,0]=4 12556 B13R2.5179 Cc1ccc2c(c1)CCCC2O Amb27426770 [0,1,0,1,0,0|2,0,0]=4 12557 B13R2.5179 Cc1ccc2c(c1)CCCN2C Amb27615542 [0,1,0,1,0,0|2,0,0]=4 12558 B13R2.5179 Cc1ccc2c(c1)CCC[C@@H]2N Amb28365634 [0,1,0,1,0,0|2,0,0]=4 12559 B13R2.5179 Cc1ccc2c(c1)CCC[C@@H]2O Amb27813108 [0,1,0,1,0,0|2,0,0]=4 12560 B13R2.5179 Cc1ccc2c(c1)CCC[C@H]2N Amb26017393 [0,1,0,1,0,0|2,0,0]=4 12561 B13R2.5179 Cc1ccc2c(c1)CCC[C@H]2O Amb27641851 [0,1,0,1,0,0|2,0,0]=4 12562 B13R2.5179 Cc1ccc2c(c1)CCNC2C Amb5735654 [0,1,0,1,0,0|2,0,0]=4 12563 B13R2.5179 Cc1ccc2c(c1)CCN[C@@H]2C Amb27976636 [0,1,0,1,0,0|2,0,0]=4 12564 B13R2.5179 Cc1ccc2c(c1)CNCC2=O Amb28130056 [0,1,0,1,0,0|1,0,1]=4 12565 B13R2.5179 Cc1ccc2c(c1)CNCC2C Amb17400098 [0,1,0,1,0,0|0,0,0]=2 12566 B13R2.5179 Cc1ccc2c(c1)CNCC2F Amb27864514 [0,1,0,1,0,0|1,0,0]=3 12567 B13R2.5179 Cc1ccc2c(c1)COCC2N Amb27873306 [0,1,0,1,0,0|2,0,0]=4 12568 B13R2.5179 Cc1ccc2c(n1)CCCC2C Amb27862394 [0,1,0,1,0,0|2,0,0]=4 12569 B13R2.5179 Cc1cnc2c(c1)CCCC2C Amb17334540 [0,1,0,1,0,0|2,0,0]=4 12570 B13R2.5179 Fc1ccc2c(c1)CCCC2Cl Amb28245303 [0,1,0,1,0,0|2,0,0]=4 12571 B13R2.5179 NC1CCCc2cc(Br)ccc21 Amb21964183 [0,1,0,1,0,0|2,0,0]=4 12572 B13R2.5179 NC1CCCc2cc(Br)ccc21 Amb23440435 [0,1,0,1,0,0|2,0,0]=4 12573 B13R2.5179 NC1CCCc2cc(Cl)ccc21 Amb27828297 [0,1,0,1,0,0|2,0,0]=4 12574 B13R2.5179 NC1CCCc2cc(F)ccc21 Amb22001951 [0,1,0,1,0,0|2,0,0]=4 12575 B13R2.5179 NC1CCCc2cc(F)ccc21 Amb28600218 [0,1,0,1,0,0|2,0,0]=4 12576 B13R2.5179 NC1CCCc2cc(I)ccc21 Amb28143533 [0,1,0,1,0,0|2,0,0]=4 12577 B13R2.5179 NC1CCCc2cc(O)ccc21 Amb18278102 [0,1,0,1,0,0|2,0,0]=4 12578 B13R2.5179 NC1CCCc2cc(O)ccc21 Amb30594150 [0,1,0,1,0,0|2,0,0]=4 12579 B13R2.5179 NC1CNCc2cc(O)ccc21 Amb28252464 [0,1,0,1,0,0|1,0,0]=3 12580 B13R2.5179 NC1COCc2cc(F)ccc21 Amb27615585 [0,1,0,1,0,0|2,0,0]=4 12581 B13R2.5179 NC1COCc2cc(I)ccc21 Amb27393846 [0,1,0,1,0,0|2,0,0]=4 12582 B13R2.5179 N[C@@H]1CCCc2cc(Cl)ccc21 Amb27461279 [0,1,0,1,0,0|2,0,0]=4 12583 B13R2.5179 N[C@@H]1CCCc2cc(F)ccc21 Amb26329704 [0,1,0,1,0,0|2,0,0]=4 12584 B13R2.5179 N[C@@H]1CCCc2cc(F)ccc21 Amb28872402 [0,1,0,1,0,0|2,0,0]=4 12585 B13R2.5179 N[C@@H]1CCCc2cc(O)ccc21 Amb28341741 [0,1,0,1,0,0|2,0,0]=4 12586 B13R2.5179 N[C@@H]1COCc2cc(Cl)ccc21 Amb27461159 [0,1,0,1,0,0|2,0,0]=4 12587 B13R2.5179 N[C@@H]1COCc2cc(Cl)ccc21 Amb28984300 [0,1,0,1,0,0|2,0,0]=4 12588 B13R2.5179 N[C@H]1CCCc2cc(Br)ccc21 Amb26840947 [0,1,0,1,0,0|2,0,0]=4 12589 B13R2.5179 N[C@H]1CCCc2cc(F)ccc21 Amb26372569 [0,1,0,1,0,0|2,0,0]=4 12590 B13R2.5179 N[C@H]1CCCc2cc(F)ccc21 Amb28600240 [0,1,0,1,0,0|2,0,0]=4 12591 B13R2.5179 N[C@H]1CCCc2cc(I)ccc21 Amb27597569 [0,1,0,1,0,0|2,0,0]=4 12592 B13R2.5179 N[C@H]1COCc2cc(Cl)ccc21 Amb27830548 [0,1,0,1,0,0|2,0,0]=4 12593 B13R2.5179 N[C@H]1COCc2cc(Cl)ccc21 Amb28984299 [0,1,0,1,0,0|2,0,0]=4 12594 B13R2.5179 N[C@H]1COCc2cc(O)ccc21 Amb28400098 [0,1,0,1,0,0|2,0,0]=4 12595 B13R2.5179 Nc1ccc2c(c1)CCCC2N Amb27627801 [0,1,0,1,0,0|2,0,0]=4 12596 B13R2.5179 Nc1ccc2c(c1)CCCC2O Amb28076085 [0,1,0,1,0,0|2,0,0]=4 12597 B13R2.5179 Nc1ccc2c(c1)COC[C@@H]2N Amb27178329 [0,1,0,1,0,0|2,0,0]=4 12598 B13R2.5179 Nc1ccc2c(c1)COC[C@H]2N Amb27615253 [0,1,0,1,0,0|2,0,0]=4 12599 B13R2.5179 OC1CCCc2cc(Br)ccc21 Amb25220886 [0,1,0,1,0,0|2,0,0]=4 12600 B13R2.5179 OC1CCCc2cc(F)ccc21 Amb20623192 [0,1,0,1,0,0|2,0,0]=4 12601 B13R2.5179 OC1CNCc2cc(F)ccc21 Amb28287805 [0,1,0,1,0,0|1,0,0]=3 12602 B13R2.5179 O[C@@H]1CCCc2cc(Br)ccc21 Amb27799484 [0,1,0,1,0,0|2,0,0]=4 12603 B13R2.5179 O[C@H]1CCCc2cc(Br)ccc21 Amb28249562 [0,1,0,1,0,0|2,0,0]=4 12604 B13R2.5179 Oc1ccc2c(c1)CCCC2O Amb18800788 [0,1,0,1,0,0|2,0,0]=4 12605 B13R2.5179 Oc1ccc2c(c1)CCCC2S Amb32788387 [0,1,0,1,0,0|2,0,0]=4 12606 B13R2.5187 CC1CC(=O)c2cc(Br)ccc21 Amb6705554 [0,1,0,1,0,0|2,0,0]=4 12607 B13R2.5187 CC1CC(=O)c2cc(Cl)ccc21 Amb6705553 [0,1,0,1,0,0|2,0,0]=4 12608 B13R2.5187 CC1CC(=O)c2cc(F)ccc21 Amb6705552 [0,1,0,1,0,0|2,0,0]=4 12609 B13R2.5187 CC1CC(=O)c2ccc(Cl)cc21 Amb22753082 [0,1,0,1,0,0|2,0,0]=4 12610 B13R2.5187 CC1CC(=O)c2ccc(F)cc21 Amb25698030 [0,1,0,1,0,0|2,0,0]=4 12611 B13R2.5187 CC1CC(=O)c2ccc(O)cc21 Amb2811362 [0,1,0,1,0,0|2,0,0]=4 12612 B13R2.5187 CC1CC(Br)c2cc(F)ccc21 Amb27757576 [0,1,0,1,0,0|2,0,0]=4 12613 B13R2.5187 CC1CC(N)c2cc(Br)ccc21 Amb6705565 [0,1,0,1,0,0|2,0,0]=4 12614 B13R2.5187 CC1CC(N)c2ccc(F)cc21 Amb27463497 [0,1,0,1,0,0|2,0,0]=4 12615 B13R2.5187 CC1CC(O)c2cc(N)ccc21 Amb9782432 [0,1,0,1,0,0|2,0,0]=4 12616 B13R2.5187 CN1CC(=O)c2cc(Br)ccc21 Amb18160225 [0,1,0,1,0,0|1,0,1]=4 12617 B13R2.5187 CN1CC(=O)c2cc(N)ccc21 Amb18829714 [0,1,0,1,0,0|1,0,1]=4 12618 B13R2.5187 CN1CC(N)c2cc(Br)ccc21 Amb24685295 [0,1,0,1,0,0|1,0,0]=3 12619 B13R2.5187 CN1CC(N)c2cc(Cl)ccc21 Amb24439461 [0,1,0,1,0,0|1,0,0]=3 12620 B13R2.5187 CN1CC(N)c2cc(F)ccc21 Amb27857257 [0,1,0,1,0,0|1,0,0]=3 12621 B13R2.5187 CN1CC(N)c2ccc(Cl)cc21 Amb27977847 [0,1,0,1,0,0|1,0,0]=3 12622 B13R2.5187 CN1CC(N)c2ccc(F)cc21 Amb24455753 [0,1,0,1,0,0|1,0,0]=3 12623 B13R2.5187 C[C@@H]1C[C@@H](C)c2cc(N)ccc21 Amb27195754 [0,1,0,1,0,0|1,0,0]=3 12624 B13R2.5187 C[C@H]1CC(=O)c2cc(O)ccc21 Amb27781977 [0,1,0,1,0,0|2,0,0]=4 12625 B13R2.5187 C[C@H]1CC(O)c2cc(F)ccc21 Amb27969106 [0,1,0,1,0,0|2,0,0]=4 12626 B13R2.5187 C[C@H]1C[C@H](C)C2=C1C=CC(=O)N2 Amb27853851 [0,1,0,1,0,0|2,0,0]=4 12627 B13R2.5187 Cc1ccc2c(C)cn(C)c2c1 Amb18893432 [0,1,0,1,0,0|0,0,2]=4 12628 B13R2.5187 Cc1ccc2c(C)nn(C)c2c1 Amb28251614 [0,1,0,1,0,0|1,0,1]=4 12629 B13R2.5187 Cc1ccc2c(c1)C(=O)CC2C Amb6705551 [0,1,0,1,0,0|2,0,0]=4 12630 B13R2.5187 Cc1ccc2c(c1)C(C)CC2=O Amb2697081 [0,1,0,1,0,0|2,0,0]=4 12631 B13R2.5187 Cc1ccc2c(c1)C(N)CN2C Amb26991441 [0,1,0,1,0,0|1,0,0]=3 12632 B13R2.5187 Cc1ccc2c(c1)N(C)CC2N Amb27213763 [0,1,0,1,0,0|1,0,0]=3 12633 B13R2.5187 Cc1ccc2c(c1)c(C)cn2C Amb18893426 [0,1,0,1,0,0|0,0,2]=4 12634 B13R2.5187 Cc1cn(C)c2cc(Cl)ccc12 Amb18893640 [0,1,0,1,0,0|0,0,2]=4 12635 B13R2.5187 Cc1cn(C)c2cc(F)ccc12 Amb18893477 [0,1,0,1,0,0|0,0,2]=4 12636 B13R2.5187 Cc1cn(C)c2cc(N)ccc12 Amb25202359 [0,1,0,1,0,0|0,0,2]=4 12637 B13R2.5187 Cc1cn(C)c2cc(O)ccc12 Amb28135772 [0,1,0,1,0,0|0,0,2]=4 12638 B13R2.5187 Cc1cn(C)c2ccc(Br)cc12 Amb18896735 [0,1,0,1,0,0|0,0,2]=4 12639 B13R2.5187 Cc1cn(C)c2ccc(Cl)cc12 Amb18893638 [0,1,0,1,0,0|0,0,2]=4 12640 B13R2.5187 Cc1cn(C)c2ccc(F)cc12 Amb18893475 [0,1,0,1,0,0|0,0,2]=4 12641 B13R2.5187 Cc1nn(C)c2cc(Br)ccc12 Amb10070872 [0,1,0,1,0,0|1,0,1]=4 12642 B13R2.5187 Cc1nn(C)c2cc(N)ccc12 Amb22406275 [0,1,0,1,0,0|1,0,1]=4 12643 B13R2.5187 Cc1nn(C)c2ccc(Br)cc12 Amb10070869 [0,1,0,1,0,0|1,0,1]=4 12644 B13R2.5187 Cc1nn(C)c2ccc(F)cc12 Amb28129531 [0,1,0,1,0,0|1,0,1]=4 12645 B13R2.5187 Cc1nn(C)c2ccc(N)cc12 Amb21962822 [0,1,0,1,0,0|1,0,1]=4 12646 B13R2.13 Brc1cc(C2CCCC2)ccn1 Amb10600462 [0,1,0,1,0,0|2,0,0]=4 12647 B13R2.13 Brc1cc(C2CCNC2)ccn1 Amb10600927 [0,1,0,1,0,0|1,0,0]=3 12648 B13R2.13 Brc1cc(C2CCOC2)ccn1 Amb10600933 [0,1,0,1,0,0|2,0,0]=4 12649 B13R2.13 Brc1cc(C2CCSC2)ccn1 Amb20617303 [0,1,0,1,0,0|2,0,0]=4 12650 B13R2.13 Brc1cccc(C2=CCNC2)c1 Amb35591805 [0,1,0,1,0,0|0,0,2]=4 12651 B13R2.13 Brc1cccc(C2CCCC2)c1 Amb20617099 [0,1,0,1,0,0|1,0,0]=3 12652 B13R2.13 Brc1cccc(C2CCCC2)n1 Amb10599826 [0,1,0,1,0,0|2,0,0]=4 12653 B13R2.13 Brc1cccc(C2CCCN2)c1 Amb2235034 [0,1,0,1,0,0|2,0,0]=4 12654 B13R2.13 Brc1cccc(C2CCCN2)c1 Amb2237174 [0,1,0,1,0,0|2,0,0]=4 12655 B13R2.13 Brc1cccc(C2CCNC2)c1 Amb17104496 [0,1,0,1,0,0|0,0,0]=2 12656 B13R2.13 Brc1cccc(C2CCNC2)c1 Amb22284651 [0,1,0,1,0,0|0,0,0]=2 12657 B13R2.13 Brc1cccc(C2CCNC2)n1 Amb10600923 [0,1,0,1,0,0|1,0,0]=3 12658 B13R2.13 Brc1cccc(C2CCOC2)c1 Amb20617102 [0,1,0,1,0,0|1,0,0]=3 12659 B13R2.13 Brc1cccc(C2CCOC2)n1 Amb10600929 [0,1,0,1,0,0|2,0,0]=4 12660 B13R2.13 Brc1cccc(C2CNCO2)c1 Amb18571829 [0,1,0,1,0,0|1,0,0]=3 12661 B13R2.13 Brc1cccc(N2CCCC2)c1 Amb22231985 [0,1,0,1,0,0|2,0,0]=4 12662 B13R2.13 Brc1cccc(N2CCCC2)c1 Amb2723634 [0,1,0,1,0,0|2,0,0]=4 12663 B13R2.13 Brc1cccc([C@@H]2CCCN2)c1 Amb23440340 [0,1,0,1,0,0|2,0,0]=4 12664 B13R2.13 Brc1cccc([C@@H]2CCCN2)c1 Amb8397165 [0,1,0,1,0,0|2,0,0]=4 12665 B13R2.13 Brc1cccc([C@@H]2CCNC2)c1 Amb28251275 [0,1,0,1,0,0|0,0,0]=2 12666 B13R2.13 Brc1cccc([C@H]2CCCN2)c1 Amb33801987 [0,1,0,1,0,0|2,0,0]=4 12667 B13R2.13 Brc1cccc([C@H]2CCCN2)c1 Amb8397164 [0,1,0,1,0,0|2,0,0]=4 12668 B13R2.13 Brc1ccnc(C2CCCC2)c1 Amb10599895 [0,1,0,1,0,0|2,0,0]=4 12669 B13R2.13 Brc1ccnc(C2CCOC2)c1 Amb20617664 [0,1,0,1,0,0|2,0,0]=4 12670 B13R2.13 Brc1cncc(C2CCCC2)c1 Amb20617717 [0,1,0,1,0,0|2,0,0]=4 12671 B13R2.13 Brc1cncc(C2CCNC2)c1 Amb24082796 [0,1,0,1,0,0|1,0,0]=3 12672 B13R2.13 Brc1cncc(C2CCOC2)c1 Amb24320760 [0,1,0,1,0,0|2,0,0]=4 12673 B13R2.13 Cc1cc(C2CCNC2)ccn1 Amb26549787 [0,1,0,1,0,0|1,0,0]=3 12674 B13R2.13 Cc1cc(C2CCNC2)ncn1 Amb18829144 [0,1,0,1,0,0|2,0,0]=4 12675 B13R2.13 Cc1cccc(C2=NNCC2)c1 Amb26946377 [0,1,0,1,0,0|1,0,1]=4 12676 B13R2.13 Cc1cccc(C2CCCN2)c1 Amb9715990 [0,1,0,1,0,0|2,0,0]=4 12677 B13R2.13 Cc1cccc(C2CCNC2)c1 Amb17104483 [0,1,0,1,0,0|0,0,0]=2 12678 B13R2.13 Cc1cccc(C2CCNC2)c1 Amb22000992 [0,1,0,1,0,0|0,0,0]=2 12679 B13R2.13 Cc1cccc(C2CCNC2)n1 Amb18829562 [0,1,0,1,0,0|1,0,0]=3 12680 B13R2.13 Cc1cccc(C2CCNC2)n1 Amb32662655 [0,1,0,1,0,0|1,0,0]=3 12681 B13R2.13 Cc1cccc(C2CNCO2)c1 Amb18563577 [0,1,0,1,0,0|1,0,0]=3 12682 B13R2.13 Cc1cccc(N2CCCC2)c1 Amb22524397 [0,1,0,1,0,0|2,0,0]=4 12683 B13R2.13 Cc1cccc([C@@H]2CCCN2)c1 Amb25992616 [0,1,0,1,0,0|2,0,0]=4 12684 B13R2.13 Cc1cccc([C@@H]2CCNC2)c1 Amb27840411 [0,1,0,1,0,0|0,0,0]=2 12685 B13R2.13 Cc1cccc([C@H]2CCCN2)c1 Amb24426768 [0,1,0,1,0,0|2,0,0]=4 12686 B13R2.13 Cc1ccnc(C2CCNC2)c1 Amb25034617 [0,1,0,1,0,0|1,0,0]=3 12687 B13R2.13 Cc1ccnc(C2CCNC2)c1 Amb32662883 [0,1,0,1,0,0|1,0,0]=3 12688 B13R2.13 Cc1ccnc(C2CCNC2)n1 Amb27598000 [0,1,0,1,0,0|2,0,0]=4 12689 B13R2.13 Cc1cncc(C2CCNC2)c1 Amb27632278 [0,1,0,1,0,0|1,0,0]=3 12690 B13R2.13 Cc1cncc(C2CCNC2)c1 Amb32662916 [0,1,0,1,0,0|1,0,0]=3 12691 B13R2.13 Cc1nccc(C2CCNC2)n1 Amb18829169 [0,1,0,1,0,0|2,0,0]=4 12692 B13R2.13 Cc1nccc(C2CCNC2)n1 Amb32410151 [0,1,0,1,0,0|2,0,0]=4 12693 B13R2.13 Clc1cc(C2CCNC2)ccn1 Amb25934772 [0,1,0,1,0,0|1,0,0]=3 12694 B13R2.13 Clc1cc(C2CCNC2)ccn1 Amb32668412 [0,1,0,1,0,0|1,0,0]=3 12695 B13R2.13 Clc1cc(C2CCOC2)ccn1 Amb20617930 [0,1,0,1,0,0|2,0,0]=4 12696 B13R2.13 Clc1cc(C2CCSC2)ccn1 Amb20617304 [0,1,0,1,0,0|2,0,0]=4 12697 B13R2.13 Clc1cccc(C2=CCNC2)c1 Amb27811845 [0,1,0,1,0,0|0,0,2]=4 12698 B13R2.13 Clc1cccc(C2CCCN2)c1 Amb2234805 [0,1,0,1,0,0|2,0,0]=4 12699 B13R2.13 Clc1cccc(C2CCCN2)c1 Amb2237167 [0,1,0,1,0,0|2,0,0]=4 12700 B13R2.13 Clc1cccc(C2CCNC2)c1 Amb10607470 [0,1,0,1,0,0|0,0,0]=2 12701 B13R2.13 Clc1cccc(C2CCNC2)c1 Amb22234362 [0,1,0,1,0,0|0,0,0]=2 12702 B13R2.13 Clc1cccc(C2CCNC2)n1 Amb27470762 [0,1,0,1,0,0|1,0,0]=3 12703 B13R2.13 Clc1cccc(C2CNCO2)c1 Amb18564264 [0,1,0,1,0,0|1,0,0]=3 12704 B13R2.13 Clc1cccc(N2CCCC2)c1 Amb10071156 [0,1,0,1,0,0|2,0,0]=4 12705 B13R2.13 Clc1cccc([C@@H]2CCCN2)c1 Amb23440341 [0,1,0,1,0,0|2,0,0]=4 12706 B13R2.13 Clc1cccc([C@@H]2CCCN2)c1 Amb8397171 [0,1,0,1,0,0|2,0,0]=4 12707 B13R2.13 Clc1cccc([C@@H]2CCNC2)c1 Amb24061063 [0,1,0,1,0,0|0,0,0]=2 12708 B13R2.13 Clc1cccc([C@H]2CCCN2)c1 Amb24093535 [0,1,0,1,0,0|2,0,0]=4 12709 B13R2.13 Clc1cccc([C@H]2CCCN2)c1 Amb8397170 [0,1,0,1,0,0|2,0,0]=4 12710 B13R2.13 Clc1cccc([C@H]2CCNC2)c1 Amb24089109 [0,1,0,1,0,0|0,0,0]=2 12711 B13R2.13 Clc1cccc([C@H]2CCNC2)c1 Amb28255437 [0,1,0,1,0,0|0,0,0]=2 12712 B13R2.13 Clc1ccnc(C2CCNC2)c1 Amb18823443 [0,1,0,1,0,0|1,0,0]=3 12713 B13R2.13 Clc1ccnc(C2CCNC2)n1 Amb10600979 [0,1,0,1,0,0|2,0,0]=4 12714 B13R2.13 Clc1ccnc(C2CCOC2)c1 Amb24320268 [0,1,0,1,0,0|2,0,0]=4 12715 B13R2.13 Clc1cncc(C2CCNC2)c1 Amb27598020 [0,1,0,1,0,0|1,0,0]=3 12716 B13R2.13 Clc1nccc(C2CCNC2)n1 Amb27445964 [0,1,0,1,0,0|2,0,0]=4 12717 B13R2.13 Fc1cccc(C2C=CCC2)c1 Amb25751416 [0,1,0,1,0,0|1,0,1]=4 12718 B13R2.13 Fc1cccc(C2CCCC2)n1 Amb24319188 [0,1,0,1,0,0|2,0,0]=4 12719 B13R2.13 Fc1cccc(C2CCCN2)c1 Amb10609533 [0,1,0,1,0,0|2,0,0]=4 12720 B13R2.13 Fc1cccc(C2CCCN2)c1 Amb9712712 [0,1,0,1,0,0|2,0,0]=4 12721 B13R2.13 Fc1cccc(C2CCNC2)c1 Amb18946445 [0,1,0,1,0,0|0,0,0]=2 12722 B13R2.13 Fc1cccc(C2CCNC2)c1 Amb24078505 [0,1,0,1,0,0|0,0,0]=2 12723 B13R2.13 Fc1cccc(C2CCNC2)c1 Amb31198204 [0,1,0,1,0,0|0,0,0]=2 12724 B13R2.13 Fc1cccc(C2CCNC2)n1 Amb18199641 [0,1,0,1,0,0|1,0,0]=3 12725 B13R2.13 Fc1cccc(C2CNCO2)c1 Amb18563794 [0,1,0,1,0,0|1,0,0]=3 12726 B13R2.13 Fc1cccc(N2CCCC2)c1 Amb18269451 [0,1,0,1,0,0|2,0,0]=4 12727 B13R2.13 Fc1cccc([C@@H]2CCCN2)c1 Amb30451176 [0,1,0,1,0,0|2,0,0]=4 12728 B13R2.13 Fc1cccc([C@@H]2CCCN2)c1 Amb8397176 [0,1,0,1,0,0|2,0,0]=4 12729 B13R2.13 Fc1cccc([C@H]2CCCN2)c1 Amb30588569 [0,1,0,1,0,0|2,0,0]=4 12730 B13R2.13 Fc1cccc([C@H]2CCCN2)c1 Amb33801906 [0,1,0,1,0,0|2,0,0]=4 12731 B13R2.13 Fc1cccc([C@H]2CCCN2)c1 Amb8397177 [0,1,0,1,0,0|2,0,0]=4 12732 B13R2.13 Fc1cccc([C@H]2CCNC2)c1 Amb24065622 [0,1,0,1,0,0|0,0,0]=2 12733 B13R2.13 Fc1ccnc(C2CCCC2)c1 Amb24319240 [0,1,0,1,0,0|2,0,0]=4 12734 B13R2.13 Fc1ccnc(C2CCNC2)c1 Amb33415304 [0,1,0,1,0,0|1,0,0]=3 12735 B13R2.13 Fc1cncc(C2CCNC2)c1 Amb23586021 [0,1,0,1,0,0|1,0,0]=3 12736 B13R2.13 Fc1cncc(C2CCNC2)c1 Amb32662738 [0,1,0,1,0,0|1,0,0]=3 12737 B13R2.13 Ic1cccc(C2CCCN2)c1 Amb2235906 [0,1,0,1,0,0|2,0,0]=4 12738 B13R2.13 Ic1cccc(C2CCNC2)c1 Amb26013544 [0,1,0,1,0,0|0,0,0]=2 12739 B13R2.13 Ic1cccc(N2CCCC2)c1 Amb33528982 [0,1,0,1,0,0|2,0,0]=4 12740 B13R2.13 Ic1cccc([C@@H]2CCCN2)c1 Amb27259342 [0,1,0,1,0,0|2,0,0]=4 12741 B13R2.13 Ic1cccc([C@@H]2CCNC2)c1 Amb27798512 [0,1,0,1,0,0|0,0,0]=2 12742 B13R2.13 Nc1cc(C2CCCC2)ccn1 Amb10600463 [0,1,0,1,0,0|2,0,0]=4 12743 B13R2.13 Nc1cc(C2CCNC2)ccn1 Amb10600928 [0,1,0,1,0,0|1,0,0]=3 12744 B13R2.13 Nc1cc(C2CCOC2)ccn1 Amb10600934 [0,1,0,1,0,0|2,0,0]=4 12745 B13R2.13 Nc1cc(C2CCSC2)ccn1 Amb20617305 [0,1,0,1,0,0|2,0,0]=4 12746 B13R2.13 Nc1cccc(C2CCCC2)c1 Amb17106960 [0,1,0,1,0,0|1,0,0]=3 12747 B13R2.13 Nc1cccc(C2CCCC2)n1 Amb10599837 [0,1,0,1,0,0|2,0,0]=4 12748 B13R2.13 Nc1cccc(C2CCCN2)c1 Amb18064042 [0,1,0,1,0,0|2,0,0]=4 12749 B13R2.13 Nc1cccc(C2CCCO2)c1 Amb17334585 [0,1,0,1,0,0|2,0,0]=4 12750 B13R2.13 Nc1cccc(C2CCNC2)c1 Amb22236081 [0,1,0,1,0,0|0,0,0]=2 12751 B13R2.13 Nc1cccc(C2CCNC2)c1 Amb27974625 [0,1,0,1,0,0|0,0,0]=2 12752 B13R2.13 Nc1cccc(C2CCOC2)c1 Amb20617103 [0,1,0,1,0,0|1,0,0]=3 12753 B13R2.13 Nc1cccc(C2CCOC2)n1 Amb10600930 [0,1,0,1,0,0|2,0,0]=4 12754 B13R2.13 Nc1cccc(N2CCCC2)c1 Amb6331052 [0,1,0,1,0,0|2,0,0]=4 12755 B13R2.13 Nc1cccc([C@@H]2CCCN2)c1 Amb30869527 [0,1,0,1,0,0|2,0,0]=4 12756 B13R2.13 Nc1cccc([C@H]2CCCN2)c1 Amb27196186 [0,1,0,1,0,0|2,0,0]=4 12757 B13R2.13 Nc1cccc([C@H]2CCCN2)c1 Amb33872241 [0,1,0,1,0,0|2,0,0]=4 12758 B13R2.13 Nc1ccnc(C2CCCC2)c1 Amb20617630 [0,1,0,1,0,0|2,0,0]=4 12759 B13R2.13 Nc1ccnc(C2CCNC2)c1 Amb27613547 [0,1,0,1,0,0|1,0,0]=3 12760 B13R2.13 Nc1ccnc(C2CCNC2)n1 Amb10600980 [0,1,0,1,0,0|2,0,0]=4 12761 B13R2.13 Nc1cncc(C2CCCC2)c1 Amb18829594 [0,1,0,1,0,0|2,0,0]=4 12762 B13R2.13 Nc1cncc(C2CCNC2)c1 Amb27862490 [0,1,0,1,0,0|1,0,0]=3 12763 B13R2.13 Nc1nccc(C2CCNC2)n1 Amb18828737 [0,1,0,1,0,0|2,0,0]=4 12764 B13R2.13 O=C1C=CC=C(C2CCNC2)N1 Amb18828786 [0,1,0,1,0,0|1,0,0]=3 12765 B13R2.13 O=C1C=CN=C(C2CCNC2)N1 Amb28251605 [0,1,0,1,0,0|2,0,0]=4 12766 B13R2.13 Oc1cc(C2CCCC2)ccn1 Amb10600464 [0,1,0,1,0,0|2,0,0]=4 12767 B13R2.13 Oc1cc(C2CCNC2)ccn1 Amb28146063 [0,1,0,1,0,0|1,0,0]=3 12768 B13R2.13 Oc1cccc(C2=NNCC2)c1 Amb28199898 [0,1,0,1,0,0|1,0,1]=4 12769 B13R2.13 Oc1cccc(C2CCCC2)c1 Amb20617100 [0,1,0,1,0,0|1,0,0]=3 12770 B13R2.13 Oc1cccc(C2CCCC2)n1 Amb10599838 [0,1,0,1,0,0|2,0,0]=4 12771 B13R2.13 Oc1cccc(C2CCCN2)c1 Amb18062874 [0,1,0,1,0,0|2,0,0]=4 12772 B13R2.13 Oc1cccc(C2CCCN2)c1 Amb30633926 [0,1,0,1,0,0|2,0,0]=4 12773 B13R2.13 Oc1cccc(C2CCNC2)c1 Amb18062857 [0,1,0,1,0,0|0,0,0]=2 12774 B13R2.13 Oc1cccc(C2CCNC2)c1 Amb28555819 [0,1,0,1,0,0|0,0,0]=2 12775 B13R2.13 Oc1cccc(C2CCOC2)c1 Amb20617104 [0,1,0,1,0,0|1,0,0]=3 12776 B13R2.13 Oc1cccc(N2CCCC2)c1 Amb18645880 [0,1,0,1,0,0|2,0,0]=4 12777 B13R2.13 Oc1cccc(N2CCCC2)c1 Amb32652233 [0,1,0,1,0,0|2,0,0]=4 12778 B13R2.13 Oc1ccnc(C2CCCC2)c1 Amb20617631 [0,1,0,1,0,0|2,0,0]=4 12779 B13R2.13 Oc1cncc(C2CCCC2)c1 Amb20617719 [0,1,0,1,0,0|2,0,0]=4 12780 B13R2.13 Oc1cncc(C2CCNC2)c1 Amb27616911 [0,1,0,1,0,0|1,0,0]=3 12781 B13R2.13 Oc1nccc(C2CCNC2)n1 Amb18828320 [0,1,0,1,0,0|2,0,0]=4 12782 B13R2.13 Sc1cccc(C2CCNC2)c1 Amb27770169 [0,1,0,1,0,0|0,0,0]=2 12783 B13R2.136 C=C[C@@H]1C[C@@H]1c2cccc(O)c2 Amb28202386 [0,1,0,1,0,0|1,0,1]=4 12784 B13R2.136 C=C[C@H]1C[C@H]1c2cccc(O)c2 Amb28057501 [0,1,0,1,0,0|1,0,1]=4 12785 B13R2.136 Cc1cccc(C2CC2C#N)c1 Amb17232208 [0,1,0,1,0,0|2,0,0]=4 12786 B13R2.136 Cc1cccc(C2CC2CCl)c1 Amb27982359 [0,1,0,1,0,0|2,0,0]=4 12787 B13R2.136 Cc1cccc(C2CC2CN)c1 Amb17232380 [0,1,0,1,0,0|2,0,0]=4 12788 B13R2.136 Cc1cccc(C2CC2CN)c1 Amb29837830 [0,1,0,1,0,0|2,0,0]=4 12789 B13R2.136 Cc1cccc([C@@H]2C[C@H]2CN)c1 Amb33380579 [0,1,0,1,0,0|2,0,0]=4 12790 B13R2.136 Cc1cccc([C@H]2C[C@@H]2CO)c1 Amb27854222 [0,1,0,1,0,0|2,0,0]=4 12791 B13R2.136 NCC1CC1c2cccc(Br)c2 Amb17247244 [0,1,0,1,0,0|2,0,0]=4 12792 B13R2.136 NCC1CC1c2cccc(Cl)c2 Amb17233871 [0,1,0,1,0,0|2,0,0]=4 12793 B13R2.136 NCC1CC1c2cccc(F)c2 Amb17568192 [0,1,0,1,0,0|2,0,0]=4 12794 B13R2.136 NCC1CC1c2cccc(O)c2 Amb17568189 [0,1,0,1,0,0|2,0,0]=4 12795 B13R2.136 NC[C@@H]1C[C@H]1c2cccc(Br)c2 Amb33451599 [0,1,0,1,0,0|2,0,0]=4 12796 B13R2.136 NC[C@@H]1C[C@H]1c2cccc(Cl)c2 Amb33223619 [0,1,0,1,0,0|2,0,0]=4 12797 B13R2.136 NC[C@@H]1C[C@H]1c2cccc(F)c2 Amb26065671 [0,1,0,1,0,0|2,0,0]=4 12798 B13R2.136 NC[C@@H]1C[C@H]1c2cccc(O)c2 Amb33310880 [0,1,0,1,0,0|2,0,0]=4 12799 B13R2.136 NC[C@H]1C[C@@H]1c2cccc(O)c2 Amb28197214 [0,1,0,1,0,0|2,0,0]=4 12800 B13R2.136 OCC1CC1c2cccc(Br)c2 Amb17605536 [0,1,0,1,0,0|2,0,0]=4 12801 B13R2.136 OCC1CC1c2cccc(F)c2 Amb17605540 [0,1,0,1,0,0|2,0,0]=4 12802 B13R2.136 OC[C@H]1C[C@@H]1c2cccc(F)c2 Amb27775547 [0,1,0,1,0,0|2,0,0]=4 12803 B13R2.151 Cc1cccc(C2CC(=O)C2)c1 Amb20622979 [0,1,0,1,0,0|2,0,0]=4 12804 B13R2.151 Cc1cccc(C2CC(N)C2)c1 Amb33362331 [0,1,0,1,0,0|2,0,0]=4 12805 B13R2.151 Cc1cccc(C2CC(N)C2)c1 Amb9497088 [0,1,0,1,0,0|2,0,0]=4 12806 B13R2.151 Cc1cccc(C2CC(O)C2)c1 Amb18792428 [0,1,0,1,0,0|2,0,0]=4 12807 B13R2.151 Cc1cccc(C2CC(S)C2)c1 Amb32788860 [0,1,0,1,0,0|2,0,0]=4 12808 B13R2.151 Cc1cccc([C@H]2C[C@H](N)C2)c1 Amb25681746 [0,1,0,1,0,0|2,0,0]=4 12809 B13R2.151 Cc1cccc([C@H]2C[C@H](N)C2)c1 Amb28963373 [0,1,0,1,0,0|2,0,0]=4 12810 B13R2.151 FC1CC(c2cccc(Br)c2)C1 Amb31378217 [0,1,0,1,0,0|2,0,0]=4 12811 B13R2.151 Fc1cccc(C2CC(S)C2)c1 Amb32788811 [0,1,0,1,0,0|2,0,0]=4 12812 B13R2.151 NC1CC(c2cccc(Cl)c2)C1 Amb33532300 [0,1,0,1,0,0|2,0,0]=4 12813 B13R2.151 NC1CC(c2cccc(Cl)c2)C1 Amb33550029 [0,1,0,1,0,0|2,0,0]=4 12814 B13R2.151 NC1CC(c2cccc(F)c2)C1 Amb19373571 [0,1,0,1,0,0|2,0,0]=4 12815 B13R2.151 NC1CC(c2cccc(F)c2)C1 Amb9497082 [0,1,0,1,0,0|2,0,0]=4 12816 B13R2.151 N[C@H]1C[C@H](c2cccc(Br)c2)C1 Amb31260933 [0,1,0,1,0,0|2,0,0]=4 12817 B13R2.151 N[C@H]1C[C@H](c2cccc(Br)c2)C1 Amb33457924 [0,1,0,1,0,0|2,0,0]=4 12818 B13R2.151 N[C@H]1C[C@H](c2cccc(Cl)c2)C1 Amb28291034 [0,1,0,1,0,0|2,0,0]=4 12819 B13R2.151 N[C@H]1C[C@H](c2cccc(Cl)c2)C1 Amb33473673 [0,1,0,1,0,0|2,0,0]=4 12820 B13R2.151 N[C@H]1C[C@H](c2cccc(F)c2)C1 Amb24433769 [0,1,0,1,0,0|2,0,0]=4 12821 B13R2.151 N[C@H]1C[C@H](c2cccc(F)c2)C1 Amb33473655 [0,1,0,1,0,0|2,0,0]=4 12822 B13R2.151 Nc1cccc(C2CC(F)C2)c1 Amb31378223 [0,1,0,1,0,0|2,0,0]=4 12823 B13R2.151 Nc1cccc(C2CC(O)C2)c1 Amb27786105 [0,1,0,1,0,0|2,0,0]=4 12824 B13R2.151 O=C1CC(c2cccc(Br)c2)C1 Amb10976129 [0,1,0,1,0,0|2,0,0]=4 12825 B13R2.151 O=C1CC(c2cccc(Cl)c2)C1 Amb20622981 [0,1,0,1,0,0|2,0,0]=4 12826 B13R2.151 O=C1CC(c2cccc(F)c2)C1 Amb20622980 [0,1,0,1,0,0|2,0,0]=4 12827 B13R2.151 OC1CC(c2cccc(Br)c2)C1 Amb24400910 [0,1,0,1,0,0|2,0,0]=4 12828 B13R2.151 OC1CC(c2cccc(Cl)c2)C1 Amb19057041 [0,1,0,1,0,0|2,0,0]=4 12829 B13R2.151 O[C@H]1C[C@@H](c2cccc(Cl)c2)C1 Amb26555344 [0,1,0,1,0,0|2,0,0]=4 12830 B13R2.151 SC1CC(c2cccc(Br)c2)C1 Amb32788476 [0,1,0,1,0,0|2,0,0]=4 12831 B13R2.151 SC1CC(c2cccc(Cl)c2)C1 Amb32788657 [0,1,0,1,0,0|2,0,0]=4 12832 B13R2.162 CC1CCCc2cnc(N)cc21 Amb32756452 [0,1,0,1,0,0|2,0,0]=4 12833 B13R2.162 CC1CCNc2ccc(Br)cc21 Amb22501043 [0,1,0,1,0,0|2,0,0]=4 12834 B13R2.162 CC1CCNc2ccc(Cl)cc21 Amb27961259 [0,1,0,1,0,0|2,0,0]=4 12835 B13R2.162 CC1CCNc2ccc(F)cc21 Amb18828263 [0,1,0,1,0,0|2,0,0]=4 12836 B13R2.162 CC1CCNc2ccc(I)cc21 Amb27776424 [0,1,0,1,0,0|2,0,0]=4 12837 B13R2.162 CC1CCNc2ccc(O)cc21 Amb27259644 [0,1,0,1,0,0|2,0,0]=4 12838 B13R2.162 CC1CCOc2ccc(O)cc21 Amb28251635 [0,1,0,1,0,0|2,0,0]=4 12839 B13R2.162 CC1CNCC2=C1NC(=O)C=C2 Amb27843547 [0,1,0,1,0,0|1,0,0]=3 12840 B13R2.162 CC1CNCc2ccc(Br)cc21 Amb34158156 [0,1,0,1,0,0|0,0,0]=2 12841 B13R2.162 CC1CNCc2ccc(Cl)cc21 Amb18648572 [0,1,0,1,0,0|0,0,0]=2 12842 B13R2.162 CC1CNCc2ccc(F)cc21 Amb25309863 [0,1,0,1,0,0|0,0,0]=2 12843 B13R2.162 CC1NCCc2ccc(Br)cc21 Amb28239265 [0,1,0,1,0,0|2,0,0]=4 12844 B13R2.162 CC1NCCc2ccc(Cl)cc21 Amb18278155 [0,1,0,1,0,0|2,0,0]=4 12845 B13R2.162 CC1NCCc2ccc(F)cc21 Amb18278154 [0,1,0,1,0,0|2,0,0]=4 12846 B13R2.162 CC1NCCc2ccc(F)cc21 Amb19374107 [0,1,0,1,0,0|2,0,0]=4 12847 B13R2.162 CC1NCCc2ccc(N)cc21 Amb24729674 [0,1,0,1,0,0|2,0,0]=4 12848 B13R2.162 CC1NCCc2ccc(O)cc21 Amb18063208 [0,1,0,1,0,0|2,0,0]=4 12849 B13R2.162 CC1NCCc2ccc(O)cc21 Amb20668206 [0,1,0,1,0,0|2,0,0]=4 12850 B13R2.162 CC1NCCc2ccc(O)cc21 Amb33330593 [0,1,0,1,0,0|2,0,0]=4 12851 B13R2.162 CN1CCCc2ccc(F)cc21 Amb27766382 [0,1,0,1,0,0|2,0,0]=4 12852 B13R2.162 CN1CCCc2ccc(N)cc21 Amb10603894 [0,1,0,1,0,0|2,0,0]=4 12853 B13R2.162 CN1CCCc2ccc(N)cc21 Amb7089073 [0,1,0,1,0,0|2,0,0]=4 12854 B13R2.162 CN1CCCc2ccc(O)cc21 Amb18054646 [0,1,0,1,0,0|2,0,0]=4 12855 B13R2.162 C[C@@H]1NCCc2ccc(F)cc21 Amb27171531 [0,1,0,1,0,0|2,0,0]=4 12856 B13R2.162 C[C@H]1NCCc2ccc(Cl)cc21 Amb28042359 [0,1,0,1,0,0|2,0,0]=4 12857 B13R2.162 Cc1ccc2c(c1)C(=O)CNC2 Amb17194297 [0,1,0,1,0,0|1,0,1]=4 12858 B13R2.162 Cc1ccc2c(c1)C(Br)CCC2 Amb27763678 [0,1,0,1,0,0|2,0,0]=4 12859 B13R2.162 Cc1ccc2c(c1)C(C)CCN2 Amb9782723 [0,1,0,1,0,0|2,0,0]=4 12860 B13R2.162 Cc1ccc2c(c1)C(C)CNC2 Amb27181238 [0,1,0,1,0,0|0,0,0]=2 12861 B13R2.162 Cc1ccc2c(c1)C(C)NCC2 Amb5735686 [0,1,0,1,0,0|2,0,0]=4 12862 B13R2.162 Cc1ccc2c(c1)C(Cl)CCC2 Amb17087943 [0,1,0,1,0,0|2,0,0]=4 12863 B13R2.162 Cc1ccc2c(c1)C(N)CCC2 Amb17088094 [0,1,0,1,0,0|2,0,0]=4 12864 B13R2.162 Cc1ccc2c(c1)C(N)CCC2 Amb23440395 [0,1,0,1,0,0|2,0,0]=4 12865 B13R2.162 Cc1ccc2c(c1)C(N)COC2 Amb27881326 [0,1,0,1,0,0|2,0,0]=4 12866 B13R2.162 Cc1ccc2c(c1)C(O)CCC2 Amb17087893 [0,1,0,1,0,0|2,0,0]=4 12867 B13R2.162 Cc1ccc2c(c1)C(O)CNC2 Amb17194238 [0,1,0,1,0,0|1,0,0]=3 12868 B13R2.162 Cc1ccc2c(c1)N(C)CCC2 Amb27651410 [0,1,0,1,0,0|2,0,0]=4 12869 B13R2.162 Cc1ccc2c(c1)[C@@H](N)CCC2 Amb26968679 [0,1,0,1,0,0|2,0,0]=4 12870 B13R2.162 Cc1ccc2c(c1)[C@@H](N)CCC2 Amb28555754 [0,1,0,1,0,0|2,0,0]=4 12871 B13R2.162 Cc1ccc2c(c1)[C@@H](O)CCC2 Amb26977097 [0,1,0,1,0,0|2,0,0]=4 12872 B13R2.162 Cc1ccc2c(c1)[C@H](N)CCC2 Amb28119974 [0,1,0,1,0,0|2,0,0]=4 12873 B13R2.162 Cc1ccc2c(c1)[C@H](N)CCC2 Amb32660959 [0,1,0,1,0,0|2,0,0]=4 12874 B13R2.162 Cc1ccc2c(c1)[C@H](N)COC2 Amb28244135 [0,1,0,1,0,0|2,0,0]=4 12875 B13R2.162 Cc1ccc2c(c1)[C@H](O)CCC2 Amb24738415 [0,1,0,1,0,0|2,0,0]=4 12876 B13R2.162 Cc1ccc2c(n1)C(C)CCC2 Amb27616936 [0,1,0,1,0,0|2,0,0]=4 12877 B13R2.162 Cc1cnc2c(c1)C(O)CNC2 Amb18828800 [0,1,0,1,0,0|2,0,0]=4 12878 B13R2.162 ClC1CCCc2ccc(Br)cc21 Amb22059139 [0,1,0,1,0,0|2,0,0]=4 12879 B13R2.162 Clc1ccc2c(c1)C(Br)CCC2 Amb28203079 [0,1,0,1,0,0|2,0,0]=4 12880 B13R2.162 Clc1ccc2c(c1)C(Cl)CCC2 Amb17087945 [0,1,0,1,0,0|2,0,0]=4 12881 B13R2.162 Fc1ccc2c(c1)C(Cl)CCC2 Amb17087944 [0,1,0,1,0,0|2,0,0]=4 12882 B13R2.162 NC1CCCc2ccc(Br)cc21 Amb22304698 [0,1,0,1,0,0|2,0,0]=4 12883 B13R2.162 NC1CCCc2ccc(Br)cc21 Amb2383244 [0,1,0,1,0,0|2,0,0]=4 12884 B13R2.162 NC1CCCc2ccc(Cl)cc21 Amb2383242 [0,1,0,1,0,0|2,0,0]=4 12885 B13R2.162 NC1CCCc2ccc(F)cc21 Amb22586300 [0,1,0,1,0,0|2,0,0]=4 12886 B13R2.162 NC1CCCc2ccc(F)cc21 Amb2383243 [0,1,0,1,0,0|2,0,0]=4 12887 B13R2.162 NC1CCCc2ccc(I)cc21 Amb27619718 [0,1,0,1,0,0|2,0,0]=4 12888 B13R2.162 NC1CCCc2ccc(O)cc21 Amb18645877 [0,1,0,1,0,0|2,0,0]=4 12889 B13R2.162 NC1COCc2ccc(Br)cc21 Amb10067683 [0,1,0,1,0,0|2,0,0]=4 12890 B13R2.162 NC1COCc2ccc(Br)cc21 Amb19958190 [0,1,0,1,0,0|2,0,0]=4 12891 B13R2.162 NC1COCc2ccc(Cl)cc21 Amb27646516 [0,1,0,1,0,0|2,0,0]=4 12892 B13R2.162 NC1CSCc2ccc(Br)cc21 Amb19958493 [0,1,0,1,0,0|2,0,0]=4 12893 B13R2.162 NC1CSCc2ccc(Br)cc21 Amb24452958 [0,1,0,1,0,0|2,0,0]=4 12894 B13R2.162 N[C@@H]1CCCc2ccc(Br)cc21 Amb24475493 [0,1,0,1,0,0|2,0,0]=4 12895 B13R2.162 N[C@@H]1CCCc2ccc(Br)cc21 Amb33875001 [0,1,0,1,0,0|2,0,0]=4 12896 B13R2.162 N[C@@H]1CCCc2ccc(Cl)cc21 Amb25084579 [0,1,0,1,0,0|2,0,0]=4 12897 B13R2.162 N[C@@H]1CCCc2ccc(F)cc21 Amb27630069 [0,1,0,1,0,0|2,0,0]=4 12898 B13R2.162 N[C@@H]1CCCc2ccc(F)cc21 Amb33379081 [0,1,0,1,0,0|2,0,0]=4 12899 B13R2.162 N[C@@H]1CCCc2ccc(I)cc21 Amb27642485 [0,1,0,1,0,0|2,0,0]=4 12900 B13R2.162 N[C@@H]1COCc2ccc(Cl)cc21 Amb27654023 [0,1,0,1,0,0|2,0,0]=4 12901 B13R2.162 N[C@@H]1COCc2ccc(F)cc21 Amb27615420 [0,1,0,1,0,0|2,0,0]=4 12902 B13R2.162 N[C@@H]1CSCc2ccc(Br)cc21 Amb27412796 [0,1,0,1,0,0|2,0,0]=4 12903 B13R2.162 N[C@H]1CCCc2ccc(Br)cc21 Amb27970789 [0,1,0,1,0,0|2,0,0]=4 12904 B13R2.162 N[C@H]1CCCc2ccc(Br)cc21 Amb33623089 [0,1,0,1,0,0|2,0,0]=4 12905 B13R2.162 N[C@H]1CCCc2ccc(Cl)cc21 Amb25921685 [0,1,0,1,0,0|2,0,0]=4 12906 B13R2.162 N[C@H]1CCCc2ccc(F)cc21 Amb27810828 [0,1,0,1,0,0|2,0,0]=4 12907 B13R2.162 N[C@H]1CCCc2ccc(F)cc21 Amb33379094 [0,1,0,1,0,0|2,0,0]=4 12908 B13R2.162 N[C@H]1CCCc2ccc(O)cc21 Amb27173360 [0,1,0,1,0,0|2,0,0]=4 12909 B13R2.162 N[C@H]1COCc2ccc(Cl)cc21 Amb27464144 [0,1,0,1,0,0|2,0,0]=4 12910 B13R2.162 N[C@H]1CSCc2ccc(Br)cc21 Amb27817457 [0,1,0,1,0,0|2,0,0]=4 12911 B13R2.162 N[C@H]1CSCc2ccc(Cl)cc21 Amb27390965 [0,1,0,1,0,0|2,0,0]=4 12912 B13R2.162 Nc1ccc2c(c1)C(F)CCC2 Amb27219831 [0,1,0,1,0,0|2,0,0]=4 12913 B13R2.162 Nc1ccc2c(c1)C(N)CCC2 Amb25363283 [0,1,0,1,0,0|2,0,0]=4 12914 B13R2.162 Nc1ccc2c(c1)C(N)CCC2 Amb32651996 [0,1,0,1,0,0|2,0,0]=4 12915 B13R2.162 Nc1ccc2c(c1)C(O)CCC2 Amb10601400 [0,1,0,1,0,0|2,0,0]=4 12916 B13R2.162 Nc1ccc2c(c1)[C@@H](N)CCC2 Amb28365739 [0,1,0,1,0,0|2,0,0]=4 12917 B13R2.162 Nc1ccc2c(c1)[C@H](N)CCC2 Amb27413074 [0,1,0,1,0,0|2,0,0]=4 12918 B13R2.162 O=C1CNCc2ccc(Cl)cc21 Amb17194299 [0,1,0,1,0,0|1,0,1]=4 12919 B13R2.162 O=C1CNCc2ccc(Cl)cc21 Amb31291117 [0,1,0,1,0,0|1,0,1]=4 12920 B13R2.162 O=C1CNCc2ccc(F)cc21 Amb17194298 [0,1,0,1,0,0|1,0,1]=4 12921 B13R2.162 O=C1CNCc2ccc(O)cc21 Amb27598011 [0,1,0,1,0,0|1,0,1]=4 12922 B13R2.162 OC1CCCc2ccc(Br)cc21 Amb17108428 [0,1,0,1,0,0|2,0,0]=4 12923 B13R2.162 OC1CCCc2ccc(Cl)cc21 Amb17087895 [0,1,0,1,0,0|2,0,0]=4 12924 B13R2.162 OC1CCCc2ccc(F)cc21 Amb17087894 [0,1,0,1,0,0|2,0,0]=4 12925 B13R2.162 OC1CNCc2ccc(Cl)cc21 Amb17194240 [0,1,0,1,0,0|1,0,0]=3 12926 B13R2.162 OC1CNCc2ccc(F)cc21 Amb17194239 [0,1,0,1,0,0|1,0,0]=3 12927 B13R2.162 OC1COCc2ccc(Br)cc21 Amb22490511 [0,1,0,1,0,0|2,0,0]=4 12928 B13R2.162 OC1CSCc2ccc(Br)cc21 Amb27167870 [0,1,0,1,0,0|2,0,0]=4 12929 B13R2.162 O[C@@H]1CCCc2ccc(Cl)cc21 Amb26314170 [0,1,0,1,0,0|2,0,0]=4 12930 B13R2.162 O[C@@H]1CCCc2ccc(F)cc21 Amb26599950 [0,1,0,1,0,0|2,0,0]=4 12931 B13R2.162 O[C@@H]1CSCc2ccc(F)cc21 Amb28341868 [0,1,0,1,0,0|2,0,0]=4 12932 B13R2.162 O[C@H]1CCCc2ccc(Cl)cc21 Amb27781095 [0,1,0,1,0,0|2,0,0]=4 12933 B13R2.162 O[C@H]1CCCc2ccc(F)cc21 Amb27265761 [0,1,0,1,0,0|2,0,0]=4 12934 B13R2.162 Oc1ccc2c(c1)C(F)CNC2 Amb27958941 [0,1,0,1,0,0|1,0,0]=3 12935 B13R2.162 Oc1ccc2c(c1)C(O)CNC2 Amb17194252 [0,1,0,1,0,0|1,0,0]=3 12936 B13R2.162 Oc1ccc2c(c1)C(S)CCC2 Amb32788802 [0,1,0,1,0,0|2,0,0]=4 12937 B13R2.162 Oc1ccc2c(c1)[C@@H](O)CCC2 Amb27163179 [0,1,0,1,0,0|2,0,0]=4 12938 B13R2.342 CC1CCNc2c(Br)cccc21 Amb24423447 [0,1,0,1,0,0|2,0,0]=4 12939 B13R2.342 CC1CCNc2c(Cl)cccc21 Amb24455755 [0,1,0,1,0,0|2,0,0]=4 12940 B13R2.342 CC1CCNc2c(F)cccc21 Amb25699202 [0,1,0,1,0,0|2,0,0]=4 12941 B13R2.342 CC1CCNc2c(O)cccc21 Amb27856811 [0,1,0,1,0,0|2,0,0]=4 12942 B13R2.342 CC1CCNc2c(O)cccc21 Amb30585036 [0,1,0,1,0,0|2,0,0]=4 12943 B13R2.342 CC1CCOc2c(N)cccc21 Amb28053005 [0,1,0,1,0,0|2,0,0]=4 12944 B13R2.342 CC1CCOc2c(O)cccc21 Amb27872999 [0,1,0,1,0,0|2,0,0]=4 12945 B13R2.342 CC1CNCc2c(Cl)cccc21 Amb18648573 [0,1,0,1,0,0|0,0,0]=2 12946 B13R2.342 CC1CNCc2c(F)cccc21 Amb24531591 [0,1,0,1,0,0|0,0,0]=2 12947 B13R2.342 CC1NCCc2c(Br)cccc21 Amb22059236 [0,1,0,1,0,0|2,0,0]=4 12948 B13R2.342 CC1NCCc2c(N)cccc21 Amb26518764 [0,1,0,1,0,0|2,0,0]=4 12949 B13R2.342 CC1NCCc2c(O)cccc21 Amb24546272 [0,1,0,1,0,0|2,0,0]=4 12950 B13R2.342 CN1CCCc2c(Br)cccc21 Amb23586165 [0,1,0,1,0,0|2,0,0]=4 12951 B13R2.342 CN1CCCc2c(O)cccc21 Amb11032489 [0,1,0,1,0,0|2,0,0]=4 12952 B13R2.342 C[C@@H]1NCCc2c(Br)cccc21 Amb27162384 [0,1,0,1,0,0|2,0,0]=4 12953 B13R2.342 C[C@H]1NCCc2c(Br)cccc21 Amb27248602 [0,1,0,1,0,0|2,0,0]=4 12954 B13R2.342 Cc1cccc2c1CCCC2C Amb22347908 [0,1,0,1,0,0|1,0,0]=3 12955 B13R2.342 Cc1cccc2c1CCCC2N Amb26027315 [0,1,0,1,0,0|2,0,0]=4 12956 B13R2.342 Cc1cccc2c1CCCC2N Amb31289677 [0,1,0,1,0,0|2,0,0]=4 12957 B13R2.342 Cc1cccc2c1CCC[C@@H]2N Amb25132142 [0,1,0,1,0,0|2,0,0]=4 12958 B13R2.342 Cc1cccc2c1CCC[C@H]2N Amb25921684 [0,1,0,1,0,0|2,0,0]=4 12959 B13R2.342 Cc1cccc2c1CCNC2C Amb5735622 [0,1,0,1,0,0|2,0,0]=4 12960 B13R2.342 Cc1cccc2c1CCN[C@H]2C Amb27752182 [0,1,0,1,0,0|2,0,0]=4 12961 B13R2.342 Cc1cccc2c1CNCC2C Amb27879149 [0,1,0,1,0,0|0,0,0]=2 12962 B13R2.342 Cc1cccc2c1CNCC2N Amb27215643 [0,1,0,1,0,0|1,0,0]=3 12963 B13R2.342 Cc1cccc2c1COCC2N Amb27237509 [0,1,0,1,0,0|2,0,0]=4 12964 B13R2.342 Cc1cccc2c1CSC[C@H]2N Amb27167871 [0,1,0,1,0,0|2,0,0]=4 12965 B13R2.342 Cc1cccc2c1NCCC2C Amb9782721 [0,1,0,1,0,0|2,0,0]=4 12966 B13R2.342 FC1CCCc2c(Br)cccc21 Amb27242792 [0,1,0,1,0,0|2,0,0]=4 12967 B13R2.342 NC1CCCc2c(Br)cccc21 Amb23440365 [0,1,0,1,0,0|2,0,0]=4 12968 B13R2.342 NC1CCCc2c(Br)cccc21 Amb25890687 [0,1,0,1,0,0|2,0,0]=4 12969 B13R2.342 NC1CCCc2c(Cl)cccc21 Amb2383247 [0,1,0,1,0,0|2,0,0]=4 12970 B13R2.342 NC1CCCc2c(F)cccc21 Amb22002615 [0,1,0,1,0,0|2,0,0]=4 12971 B13R2.342 NC1CCCc2c(F)cccc21 Amb2383248 [0,1,0,1,0,0|2,0,0]=4 12972 B13R2.342 NC1CCCc2c(O)cccc21 Amb18645876 [0,1,0,1,0,0|2,0,0]=4 12973 B13R2.342 NC1CSCc2c(Br)cccc21 Amb27196077 [0,1,0,1,0,0|2,0,0]=4 12974 B13R2.342 NC1CSCc2c(F)cccc21 Amb26067004 [0,1,0,1,0,0|2,0,0]=4 12975 B13R2.342 NC1CSCc2c(F)cccc21 Amb32701592 [0,1,0,1,0,0|2,0,0]=4 12976 B13R2.342 N[C@@H]1CCCc2c(Br)cccc21 Amb28246420 [0,1,0,1,0,0|2,0,0]=4 12977 B13R2.342 N[C@@H]1CCCc2c(Cl)cccc21 Amb27751952 [0,1,0,1,0,0|2,0,0]=4 12978 B13R2.342 N[C@@H]1CCCc2c(O)cccc21 Amb13953016 [0,1,0,1,0,0|2,0,0]=4 12979 B13R2.342 N[C@@H]1COCc2c(F)cccc21 Amb27619682 [0,1,0,1,0,0|2,0,0]=4 12980 B13R2.342 N[C@@H]1COCc2c(I)cccc21 Amb27168076 [0,1,0,1,0,0|2,0,0]=4 12981 B13R2.342 N[C@@H]1CSCc2c(Br)cccc21 Amb27405497 [0,1,0,1,0,0|2,0,0]=4 12982 B13R2.342 N[C@@H]1CSCc2c(F)cccc21 Amb28456160 [0,1,0,1,0,0|2,0,0]=4 12983 B13R2.342 N[C@H]1CCCc2c(Br)cccc21 Amb25034693 [0,1,0,1,0,0|2,0,0]=4 12984 B13R2.342 N[C@H]1CCCc2c(Br)cccc21 Amb33813742 [0,1,0,1,0,0|2,0,0]=4 12985 B13R2.342 N[C@H]1CCCc2c(Cl)cccc21 Amb26860753 [0,1,0,1,0,0|2,0,0]=4 12986 B13R2.342 N[C@H]1CCCc2c(F)cccc21 Amb26963664 [0,1,0,1,0,0|2,0,0]=4 12987 B13R2.342 N[C@H]1COCc2c(Br)cccc21 Amb27253114 [0,1,0,1,0,0|2,0,0]=4 12988 B13R2.342 N[C@H]1COCc2c(Cl)cccc21 Amb27593891 [0,1,0,1,0,0|2,0,0]=4 12989 B13R2.342 N[C@H]1COCc2c(F)cccc21 Amb27640081 [0,1,0,1,0,0|2,0,0]=4 12990 B13R2.342 Nc1cccc2c1CCCC2N Amb28044340 [0,1,0,1,0,0|2,0,0]=4 12991 B13R2.342 Nc1cccc2c1CCC[C@H]2N Amb27166870 [0,1,0,1,0,0|2,0,0]=4 12992 B13R2.342 Nc1cccc2c1COC[C@H]2N Amb28244003 [0,1,0,1,0,0|2,0,0]=4 12993 B13R2.342 OC1CCCc2c(Br)cccc21 Amb22500943 [0,1,0,1,0,0|2,0,0]=4 12994 B13R2.342 OC1CCCc2c(F)cccc21 Amb25719778 [0,1,0,1,0,0|2,0,0]=4 12995 B13R2.342 OC1CSCc2c(Br)cccc21 Amb28250582 [0,1,0,1,0,0|2,0,0]=4 12996 B13R2.342 O[C@@H]1CCCc2c(Cl)cccc21 Amb27878156 [0,1,0,1,0,0|2,0,0]=4 12997 B13R2.342 O[C@@H]1CCCc2c(F)cccc21 Amb27470913 [0,1,0,1,0,0|2,0,0]=4 12998 B13R2.342 O[C@H]1CCCc2c(Br)cccc21 Amb25848497 [0,1,0,1,0,0|2,0,0]=4 12999 B13R2.342 O[C@H]1CSCc2c(Br)cccc21 Amb27833149 [0,1,0,1,0,0|2,0,0]=4 13000 B13R2.342 O[C@H]1CSCc2c(Cl)cccc21 Amb28059381 [0,1,0,1,0,0|2,0,0]=4 13001 B13R2.342 O[C@H]1CSCc2c(F)cccc21 Amb27833150 [0,1,0,1,0,0|2,0,0]=4 13002 B13R2.342 Oc1cccc2c1CCCC2O Amb6357372 [0,1,0,1,0,0|2,0,0]=4 13003 B13R2.342 Oc1cccc2c1CCC[C@@H]2O Amb13953015 [0,1,0,1,0,0|2,0,0]=4 13004 B13R2.342 Oc1cccc2c1CNCC2O Amb27648844 [0,1,0,1,0,0|1,0,0]=3 13005 B13R2.3018 CC1(c2cc(Br)ccn2)CCC1 Amb28203791 [0,1,0,1,0,0|2,0,0]=4 13006 B13R2.3018 CC1(c2cccc(Br)c2)CCC1 Amb28053210 [0,1,0,1,0,0|1,0,0]=3 13007 B13R2.3018 CC1(c2cccc(Br)c2)CCO1 Amb10975946 [0,1,0,1,0,0|2,0,0]=4 13008 B13R2.3018 CC1(c2cccc(Br)c2)CNC1 Amb18571246 [0,1,0,1,0,0|0,0,0]=2 13009 B13R2.3018 CC1(c2cccc(Br)c2)COC1 Amb22737357 [0,1,0,1,0,0|1,0,0]=3 13010 B13R2.3018 CC1(c2cccc(Cl)c2)CCC1 Amb27421861 [0,1,0,1,0,0|1,0,0]=3 13011 B13R2.3018 CC1(c2cccc(Cl)c2)CCO1 Amb32946045 [0,1,0,1,0,0|2,0,0]=4 13012 B13R2.3018 CC1(c2cccc(Cl)c2)CNC1 Amb18564192 [0,1,0,1,0,0|0,0,0]=2 13013 B13R2.3018 CC1(c2cccc(F)c2)CCC1 Amb25202327 [0,1,0,1,0,0|1,0,0]=3 13014 B13R2.3018 CC1(c2cccc(F)c2)CCO1 Amb32642030 [0,1,0,1,0,0|2,0,0]=4 13015 B13R2.3018 CC1(c2cccc(I)c2)CCC1 Amb25249495 [0,1,0,1,0,0|1,0,0]=3 13016 B13R2.3018 Cc1cc(C2(O)CNC2)ccn1 Amb32733013 [0,1,0,1,0,0|2,0,0]=4 13017 B13R2.3018 Cc1cccc(C2(C)CCC2)c1 Amb27481768 [0,1,0,1,0,0|1,0,0]=3 13018 B13R2.3018 Cc1cccc(C2(C)CNC2)c1 Amb18563526 [0,1,0,1,0,0|0,0,0]=2 13019 B13R2.3018 Cc1cccc(C2(N)CCC2)c1 Amb28555685 [0,1,0,1,0,0|2,0,0]=4 13020 B13R2.3018 Cc1cccc(C2(N)CCC2)c1 Amb8997031 [0,1,0,1,0,0|2,0,0]=4 13021 B13R2.3018 Cc1cccc(C2(N)COC2)c1 Amb19892687 [0,1,0,1,0,0|2,0,0]=4 13022 B13R2.3018 Cc1cccc(C2(O)CNC2)c1 Amb27461104 [0,1,0,1,0,0|1,0,0]=3 13023 B13R2.3018 Cc1cccc(C2(O)CNC2)n1 Amb33199578 [0,1,0,1,0,0|2,0,0]=4 13024 B13R2.3018 Cc1cccc(C2(O)COC2)c1 Amb35658900 [0,1,0,1,0,0|2,0,0]=4 13025 B13R2.3018 Cc1ccnc(C2(O)CNC2)c1 Amb33318065 [0,1,0,1,0,0|2,0,0]=4 13026 B13R2.3018 Cc1cncc(C2(F)CNC2)c1 Amb27231054 [0,1,0,1,0,0|2,0,0]=4 13027 B13R2.3018 Cc1cncc(C2(O)CNC2)c1 Amb25094978 [0,1,0,1,0,0|2,0,0]=4 13028 B13R2.3018 FC1(c2cccc(Br)c2)CNC1 Amb35641869 [0,1,0,1,0,0|1,0,0]=3 13029 B13R2.3018 FC1(c2cccc(Br)c2)COC1 Amb27229039 [0,1,0,1,0,0|2,0,0]=4 13030 B13R2.3018 NC1(c2cccc(Br)c2)CCC1 Amb19892649 [0,1,0,1,0,0|2,0,0]=4 13031 B13R2.3018 NC1(c2cccc(Br)c2)CCC1 Amb33545952 [0,1,0,1,0,0|2,0,0]=4 13032 B13R2.3018 NC1(c2cccc(Br)c2)COC1 Amb19892681 [0,1,0,1,0,0|2,0,0]=4 13033 B13R2.3018 NC1(c2cccc(Br)c2)COC1 Amb23440109 [0,1,0,1,0,0|2,0,0]=4 13034 B13R2.3018 NC1(c2cccc(Cl)c2)CCC1 Amb1052366 [0,1,0,1,0,0|2,0,0]=4 13035 B13R2.3018 NC1(c2cccc(Cl)c2)CCC1 Amb19892642 [0,1,0,1,0,0|2,0,0]=4 13036 B13R2.3018 NC1(c2cccc(Cl)c2)CNC1 Amb27203227 [0,1,0,1,0,0|1,0,0]=3 13037 B13R2.3018 NC1(c2cccc(Cl)c2)COC1 Amb19892678 [0,1,0,1,0,0|2,0,0]=4 13038 B13R2.3018 NC1(c2cccc(Cl)c2)COC1 Amb26932986 [0,1,0,1,0,0|2,0,0]=4 13039 B13R2.3018 NC1(c2cccc(F)c2)CCC1 Amb19892177 [0,1,0,1,0,0|2,0,0]=4 13040 B13R2.3018 NC1(c2cccc(F)c2)CCC1 Amb8840557 [0,1,0,1,0,0|2,0,0]=4 13041 B13R2.3018 NC1(c2cccc(F)c2)COC1 Amb19892675 [0,1,0,1,0,0|2,0,0]=4 13042 B13R2.3018 NC1(c2cccc(F)c2)COC1 Amb22738799 [0,1,0,1,0,0|2,0,0]=4 13043 B13R2.3018 NC1(c2cccc(I)c2)CCC1 Amb27797048 [0,1,0,1,0,0|2,0,0]=4 13044 B13R2.3018 NC1(c2cccc(I)c2)COC1 Amb24183979 [0,1,0,1,0,0|2,0,0]=4 13045 B13R2.3018 NC1(c2cccc(O)c2)CCC1 Amb26062558 [0,1,0,1,0,0|2,0,0]=4 13046 B13R2.3018 Nc1cccc(C2(F)CCC2)c1 Amb27199363 [0,1,0,1,0,0|2,0,0]=4 13047 B13R2.3018 Nc1cccc(C2(N)CCC2)c1 Amb25860247 [0,1,0,1,0,0|2,0,0]=4 13048 B13R2.3018 Nc1cccc(C2(O)COC2)c1 Amb24460301 [0,1,0,1,0,0|2,0,0]=4 13049 B13R2.3018 OC1(c2cc(F)ccn2)CNC1 Amb33325537 [0,1,0,1,0,0|2,0,0]=4 13050 B13R2.3018 OC1(c2cccc(Br)c2)CCC1 Amb27868664 [0,1,0,1,0,0|2,0,0]=4 13051 B13R2.3018 OC1(c2cccc(Br)c2)CNC1 Amb24493059 [0,1,0,1,0,0|1,0,0]=3 13052 B13R2.3018 OC1(c2cccc(Br)c2)COC1 Amb22386873 [0,1,0,1,0,0|2,0,0]=4 13053 B13R2.3018 OC1(c2cccc(Br)c2)CSC1 Amb30021773 [0,1,0,1,0,0|2,0,0]=4 13054 B13R2.3018 OC1(c2cccc(Br)n2)CNC1 Amb33433166 [0,1,0,1,0,0|2,0,0]=4 13055 B13R2.3018 OC1(c2cccc(Cl)c2)CCC1 Amb27393758 [0,1,0,1,0,0|2,0,0]=4 13056 B13R2.3018 OC1(c2cccc(Cl)c2)CNC1 Amb24455953 [0,1,0,1,0,0|1,0,0]=3 13057 B13R2.3018 OC1(c2cccc(Cl)c2)COC1 Amb29871343 [0,1,0,1,0,0|2,0,0]=4 13058 B13R2.3018 OC1(c2cccc(Cl)c2)CSC1 Amb27468787 [0,1,0,1,0,0|2,0,0]=4 13059 B13R2.3018 OC1(c2cccc(Cl)n2)CNC1 Amb33222643 [0,1,0,1,0,0|2,0,0]=4 13060 B13R2.3018 OC1(c2cccc(F)c2)CCC1 Amb27393293 [0,1,0,1,0,0|2,0,0]=4 13061 B13R2.3018 OC1(c2cccc(F)c2)CNC1 Amb26635984 [0,1,0,1,0,0|1,0,0]=3 13062 B13R2.3018 OC1(c2cccc(F)c2)CNC1 Amb35747278 [0,1,0,1,0,0|1,0,0]=3 13063 B13R2.3018 OC1(c2cccc(F)c2)COC1 Amb35658911 [0,1,0,1,0,0|2,0,0]=4 13064 B13R2.3018 OC1(c2cncc(Br)c2)CNC1 Amb23455506 [0,1,0,1,0,0|2,0,0]=4 13065 B13R2.3018 OC1(c2cncc(F)c2)CNC1 Amb24684257 [0,1,0,1,0,0|2,0,0]=4 13066 B13R2.3018 Oc1cccc(C2(O)CCC2)c1 Amb32414076 [0,1,0,1,0,0|2,0,0]=4 13067 B13R2.3018 Oc1cccc(C2(O)CNC2)c1 Amb33311154 [0,1,0,1,0,0|1,0,0]=3 13068 B13R2.3018 Oc1cccc(C2(O)COC2)c1 Amb22386870 [0,1,0,1,0,0|2,0,0]=4 13069 B13R2.3019 CC1(c2cccc(Cl)c2)CC1N Amb18947390 [0,1,0,1,0,0|2,0,0]=4 13070 B13R2.3019 CC1(c2cccc(F)c2)CC1N Amb18947393 [0,1,0,1,0,0|2,0,0]=4 13071 B13R2.3019 CC1(c2cccc(F)c2)CC1N Amb33550662 [0,1,0,1,0,0|2,0,0]=4 13072 B13R2.3019 CC1CC1(O)c2cccc(F)c2 Amb27470678 [0,1,0,1,0,0|2,0,0]=4 13073 B13R2.4529 CCNC1Cc2ccc(F)cc21 Amb32721672 [0,1,0,1,0,0|2,0,0]=4 13074 B13R2.4857 CC1CC(=O)c2cccc(Br)c21 Amb9748160 [0,1,0,1,0,0|2,0,0]=4 13075 B13R2.4857 CC1CC(Cl)c2cccc(F)c21 Amb27801640 [0,1,0,1,0,0|2,0,0]=4 13076 B13R2.4857 CC1CC(Cl)c2cccc(N)c21 Amb27791847 [0,1,0,1,0,0|2,0,0]=4 13077 B13R2.4857 CC1CC(N)c2cccc(Br)c21 Amb6705570 [0,1,0,1,0,0|2,0,0]=4 13078 B13R2.4857 CN1CC(=O)c2cccc(Br)c21 Amb18160222 [0,1,0,1,0,0|1,0,1]=4 13079 B13R2.4857 CN1CC(=O)c2cccc(N)c21 Amb18829719 [0,1,0,1,0,0|1,0,1]=4 13080 B13R2.4857 CN1CC(N)c2cccc(Br)c21 Amb26898560 [0,1,0,1,0,0|1,0,0]=3 13081 B13R2.4857 CN1CC(N)c2cccc(Cl)c21 Amb27149193 [0,1,0,1,0,0|1,0,0]=3 13082 B13R2.4857 CN1CC(N)c2cccc(F)c21 Amb25864468 [0,1,0,1,0,0|1,0,0]=3 13083 B13R2.4857 Cc1cccc2c1C(C)CC2=O Amb6705556 [0,1,0,1,0,0|2,0,0]=4 13084 B13R2.4857 Cc1cccc2c1C(C)CC2Cl Amb25680950 [0,1,0,1,0,0|2,0,0]=4 13085 B13R2.4857 Cc1cccc2c1C(C)CC2N Amb6705567 [0,1,0,1,0,0|2,0,0]=4 13086 B13R2.4857 Cc1cccc2c1C(C)CC2O Amb22059331 [0,1,0,1,0,0|2,0,0]=4 13087 B13R2.4857 Cc1cccc2c1N(C)CC2N Amb25762848 [0,1,0,1,0,0|1,0,0]=3 13088 B13R2.4857 Cc1cn(C)c2c(Br)cccc12 Amb18896740 [0,1,0,1,0,0|0,0,2]=4 13089 B13R2.4857 Cc1cn(C)c2c(C)cccc12 Amb18893428 [0,1,0,1,0,0|0,0,2]=4 13090 B13R2.4857 Cc1cn(C)c2c(Cl)cccc12 Amb18893639 [0,1,0,1,0,0|0,0,2]=4 13091 B13R2.4857 Cc1cn(C)c2c(F)cccc12 Amb18893476 [0,1,0,1,0,0|0,0,2]=4 13092 B13R2.4857 Cc1cn(C)c2cccc(O)c12 Amb27642728 [0,1,0,1,0,0|0,0,2]=4 13093 B13R2.4857 Cc1nn(C)c2c(Br)cccc12 Amb10070875 [0,1,0,1,0,0|1,0,1]=4 13094 B13R2.4857 Cc1nn(C)c2cccc(Br)c12 Amb10070865 [0,1,0,1,0,0|1,0,1]=4 13095 B13R2.5324 CC(c1cccc(O)c1)C2CC2 Amb27970156 [0,1,0,1,0,0|1,0,0]=3 13096 B13R2.5324 CN(c1cccc(F)c1)C2CC2 Amb27442449 [0,1,0,1,0,0|2,0,0]=4 13097 B13R2.5324 CN(c1cccc(O)c1)C2CC2 Amb27442468 [0,1,0,1,0,0|2,0,0]=4 13098 B13R2.5324 Cc1cccc(C(N)C2CC2)c1 Amb3788159 [0,1,0,1,0,0|2,0,0]=4 13099 B13R2.5324 Cc1cccc(C(O)C2CC2)c1 Amb17232417 [0,1,0,1,0,0|2,0,0]=4 13100 B13R2.5324 NC(c1cccc(Cl)c1)C2CC2 Amb3788339 [0,1,0,1,0,0|2,0,0]=4 13101 B13R2.5324 NC(c1cccc(F)c1)C2CC2 Amb3788176 [0,1,0,1,0,0|2,0,0]=4 13102 B13R2.5324 NC(c1cccc(S)c1)C2CC2 Amb27593236 [0,1,0,1,0,0|2,0,0]=4 13103 B13R2.5324 N[C@@H](c1cccc(Cl)c1)C2CC2 Amb28365547 [0,1,0,1,0,0|2,0,0]=4 13104 B13R2.5324 N[C@H](c1cccc(Cl)c1)C2CC2 Amb27655541 [0,1,0,1,0,0|2,0,0]=4 13105 B13R2.5324 Nc1cccc(C(F)C2CC2)c1 Amb28256762 [0,1,0,1,0,0|2,0,0]=4 13106 B13R2.5324 OC(c1cccc(Br)c1)C2CC2 Amb24719965 [0,1,0,1,0,0|2,0,0]=4 13107 B13R2.5324 OC(c1cccc(Cl)c1)C2CC2 Amb17233966 [0,1,0,1,0,0|2,0,0]=4 13108 B13R2.5324 OC(c1cccc(F)c1)C2CC2 Amb17232582 [0,1,0,1,0,0|2,0,0]=4 13109 B13R2.5324 O[C@@H](c1cccc(Cl)c1)[C@H]2CO2 Amb27422239 [0,1,0,1,0,0|2,0,0]=4 13110 B13R2.5324 Oc1cccc([C@@H](O)C2CC2)c1 Amb27169267 [0,1,0,1,0,0|2,0,0]=4 13111 B13R2.52 BrCC1CC(c2ccccc2)C1 Amb35733987 [0,1,0,1,0,0|1,0,0]=3 13112 B13R2.52 CNC1CC(c2ccccc2)C1 Amb9496748 [0,1,0,1,0,0|0,0,0]=2 13113 B13R2.52 CNC1CC(c2cccnc2)C1 Amb25064394 [0,1,0,1,0,0|1,0,0]=3 13114 B13R2.52 CNC1CC(c2ccncc2)C1 Amb26319491 [0,1,0,1,0,0|1,0,0]=3 13115 B13R2.52 CN[C@H]1C[C@H](c2ccccc2)C1 Amb33483398 [0,1,0,1,0,0|0,0,0]=2 13116 B13R2.52 ClCC1CC(c2ccccc2)C1 Amb35733986 [0,1,0,1,0,0|1,0,0]=3 13117 B13R2.52 N#CC1CC(c2ccccc2)C1 Amb35702966 [0,1,0,1,0,0|1,0,1]=4 13118 B13R2.52 NCC1CC(c2ccccc2)C1 Amb24537646 [0,1,0,1,0,0|1,0,0]=3 13119 B13R2.52 NCC1CC(c2ccccc2)C1 Amb33537402 [0,1,0,1,0,0|1,0,0]=3 13120 B13R2.52 NCC1CC(c2ccccn2)C1 Amb25871678 [0,1,0,1,0,0|2,0,0]=4 13121 B13R2.52 NCC1CC(c2cccnc2)C1 Amb24644040 [0,1,0,1,0,0|2,0,0]=4 13122 B13R2.52 NCC1CC(c2ccncc2)C1 Amb27622091 [0,1,0,1,0,0|2,0,0]=4 13123 B13R2.52 NC[C@H]1C[C@@H](c2ccccc2)C1 Amb32668028 [0,1,0,1,0,0|1,0,0]=3 13124 B13R2.52 NNC1CC(c2ccccc2)C1 Amb35671744 [0,1,0,1,0,0|1,0,0]=3 13125 B13R2.52 O=CC1CC(c2ccccc2)C1 Amb25725908 [0,1,0,1,0,0|1,0,1]=4 13126 B13R2.52 OCC1CC(c2ccccc2)O1 Amb27653106 [0,1,0,1,0,0|2,0,0]=4 13127 B13R2.52 OC[C@H]1C[C@H](c2ccccc2)C1 Amb27978533 [0,1,0,1,0,0|1,0,0]=3 13128 B13R2.52 ON=C1CC(c2ccccc2)C1 Amb25719470 [0,1,0,1,0,0|1,0,1]=4 13129 B13R2.223 BrC1(c2ccccc2)C=CCC1 Amb21856767 [0,1,0,1,0,0|1,0,1]=4 13130 B13R2.223 BrC1(c2ccccc2)CC=CC1 Amb21856760 [0,1,0,1,0,0|1,0,1]=4 13131 B13R2.223 CC1(c2ccccc2)CCCN1 Amb18829881 [0,1,0,1,0,0|1,0,0]=3 13132 B13R2.223 CC1(c2ccccc2)CCNC1 Amb18280004 [0,1,0,1,0,0|0,0,0]=2 13133 B13R2.223 CC1(c2ccccc2)CNCO1 Amb27793552 [0,1,0,1,0,0|0,0,0]=2 13134 B13R2.223 CC1(c2ccccc2)OCCO1 Amb9787463 [0,1,0,1,0,0|2,0,0]=4 13135 B13R2.223 CC1(c2ccccn2)CCNC1 Amb18947274 [0,1,0,1,0,0|1,0,0]=3 13136 B13R2.223 CC1(c2cccnc2)CCNC1 Amb18947277 [0,1,0,1,0,0|1,0,0]=3 13137 B13R2.223 CC1(c2cccnc2)CCNC1 Amb35746480 [0,1,0,1,0,0|1,0,0]=3 13138 B13R2.223 FC1(c2ccccc2)CCNC1 Amb24359513 [0,1,0,1,0,0|0,0,0]=2 13139 B13R2.223 FC1(c2ccccc2)CCNC1 Amb28600260 [0,1,0,1,0,0|0,0,0]=2 13140 B13R2.223 FC1(c2cnccn2)CCNC1 Amb27489391 [0,1,0,1,0,0|2,0,0]=4 13141 B13R2.223 FC1(c2cncnc2)CCNC1 Amb27880860 [0,1,0,1,0,0|2,0,0]=4 13142 B13R2.223 NC1(c2ccccc2)CCCC1 Amb33534496 [0,1,0,1,0,0|1,0,0]=3 13143 B13R2.223 NC1(c2ccccc2)CCCC1 Amb5753217 [0,1,0,1,0,0|1,0,0]=3 13144 B13R2.223 NC1(c2ccccc2)CCNC1 Amb24381975 [0,1,0,1,0,0|0,0,0]=2 13145 B13R2.223 NC1(c2ccccc2)CCNC1 Amb30584990 [0,1,0,1,0,0|0,0,0]=2 13146 B13R2.223 NC1(c2ccccc2)CCOC1 Amb24120651 [0,1,0,1,0,0|1,0,0]=3 13147 B13R2.223 NC1(c2ccccc2)CCOC1 Amb33483802 [0,1,0,1,0,0|1,0,0]=3 13148 B13R2.223 NC1(c2ccccn2)CCCC1 Amb17106973 [0,1,0,1,0,0|2,0,0]=4 13149 B13R2.223 NC1(c2ccccn2)CCOC1 Amb28410914 [0,1,0,1,0,0|2,0,0]=4 13150 B13R2.223 NC1(c2cccnc2)CCCC1 Amb18944274 [0,1,0,1,0,0|2,0,0]=4 13151 B13R2.223 NC1(c2cccnc2)CCOC1 Amb27629814 [0,1,0,1,0,0|2,0,0]=4 13152 B13R2.223 NC1(c2ccncc2)CCCC1 Amb18829612 [0,1,0,1,0,0|2,0,0]=4 13153 B13R2.223 O=P1(c2ccccc2)CCCC1 Amb25833532 [0,1,0,1,0,0|2,0,0]=4 13154 B13R2.223 OC1(c2ccccc2)CCCC1 Amb4010012 [0,1,0,1,0,0|1,0,0]=3 13155 B13R2.223 OC1(c2ccccc2)CCCO1 Amb22752498 [0,1,0,1,0,0|2,0,0]=4 13156 B13R2.223 OC1(c2ccccc2)CCNC1 Amb10821679 [0,1,0,1,0,0|0,0,0]=2 13157 B13R2.223 OC1(c2ccccc2)CCNC1 Amb1775519 [0,1,0,1,0,0|0,0,0]=2 13158 B13R2.223 OC1(c2ccccc2)CCNC1 Amb29837920 [0,1,0,1,0,0|0,0,0]=2 13159 B13R2.223 OC1(c2ccccc2)CCOC1 Amb26079256 [0,1,0,1,0,0|1,0,0]=3 13160 B13R2.223 OC1(c2ccccc2)CCSC1 Amb26428841 [0,1,0,1,0,0|1,0,0]=3 13161 B13R2.223 OC1(c2ccccn2)CCCC1 Amb27813167 [0,1,0,1,0,0|2,0,0]=4 13162 B13R2.223 OC1(c2cccnc2)CCCC1 Amb18792484 [0,1,0,1,0,0|2,0,0]=4 13163 B13R2.223 OC1(c2cccnc2)CCNC1 Amb24063163 [0,1,0,1,0,0|1,0,0]=3 13164 B13R2.223 OC1(c2cccnc2)CCNC1 Amb33733609 [0,1,0,1,0,0|1,0,0]=3 13165 B13R2.223 OC1(c2cncnc2)CCNC1 Amb24387076 [0,1,0,1,0,0|2,0,0]=4 13166 B13R2.223 S=P1(c2ccccc2)CCCC1 Amb28244387 [0,1,0,1,0,0|2,0,0]=4 13167 B13R2.223 SC1(c2ccccc2)CCCC1 Amb32952802 [0,1,0,1,0,0|1,0,0]=3 13168 B13R2.371 BrC1CCC(Br)c2ccccc21 Amb26907462 [0,1,0,1,0,0|2,0,0]=4 13169 B13R2.371 Br[C@H]1CC[C@H](Br)c2ccccc21 Amb27654282 [0,1,0,1,0,0|2,0,0]=4 13170 B13R2.371 C=C1CCC(C)c2ccccc21 Amb27254513 [0,1,0,1,0,0|1,0,1]=4 13171 B13R2.371 CC1=CCC(C)c2ccccc21 Amb27800693 [0,1,0,1,0,0|1,0,0]=3 13172 B13R2.371 CC1=NCC(C)c2ccccc21 Amb8384389 [0,1,0,1,0,0|0,0,1]=3 13173 B13R2.371 CC1=NCC(C)c2ccncc21 Amb25060121 [0,1,0,1,0,0|1,0,1]=4 13174 B13R2.371 CC1CCC(=O)c2ccccc21 Amb2721256 [0,1,0,1,0,0|1,0,1]=4 13175 B13R2.371 CC1CCC(C)c2ccccc21 Amb22734862 [0,1,0,1,0,0|1,0,0]=3 13176 B13R2.371 CC1CCC(N)c2ccccc21 Amb22059731 [0,1,0,1,0,0|1,0,0]=3 13177 B13R2.371 CC1CCC(O)c2ccccc21 Amb25730348 [0,1,0,1,0,0|1,0,0]=3 13178 B13R2.371 CC1CCC(S)c2ccccc21 Amb27656941 [0,1,0,1,0,0|1,0,0]=3 13179 B13R2.371 CC1CCN(C)c2ccccc21 Amb10559890 [0,1,0,1,0,0|0,0,0]=2 13180 B13R2.371 CC1CC[C@@H](N)c2ccccc21 Amb25806821 [0,1,0,1,0,0|1,0,0]=3 13181 B13R2.371 CC1CC[C@@H](O)c2ccccc21 Amb27748629 [0,1,0,1,0,0|1,0,0]=3 13182 B13R2.371 CC1CNC(=O)c2ccccc21 Amb17400088 [0,1,0,1,0,0|0,0,1]=3 13183 B13R2.371 CC1CNC(C)c2ccccc21 Amb28322848 [0,1,0,1,0,0|0,0,0]=2 13184 B13R2.371 CC1COB(O)c2ccccc21 Amb27435966 [0,1,0,1,0,0|2,0,0]=4 13185 B13R2.371 CC1SCC(=O)c2ccccc21 Amb28285936 [0,1,0,1,0,0|2,0,0]=4 13186 B13R2.371 CC1SC[C@@H](N)c2ccccc21 Amb28424285 [0,1,0,1,0,0|2,0,0]=4 13187 B13R2.371 CC1SC[C@@H](O)c2ccccc21 Amb27170373 [0,1,0,1,0,0|2,0,0]=4 13188 B13R2.371 CC1SC[C@H](N)c2ccccc21 Amb27817456 [0,1,0,1,0,0|2,0,0]=4 13189 B13R2.371 CN1C=CC(O)c2ccccc21 Amb25324366 [0,1,0,1,0,0|1,0,1]=4 13190 B13R2.371 CN1CCC(=O)c2ccccc21 Amb18560299 [0,1,0,1,0,0|1,0,1]=4 13191 B13R2.371 CN1CCC(N)c2ccccc21 Amb18560283 [0,1,0,1,0,0|1,0,0]=3 13192 B13R2.371 CN1CCC(N)c2cccnc21 Amb18829159 [0,1,0,1,0,0|2,0,0]=4 13193 B13R2.371 CN1CC[C@@H](O)c2ccccc21 Amb28126988 [0,1,0,1,0,0|1,0,0]=3 13194 B13R2.371 CN1CNC(=O)c2ccccc21 Amb27754082 [0,1,0,1,0,0|1,0,1]=4 13195 B13R2.371 CN1NCC(=O)c2ccccc21 Amb27177499 [0,1,0,1,0,0|1,0,1]=4 13196 B13R2.371 C[C@@H]1CCC(=O)c2ccccc21 Amb27974633 [0,1,0,1,0,0|1,0,1]=4 13197 B13R2.371 C[C@@H]1SCC(=O)c2ccccc21 Amb28202184 [0,1,0,1,0,0|2,0,0]=4 13198 B13R2.371 NC1CCC(O)c2ccccc21 Amb26457631 [0,1,0,1,0,0|2,0,0]=4 13199 B13R2.371 N[C@@H]1CC[C@@H](O)c2ccccc21 Amb27858271 [0,1,0,1,0,0|2,0,0]=4 13200 B13R2.371 N[C@@H]1CC[C@H](O)c2ccccc21 Amb26581277 [0,1,0,1,0,0|2,0,0]=4 13201 B13R2.371 N[C@H]1CC[C@@H](O)c2ccccc21 Amb26459764 [0,1,0,1,0,0|2,0,0]=4 13202 B13R2.371 O=C1NCC(Br)c2ccccc21 Amb32658887 [0,1,0,1,0,0|1,0,1]=4 13203 B13R2.371 O=C1NCC(Cl)c2ccccc21 Amb25992409 [0,1,0,1,0,0|1,0,1]=4 13204 B13R2.371 O=C1NCC(O)c2ccccc21 Amb17615447 [0,1,0,1,0,0|1,0,1]=4 13205 B13R2.371 OC1CCC(O)c2ccccc21 Amb24484191 [0,1,0,1,0,0|2,0,0]=4 13206 B13R2.371 O[C@H]1CC[C@@H](O)c2ccccc21 Amb25802026 [0,1,0,1,0,0|2,0,0]=4 13207 B13R2.371 O[C@H]1CC[C@H](O)c2ccccc21 Amb27443160 [0,1,0,1,0,0|2,0,0]=4 13208 B13R2.382 C=C1CC1C(O)c2ccccc2 Amb22363901 [0,1,0,1,0,0|2,0,0]=4 13209 B13R2.382 C=C1C[C@H]1[C@H](O)c2ccccc2 Amb27260210 [0,1,0,1,0,0|2,0,0]=4 13210 B13R2.382 CC(c1ccccc1)C2CC2N Amb33081606 [0,1,0,1,0,0|1,0,0]=3 13211 B13R2.382 CC(c1ccccc1)[C@@H]2C[C@H]2N Amb33081605 [0,1,0,1,0,0|1,0,0]=3 13212 B13R2.382 CC1=C([C@@H](O)c2ccccc2)C1 Amb28207381 [0,1,0,1,0,0|2,0,0]=4 13213 B13R2.382 CC1=C([C@H](O)c2ccccc2)C1 Amb27615227 [0,1,0,1,0,0|2,0,0]=4 13214 B13R2.382 CC1CC1C(N)c2ccccc2 Amb19515274 [0,1,0,1,0,0|2,0,0]=4 13215 B13R2.382 CC1CC1C(N)c2ccccc2 Amb6255271 [0,1,0,1,0,0|2,0,0]=4 13216 B13R2.382 CC1OC1C(O)c2ccccc2 Amb27416827 [0,1,0,1,0,0|2,0,0]=4 13217 B13R2.382 C[C@H]1O[C@@H]1[C@@H](O)c2ccccc2 Amb27788493 [0,1,0,1,0,0|2,0,0]=4 13218 B13R2.413 CC1(c2ccccc2)CCC1=O Amb22496413 [0,1,0,1,0,0|1,0,1]=4 13219 B13R2.413 CC1(c2ccccc2)CCC1N Amb27784417 [0,1,0,1,0,0|1,0,0]=3 13220 B13R2.413 CC1(c2ccccc2)CNC1=O Amb26007017 [0,1,0,1,0,0|0,0,1]=3 13221 B13R2.413 CC1NCC1(O)c2ccccc2 Amb27178292 [0,1,0,1,0,0|1,0,0]=3 13222 B13R2.413 C[C@H]1NC[C@]1(O)c2ccccc2 Amb27239639 [0,1,0,1,0,0|1,0,0]=3 13223 B13R2.413 C[C@]1(c2ccccc2)CCC1=O Amb27389318 [0,1,0,1,0,0|1,0,1]=4 13224 B13R2.413 N[C@@H]1CC[C@]1(O)c2ccccc2 Amb27206478 [0,1,0,1,0,0|2,0,0]=4 13225 B13R2.413 O=C1NCC1(Cl)c2ccccc2 Amb28316755 [0,1,0,1,0,0|1,0,1]=4 13226 B13R2.633 CC1(c2ccccc2)CC1C=O Amb28351425 [0,1,0,1,0,0|1,0,1]=4 13227 B13R2.633 CC1(c2ccccc2)OC1C#N Amb2780661 [0,1,0,1,0,0|2,0,0]=4 13228 B13R2.633 CC1(c2ccccc2)OC1C=O Amb28130467 [0,1,0,1,0,0|2,0,0]=4 13229 B13R2.633 CC1(c2ccccc2)OC1CN Amb25148602 [0,1,0,1,0,0|2,0,0]=4 13230 B13R2.633 CC1(c2cccnc2)CC1CCl Amb27836343 [0,1,0,1,0,0|2,0,0]=4 13231 B13R2.633 CC1(c2cccnc2)CC1CO Amb27761908 [0,1,0,1,0,0|2,0,0]=4 13232 B13R2.633 CCC1CC1(N)c2ccncc2 Amb27230897 [0,1,0,1,0,0|2,0,0]=4 13233 B13R2.633 C[C@@]1(c2ccccc2)C[C@H]1CO Amb28053363 [0,1,0,1,0,0|1,0,0]=3 13234 B13R2.633 C[C@]1(c2ccccc2)O[C@@H]1CO Amb28344619 [0,1,0,1,0,0|2,0,0]=4 13235 B13R2.633 NC[C@H]1C[C@@]1(F)c2ccccc2 Amb27424056 [0,1,0,1,0,0|2,0,0]=4 13236 B13R2.633 OCC1CC1(F)c2ccccc2 Amb27981984 [0,1,0,1,0,0|2,0,0]=4 13237 B13R2.633 OC[C@H]1C[C@@]1(F)c2ccccc2 Amb27422638 [0,1,0,1,0,0|2,0,0]=4 13238 B13R2.690 CC(CC1CO1)c2ccccc2 Amb18798136 [0,1,0,1,0,0|1,0,0]=3 13239 B13R2.690 CC(NC1CC1)c2ccccc2 Amb1114089 [0,1,0,1,0,0|1,0,0]=3 13240 B13R2.690 CC(NC1CC1)c2ccccc2 Amb28555670 [0,1,0,1,0,0|1,0,0]=3 13241 B13R2.690 CC(NC1CC1)c2ccccn2 Amb9704038 [0,1,0,1,0,0|2,0,0]=4 13242 B13R2.690 CC(NC1CC1)c2cccnc2 Amb9705422 [0,1,0,1,0,0|2,0,0]=4 13243 B13R2.690 CC(NC1CC1)c2ccncc2 Amb1116949 [0,1,0,1,0,0|2,0,0]=4 13244 B13R2.690 CN(CC1CC1)c2ccccc2 Amb17232382 [0,1,0,1,0,0|2,0,0]=4 13245 B13R2.690 CN(CC1CO1)c2ccccc2 Amb1130983 [0,1,0,1,0,0|2,0,0]=4 13246 B13R2.690 CN(C[C@@H]1CO1)c2ccccc2 Amb28193547 [0,1,0,1,0,0|2,0,0]=4 13247 B13R2.690 C[C@H](NC1CC1)c2ccccn2 Amb28399658 [0,1,0,1,0,0|2,0,0]=4 13248 B13R2.690 C[C@H](NC1CC1)c2cccnc2 Amb27244170 [0,1,0,1,0,0|2,0,0]=4 13249 B13R2.690 C[C@H](NC1CC1)c2ccncc2 Amb27974932 [0,1,0,1,0,0|2,0,0]=4 13250 B13R2.690 ClC(CC1CC1)c2ccccc2 Amb18796387 [0,1,0,1,0,0|2,0,0]=4 13251 B13R2.690 NC(CC1CC1)c2ccccc2 Amb18292886 [0,1,0,1,0,0|2,0,0]=4 13252 B13R2.690 N[C@@H](CC1CC1)c2ccccc2 Amb27248814 [0,1,0,1,0,0|2,0,0]=4 13253 B13R2.690 N[C@H](CC1CC1)c2ccccc2 Amb28250868 [0,1,0,1,0,0|2,0,0]=4 13254 B13R2.690 O=C(CN1CC1)c2ccccc2 Amb17400091 [0,1,0,1,0,0|1,0,1]=4 13255 B13R2.690 OC(CC1CC1)c2ccccc2 Amb18792434 [0,1,0,1,0,0|2,0,0]=4 13256 B13R2.690 OC(CC1CO1)c2ccccc2 Amb24758463 [0,1,0,1,0,0|2,0,0]=4 13257 B13R2.690 OC(CN1CC1)c2ccccc2 Amb17400133 [0,1,0,1,0,0|1,0,0]=3 13258 B13R2.690 OC(CN1CC1)c2ccccn2 Amb17400153 [0,1,0,1,0,0|2,0,0]=4 13259 B13R2.690 OC(CN1CC1)c2cccnc2 Amb17400154 [0,1,0,1,0,0|2,0,0]=4 13260 B13R2.690 OC(CN1CC1)c2ccncc2 Amb17400155 [0,1,0,1,0,0|2,0,0]=4 13261 B13R2.1028 CCCCC1Cc2ccccc21 Amb17758498 [0,1,0,1,0,0|1,0,0]=3 13262 B13R2.1028 CCCNC1Cc2ccccc21 Amb27752888 [0,1,0,1,0,0|1,0,0]=3 13263 B13R2.1028 CCNCC1Cc2ccccc21 Amb18289168 [0,1,0,1,0,0|0,0,0]=2 13264 B13R2.1028 O=CNCC1Cc2ccccc21 Amb28045219 [0,1,0,1,0,0|0,0,1]=3 13265 B13R2.1028 OCCOC1Cc2ccccc21 Amb27587566 [0,1,0,1,0,0|2,0,0]=4 13266 B13R2.1028 S=C=NCC1Cc2ccccc21 Amb27263289 [0,1,0,1,0,0|0,0,2]=4 13267 B13R2.5252 BrC1CCCCc2ccccc21 Amb8835407 [0,1,0,1,0,0|2,0,0]=4 13268 B13R2.5252 CC1=CCCCc2ccccc21 Amb27986008 [0,1,0,1,0,0|1,0,1]=4 13269 B13R2.5252 CC1CCCNc2ccccc21 Amb25764580 [0,1,0,1,0,0|1,0,0]=3 13270 B13R2.5252 CC1CNCCc2ccccc21 Amb24728196 [0,1,0,1,0,0|0,0,0]=2 13271 B13R2.5252 CC1NCCCc2ccccc21 Amb25685960 [0,1,0,1,0,0|1,0,0]=3 13272 B13R2.5252 CC1NCCCc2ncccc21 Amb33456263 [0,1,0,1,0,0|2,0,0]=4 13273 B13R2.5252 CC1NCCOc2ccccc21 Amb10609534 [0,1,0,1,0,0|2,0,0]=4 13274 B13R2.5252 CC1NCCOc2ccccc21 Amb5750850 [0,1,0,1,0,0|2,0,0]=4 13275 B13R2.5252 CC1NCCSc2ccccc21 Amb27636169 [0,1,0,1,0,0|2,0,0]=4 13276 B13R2.5252 CN1CCCCc2ccccc21 Amb6359492 [0,1,0,1,0,0|2,0,0]=4 13277 B13R2.5252 CN1CCCNc2ccccc21 Amb17617816 [0,1,0,1,0,0|2,0,0]=4 13278 B13R2.5252 CN1CCCSc2ccccc21 Amb28063535 [0,1,0,1,0,0|2,0,0]=4 13279 B13R2.5252 CN1CCNCc2ccccc21 Amb18047038 [0,1,0,1,0,0|1,0,0]=3 13280 B13R2.5252 CN1CCNCc2cccnc21 Amb22174183 [0,1,0,1,0,0|2,0,0]=4 13281 B13R2.5252 CN1CCNCc2cnccc21 Amb27268642 [0,1,0,1,0,0|2,0,0]=4 13282 B13R2.5252 C[C@@H]1CNCCc2ccccc21 Amb25760828 [0,1,0,1,0,0|0,0,0]=2 13283 B13R2.5252 C[C@H]1CNCCc2ccccc21 Amb27616776 [0,1,0,1,0,0|0,0,0]=2 13284 B13R2.5252 ClC1CCCCc2ccccc21 Amb7766813 [0,1,0,1,0,0|2,0,0]=4 13285 B13R2.5252 ClC1CCCSc2ccccc21 Amb27233569 [0,1,0,1,0,0|2,0,0]=4 13286 B13R2.5252 NC1CCCCc2ccccc21 Amb1113859 [0,1,0,1,0,0|2,0,0]=4 13287 B13R2.5252 NC1CCCNc2ccccc21 Amb22228244 [0,1,0,1,0,0|2,0,0]=4 13288 B13R2.5252 NC1CCCOc2ccccc21 Amb22039480 [0,1,0,1,0,0|2,0,0]=4 13289 B13R2.5252 NC1CCCOc2ccccc21 Amb8843614 [0,1,0,1,0,0|2,0,0]=4 13290 B13R2.5252 NC1CNCCc2ccccc21 Amb25759447 [0,1,0,1,0,0|1,0,0]=3 13291 B13R2.5252 NC1CNCCc2ccccc21 Amb33803137 [0,1,0,1,0,0|1,0,0]=3 13292 B13R2.5252 N[C@@H]1CCCNc2ccccc21 Amb22232856 [0,1,0,1,0,0|2,0,0]=4 13293 B13R2.5252 N[C@@H]1CCSCc2ccccc21 Amb28187807 [0,1,0,1,0,0|2,0,0]=4 13294 B13R2.5252 N[C@H]1CCCCc2ccccc21 Amb24674187 [0,1,0,1,0,0|2,0,0]=4 13295 B13R2.5252 N[C@H]1CCCNc2ccccc21 Amb25340381 [0,1,0,1,0,0|2,0,0]=4 13296 B13R2.5252 O=C1CCNCc2ccccc21 Amb22499160 [0,1,0,1,0,0|1,0,1]=4 13297 B13R2.5252 O=C1CCNCc2ccccc21 Amb32405167 [0,1,0,1,0,0|1,0,1]=4 13298 B13R2.5252 O=C1CNCCc2ccccc21 Amb27389469 [0,1,0,1,0,0|1,0,1]=4 13299 B13R2.5252 OC1CC=CCc2ccccc21 Amb27456591 [0,1,0,1,0,0|2,0,0]=4 13300 B13R2.5252 OC1CCCCc2ccccc21 Amb9703920 [0,1,0,1,0,0|2,0,0]=4 13301 B13R2.5252 OC1CCCNc2ccccc21 Amb25148561 [0,1,0,1,0,0|2,0,0]=4 13302 B13R2.5252 OC1CCCOc2ccccc21 Amb17578185 [0,1,0,1,0,0|2,0,0]=4 13303 B13R2.5252 OC1CCCSc2ccccc21 Amb2413585 [0,1,0,1,0,0|2,0,0]=4 13304 B13R2.5252 OC1CCNCc2ccccc21 Amb24378329 [0,1,0,1,0,0|1,0,0]=3 13305 B13R2.5252 OC1CNCCc2ccccc21 Amb26936044 [0,1,0,1,0,0|1,0,0]=3 13306 B13R2.5252 O[C@@H]1CCCOc2ccccc21 Amb25093048 [0,1,0,1,0,0|2,0,0]=4 13307 B13R2.5252 O[C@@H]1CCCSc2ccccc21 Amb26859091 [0,1,0,1,0,0|2,0,0]=4 13308 B13R2.5252 O[C@H]1CCCCc2ccccc21 Amb26372428 [0,1,0,1,0,0|2,0,0]=4 13309 B13R2.5252 O[C@H]1CCCNc2ccccc21 Amb27797120 [0,1,0,1,0,0|2,0,0]=4 13310 B13R2.5252 O[C@H]1CCCOc2ccccc21 Amb26841182 [0,1,0,1,0,0|2,0,0]=4 13311 B13R2.5252 O[C@H]1CCCSc2ccccc21 Amb25076028 [0,1,0,1,0,0|2,0,0]=4 13312 B13R2.5252 SC1CCCCc2ccccc21 Amb7784721 [0,1,0,1,0,0|2,0,0]=4 13313 B13R2.5252 SC1CCNCc2ccccc21 Amb32788488 [0,1,0,1,0,0|1,0,0]=3 13314 B13R2.8137 CC(c1ccccc1)C2CCN2 Amb33081596 [0,1,0,1,0,0|0,0,0]=2 13315 B13R2.8137 CC(c1ccccc1)C2CNC2 Amb33081593 [0,1,0,1,0,0|0,0,0]=2 13316 B13R2.8137 CC(c1ccccc1)N2CCC2 Amb27219769 [0,1,0,1,0,0|1,0,0]=3 13317 B13R2.8137 CC(c1ccccn1)N2CCC2 Amb27827069 [0,1,0,1,0,0|2,0,0]=4 13318 B13R2.8137 CC(c1ccncc1)N2CCC2 Amb27756158 [0,1,0,1,0,0|2,0,0]=4 13319 B13R2.8137 CN(c1ccccc1)C2CCC2 Amb27982649 [0,1,0,1,0,0|2,0,0]=4 13320 B13R2.8137 CN(c1ccccc1)C2COC2 Amb27396745 [0,1,0,1,0,0|2,0,0]=4 13321 B13R2.8137 CN(c1ccncc1)C2CNC2 Amb27757679 [0,1,0,1,0,0|2,0,0]=4 13322 B13R2.8137 ClC(c1ccccc1)C2CCC2 Amb18181272 [0,1,0,1,0,0|2,0,0]=4 13323 B13R2.8137 NC(c1ccccc1)C2CCC2 Amb23438851 [0,1,0,1,0,0|2,0,0]=4 13324 B13R2.8137 NC(c1ccccc1)C2CCC2 Amb9717768 [0,1,0,1,0,0|2,0,0]=4 13325 B13R2.8137 NC(c1ccccc1)C2CSC2 Amb29852410 [0,1,0,1,0,0|2,0,0]=4 13326 B13R2.8137 N[C@@H](c1ccccc1)C2CCC2 Amb33871462 [0,1,0,1,0,0|2,0,0]=4 13327 B13R2.8137 N[C@H](c1ccccc1)C2CCC2 Amb23438857 [0,1,0,1,0,0|2,0,0]=4 13328 B13R2.8137 N[C@H](c1ccccc1)C2CCC2 Amb28364913 [0,1,0,1,0,0|2,0,0]=4 13329 B13R2.8137 O=C(c1ccccc1)C2CCN2 Amb27427543 [0,1,0,1,0,0|1,0,1]=4 13330 B13R2.8137 O=C(c1ccccc1)C2CNC2 Amb26605769 [0,1,0,1,0,0|1,0,1]=4 13331 B13R2.8137 OC(c1ccccc1)C2CCC2 Amb17194467 [0,1,0,1,0,0|2,0,0]=4 13332 B13R2.8137 OC(c1ccccc1)C2CSC2 Amb29852042 [0,1,0,1,0,0|2,0,0]=4 13333 B13R2.8137 OC(c1ccccn1)C2CNC2 Amb23598814 [0,1,0,1,0,0|2,0,0]=4 13334 B13R2.8137 OC(c1ccccn1)C2CNC2 Amb32662075 [0,1,0,1,0,0|2,0,0]=4 13335 B13R2.8137 OC(c1cccnc1)C2CNC2 Amb23598813 [0,1,0,1,0,0|2,0,0]=4 13336 B13R2.8137 OC(c1cccnc1)C2CNC2 Amb32662074 [0,1,0,1,0,0|2,0,0]=4 13337 B13R2.8137 OC(c1ccncc1)C2CNC2 Amb23598812 [0,1,0,1,0,0|2,0,0]=4 13338 B13R2.8137 OC(c1ccncc1)C2CNC2 Amb32662073 [0,1,0,1,0,0|2,0,0]=4 13339 B13R2.32 BrC1CCc2ccccc2C1Br Amb4020672 [0,1,0,1,0,0|2,0,0]=4 13340 B13R2.32 CC1=C(C)c2ccccc2CN1 Amb27392086 [0,1,0,1,0,0|0,0,2]=4 13341 B13R2.32 CC1C(=O)CCc2ccccc21 Amb4605911 [0,1,0,1,0,0|1,0,1]=4 13342 B13R2.32 CC1CCc2ccccc2C1Br Amb25106373 [0,1,0,1,0,0|2,0,0]=4 13343 B13R2.32 CC1CCc2ccccc2C1N Amb30584820 [0,1,0,1,0,0|2,0,0]=4 13344 B13R2.32 CC1CCc2ccccc2C1N Amb9782750 [0,1,0,1,0,0|2,0,0]=4 13345 B13R2.32 CC1CCc2ccccc2C1O Amb18800659 [0,1,0,1,0,0|2,0,0]=4 13346 B13R2.32 CC1CCc2ccccc2[C@H]1O Amb28194260 [0,1,0,1,0,0|2,0,0]=4 13347 B13R2.32 CC1SCc2ccccc2C1N Amb28046566 [0,1,0,1,0,0|2,0,0]=4 13348 B13R2.32 CC1c2ccccc2CCC1O Amb25861319 [0,1,0,1,0,0|1,0,0]=3 13349 B13R2.32 CC1c2ccccc2CCN1C Amb28434667 [0,1,0,1,0,0|2,0,0]=4 13350 B13R2.32 CN1C(=O)NCc2ccccc21 Amb28243973 [0,1,0,1,0,0|1,0,1]=4 13351 B13R2.32 C[C@@H]1CCc2ccccc2[C@@H]1N Amb27461977 [0,1,0,1,0,0|2,0,0]=4 13352 B13R2.32 C[C@@H]1CCc2ccccc2[C@H]1O Amb28061859 [0,1,0,1,0,0|2,0,0]=4 13353 B13R2.32 ClC1CCc2ccccc2C1Cl Amb27799784 [0,1,0,1,0,0|2,0,0]=4 13354 B13R2.32 Cl[C@@H]1CCc2ccccc2[C@H]1Cl Amb28287713 [0,1,0,1,0,0|2,0,0]=4 13355 B13R2.32 F[C@H]1c2ccccc2CC[C@@H]1Cl Amb28436893 [0,1,0,1,0,0|2,0,0]=4 13356 B13R2.32 NC1C(=O)NCc2ccccc21 Amb21857372 [0,1,0,1,0,0|1,0,1]=4 13357 B13R2.32 NC1C(=O)NCc2ccccc21 Amb22436817 [0,1,0,1,0,0|1,0,1]=4 13358 B13R2.32 NC1CCc2ccccc2C1N Amb18645719 [0,1,0,1,0,0|2,0,0]=4 13359 B13R2.32 NC1CCc2ccccc2C1O Amb21964517 [0,1,0,1,0,0|2,0,0]=4 13360 B13R2.32 NC1CCc2ccccc2C1O Amb2383071 [0,1,0,1,0,0|2,0,0]=4 13361 B13R2.32 NC1c2ccccc2CCC1Br Amb32752747 [0,1,0,1,0,0|2,0,0]=4 13362 B13R2.32 NC1c2ccccc2CCC1Cl Amb32698023 [0,1,0,1,0,0|2,0,0]=4 13363 B13R2.32 NC1c2ccccc2CCC1F Amb25117934 [0,1,0,1,0,0|2,0,0]=4 13364 B13R2.32 NC1c2ccccc2CCC1F Amb29990260 [0,1,0,1,0,0|2,0,0]=4 13365 B13R2.32 NC1c2ccccc2CCC1O Amb18645888 [0,1,0,1,0,0|2,0,0]=4 13366 B13R2.32 NC1c2ccccc2CCC1O Amb22275991 [0,1,0,1,0,0|2,0,0]=4 13367 B13R2.32 N[C@@H]1c2ccccc2CCC1Br Amb32654865 [0,1,0,1,0,0|2,0,0]=4 13368 B13R2.32 N[C@@H]1c2ccccc2CCC1Cl Amb32654866 [0,1,0,1,0,0|2,0,0]=4 13369 B13R2.32 N[C@@H]1c2ccccc2CC[C@@H]1O Amb27985829 [0,1,0,1,0,0|2,0,0]=4 13370 B13R2.32 N[C@@H]1c2ccccc2CC[C@H]1O Amb26397238 [0,1,0,1,0,0|2,0,0]=4 13371 B13R2.32 N[C@H]1c2ccccc2CC[C@H]1N Amb26418947 [0,1,0,1,0,0|2,0,0]=4 13372 B13R2.32 N[C@H]1c2ccccc2CC[C@H]1O Amb22748703 [0,1,0,1,0,0|2,0,0]=4 13373 B13R2.32 N[C@H]1c2ccccc2CC[C@H]1O Amb32752546 [0,1,0,1,0,0|2,0,0]=4 13374 B13R2.32 OC1c2ccccc2CCC1Br Amb4036293 [0,1,0,1,0,0|2,0,0]=4 13375 B13R2.32 OC1c2ccccc2CCC1Cl Amb26456275 [0,1,0,1,0,0|2,0,0]=4 13376 B13R2.32 OC1c2ccccc2CCC1F Amb26866847 [0,1,0,1,0,0|2,0,0]=4 13377 B13R2.32 O[C@@H]1CCc2ccccc2[C@H]1O Amb25250666 [0,1,0,1,0,0|2,0,0]=4 13378 B13R2.32 O[C@@H]1c2ccccc2CCC1Br Amb32654860 [0,1,0,1,0,0|2,0,0]=4 13379 B13R2.32 O[C@@H]1c2ccccc2CCC1Cl Amb32654864 [0,1,0,1,0,0|2,0,0]=4 13380 B13R2.32 O[C@@H]1c2ccccc2CC[C@@H]1Cl Amb8394044 [0,1,0,1,0,0|2,0,0]=4 13381 B13R2.32 O[C@@H]1c2ccccc2CC[C@H]1F Amb28321308 [0,1,0,1,0,0|2,0,0]=4 13382 B13R2.32 O[C@H]1CCc2ccccc2[C@@H]1Cl Amb28422703 [0,1,0,1,0,0|2,0,0]=4 13383 B13R2.32 O[C@H]1CCc2ccccc2[C@H]1O Amb22224796 [0,1,0,1,0,0|2,0,0]=4 13384 B13R2.32 O[C@H]1c2ccccc2CC[C@H]1Cl Amb28422794 [0,1,0,1,0,0|2,0,0]=4 13385 B13R2.32 O[C@H]1c2ccccc2CC[C@H]1O Amb2613184 [0,1,0,1,0,0|2,0,0]=4 13386 B13R2.45 CC1c2ccccc2CC1C#N Amb35722776 [0,1,0,1,0,0|2,0,0]=4 13387 B13R2.45 CC1c2ccccc2CC1CBr Amb29887219 [0,1,0,1,0,0|2,0,0]=4 13388 B13R2.45 CC1c2ccccc2CC1CN Amb35672163 [0,1,0,1,0,0|2,0,0]=4 13389 B13R2.45 CC1c2ccccc2CC1NN Amb29855809 [0,1,0,1,0,0|1,0,0]=3 13390 B13R2.45 CC1c2ccccc2CC1NO Amb29855874 [0,1,0,1,0,0|1,0,0]=3 13391 B13R2.45 CC1c2ccccc2NC1C=O Amb18829943 [0,1,0,1,0,0|2,0,0]=4 13392 B13R2.45 CC1c2ccccc2OC1CN Amb25071717 [0,1,0,1,0,0|2,0,0]=4 13393 B13R2.45 CC1c2ccccc2OC1CN Amb32753301 [0,1,0,1,0,0|2,0,0]=4 13394 B13R2.45 CC1c2ccccc2OC1CO Amb27588983 [0,1,0,1,0,0|2,0,0]=4 13395 B13R2.45 CCC1Cc2ccccc2C1Br Amb27588452 [0,1,0,1,0,0|2,0,0]=4 13396 B13R2.45 CCC1Cc2ccccc2C1Cl Amb18186760 [0,1,0,1,0,0|2,0,0]=4 13397 B13R2.45 CCC1Oc2ccccc2C1N Amb26844209 [0,1,0,1,0,0|2,0,0]=4 13398 B13R2.45 CC[C@@H]1Nc2ccccc2[C@@H]1C Amb27965504 [0,1,0,1,0,0|1,0,0]=3 13399 B13R2.45 CNC1Cc2ccccc2C1C Amb29855873 [0,1,0,1,0,0|0,0,0]=2 13400 B13R2.45 CNC1Cc2ccccc2C1O Amb18645898 [0,1,0,1,0,0|1,0,0]=3 13401 B13R2.45 CN[C@@H]1Cc2ccccc2[C@H]1O Amb24056611 [0,1,0,1,0,0|1,0,0]=3 13402 B13R2.45 CN[C@H]1Cc2ccccc2[C@@H]1O Amb9133996 [0,1,0,1,0,0|1,0,0]=3 13403 B13R2.45 CNc1cc2ccccc2n1C Amb22753877 [0,1,0,1,0,0|1,0,1]=4 13404 B13R2.45 CNc1nc2ccccc2n1C Amb5716539 [0,1,0,1,0,0|1,0,1]=4 13405 B13R2.45 COC1Cc2ccccc2C1Cl Amb27178097 [0,1,0,1,0,0|2,0,0]=4 13406 B13R2.45 COC1Cc2ccccc2C1N Amb1140146 [0,1,0,1,0,0|2,0,0]=4 13407 B13R2.45 COC1Cc2ccccc2C1N Amb32656099 [0,1,0,1,0,0|2,0,0]=4 13408 B13R2.45 COC1Cc2ccccc2C1O Amb18800787 [0,1,0,1,0,0|2,0,0]=4 13409 B13R2.45 CO[C@@H]1Cc2ccccc2[C@@H]1Cl Amb27637752 [0,1,0,1,0,0|2,0,0]=4 13410 B13R2.45 CO[C@@H]1Cc2ccccc2[C@@H]1O Amb27443198 [0,1,0,1,0,0|2,0,0]=4 13411 B13R2.45 CO[C@@H]1Cc2ccccc2[C@H]1N Amb27238773 [0,1,0,1,0,0|2,0,0]=4 13412 B13R2.45 CO[C@H]1Cc2ccccc2[C@@H]1Cl Amb28051829 [0,1,0,1,0,0|2,0,0]=4 13413 B13R2.45 CO[C@H]1Cc2ccccc2[C@H]1N Amb24567956 [0,1,0,1,0,0|2,0,0]=4 13414 B13R2.45 CO[C@H]1Cc2ccccc2[C@H]1N Amb32656192 [0,1,0,1,0,0|2,0,0]=4 13415 B13R2.45 CSC1Cc2ccccc2C1O Amb28127814 [0,1,0,1,0,0|2,0,0]=4 13416 B13R2.45 C[C@@H]1c2ccccc2C[C@H]1CO Amb27653087 [0,1,0,1,0,0|2,0,0]=4 13417 B13R2.45 C[C@@H]1c2ccccc2O[C@@H]1CN Amb27200834 [0,1,0,1,0,0|2,0,0]=4 13418 B13R2.45 C[C@@H]1c2ccccc2O[C@H]1CN Amb34916432 [0,1,0,1,0,0|2,0,0]=4 13419 B13R2.45 C[C@H]1c2ccccc2O[C@H]1CN Amb25139682 [0,1,0,1,0,0|2,0,0]=4 13420 B13R2.45 C[C@H]1c2ccccc2O[C@H]1CN Amb32675155 [0,1,0,1,0,0|2,0,0]=4 13421 B13R2.98 CC1(C=O)CC1c2ccccc2 Amb25674437 [0,1,0,1,0,0|2,0,0]=4 13422 B13R2.98 CC1(CN)CC1c2ccccc2 Amb26439851 [0,1,0,1,0,0|2,0,0]=4 13423 B13R2.98 CC1(CN)CC1c2ccccc2 Amb32666300 [0,1,0,1,0,0|2,0,0]=4 13424 B13R2.98 CC1(CO)CC1c2ccccc2 Amb27763865 [0,1,0,1,0,0|2,0,0]=4 13425 B13R2.98 CC[C@@]1(O)C[C@H]1c2ccccc2 Amb35749203 [0,1,0,1,0,0|1,0,0]=3 13426 B13R2.98 C[C@@]1(C=O)C[C@H]1c2ccccc2 Amb24545890 [0,1,0,1,0,0|2,0,0]=4 13427 B13R2.98 C[C@@]1(CN)C[C@H]1c2ccccc2 Amb24523691 [0,1,0,1,0,0|2,0,0]=4 13428 B13R2.98 C[C@@]1(CN)C[C@H]1c2ccccc2 Amb28641945 [0,1,0,1,0,0|2,0,0]=4 13429 B13R2.98 C[C@@]1(CO)C[C@H]1c2ccccc2 Amb25950357 [0,1,0,1,0,0|2,0,0]=4 13430 B13R2.98 C[C@]1(C=O)C[C@@H]1c2ccccc2 Amb24460888 [0,1,0,1,0,0|2,0,0]=4 13431 B13R2.98 C[C@]1(C=O)C[C@H]1c2ccccc2 Amb24678176 [0,1,0,1,0,0|2,0,0]=4 13432 B13R2.98 N#CC1(N)CC1c2ccccc2 Amb27389345 [0,1,0,1,0,0|2,0,0]=4 13433 B13R2.98 NCC1(O)CC1c2ccccc2 Amb28436403 [0,1,0,1,0,0|2,0,0]=4 13434 B13R2.98 O=CC1(Cl)CC1c2ccccc2 Amb27751379 [0,1,0,1,0,0|2,0,0]=4 13435 B13R2.3085 CC1C(=N)N(C)c2ccccc21 Amb22536459 [0,1,0,1,0,0|0,0,1]=3 13436 B13R2.3085 CC1C(=O)N(C)c2ccccc21 Amb24273383 [0,1,0,1,0,0|0,0,1]=3 13437 B13R2.3085 CC1c2ccccc2C(=O)C1O Amb27770302 [0,1,0,1,0,0|2,0,0]=4 13438 B13R2.3085 CC1c2ccccc2C(C)C1N Amb18645544 [0,1,0,1,0,0|1,0,0]=3 13439 B13R2.3085 CC1c2ccccc2C(N)C1N Amb25950623 [0,1,0,1,0,0|2,0,0]=4 13440 B13R2.3085 CC1c2ccccc2C(O)C1N Amb25892193 [0,1,0,1,0,0|2,0,0]=4 13441 B13R2.3085 CC1c2ccccc2[C@@H](O)C1C Amb27594736 [0,1,0,1,0,0|2,0,0]=4 13442 B13R2.3085 CN1C(=N)C(Cl)c2ccccc21 Amb27816558 [0,1,0,1,0,0|1,0,1]=4 13443 B13R2.3085 CN1C(=O)C(Br)c2ccccc21 Amb22749190 [0,1,0,1,0,0|1,0,1]=4 13444 B13R2.3085 CN1C(=O)C(N)c2ccccc21 Amb22586861 [0,1,0,1,0,0|1,0,1]=4 13445 B13R2.3085 CN1C(=O)C(N)c2ccccc21 Amb535212 [0,1,0,1,0,0|1,0,1]=4 13446 B13R2.3085 CN1C(=O)C(N)c2ccccc21 Amb5633811 [0,1,0,1,0,0|1,0,1]=4 13447 B13R2.3085 CN1C(=O)C(O)c2ccccc21 Amb2613141 [0,1,0,1,0,0|1,0,1]=4 13448 B13R2.3085 CN1C(=O)N(C)c2ccccc21 Amb18004177 [0,1,0,1,0,0|1,0,1]=4 13449 B13R2.3085 CN1C(=O)[C@@H](O)c2ccccc21 Amb27426901 [0,1,0,1,0,0|1,0,1]=4 13450 B13R2.3085 CN1C(=S)N(C)c2ccccc21 Amb20666683 [0,1,0,1,0,0|1,0,1]=4 13451 B13R2.3085 CN1c2ccccc2C(=O)C1O Amb27164622 [0,1,0,1,0,0|1,0,1]=4 13452 B13R2.3085 CN1c2ccccc2N(C)C1Cl Amb28384139 [0,1,0,1,0,0|1,0,0]=3 13453 B13R2.3085 C[C@@H]1C(=O)c2ccccc2[C@H]1C Amb27195793 [0,1,0,1,0,0|2,0,0]=4 13454 B13R2.3085 Cc1c(C)n(C)c2ccccc12 Amb26899733 [0,1,0,1,0,0|0,0,2]=4 13455 B13R2.3085 Cc1c(Cl)n(C)c2ccccc12 Amb23569031 [0,1,0,1,0,0|0,0,2]=4 13456 B13R2.3085 Cc1c(I)n(C)c2ccccc12 Amb21963101 [0,1,0,1,0,0|0,0,2]=4 13457 B13R2.3085 Cc1n(C)c2ccccc2[n+]1C Amb2779891 [0,1,0,1,0,0|1,0,1]=4 13458 B13R2.7350 CCC1(O)c2ccccc2C1C Amb17778669 [0,1,0,1,0,0|1,0,0]=3 13459 B13R2.8138 CC(c1ccccc1)C2(C)CO2 Amb33081887 [0,1,0,1,0,0|1,0,0]=3 13460 B13R2.8138 CC(c1ccccc1)C2(N)CC2 Amb29852224 [0,1,0,1,0,0|1,0,0]=3 13461 B13R2.8138 CC(c1ccccc1)C2(N)CC2 Amb35752608 [0,1,0,1,0,0|1,0,0]=3 13462 B13R2.8138 CC(c1ccccc1)C2(O)CC2 Amb24684522 [0,1,0,1,0,0|1,0,0]=3 13463 B13R2.8138 CC1(C(Cl)c2ccccc2)CC1 Amb27808998 [0,1,0,1,0,0|2,0,0]=4 13464 B13R2.8138 CC1(C(N)c2ccccc2)CC1 Amb18563532 [0,1,0,1,0,0|2,0,0]=4 13465 B13R2.8138 CC1(C(O)c2ccccc2)CO1 Amb27260258 [0,1,0,1,0,0|2,0,0]=4 13466 B13R2.8138 C[C@]1([C@@H](O)c2ccccc2)CO1 Amb27457922 [0,1,0,1,0,0|2,0,0]=4 13467 B13R2.8138 NC(c1ccccc1)C2(O)CC2 Amb22236255 [0,1,0,1,0,0|2,0,0]=4 13468 B13R2.8138 NC1(C(O)c2ccccc2)CC1 Amb24095286 [0,1,0,1,0,0|2,0,0]=4 13469 B13R2.8138 N[C@@H](c1ccccc1)C2(O)CC2 Amb22225452 [0,1,0,1,0,0|2,0,0]=4 13470 B13R2.15272 C#CC(N)C1Cc2ccccc21 Amb27952231 [0,1,0,1,0,0|1,0,1]=4 13471 B13R2.15272 C#C[C@@H](O)C1Cc2ccccc21 Amb27255548 [0,1,0,1,0,0|1,0,1]=4 13472 B13R2.15272 C#C[C@H](O)C1Cc2ccccc21 Amb28124063 [0,1,0,1,0,0|1,0,1]=4 13473 B13R2.15272 CCC(=O)C1Cc2ccccc21 Amb28250023 [0,1,0,1,0,0|1,0,1]=4 13474 B13R2.15272 CC[C@@H](O)C1Cc2ccccc21 Amb27177476 [0,1,0,1,0,0|1,0,0]=3 13475 B13R2.15272 CNC(=O)C1Cc2ccccc21 Amb27166885 [0,1,0,1,0,0|0,0,1]=3 13476 B13R2.15272 CNC(C)C1Cc2ccccc21 Amb26590734 [0,1,0,1,0,0|0,0,0]=2 13477 B13R2.15272 COC(=O)C1Cc2ccccc21 Amb27616823 [0,1,0,1,0,0|1,0,1]=4 13478 B13R2.238 CC1(c2ccccc2)CC(=O)C1 Amb19373258 [0,1,0,1,0,0|1,0,0]=3 13479 B13R2.238 CC1(c2ccccc2)CC(N)C1 Amb19373291 [0,1,0,1,0,0|1,0,0]=3 13480 B13R2.238 CC1(c2ccccc2)CC(N)C1 Amb27770642 [0,1,0,1,0,0|1,0,0]=3 13481 B13R2.238 CN1CC(F)(c2ccccc2)C1 Amb27178912 [0,1,0,1,0,0|0,0,0]=2 13482 B13R2.238 CN1CC(O)(c2ccncn2)C1 Amb28367789 [0,1,0,1,0,0|2,0,0]=4 13483 B13R2.238 NC1(c2ccccc2)CC(F)C1 Amb23449157 [0,1,0,1,0,0|2,0,0]=4 13484 B13R2.238 NC1(c2ccccc2)CC(F)C1 Amb32679375 [0,1,0,1,0,0|2,0,0]=4 13485 B13R2.238 NC1(c2ccccc2)CC(O)C1 Amb23536867 [0,1,0,1,0,0|2,0,0]=4 13486 B13R2.238 NC1(c2ccccc2)CC(O)C1 Amb32679374 [0,1,0,1,0,0|2,0,0]=4 13487 B13R2.238 NC1CC(N)(c2ccccc2)C1 Amb25103797 [0,1,0,1,0,0|2,0,0]=4 13488 B13R2.238 NC1CC(O)(c2ccccc2)C1 Amb25829244 [0,1,0,1,0,0|2,0,0]=4 13489 B13R2.238 NC1CC(O)(c2ccccc2)C1 Amb30594235 [0,1,0,1,0,0|2,0,0]=4 13490 B13R2.238 N[C@]1(c2ccccc2)C[C@@H](F)C1 Amb26867400 [0,1,0,1,0,0|2,0,0]=4 13491 B13R2.238 N[C@]1(c2ccccc2)C[C@@H](F)C1 Amb32679595 [0,1,0,1,0,0|2,0,0]=4 13492 B13R2.238 N[C@]1(c2ccccc2)C[C@H](F)C1 Amb27403616 [0,1,0,1,0,0|2,0,0]=4 13493 B13R2.238 N[C@]1(c2ccccc2)C[C@H](O)C1 Amb32659915 [0,1,0,1,0,0|2,0,0]=4 13494 B13R2.238 N[C@]1(c2ccccc2)C[C@H](O)C1 Amb32679610 [0,1,0,1,0,0|2,0,0]=4 13495 B13R2.3063 CC(C)(c1ccccc1)C2CC2 Amb4016920 [0,1,0,1,0,0|1,0,0]=3 13496 B13R2.3063 CC(C)(c1ccccc1)C2CO2 Amb27178341 [0,1,0,1,0,0|1,0,0]=3 13497 B13R2.3063 CC(C)(c1ccccc1)[C@@H]2CO2 Amb33176157 [0,1,0,1,0,0|1,0,0]=3 13498 B13R2.3063 CC(C)(c1ccccc1)[C@H]2CO2 Amb33176155 [0,1,0,1,0,0|1,0,0]=3 13499 B13R2.3063 CC(N)(c1ccccn1)C2CC2 Amb28196142 [0,1,0,1,0,0|2,0,0]=4 13500 B13R2.3063 CC(N)(c1cccnc1)C2CC2 Amb18950472 [0,1,0,1,0,0|2,0,0]=4 13501 B13R2.3063 CC(O)(c1ccccc1)C2CC2 Amb4035891 [0,1,0,1,0,0|1,0,0]=3 13502 B13R2.3063 CC(O)(c1ccccn1)C2CC2 Amb23454955 [0,1,0,1,0,0|2,0,0]=4 13503 B13R2.3063 CC(O)(c1cccnc1)C2CC2 Amb23454967 [0,1,0,1,0,0|2,0,0]=4 13504 B13R2.3063 FC(F)(c1ccccc1)C2CC2 Amb20670158 [0,1,0,1,0,0|2,0,0]=4 13505 B13R2.3063 FC(F)(c1ccccc1)C2CO2 Amb33081995 [0,1,0,1,0,0|2,0,0]=4 13506 B13R2.3063 FC(F)(c1ccccc1)[C@@H]2CO2 Amb33082578 [0,1,0,1,0,0|2,0,0]=4 13507 B13R2.3063 FC(F)(c1ccccc1)[C@H]2CO2 Amb33082577 [0,1,0,1,0,0|2,0,0]=4 13508 B13R2.3122 CC1(C)CC=Cc2ccccc21 Amb28388208 [0,1,0,1,0,0|1,0,1]=4 13509 B13R2.3122 CC1(C)CCCc2ccccc21 Amb25328610 [0,1,0,1,0,0|1,0,0]=3 13510 B13R2.3122 CC1(C)CCNc2ccccc21 Amb18061657 [0,1,0,1,0,0|2,0,0]=4 13511 B13R2.3122 CC1(C)CCNc2ccccc21 Amb33716373 [0,1,0,1,0,0|2,0,0]=4 13512 B13R2.3122 CC1(C)CCOc2ccccc21 Amb26980821 [0,1,0,1,0,0|2,0,0]=4 13513 B13R2.3122 CC1(C)CCSc2ccccc21 Amb8394724 [0,1,0,1,0,0|2,0,0]=4 13514 B13R2.3122 CC1(C)CN=Cc2ccccc21 Amb27179863 [0,1,0,1,0,0|0,0,2]=4 13515 B13R2.3122 CC1(C)CNCc2ccccc21 Amb17106475 [0,1,0,1,0,0|0,0,0]=2 13516 B13R2.3122 CC1(C)CNCc2ccccc21 Amb22498746 [0,1,0,1,0,0|0,0,0]=2 13517 B13R2.3122 CC1(C)NCCc2ccccc21 Amb18645550 [0,1,0,1,0,0|2,0,0]=4 13518 B13R2.3122 CC1(C)NCCc2ccccc21 Amb30584909 [0,1,0,1,0,0|2,0,0]=4 13519 B13R2.3122 CC1(F)CCNc2ccccc21 Amb27199819 [0,1,0,1,0,0|2,0,0]=4 13520 B13R2.3122 CC1(N)CCCc2ccccc21 Amb13952456 [0,1,0,1,0,0|1,0,0]=3 13521 B13R2.3122 CC1(N)CCCc2ccccc21 Amb9676140 [0,1,0,1,0,0|1,0,0]=3 13522 B13R2.3122 CC1(N)CCNc2ccccc21 Amb24644178 [0,1,0,1,0,0|2,0,0]=4 13523 B13R2.3122 CC1(N)CCOc2ccccc21 Amb17519223 [0,1,0,1,0,0|2,0,0]=4 13524 B13R2.3122 CC1(N)CCOc2ccccc21 Amb30584945 [0,1,0,1,0,0|2,0,0]=4 13525 B13R2.3122 CC1(O)CCCc2ccccc21 Amb6332075 [0,1,0,1,0,0|1,0,0]=3 13526 B13R2.3122 CC1(O)CCCc2cccnc21 Amb25736761 [0,1,0,1,0,0|2,0,0]=4 13527 B13R2.3122 CC1(O)CCCc2ncccc21 Amb27974514 [0,1,0,1,0,0|2,0,0]=4 13528 B13R2.3122 CC1(O)CCNc2ccccc21 Amb25723767 [0,1,0,1,0,0|2,0,0]=4 13529 B13R2.3122 CC1(O)CCOc2ccccc21 Amb26517607 [0,1,0,1,0,0|2,0,0]=4 13530 B13R2.3122 CC1(O)CCSc2ccccc21 Amb26454160 [0,1,0,1,0,0|2,0,0]=4 13531 B13R2.3122 C[N+]1(C)CCCc2ccccc21 Amb5717952 [0,1,0,1,0,0|2,0,0]=4 13532 B13R2.3122 FC1(F)CNCc2ccccc21 Amb19372985 [0,1,0,1,0,0|1,0,0]=3 13533 B13R2.3122 FC1(F)CNCc2ccccc21 Amb20668388 [0,1,0,1,0,0|1,0,0]=3 13534 B13R2.3122 FC1(F)CNCc2cccnc21 Amb27624700 [0,1,0,1,0,0|2,0,0]=4 13535 B13R2.3122 NC1(F)CCCc2ccccc21 Amb27946998 [0,1,0,1,0,0|2,0,0]=4 13536 B13R2.12159 CC1(C)CC(=O)c2ccccc21 Amb6739860 [0,1,0,1,0,0|2,0,0]=4 13537 B13R2.12159 CC1(C)CC(N)c2ccccc21 Amb17232394 [0,1,0,1,0,0|2,0,0]=4 13538 B13R2.12159 CC1(C)CC(O)c2ccccc21 Amb22229024 [0,1,0,1,0,0|2,0,0]=4 13539 B13R2.12159 CC1=CC(C)(O)c2ccccc21 Amb17778887 [0,1,0,1,0,0|1,0,1]=4 13540 B13R2.12159 CC1CC(C)(C)c2ccccc21 Amb25198302 [0,1,0,1,0,0|1,0,0]=3 13541 B13R2.12159 CN1CC(C)(C)c2ccccc21 Amb27263689 [0,1,0,1,0,0|0,0,0]=2 13542 B13R2.173 CC1(O)CC(c2ccccc2)C1 Amb35681300 [0,1,0,1,0,0|1,0,0]=3 13543 B13R2.244 CC1c2ccccc2C1C(N)=O Amb27845294 [0,1,0,1,0,0|2,0,0]=4 13544 B13R2.244 C[C@@H]1c2ccccc2[C@@H]1C(=O)O Amb28132389 [0,1,0,1,0,0|2,0,0]=4 13545 B13R2.423 CC(=O)C1CC1c2ccccc2 Amb534893 [0,1,0,1,0,0|1,0,0]=3 13546 B13R2.423 CC(=O)[C@@H]1C[C@@H]1c2ccccc2 Amb27780823 [0,1,0,1,0,0|1,0,0]=3 13547 B13R2.423 CC(=O)[C@@H]1C[C@H]1c2ccccc2 Amb25168893 [0,1,0,1,0,0|1,0,0]=3 13548 B13R2.423 CC(=O)[C@@H]1C[C@H]1c2ccccn2 Amb33457459 [0,1,0,1,0,0|2,0,0]=4 13549 B13R2.423 CC(=O)[C@@H]1O[C@@H]1c2ccccc2 Amb26481631 [0,1,0,1,0,0|2,0,0]=4 13550 B13R2.423 CC(=O)[C@@H]1O[C@H]1c2ccccc2 Amb25174918 [0,1,0,1,0,0|2,0,0]=4 13551 B13R2.423 CC(=O)[C@H]1CC1c2ccccc2 Amb27770300 [0,1,0,1,0,0|1,0,0]=3 13552 B13R2.423 CC(=O)[C@H]1C[C@@H]1c2ccccc2 Amb28054879 [0,1,0,1,0,0|1,0,0]=3 13553 B13R2.423 CC(=O)[C@H]1C[C@H]1c2ccccc2 Amb24540267 [0,1,0,1,0,0|1,0,0]=3 13554 B13R2.423 CC(=O)[C@H]1O[C@@H]1c2ccccc2 Amb24601834 [0,1,0,1,0,0|2,0,0]=4 13555 B13R2.423 CC(=O)[C@H]1O[C@H]1c2ccccc2 Amb27966798 [0,1,0,1,0,0|2,0,0]=4 13556 B13R2.423 CC(C)C1NC1c2ccccc2 Amb31293615 [0,1,0,1,0,0|2,0,0]=4 13557 B13R2.423 CC(C)[C@@H]1N[C@H]1c2ccccc2 Amb31293613 [0,1,0,1,0,0|2,0,0]=4 13558 B13R2.423 CC(C)[C@H]1O[C@@H]1c2ccccc2 Amb27244814 [0,1,0,1,0,0|2,0,0]=4 13559 B13R2.423 CC(Cl)C1CC1c2ccccc2 Amb27426778 [0,1,0,1,0,0|1,0,0]=3 13560 B13R2.423 CC(N)C1CC1c2ccccc2 Amb10610180 [0,1,0,1,0,0|1,0,0]=3 13561 B13R2.423 CC(N)C1CC1c2ccccc2 Amb7807914 [0,1,0,1,0,0|1,0,0]=3 13562 B13R2.423 CC(N)C1CC1c2ccncc2 Amb7807872 [0,1,0,1,0,0|2,0,0]=4 13563 B13R2.423 CC(N)[C@@H]1C[C@H]1c2ccccc2 Amb26926536 [0,1,0,1,0,0|1,0,0]=3 13564 B13R2.423 CC(N)[C@@H]1C[C@H]1c2ccccc2 Amb32652180 [0,1,0,1,0,0|1,0,0]=3 13565 B13R2.423 CC(O)C1CC1c2ccccc2 Amb17605479 [0,1,0,1,0,0|1,0,0]=3 13566 B13R2.423 CC(O)[C@@H]1O[C@H]1c2ccccc2 Amb27422611 [0,1,0,1,0,0|2,0,0]=4 13567 B13R2.423 CC(O)[C@H]1C[C@@H]1c2ccccc2 Amb27664262 [0,1,0,1,0,0|1,0,0]=3 13568 B13R2.423 CC(O)[C@H]1O[C@@H]1c2ccccc2 Amb28076907 [0,1,0,1,0,0|2,0,0]=4 13569 B13R2.423 C[C@@H](O)[C@@H]1O[C@H]1c2ccccc2 Amb27218973 [0,1,0,1,0,0|2,0,0]=4 13570 B13R2.423 C[C@@H](O)[C@H]1C[C@@H]1c2ccccc2 Amb27857504 [0,1,0,1,0,0|1,0,0]=3 13571 B13R2.423 C[C@@H](O)[C@H]1O[C@H]1c2ccccc2 Amb27431417 [0,1,0,1,0,0|2,0,0]=4 13572 B13R2.423 C[C@H](O)[C@H]1O[C@H]1c2ccccc2 Amb27775377 [0,1,0,1,0,0|2,0,0]=4 13573 B13R2.423 NC(=O)[C@@H]1C[C@@H]1c2ccccc2 Amb25965684 [0,1,0,1,0,0|2,0,0]=4 13574 B13R2.423 NC(=O)[C@@H]1C[C@H]1c2ccccc2 Amb26624595 [0,1,0,1,0,0|2,0,0]=4 13575 B13R2.423 NC(=S)C1CC1c2ccccc2 Amb27616774 [0,1,0,1,0,0|2,0,0]=4 13576 B13R2.423 O=C(Cl)C1CC1c2ccccc2 Amb24655655 [0,1,0,1,0,0|2,0,0]=4 13577 B13R2.423 O=C(Cl)[C@@H]1C[C@H]1c2ccccc2 Amb3939047 [0,1,0,1,0,0|2,0,0]=4 13578 B13R2.423 O=C(O)C1CC1c2ccccc2 Amb534800 [0,1,0,1,0,0|2,0,0]=4 13579 B13R2.423 O=C(O)[C@@H]1C[C@@H]1c2ccccc2 Amb17621816 [0,1,0,1,0,0|2,0,0]=4 13580 B13R2.423 O=C(O)[C@@H]1C[C@H]1c2ccccc2 Amb33524226 [0,1,0,1,0,0|2,0,0]=4 13581 B13R2.423 O=C(O)[C@H]1C[C@@H]1c2ccccc2 Amb10071353 [0,1,0,1,0,0|2,0,0]=4 13582 B13R2.423 O=C(O)[C@H]1C[C@H]1c2ccccc2 Amb25231831 [0,1,0,1,0,0|2,0,0]=4 13583 B13R2.423 O=S([O-])[C@@H]1C[C@H]1c2ccccc2 Amb32755429 [0,1,0,1,0,0|2,0,0]=4 13584 B13R2.423 O=[N+]([O-])C1CC1c2ccccc2 Amb27651637 [0,1,0,1,0,0|1,0,1]=4 13585 B13R2.423 O=[N+]([O-])[C@@H]1CC1c2ccccc2 Amb27635928 [0,1,0,1,0,0|1,0,1]=4 13586 B13R2.423 O=[N+]([O-])[C@H]1C[C@@H]1c2ccccc2 Amb26989678 [0,1,0,1,0,0|1,0,1]=4 13587 B13R2.423 OB(O)C1CC1c2ccccc2 Amb26632211 [0,1,0,1,0,0|2,0,0]=4 13588 B13R2.423 OB(O)[C@@H]1C[C@H]1c2ccccc2 Amb24711708 [0,1,0,1,0,0|2,0,0]=4 13589 B13R2.423 OB(O)[C@H]1C[C@@H]1c2ccccc2 Amb27420204 [0,1,0,1,0,0|2,0,0]=4 13590 B13R2.3201 CC1(C)CC1(N)c2ccccc2 Amb26495630 [0,1,0,1,0,0|2,0,0]=4 13591 B13R2.3201 CC1(C)C[C@@]1(N)c2ccccc2 Amb27181240 [0,1,0,1,0,0|2,0,0]=4 13592 B13R2.3201 CC1(c2ccccc2)CC1(Cl)Cl Amb4021847 [0,1,0,1,0,0|2,0,0]=4 13593 B13R2.3201 CC1(c2ccccc2)CC1(F)Cl Amb27488396 [0,1,0,1,0,0|2,0,0]=4 13594 B13R2.5881 CC(=O)NC1Cc2ccccc21 Amb17778879 [0,1,0,1,0,0|2,0,0]=4 13595 B13R2.5881 CC(=O)OC1Cc2ccccc21 Amb17778687 [0,1,0,1,0,0|2,0,0]=4 13596 B13R2.5881 O=C(O)CC1Cc2ccccc21 Amb25279494 [0,1,0,1,0,0|2,0,0]=4 13597 B13R2.18 Brc1ccccc1C2CCCC2 Amb18760094 [0,1,0,1,0,0|1,0,0]=3 13598 B13R2.18 Brc1ccccc1C2CCCN2 Amb17659160 [0,1,0,1,0,0|2,0,0]=4 13599 B13R2.18 Brc1ccccc1C2CCCN2 Amb20626046 [0,1,0,1,0,0|2,0,0]=4 13600 B13R2.18 Brc1ccccc1C2CCCN2 Amb2237168 [0,1,0,1,0,0|2,0,0]=4 13601 B13R2.18 Brc1ccccc1C2CCNC2 Amb18571277 [0,1,0,1,0,0|0,0,0]=2 13602 B13R2.18 Brc1ccccc1C2CCNC2 Amb30588526 [0,1,0,1,0,0|0,0,0]=2 13603 B13R2.18 Brc1ccccc1C2CCOC2 Amb20617119 [0,1,0,1,0,0|1,0,0]=3 13604 B13R2.18 Brc1ccccc1C2CNCO2 Amb18571585 [0,1,0,1,0,0|1,0,0]=3 13605 B13R2.18 Brc1ccccc1N2CCCC2 Amb19959459 [0,1,0,1,0,0|2,0,0]=4 13606 B13R2.18 Brc1ccccc1[C@@H]2CCCN2 Amb8397166 [0,1,0,1,0,0|2,0,0]=4 13607 B13R2.18 Brc1ccccc1[C@H]2CCCN2 Amb8397167 [0,1,0,1,0,0|2,0,0]=4 13608 B13R2.18 Brc1ccccc1[C@H]2CCNC2 Amb27390200 [0,1,0,1,0,0|0,0,0]=2 13609 B13R2.18 Brc1cccnc1C2CCCC2 Amb24320673 [0,1,0,1,0,0|2,0,0]=4 13610 B13R2.18 Brc1cccnc1C2CCNC2 Amb26066704 [0,1,0,1,0,0|1,0,0]=3 13611 B13R2.18 Brc1ccncc1C2CCCC2 Amb20617517 [0,1,0,1,0,0|2,0,0]=4 13612 B13R2.18 Brc1cnccc1C2CCNC2 Amb24082791 [0,1,0,1,0,0|1,0,0]=3 13613 B13R2.18 Brc1ncccc1C2CCNC2 Amb25301377 [0,1,0,1,0,0|1,0,0]=3 13614 B13R2.18 Cc1ccccc1C2=CCNC2 Amb22059719 [0,1,0,1,0,0|0,0,2]=4 13615 B13R2.18 Cc1ccccc1C2=CCNC2 Amb30584972 [0,1,0,1,0,0|0,0,2]=4 13616 B13R2.18 Cc1ccccc1C2=NNCC2 Amb25697316 [0,1,0,1,0,0|1,0,1]=4 13617 B13R2.18 Cc1ccccc1C2CCCC2 Amb28385527 [0,1,0,1,0,0|1,0,0]=3 13618 B13R2.18 Cc1ccccc1C2CCCN2 Amb20668068 [0,1,0,1,0,0|2,0,0]=4 13619 B13R2.18 Cc1ccccc1C2CCCN2 Amb9715198 [0,1,0,1,0,0|2,0,0]=4 13620 B13R2.18 Cc1ccccc1C2CCNC2 Amb13952285 [0,1,0,1,0,0|0,0,0]=2 13621 B13R2.18 Cc1ccccc1C2CCNC2 Amb24094033 [0,1,0,1,0,0|0,0,0]=2 13622 B13R2.18 Cc1ccccc1C2CNCO2 Amb18563576 [0,1,0,1,0,0|1,0,0]=3 13623 B13R2.18 Cc1ccccc1N2CCCC2 Amb24418554 [0,1,0,1,0,0|2,0,0]=4 13624 B13R2.18 Cc1ccccc1[C@@H]2CCCN2 Amb24117100 [0,1,0,1,0,0|2,0,0]=4 13625 B13R2.18 Cc1ccccc1[C@H]2CCCN2 Amb24714734 [0,1,0,1,0,0|2,0,0]=4 13626 B13R2.18 Cc1ccccc1[C@H]2CCNC2 Amb27230875 [0,1,0,1,0,0|0,0,0]=2 13627 B13R2.18 Cc1cccnc1C2CCNC2 Amb27389163 [0,1,0,1,0,0|1,0,0]=3 13628 B13R2.18 Cc1ccncc1C2CCNC2 Amb24471679 [0,1,0,1,0,0|1,0,0]=3 13629 B13R2.18 Cc1cnccc1C2CCNC2 Amb25737168 [0,1,0,1,0,0|1,0,0]=3 13630 B13R2.18 Cc1cncnc1C2CCNC2 Amb18829170 [0,1,0,1,0,0|2,0,0]=4 13631 B13R2.18 Cc1ncccc1C2CCNC2 Amb23586023 [0,1,0,1,0,0|1,0,0]=3 13632 B13R2.18 Cc1nccnc1C2CCNC2 Amb33225627 [0,1,0,1,0,0|2,0,0]=4 13633 B13R2.18 Cc1ncncc1C2CCNC2 Amb18829145 [0,1,0,1,0,0|2,0,0]=4 13634 B13R2.18 Clc1ccccc1C2CCCN2 Amb19887240 [0,1,0,1,0,0|2,0,0]=4 13635 B13R2.18 Clc1ccccc1C2CCCN2 Amb9713718 [0,1,0,1,0,0|2,0,0]=4 13636 B13R2.18 Clc1ccccc1C2CCNC2 Amb10068901 [0,1,0,1,0,0|0,0,0]=2 13637 B13R2.18 Clc1ccccc1C2CCNC2 Amb10602146 [0,1,0,1,0,0|0,0,0]=2 13638 B13R2.18 Clc1ccccc1C2CCNC2 Amb19958389 [0,1,0,1,0,0|0,0,0]=2 13639 B13R2.18 Clc1ccccc1C2CNCO2 Amb18564263 [0,1,0,1,0,0|1,0,0]=3 13640 B13R2.18 Clc1ccccc1N2CCCC2 Amb18268600 [0,1,0,1,0,0|2,0,0]=4 13641 B13R2.18 Clc1ccccc1[C@@H]2CCCN2 Amb24062899 [0,1,0,1,0,0|2,0,0]=4 13642 B13R2.18 Clc1ccccc1[C@@H]2CCCN2 Amb8397172 [0,1,0,1,0,0|2,0,0]=4 13643 B13R2.18 Clc1ccccc1[C@H]2CCCN2 Amb24078711 [0,1,0,1,0,0|2,0,0]=4 13644 B13R2.18 Clc1ccccc1[C@H]2CCCN2 Amb8397173 [0,1,0,1,0,0|2,0,0]=4 13645 B13R2.18 Clc1cccnc1C2CCNC2 Amb18823440 [0,1,0,1,0,0|1,0,0]=3 13646 B13R2.18 Clc1ccncc1C2CCNC2 Amb18823442 [0,1,0,1,0,0|1,0,0]=3 13647 B13R2.18 Clc1cnccc1C2CCCC2 Amb27470152 [0,1,0,1,0,0|2,0,0]=4 13648 B13R2.18 Clc1cnccc1C2CCNC2 Amb18823441 [0,1,0,1,0,0|1,0,0]=3 13649 B13R2.18 Clc1ncccc1C2CCCC2 Amb24319281 [0,1,0,1,0,0|2,0,0]=4 13650 B13R2.18 Clc1ncccc1C2CCNC2 Amb26873372 [0,1,0,1,0,0|1,0,0]=3 13651 B13R2.18 Fc1ccccc1C2=CCNC2 Amb22059720 [0,1,0,1,0,0|0,0,2]=4 13652 B13R2.18 Fc1ccccc1C2=CCNC2 Amb30585028 [0,1,0,1,0,0|0,0,2]=4 13653 B13R2.18 Fc1ccccc1C2CCCN2 Amb2693808 [0,1,0,1,0,0|2,0,0]=4 13654 B13R2.18 Fc1ccccc1C2CCCN2 Amb3788174 [0,1,0,1,0,0|2,0,0]=4 13655 B13R2.18 Fc1ccccc1C2CCNC2 Amb19351410 [0,1,0,1,0,0|0,0,0]=2 13656 B13R2.18 Fc1ccccc1C2CCNC2 Amb8009464 [0,1,0,1,0,0|0,0,0]=2 13657 B13R2.18 Fc1ccccc1C2CNCO2 Amb18563791 [0,1,0,1,0,0|1,0,0]=3 13658 B13R2.18 Fc1ccccc1[C@@H]2CCCN2 Amb24094371 [0,1,0,1,0,0|2,0,0]=4 13659 B13R2.18 Fc1ccccc1[C@@H]2CCNC2 Amb24094222 [0,1,0,1,0,0|0,0,0]=2 13660 B13R2.18 Fc1ccccc1[C@H]2CCCN2 Amb24099980 [0,1,0,1,0,0|2,0,0]=4 13661 B13R2.18 Fc1ccccc1[C@H]2CCNC2 Amb24099973 [0,1,0,1,0,0|0,0,0]=2 13662 B13R2.18 Fc1cccnc1C2CCNC2 Amb26517447 [0,1,0,1,0,0|1,0,0]=3 13663 B13R2.18 Fc1cnccc1C2CCNC2 Amb24758349 [0,1,0,1,0,0|1,0,0]=3 13664 B13R2.18 Fc1ncccc1C2CCNC2 Amb18827733 [0,1,0,1,0,0|1,0,0]=3 13665 B13R2.18 Ic1ccccc1C2CCCN2 Amb9713257 [0,1,0,1,0,0|2,0,0]=4 13666 B13R2.18 Ic1ccccc1[C@@H]2CCCN2 Amb27750769 [0,1,0,1,0,0|2,0,0]=4 13667 B13R2.18 Ic1ccccc1[C@H]2CCCN2 Amb27389454 [0,1,0,1,0,0|2,0,0]=4 13668 B13R2.18 Ic1ccccc1[C@H]2CCNC2 Amb27263845 [0,1,0,1,0,0|0,0,0]=2 13669 B13R2.18 Nc1ccccc1C2C=CCC2 Amb18126193 [0,1,0,1,0,0|1,0,1]=4 13670 B13R2.18 Nc1ccccc1C2CCCC2 Amb17106959 [0,1,0,1,0,0|1,0,0]=3 13671 B13R2.18 Nc1ccccc1C2CCCN2 Amb18064028 [0,1,0,1,0,0|2,0,0]=4 13672 B13R2.18 Nc1ccccc1C2CCNC2 Amb27412916 [0,1,0,1,0,0|0,0,0]=2 13673 B13R2.18 Nc1ccccc1C2CCOC2 Amb20617120 [0,1,0,1,0,0|1,0,0]=3 13674 B13R2.18 Nc1ccccc1N2CCCC2 Amb24053263 [0,1,0,1,0,0|2,0,0]=4 13675 B13R2.18 Nc1ccccc1N2CCCC2 Amb420192 [0,1,0,1,0,0|2,0,0]=4 13676 B13R2.18 Nc1ccccc1N2CCCC2 Amb716884 [0,1,0,1,0,0|2,0,0]=4 13677 B13R2.18 Nc1ccccc1[C@@H]2CCCN2 Amb27259054 [0,1,0,1,0,0|2,0,0]=4 13678 B13R2.18 Nc1ccccc1[C@H]2CCNC2 Amb27390596 [0,1,0,1,0,0|0,0,0]=2 13679 B13R2.18 Nc1cccnc1C2CCCC2 Amb18829595 [0,1,0,1,0,0|2,0,0]=4 13680 B13R2.18 Nc1ccncc1C2CCCC2 Amb24319530 [0,1,0,1,0,0|2,0,0]=4 13681 B13R2.18 Nc1ccncc1C2CCNC2 Amb27168603 [0,1,0,1,0,0|1,0,0]=3 13682 B13R2.18 Nc1ccncc1C2CCOC2 Amb27425210 [0,1,0,1,0,0|2,0,0]=4 13683 B13R2.18 Nc1ccncc1C2CCSC2 Amb29852281 [0,1,0,1,0,0|2,0,0]=4 13684 B13R2.18 Nc1cnccc1C2CCCC2 Amb18829606 [0,1,0,1,0,0|2,0,0]=4 13685 B13R2.18 Nc1cnccc1C2CCNC2 Amb27214120 [0,1,0,1,0,0|1,0,0]=3 13686 B13R2.18 Nc1cnccc1C2CCOC2 Amb33231416 [0,1,0,1,0,0|2,0,0]=4 13687 B13R2.18 Nc1ncccc1C2CCCC2 Amb18829596 [0,1,0,1,0,0|2,0,0]=4 13688 B13R2.18 Nc1ncccc1C2CCSC2 Amb29852282 [0,1,0,1,0,0|2,0,0]=4 13689 B13R2.18 O=C1C=CC=CN1C2CCNC2 Amb18038062 [0,1,0,1,0,0|1,0,0]=3 13690 B13R2.18 O=C1N=CC=CN1C2CCNC2 Amb18540386 [0,1,0,1,0,0|2,0,0]=4 13691 B13R2.18 Oc1ccccc1C2C=CCC2 Amb1150411 [0,1,0,1,0,0|1,0,1]=4 13692 B13R2.18 Oc1ccccc1C2CCCC2 Amb3939129 [0,1,0,1,0,0|1,0,0]=3 13693 B13R2.18 Oc1ccccc1C2CCCN2 Amb18560469 [0,1,0,1,0,0|2,0,0]=4 13694 B13R2.18 Oc1ccccc1C2CCCN2 Amb30633924 [0,1,0,1,0,0|2,0,0]=4 13695 B13R2.18 Oc1ccccc1C2CCCO2 Amb18646054 [0,1,0,1,0,0|2,0,0]=4 13696 B13R2.18 Oc1ccccc1C2CCNC2 Amb18062861 [0,1,0,1,0,0|0,0,0]=2 13697 B13R2.18 Oc1ccccc1C2CCOC2 Amb20617121 [0,1,0,1,0,0|1,0,0]=3 13698 B13R2.18 Oc1ccccc1N2CCCC2 Amb2725401 [0,1,0,1,0,0|2,0,0]=4 13699 B13R2.18 Oc1ccccc1[C@H]2CCCN2 Amb27975756 [0,1,0,1,0,0|2,0,0]=4 13700 B13R2.18 Oc1cccnc1C2CCNC2 Amb27190722 [0,1,0,1,0,0|1,0,0]=3 13701 B13R2.18 Oc1ncccc1C2CCCC2 Amb24319282 [0,1,0,1,0,0|2,0,0]=4 13702 B13R2.18 Sc1ccccc1C2CCCC2 Amb27840644 [0,1,0,1,0,0|1,0,0]=3 13703 B13R2.18 Sc1ccccc1[C@@H]2CCCN2 Amb27644204 [0,1,0,1,0,0|2,0,0]=4 13704 B13R2.18 Sc1ncccc1C2CCNC2 Amb28122891 [0,1,0,1,0,0|1,0,0]=3 13705 B13R2.216 CN1CC(c2ccccc2N)C1 Amb27813569 [0,1,0,1,0,0|0,0,0]=2 13706 B13R2.216 CN1CC(c2ccccc2O)C1 Amb28053131 [0,1,0,1,0,0|0,0,0]=2 13707 B13R2.216 Cc1ccccc1C2CC(=O)C2 Amb19286389 [0,1,0,1,0,0|2,0,0]=4 13708 B13R2.216 Cc1ccccc1C2CC(N)C2 Amb19148955 [0,1,0,1,0,0|2,0,0]=4 13709 B13R2.216 Cc1ccccc1C2CC(N)C2 Amb9497090 [0,1,0,1,0,0|2,0,0]=4 13710 B13R2.216 Cc1ccccc1C2CC(S)C2 Amb32788511 [0,1,0,1,0,0|2,0,0]=4 13711 B13R2.216 Cc1ccccc1[C@H]2C[C@H](N)C2 Amb24624964 [0,1,0,1,0,0|2,0,0]=4 13712 B13R2.216 Cc1ccccc1[C@H]2C[C@H](N)C2 Amb33172741 [0,1,0,1,0,0|2,0,0]=4 13713 B13R2.216 Fc1ccccc1C2CC(S)C2 Amb32788106 [0,1,0,1,0,0|2,0,0]=4 13714 B13R2.216 NC1CC(c2ccccc2Br)C1 Amb33548170 [0,1,0,1,0,0|2,0,0]=4 13715 B13R2.216 NC1CC(c2ccccc2Br)C1 Amb9497091 [0,1,0,1,0,0|2,0,0]=4 13716 B13R2.216 NC1CC(c2ccccc2Cl)C1 Amb19374604 [0,1,0,1,0,0|2,0,0]=4 13717 B13R2.216 NC1CC(c2ccccc2Cl)C1 Amb9497078 [0,1,0,1,0,0|2,0,0]=4 13718 B13R2.216 NC1CC(c2ccccc2F)C1 Amb19373545 [0,1,0,1,0,0|2,0,0]=4 13719 B13R2.216 NC1CC(c2ccccc2F)C1 Amb9497084 [0,1,0,1,0,0|2,0,0]=4 13720 B13R2.216 N[C@H]1C[C@H](c2ccccc2Cl)C1 Amb24683487 [0,1,0,1,0,0|2,0,0]=4 13721 B13R2.216 N[C@H]1C[C@H](c2ccccc2Cl)C1 Amb33473657 [0,1,0,1,0,0|2,0,0]=4 13722 B13R2.216 N[C@H]1C[C@H](c2ccccc2F)C1 Amb25159862 [0,1,0,1,0,0|2,0,0]=4 13723 B13R2.216 N[C@H]1C[C@H](c2ccccc2F)C1 Amb33473636 [0,1,0,1,0,0|2,0,0]=4 13724 B13R2.216 O=C1CC(c2ccccc2Br)C1 Amb20622984 [0,1,0,1,0,0|2,0,0]=4 13725 B13R2.216 O=C1CC(c2ccccc2Cl)C1 Amb20622983 [0,1,0,1,0,0|2,0,0]=4 13726 B13R2.216 O=C1CC(c2ccccc2F)C1 Amb19286390 [0,1,0,1,0,0|2,0,0]=4 13727 B13R2.216 OC1CC(c2ccccc2Br)C1 Amb27946357 [0,1,0,1,0,0|2,0,0]=4 13728 B13R2.216 OC1CC(c2ccccc2Cl)C1 Amb19057039 [0,1,0,1,0,0|2,0,0]=4 13729 B13R2.216 OC1CC(c2ccccc2F)C1 Amb18792758 [0,1,0,1,0,0|2,0,0]=4 13730 B13R2.216 O[C@H]1C[C@@H](c2ccccc2Cl)C1 Amb25933889 [0,1,0,1,0,0|2,0,0]=4 13731 B13R2.216 O[C@H]1C[C@@H](c2ccccc2F)C1 Amb26957371 [0,1,0,1,0,0|2,0,0]=4 13732 B13R2.216 O[C@H]1C[C@H](c2ccccc2F)C1 Amb33803924 [0,1,0,1,0,0|2,0,0]=4 13733 B13R2.216 SC1CC(c2ccccc2Br)C1 Amb32788435 [0,1,0,1,0,0|2,0,0]=4 13734 B13R2.216 SC1CC(c2ccccc2Cl)C1 Amb32788551 [0,1,0,1,0,0|2,0,0]=4 13735 B13R2.567 C=CC1CC1c2ccccc2O Amb27177513 [0,1,0,1,0,0|1,0,1]=4 13736 B13R2.567 CCC1CC1c2ccccc2N Amb27845524 [0,1,0,1,0,0|1,0,0]=3 13737 B13R2.567 Cc1ccccc1C2CC2C#N Amb17232207 [0,1,0,1,0,0|2,0,0]=4 13738 B13R2.567 Cc1ccccc1C2CC2CN Amb17232379 [0,1,0,1,0,0|2,0,0]=4 13739 B13R2.567 Cc1ccccc1[C@@H]2C[C@H]2CN Amb25251137 [0,1,0,1,0,0|2,0,0]=4 13740 B13R2.567 N#CC1CC1c2ccccc2Cl Amb17233374 [0,1,0,1,0,0|2,0,0]=4 13741 B13R2.567 N#CC1CC1c2ccccc2F Amb17232353 [0,1,0,1,0,0|2,0,0]=4 13742 B13R2.567 N#CC1CC1c2ccccc2O Amb27793866 [0,1,0,1,0,0|2,0,0]=4 13743 B13R2.567 NCC1CC1c2ccccc2Br Amb17568203 [0,1,0,1,0,0|2,0,0]=4 13744 B13R2.567 NCC1CC1c2ccccc2Cl Amb17233870 [0,1,0,1,0,0|2,0,0]=4 13745 B13R2.567 NCC1CC1c2ccccc2F Amb17232528 [0,1,0,1,0,0|2,0,0]=4 13746 B13R2.567 NCC1CC1c2ccccc2O Amb27855492 [0,1,0,1,0,0|2,0,0]=4 13747 B13R2.567 NC[C@@H]1C[C@H]1c2ccccc2Br Amb25264940 [0,1,0,1,0,0|2,0,0]=4 13748 B13R2.567 NC[C@@H]1C[C@H]1c2ccccc2Cl Amb27494539 [0,1,0,1,0,0|2,0,0]=4 13749 B13R2.567 NC[C@@H]1C[C@H]1c2ccccc2F Amb25204987 [0,1,0,1,0,0|2,0,0]=4 13750 B13R2.567 NC[C@@H]1C[C@H]1c2ccccc2O Amb26958612 [0,1,0,1,0,0|2,0,0]=4 13751 B13R2.567 O=CC1CC1c2ccccc2Cl Amb18636302 [0,1,0,1,0,0|2,0,0]=4 13752 B13R2.567 O=CC1CC1c2ccccc2F Amb18636293 [0,1,0,1,0,0|2,0,0]=4 13753 B13R2.567 OCC1CC1c2ccccc2Br Amb17605545 [0,1,0,1,0,0|2,0,0]=4 13754 B13R2.567 OCC1CC1c2ccccc2Cl Amb17605562 [0,1,0,1,0,0|2,0,0]=4 13755 B13R2.567 OCC1CC1c2ccccc2F Amb17605538 [0,1,0,1,0,0|2,0,0]=4 13756 B13R2.3097 CN(c1ccccc1F)C2CC2 Amb27389157 [0,1,0,1,0,0|2,0,0]=4 13757 B13R2.3097 CN(c1ccccc1N)C2CC2 Amb8892126 [0,1,0,1,0,0|2,0,0]=4 13758 B13R2.3097 Cc1ccccc1C(N)C2CC2 Amb30869581 [0,1,0,1,0,0|2,0,0]=4 13759 B13R2.3097 Cc1ccccc1C(N)C2CC2 Amb3788158 [0,1,0,1,0,0|2,0,0]=4 13760 B13R2.3097 Cc1ccccc1C(O)C2CC2 Amb17232415 [0,1,0,1,0,0|2,0,0]=4 13761 B13R2.3097 NC(c1ccccc1Cl)C2CC2 Amb17233873 [0,1,0,1,0,0|2,0,0]=4 13762 B13R2.3097 NC(c1ccccc1F)C2CC2 Amb17232530 [0,1,0,1,0,0|2,0,0]=4 13763 B13R2.3097 N[C@@H](c1ccccc1Br)C2CC2 Amb27390046 [0,1,0,1,0,0|2,0,0]=4 13764 B13R2.3097 N[C@@H](c1ccccc1Cl)C2CC2 Amb27468644 [0,1,0,1,0,0|2,0,0]=4 13765 B13R2.3097 N[C@@H](c1ccccc1F)C2CC2 Amb22406378 [0,1,0,1,0,0|2,0,0]=4 13766 B13R2.3097 N[C@@H](c1ccccc1F)C2CC2 Amb25113412 [0,1,0,1,0,0|2,0,0]=4 13767 B13R2.3097 N[C@@H](c1ccccc1I)C2CC2 Amb27974820 [0,1,0,1,0,0|2,0,0]=4 13768 B13R2.3097 N[C@H](c1ccccc1F)C2CC2 Amb22406379 [0,1,0,1,0,0|2,0,0]=4 13769 B13R2.3097 N[C@H](c1ccccc1F)C2CC2 Amb26399464 [0,1,0,1,0,0|2,0,0]=4 13770 B13R2.3097 Nc1ccccc1C(F)C2CC2 Amb28315177 [0,1,0,1,0,0|2,0,0]=4 13771 B13R2.3097 Nc1ccccc1C(N)C2CC2 Amb28059875 [0,1,0,1,0,0|2,0,0]=4 13772 B13R2.3097 OC(c1ccccc1Br)C2CC2 Amb24625121 [0,1,0,1,0,0|2,0,0]=4 13773 B13R2.3097 OC(c1ccccc1Cl)C2CC2 Amb17233964 [0,1,0,1,0,0|2,0,0]=4 13774 B13R2.3097 OC(c1ccccc1F)C2CC2 Amb17232579 [0,1,0,1,0,0|2,0,0]=4 13775 B13R2.3097 O[C@H](c1ccccc1F)C2CC2 Amb24182072 [0,1,0,1,0,0|2,0,0]=4 13776 B13R2.3569 CC1(c2ccccc2Br)CCC1 Amb26905686 [0,1,0,1,0,0|1,0,0]=3 13777 B13R2.3569 CC1(c2ccccc2Br)CCO1 Amb26908669 [0,1,0,1,0,0|2,0,0]=4 13778 B13R2.3569 CC1(c2ccccc2Br)CNC1 Amb27479077 [0,1,0,1,0,0|0,0,0]=2 13779 B13R2.3569 CC1(c2ccccc2Cl)CCC1 Amb27864236 [0,1,0,1,0,0|1,0,0]=3 13780 B13R2.3569 CC1(c2ccccc2Cl)CNC1 Amb18564191 [0,1,0,1,0,0|0,0,0]=2 13781 B13R2.3569 CC1(c2ccccc2F)CCC1 Amb25951842 [0,1,0,1,0,0|1,0,0]=3 13782 B13R2.3569 CC1(c2ccccc2F)CCO1 Amb32946043 [0,1,0,1,0,0|2,0,0]=4 13783 B13R2.3569 CC1(c2ccccc2F)CNC1 Amb18563684 [0,1,0,1,0,0|0,0,0]=2 13784 B13R2.3569 CC1(c2ccccc2F)CNC1 Amb32737485 [0,1,0,1,0,0|0,0,0]=2 13785 B13R2.3569 CC1(c2ccccc2I)CCC1 Amb28071435 [0,1,0,1,0,0|1,0,0]=3 13786 B13R2.3569 CC1(c2ccccc2O)COC1 Amb22295892 [0,1,0,1,0,0|1,0,0]=3 13787 B13R2.3569 Cc1ccccc1C2(C)CCC2 Amb24636942 [0,1,0,1,0,0|1,0,0]=3 13788 B13R2.3569 Cc1ccccc1C2(C)CNC2 Amb18563525 [0,1,0,1,0,0|0,0,0]=2 13789 B13R2.3569 Cc1ccccc1C2(N)CCC2 Amb28555682 [0,1,0,1,0,0|2,0,0]=4 13790 B13R2.3569 Cc1ccccc1C2(N)CCC2 Amb9211467 [0,1,0,1,0,0|2,0,0]=4 13791 B13R2.3569 Cc1ccccc1C2(N)COC2 Amb27460238 [0,1,0,1,0,0|2,0,0]=4 13792 B13R2.3569 Cc1ccccc1C2(O)CNC2 Amb25323719 [0,1,0,1,0,0|1,0,0]=3 13793 B13R2.3569 Cc1ccccc1C2(O)CNC2 Amb32651860 [0,1,0,1,0,0|1,0,0]=3 13794 B13R2.3569 Cc1ccccc1C2(O)COC2 Amb27770908 [0,1,0,1,0,0|2,0,0]=4 13795 B13R2.3569 Cc1ccccc1C2(O)CSC2 Amb27399593 [0,1,0,1,0,0|2,0,0]=4 13796 B13R2.3569 Cc1cccnc1C2(O)CNC2 Amb33360240 [0,1,0,1,0,0|2,0,0]=4 13797 B13R2.3569 Cc1ccncc1C2(O)CNC2 Amb26517200 [0,1,0,1,0,0|2,0,0]=4 13798 B13R2.3569 Cc1cnccc1C2(O)CNC2 Amb33426441 [0,1,0,1,0,0|2,0,0]=4 13799 B13R2.3569 Cc1ncccc1C2(O)CNC2 Amb33224562 [0,1,0,1,0,0|2,0,0]=4 13800 B13R2.3569 Fc1ccccc1C2(F)CNC2 Amb24425207 [0,1,0,1,0,0|1,0,0]=3 13801 B13R2.3569 Fc1ccccc1C2(F)CNC2 Amb32941830 [0,1,0,1,0,0|1,0,0]=3 13802 B13R2.3569 NC1(c2ccccc2Br)CCC1 Amb18948441 [0,1,0,1,0,0|2,0,0]=4 13803 B13R2.3569 NC1(c2ccccc2Br)CCC1 Amb19892796 [0,1,0,1,0,0|2,0,0]=4 13804 B13R2.3569 NC1(c2ccccc2Br)COC1 Amb27879660 [0,1,0,1,0,0|2,0,0]=4 13805 B13R2.3569 NC1(c2ccccc2Br)COC1 Amb28989495 [0,1,0,1,0,0|2,0,0]=4 13806 B13R2.3569 NC1(c2ccccc2Cl)CCC1 Amb18279451 [0,1,0,1,0,0|2,0,0]=4 13807 B13R2.3569 NC1(c2ccccc2Cl)CCC1 Amb19892631 [0,1,0,1,0,0|2,0,0]=4 13808 B13R2.3569 NC1(c2ccccc2F)CCC1 Amb19892633 [0,1,0,1,0,0|2,0,0]=4 13809 B13R2.3569 NC1(c2ccccc2F)CCC1 Amb5754031 [0,1,0,1,0,0|2,0,0]=4 13810 B13R2.3569 NC1(c2ccccc2F)COC1 Amb19892674 [0,1,0,1,0,0|2,0,0]=4 13811 B13R2.3569 NC1(c2ccccc2F)COC1 Amb24518551 [0,1,0,1,0,0|2,0,0]=4 13812 B13R2.3569 NC1(c2ccccc2O)CCC1 Amb25719491 [0,1,0,1,0,0|2,0,0]=4 13813 B13R2.3569 Nc1ccccc1C2(F)CCC2 Amb27633604 [0,1,0,1,0,0|2,0,0]=4 13814 B13R2.3569 Nc1ccccc1C2(N)CCC2 Amb26986303 [0,1,0,1,0,0|2,0,0]=4 13815 B13R2.3569 Nc1ncccc1C2(O)CNC2 Amb28186894 [0,1,0,1,0,0|2,0,0]=4 13816 B13R2.3569 OC1(c2ccccc2Br)CNC1 Amb28061274 [0,1,0,1,0,0|1,0,0]=3 13817 B13R2.3569 OC1(c2ccccc2Cl)CCC1 Amb26352361 [0,1,0,1,0,0|2,0,0]=4 13818 B13R2.3569 OC1(c2ccccc2Cl)CNC1 Amb27649353 [0,1,0,1,0,0|1,0,0]=3 13819 B13R2.3569 OC1(c2ccccc2Cl)COC1 Amb29871342 [0,1,0,1,0,0|2,0,0]=4 13820 B13R2.3569 OC1(c2ccccc2Cl)CSC1 Amb28248344 [0,1,0,1,0,0|2,0,0]=4 13821 B13R2.3569 OC1(c2ccccc2F)CCC1 Amb28048628 [0,1,0,1,0,0|2,0,0]=4 13822 B13R2.3569 OC1(c2ccccc2F)CNC1 Amb25738686 [0,1,0,1,0,0|1,0,0]=3 13823 B13R2.3569 OC1(c2ccccc2F)CNC1 Amb35749556 [0,1,0,1,0,0|1,0,0]=3 13824 B13R2.3569 OC1(c2ccccc2F)COC1 Amb35658910 [0,1,0,1,0,0|2,0,0]=4 13825 B13R2.3569 OC1(c2cccnc2Br)CNC1 Amb33389451 [0,1,0,1,0,0|2,0,0]=4 13826 B13R2.3569 OC1(c2cccnc2Cl)CNC1 Amb33257382 [0,1,0,1,0,0|2,0,0]=4 13827 B13R2.3569 OC1(c2cccnc2Cl)CNC1 Amb33733640 [0,1,0,1,0,0|2,0,0]=4 13828 B13R2.3569 OC1(c2cccnc2F)CNC1 Amb33377164 [0,1,0,1,0,0|2,0,0]=4 13829 B13R2.3569 OC1(c2cccnc2F)CNC1 Amb35749764 [0,1,0,1,0,0|2,0,0]=4 13830 B13R2.3569 OC1(c2cccnc2F)CNC1 Amb35789586 [0,1,0,1,0,0|2,0,0]=4 13831 B13R2.3569 OC1(c2ccncc2Br)CNC1 Amb33388632 [0,1,0,1,0,0|2,0,0]=4 13832 B13R2.3569 OC1(c2ccncc2Cl)CNC1 Amb33413777 [0,1,0,1,0,0|2,0,0]=4 13833 B13R2.3569 OC1(c2ccncc2F)CNC1 Amb25340112 [0,1,0,1,0,0|2,0,0]=4 13834 B13R2.3569 OC1(c2ncccc2Br)CNC1 Amb33336353 [0,1,0,1,0,0|2,0,0]=4 13835 B13R2.3569 OC1(c2ncccc2F)CNC1 Amb33358859 [0,1,0,1,0,0|2,0,0]=4 13836 B13R2.3569 Oc1ccccc1C2(O)CNC2 Amb33195799 [0,1,0,1,0,0|1,0,0]=3 13837 B13R2.3569 Oc1ccccc1C2(O)COC2 Amb25992625 [0,1,0,1,0,0|2,0,0]=4 13838 B13R2.3570 CC1(c2ccccc2Cl)CC1N Amb18280093 [0,1,0,1,0,0|2,0,0]=4 13839 B13R2.3570 CC1(c2ccccc2Cl)CC1N Amb19374682 [0,1,0,1,0,0|2,0,0]=4 13840 B13R2.3570 CC1(c2ccccc2F)CC1N Amb18280069 [0,1,0,1,0,0|2,0,0]=4 13841 B13R2.3570 CC1(c2ccccc2F)CC1N Amb19148073 [0,1,0,1,0,0|2,0,0]=4 13842 B13R2.3570 CC1CC1(N)c2ccccc2Br Amb27805597 [0,1,0,1,0,0|2,0,0]=4 13843 B13R2.3570 CC1CC1(N)c2ccccc2O Amb27242608 [0,1,0,1,0,0|2,0,0]=4 13844 B13R2.3570 CC1CC1(O)c2ccccc2Br Amb28146579 [0,1,0,1,0,0|2,0,0]=4 13845 B13R2.3570 Cc1ccccc1C2(C)CC2N Amb18947396 [0,1,0,1,0,0|2,0,0]=4 13846 B13R2.3570 Cc1ccccc1C2(C)CC2N Amb19302399 [0,1,0,1,0,0|2,0,0]=4 13847 B13R2.4486 CCNC1Cc2cccc(F)c21 Amb32721660 [0,1,0,1,0,0|2,0,0]=4 13848 B13R2.4818 CC1CCNc2cccc(F)c21 Amb18828265 [0,1,0,1,0,0|2,0,0]=4 13849 B13R2.4818 CC1CCNc2cccc(O)c21 Amb27794952 [0,1,0,1,0,0|2,0,0]=4 13850 B13R2.4818 CC1CNCc2cccc(Cl)c21 Amb18648574 [0,1,0,1,0,0|0,0,0]=2 13851 B13R2.4818 CC1CNCc2cccc(F)c21 Amb27426903 [0,1,0,1,0,0|0,0,0]=2 13852 B13R2.4818 CC1CNCc2cccc(N)c21 Amb18355178 [0,1,0,1,0,0|0,0,0]=2 13853 B13R2.4818 CC1NCCc2cccc(Br)c21 Amb25707530 [0,1,0,1,0,0|2,0,0]=4 13854 B13R2.4818 CC1NCCc2cccc(F)c21 Amb19374693 [0,1,0,1,0,0|2,0,0]=4 13855 B13R2.4818 CC1NCCc2cccc(N)c21 Amb26330698 [0,1,0,1,0,0|2,0,0]=4 13856 B13R2.4818 CC1NCCc2cccc(O)c21 Amb27241628 [0,1,0,1,0,0|2,0,0]=4 13857 B13R2.4818 CN1CCCc2cccc(Br)c21 Amb18159824 [0,1,0,1,0,0|2,0,0]=4 13858 B13R2.4818 CN1CCCc2cccc(F)c21 Amb27805949 [0,1,0,1,0,0|2,0,0]=4 13859 B13R2.4818 CN1CCCc2cccc(N)c21 Amb5750774 [0,1,0,1,0,0|2,0,0]=4 13860 B13R2.4818 CN1CCCc2cccc(O)c21 Amb18645879 [0,1,0,1,0,0|2,0,0]=4 13861 B13R2.4818 C[C@@H]1NCCc2cccc(Br)c21 Amb27615335 [0,1,0,1,0,0|2,0,0]=4 13862 B13R2.4818 C[C@@H]1NCCc2cccc(Cl)c21 Amb27883676 [0,1,0,1,0,0|2,0,0]=4 13863 B13R2.4818 C[C@H]1NCCc2cccc(Br)c21 Amb27968392 [0,1,0,1,0,0|2,0,0]=4 13864 B13R2.4818 C[C@H]1NCCc2cccc(F)c21 Amb27219152 [0,1,0,1,0,0|2,0,0]=4 13865 B13R2.4818 C[C@H]1NCCc2cccc(O)c21 Amb27976635 [0,1,0,1,0,0|2,0,0]=4 13866 B13R2.4818 Cc1cccc2c1C(C)CCC2 Amb25314391 [0,1,0,1,0,0|1,0,0]=3 13867 B13R2.4818 Cc1cccc2c1C(C)CNC2 Amb28254564 [0,1,0,1,0,0|0,0,0]=2 13868 B13R2.4818 Cc1cccc2c1C(N)CCC2 Amb27160386 [0,1,0,1,0,0|2,0,0]=4 13869 B13R2.4818 Cc1cccc2c1C(N)CCC2 Amb35788629 [0,1,0,1,0,0|2,0,0]=4 13870 B13R2.4818 Cc1cccc2c1C(O)CCC2 Amb28321519 [0,1,0,1,0,0|2,0,0]=4 13871 B13R2.4818 Cc1cccc2c1[C@@H](N)COC2 Amb27949986 [0,1,0,1,0,0|2,0,0]=4 13872 B13R2.4818 Cc1cccc2c1[C@H](C)NCC2 Amb27169199 [0,1,0,1,0,0|2,0,0]=4 13873 B13R2.4818 Cc1ccnc2c1C(O)CNC2 Amb18828799 [0,1,0,1,0,0|2,0,0]=4 13874 B13R2.4818 NC1CCCc2cccc(Br)c21 Amb22500451 [0,1,0,1,0,0|2,0,0]=4 13875 B13R2.4818 NC1CCCc2cccc(F)c21 Amb22295835 [0,1,0,1,0,0|2,0,0]=4 13876 B13R2.4818 NC1CCCc2cccc(F)c21 Amb35788633 [0,1,0,1,0,0|2,0,0]=4 13877 B13R2.4818 NC1COCc2cccc(Br)c21 Amb27770940 [0,1,0,1,0,0|2,0,0]=4 13878 B13R2.4818 NC1COCc2cccc(Cl)c21 Amb27204479 [0,1,0,1,0,0|2,0,0]=4 13879 B13R2.4818 NC1COCc2cccc(O)c21 Amb27225909 [0,1,0,1,0,0|2,0,0]=4 13880 B13R2.4818 N[C@@H]1CCCc2cccc(Br)c21 Amb27761878 [0,1,0,1,0,0|2,0,0]=4 13881 B13R2.4818 N[C@@H]1COCc2cccc(Cl)c21 Amb27622214 [0,1,0,1,0,0|2,0,0]=4 13882 B13R2.4818 N[C@@H]1COCc2cccc(F)c21 Amb27800893 [0,1,0,1,0,0|2,0,0]=4 13883 B13R2.4818 N[C@H]1CCCc2cccc(Br)c21 Amb27441736 [0,1,0,1,0,0|2,0,0]=4 13884 B13R2.4818 N[C@H]1CCCc2cccc(Cl)c21 Amb28250880 [0,1,0,1,0,0|2,0,0]=4 13885 B13R2.4818 N[C@H]1CCCc2cccc(S)c21 Amb27658888 [0,1,0,1,0,0|2,0,0]=4 13886 B13R2.4818 N[C@H]1COCc2cccc(Br)c21 Amb27390669 [0,1,0,1,0,0|2,0,0]=4 13887 B13R2.4818 Nc1cccc2c1C(N)CCC2 Amb26846138 [0,1,0,1,0,0|2,0,0]=4 13888 B13R2.4818 Nc1cccc2c1C(N)CCC2 Amb28653057 [0,1,0,1,0,0|2,0,0]=4 13889 B13R2.4818 Nc1cccc2c1[C@H](N)CCC2 Amb27490859 [0,1,0,1,0,0|2,0,0]=4 13890 B13R2.4818 OC1CCCc2cccc(Br)c21 Amb8388746 [0,1,0,1,0,0|2,0,0]=4 13891 B13R2.4818 Oc1cccc2c1C(F)CNC2 Amb28129440 [0,1,0,1,0,0|1,0,0]=3 13892 B13R2.4818 Oc1cccc2c1C(O)CNC2 Amb27795276 [0,1,0,1,0,0|1,0,0]=3 13893 B13R3.1962 C1=CC2CC1c3ccccc32 Amb4018808 [0,0,0,2,0,0|1,0,1]=4 13894 B13R3.1962 C1=C[C@H]2C[C@@H]1c3ccccc32 Amb25858647 [0,0,0,2,0,0|1,0,1]=4 13895 B13R3.1962 c1cc2c(cn1)[C@@H]3CC[C@H]2C3 Amb27983543 [0,0,0,2,0,0|2,0,0]=4 13896 B13R3.1962 c1ccc2c(c1)C3CCC2C3 Amb29838327 [0,0,0,2,0,0|1,0,0]=3 13897 B13R3.1962 c1ccc2c(c1)C3CCC2N3 Amb18124757 [0,0,0,2,0,0|2,0,0]=4 13898 B13R3.1962 c1ccc2c(c1)C3CCC2N3 Amb33378977 [0,0,0,2,0,0|2,0,0]=4 13899 B13R3.1962 c1ccc2c(c1)C3CNC2C3 Amb18124756 [0,0,0,2,0,0|0,0,0]=2 13900 B13R3.1962 c1ccc2c(c1)C3CNC2C3 Amb32663252 [0,0,0,2,0,0|0,0,0]=2 13901 B13R3.1962 c1ccc2c(c1)[C@@H]3CC[C@H]2N3 Amb10606699 [0,0,0,2,0,0|2,0,0]=4 13902 B13R3.1962 c1ccc2c(c1)[C@@H]3CC[C@H]2O3 Amb25679044 [0,0,0,2,0,0|2,0,0]=4 13903 B13R3.6977 c1ccc(C23CC(C2)C3)cc1 Amb24058119 [0,0,0,2,0,0|1,0,0]=3 13904 B13R3.28 c1ccc2c(c1)CCC3OC23 Amb2383739 [0,0,0,2,0,0|2,0,0]=4 13905 B13R3.28 c1ccc2c(c1)CC[C@@H]3O[C@H]23 Amb28068230 [0,0,0,2,0,0|2,0,0]=4 13906 B13R3.28 c1ccc2c(c1)NCC3CC23 Amb28189406 [0,0,0,2,0,0|2,0,0]=4 13907 B13R3.274 BrC1c2ccccc2C3CC13 Amb27667994 [0,0,0,2,0,0|2,0,0]=4 13908 B13R3.274 O=C1c2ccccc2C3CC13 Amb24533047 [0,0,0,2,0,0|2,0,0]=4 13909 B13R3.274 OC1c2ccccc2C3CC13 Amb10560547 [0,0,0,2,0,0|2,0,0]=4 13910 B13R3.274 OC1c2ccccc2C3OC13 Amb28343274 [0,0,0,2,0,0|2,0,0]=4 13911 B13R3.2083 COC12OC1c3ccccc32 Amb24334687 [0,0,0,2,0,0|2,0,0]=4 13912 B9R1.11 CC(CBr)c1ccco1 Amb33262828 [1,0,0,0,1,0|2,0,0]=4 13913 B9R1.11 CC(CBr)c1cccs1 Amb17238292 [1,0,0,0,1,0|2,0,0]=4 13914 B9R1.11 CC(CBr)c1ccoc1 Amb33451348 [1,0,0,0,1,0|2,0,0]=4 13915 B9R1.11 CC(CBr)c1ccsc1 Amb33451467 [1,0,0,0,1,0|2,0,0]=4 13916 B9R1.11 CC(CCl)c1cccs1 Amb17232346 [1,0,0,0,1,0|2,0,0]=4 13917 B9R1.11 CC(CN)c1ccco1 Amb8950118 [1,0,0,0,1,0|1,0,0]=3 13918 B9R1.11 CC(CN)c1cccs1 Amb4056911 [1,0,0,0,1,0|1,0,0]=3 13919 B9R1.11 CC(CN)c1ccoc1 Amb25888901 [1,0,0,0,1,0|1,0,0]=3 13920 B9R1.11 CC(CN)c1ccon1 Amb33198791 [1,0,0,0,1,0|2,0,0]=4 13921 B9R1.11 CC(CN)c1ccsc1 Amb18958489 [1,0,0,0,1,0|1,0,0]=3 13922 B9R1.11 CC(CN)c1cnco1 Amb26456529 [1,0,0,0,1,0|2,0,0]=4 13923 B9R1.11 CC(CN)c1cncs1 Amb33269816 [1,0,0,0,1,0|2,0,0]=4 13924 B9R1.11 CC(CN)c1cnsc1 Amb29868694 [1,0,0,0,1,0|2,0,0]=4 13925 B9R1.11 CC(CN)c1cscn1 Amb26545075 [1,0,0,0,1,0|2,0,0]=4 13926 B9R1.11 CC(CN)c1nccs1 Amb5740844 [1,0,0,0,1,0|2,0,0]=4 13927 B9R1.11 CC(CN)n1cccc1 Amb5744334 [1,0,0,0,1,0|1,0,0]=3 13928 B9R1.11 CC(CN)n1cccn1 Amb22587139 [1,0,0,0,1,0|2,0,0]=4 13929 B9R1.11 CC(CN)n1cccn1 Amb6891106 [1,0,0,0,1,0|2,0,0]=4 13930 B9R1.11 CC(CN)n1ccnc1 Amb22586949 [1,0,0,0,1,0|2,0,0]=4 13931 B9R1.11 CC(CN)n1ccnc1 Amb32411917 [1,0,0,0,1,0|2,0,0]=4 13932 B9R1.11 CC(CN)n1ccnc1 Amb9763912 [1,0,0,0,1,0|2,0,0]=4 13933 B9R1.11 CC(CO)=C1C=CC=C1 Amb27981717 [1,0,0,0,1,0|1,0,1]=4 13934 B9R1.11 CC(CO)C1=CCC=C1 Amb27981767 [1,0,0,0,1,0|1,0,1]=4 13935 B9R1.11 CC(CO)c1cccs1 Amb17231948 [1,0,0,0,1,0|2,0,0]=4 13936 B9R1.11 CC(CO)c1ccoc1 Amb28397230 [1,0,0,0,1,0|2,0,0]=4 13937 B9R1.11 CC(CO)n1cccc1 Amb26480143 [1,0,0,0,1,0|2,0,0]=4 13938 B9R1.11 CC(NN)c1ccco1 Amb6251505 [1,0,0,0,1,0|2,0,0]=4 13939 B9R1.11 CC(NN)c1ccoc1 Amb27837250 [1,0,0,0,1,0|2,0,0]=4 13940 B9R1.11 CC(NO)c1ccco1 Amb10605011 [1,0,0,0,1,0|2,0,0]=4 13941 B9R1.11 CC(NO)c1cccs1 Amb10606933 [1,0,0,0,1,0|2,0,0]=4 13942 B9R1.11 CC(ON)c1ccco1 Amb33360961 [1,0,0,0,1,0|2,0,0]=4 13943 B9R1.11 CC(ON)c1cccs1 Amb17089184 [1,0,0,0,1,0|2,0,0]=4 13944 B9R1.11 CC(ON)c1ccoc1 Amb33360615 [1,0,0,0,1,0|2,0,0]=4 13945 B9R1.11 CC(ON)c1ccsc1 Amb33428928 [1,0,0,0,1,0|2,0,0]=4 13946 B9R1.11 CCC(C)c1cnco1 Amb35647922 [1,0,0,0,1,0|2,0,0]=4 13947 B9R1.11 CCC(C)c1cscn1 Amb28065701 [1,0,0,0,1,0|2,0,0]=4 13948 B9R1.11 CCC(C)n1cccn1 Amb6890436 [1,0,0,0,1,0|2,0,0]=4 13949 B9R1.11 CCC(C)n1ccnc1 Amb20624437 [1,0,0,0,1,0|2,0,0]=4 13950 B9R1.11 CCC(Cl)c1ccco1 Amb17138399 [1,0,0,0,1,0|2,0,0]=4 13951 B9R1.11 CCC(Cl)c1cccs1 Amb17138515 [1,0,0,0,1,0|2,0,0]=4 13952 B9R1.11 CCC(Cl)c1ccsc1 Amb27595300 [1,0,0,0,1,0|2,0,0]=4 13953 B9R1.11 CCC(N)c1ccco1 Amb17061211 [1,0,0,0,1,0|2,0,0]=4 13954 B9R1.11 CCC(N)c1ccco1 Amb35745739 [1,0,0,0,1,0|2,0,0]=4 13955 B9R1.11 CCC(N)c1cccs1 Amb10609665 [1,0,0,0,1,0|2,0,0]=4 13956 B9R1.11 CCC(N)c1cccs1 Amb9703567 [1,0,0,0,1,0|2,0,0]=4 13957 B9R1.11 CCC(N)c1ccoc1 Amb28049070 [1,0,0,0,1,0|2,0,0]=4 13958 B9R1.11 CCC(N)c1ccsc1 Amb18523733 [1,0,0,0,1,0|2,0,0]=4 13959 B9R1.11 CCC(O)c1ccco1 Amb17138369 [1,0,0,0,1,0|2,0,0]=4 13960 B9R1.11 CCC(O)c1cccs1 Amb9358389 [1,0,0,0,1,0|2,0,0]=4 13961 B9R1.11 CCC(O)c1ccoc1 Amb27397356 [1,0,0,0,1,0|2,0,0]=4 13962 B9R1.11 CCC(O)n1cccc1 Amb28189484 [1,0,0,0,1,0|2,0,0]=4 13963 B9R1.11 CCC(S)c1ccco1 Amb27621419 [1,0,0,0,1,0|2,0,0]=4 13964 B9R1.11 CCC(S)c1cccs1 Amb18787791 [1,0,0,0,1,0|2,0,0]=4 13965 B9R1.11 CCC(S)c1ccsc1 Amb26910516 [1,0,0,0,1,0|2,0,0]=4 13966 B9R1.11 CC[C@@H](N)c1cccs1 Amb24666373 [1,0,0,0,1,0|2,0,0]=4 13967 B9R1.11 CC[C@@H](N)c1cccs1 Amb33204429 [1,0,0,0,1,0|2,0,0]=4 13968 B9R1.11 CC[C@H](N)c1ccco1 Amb27946499 [1,0,0,0,1,0|2,0,0]=4 13969 B9R1.11 CC[C@H](N)c1cccs1 Amb26407222 [1,0,0,0,1,0|2,0,0]=4 13970 B9R1.11 CC[C@H](N)c1cccs1 Amb33313563 [1,0,0,0,1,0|2,0,0]=4 13971 B9R1.11 CC[C@H](N)c1ccoc1 Amb27187141 [1,0,0,0,1,0|2,0,0]=4 13972 B9R1.11 CC[C@H](O)c1ccco1 Amb27970619 [1,0,0,0,1,0|2,0,0]=4 13973 B9R1.11 CC[C@H](O)c1cccs1 Amb27837491 [1,0,0,0,1,0|2,0,0]=4 13974 B9R1.11 CC[C@H](O)c1ccsc1 Amb27838764 [1,0,0,0,1,0|2,0,0]=4 13975 B9R1.11 CC[SiH](C)c1ccco1 Amb27849145 [1,0,0,0,1,0|1,1,0]=4 13976 B9R1.11 CNC(C)c1ccco1 Amb9707940 [1,0,0,0,1,0|1,0,0]=3 13977 B9R1.11 CNC(C)c1cccs1 Amb1799863 [1,0,0,0,1,0|1,0,0]=3 13978 B9R1.11 CNC(C)c1cccs1 Amb6344854 [1,0,0,0,1,0|1,0,0]=3 13979 B9R1.11 CNC(C)c1ccns1 Amb27855302 [1,0,0,0,1,0|2,0,0]=4 13980 B9R1.11 CNC(C)c1ccoc1 Amb2234942 [1,0,0,0,1,0|1,0,0]=3 13981 B9R1.11 CNC(C)c1ccon1 Amb9767623 [1,0,0,0,1,0|2,0,0]=4 13982 B9R1.11 CNC(C)c1ccsc1 Amb18288002 [1,0,0,0,1,0|1,0,0]=3 13983 B9R1.11 CNC(C)c1cnsc1 Amb35720011 [1,0,0,0,1,0|2,0,0]=4 13984 B9R1.11 CNC(C)c1cscn1 Amb19648829 [1,0,0,0,1,0|2,0,0]=4 13985 B9R1.11 CNC(C)c1nccs1 Amb18282541 [1,0,0,0,1,0|2,0,0]=4 13986 B9R1.11 CNC(O)c1cccs1 Amb27637082 [1,0,0,0,1,0|2,0,0]=4 13987 B9R1.11 CN[C@@H](C)c1nccs1 Amb28428458 [1,0,0,0,1,0|2,0,0]=4 13988 B9R1.11 C[C@@H](CO)C1=CCC=C1 Amb27959624 [1,0,0,0,1,0|1,0,1]=4 13989 B9R1.11 C[C@@H](CO)c1ccoc1 Amb27470896 [1,0,0,0,1,0|2,0,0]=4 13990 B9R1.11 C[C@H](CO)c1ccsc1 Amb28315476 [1,0,0,0,1,0|2,0,0]=4 13991 B9R1.11 NCC(F)c1ccco1 Amb24573586 [1,0,0,0,1,0|2,0,0]=4 13992 B9R1.11 NCC(F)c1cccs1 Amb25842892 [1,0,0,0,1,0|2,0,0]=4 13993 B9R1.11 NCC(F)c1ccoc1 Amb28341840 [1,0,0,0,1,0|2,0,0]=4 13994 B9R1.11 NCC(F)c1ccsc1 Amb28345598 [1,0,0,0,1,0|2,0,0]=4 13995 B9R1.11 NCC(N)c1ccco1 Amb9380727 [1,0,0,0,1,0|2,0,0]=4 13996 B9R1.11 NCC(N)c1ccoc1 Amb25993149 [1,0,0,0,1,0|2,0,0]=4 13997 B9R1.11 NCC(N)c1ccsc1 Amb9380691 [1,0,0,0,1,0|2,0,0]=4 13998 B9R1.11 NCC(O)c1ccco1 Amb9703775 [1,0,0,0,1,0|2,0,0]=4 13999 B9R1.11 NCC(O)c1cccs1 Amb9703659 [1,0,0,0,1,0|2,0,0]=4 14000 B9R1.11 NCC(O)c1ccoc1 Amb22642021 [1,0,0,0,1,0|2,0,0]=4 14001 B9R1.11 NCC(O)c1ccsc1 Amb1108450 [1,0,0,0,1,0|2,0,0]=4 14002 B9R1.11 NC[C@@H](N)c1ccco1 Amb27768645 [1,0,0,0,1,0|2,0,0]=4 14003 B9R1.11 NC[C@@H](N)c1ccoc1 Amb27872120 [1,0,0,0,1,0|2,0,0]=4 14004 B9R1.11 NC[C@@H](O)c1ccco1 Amb22747769 [1,0,0,0,1,0|2,0,0]=4 14005 B9R1.11 NC[C@@H](O)c1cccs1 Amb25804883 [1,0,0,0,1,0|2,0,0]=4 14006 B9R1.11 NC[C@@H](O)c1ccoc1 Amb33361228 [1,0,0,0,1,0|2,0,0]=4 14007 B9R1.11 NC[C@@H](O)c1ccsc1 Amb26950004 [1,0,0,0,1,0|2,0,0]=4 14008 B9R1.11 NC[C@H](N)c1cccs1 Amb27800048 [1,0,0,0,1,0|2,0,0]=4 14009 B9R1.11 NC[C@H](N)c1ccoc1 Amb28340959 [1,0,0,0,1,0|2,0,0]=4 14010 B9R1.11 NC[C@H](O)c1ccco1 Amb26981556 [1,0,0,0,1,0|2,0,0]=4 14011 B9R1.11 NC[C@H](O)c1cccs1 Amb26419255 [1,0,0,0,1,0|2,0,0]=4 14012 B9R1.11 NC[C@H](O)c1ccoc1 Amb33361229 [1,0,0,0,1,0|2,0,0]=4 14013 B9R1.11 NC[C@H](O)c1ccsc1 Amb25828147 [1,0,0,0,1,0|2,0,0]=4 14014 B9R1.12 CCCCc1ccco1 Amb10070290 [1,0,0,0,1,0|2,0,0]=4 14015 B9R1.12 CCCCc1cccs1 Amb4477470 [1,0,0,0,1,0|2,0,0]=4 14016 B9R1.12 CCCCc1ccsc1 Amb17779303 [1,0,0,0,1,0|2,0,0]=4 14017 B9R1.12 CNCCc1ccco1 Amb17399803 [1,0,0,0,1,0|1,0,0]=3 14018 B9R1.12 CNCCc1cccs1 Amb6712648 [1,0,0,0,1,0|1,0,0]=3 14019 B9R1.12 CNCCc1ccno1 Amb28368791 [1,0,0,0,1,0|2,0,0]=4 14020 B9R1.12 CNCCc1ccns1 Amb28073506 [1,0,0,0,1,0|2,0,0]=4 14021 B9R1.12 CNCCc1ccoc1 Amb25682417 [1,0,0,0,1,0|1,0,0]=3 14022 B9R1.12 CNCCc1ccon1 Amb25078186 [1,0,0,0,1,0|2,0,0]=4 14023 B9R1.12 CNCCc1ccsc1 Amb8853652 [1,0,0,0,1,0|1,0,0]=3 14024 B9R1.12 CNCCc1cnco1 Amb33415561 [1,0,0,0,1,0|2,0,0]=4 14025 B9R1.12 CNCCc1cncs1 Amb26877308 [1,0,0,0,1,0|2,0,0]=4 14026 B9R1.12 CNCCc1cnsc1 Amb30020095 [1,0,0,0,1,0|2,0,0]=4 14027 B9R1.12 CNCCc1cscn1 Amb8009872 [1,0,0,0,1,0|2,0,0]=4 14028 B9R1.12 CNCCc1ncco1 Amb18222315 [1,0,0,0,1,0|2,0,0]=4 14029 B9R1.12 CNCCc1nccs1 Amb8009874 [1,0,0,0,1,0|2,0,0]=4 14030 B9R1.12 CNCCn1cccc1 Amb18994357 [1,0,0,0,1,0|1,0,0]=3 14031 B9R1.12 CNCCn1cccn1 Amb18299424 [1,0,0,0,1,0|2,0,0]=4 14032 B9R1.12 CNCCn1cccn1 Amb33801434 [1,0,0,0,1,0|2,0,0]=4 14033 B9R1.12 CNCCn1ccnc1 Amb22586829 [1,0,0,0,1,0|2,0,0]=4 14034 B9R1.12 CNCCn1ccnc1 Amb5559946 [1,0,0,0,1,0|2,0,0]=4 14035 B9R1.12 CNNCc1ccco1 Amb27463559 [1,0,0,0,1,0|2,0,0]=4 14036 B9R1.12 COCCC1=CC=CC1 Amb27806849 [1,0,0,0,1,0|1,0,1]=4 14037 B9R1.12 COCCc1ccsc1 Amb27843682 [1,0,0,0,1,0|2,0,0]=4 14038 B9R1.12 CSCCc1ccco1 Amb27438612 [1,0,0,0,1,0|2,0,0]=4 14039 B9R1.12 CSCCc1cccs1 Amb27443874 [1,0,0,0,1,0|2,0,0]=4 14040 B9R1.12 NNCCc1cccs1 Amb6242818 [1,0,0,0,1,0|2,0,0]=4 14041 B9R1.12 NNCCc1ccsc1 Amb6744631 [1,0,0,0,1,0|2,0,0]=4 14042 B13R1.42 C=CCC(C)NCc1ccccc1 Amb18127528 [0,0,0,0,0,2|1,0,1]=4 14043 B13R1.42 CC(C#Cc1ccccc1)CC=O Amb27238581 [0,0,0,0,0,2|2,0,0]=4 14044 B13R1.42 CC(CC#N)NCc1ccccc1 Amb17334998 [0,0,0,0,0,2|2,0,0]=4 14045 B13R1.42 CC(CCBr)NCc1ccccc1 Amb27443745 [0,0,0,0,0,2|2,0,0]=4 14046 B13R1.42 CC(CCCl)OCc1ccccc1 Amb27865562 [0,0,0,0,0,2|2,0,0]=4 14047 B13R1.42 CC(CCO)CCc1ccccc1 Amb533017 [0,0,0,0,0,2|2,0,0]=4 14048 B13R1.42 CC(CCO)NCc1ccccc1 Amb18128514 [0,0,0,0,0,2|2,0,0]=4 14049 B13R1.42 CC(CCO)OCc1ccccc1 Amb24533309 [0,0,0,0,0,2|2,0,0]=4 14050 B13R1.42 CC(\C=C\c1ccccc1)CCN Amb33081133 [0,0,0,0,0,2|2,0,0]=4 14051 B13R1.42 CC(\C=C\c1ccccc1)CON Amb33080786 [0,0,0,0,0,2|2,0,0]=4 14052 B13R1.42 CCCC(C)CNc1cccnc1 Amb6719794 [0,0,0,0,0,2|2,0,0]=4 14053 B13R1.42 CCCC(C)NCc1ccccc1 Amb21959687 [0,0,0,0,0,2|1,0,0]=3 14054 B13R1.42 CCCC(C)NCc1ccccc1 Amb9743669 [0,0,0,0,0,2|1,0,0]=3 14055 B13R1.42 CCCC(N)CCc1ccccc1 Amb9031789 [0,0,0,0,0,2|2,0,0]=4 14056 B13R1.42 CCCC(O)C#Cc1ccccc1 Amb2721603 [0,0,0,0,0,2|2,0,0]=4 14057 B13R1.42 CCCC(O)NCc1ccccc1 Amb27407815 [0,0,0,0,0,2|2,0,0]=4 14058 B13R1.42 CCC[C@H](O)C#Cc1ccccc1 Amb27448468 [0,0,0,0,0,2|2,0,0]=4 14059 B13R1.42 CCC\C(C)=N\Nc1ccccc1 Amb27806061 [0,0,0,0,0,2|1,0,1]=4 14060 B13R1.42 CCOC(C)OCc1ccccc1 Amb28247923 [0,0,0,0,0,2|2,0,0]=4 14061 B13R1.42 CCSC(C)OCc1ccccc1 Amb28292482 [0,0,0,0,0,2|2,0,0]=4 14062 B13R1.42 CNCC(=O)NCc1ccccc1 Amb21959039 [0,0,0,0,0,2|1,0,1]=4 14063 B13R1.42 CNCC(=O)NCc1ccccc1 Amb6276572 [0,0,0,0,0,2|1,0,1]=4 14064 B13R1.42 CNCC(=O)OCc1ccccc1 Amb18809175 [0,0,0,0,0,2|1,0,1]=4 14065 B13R1.42 CNCC(=O)OCc1ccccc1 Amb21929370 [0,0,0,0,0,2|1,0,1]=4 14066 B13R1.42 CNCC(=O)OCc1ccccc1 Amb22002169 [0,0,0,0,0,2|1,0,1]=4 14067 B13R1.42 CNCC(=O)\C=C\c1ccccc1 Amb33081764 [0,0,0,0,0,2|1,0,1]=4 14068 B13R1.42 CNCC(O)C#Cc1ccccc1 Amb27862785 [0,0,0,0,0,2|1,0,0]=3 14069 B13R1.42 CNCC(O)COc1ccccc1 Amb9741108 [0,0,0,0,0,2|1,0,0]=3 14070 B13R1.42 CNCC(O)\C=C\c1ccccc1 Amb33081784 [0,0,0,0,0,2|1,0,0]=3 14071 B13R1.42 COCC(C)NCc1ccccc1 Amb6689699 [0,0,0,0,0,2|1,0,0]=3 14072 B13R1.42 COCC(C)NCc1ccccn1 Amb6689718 [0,0,0,0,0,2|2,0,0]=4 14073 B13R1.42 COCC(C)NCc1cccnc1 Amb6689551 [0,0,0,0,0,2|2,0,0]=4 14074 B13R1.42 COCC(C)NCc1ccncc1 Amb6689557 [0,0,0,0,0,2|2,0,0]=4 14075 B13R1.42 COCC(O)CNc1ccccc1 Amb2721933 [0,0,0,0,0,2|2,0,0]=4 14076 B13R1.42 COC[C@@H](C)NCc1ccccc1 Amb28345204 [0,0,0,0,0,2|1,0,0]=3 14077 B13R1.42 CSCC(N)C#Cc1ccccc1 Amb27875282 [0,0,0,0,0,2|2,0,0]=4 14078 B13R1.42 C[C@@H](CCO)NCc1ccccc1 Amb27179186 [0,0,0,0,0,2|2,0,0]=4 14079 B13R1.42 C[C@H](CC=O)OCc1ccccc1 Amb27755041 [0,0,0,0,0,2|2,0,0]=4 14080 B13R1.42 C\C=C\[C@H](C)NCc1ccccc1 Amb27390054 [0,0,0,0,0,2|1,0,1]=4