0 B11R1.16 BrCCC(Br)c1ccccc1 Amb23456167 [0,0,0,0,0,0|3,0,1]=4 1 B11R1.16 C#CCC(=O)c1cc[n]cc1 Amb24476563 [0,0,0,0,0,0|2,0,2]=4 2 B11R1.16 C#CCC(=O)c1cccc[n]1 Amb24476562 [0,0,0,0,0,0|2,0,2]=4 3 B11R1.16 C#CCS(=O)c1ccccc1 Amb25241742 [0,0,0,0,0,0|2,0,2]=4 4 B11R1.16 C#COC(=O)c1cc[n]cc1 Amb24099556 [0,0,0,0,0,0|1,0,2]=3 5 B11R1.16 C#COC(=O)c1ccccc1 Amb25084221 [0,0,0,0,0,0|0,0,2]=2 6 B11R1.16 C=C(N=C=O)c1ccccc1 Amb24740951 [0,0,0,0,0,0|3,0,1]=4 7 B11R1.16 C=C=CC(=O)c1ccccc1 Amb25053112 [0,0,0,0,0,0|1,0,2]=3 8 B11R1.16 C=CCC(=O)c1ccccc1 Amb17334260 [0,0,0,0,0,0|1,0,2]=3 9 B11R1.16 C=CCC(=O)c1ccccn1 Amb17334265 [0,0,0,0,0,0|2,0,2]=4 10 B11R1.16 C=CCC(=O)c1cccnc1 Amb17334267 [0,0,0,0,0,0|2,0,2]=4 11 B11R1.16 C=CCC(=O)c1ccncc1 Amb17334269 [0,0,0,0,0,0|2,0,2]=4 12 B11R1.16 C=CCS(=O)c1ccccc1 Amb17933936 [0,0,0,0,0,0|2,0,2]=4 13 B11R1.16 C=CC[S@@](=O)c1ccccc1 Amb22747466 [0,0,0,0,0,0|2,0,2]=4 14 B11R1.16 C=CNC(=O)c1ccc[n]c1 Amb24715715 [0,0,0,0,0,0|2,0,2]=4 15 B11R1.16 C=CNC(=O)c1ccccc1 Amb24096819 [0,0,0,0,0,0|1,0,2]=3 16 B11R1.16 C=COC(=O)c1cc[n]cc1 Amb24099554 [0,0,0,0,0,0|1,0,2]=3 17 B11R1.16 C=COC(=O)c1ccc[n]c1 Amb24062392 [0,0,0,0,0,0|1,0,2]=3 18 B11R1.16 C=COC(=O)c1cccc[n]1 Amb24061334 [0,0,0,0,0,0|1,0,2]=3 19 B11R1.16 C=COC(=O)c1ccccc1 Amb10807409 [0,0,0,0,0,0|0,0,2]=2 20 B11R1.16 CC#CC(=O)c1cc[n]cc1 Amb25112662 [0,0,0,0,0,0|2,0,1]=3 21 B11R1.16 CC#CC(=O)c1ccccc1 Amb17593622 [0,0,0,0,0,0|1,0,1]=2 22 B11R1.16 CC#CC(N)c1ccccc1 Amb25113894 [0,0,0,0,0,0|2,0,2]=4 23 B11R1.16 CC#CC(O)c1ccccc1 Amb25148346 [0,0,0,0,0,0|1,0,3]=4 24 B11R1.16 CC#C[C@@H](O)c1ccccc1 Amb25188578 [0,0,0,0,0,0|1,0,3]=4 25 B11R1.16 CC(=CCC)c1ccccc1 Amb22228912 [0,0,0,0,0,0|2,0,0]=2 26 B11R1.16 CC(CCN)c1ccccc1 Amb17991256 [0,0,0,0,0,0|3,0,1]=4 27 B11R1.16 CC(OC=C)c1ccccc1 Amb22522122 [0,0,0,0,0,0|1,0,3]=4 28 B11R1.16 CC(OC=O)c1ccccc1 Amb22735162 [0,0,0,0,0,0|2,0,2]=4 29 B11R1.16 CC(OCO)c1ccccc1 Amb24613529 [0,0,0,0,0,0|2,0,1]=3 30 B11R1.16 CC(SCCl)c1ccccc1 Amb24487902 [0,0,0,0,0,0|2,1,1]=4 31 B11R1.16 CC=CC(O)c1ccccc1 Amb22228005 [0,0,0,0,0,0|1,0,3]=4 32 B11R1.16 CCCC(=C)c1ccccc1 Amb24669524 [0,0,0,0,0,0|2,0,0]=2 33 B11R1.16 CCCC(=O)c1[n]ccc[n]1 Amb18179375 [0,0,0,0,0,0|3,0,0]=3 34 B11R1.16 CCCC(=O)c1c[n]c[n]c1 Amb18182735 [0,0,0,0,0,0|3,0,0]=3 35 B11R1.16 CCCC(=O)c1c[n]cc[n]1 Amb18791460 [0,0,0,0,0,0|3,0,0]=3 36 B11R1.16 CCCC(=O)c1cc[n][n]c1 Amb24454043 [0,0,0,0,0,0|3,0,0]=3 37 B11R1.16 CCCC(=O)c1cc[n]cc1 Amb22235246 [0,0,0,0,0,0|2,0,0]=2 38 B11R1.16 CCCC(=O)c1cccnc1 Amb17232054 [0,0,0,0,0,0|2,0,0]=2 39 B11R1.16 CCCC(Br)c1cccc[n]1 Amb25675709 [0,0,0,0,0,0|3,0,1]=4 40 B11R1.16 CCCC(Cl)c1cc[n]cc1 Amb24102654 [0,0,0,0,0,0|3,0,1]=4 41 B11R1.16 CCCC(N)c1c[n]ccc1 Amb18984960 [0,0,0,0,0,0|3,0,1]=4 42 B11R1.16 CCCC(N)c1cc[n]cc1 Amb18984961 [0,0,0,0,0,0|3,0,1]=4 43 B11R1.16 CCCC(N)c1cccc[n]1 Amb18984959 [0,0,0,0,0,0|3,0,1]=4 44 B11R1.16 CCCC(O)c1cc[n]cc1 Amb18179398 [0,0,0,0,0,0|2,0,2]=4 45 B11R1.16 CCCC(O)c1cccc[n]1 Amb18179397 [0,0,0,0,0,0|2,0,2]=4 46 B11R1.16 CCCC(c1ccccc1)[NH3+] Amb10560246 [0,0,0,0,0,0|2,0,1]=3 47 B11R1.16 CCCC(c1cccnc1)O Amb17232090 [0,0,0,0,0,0|2,0,2]=4 48 B11R1.16 CCCN(C)c1cccc[n]1 Amb24719444 [0,0,0,0,0,0|4,0,0]=4 49 B11R1.16 CCCN(O)c1ccccc1 Amb25349642 [0,0,0,0,0,0|2,0,1]=3 50 B11R1.16 CCC[C@@H](N)c1c[n]ccc1 Amb24617547 [0,0,0,0,0,0|3,0,1]=4 51 B11R1.16 CCC[C@@H](N)c1ccccc1 Amb22388605 [0,0,0,0,0,0|2,0,1]=3 52 B11R1.16 CCC[C@@H](O)c1cc[n]cc1 Amb24429371 [0,0,0,0,0,0|2,0,2]=4 53 B11R1.16 CCC[C@@H](O)c1cccc[n]1 Amb25795692 [0,0,0,0,0,0|2,0,2]=4 54 B11R1.16 CCC[C@@H](O)c1ccccc1 Amb22338826 [0,0,0,0,0,0|1,0,2]=3 55 B11R1.16 CCC[C@H](N)c1cccc[n]1 Amb25836783 [0,0,0,0,0,0|3,0,1]=4 56 B11R1.16 CCC[C@H](N)c1ccccc1 Amb20241164 [0,0,0,0,0,0|2,0,1]=3 57 B11R1.16 CCC[C@H](N)c1ccccc1 Amb23385315 [0,0,0,0,0,0|2,0,1]=3 58 B11R1.16 CCC[C@H](O)c1c[n]ccc1 Amb25845549 [0,0,0,0,0,0|2,0,2]=4 59 B11R1.16 CCC[C@H](O)c1cc[n]cc1 Amb24414462 [0,0,0,0,0,0|2,0,2]=4 60 B11R1.16 CCC[C@H](O)c1ccccc1 Amb22338698 [0,0,0,0,0,0|1,0,2]=3 61 B11R1.16 CCC[C@H](c1ccccc1)N Amb16233791 [0,0,0,0,0,0|2,0,1]=3 62 B11R1.16 CCNC(=N)c1c[n]cc[n]1 Amb24477665 [0,0,0,0,0,0|4,0,0]=4 63 B11R1.16 CCNC(=N)c1ccccc1 Amb23447118 [0,0,0,0,0,0|2,0,0]=2 64 B11R1.16 CCNC(=N)c1ccccn1 Amb11014511 [0,0,0,0,0,0|3,0,0]=3 65 B11R1.16 CCNC(=N)c1cccnc1 Amb11014521 [0,0,0,0,0,0|3,0,0]=3 66 B11R1.16 CCNC(=N)c1ccncc1 Amb11014517 [0,0,0,0,0,0|3,0,0]=3 67 B11R1.16 CCNC(=O)c1[n]ccc[n]1 Amb25857132 [0,0,0,0,0,0|3,0,0]=3 68 B11R1.16 CCNC(=O)c1cc[n]c[n]1 Amb24673220 [0,0,0,0,0,0|3,0,0]=3 69 B11R1.16 CCNC(=O)c1cnccn1 Amb17797235 [0,0,0,0,0,0|3,0,0]=3 70 B11R1.16 CCNC(=S)c1c[n]cc[n]1 Amb25729910 [0,0,0,0,0,0|3,1,0]=4 71 B11R1.16 CCNC(C)c1cc[n]cc1 Amb19515613 [0,0,0,0,0,0|3,0,1]=4 72 B11R1.16 CCNC(c1ccccc1)C Amb1771733 [0,0,0,0,0,0|2,0,1]=3 73 B11R1.16 CCN[C@H](C)c1c[n]ccc1 Amb25114990 [0,0,0,0,0,0|3,0,1]=4 74 B11R1.16 CCN[C@H](C)c1ccccc1 Amb24363134 [0,0,0,0,0,0|2,0,1]=3 75 B11R1.16 CCOC(=C)c1[n]ccc[n]1 Amb24533755 [0,0,0,0,0,0|3,0,0]=3 76 B11R1.16 CCOC(=C)c1c[n]c[n]c1 Amb24070702 [0,0,0,0,0,0|3,0,0]=3 77 B11R1.16 CCOC(=C)c1ccccc1 Amb24495644 [0,0,0,0,0,0|1,0,0]=1 78 B11R1.16 CCOC(=N)c1[n]ccc[n]1 Amb18179393 [0,0,0,0,0,0|3,0,0]=3 79 B11R1.16 CCOC(=N)c1c[n]cc[n]1 Amb18179394 [0,0,0,0,0,0|3,0,0]=3 80 B11R1.16 CCOC(=N)c1cc[n]c[n]1 Amb24626972 [0,0,0,0,0,0|3,0,0]=3 81 B11R1.16 CCOC(=N)c1cc[n]cc1 Amb18179378 [0,0,0,0,0,0|2,0,0]=2 82 B11R1.16 CCOC(=N)c1ccc[n]c1 Amb18179379 [0,0,0,0,0,0|2,0,0]=2 83 B11R1.16 CCOC(=N)c1cccc[n]1 Amb18791461 [0,0,0,0,0,0|2,0,0]=2 84 B11R1.16 CCOC(=N)c1ccccc1 Amb17666955 [0,0,0,0,0,0|1,0,0]=1 85 B11R1.16 CCOC(=O)C1=CCC=CC1 Amb17611462 [0,0,0,0,0,0|0,0,2]=2 86 B11R1.16 CCOC(=O)C1=CCCCN1 Amb24061335 [0,0,0,0,0,0|1,0,3]=4 87 B11R1.16 CCOC(=O)C1=CCCCO1 Amb25711566 [0,0,0,0,0,0|1,0,3]=4 88 B11R1.16 CCOC(=O)C1=CCOC=C1 Amb15692807 [0,0,0,0,0,0|1,0,1]=2 89 B11R1.16 CCOC(=O)C1=CNCCN1 Amb24103479 [0,0,0,0,0,0|2,0,2]=4 90 B11R1.16 CCOC(=O)C1=COCCO1 Amb24408068 [0,0,0,0,0,0|2,0,2]=4 91 B11R1.16 CCOC(=O)C1CC=CCO1 Amb24538222 [0,0,0,0,0,0|1,0,3]=4 92 B11R1.16 CCOC(=O)C1CC=CN=N1 Amb24062285 [0,0,0,0,0,0|2,0,2]=4 93 B11R1.16 CCOC(=O)C1CC=CNC1 Amb24062394 [0,0,0,0,0,0|1,0,3]=4 94 B11R1.16 CCOC(=O)C1CCC=CC1 Amb16230893 [0,0,0,0,0,0|0,0,4]=4 95 B11R1.16 CCOC(=O)C1CCC=CO1 Amb23439138 [0,0,0,0,0,0|1,0,3]=4 96 B11R1.16 CCOC(=O)C=1C=CCON1 Amb24095626 [0,0,0,0,0,0|2,0,1]=3 97 B11R1.16 CCOC(=O)C=1CCCC=C1 Amb24528878 [0,0,0,0,0,0|0,0,4]=4 98 B11R1.16 CCOC(=O)C=1CCCCC1 Amb24612358 [0,0,0,0,0,0|0,0,4]=4 99 B11R1.16 CCOC(=O)C=1CCCNC1 Amb22232458 [0,0,0,0,0,0|1,0,3]=4 100 B11R1.16 CCOC(=O)C=1CCCOC1 Amb24532943 [0,0,0,0,0,0|1,0,3]=4 101 B11R1.16 CCOC(=O)C=1CCNCC1 Amb18644730 [0,0,0,0,0,0|1,0,3]=4 102 B11R1.16 CCOC(=O)C=1CCOCC1 Amb25344436 [0,0,0,0,0,0|1,0,3]=4 103 B11R1.16 CCOC(=O)C=1CNCCC1 Amb24117865 [0,0,0,0,0,0|1,0,3]=4 104 B11R1.16 CCOC(=O)C=1CNCCC1 Amb25726082 [0,0,0,0,0,0|1,0,3]=4 105 B11R1.16 CCOC(=O)C=1COCCC1 Amb24178914 [0,0,0,0,0,0|1,0,3]=4 106 B11R1.16 CCOC(=O)N1C=CCC=C1 Amb24060183 [0,0,0,0,0,0|1,0,1]=2 107 B11R1.16 CCOC(=O)N1CC=CC=C1 Amb24060015 [0,0,0,0,0,0|1,0,1]=2 108 B11R1.16 CCOC(=O)N1CC=CCN1 Amb22486323 [0,0,0,0,0,0|2,0,2]=4 109 B11R1.16 CCOC(=O)N1CCCC=C1 Amb24667994 [0,0,0,0,0,0|1,0,3]=4 110 B11R1.16 CCOC(=O)c1[n]c[n]c[n]1 Amb24060635 [0,0,0,0,0,0|3,0,0]=3 111 B11R1.16 CCOC(=O)c1[n]ccc[n]1 Amb19930079 [0,0,0,0,0,0|2,0,0]=2 112 B11R1.16 CCOC(=O)c1c[n][n]c[n]1 Amb24060428 [0,0,0,0,0,0|3,0,0]=3 113 B11R1.16 CCOC(=O)c1ccc[n][n]1 Amb22494293 [0,0,0,0,0,0|2,0,0]=2 114 B11R1.16 CCOC(=O)c1ccccc1 Amb22367067 [0,0,0,0,0,0|0,0,0]=0 115 B11R1.16 CCOC(=O)c1ccncc1 Amb1210124 [0,0,0,0,0,0|1,0,0]=1 116 B11R1.16 CCOC(=O)c1nccnn1 Amb10604457 [0,0,0,0,0,0|3,0,0]=3 117 B11R1.16 CCOC(=[NH2+])c1ccccc1 Amb22445379 [0,0,0,0,0,0|1,0,0]=1 118 B11R1.16 CCOC(C)c1c[n]ccc1 Amb24085116 [0,0,0,0,0,0|2,0,1]=3 119 B11R1.16 CCOC(C)c1ccccc1 Amb17940188 [0,0,0,0,0,0|1,0,1]=2 120 B11R1.16 CCOC(Cl)c1ccccc1 Amb24419639 [0,0,0,0,0,0|1,0,1]=2 121 B11R1.16 CCOC(O)c1c[n]ccc1 Amb24379956 [0,0,0,0,0,0|1,0,2]=3 122 B11R1.16 CCOC(O)c1cccc[n]1 Amb25057798 [0,0,0,0,0,0|1,0,2]=3 123 B11R1.16 CCOP(=O)c1cccc[n]1 Amb24563590 [0,0,0,0,0,0|2,0,0]=2 124 B11R1.16 CCOP(=O)c1ccccc1 Amb10601587 [0,0,0,0,0,0|1,0,0]=1 125 B11R1.16 CCO[13C](=O)[13c]1[13cH][13cH][13cH][n][13cH]1 Amb22055230 [0,0,0,0,0,0|1,0,0]=1 126 B11R1.16 CCSC(=O)c1c[n]cc[n]1 Amb24579075 [0,0,0,0,0,0|2,1,0]=3 127 B11R1.16 CCSC(C)c1c[n]ccc1 Amb25099407 [0,0,0,0,0,0|2,1,1]=4 128 B11R1.16 CCSC(Cl)c1ccccc1 Amb25109977 [0,0,0,0,0,0|1,1,1]=3 129 B11R1.16 CC\N=C(/N)\c1c[n]ccc1 Amb21970333 [0,0,0,0,0,0|3,0,0]=3 130 B11R1.16 CC\N=C(\Cl)/c1ccccc1 Amb24463735 [0,0,0,0,0,0|2,0,0]=2 131 B11R1.16 CN(CCBr)c1ccccc1 Amb24477466 [0,0,0,0,0,0|4,0,0]=4 132 B11R1.16 CN(CCF)c1ccccc1 Amb24485344 [0,0,0,0,0,0|4,0,0]=4 133 B11R1.16 CNCC(=C)c1ccccc1 Amb18124860 [0,0,0,0,0,0|3,0,0]=3 134 B11R1.16 CNCC(=O)c1c[n]cc[n]1 Amb21862013 [0,0,0,0,0,0|4,0,0]=4 135 B11R1.16 CNCC(Br)c1ccccc1 Amb25224394 [0,0,0,0,0,0|3,0,1]=4 136 B11R1.16 CNCC(F)c1ccccc1 Amb24710254 [0,0,0,0,0,0|3,0,1]=4 137 B11R1.16 CNCC(N)c1ccccc1 Amb18290185 [0,0,0,0,0,0|3,0,1]=4 138 B11R1.16 CNCC(S)c1ccccc1 Amb25685409 [0,0,0,0,0,0|2,1,1]=4 139 B11R1.16 CNCC(c1ccccc1)C Amb17619365 [0,0,0,0,0,0|3,0,1]=4 140 B11R1.16 CNCC(c1ccccc1)N Amb13883001 [0,0,0,0,0,0|3,0,1]=4 141 B11R1.16 CNC[C@@H](N)c1ccccc1 Amb24487965 [0,0,0,0,0,0|3,0,1]=4 142 B11R1.16 CNC[C@H](C)c1ccccc1 Amb24399611 [0,0,0,0,0,0|3,0,1]=4 143 B11R1.16 CNC[C@H](N)c1ccccc1 Amb25040662 [0,0,0,0,0,0|3,0,1]=4 144 B11R1.16 CNC[C@H](O)c1ccccc1 Amb25674653 [0,0,0,0,0,0|2,0,2]=4 145 B11R1.16 CNN=C(N)c1ccccc1 Amb20623020 [0,0,0,0,0,0|3,0,0]=3 146 B11R1.16 CNNC(=N)c1ccc[n]c1 Amb25690466 [0,0,0,0,0,0|4,0,0]=4 147 B11R1.16 CNNC(=N)c1cccc[n]1 Amb24516890 [0,0,0,0,0,0|4,0,0]=4 148 B11R1.16 CNNC(=O)c1[n]ccc[n]1 Amb22749170 [0,0,0,0,0,0|4,0,0]=4 149 B11R1.16 CNNC(=O)c1c[n]cc[n]1 Amb24096714 [0,0,0,0,0,0|4,0,0]=4 150 B11R1.16 CNNC(=O)c1ccc[n][n]1 Amb25092822 [0,0,0,0,0,0|4,0,0]=4 151 B11R1.16 CNNC(=O)c1ccc[n]c1 Amb25216264 [0,0,0,0,0,0|3,0,0]=3 152 B11R1.16 CNNC(=O)c1ccccc1 Amb24096729 [0,0,0,0,0,0|2,0,0]=2 153 B11R1.16 CNNC(=S)c1ccccc1 Amb25084578 [0,0,0,0,0,0|2,1,0]=3 154 B11R1.16 CNNC(Br)c1ccccc1 Amb24643804 [0,0,0,0,0,0|3,0,1]=4 155 B11R1.16 CNOC(=O)c1ccccc1 Amb25240574 [0,0,0,0,0,0|1,0,0]=1 156 B11R1.16 CN\N=C(\Br)/c1cc[n]cc1 Amb25785501 [0,0,0,0,0,0|4,0,0]=4 157 B11R1.16 COCC(=O)c1c[n]c[n]c1 Amb18182775 [0,0,0,0,0,0|4,0,0]=4 158 B11R1.16 COCC(=O)c1cc[n][n]c1 Amb25756900 [0,0,0,0,0,0|4,0,0]=4 159 B11R1.16 COCC(=O)c1cc[n]c[n]1 Amb25339017 [0,0,0,0,0,0|4,0,0]=4 160 B11R1.16 COCC(=O)c1ccc[n]c1 Amb18179389 [0,0,0,0,0,0|3,0,0]=3 161 B11R1.16 COCC(=O)c1ccccn1 Amb10607921 [0,0,0,0,0,0|3,0,0]=3 162 B11R1.16 COCC(C)c1ccccc1 Amb24079980 [0,0,0,0,0,0|3,0,1]=4 163 B11R1.16 COCC(Cl)c1ccccc1 Amb24509304 [0,0,0,0,0,0|3,0,1]=4 164 B11R1.16 COCC(O)c1ccccc1 Amb18791504 [0,0,0,0,0,0|2,0,2]=4 165 B11R1.16 COCC(S)c1ccccc1 Amb25698414 [0,0,0,0,0,0|2,1,1]=4 166 B11R1.16 COCC(c1ccccc1)N Amb1134749 [0,0,0,0,0,0|3,0,1]=4 167 B11R1.16 COCC(c1ccccc1)N Amb13952604 [0,0,0,0,0,0|3,0,1]=4 168 B11R1.16 COC[C@@H](O)c1ccccc1 Amb22746575 [0,0,0,0,0,0|2,0,2]=4 169 B11R1.16 COC[C@H](N)c1ccccc1 Amb22737495 [0,0,0,0,0,0|3,0,1]=4 170 B11R1.16 COC[C@H](c1ccccc1)N Amb17061641 [0,0,0,0,0,0|3,0,1]=4 171 B11R1.16 CONC(=O)c1c[n]cc[n]1 Amb24096696 [0,0,0,0,0,0|4,0,0]=4 172 B11R1.16 CONC(=O)c1cc[n][n]c1 Amb24486737 [0,0,0,0,0,0|4,0,0]=4 173 B11R1.16 CONC(=O)c1cccc[n]1 Amb25829451 [0,0,0,0,0,0|3,0,0]=3 174 B11R1.16 CONC(=O)c1ccccc1 Amb16969913 [0,0,0,0,0,0|2,0,0]=2 175 B11R1.16 CONC(=O)c1cccnc1 Amb16980469 [0,0,0,0,0,0|3,0,0]=3 176 B11R1.16 CONC(=O)c1ccncc1 Amb16980470 [0,0,0,0,0,0|3,0,0]=3 177 B11R1.16 CONC(C)c1ccccc1 Amb22896960 [0,0,0,0,0,0|3,0,1]=4 178 B11R1.16 CO\N=C(/N)\c1c[n]ccc1 Amb18224285 [0,0,0,0,0,0|4,0,0]=4 179 B11R1.16 CO\N=C(/N)\c1cc[n]cc1 Amb18224286 [0,0,0,0,0,0|4,0,0]=4 180 B11R1.16 CO\N=C(/N)\c1cccc[n]1 Amb18224284 [0,0,0,0,0,0|4,0,0]=4 181 B11R1.16 CO\N=C(/N)\c1ccccc1 Amb18224270 [0,0,0,0,0,0|3,0,0]=3 182 B11R1.16 CO\N=C(\c1ccccc1)/C Amb10572535 [0,0,0,0,0,0|3,0,0]=3 183 B11R1.16 CP(CCN)c1ccccc1 Amb25685240 [0,0,0,0,0,0|4,0,0]=4 184 B11R1.16 CSCC(=O)c1[n]ccc[n]1 Amb25804270 [0,0,0,0,0,0|4,0,0]=4 185 B11R1.16 CSCC(=O)c1c[n]c[n]c1 Amb18182678 [0,0,0,0,0,0|4,0,0]=4 186 B11R1.16 CSCC(=O)c1c[n]cc[n]1 Amb24723134 [0,0,0,0,0,0|4,0,0]=4 187 B11R1.16 CSCC(=O)c1cc[n]cc1 Amb22730530 [0,0,0,0,0,0|3,0,0]=3 188 B11R1.16 CSCC(=O)c1ccc[n]c1 Amb18182650 [0,0,0,0,0,0|3,0,0]=3 189 B11R1.16 CSCC(C)c1ccccc1 Amb25143821 [0,0,0,0,0,0|3,0,1]=4 190 B11R1.16 CSCC(N)c1ccccc1 Amb18300065 [0,0,0,0,0,0|3,0,1]=4 191 B11R1.16 CSCC(O)c1ccccc1 Amb18793198 [0,0,0,0,0,0|2,0,2]=4 192 B11R1.16 CSC[C@@H](N)c1ccccc1 Amb25368447 [0,0,0,0,0,0|3,0,1]=4 193 B11R1.16 C[C@@H](CCBr)c1ccccc1 Amb24395063 [0,0,0,0,0,0|3,0,1]=4 194 B11R1.16 C[C@H](CCBr)c1ccccc1 Amb25690423 [0,0,0,0,0,0|3,0,1]=4 195 B11R1.16 C[C@H](CCO)c1ccccc1 Amb24371178 [0,0,0,0,0,0|3,0,1]=4 196 B11R1.16 C[NH2+]OC(=O)c1ccccc1 Amb22352804 [0,0,0,0,0,0|1,0,0]=1 197 B11R1.16 C\C(=C/CC)\c1ccccc1 Amb25151168 [0,0,0,0,0,0|2,0,0]=2 198 B11R1.16 C\C(=C/CN)\c1ccccc1 Amb23555622 [0,0,0,0,0,0|3,0,0]=3 199 B11R1.16 C\C(=C/CO)\c1cccc[n]1 Amb24373086 [0,0,0,0,0,0|4,0,0]=4 200 B11R1.16 C\C(=C\C#N)\c1ccccc1 Amb25720664 [0,0,0,0,0,0|3,0,1]=4 201 B11R1.16 C\C(=C\C=O)\c1ccccc1 Amb25124926 [0,0,0,0,0,0|3,0,1]=4 202 B11R1.16 C\C(=C\CC)\c1cccc[n]1 Amb24101998 [0,0,0,0,0,0|3,0,0]=3 203 B11R1.16 C\C(=C\CCl)\c1ccccc1 Amb24579744 [0,0,0,0,0,0|3,0,0]=3 204 B11R1.16 C\C(=C\CN)\c1cc[n]cc1 Amb25145811 [0,0,0,0,0,0|4,0,0]=4 205 B11R1.16 C\C(=C\CN)\c1cccc[n]1 Amb24538112 [0,0,0,0,0,0|4,0,0]=4 206 B11R1.16 C\C(=C\CN)\c1ccccc1 Amb25145810 [0,0,0,0,0,0|3,0,0]=3 207 B11R1.16 C\C(=C\CO)\c1cccc[n]1 Amb24563551 [0,0,0,0,0,0|4,0,0]=4 208 B11R1.16 C\C(=N\CO)\c1cccc[n]1 Amb24069128 [0,0,0,0,0,0|4,0,0]=4 209 B11R1.16 C\C(=N\NC)\c1cc[n]cc1 Amb25129259 [0,0,0,0,0,0|4,0,0]=4 210 B11R1.16 C\C(=N\NC)\c1cccc[n]1 Amb24101916 [0,0,0,0,0,0|4,0,0]=4 211 B11R1.16 C\C(=N\NC)\c1ccccc1 Amb25099332 [0,0,0,0,0,0|3,0,0]=3 212 B11R1.16 C\C(=N\OC)\c1c[n]ccc1 Amb25751938 [0,0,0,0,0,0|4,0,0]=4 213 B11R1.16 C\C(=N\OC)\c1cc[n]cc1 Amb25796012 [0,0,0,0,0,0|4,0,0]=4 214 B11R1.16 C\C(=N\OC)\c1cccc[n]1 Amb24353963 [0,0,0,0,0,0|4,0,0]=4 215 B11R1.16 C\C(=N\OC)\c1ccccc1 Amb25189562 [0,0,0,0,0,0|3,0,0]=3 216 B11R1.16 C\C=C/C(=O)c1cc[n]cc1 Amb24425402 [0,0,0,0,0,0|2,0,1]=3 217 B11R1.16 C\C=C\C(=O)c1c[n]cc[n]1 Amb25149487 [0,0,0,0,0,0|3,0,1]=4 218 B11R1.16 C\C=C\C(=O)c1cc[n]cc1 Amb24408944 [0,0,0,0,0,0|2,0,1]=3 219 B11R1.16 C\C=C\C(=O)c1ccc[n]c1 Amb25712944 [0,0,0,0,0,0|2,0,1]=3 220 B11R1.16 C\C=C\C(=O)c1cccc[n]1 Amb25179680 [0,0,0,0,0,0|2,0,1]=3 221 B11R1.16 C\C=C\C(=O)c1ccccc1 Amb10574126 [0,0,0,0,0,0|1,0,1]=2 222 B11R1.16 C\C=C\C(N)c1ccccc1 Amb18124850 [0,0,0,0,0,0|2,0,2]=4 223 B11R1.16 C\C=C\[C@@H](O)c1ccccc1 Amb25760539 [0,0,0,0,0,0|1,0,3]=4 224 B11R1.16 C\C=C\[C@H](O)c1ccccc1 Amb25190477 [0,0,0,0,0,0|1,0,3]=4 225 B11R1.16 C\C=N/C(=O)c1ccccc1 Amb24072877 [0,0,0,0,0,0|1,0,1]=2 226 B11R1.16 C\C=N\C(=O)c1ccccc1 Amb24563950 [0,0,0,0,0,0|1,0,1]=2 227 B11R1.16 ClCCC(Br)c1ccccc1 Amb21856734 [0,0,0,0,0,0|3,0,1]=4 228 B11R1.16 ClCCC(Cl)c1ccccc1 Amb17872667 [0,0,0,0,0,0|3,0,1]=4 229 B11R1.16 ClCCC(c1ccccc1)C Amb17232691 [0,0,0,0,0,0|3,0,1]=4 230 B11R1.16 ClCCC(c1ccccc1)O Amb17611064 [0,0,0,0,0,0|2,0,2]=4 231 B11R1.16 ClCCN(c1ccccc1)C Amb17334788 [0,0,0,0,0,0|4,0,0]=4 232 B11R1.16 ClCCP(Cl)c1ccccc1 Amb24398805 [0,0,0,0,0,0|4,0,0]=4 233 B11R1.16 ClCC[C@@H](c1ccccc1)O Amb17611058 [0,0,0,0,0,0|2,0,2]=4 234 B11R1.16 ClC\C=C(\Br)/c1ccccc1 Amb25777111 [0,0,0,0,0,0|3,0,0]=3 235 B11R1.16 Cl\C=C\C(=O)c1ccccc1 Amb17594153 [0,0,0,0,0,0|2,0,1]=3 236 B11R1.16 FCCC(=O)c1ccccc1 Amb10603695 [0,0,0,0,0,0|2,0,0]=2 237 B11R1.16 N#CCC(=O)c1c[n]ccc1 Amb22899257 [0,0,0,0,0,0|3,0,1]=4 238 B11R1.16 N#CCC(=O)c1ccccc1 Amb1644485 [0,0,0,0,0,0|2,0,1]=3 239 B11R1.16 N#CCS(=O)c1ccccc1 Amb22505329 [0,0,0,0,0,0|3,0,1]=4 240 B11R1.16 N#CNC(=O)c1cc[n]cc1 Amb22731219 [0,0,0,0,0,0|3,0,1]=4 241 B11R1.16 N#CNC(=O)c1ccc[n]c1 Amb24062381 [0,0,0,0,0,0|3,0,1]=4 242 B11R1.16 N#C\C=C(\c1ccccc1)/Br Amb17595559 [0,0,0,0,0,0|3,0,1]=4 243 B11R1.16 N#C\C=C(\c1ccccc1)/Cl Amb1107219 [0,0,0,0,0,0|3,0,1]=4 244 B11R1.16 N#C\N=C(\c1ccccc1)/N Amb1146072 [0,0,0,0,0,0|3,0,1]=4 245 B11R1.16 N#N=NC(=O)c1ccccn1 Amb10575043 [0,0,0,0,0,0|4,0,0]=4 246 B11R1.16 N=C(NC#N)c1ccccc1 Amb20527583 [0,0,0,0,0,0|3,0,1]=4 247 B11R1.16 N=CCC(=O)c1ccccc1 Amb24408300 [0,0,0,0,0,0|2,0,1]=3 248 B11R1.16 NC(CCO)c1ccccc1 Amb22730035 [0,0,0,0,0,0|3,0,1]=4 249 B11R1.16 NCCC(=O)c1c[n]c[n]c1 Amb24761230 [0,0,0,0,0,0|4,0,0]=4 250 B11R1.16 NCCC(=O)c1cc[n]cc1 Amb18639595 [0,0,0,0,0,0|3,0,0]=3 251 B11R1.16 NCCC(=O)c1ccc[n]c1 Amb18121496 [0,0,0,0,0,0|3,0,0]=3 252 B11R1.16 NCCC(=O)c1cccc[n]1 Amb18121375 [0,0,0,0,0,0|3,0,0]=3 253 B11R1.16 NCCC(Cl)c1ccccc1 Amb24487859 [0,0,0,0,0,0|3,0,1]=4 254 B11R1.16 NCCC(N)c1ccccc1 Amb18972395 [0,0,0,0,0,0|3,0,1]=4 255 B11R1.16 NCCC(O)c1ccccc1 Amb21984527 [0,0,0,0,0,0|2,0,2]=4 256 B11R1.16 NCCC(S)c1ccccc1 Amb18251942 [0,0,0,0,0,0|2,1,1]=4 257 B11R1.16 NCCC(c1ccccc1)O Amb2383139 [0,0,0,0,0,0|2,0,2]=4 258 B11R1.16 NCCN(c1ccccc1)C Amb13949227 [0,0,0,0,0,0|4,0,0]=4 259 B11R1.16 NCCN(c1ccccc1)C Amb2371516 [0,0,0,0,0,0|4,0,0]=4 260 B11R1.16 NCCS(=O)c1ccccc1 Amb18974516 [0,0,0,0,0,0|3,0,0]=3 261 B11R1.16 NCCS(=O)c1ccccc1 Amb19349568 [0,0,0,0,0,0|3,0,0]=3 262 B11R1.16 NCC[C@@H](N)c1ccccc1 Amb25210474 [0,0,0,0,0,0|3,0,1]=4 263 B11R1.16 NCC[C@@H](O)c1ccccc1 Amb22225304 [0,0,0,0,0,0|2,0,2]=4 264 B11R1.16 NCC[C@H](O)c1ccccc1 Amb22226644 [0,0,0,0,0,0|2,0,2]=4 265 B11R1.16 NCNC(=O)c1c[n]cc[n]1 Amb24727591 [0,0,0,0,0,0|4,0,0]=4 266 B11R1.16 NCNC(=O)c1ccccc1 Amb24072660 [0,0,0,0,0,0|2,0,0]=2 267 B11R1.16 NN(CCO)c1ccccc1 Amb24555138 [0,0,0,0,0,0|4,0,0]=4 268 B11R1.16 NNCC(=O)c1cc[n]cc1 Amb25694854 [0,0,0,0,0,0|4,0,0]=4 269 B11R1.16 NNCC(=O)c1ccccc1 Amb18125154 [0,0,0,0,0,0|3,0,0]=3 270 B11R1.16 NOCC(=O)c1ccccc1 Amb22729387 [0,0,0,0,0,0|3,0,0]=3 271 B11R1.16 NSCC(=O)c1ccccc1 Amb24564884 [0,0,0,0,0,0|3,0,0]=3 272 B11R1.16 N[C@H](CCO)c1ccccc1 Amb22265524 [0,0,0,0,0,0|3,0,1]=4 273 B11R1.16 N\C(=C\C=O)\c1ccccc1 Amb24514799 [0,0,0,0,0,0|3,0,1]=4 274 B11R1.16 N\C=C/C(=O)c1ccccc1 Amb24706769 [0,0,0,0,0,0|2,0,1]=3 275 B11R1.16 N\C=C\C(=O)c1ccccc1 Amb25730024 [0,0,0,0,0,0|2,0,1]=3 276 B11R1.16 O=C(C#C[Cu])c1ccccc1 Amb22343042 [0,0,0,0,0,0|2,0,1]=3 277 B11R1.16 O=C(C=C=O)c1cccc[n]1 Amb24469990 [0,0,0,0,0,0|3,0,1]=4 278 B11R1.16 O=C(C=C=O)c1ccccc1 Amb24737519 [0,0,0,0,0,0|2,0,1]=3 279 B11R1.16 O=C(C=S=O)c1ccccc1 Amb25713057 [0,0,0,0,0,0|3,0,0]=3 280 B11R1.16 O=C(CCCl)c1cc[n]cc1 Amb24117884 [0,0,0,0,0,0|3,0,0]=3 281 B11R1.16 O=C(CCCl)c1cccc[n]1 Amb24422601 [0,0,0,0,0,0|3,0,0]=3 282 B11R1.16 O=C(CN=O)c1ccccc1 Amb25821412 [0,0,0,0,0,0|3,0,0]=3 283 B11R1.16 O=C(NC=O)c1c[n]ccc1 Amb24062384 [0,0,0,0,0,0|3,0,1]=4 284 B11R1.16 O=C(NC=O)c1ccccc1 Amb24096618 [0,0,0,0,0,0|2,0,1]=3 285 B11R1.16 O=C(NCBr)c1ccccc1 Amb25772077 [0,0,0,0,0,0|2,0,0]=2 286 B11R1.16 O=C(OCCl)c1ccccc1 Amb19958719 [0,0,0,0,0,0|1,0,0]=1 287 B11R1.16 O=C(OCI)c1ccccc1 Amb25148286 [0,0,0,0,0,0|1,0,0]=1 288 B11R1.16 O=C([CH-]C=O)c1ccccc1 Amb22330589 [0,0,0,0,0,0|2,0,1]=3 289 B11R1.16 O=C([CH-]C=O)c1ccccc1 Amb24121236 [0,0,0,0,0,0|2,0,1]=3 290 B11R1.16 O=C(\C=C/Cl)c1ccccc1 Amb25723188 [0,0,0,0,0,0|2,0,1]=3 291 B11R1.16 O=C(\C=N\Cl)c1ccccc1 Amb25319928 [0,0,0,0,0,0|3,0,0]=3 292 B11R1.16 O=C(\N=C\S)c1ccccc1 Amb24485844 [0,0,0,0,0,0|2,0,1]=3 293 B11R1.16 O=C(c1ccccc1)C=[N+]=[N-] Amb16233231 [0,0,0,0,0,0|3,0,0]=3 294 B11R1.16 O=C(c1ccncc1)N=[N+]=[N-] Amb10574948 [0,0,0,0,0,0|4,0,0]=4 295 B11R1.16 O=C=NC(=O)c1cccnc1 Amb17232035 [0,0,0,0,0,0|3,0,1]=4 296 B11R1.16 O=C=NS(=O)c1ccccc1 Amb24608566 [0,0,0,0,0,0|3,0,1]=4 297 B11R1.16 O=CC=C(c1ccccc1)Cl Amb17232626 [0,0,0,0,0,0|3,0,1]=4 298 B11R1.16 O=CCC(=S)c1ccccc1 Amb25351016 [0,0,0,0,0,0|2,1,1]=4 299 B11R1.16 O=CCS(=O)c1ccccc1 Amb25674931 [0,0,0,0,0,0|3,0,1]=4 300 B11R1.16 O=COC(Cl)c1ccccc1 Amb24710112 [0,0,0,0,0,0|2,0,2]=4 301 B11R1.16 O=C\C=C(/F)\c1ccccc1 Amb18125100 [0,0,0,0,0,0|3,0,1]=4 302 B11R1.16 O=C\C=C(/S)\c1ccccc1 Amb18646120 [0,0,0,0,0,0|2,1,1]=4 303 B11R1.16 O=C\C=C(\Br)/c1ccccc1 Amb25084228 [0,0,0,0,0,0|3,0,1]=4 304 B11R1.16 O=C\C=C(\Cl)/c1ccccc1 Amb19884139 [0,0,0,0,0,0|3,0,1]=4 305 B11R1.16 O=C\C=C(\c1ccccc1)/C Amb17593660 [0,0,0,0,0,0|3,0,1]=4 306 B11R1.16 OC(CCF)c1ccccc1 Amb24412986 [0,0,0,0,0,0|2,0,2]=4 307 B11R1.16 OC(CCS)c1ccccc1 Amb25837914 [0,0,0,0,0,0|2,0,2]=4 308 B11R1.16 OCCC(=C)c1ccncc1 Amb10573777 [0,0,0,0,0,0|4,0,0]=4 309 B11R1.16 OCCC(=O)c1cc[n]cc1 Amb24544067 [0,0,0,0,0,0|3,0,0]=3 310 B11R1.16 OCCC(=O)c1ccccc1 Amb16231606 [0,0,0,0,0,0|2,0,0]=2 311 B11R1.16 OCCC(O)c1ccccc1 Amb17777842 [0,0,0,0,0,0|2,0,2]=4 312 B11R1.16 OCCC(c1ccccc1)N Amb1993953 [0,0,0,0,0,0|3,0,1]=4 313 B11R1.16 OCNC(=O)c1c[n]cc[n]1 Amb24072688 [0,0,0,0,0,0|4,0,0]=4 314 B11R1.16 OCNC(=O)c1ccccc1 Amb1200467 [0,0,0,0,0,0|2,0,0]=2 315 B11R1.16 OCNC(=S)c1ccc[n]c1 Amb24523133 [0,0,0,0,0,0|3,1,0]=4 316 B11R1.16 OCNC(=S)c1ccccc1 Amb25289021 [0,0,0,0,0,0|2,1,0]=3 317 B11R1.16 OCOC(=O)c1ccc[n]c1 Amb24062492 [0,0,0,0,0,0|2,0,0]=2 318 B11R1.16 OCOC(=O)c1ccccc1 Amb25115920 [0,0,0,0,0,0|1,0,0]=1 319 B11R1.16 OCSC(=S)c1ccccc1 Amb25806661 [0,0,0,0,0,0|1,2,0]=3 320 B11R1.16 OC\C=C(\Cl)/c1ccccc1 Amb24748632 [0,0,0,0,0,0|3,0,0]=3 321 B11R1.16 OC\C=C(\F)/c1ccccc1 Amb24355216 [0,0,0,0,0,0|3,0,0]=3 322 B11R1.16 ONNC(=O)c1cccc[n]1 Amb25043959 [0,0,0,0,0,0|4,0,0]=4 323 B11R1.16 O\C=C\C(=S)c1ccccc1 Amb24645164 [0,0,0,0,0,0|2,1,1]=4 324 B11R1.16 O\N=C/C(=O)c1ccccc1 Amb25767720 [0,0,0,0,0,0|3,0,0]=3 325 B11R1.16 S=C(S[Mg]Cl)c1ccccc1 Amb22264563 [0,0,0,0,0,0|2,2,0]=4 326 B11R1.16 S=C=NC(=O)c1ccccc1 Amb2092776 [0,0,0,0,0,0|2,0,1]=3 327 B11R1.16 SCCC(=O)c1ccccc1 Amb17400214 [0,0,0,0,0,0|2,0,0]=2 328 B11R1.16 SCCN(c1ccccc1)C Amb13881732 [0,0,0,0,0,0|4,0,0]=4 329 B11R1.16 [13CH3]COC(=O)[13c]1[13cH][n][13cH][13cH][13cH]1 Amb22367448 [0,0,0,0,0,0|1,0,0]=1 330 B11R1.16 [N-]=[N+]=CC(=O)c1cccc[n]1 Amb24618462 [0,0,0,0,0,0|4,0,0]=4 331 B11R1.16 [N-]=[N+]=NC(=S)c1ccccc1 Amb24558614 [0,0,0,0,0,0|3,1,0]=4 332 B11R1.16 [O-]/C=C\C(=O)c1ccccc1 Amb17843402 [0,0,0,0,0,0|2,0,1]=3 333 B11R1.16 [O-]SOC(O)c1ccccc1 Amb24403740 [0,0,0,0,0,0|2,0,2]=4 334 B11R1.16 [O-]\C=C/C(=O)c1ccccc1 Amb2385893 [0,0,0,0,0,0|2,0,1]=3 335 B11R1.16 [O-]\C=C\C(=O)c1ccccc1 Amb22360915 [0,0,0,0,0,0|2,0,1]=3 336 B10R1.15 BrCC(=O)c1ccccc1 Amb1102084 [1,0,0,0,0,0|1,0,0]=2 337 B10R1.15 BrCC(=O)c1ccccn1 Amb1980867 [1,0,0,0,0,0|2,0,0]=3 338 B10R1.15 BrCC(=O)c1cccnc1 Amb1981330 [1,0,0,0,0,0|2,0,0]=3 339 B10R1.15 BrCC(=O)c1ccncc1 Amb1981329 [1,0,0,0,0,0|2,0,0]=3 340 B10R1.15 BrCC(=O)c1cnccn1 Amb16233325 [1,0,0,0,0,0|3,0,0]=4 341 B10R1.15 BrCC(c1ccccc1)O Amb17206105 [1,0,0,0,0,0|1,0,2]=4 342 B10R1.15 Br[13CH2]C(Br)c1ccccc1 Amb22367266 [1,0,0,0,0,0|2,0,1]=4 343 B10R1.15 C#CC(=O)c1ccccc1 Amb1088846 [1,0,0,0,0,0|0,0,2]=3 344 B10R1.15 C/C=C(\C)c1ccccc1 Amb17940650 [1,0,0,0,0,0|1,0,1]=3 345 B10R1.15 C=C(CBr)c1cc[n]cc1 Amb24759413 [1,0,0,0,0,0|3,0,0]=4 346 B10R1.15 C=C(CO)c1ccc[n]c1 Amb25829121 [1,0,0,0,0,0|3,0,0]=4 347 B10R1.15 C=C([Zn]Br)c1ccccc1 Amb22000417 [1,0,0,0,0,0|3,0,0]=4 348 B10R1.15 C=CC(=O)c1cc[n]cc1 Amb24482055 [1,0,0,0,0,0|1,0,2]=4 349 B10R1.15 C=CC(=O)c1ccc[n]c1 Amb25776729 [1,0,0,0,0,0|1,0,2]=4 350 B10R1.15 C=CC(=O)c1ccccc1 Amb18062256 [1,0,0,0,0,0|0,0,2]=3 351 B10R1.15 C=CS(=O)c1ccccc1 Amb15692858 [1,0,0,0,0,0|1,0,2]=4 352 B10R1.15 C=C[S@@](=O)c1ccccc1 Amb22747463 [1,0,0,0,0,0|1,0,2]=4 353 B10R1.15 CC(CN)c1ccccc1 Amb19958781 [1,0,0,0,0,0|2,0,1]=4 354 B10R1.15 CC(ON)c1ccccc1 Amb22491086 [1,0,0,0,0,0|2,0,1]=4 355 B10R1.15 CC=C(F)c1ccccc1 Amb22008093 [1,0,0,0,0,0|1,0,1]=3 356 B10R1.15 CCB(N)c1ccccc1 Amb25269618 [1,0,0,0,0,0|2,0,0]=3 357 B10R1.15 CCB(O)c1ccccc1 Amb25174287 [1,0,0,0,0,0|1,0,1]=3 358 B10R1.15 CCC(=C)c1cccc[n]1 Amb24467663 [1,0,0,0,0,0|2,0,0]=3 359 B10R1.15 CCC(=C)c1ccccc1 Amb22234837 [1,0,0,0,0,0|1,0,0]=2 360 B10R1.15 CCC(=N)c1c[n]c[n]c1 Amb24404964 [1,0,0,0,0,0|3,0,0]=4 361 B10R1.15 CCC(=N)c1cc[n]cc1 Amb25303409 [1,0,0,0,0,0|2,0,0]=3 362 B10R1.15 CCC(=O)c1[n]ccc[n]1 Amb22236265 [1,0,0,0,0,0|2,0,0]=3 363 B10R1.15 CCC(=O)c1c[n][n]c[n]1 Amb18203073 [1,0,0,0,0,0|3,0,0]=4 364 B10R1.15 CCC(=O)c1c[n]c[n]c1 Amb24082134 [1,0,0,0,0,0|2,0,0]=3 365 B10R1.15 CCC(=O)c1c[n]cc[n]1 Amb22235242 [1,0,0,0,0,0|2,0,0]=3 366 B10R1.15 CCC(=O)c1cc[n][n]c1 Amb25143455 [1,0,0,0,0,0|2,0,0]=3 367 B10R1.15 CCC(=O)c1cc[n]c[n]1 Amb25737542 [1,0,0,0,0,0|2,0,0]=3 368 B10R1.15 CCC(=O)c1ccc[n][n]1 Amb24676867 [1,0,0,0,0,0|2,0,0]=3 369 B10R1.15 CCC(=O)c1ccncc1 Amb10576400 [1,0,0,0,0,0|1,0,0]=2 370 B10R1.15 CCC(=S)c1ccc[n]c1 Amb25837178 [1,0,0,0,0,0|1,1,0]=3 371 B10R1.15 CCC(Br)c1c[n]ccc1 Amb24556035 [1,0,0,0,0,0|2,0,1]=4 372 B10R1.15 CCC(C)c1c[n]ccc1 Amb24690132 [1,0,0,0,0,0|2,0,1]=4 373 B10R1.15 CCC(Cl)[n+]1ccccc1 Amb24365361 [1,0,0,0,0,0|2,0,1]=4 374 B10R1.15 CCC(Cl)c1c[n]ccc1 Amb25708334 [1,0,0,0,0,0|2,0,1]=4 375 B10R1.15 CCC(N)c1cccc[n]1 Amb22587075 [1,0,0,0,0,0|2,0,1]=4 376 B10R1.15 CCC(N)c1ccccc1 Amb19959910 [1,0,0,0,0,0|1,0,1]=3 377 B10R1.15 CCC(c1ccccc1)N Amb1108026 [1,0,0,0,0,0|1,0,1]=3 378 B10R1.15 CCC(c1ccccn1)N Amb10607917 [1,0,0,0,0,0|2,0,1]=4 379 B10R1.15 CCC(c1cccnc1)N Amb10607957 [1,0,0,0,0,0|2,0,1]=4 380 B10R1.15 CCC(c1cccnc1)O Amb17231904 [1,0,0,0,0,0|1,0,2]=4 381 B10R1.15 CCC(c1ccncc1)O Amb16233288 [1,0,0,0,0,0|1,0,2]=4 382 B10R1.15 CCN(N)c1cccc[n]1 Amb18643189 [1,0,0,0,0,0|3,0,0]=4 383 B10R1.15 CCN(O)c1ccccc1 Amb25223262 [1,0,0,0,0,0|1,0,1]=3 384 B10R1.15 CCS(=O)c1[n]ccc[n]1 Amb25223988 [1,0,0,0,0,0|3,0,0]=4 385 B10R1.15 CCS(=O)c1c[n]cc[n]1 Amb24408108 [1,0,0,0,0,0|3,0,0]=4 386 B10R1.15 CCS(=O)c1ccccc1 Amb22234834 [1,0,0,0,0,0|1,0,0]=2 387 B10R1.15 CCS(=O)c1ccccc1 Amb22500370 [1,0,0,0,0,0|1,0,0]=2 388 B10R1.15 CC[C@@H](N)c1c[n]ccc1 Amb23401519 [1,0,0,0,0,0|2,0,1]=4 389 B10R1.15 CC[C@@H](N)c1c[n]ccc1 Amb25805543 [1,0,0,0,0,0|2,0,1]=4 390 B10R1.15 CC[C@@H](N)c1cc[n]cc1 Amb23401520 [1,0,0,0,0,0|2,0,1]=4 391 B10R1.15 CC[C@@H](N)c1cc[n]cc1 Amb24744408 [1,0,0,0,0,0|2,0,1]=4 392 B10R1.15 CC[C@@H](N)c1cccc[n]1 Amb23440390 [1,0,0,0,0,0|2,0,1]=4 393 B10R1.15 CC[C@@H](N)c1cccc[n]1 Amb25797820 [1,0,0,0,0,0|2,0,1]=4 394 B10R1.15 CC[C@@H](N)c1ccccc1 Amb22265426 [1,0,0,0,0,0|1,0,1]=3 395 B10R1.15 CC[C@@H](O)c1cccc[n]1 Amb25717055 [1,0,0,0,0,0|1,0,2]=4 396 B10R1.15 CC[C@H](C)c1cc[n]cc1 Amb24599884 [1,0,0,0,0,0|2,0,1]=4 397 B10R1.15 CC[C@H](Cl)c1ccccc1 Amb24429104 [1,0,0,0,0,0|1,0,1]=3 398 B10R1.15 CC[C@H](N)c1c[n]ccc1 Amb25277011 [1,0,0,0,0,0|2,0,1]=4 399 B10R1.15 CC[C@H](N)c1ccccc1 Amb22265559 [1,0,0,0,0,0|1,0,1]=3 400 B10R1.15 CC[C@H](O)c1c[n]ccc1 Amb24432697 [1,0,0,0,0,0|1,0,2]=4 401 B10R1.15 CC[S@@](=O)c1ccccc1 Amb22747460 [1,0,0,0,0,0|1,0,0]=2 402 B10R1.15 CN(CCl)c1ccccc1 Amb24479224 [1,0,0,0,0,0|3,0,0]=4 403 B10R1.15 CNC(=N)c1cc[n]cc1 Amb24476946 [1,0,0,0,0,0|3,0,0]=4 404 B10R1.15 CNC(=N)c1ccccc1 Amb23447117 [1,0,0,0,0,0|2,0,0]=3 405 B10R1.15 CNC(=N)c1ccccn1 Amb11014510 [1,0,0,0,0,0|3,0,0]=4 406 B10R1.15 CNC(=N)c1ccncc1 Amb11014516 [1,0,0,0,0,0|3,0,0]=4 407 B10R1.15 CNC(=O)C=1CC=CNC1 Amb24478973 [1,0,0,0,0,0|2,0,1]=4 408 B10R1.15 CNC(=O)c1c[n]c[n]c1 Amb25114110 [1,0,0,0,0,0|3,0,0]=4 409 B10R1.15 CNC(=O)c1c[n]cc[n]1 Amb22500337 [1,0,0,0,0,0|3,0,0]=4 410 B10R1.15 CNC(=O)c1ccccc1 Amb1793916 [1,0,0,0,0,0|1,0,0]=2 411 B10R1.15 CNC(=O)c1ccncc1 Amb1772729 [1,0,0,0,0,0|2,0,0]=3 412 B10R1.15 CNC(=O)c1ccncc1 Amb1782568 [1,0,0,0,0,0|2,0,0]=3 413 B10R1.15 CNC(=O)c1ccncc1 Amb1787524 [1,0,0,0,0,0|2,0,0]=3 414 B10R1.15 CNC(=S)c1cccc[n]1 Amb24451125 [1,0,0,0,0,0|2,1,0]=4 415 B10R1.15 CNC(=S)c1ccccc1 Amb10552988 [1,0,0,0,0,0|1,1,0]=3 416 B10R1.15 CNC(c1ccccc1)C Amb1215689 [1,0,0,0,0,0|2,0,1]=4 417 B10R1.15 CNS(=O)c1ccccc1 Amb24606698 [1,0,0,0,0,0|2,0,0]=3 418 B10R1.15 CN[C@@H](C)c1ccccc1 Amb17740009 [1,0,0,0,0,0|2,0,1]=4 419 B10R1.15 CN[C@@H](C)c1ccccc1 Amb22899444 [1,0,0,0,0,0|2,0,1]=4 420 B10R1.15 CN[C@@H](c1ccccc1)C Amb10844610 [1,0,0,0,0,0|2,0,1]=4 421 B10R1.15 COC(=C)c1ccccc1 Amb10558859 [1,0,0,0,0,0|1,0,0]=2 422 B10R1.15 COC(=N)c1[n]ccc[n]1 Amb24061344 [1,0,0,0,0,0|3,0,0]=4 423 B10R1.15 COC(=N)c1c[n]c[n]c1 Amb24063073 [1,0,0,0,0,0|3,0,0]=4 424 B10R1.15 COC(=N)c1c[n]cc[n]1 Amb21955137 [1,0,0,0,0,0|3,0,0]=4 425 B10R1.15 COC(=N)c1cc[n][n]c1 Amb24696437 [1,0,0,0,0,0|3,0,0]=4 426 B10R1.15 COC(=N)c1cc[n]c[n]1 Amb24595683 [1,0,0,0,0,0|3,0,0]=4 427 B10R1.15 COC(=N)c1cc[n]cc1 Amb21963597 [1,0,0,0,0,0|2,0,0]=3 428 B10R1.15 COC(=N)c1ccccn1 Amb10072424 [1,0,0,0,0,0|2,0,0]=3 429 B10R1.15 COC(=N)c1ccccn1 Amb10552783 [1,0,0,0,0,0|2,0,0]=3 430 B10R1.15 COC(=N)c1ccccn1 Amb10553348 [1,0,0,0,0,0|2,0,0]=3 431 B10R1.15 COC(=N)c1cnccn1 Amb10071951 [1,0,0,0,0,0|3,0,0]=4 432 B10R1.15 COC(=O)C1=COCC=C1 Amb24100793 [1,0,0,0,0,0|1,0,1]=3 433 B10R1.15 COC(=O)C1C=CCC=C1 Amb22365029 [1,0,0,0,0,0|0,0,2]=3 434 B10R1.15 COC(=O)C=1C=CCNC1 Amb25105274 [1,0,0,0,0,0|1,0,1]=3 435 B10R1.15 COC(=O)C=1CC=CCC1 Amb22365036 [1,0,0,0,0,0|0,0,2]=3 436 B10R1.15 COC(=O)C=1CC=NNC1 Amb24099509 [1,0,0,0,0,0|2,0,1]=4 437 B10R1.15 COC(=O)N1CC=CC=N1 Amb24060232 [1,0,0,0,0,0|2,0,1]=4 438 B10R1.15 COC(=O)[n+]1ccccc1 Amb24649947 [1,0,0,0,0,0|1,0,0]=2 439 B10R1.15 COC(=O)c1[n][n]cc[n]1 Amb25327432 [1,0,0,0,0,0|3,0,0]=4 440 B10R1.15 COC(=O)c1c[n][n][n]c1 Amb21963299 [1,0,0,0,0,0|3,0,0]=4 441 B10R1.15 COC(=O)c1cc[n][n][n]1 Amb25212107 [1,0,0,0,0,0|3,0,0]=4 442 B10R1.15 COC(=O)c1ccc[n][n]1 Amb21960450 [1,0,0,0,0,0|2,0,0]=3 443 B10R1.15 COC(=O)c1ccc[n]c1 Amb22741138 [1,0,0,0,0,0|1,0,0]=2 444 B10R1.15 COC(=O)c1cccnc1 Amb1212078 [1,0,0,0,0,0|1,0,0]=2 445 B10R1.15 COC(=O)c1ccnnc1 Amb17935713 [1,0,0,0,0,0|2,0,0]=3 446 B10R1.15 COC(=O)c1cnccn1 Amb2455964 [1,0,0,0,0,0|2,0,0]=3 447 B10R1.15 COC(=S)c1ccccc1 Amb10569749 [1,0,0,0,0,0|0,1,0]=2 448 B10R1.15 COC(=[NH2+])c1ccccc1 Amb10241351 [1,0,0,0,0,0|1,0,0]=2 449 B10R1.15 COC(C)c1cc[n]cc1 Amb24102684 [1,0,0,0,0,0|2,0,1]=4 450 B10R1.15 COC(C)c1ccccc1 Amb23568513 [1,0,0,0,0,0|1,0,1]=3 451 B10R1.15 COC(Cl)c1ccccc1 Amb17940179 [1,0,0,0,0,0|1,0,1]=3 452 B10R1.15 COC(O)c1c[n]ccc1 Amb25213606 [1,0,0,0,0,0|1,0,2]=4 453 B10R1.15 COC(O)c1cccc[n]1 Amb25236210 [1,0,0,0,0,0|1,0,2]=4 454 B10R1.15 COC(O)c1ccccc1 Amb25225981 [1,0,0,0,0,0|0,0,2]=3 455 B10R1.15 CO[13C](=O)c1ccccc1 Amb22363354 [1,0,0,0,0,0|0,0,0]=1 456 B10R1.15 CO[C@@H](Cl)c1ccccc1 Amb25108131 [1,0,0,0,0,0|1,0,1]=3 457 B10R1.15 CPC(O)c1ccccc1 Amb25144461 [1,0,0,0,0,0|1,0,2]=4 458 B10R1.15 CSC(=N)c1cc[n]cc1 Amb21955384 [1,0,0,0,0,0|2,1,0]=4 459 B10R1.15 CSC(=N)c1cc[n]cc1 Amb25288573 [1,0,0,0,0,0|2,1,0]=4 460 B10R1.15 CSC(=N)c1ccc[n]c1 Amb21955383 [1,0,0,0,0,0|2,1,0]=4 461 B10R1.15 CSC(=N)c1ccc[n]c1 Amb24563938 [1,0,0,0,0,0|2,1,0]=4 462 B10R1.15 CSC(=N)c1cccc[n]1 Amb21955629 [1,0,0,0,0,0|2,1,0]=4 463 B10R1.15 CSC(=N)c1cccc[n]1 Amb24711862 [1,0,0,0,0,0|2,1,0]=4 464 B10R1.15 CSC(=N)c1ccccc1 Amb22488568 [1,0,0,0,0,0|1,1,0]=3 465 B10R1.15 CSC(=N)c1ccccc1 Amb24542868 [1,0,0,0,0,0|1,1,0]=3 466 B10R1.15 CSC(=O)c1c[n]cc[n]1 Amb24678657 [1,0,0,0,0,0|2,1,0]=4 467 B10R1.15 CSC(=O)c1ccccn1 Amb1487227 [1,0,0,0,0,0|1,1,0]=3 468 B10R1.15 CSC(=S)c1ccccc1 Amb24395059 [1,0,0,0,0,0|0,2,0]=3 469 B10R1.15 C[C@@H](CBr)c1ccccc1 Amb25786304 [1,0,0,0,0,0|2,0,1]=4 470 B10R1.15 C[C@@H](CCl)c1ccccc1 Amb24632311 [1,0,0,0,0,0|2,0,1]=4 471 B10R1.15 C[C@@H](ON)c1ccccc1 Amb25850037 [1,0,0,0,0,0|2,0,1]=4 472 B10R1.15 C[C@H](CCl)c1ccccc1 Amb24658260 [1,0,0,0,0,0|2,0,1]=4 473 B10R1.15 C[SiH](CCl)c1ccccc1 Amb25053449 [1,0,0,0,0,0|2,1,0]=4 474 B10R1.15 C\C(=C/Br)\c1ccccc1 Amb25066105 [1,0,0,0,0,0|2,0,1]=4 475 B10R1.15 C\C(=C/C)\c1c[n]ccc1 Amb24085629 [1,0,0,0,0,0|2,0,1]=4 476 B10R1.15 C\C(=C/C)\c1cc[n]cc1 Amb24103190 [1,0,0,0,0,0|2,0,1]=4 477 B10R1.15 C\C(=C\C)\c1cc[n]cc1 Amb24619216 [1,0,0,0,0,0|2,0,1]=4 478 B10R1.15 C\C(=C\C)\c1cccc[n]1 Amb24580985 [1,0,0,0,0,0|2,0,1]=4 479 B10R1.15 C\C(=C\N)\c1ccccc1 Amb24674165 [1,0,0,0,0,0|2,0,1]=4 480 B10R1.15 C\C(=N\C)\c1c[n]ccc1 Amb25230944 [1,0,0,0,0,0|3,0,0]=4 481 B10R1.15 C\C(=N\C)\c1cccc[n]1 Amb24433259 [1,0,0,0,0,0|3,0,0]=4 482 B10R1.15 C\C=C(\N)/c1cccc[n]1 Amb25777355 [1,0,0,0,0,0|2,0,1]=4 483 B10R1.15 C\N=C(/N)\c1c[n]ccc1 Amb21970335 [1,0,0,0,0,0|3,0,0]=4 484 B10R1.15 C\N=C(\Cl)/c1ccccc1 Amb25835717 [1,0,0,0,0,0|2,0,0]=3 485 B10R1.15 ClC(CBr)c1ccccc1 Amb24079929 [1,0,0,0,0,0|2,0,1]=4 486 B10R1.15 ClCC(c1ccccc1)C Amb17232147 [1,0,0,0,0,0|2,0,1]=4 487 B10R1.15 ClCP(Cl)c1ccccc1 Amb25725059 [1,0,0,0,0,0|3,0,0]=4 488 B10R1.15 ClC[C@@H](c1ccccc1)O Amb16231709 [1,0,0,0,0,0|1,0,2]=4 489 B10R1.15 ClC[C@H](Cl)c1ccccc1 Amb25131628 [1,0,0,0,0,0|2,0,1]=4 490 B10R1.15 ClC[SiH](Cl)c1ccccc1 Amb25061252 [1,0,0,0,0,0|2,1,0]=4 491 B10R1.15 Cl\C(=C\Cl)\c1ccccc1 Amb25849275 [1,0,0,0,0,0|2,0,1]=4 492 B10R1.15 FC(CBr)c1ccccc1 Amb20075900 [1,0,0,0,0,0|2,0,1]=4 493 B10R1.15 FCC(=O)c1ccccc1 Amb10603600 [1,0,0,0,0,0|1,0,0]=2 494 B10R1.15 FCC(Br)c1ccccc1 Amb25366148 [1,0,0,0,0,0|2,0,1]=4 495 B10R1.15 FCC(Cl)c1ccccc1 Amb25361037 [1,0,0,0,0,0|2,0,1]=4 496 B10R1.15 FCC(c1ccccc1)N Amb2372575 [1,0,0,0,0,0|2,0,1]=4 497 B10R1.15 F\C(=C/Cl)\c1ccccc1 Amb24589902 [1,0,0,0,0,0|2,0,1]=4 498 B10R1.15 F\C(=C\F)\c1ccccc1 Amb25762778 [1,0,0,0,0,0|2,0,1]=4 499 B10R1.15 N#CC(=C)c1ccccc1 Amb17231856 [1,0,0,0,0,0|2,0,1]=4 500 B10R1.15 N#CC(=O)c1ccc[n]c1 Amb24725178 [1,0,0,0,0,0|2,0,1]=4 501 B10R1.15 N#CC(=O)c1cccc[n]1 Amb25336318 [1,0,0,0,0,0|2,0,1]=4 502 B10R1.15 N=C(OO)c1ccc[n]c1 Amb24062391 [1,0,0,0,0,0|3,0,0]=4 503 B10R1.15 N=NC(=O)c1cc[n]cc1 Amb24102954 [1,0,0,0,0,0|3,0,0]=4 504 B10R1.15 NC(=NN)c1ccccc1 Amb22488579 [1,0,0,0,0,0|3,0,0]=4 505 B10R1.15 NC(=S=O)c1ccccc1 Amb24406743 [1,0,0,0,0,0|2,1,0]=4 506 B10R1.15 NC(CBr)c1ccccc1 Amb25690830 [1,0,0,0,0,0|2,0,1]=4 507 B10R1.15 NC(CI)c1ccccc1 Amb24404731 [1,0,0,0,0,0|2,0,1]=4 508 B10R1.15 NC(CS)c1ccccc1 Amb25061358 [1,0,0,0,0,0|2,0,1]=4 509 B10R1.15 NCC(=C)c1ccccc1 Amb10609068 [1,0,0,0,0,0|2,0,0]=3 510 B10R1.15 NCC(=O)c1[n]ccc[n]1 Amb24105961 [1,0,0,0,0,0|3,0,0]=4 511 B10R1.15 NCC(=O)c1c[n]c[n]c1 Amb18832378 [1,0,0,0,0,0|3,0,0]=4 512 B10R1.15 NCC(=O)c1c[n]cc[n]1 Amb21862012 [1,0,0,0,0,0|3,0,0]=4 513 B10R1.15 NCC(=O)c1c[n]cc[n]1 Amb22273990 [1,0,0,0,0,0|3,0,0]=4 514 B10R1.15 NCC(=O)c1cc[n]cc1 Amb18832471 [1,0,0,0,0,0|2,0,0]=3 515 B10R1.15 NCC(=O)c1cc[n]cc1 Amb22002046 [1,0,0,0,0,0|2,0,0]=3 516 B10R1.15 NCC(=O)c1ccc[n]c1 Amb22277079 [1,0,0,0,0,0|2,0,0]=3 517 B10R1.15 NCC(=O)c1ccc[n]c1 Amb22754018 [1,0,0,0,0,0|2,0,0]=3 518 B10R1.15 NCC(=O)c1cccc[n]1 Amb18832469 [1,0,0,0,0,0|2,0,0]=3 519 B10R1.15 NCC(=O)c1ccccc1 Amb1073498 [1,0,0,0,0,0|1,0,0]=2 520 B10R1.15 NCC(=O)c1ccccn1 Amb10601921 [1,0,0,0,0,0|2,0,0]=3 521 B10R1.15 NCC(=O)c1cccnc1 Amb17607867 [1,0,0,0,0,0|2,0,0]=3 522 B10R1.15 NCC(Br)c1ccccc1 Amb19516007 [1,0,0,0,0,0|2,0,1]=4 523 B10R1.15 NCC(F)c1ccccc1 Amb23454844 [1,0,0,0,0,0|2,0,1]=4 524 B10R1.15 NCC(N)c1ccccc1 Amb21857142 [1,0,0,0,0,0|2,0,1]=4 525 B10R1.15 NCC(O)c1ccccc1 Amb21961704 [1,0,0,0,0,0|1,0,2]=4 526 B10R1.15 NCC(S)c1ccccc1 Amb18125608 [1,0,0,0,0,0|1,1,1]=4 527 B10R1.15 NCC(S)c1ccccc1 Amb24106048 [1,0,0,0,0,0|1,1,1]=4 528 B10R1.15 NCC(c1ccccc1)C Amb1085937 [1,0,0,0,0,0|2,0,1]=4 529 B10R1.15 NCC(c1ccccc1)O Amb2383121 [1,0,0,0,0,0|1,0,2]=4 530 B10R1.15 NC[C@@H](Cl)c1ccccc1 Amb24717355 [1,0,0,0,0,0|2,0,1]=4 531 B10R1.15 NC[C@@H](F)c1ccccc1 Amb25279947 [1,0,0,0,0,0|2,0,1]=4 532 B10R1.15 NC[C@@H](O)c1ccccc1 Amb24107154 [1,0,0,0,0,0|1,0,2]=4 533 B10R1.15 NC[C@@H](c1ccccc1)O Amb10070626 [1,0,0,0,0,0|1,0,2]=4 534 B10R1.15 NC[C@H](F)c1ccccc1 Amb25044881 [1,0,0,0,0,0|2,0,1]=4 535 B10R1.15 NC[C@H](N)c1ccccc1 Amb25757101 [1,0,0,0,0,0|2,0,1]=4 536 B10R1.15 NC[C@H](c1ccccc1)C Amb10070369 [1,0,0,0,0,0|2,0,1]=4 537 B10R1.15 NNC(=N)c1ccccc1 Amb22234855 [1,0,0,0,0,0|3,0,0]=4 538 B10R1.15 NNC(=N)c1ccccc1 Amb22481319 [1,0,0,0,0,0|3,0,0]=4 539 B10R1.15 NNC(=N)c1ccccc1 Amb22756451 [1,0,0,0,0,0|3,0,0]=4 540 B10R1.15 NNC(=O)c1ccccc1 Amb1208583 [1,0,0,0,0,0|2,0,0]=3 541 B10R1.15 NNC(=O)c1ccccn1 Amb1208395 [1,0,0,0,0,0|3,0,0]=4 542 B10R1.15 NNC(=O)c1cccnc1 Amb1786962 [1,0,0,0,0,0|3,0,0]=4 543 B10R1.15 NNC(=S)c1ccccc1 Amb23513674 [1,0,0,0,0,0|2,1,0]=4 544 B10R1.15 NOC(=O)c1ccccc1 Amb22054026 [1,0,0,0,0,0|1,0,0]=2 545 B10R1.15 NOC(c1ccccc1)C Amb17089185 [1,0,0,0,0,0|2,0,1]=4 546 B10R1.15 N[C@@H](CF)c1ccccc1 Amb22887019 [1,0,0,0,0,0|2,0,1]=4 547 B10R1.15 N[C@@H](CF)c1ccccc1 Amb22887020 [1,0,0,0,0,0|2,0,1]=4 548 B10R1.15 N[C@@H](CS)c1ccccc1 Amb25689822 [1,0,0,0,0,0|2,0,1]=4 549 B10R1.15 N[C@H](CBr)c1ccccc1 Amb24391587 [1,0,0,0,0,0|2,0,1]=4 550 B10R1.15 N[C@H](CS)c1ccccc1 Amb25111122 [1,0,0,0,0,0|2,0,1]=4 551 B10R1.15 N\C(=C\N)\c1ccccc1 Amb25147590 [1,0,0,0,0,0|2,0,1]=4 552 B10R1.15 N\C(=C\O)\c1ccccc1 Amb25675946 [1,0,0,0,0,0|2,0,1]=4 553 B10R1.15 N\C(=N/Br)\c1ccccc1 Amb25046590 [1,0,0,0,0,0|3,0,0]=4 554 B10R1.15 N\C(=N/N)\c1ccccc1 Amb20407822 [1,0,0,0,0,0|3,0,0]=4 555 B10R1.15 N\C(=N\Cl)\c1ccccc1 Amb24571718 [1,0,0,0,0,0|3,0,0]=4 556 B10R1.15 N\C(=N\I)\c1ccccc1 Amb24599616 [1,0,0,0,0,0|3,0,0]=4 557 B10R1.15 N\N=C(\c1ccccc1)/N Amb10608779 [1,0,0,0,0,0|3,0,0]=4 558 B10R1.15 O/C=C(\O)c1ccccc1 Amb17943089 [1,0,0,0,0,0|1,0,2]=4 559 B10R1.15 O/N=C(/O)c1ccccc1 Amb17843421 [1,0,0,0,0,0|2,0,1]=4 560 B10R1.15 O=C(C=O)c1c[n]ccc1 Amb18642978 [1,0,0,0,0,0|2,0,1]=4 561 B10R1.15 O=C(C=O)c1cccc[n]1 Amb25066902 [1,0,0,0,0,0|2,0,1]=4 562 B10R1.15 O=C(CBr)c1[n]ccc[n]1 Amb22304716 [1,0,0,0,0,0|3,0,0]=4 563 B10R1.15 O=C(CBr)c1[n]ccc[n]1 Amb22491896 [1,0,0,0,0,0|3,0,0]=4 564 B10R1.15 O=C(CBr)c1c[n]c[n]c1 Amb21964583 [1,0,0,0,0,0|3,0,0]=4 565 B10R1.15 O=C(CBr)c1c[n]c[n]c1 Amb22276010 [1,0,0,0,0,0|3,0,0]=4 566 B10R1.15 O=C(CBr)c1c[n]cc[n]1 Amb22235528 [1,0,0,0,0,0|3,0,0]=4 567 B10R1.15 O=C(CBr)c1cc[n]c[n]1 Amb22304669 [1,0,0,0,0,0|3,0,0]=4 568 B10R1.15 O=C(CBr)c1cc[n]c[n]1 Amb22490403 [1,0,0,0,0,0|3,0,0]=4 569 B10R1.15 O=C(CBr)c1cc[n]c[n]1 Amb23438825 [1,0,0,0,0,0|3,0,0]=4 570 B10R1.15 O=C(CBr)c1ccc[n][n]1 Amb24061143 [1,0,0,0,0,0|3,0,0]=4 571 B10R1.15 O=C(CCl)c1[n]ccc[n]1 Amb22753079 [1,0,0,0,0,0|3,0,0]=4 572 B10R1.15 O=C(CCl)c1c[n]c[n]c1 Amb25281438 [1,0,0,0,0,0|3,0,0]=4 573 B10R1.15 O=C(CCl)c1c[n]cc[n]1 Amb24104161 [1,0,0,0,0,0|3,0,0]=4 574 B10R1.15 O=C(CCl)c1cc[n]cc1 Amb22371842 [1,0,0,0,0,0|2,0,0]=3 575 B10R1.15 O=C(CCl)c1ccc[n][n]1 Amb22276830 [1,0,0,0,0,0|3,0,0]=4 576 B10R1.15 O=C(CCl)c1ccc[n]c1 Amb22371841 [1,0,0,0,0,0|2,0,0]=3 577 B10R1.15 O=C(CCl)c1cccc[n]1 Amb22497248 [1,0,0,0,0,0|2,0,0]=3 578 B10R1.15 O=C(CF)c1ccc[n]c1 Amb24084131 [1,0,0,0,0,0|2,0,0]=3 579 B10R1.15 O=C(CF)c1cccc[n]1 Amb24084124 [1,0,0,0,0,0|2,0,0]=3 580 B10R1.15 O=C(CI)c1ccccc1 Amb23579972 [1,0,0,0,0,0|1,0,0]=2 581 B10R1.15 O=C(C[K])c1[n]ccc[n]1 Amb24518656 [1,0,0,0,0,0|3,0,0]=4 582 B10R1.15 O=C(C[K])c1c[n]c[n]c1 Amb24639734 [1,0,0,0,0,0|3,0,0]=4 583 B10R1.15 O=C(C[K])c1c[n]cc[n]1 Amb25207050 [1,0,0,0,0,0|3,0,0]=4 584 B10R1.15 O=C(C[K])c1ccc[n][n]1 Amb24518655 [1,0,0,0,0,0|3,0,0]=4 585 B10R1.15 O=C(C[K])c1cccc[n]1 Amb25224773 [1,0,0,0,0,0|2,0,0]=3 586 B10R1.15 O=C(N=O)c1ccccc1 Amb24096802 [1,0,0,0,0,0|2,0,0]=3 587 B10R1.15 O=C(NCl)c1ccccc1 Amb25277317 [1,0,0,0,0,0|2,0,0]=3 588 B10R1.15 O=CC(=C)c1ccccc1 Amb16233227 [1,0,0,0,0,0|2,0,1]=4 589 B10R1.15 O=P(CCl)c1ccccc1 Amb25053604 [1,0,0,0,0,0|2,0,0]=3 590 B10R1.15 O=P(O[Na])c1ccccc1 Amb22360738 [1,0,0,0,0,0|2,0,0]=3 591 B10R1.15 O=S(CF)c1ccccc1 Amb22723398 [1,0,0,0,0,0|2,0,0]=3 592 B10R1.15 OC(CF)c1ccccc1 Amb22731897 [1,0,0,0,0,0|1,0,2]=4 593 B10R1.15 OCC(=C)c1ccccn1 Amb10552982 [1,0,0,0,0,0|3,0,0]=4 594 B10R1.15 OCC(=O)c1cc[n]cc1 Amb18063686 [1,0,0,0,0,0|2,0,0]=3 595 B10R1.15 OCC(=O)c1ccc[n]c1 Amb18063681 [1,0,0,0,0,0|2,0,0]=3 596 B10R1.15 OCC(=O)c1cccc[n]1 Amb18063640 [1,0,0,0,0,0|2,0,0]=3 597 B10R1.15 OCC(F)c1ccccc1 Amb24105399 [1,0,0,0,0,0|2,0,1]=4 598 B10R1.15 OCC(S)c1ccccc1 Amb25333535 [1,0,0,0,0,0|1,1,1]=4 599 B10R1.15 OC[C@@H](Br)c1ccccc1 Amb25770108 [1,0,0,0,0,0|2,0,1]=4 600 B10R1.15 OC[C@@H](Cl)c1ccccc1 Amb24417788 [1,0,0,0,0,0|2,0,1]=4 601 B10R1.15 OC[C@@H](F)c1ccccc1 Amb25320636 [1,0,0,0,0,0|2,0,1]=4 602 B10R1.15 OC[C@@H](S)c1ccccc1 Amb24504991 [1,0,0,0,0,0|1,1,1]=4 603 B10R1.15 ONC(=N)c1ccccc1 Amb17231893 [1,0,0,0,0,0|3,0,0]=4 604 B10R1.15 ONC(=O)c1ccccc1 Amb1645521 [1,0,0,0,0,0|2,0,0]=3 605 B10R1.15 OOC(=O)c1cc[n]cc1 Amb24066209 [1,0,0,0,0,0|2,0,0]=3 606 B10R1.15 OOC(=O)c1ccc[n]c1 Amb24094187 [1,0,0,0,0,0|2,0,0]=3 607 B10R1.15 OOC(=O)c1ccccc1 Amb17672281 [1,0,0,0,0,0|1,0,0]=2 608 B10R1.15 O[C@@H](CBr)c1ccccc1 Amb19929326 [1,0,0,0,0,0|1,0,2]=4 609 B10R1.15 O[C@@H](CF)c1ccccc1 Amb24389146 [1,0,0,0,0,0|1,0,2]=4 610 B10R1.15 O[C@@H](CI)c1ccccc1 Amb25738089 [1,0,0,0,0,0|1,0,2]=4 611 B10R1.15 O[C@H](CBr)c1ccccc1 Amb19929329 [1,0,0,0,0,0|1,0,2]=4 612 B10R1.15 O[C@H](CF)c1ccccc1 Amb24437736 [1,0,0,0,0,0|1,0,2]=4 613 B10R1.15 O\C(=C/Cl)\c1ccccc1 Amb24068872 [1,0,0,0,0,0|1,0,2]=4 614 B10R1.15 O\C(=C/F)\c1ccccc1 Amb24068873 [1,0,0,0,0,0|1,0,2]=4 615 B10R1.15 O\C(=C\F)\c1ccccc1 Amb25094625 [1,0,0,0,0,0|1,0,2]=4 616 B10R1.15 O\C=C(\Cl)/c1ccccc1 Amb25332181 [1,0,0,0,0,0|2,0,1]=4 617 B10R1.15 O\N=C(/c1ccccc1)\N Amb2226909 [1,0,0,0,0,0|3,0,0]=4 618 B10R1.15 O\N=C(\c1ccccc1)/C Amb2387477 [1,0,0,0,0,0|3,0,0]=4 619 B10R1.15 O\N=C(\c1ccccc1)/Cl Amb10563288 [1,0,0,0,0,0|3,0,0]=4 620 B10R1.15 O\N=C(\c1ccccc1)/N Amb1149046 [1,0,0,0,0,0|3,0,0]=4 621 B10R1.15 SCC(=O)c1ccccc1 Amb16192503 [1,0,0,0,0,0|1,0,0]=2 622 B10R1.15 SCC(c1ccccc1)O Amb10608997 [1,0,0,0,0,0|1,0,2]=4 623 B10R1.15 [2H]\C(=C\[2H])\c1ccccc1 Amb22353430 [1,0,0,0,0,0|2,0,1]=4 624 B10R1.15 [Li]OS(=O)c1ccccc1 Amb22359261 [1,0,0,0,0,0|2,0,0]=3 625 B10R1.15 [O-]NC(=O)c1ccccc1 Amb18800075 [1,0,0,0,0,0|2,0,0]=3 626 B10R1.15 [O-]NC(=O)c1ccccc1 Amb22527267 [1,0,0,0,0,0|2,0,0]=3 627 B10R1.15 [O-][NH2+]C(=O)c1ccc[n]c1 Amb22170062 [1,0,0,0,0,0|3,0,0]=4 628 B10R1.17 BrC=C=Cc1ccccc1 Amb17673290 [1,0,0,0,0,0|2,0,1]=4 629 B10R1.17 BrCCOc1ccccc1 Amb1152333 [1,0,0,0,0,0|3,0,0]=4 630 B10R1.17 C#C\C=C\c1ccccc1 Amb25146407 [1,0,0,0,0,0|1,0,2]=4 631 B10R1.17 C=C/C=C/c1ccccc1 Amb17938988 [1,0,0,0,0,0|1,0,2]=4 632 B10R1.17 C=COCc1ccccc1 Amb17940722 [1,0,0,0,0,0|0,0,3]=4 633 B10R1.17 C=NOCc1ccccc1 Amb24704253 [1,0,0,0,0,0|1,0,2]=4 634 B10R1.17 CC#COc1ccccc1 Amb25146348 [1,0,0,0,0,0|2,0,1]=4 635 B10R1.17 CC/C=C/c1ccccc1 Amb17673826 [1,0,0,0,0,0|1,0,0]=2 636 B10R1.17 CCC#Cc1c[n]ccc1 Amb24085891 [1,0,0,0,0,0|2,0,1]=4 637 B10R1.17 CCC#Cc1cccc[n]1 Amb24069949 [1,0,0,0,0,0|2,0,1]=4 638 B10R1.17 CCC=Cc1c[n]ccc1 Amb24085334 [1,0,0,0,0,0|2,0,0]=3 639 B10R1.17 CCCCc1ccccn1 Amb10574134 [1,0,0,0,0,0|2,0,1]=4 640 B10R1.17 CCCCc1ccncc1 Amb10555008 [1,0,0,0,0,0|2,0,1]=4 641 B10R1.17 CCCNc1ccccc1 Amb22284540 [1,0,0,0,0,0|2,0,0]=3 642 B10R1.17 CCCOc1c[n]ccc1 Amb25064833 [1,0,0,0,0,0|3,0,0]=4 643 B10R1.17 CCCOc1cccc[n]1 Amb24096899 [1,0,0,0,0,0|3,0,0]=4 644 B10R1.17 CCCSc1cccc[n]1 Amb24733306 [1,0,0,0,0,0|3,0,0]=4 645 B10R1.17 CCN=Cc1ccccc1 Amb15692852 [1,0,0,0,0,0|1,0,0]=2 646 B10R1.17 CCNCc1c[n]ccc1 Amb21972163 [1,0,0,0,0,0|2,0,1]=4 647 B10R1.17 CCNCc1ccncc1 Amb1214646 [1,0,0,0,0,0|2,0,1]=4 648 B10R1.17 CCOCc1c[n]c[n]c1 Amb24070812 [1,0,0,0,0,0|2,0,1]=4 649 B10R1.17 CCOCc1ccc[n][n]1 Amb25253318 [1,0,0,0,0,0|2,0,1]=4 650 B10R1.17 CCONc1cccc[n]1 Amb25307411 [1,0,0,0,0,0|2,0,0]=3 651 B10R1.17 CC\C=C/c1c[n]ccc1 Amb24602371 [1,0,0,0,0,0|2,0,0]=3 652 B10R1.17 CC\C=C/c1cc[n]cc1 Amb25831273 [1,0,0,0,0,0|2,0,0]=3 653 B10R1.17 CC\C=C\c1cc[n]cc1 Amb25379243 [1,0,0,0,0,0|2,0,0]=3 654 B10R1.17 CC\C=C\c1cccc[n]1 Amb22170387 [1,0,0,0,0,0|2,0,0]=3 655 B10R1.17 CC\N=C/c1c[n]ccc1 Amb24068896 [1,0,0,0,0,0|2,0,0]=3 656 B10R1.17 CC\N=C/c1cc[n]cc1 Amb25808022 [1,0,0,0,0,0|2,0,0]=3 657 B10R1.17 CC\N=C\c1cccc[n]1 Amb24585676 [1,0,0,0,0,0|2,0,0]=3 658 B10R1.17 CC\N=C\c1ccccc1 Amb10558476 [1,0,0,0,0,0|1,0,0]=2 659 B10R1.17 CN/N=C/c1ccccc1 Amb17867553 [1,0,0,0,0,0|2,0,0]=3 660 B10R1.17 CN=C=Nc1ccccc1 Amb24096797 [1,0,0,0,0,0|3,0,0]=4 661 B10R1.17 CNCCc1ccccc1 Amb1132990 [1,0,0,0,0,0|2,0,1]=4 662 B10R1.17 CNCCc1ccccc1 Amb2119452 [1,0,0,0,0,0|2,0,1]=4 663 B10R1.17 CNNCc1ccccc1 Amb10553073 [1,0,0,0,0,0|2,0,1]=4 664 B10R1.17 CNOCc1ccccc1 Amb22059601 [1,0,0,0,0,0|1,0,1]=3 665 B10R1.17 CN\C=N\c1ccccc1 Amb25348617 [1,0,0,0,0,0|3,0,0]=4 666 B10R1.17 CN\N=C\c1cc[n]cc1 Amb25071810 [1,0,0,0,0,0|3,0,0]=4 667 B10R1.17 CN\N=C\c1cccc[n]1 Amb24356439 [1,0,0,0,0,0|3,0,0]=4 668 B10R1.17 CN\N=N\c1ccccc1 Amb25720206 [1,0,0,0,0,0|3,0,0]=4 669 B10R1.17 COCNc1ccccc1 Amb10565397 [1,0,0,0,0,0|3,0,0]=4 670 B10R1.17 CON=Cc1ccccc1 Amb22896936 [1,0,0,0,0,0|2,0,0]=3 671 B10R1.17 CO\C=C/c1c[n]ccc1 Amb24085685 [1,0,0,0,0,0|3,0,0]=4 672 B10R1.17 CO\C=C/c1cc[n]cc1 Amb24103279 [1,0,0,0,0,0|3,0,0]=4 673 B10R1.17 CO\C=C/c1cccc[n]1 Amb24106783 [1,0,0,0,0,0|3,0,0]=4 674 B10R1.17 CO\C=C\c1c[n]ccc1 Amb24085666 [1,0,0,0,0,0|3,0,0]=4 675 B10R1.17 CO\C=C\c1ccccc1 Amb22002452 [1,0,0,0,0,0|2,0,0]=3 676 B10R1.17 CO\N=C\c1cc[n]cc1 Amb25173617 [1,0,0,0,0,0|3,0,0]=4 677 B10R1.17 CO\N=C\c1cccc[n]1 Amb24719324 [1,0,0,0,0,0|3,0,0]=4 678 B10R1.17 CO\N=C\c1ccccc1 Amb25762975 [1,0,0,0,0,0|2,0,0]=3 679 B10R1.17 CSCOc1ccccc1 Amb22231357 [1,0,0,0,0,0|3,0,0]=4 680 B10R1.17 CSCSc1ccccc1 Amb25162526 [1,0,0,0,0,0|3,0,0]=4 681 B10R1.17 CSSCc1ccccc1 Amb22230274 [1,0,0,0,0,0|1,1,1]=4 682 B10R1.17 C\C=C\Oc1ccccc1 Amb10564701 [1,0,0,0,0,0|2,0,1]=4 683 B10R1.17 C\C=C\Sc1ccccc1 Amb24665698 [1,0,0,0,0,0|2,0,1]=4 684 B10R1.17 ClC=C=Cc1ccccc1 Amb17670635 [1,0,0,0,0,0|2,0,1]=4 685 B10R1.17 ClCC#Cc1ccccc1 Amb17772264 [1,0,0,0,0,0|2,0,1]=4 686 B10R1.17 ClCC=Cc1c[n]ccc1 Amb24082988 [1,0,0,0,0,0|3,0,0]=4 687 B10R1.17 ClCCNc1ccccc1 Amb17334388 [1,0,0,0,0,0|3,0,0]=4 688 B10R1.17 ClCCPc1ccccc1 Amb24390336 [1,0,0,0,0,0|3,0,0]=4 689 B10R1.17 ClCSCc1ccccc1 Amb16231183 [1,0,0,0,0,0|1,1,1]=4 690 B10R1.17 ClC[SiH2]Cc1ccccc1 Amb24433498 [1,0,0,0,0,0|2,0,1]=4 691 B10R1.17 ClC\C=C/c1c[n]ccc1 Amb24567985 [1,0,0,0,0,0|3,0,0]=4 692 B10R1.17 ClC\C=C\c1cccc[n]1 Amb24353572 [1,0,0,0,0,0|3,0,0]=4 693 B10R1.17 FCC#Cc1ccccc1 Amb24586400 [1,0,0,0,0,0|2,0,1]=4 694 B10R1.17 FCCCc1ccccc1 Amb25737014 [1,0,0,0,0,0|2,0,1]=4 695 B10R1.17 FCCOc1ccccc1 Amb25350055 [1,0,0,0,0,0|3,0,0]=4 696 B10R1.17 ICCCc1ccccc1 Amb10605506 [1,0,0,0,0,0|2,0,1]=4 697 B10R1.17 ICCOc1ccccc1 Amb10608588 [1,0,0,0,0,0|3,0,0]=4 698 B10R1.17 N#C\C=C\c1ccccc1 Amb1678044 [1,0,0,0,0,0|2,0,1]=4 699 B10R1.17 N=COCc1ccccc1 Amb22269902 [1,0,0,0,0,0|1,0,2]=4 700 B10R1.17 N=COCc1ccccc1 Amb24652885 [1,0,0,0,0,0|1,0,2]=4 701 B10R1.17 NCC#Cc1ccccc1 Amb1239477 [1,0,0,0,0,0|2,0,1]=4 702 B10R1.17 NCC#Cc1ccccc1 Amb2371766 [1,0,0,0,0,0|2,0,1]=4 703 B10R1.17 NCCCc1ccccc1 Amb22490482 [1,0,0,0,0,0|2,0,1]=4 704 B10R1.17 NCCNc1ccccc1 Amb23412206 [1,0,0,0,0,0|3,0,0]=4 705 B10R1.17 NCCOc1ccccc1 Amb1214559 [1,0,0,0,0,0|3,0,0]=4 706 B10R1.17 NCCOc1ccccc1 Amb2099529 [1,0,0,0,0,0|3,0,0]=4 707 B10R1.17 NCCPc1ccccc1 Amb24482461 [1,0,0,0,0,0|3,0,0]=4 708 B10R1.17 NC\C=C/c1c[n]ccc1 Amb25349251 [1,0,0,0,0,0|3,0,0]=4 709 B10R1.17 NC\C=C/c1cc[n]cc1 Amb25295348 [1,0,0,0,0,0|3,0,0]=4 710 B10R1.17 NC\C=C/c1cccc[n]1 Amb25299216 [1,0,0,0,0,0|3,0,0]=4 711 B10R1.17 NC\C=C/c1ccccc1 Amb24746209 [1,0,0,0,0,0|2,0,0]=3 712 B10R1.17 NC\C=C\c1c[n]ccc1 Amb18063302 [1,0,0,0,0,0|3,0,0]=4 713 B10R1.17 NC\C=C\c1cc[n]cc1 Amb18062333 [1,0,0,0,0,0|3,0,0]=4 714 B10R1.17 NC\C=C\c1cccc[n]1 Amb18063261 [1,0,0,0,0,0|3,0,0]=4 715 B10R1.17 NC\C=C\c1ccccc1 Amb16187112 [1,0,0,0,0,0|2,0,0]=3 716 B10R1.17 O=C\C=C/c1ccccc1 Amb20246989 [1,0,0,0,0,0|2,0,1]=4 717 B10R1.17 OCCNc1ccccc1 Amb24065196 [1,0,0,0,0,0|3,0,0]=4 718 B10R1.17 OCCNc1ccccc1 Amb24065197 [1,0,0,0,0,0|3,0,0]=4 719 B10R1.17 OCCOc1ccccc1 Amb2209344 [1,0,0,0,0,0|3,0,0]=4 720 B10R1.17 OCNCc1ccccc1 Amb24756521 [1,0,0,0,0,0|2,0,1]=4 721 B10R1.17 OCOCc1ccccc1 Amb25727798 [1,0,0,0,0,0|1,0,1]=3 722 B10R1.17 OC\C=C\c1cc[n]cc1 Amb22749186 [1,0,0,0,0,0|3,0,0]=4 723 B10R1.17 OC\C=C\c1cccc[n]1 Amb22749315 [1,0,0,0,0,0|3,0,0]=4 724 B10R1.17 OC\C=C\c1cccnc1 Amb17619713 [1,0,0,0,0,0|3,0,0]=4 725 B10R1.17 OC\C=N\c1ccccc1 Amb25740591 [1,0,0,0,0,0|3,0,0]=4 726 B10R1.17 OC\N=C\c1ccccc1 Amb25105990 [1,0,0,0,0,0|2,0,0]=3 727 B10R1.17 SCCNc1ccccc1 Amb24065195 [1,0,0,0,0,0|3,0,0]=4 728 B10R1.17 SCCSc1ccccc1 Amb13881734 [1,0,0,0,0,0|3,0,0]=4 729 B10R1.17 [NH3+]CC#Cc1ccccc1 Amb10555899 [1,0,0,0,0,0|2,0,1]=4 730 B10R1.17 [SiH3]CCCc1ccccc1 Amb22347053 [1,0,0,0,0,0|1,1,1]=4 731 B12R1.3 C#C\C(=C\CCl)\c1ccccc1 Amb24635838 [0,1,0,0,0,0|3,0,0]=4 732 B12R1.3 C=C\C(=C\CO)\c1ccccc1 Amb24619165 [0,1,0,0,0,0|3,0,0]=4 733 B12R1.3 C=C\C=C(\C=O)/c1ccccc1 Amb25768466 [0,1,0,0,0,0|1,0,2]=4 734 B12R1.3 CCCC(=[N+]=[N-])c1ccccc1 Amb24095317 [0,1,0,0,0,0|2,0,0]=3 735 B12R1.3 CCCC(CN)c1ccccc1 Amb22052580 [0,1,0,0,0,0|2,0,1]=4 736 B12R1.3 CCCC(c1ccccc1)C=O Amb17594046 [0,1,0,0,0,0|1,0,1]=3 737 B12R1.3 CCCC(c1ccccc1)CBr Amb17247626 [0,1,0,0,0,0|2,0,1]=4 738 B12R1.3 CCCC(c1ccccc1)CCl Amb17233968 [0,1,0,0,0,0|2,0,1]=4 739 B12R1.3 CCCC(c1ccccc1)CO Amb17232487 [0,1,0,0,0,0|1,0,2]=4 740 B12R1.3 CCCC(c1ccccc1)NO Amb10605018 [0,1,0,0,0,0|1,0,2]=4 741 B12R1.3 CCCN(c1ccccn1)C=O Amb10553724 [0,1,0,0,0,0|3,0,0]=4 742 B12R1.3 CCC\C(=N\N)\c1c[n]ccc1 Amb24632002 [0,1,0,0,0,0|3,0,0]=4 743 B12R1.3 CCNC(C#N)c1ccccc1 Amb22736556 [0,1,0,0,0,0|2,0,1]=4 744 B12R1.3 CCN[C@@H](CO)c1ccccc1 Amb22745949 [0,1,0,0,0,0|1,0,2]=4 745 B12R1.3 CCN\C(=N\N)\c1c[n]ccc1 Amb18788294 [0,1,0,0,0,0|3,0,0]=4 746 B12R1.3 CCN\C(=N\N)\c1cc[n]cc1 Amb18788295 [0,1,0,0,0,0|3,0,0]=4 747 B12R1.3 CCN\C(=N\N)\c1cccc[n]1 Amb18788296 [0,1,0,0,0,0|3,0,0]=4 748 B12R1.3 CCN\C(=N\N)\c1ccccc1 Amb18788199 [0,1,0,0,0,0|2,0,0]=3 749 B12R1.3 CCN\C(=N\O)\c1cc[n]cc1 Amb25375984 [0,1,0,0,0,0|2,0,1]=4 750 B12R1.3 CC\C(=C\CN)\c1ccccc1 Amb25050568 [0,1,0,0,0,0|3,0,0]=4 751 B12R1.3 CC\C(=C\CO)\c1ccccc1 Amb25816528 [0,1,0,0,0,0|3,0,0]=4 752 B12R1.3 CC\C=C(/c1ccccc1)\C=O Amb10807890 [0,1,0,0,0,0|1,0,0]=2 753 B12R1.3 CC\C=C(\CO)/c1ccccc1 Amb24397985 [0,1,0,0,0,0|1,0,1]=3 754 B12R1.3 CC\C=C(\c1ccccc1)/C#N Amb17232217 [0,1,0,0,0,0|2,0,0]=3 755 B12R1.3 CN\C(=N\OC)\c1ccccc1 Amb24519522 [0,1,0,0,0,0|3,0,0]=4 756 B12R1.3 CN\C=C(/C=S)\c1ccccc1 Amb24637960 [0,1,0,0,0,0|2,1,0]=4 757 B12R1.3 CN\C=C(\C=S)/c1ccccc1 Amb24642034 [0,1,0,0,0,0|2,1,0]=4 758 B12R1.3 COC\C(=N\N)\c1ccccc1 Amb25160254 [0,1,0,0,0,0|3,0,0]=4 759 B12R1.3 CO\C=C(/C=O)\c1ccccc1 Amb18126326 [0,1,0,0,0,0|2,0,0]=3 760 B12R1.3 CO\C=C(\C=O)/c1ccccc1 Amb24497332 [0,1,0,0,0,0|2,0,0]=3 761 B12R1.3 CO\N=C(\CCl)/c1ccccc1 Amb25700961 [0,1,0,0,0,0|3,0,0]=4 762 B12R1.3 CO\N=C(\CN)/c1ccccc1 Amb25114719 [0,1,0,0,0,0|3,0,0]=4 763 B12R1.3 CO\N=C(\CO)/c1ccccc1 Amb24413008 [0,1,0,0,0,0|2,0,1]=4 764 B12R1.3 CO\N=C(\c1ccccc1)/C=O Amb10572536 [0,1,0,0,0,0|2,0,0]=3 765 B12R1.3 CS\C=C(/C=O)\c1ccccc1 Amb18648149 [0,1,0,0,0,0|2,0,0]=3 766 B12R1.3 CS\C=C(\C=O)/c1ccccc1 Amb24605059 [0,1,0,0,0,0|2,0,0]=3 767 B12R1.3 C\C=C(\CCN)/c1ccccc1 Amb25349495 [0,1,0,0,0,0|3,0,0]=4 768 B12R1.3 C\C=C(\CCO)/c1ccccc1 Amb25256435 [0,1,0,0,0,0|3,0,0]=4 769 B12R1.3 C\C=C\C(C=O)c1ccccc1 Amb24628954 [0,1,0,0,0,0|1,0,2]=4 770 B12R1.3 NCC(c1ccccc1)OCC Amb17605997 [0,1,0,0,0,0|1,0,1]=3 771 B12R1.3 NCC\C(=N\N)\c1ccccc1 Amb24427544 [0,1,0,0,0,0|3,0,0]=4 772 B12R1.3 O=C\C(=C\CCl)\c1ccccc1 Amb25139392 [0,1,0,0,0,0|2,0,0]=3 773 B12R1.3 OCC\C(=N\O)\c1ccccc1 Amb24497634 [0,1,0,0,0,0|2,0,1]=4 774 B12R1.3 OC\C=C(\CF)/c1ccccc1 Amb25769424 [0,1,0,0,0,0|3,0,0]=4 775 B12R1.3 ON/C=C(\C=O)c1ccccc1 Amb17777667 [0,1,0,0,0,0|3,0,0]=4 776 B12R1.3 [N-]=[N+]=NC(=S=O)c1ccccc1 Amb24358220 [0,1,0,0,0,0|3,0,0]=4 777 B12R1.16 BrCCC(=O)c1ccc(cc1)Br Amb17437866 [0,1,0,0,0,0|2,0,0]=3 778 B12R1.16 BrCCC(=O)c1ccc(cc1)F Amb17437867 [0,1,0,0,0,0|2,0,0]=3 779 B12R1.16 C#CCC(=O)c1ccc(Br)cc1 Amb25669435 [0,1,0,0,0,0|1,0,2]=4 780 B12R1.16 C#CCC(=O)c1ccc(Cl)cc1 Amb18809130 [0,1,0,0,0,0|1,0,2]=4 781 B12R1.16 C#CCC(=O)c1ccc(F)cc1 Amb18800608 [0,1,0,0,0,0|1,0,2]=4 782 B12R1.16 C=C(CCO)c1ccc(Cl)cc1 Amb25760753 [0,1,0,0,0,0|3,0,0]=4 783 B12R1.16 C=C=CC(=O)c1ccc(Cl)cc1 Amb24620039 [0,1,0,0,0,0|1,0,2]=4 784 B12R1.16 C=CCC(=O)c1ccc(cc1)Br Amb17343203 [0,1,0,0,0,0|1,0,2]=4 785 B12R1.16 C=CCC(=O)c1ccc(cc1)C Amb10563159 [0,1,0,0,0,0|1,0,2]=4 786 B12R1.16 C=CCC(=O)c1ccc(cc1)Cl Amb17335459 [0,1,0,0,0,0|1,0,2]=4 787 B12R1.16 C=CCC(=O)c1ccc(cc1)F Amb17334601 [0,1,0,0,0,0|1,0,2]=4 788 B12R1.16 C=CCC(=O)c1ccc(cc1)O Amb17334557 [0,1,0,0,0,0|1,0,2]=4 789 B12R1.16 C=CNC(=O)c1ccc(N)cc1 Amb24091301 [0,1,0,0,0,0|1,0,2]=4 790 B12R1.16 C=COC(=O)c1ccc(O)cc1 Amb18645955 [0,1,0,0,0,0|0,0,2]=3 791 B12R1.16 CC=1NCC(=CN1)C(=O)OCC Amb24440877 [0,1,0,0,0,0|2,0,1]=4 792 B12R1.16 CCC=C(Cl)c1ccc(Br)cc1 Amb24064680 [0,1,0,0,0,0|2,0,0]=3 793 B12R1.16 CCCC(=C)c1ccc(N)cc1 Amb25258551 [0,1,0,0,0,0|2,0,0]=3 794 B12R1.16 CCCC(=O)c1c[n]c(Cl)cc1 Amb20242050 [0,1,0,0,0,0|2,0,0]=3 795 B12R1.16 CCCC(=O)c1ccc(N)c[n]1 Amb24729254 [0,1,0,0,0,0|2,0,0]=3 796 B12R1.16 CCCC(=O)c1ccc(cc1)Br Amb2567820 [0,1,0,0,0,0|1,0,0]=2 797 B12R1.16 CCCC(=O)c1ccc(cc1)Cl Amb1679791 [0,1,0,0,0,0|1,0,0]=2 798 B12R1.16 CCCC(=O)c1ccc(cc1)O Amb1033062 [0,1,0,0,0,0|1,0,0]=2 799 B12R1.16 CCCC(Br)c1ccc(Cl)cc1 Amb25281165 [0,1,0,0,0,0|2,0,1]=4 800 B12R1.16 CCCC(C)c1ccc(N)cc1 Amb18126395 [0,1,0,0,0,0|2,0,1]=4 801 B12R1.16 CCCC(N)c1ccc(Cl)cc1 Amb20626143 [0,1,0,0,0,0|2,0,1]=4 802 B12R1.16 CCCC(N)c1ccc(I)cc1 Amb25118824 [0,1,0,0,0,0|2,0,1]=4 803 B12R1.16 CCCC(N)c1ccc(O)cc1 Amb18939625 [0,1,0,0,0,0|2,0,1]=4 804 B12R1.16 CCCC(O)c1ccc(N)cc1 Amb24619836 [0,1,0,0,0,0|1,0,2]=4 805 B12R1.16 CCCC(c1ccc(cc1)Br)Cl Amb17160235 [0,1,0,0,0,0|2,0,1]=4 806 B12R1.16 CCCC(c1ccc(cc1)C)Cl Amb17139051 [0,1,0,0,0,0|2,0,1]=4 807 B12R1.16 CCCC(c1ccc(cc1)Cl)Cl Amb17139906 [0,1,0,0,0,0|2,0,1]=4 808 B12R1.16 CCCC(c1ccc(cc1)F)Cl Amb17139162 [0,1,0,0,0,0|2,0,1]=4 809 B12R1.16 CCCC(c1ccc(cc1)O)C Amb17594074 [0,1,0,0,0,0|2,0,1]=4 810 B12R1.16 CCCS(=O)c1ccc(N)cc1 Amb18977331 [0,1,0,0,0,0|2,0,0]=3 811 B12R1.16 CCC[C@@H](N)c1ccc(Br)cc1 Amb24729386 [0,1,0,0,0,0|2,0,1]=4 812 B12R1.16 CCC[C@@H](N)c1ccc(Cl)cc1 Amb25043269 [0,1,0,0,0,0|2,0,1]=4 813 B12R1.16 CCC[C@@H](N)c1ccc(F)cc1 Amb22298535 [0,1,0,0,0,0|2,0,1]=4 814 B12R1.16 CCC[C@@H](N)c1ccc(F)cc1 Amb22744980 [0,1,0,0,0,0|2,0,1]=4 815 B12R1.16 CCC[C@@H](N)c1ccc(I)cc1 Amb25195840 [0,1,0,0,0,0|2,0,1]=4 816 B12R1.16 CCC[C@@H](N)c1ccc(N)cc1 Amb22288661 [0,1,0,0,0,0|2,0,1]=4 817 B12R1.16 CCC[C@@H](N)c1ccc(N)cc1 Amb25149895 [0,1,0,0,0,0|2,0,1]=4 818 B12R1.16 CCC[C@@H](N)c1ccc(O)cc1 Amb22288662 [0,1,0,0,0,0|2,0,1]=4 819 B12R1.16 CCC[C@@H](N)c1ccc(O)cc1 Amb25063010 [0,1,0,0,0,0|2,0,1]=4 820 B12R1.16 CCC[C@@H](O)c1ccc(Br)cc1 Amb25069849 [0,1,0,0,0,0|1,0,2]=4 821 B12R1.16 CCC[C@@H](O)c1ccc(F)cc1 Amb24404009 [0,1,0,0,0,0|1,0,2]=4 822 B12R1.16 CCC[C@H](N)c1ccc(F)cc1 Amb22298578 [0,1,0,0,0,0|2,0,1]=4 823 B12R1.16 CCC[C@H](N)c1ccc(F)cc1 Amb24700451 [0,1,0,0,0,0|2,0,1]=4 824 B12R1.16 CCC[C@H](N)c1ccc(I)cc1 Amb25337897 [0,1,0,0,0,0|2,0,1]=4 825 B12R1.16 CCC[C@H](N)c1ccc(N)cc1 Amb22288706 [0,1,0,0,0,0|2,0,1]=4 826 B12R1.16 CCC[C@H](N)c1ccc(O)cc1 Amb22288707 [0,1,0,0,0,0|2,0,1]=4 827 B12R1.16 CCC[C@H](N)c1ccc(S)cc1 Amb24341710 [0,1,0,0,0,0|2,0,1]=4 828 B12R1.16 CCC[C@H](O)c1ccc(Cl)cc1 Amb24483363 [0,1,0,0,0,0|1,0,2]=4 829 B12R1.16 CCC[C@H](O)c1ccc(F)cc1 Amb24576719 [0,1,0,0,0,0|1,0,2]=4 830 B12R1.16 CCNC(=N)c1ccc(Br)c[n]1 Amb25856562 [0,1,0,0,0,0|3,0,0]=4 831 B12R1.16 CCNC(=N)c1ccc(Cl)c[n]1 Amb24713213 [0,1,0,0,0,0|3,0,0]=4 832 B12R1.16 CCNC(=N)c1ccc(O)cc1 Amb25173656 [0,1,0,0,0,0|2,0,0]=3 833 B12R1.16 CCNC(=O)C1=CNC(=O)C=C1 Amb18801002 [0,1,0,0,0,0|2,0,0]=3 834 B12R1.16 CCNC(=O)C1=COC(=O)C=C1 Amb24457580 [0,1,0,0,0,0|2,0,0]=3 835 B12R1.16 CCNC(=O)C=1C=CC(=O)NN1 Amb25187461 [0,1,0,0,0,0|3,0,0]=4 836 B12R1.16 CCNC(=O)c1c[n]c(N)[n]c1 Amb25802254 [0,1,0,0,0,0|3,0,0]=4 837 B12R1.16 CCNC(=O)c1c[n]c(N)c[n]1 Amb25741366 [0,1,0,0,0,0|3,0,0]=4 838 B12R1.16 CCNC(=O)c1ccc(Br)[n]c1 Amb19959846 [0,1,0,0,0,0|2,0,0]=3 839 B12R1.16 CCNC(=O)c1ccc(Cl)[n][n]1 Amb19058323 [0,1,0,0,0,0|3,0,0]=4 840 B12R1.16 CCNC(=O)c1ccc(F)c[n]1 Amb25702700 [0,1,0,0,0,0|2,0,0]=3 841 B12R1.16 CCNC(=O)c1ccc(F)cc1 Amb17775265 [0,1,0,0,0,0|1,0,0]=2 842 B12R1.16 CCNC(=O)c1ccc(N)[n][n]1 Amb18284832 [0,1,0,0,0,0|3,0,0]=4 843 B12R1.16 CCNC(=O)c1ccc(N)[n]c1 Amb18284692 [0,1,0,0,0,0|2,0,0]=3 844 B12R1.16 CCNC(=O)c1ccc(O)c[n]1 Amb25806035 [0,1,0,0,0,0|2,0,0]=3 845 B12R1.16 CCNC(=O)c1ccc(cc1)Cl Amb2221398 [0,1,0,0,0,0|1,0,0]=2 846 B12R1.16 CCNC(=O)c1ccc(cn1)Br Amb10068170 [0,1,0,0,0,0|2,0,0]=3 847 B12R1.16 CCNC(=S)c1ccc(Cl)cc1 Amb25674175 [0,1,0,0,0,0|1,1,0]=3 848 B12R1.16 CCNC(=S)c1ccc(O)cc1 Amb24400399 [0,1,0,0,0,0|1,1,0]=3 849 B12R1.16 CCNC(c1ccc(cc1)Br)C Amb1095032 [0,1,0,0,0,0|2,0,1]=4 850 B12R1.16 CCNC(c1ccc(cc1)F)C Amb10188230 [0,1,0,0,0,0|2,0,1]=4 851 B12R1.16 CCNS(=O)c1ccc(N)cc1 Amb18863098 [0,1,0,0,0,0|2,0,0]=3 852 B12R1.16 CCN[C@@H](C)c1ccc(Cl)cc1 Amb25138514 [0,1,0,0,0,0|2,0,1]=4 853 B12R1.16 CCN[C@H](C)c1ccc(Br)cc1 Amb25788596 [0,1,0,0,0,0|2,0,1]=4 854 B12R1.16 CCN[C@H](C)c1ccc(Cl)cc1 Amb24383514 [0,1,0,0,0,0|2,0,1]=4 855 B12R1.16 CCOC(=C)N1C=CC(=O)C=C1 Amb24686477 [0,1,0,0,0,0|2,0,0]=3 856 B12R1.16 CCOC(=C)c1c[n]c(Br)c[n]1 Amb24675425 [0,1,0,0,0,0|3,0,0]=4 857 B12R1.16 CCOC(=C)c1c[n]c(Cl)[n]c1 Amb25256272 [0,1,0,0,0,0|3,0,0]=4 858 B12R1.16 CCOC(=C)c1ccc(F)cc1 Amb24405743 [0,1,0,0,0,0|1,0,0]=2 859 B12R1.16 CCOC(=N)c1cc[n+]([O-])cc1 Amb24654829 [0,1,0,0,0,0|2,0,0]=3 860 B12R1.16 CCOC(=N)c1ccc(Br)cc1 Amb20673144 [0,1,0,0,0,0|1,0,0]=2 861 B12R1.16 CCOC(=N)c1ccc(Br)cc1 Amb24065887 [0,1,0,0,0,0|1,0,0]=2 862 B12R1.16 CCOC(=N)c1ccc(Cl)c[n]1 Amb24629148 [0,1,0,0,0,0|2,0,0]=3 863 B12R1.16 CCOC(=N)c1ccc(Cl)cc1 Amb19057374 [0,1,0,0,0,0|1,0,0]=2 864 B12R1.16 CCOC(=N)c1ccc(Cl)cc1 Amb20673139 [0,1,0,0,0,0|1,0,0]=2 865 B12R1.16 CCOC(=N)c1ccc(F)c[n]1 Amb25709322 [0,1,0,0,0,0|2,0,0]=3 866 B12R1.16 CCOC(=N)c1ccc(I)cc1 Amb24451092 [0,1,0,0,0,0|1,0,0]=2 867 B12R1.16 CCOC(=N)c1ccc(N)cc1 Amb25150988 [0,1,0,0,0,0|1,0,0]=2 868 B12R1.16 CCOC(=N)c1ccc(O)cc1 Amb18798395 [0,1,0,0,0,0|1,0,0]=2 869 B12R1.16 CCOC(=N)c1ccc(cc1)F Amb10072702 [0,1,0,0,0,0|1,0,0]=2 870 B12R1.16 CCOC(=O)C1=CNC(=O)C=C1 Amb20240866 [0,1,0,0,0,0|1,0,0]=2 871 B12R1.16 CCOC(=O)C1=CNC(=O)N=C1 Amb22015202 [0,1,0,0,0,0|2,0,0]=3 872 B12R1.16 CCOC(=O)C1=CNC(=O)N=C1 Amb22494788 [0,1,0,0,0,0|2,0,0]=3 873 B12R1.16 CCOC(=O)C1CCC(=O)C=C1 Amb24117007 [0,1,0,0,0,0|0,0,3]=4 874 B12R1.16 CCOC(=O)C=1C=CC(=O)NN1 Amb18003087 [0,1,0,0,0,0|2,0,0]=3 875 B12R1.16 CCOC(=O)C=1C=CC(=S)NC1 Amb19373085 [0,1,0,0,0,0|1,0,0]=2 876 B12R1.16 CCOC(=O)C=1C=NC(=S)NC1 Amb22490832 [0,1,0,0,0,0|2,0,0]=3 877 B12R1.16 CCOC(=O)C=1CNC(=S)NC1 Amb25804195 [0,1,0,0,0,0|2,0,1]=4 878 B12R1.16 CCOC(=O)C=1CSC(=S)NC1 Amb24358213 [0,1,0,0,0,0|2,0,1]=4 879 B12R1.16 CCOC(=O)N1CCC(=O)C=C1 Amb25340967 [0,1,0,0,0,0|1,0,2]=4 880 B12R1.16 CCOC(=O)[13c]1[13cH][13cH][13c](N)[13cH][13cH]1 Amb22054401 [0,1,0,0,0,0|0,0,0]=1 881 B12R1.16 CCOC(=O)c1[n]cc(Cl)c[n]1 Amb23439140 [0,1,0,0,0,0|2,0,0]=3 882 B12R1.16 CCOC(=O)c1[n]cc(F)c[n]1 Amb24485438 [0,1,0,0,0,0|2,0,0]=3 883 B12R1.16 CCOC(=O)c1[n]cc(N)c[n]1 Amb23412488 [0,1,0,0,0,0|2,0,0]=3 884 B12R1.16 CCOC(=O)c1[n]cc(O)c[n]1 Amb22499473 [0,1,0,0,0,0|2,0,0]=3 885 B12R1.16 CCOC(=O)c1c[n]c(Br)[n]c1 Amb24432526 [0,1,0,0,0,0|2,0,0]=3 886 B12R1.16 CCOC(=O)c1c[n]c(Br)c[n]1 Amb19957595 [0,1,0,0,0,0|2,0,0]=3 887 B12R1.16 CCOC(=O)c1c[n]c(Cl)c[n]1 Amb21964837 [0,1,0,0,0,0|2,0,0]=3 888 B12R1.16 CCOC(=O)c1c[n]c(N)c[n]1 Amb22755437 [0,1,0,0,0,0|2,0,0]=3 889 B12R1.16 CCOC(=O)c1c[n]c(O)[n]c1 Amb21858291 [0,1,0,0,0,0|2,0,0]=3 890 B12R1.16 CCOC(=O)c1c[n]c(O)c[n]1 Amb21964496 [0,1,0,0,0,0|2,0,0]=3 891 B12R1.16 CCOC(=O)c1cc[n+](N)cc1 Amb25304142 [0,1,0,0,0,0|1,0,0]=2 892 B12R1.16 CCOC(=O)c1cc[n+]([O-])cc1 Amb21961771 [0,1,0,0,0,0|1,0,0]=2 893 B12R1.16 CCOC(=O)c1ccc(C)nn1 Amb17798485 [0,1,0,0,0,0|2,0,0]=3 894 B12R1.16 CCOC(=O)c1ccc(Cl)[nH+]c1 Amb22443406 [0,1,0,0,0,0|1,0,0]=2 895 B12R1.16 CCOC(=O)c1ccc(Cl)[n][n]1 Amb24081665 [0,1,0,0,0,0|2,0,0]=3 896 B12R1.16 CCOC(=O)c1ccc(F)[n]c1 Amb22233836 [0,1,0,0,0,0|1,0,0]=2 897 B12R1.16 CCOC(=O)c1ccc(F)c[n]1 Amb19930070 [0,1,0,0,0,0|1,0,0]=2 898 B12R1.16 CCOC(=O)c1ccc(F)cc1 Amb24065627 [0,1,0,0,0,0|0,0,0]=1 899 B12R1.16 CCOC(=O)c1ccc(I)c[n]1 Amb23412377 [0,1,0,0,0,0|1,0,0]=2 900 B12R1.16 CCOC(=O)c1ccc(N)c[n]1 Amb18646487 [0,1,0,0,0,0|1,0,0]=2 901 B12R1.16 CCOC(=O)c1ccc(N)nn1 Amb17739970 [0,1,0,0,0,0|2,0,0]=3 902 B12R1.16 CCOC(=O)c1ccc(O)c[n]1 Amb22490288 [0,1,0,0,0,0|1,0,0]=2 903 B12R1.16 CCOC(=O)c1ccc(O)cc1 Amb22232467 [0,1,0,0,0,0|0,0,0]=1 904 B12R1.16 CCOC(=O)c1ccc(S)cc1 Amb25263975 [0,1,0,0,0,0|0,0,0]=1 905 B12R1.16 CCOC(=O)c1ccc(cc1)N Amb1196078 [0,1,0,0,0,0|0,0,0]=1 906 B12R1.16 CCOC(=O)c1ccc(nc1)S Amb1130781 [0,1,0,0,0,0|1,0,0]=2 907 B12R1.16 CCOC(=O)c1ccc(nn1)O Amb10879437 [0,1,0,0,0,0|2,0,0]=3 908 B12R1.16 CCOC(=O)c1ccc(nn1)S Amb10879438 [0,1,0,0,0,0|2,0,0]=3 909 B12R1.16 CCOC(=O)c1cnc(cn1)N Amb16232001 [0,1,0,0,0,0|2,0,0]=3 910 B12R1.16 CCOC(=O)c1cnc(nc1)Cl Amb17621544 [0,1,0,0,0,0|2,0,0]=3 911 B12R1.16 CCOC(=O)c1ncc(Br)cn1 Amb17935844 [0,1,0,0,0,0|2,0,0]=3 912 B12R1.16 CCOC(=S)c1ccc(O)cc1 Amb25371826 [0,1,0,0,0,0|0,1,0]=2 913 B12R1.16 CCOC(=S)c1ccc(cc1)Cl Amb10574173 [0,1,0,0,0,0|0,1,0]=2 914 B12R1.16 CCOC(C)c1ccc(Br)cc1 Amb23443733 [0,1,0,0,0,0|1,0,1]=3 915 B12R1.16 CCOC(C)c1ccc(N)cc1 Amb18974004 [0,1,0,0,0,0|1,0,1]=3 916 B12R1.16 CCOC(C)c1ccc(S)cc1 Amb23568732 [0,1,0,0,0,0|1,0,1]=3 917 B12R1.16 CCOS(=O)c1ccc(Cl)cc1 Amb25114237 [0,1,0,0,0,0|1,0,0]=2 918 B12R1.16 CCSC(=O)c1ccc(O)cc1 Amb24497128 [0,1,0,0,0,0|0,1,0]=2 919 B12R1.16 CCSC(C)c1ccc(N)cc1 Amb18974009 [0,1,0,0,0,0|1,1,1]=4 920 B12R1.16 CN(OCC)c1ccc(N)[n]c1 Amb25327747 [0,1,0,0,0,0|3,0,0]=4 921 B12R1.16 CNCC(=C)c1ccc(O)cc1 Amb24727996 [0,1,0,0,0,0|3,0,0]=4 922 B12R1.16 CNCC(=O)c1ccc(F)cc1 Amb24121219 [0,1,0,0,0,0|2,0,0]=3 923 B12R1.16 CNCC(=O)c1ccc(N)cc1 Amb18550919 [0,1,0,0,0,0|2,0,0]=3 924 B12R1.16 CNCC(=O)c1ccc(cc1)Br Amb17248090 [0,1,0,0,0,0|2,0,0]=3 925 B12R1.16 CNCC(=O)c1ccc(cc1)C Amb17232427 [0,1,0,0,0,0|2,0,0]=3 926 B12R1.16 CNCC(=O)c1ccc(cc1)F Amb17232631 [0,1,0,0,0,0|2,0,0]=3 927 B12R1.16 CNCC(=O)c1ccc(cc1)O Amb1075808 [0,1,0,0,0,0|2,0,0]=3 928 B12R1.16 CNOC(=O)c1ccc(Cl)cc1 Amb22441604 [0,1,0,0,0,0|1,0,0]=2 929 B12R1.16 CNOC(=O)c1ccc(I)cc1 Amb22434649 [0,1,0,0,0,0|1,0,0]=2 930 B12R1.16 COCC(=C)c1ccc(N)cc1 Amb18126371 [0,1,0,0,0,0|3,0,0]=4 931 B12R1.16 COCC(=O)c1ccc(Cl)[n]c1 Amb25758146 [0,1,0,0,0,0|3,0,0]=4 932 B12R1.16 COCC(=O)c1ccc(cc1)N Amb17202004 [0,1,0,0,0,0|2,0,0]=3 933 B12R1.16 COCC(=O)c1ccc(cc1)O Amb17616985 [0,1,0,0,0,0|2,0,0]=3 934 B12R1.16 COCS(=O)c1ccc(F)cc1 Amb24760828 [0,1,0,0,0,0|3,0,0]=4 935 B12R1.16 COCS(=O)c1ccc(N)cc1 Amb25742705 [0,1,0,0,0,0|3,0,0]=4 936 B12R1.16 CONC(=O)C1=CNC(=O)C=C1 Amb18381822 [0,1,0,0,0,0|3,0,0]=4 937 B12R1.16 CONC(=O)c1ccc(N)c[n]1 Amb24573734 [0,1,0,0,0,0|3,0,0]=4 938 B12R1.16 CONC(=O)c1ccc(N)cc1 Amb25831620 [0,1,0,0,0,0|2,0,0]=3 939 B12R1.16 CONC(=O)c1ccc(O)cc1 Amb25124655 [0,1,0,0,0,0|2,0,0]=3 940 B12R1.16 CONC(=O)c1ccc(cc1)Br Amb16072951 [0,1,0,0,0,0|2,0,0]=3 941 B12R1.16 CONC(=O)c1ccc(cc1)C Amb16980459 [0,1,0,0,0,0|2,0,0]=3 942 B12R1.16 CONC(=O)c1ccc(cc1)F Amb16969919 [0,1,0,0,0,0|2,0,0]=3 943 B12R1.16 CONC(=O)c1ccc(cc1)I Amb16072956 [0,1,0,0,0,0|2,0,0]=3 944 B12R1.16 CO\N=C(/N)\c1ccc(Br)cc1 Amb18227753 [0,1,0,0,0,0|3,0,0]=4 945 B12R1.16 CO\N=C(/N)\c1ccc(Cl)cc1 Amb18863111 [0,1,0,0,0,0|3,0,0]=4 946 B12R1.16 CO\N=C(/N)\c1ccc(F)cc1 Amb18862745 [0,1,0,0,0,0|3,0,0]=4 947 B12R1.16 CSCC(=O)c1ccc(Br)cc1 Amb24638487 [0,1,0,0,0,0|2,0,0]=3 948 B12R1.16 CSCC(=O)c1ccc(Cl)cc1 Amb18320090 [0,1,0,0,0,0|2,0,0]=3 949 B12R1.16 CSCC(=O)c1ccc(F)cc1 Amb19057445 [0,1,0,0,0,0|2,0,0]=3 950 B12R1.16 CSCC(=O)c1ccc(I)cc1 Amb25826398 [0,1,0,0,0,0|2,0,0]=3 951 B12R1.16 CSCC(=O)c1ccc(O)cc1 Amb18181564 [0,1,0,0,0,0|2,0,0]=3 952 B12R1.16 C[n+]1ccc(cc1)C(=O)OCC Amb22263420 [0,1,0,0,0,0|1,0,0]=2 953 B12R1.16 C\C(=C/CCl)\c1ccc(Cl)cc1 Amb25300391 [0,1,0,0,0,0|3,0,0]=4 954 B12R1.16 C\C(=C\CN)\c1ccc(Br)cc1 Amb25273473 [0,1,0,0,0,0|3,0,0]=4 955 B12R1.16 C\C(=C\CN)\c1ccc(Cl)cc1 Amb25273472 [0,1,0,0,0,0|3,0,0]=4 956 B12R1.16 C\C(=C\CN)\c1ccc(F)cc1 Amb24662850 [0,1,0,0,0,0|3,0,0]=4 957 B12R1.16 C\C(=C\CN)\c1ccc(I)cc1 Amb24660584 [0,1,0,0,0,0|3,0,0]=4 958 B12R1.16 C\C(=C\CO)\c1ccc(Br)cc1 Amb24579789 [0,1,0,0,0,0|3,0,0]=4 959 B12R1.16 C\C(=C\CO)\c1ccc(F)cc1 Amb25848827 [0,1,0,0,0,0|3,0,0]=4 960 B12R1.16 C\C(=N/OC)\c1ccc(Cl)cc1 Amb21856198 [0,1,0,0,0,0|3,0,0]=4 961 B12R1.16 C\C(=N\NC)\c1ccc(Cl)cc1 Amb25160129 [0,1,0,0,0,0|3,0,0]=4 962 B12R1.16 C\C(=N\NC)\c1ccc(N)cc1 Amb24720450 [0,1,0,0,0,0|3,0,0]=4 963 B12R1.16 C\C(=N\OC)\c1ccc(Cl)cc1 Amb24556729 [0,1,0,0,0,0|3,0,0]=4 964 B12R1.16 C\C(=N\OC)\c1ccc(N)cc1 Amb25764511 [0,1,0,0,0,0|3,0,0]=4 965 B12R1.16 C\C(=N\OC)\c1ccc(O)cc1 Amb24747784 [0,1,0,0,0,0|3,0,0]=4 966 B12R1.16 C\C=C\C(=O)c1ccc(cc1)C Amb10574127 [0,1,0,0,0,0|1,0,1]=3 967 B12R1.16 C\C=C\C(=O)c1ccc(cc1)Cl Amb10574128 [0,1,0,0,0,0|1,0,1]=3 968 B12R1.16 Cc1c[n]c([n]c1)C(=O)CCC Amb25735788 [0,1,0,0,0,0|3,0,0]=4 969 B12R1.16 Cc1c[n]c([n]c1)C(=O)OCC Amb22490769 [0,1,0,0,0,0|2,0,0]=3 970 B12R1.16 Cc1c[n]c(c[n]1)C(=O)OCC Amb18801006 [0,1,0,0,0,0|2,0,0]=3 971 B12R1.16 Cc1ccc([n]c1)C(=N)OCC Amb25058006 [0,1,0,0,0,0|2,0,0]=3 972 B12R1.16 Cc1ccc([n]c1)C(=O)NOC Amb25787949 [0,1,0,0,0,0|3,0,0]=4 973 B12R1.16 Cc1ccc([n]c1)C(=O)OCC Amb19958117 [0,1,0,0,0,0|1,0,0]=2 974 B12R1.16 Cc1ccc(c[n]1)C(=N)OCC Amb25751706 [0,1,0,0,0,0|2,0,0]=3 975 B12R1.16 Cc1ccc(c[n]1)C(=O)CCN Amb24560240 [0,1,0,0,0,0|3,0,0]=4 976 B12R1.16 Cc1ccc(c[n]1)C(=O)CNC Amb25154107 [0,1,0,0,0,0|3,0,0]=4 977 B12R1.16 Cc1ccc(c[n]1)C(=O)COC Amb25779164 [0,1,0,0,0,0|3,0,0]=4 978 B12R1.16 Cc1ccc(c[n]1)C(=O)NCC Amb25093070 [0,1,0,0,0,0|2,0,0]=3 979 B12R1.16 Cc1ccc(c[n]1)C(=O)NOC Amb25110926 [0,1,0,0,0,0|3,0,0]=4 980 B12R1.16 Cc1ccc(cc1)C(=N)OCC Amb18792492 [0,1,0,0,0,0|1,0,0]=2 981 B12R1.16 Cc1ccc(cc1)C(=N)OCC Amb20673131 [0,1,0,0,0,0|1,0,0]=2 982 B12R1.16 Cc1ccc(cc1)C(=O)C=C=C Amb24737473 [0,1,0,0,0,0|1,0,2]=4 983 B12R1.16 Cc1ccc(cc1)C(=O)CC#C Amb18799924 [0,1,0,0,0,0|1,0,2]=4 984 B12R1.16 Cc1ccc(cc1)C(=O)CCO Amb18563614 [0,1,0,0,0,0|2,0,0]=3 985 B12R1.16 Cc1ccc(cc1)C(=O)CNO Amb25140702 [0,1,0,0,0,0|3,0,0]=4 986 B12R1.16 Cc1ccc(cc1)C(=O)CON Amb25777089 [0,1,0,0,0,0|3,0,0]=4 987 B12R1.16 Cc1ccc(cc1)C(=O)CSC Amb18796320 [0,1,0,0,0,0|2,0,0]=3 988 B12R1.16 Cc1ccc(cc1)C(=O)NC#N Amb24096516 [0,1,0,0,0,0|2,0,1]=4 989 B12R1.16 Cc1ccc(cc1)C(=O)NC=O Amb24096616 [0,1,0,0,0,0|2,0,1]=4 990 B12R1.16 Cc1ccc(cc1)C(=O)\C=C\Cl Amb25774994 [0,1,0,0,0,0|2,0,1]=4 991 B12R1.16 Cc1ccc(cc1)C(=O)\C=N/O Amb24531419 [0,1,0,0,0,0|3,0,0]=4 992 B12R1.16 Cc1ccc(cc1)C(=S)NCO Amb25751184 [0,1,0,0,0,0|2,1,0]=4 993 B12R1.16 Cc1ccc(cc1)N(C)CCC Amb25154383 [0,1,0,0,0,0|3,0,0]=4 994 B12R1.16 Cc1ccc(cc1)P(=O)OCC Amb25675529 [0,1,0,0,0,0|1,0,0]=2 995 B12R1.16 Cc1ccc(cc1)S(=O)CCN Amb18290917 [0,1,0,0,0,0|3,0,0]=4 996 B12R1.16 Cc1ccc(cc1)S(=O)CCO Amb24578332 [0,1,0,0,0,0|3,0,0]=4 997 B12R1.16 Cc1ccc(cc1)[C@@H](C)NCC Amb24425911 [0,1,0,0,0,0|2,0,1]=4 998 B12R1.16 Cc1ccc(cc1)[C@@H](N)CCC Amb22298580 [0,1,0,0,0,0|2,0,1]=4 999 B12R1.16 Cc1ccc(cc1)[C@@H](O)CCC Amb24364768 [0,1,0,0,0,0|1,0,2]=4 1000 B12R1.16 Cc1ccc(cc1)[C@H](C)NCC Amb24415678 [0,1,0,0,0,0|2,0,1]=4 1001 B12R1.16 Cc1ccc(cc1)[C@H](N)CCC Amb22298537 [0,1,0,0,0,0|2,0,1]=4 1002 B12R1.16 Cc1ccc(cc1)[C@H](O)CCC Amb24709228 [0,1,0,0,0,0|1,0,2]=4 1003 B12R1.16 Cc1ccc(cc1)\C(\C)=C/NC Amb25804209 [0,1,0,0,0,0|3,0,0]=4 1004 B12R1.16 Cc1ccc(cc1)\C(\C)=N/NC Amb25816631 [0,1,0,0,0,0|3,0,0]=4 1005 B12R1.16 Cc1ccc(cc1)\C(\N)=N\OC Amb18862602 [0,1,0,0,0,0|3,0,0]=4 1006 B12R1.16 ClCCC(=O)c1ccc(cc1)F Amb1233062 [0,1,0,0,0,0|2,0,0]=3 1007 B12R1.16 ClCCC(=O)c1ccc(cc1)N Amb17202006 [0,1,0,0,0,0|2,0,0]=3 1008 B12R1.16 F\C(=C/CCl)\c1ccc(Cl)cc1 Amb25726955 [0,1,0,0,0,0|3,0,0]=4 1009 B12R1.16 F\C(=C\CCl)\c1ccc(Cl)cc1 Amb24705619 [0,1,0,0,0,0|3,0,0]=4 1010 B12R1.16 N#CCC(=O)c1ccc(cc1)C Amb1981339 [0,1,0,0,0,0|2,0,1]=4 1011 B12R1.16 N#CCC(=O)c1ccc(cc1)Cl Amb1648832 [0,1,0,0,0,0|2,0,1]=4 1012 B12R1.16 N#CCC(=O)c1ccc(cc1)F Amb1661968 [0,1,0,0,0,0|2,0,1]=4 1013 B12R1.16 N#CCC(=O)c1ccc(cc1)O Amb10071606 [0,1,0,0,0,0|2,0,1]=4 1014 B12R1.16 N#CNC(=O)c1ccc(Cl)cc1 Amb24419183 [0,1,0,0,0,0|2,0,1]=4 1015 B12R1.16 N#CNC(=O)c1ccc(I)cc1 Amb25769684 [0,1,0,0,0,0|2,0,1]=4 1016 B12R1.16 N#CNC(=O)c1ccc(O)cc1 Amb24532497 [0,1,0,0,0,0|2,0,1]=4 1017 B12R1.16 N#CSC(=O)c1ccc(Cl)cc1 Amb24442349 [0,1,0,0,0,0|1,1,1]=4 1018 B12R1.16 NCCC(=O)c1ccc(cc1)Br Amb17195655 [0,1,0,0,0,0|2,0,0]=3 1019 B12R1.16 NCCC(=O)c1ccc(cc1)C Amb17194471 [0,1,0,0,0,0|2,0,0]=3 1020 B12R1.16 NCCC(=O)c1ccc(cc1)Cl Amb17194559 [0,1,0,0,0,0|2,0,0]=3 1021 B12R1.16 NCCC(=O)c1ccc(cc1)F Amb17108934 [0,1,0,0,0,0|2,0,0]=3 1022 B12R1.16 NCCS(=O)c1ccc(Br)cc1 Amb18290919 [0,1,0,0,0,0|3,0,0]=4 1023 B12R1.16 NCCS(=O)c1ccc(Cl)cc1 Amb18974515 [0,1,0,0,0,0|3,0,0]=4 1024 B12R1.16 NCCS(=O)c1ccc(F)cc1 Amb18974517 [0,1,0,0,0,0|3,0,0]=4 1025 B12R1.16 NCCS(=O)c1ccc(I)cc1 Amb25315872 [0,1,0,0,0,0|3,0,0]=4 1026 B12R1.16 NC\C=C(/Cl)\c1ccc(F)cc1 Amb24411455 [0,1,0,0,0,0|3,0,0]=4 1027 B12R1.16 NOCC(=O)c1ccc(Br)cc1 Amb25159956 [0,1,0,0,0,0|3,0,0]=4 1028 B12R1.16 N\C=C\C(=O)c1ccc(cc1)Br Amb16187725 [0,1,0,0,0,0|2,0,1]=4 1029 B12R1.16 Nc1ccc(cc1)C(=O)CCN Amb24550545 [0,1,0,0,0,0|2,0,0]=3 1030 B12R1.16 Nc1ccc(cc1)C(=O)NC#N Amb24091298 [0,1,0,0,0,0|2,0,1]=4 1031 B12R1.16 O=C(CC=O)c1ccc(I)cc1 Amb24748951 [0,1,0,0,0,0|2,0,1]=4 1032 B12R1.16 O=C(CCCl)c1ccc(I)cc1 Amb24417846 [0,1,0,0,0,0|2,0,0]=3 1033 B12R1.16 O=C(N=C=O)c1ccc(I)cc1 Amb25160063 [0,1,0,0,0,0|2,0,1]=4 1034 B12R1.16 O=C(c1ccc(cc1)O)N=[N+]=[N-] Amb16202814 [0,1,0,0,0,0|3,0,0]=4 1035 B12R1.16 O=C=NC(=O)c1ccc(cc1)Br Amb17247242 [0,1,0,0,0,0|2,0,1]=4 1036 B12R1.16 O=S(CCCl)c1ccc(F)cc1 Amb24536748 [0,1,0,0,0,0|3,0,0]=4 1037 B12R1.16 OCCC(=O)c1ccc(Br)cc1 Amb18069914 [0,1,0,0,0,0|2,0,0]=3 1038 B12R1.16 OCCC(=O)c1ccc(Cl)cc1 Amb18564305 [0,1,0,0,0,0|2,0,0]=3 1039 B12R1.16 OCCC(=O)c1ccc(cc1)F Amb1111123 [0,1,0,0,0,0|2,0,0]=3 1040 B12R1.16 OCNC(=S)c1ccc(Cl)cc1 Amb25081413 [0,1,0,0,0,0|2,1,0]=4 1041 B12R1.16 OC\C=C(\F)/c1ccc(Cl)cc1 Amb24569989 [0,1,0,0,0,0|3,0,0]=4 1042 B12R1.16 O\N=C\C(=O)c1ccc(cc1)Cl Amb2434431 [0,1,0,0,0,0|3,0,0]=4 1043 B12R1.16 Oc1ccc(cc1)C(=O)CCCl Amb18552996 [0,1,0,0,0,0|2,0,0]=3 1044 B12R1.16 Oc1ccc(cc1)C(=O)N=C=S Amb25128266 [0,1,0,0,0,0|2,0,1]=4 1045 B12R1.16 Oc1ccc(cc1)C(=O)NC=O Amb25255361 [0,1,0,0,0,0|2,0,1]=4 1046 B12R1.16 Oc1ccc(cc1)C(=O)OCF Amb24357184 [0,1,0,0,0,0|1,0,0]=2 1047 B12R1.16 Oc1ccc(cc1)C(=O)\C=N\O Amb25113482 [0,1,0,0,0,0|3,0,0]=4 1048 B12R1.16 S=C=NC(=O)c1ccc(cc1)Cl Amb1649095 [0,1,0,0,0,0|2,0,1]=4 1049 B12R1.16 SCCC(=O)c1ccc(cc1)Br Amb17411234 [0,1,0,0,0,0|2,0,0]=3 1050 B12R1.16 SCCC(=O)c1ccc(cc1)C Amb17400836 [0,1,0,0,0,0|2,0,0]=3 1051 B12R1.16 SCCC(=O)c1ccc(cc1)Cl Amb17402391 [0,1,0,0,0,0|2,0,0]=3 1052 B12R1.16 SCCC(=O)c1ccc(cc1)F Amb17401021 [0,1,0,0,0,0|2,0,0]=3 1053 B12R1.16 [O-]\C=C/C(=O)c1ccc(Cl)cc1 Amb22330574 [0,1,0,0,0,0|2,0,1]=4 1054 B12R1.16 [O-]\C=C/C(=O)c1ccc(Cl)cc1 Amb24121228 [0,1,0,0,0,0|2,0,1]=4 1055 B12R1.16 [O-]\C=C\C(=O)c1ccc(Cl)cc1 Amb24109294 [0,1,0,0,0,0|2,0,1]=4 1056 B12R1.16 [O-]\C=C\C(=O)c1ccc(I)cc1 Amb25782069 [0,1,0,0,0,0|2,0,1]=4 1057 B12R1.17 BrCCC(=O)c1cccc(c1)Br Amb17437897 [0,1,0,0,0,0|2,0,0]=3 1058 B12R1.17 C#CCC(=O)c1cccc(Br)c1 Amb24352657 [0,1,0,0,0,0|1,0,2]=4 1059 B12R1.17 C#CCC(=O)c1cccc(Cl)c1 Amb18809131 [0,1,0,0,0,0|1,0,2]=4 1060 B12R1.17 C#CCC(=O)c1cccc(F)c1 Amb18800609 [0,1,0,0,0,0|1,0,2]=4 1061 B12R1.17 C#CCC(=O)c1cccc(I)c1 Amb24578460 [0,1,0,0,0,0|1,0,2]=4 1062 B12R1.17 C#CCC(=O)c1cccc(N)c1 Amb25789711 [0,1,0,0,0,0|1,0,2]=4 1063 B12R1.17 C=C(CCO)c1cc(F)ccc1 Amb25098576 [0,1,0,0,0,0|3,0,0]=4 1064 B12R1.17 C=C=CC(=O)c1cccc(F)c1 Amb24709385 [0,1,0,0,0,0|1,0,2]=4 1065 B12R1.17 C=CCC(=O)c1cccc(F)c1 Amb18788273 [0,1,0,0,0,0|1,0,2]=4 1066 B12R1.17 C=CCC(=O)c1cccc(N)c1 Amb24453604 [0,1,0,0,0,0|1,0,2]=4 1067 B12R1.17 C=CCC(=O)c1cccc(c1)Br Amb17343201 [0,1,0,0,0,0|1,0,2]=4 1068 B12R1.17 C=CCC(=O)c1cccc(c1)C Amb17334498 [0,1,0,0,0,0|1,0,2]=4 1069 B12R1.17 C=CCC(=O)c1cccc(c1)Cl Amb17335457 [0,1,0,0,0,0|1,0,2]=4 1070 B12R1.17 C=CCC(=O)c1cccc(c1)O Amb17334559 [0,1,0,0,0,0|1,0,2]=4 1071 B12R1.17 C=CNC(=O)c1cccc(Cl)c1 Amb24490413 [0,1,0,0,0,0|1,0,2]=4 1072 B12R1.17 C=COC(=O)c1cccc(O)c1 Amb18645954 [0,1,0,0,0,0|0,0,2]=3 1073 B12R1.17 CCCC(=O)c1c[n]cc(Br)c1 Amb24535416 [0,1,0,0,0,0|2,0,0]=3 1074 B12R1.17 CCCC(=O)c1c[n]cc(Cl)c1 Amb25101093 [0,1,0,0,0,0|2,0,0]=3 1075 B12R1.17 CCCC(=O)c1c[n]cc(F)c1 Amb18792901 [0,1,0,0,0,0|2,0,0]=3 1076 B12R1.17 CCCC(=O)c1cc(I)ccc1 Amb24424807 [0,1,0,0,0,0|1,0,0]=2 1077 B12R1.17 CCCC(=O)c1cc(N)ccc1 Amb22730482 [0,1,0,0,0,0|1,0,0]=2 1078 B12R1.17 CCCC(=O)c1cc(O)ccc1 Amb24736503 [0,1,0,0,0,0|1,0,0]=2 1079 B12R1.17 CCCC(=O)c1cccc(c1)Br Amb17193987 [0,1,0,0,0,0|1,0,0]=2 1080 B12R1.17 CCCC(=O)c1cccc(c1)Cl Amb17198744 [0,1,0,0,0,0|1,0,0]=2 1081 B12R1.17 CCCC(=O)c1cccc(c1)F Amb17232581 [0,1,0,0,0,0|1,0,0]=2 1082 B12R1.17 CCCC(C)c1cccc(Br)c1 Amb25281341 [0,1,0,0,0,0|2,0,1]=4 1083 B12R1.17 CCCC(N)c1cc(O)ccc1 Amb24379131 [0,1,0,0,0,0|2,0,1]=4 1084 B12R1.17 CCCC(O)c1cc(I)ccc1 Amb25310854 [0,1,0,0,0,0|1,0,2]=4 1085 B12R1.17 CCCC(O)c1cc(N)ccc1 Amb25087129 [0,1,0,0,0,0|1,0,2]=4 1086 B12R1.17 CCCC(O)c1cc(O)ccc1 Amb24706852 [0,1,0,0,0,0|1,0,2]=4 1087 B12R1.17 CCCC(c1cccc(c1)Br)O Amb17248424 [0,1,0,0,0,0|1,0,2]=4 1088 B12R1.17 CCCC(c1cccc(c1)C)N Amb17232449 [0,1,0,0,0,0|2,0,1]=4 1089 B12R1.17 CCCC(c1cccc(c1)C)O Amb17232484 [0,1,0,0,0,0|1,0,2]=4 1090 B12R1.17 CCCC(c1cccc(c1)Cl)N Amb17234050 [0,1,0,0,0,0|2,0,1]=4 1091 B12R1.17 CCCC(c1cccc(c1)Cl)O Amb17234155 [0,1,0,0,0,0|1,0,2]=4 1092 B12R1.17 CCCC(c1cccc(c1)F)N Amb17232649 [0,1,0,0,0,0|2,0,1]=4 1093 B12R1.17 CCCC(c1cccc(c1)F)O Amb17232673 [0,1,0,0,0,0|1,0,2]=4 1094 B12R1.17 CCCN(C)c1cccc(Br)c1 Amb25154384 [0,1,0,0,0,0|3,0,0]=4 1095 B12R1.17 CCCN(C)c1cccc(F)c1 Amb25285140 [0,1,0,0,0,0|3,0,0]=4 1096 B12R1.17 CCCN(C)c1cccc(O)c1 Amb18646357 [0,1,0,0,0,0|3,0,0]=4 1097 B12R1.17 CCC[C@@H](N)c1cc(Br)ccc1 Amb25301508 [0,1,0,0,0,0|2,0,1]=4 1098 B12R1.17 CCC[C@@H](N)c1cc(Cl)ccc1 Amb24426769 [0,1,0,0,0,0|2,0,1]=4 1099 B12R1.17 CCC[C@@H](N)c1cc(F)ccc1 Amb25709212 [0,1,0,0,0,0|2,0,1]=4 1100 B12R1.17 CCC[C@@H](N)c1cc(O)ccc1 Amb25328595 [0,1,0,0,0,0|2,0,1]=4 1101 B12R1.17 CCC[C@@H](O)c1cc(Cl)ccc1 Amb25069848 [0,1,0,0,0,0|1,0,2]=4 1102 B12R1.17 CCC[C@H](N)c1cc(Br)ccc1 Amb24400381 [0,1,0,0,0,0|2,0,1]=4 1103 B12R1.17 CCC[C@H](O)c1cc(Br)ccc1 Amb25762439 [0,1,0,0,0,0|1,0,2]=4 1104 B12R1.17 CCNC(=N)c1cccc(O)c1 Amb24438252 [0,1,0,0,0,0|2,0,0]=3 1105 B12R1.17 CCNC(=O)C1=CC=CC(=O)N1 Amb25344085 [0,1,0,0,0,0|2,0,0]=3 1106 B12R1.17 CCNC(=O)C=1CC=CN(C)C1 Amb24497142 [0,1,0,0,0,0|2,0,1]=4 1107 B12R1.17 CCNC(=O)c1[n]c(N)cc[n]1 Amb25097537 [0,1,0,0,0,0|3,0,0]=4 1108 B12R1.17 CCNC(=O)c1c[n]cc(Cl)c1 Amb25310537 [0,1,0,0,0,0|2,0,0]=3 1109 B12R1.17 CCNC(=O)c1c[n]cc(F)c1 Amb24387214 [0,1,0,0,0,0|2,0,0]=3 1110 B12R1.17 CCNC(=O)c1c[n]cc(N)[n]1 Amb25159943 [0,1,0,0,0,0|3,0,0]=4 1111 B12R1.17 CCNC(=O)c1c[n]cc(N)c1 Amb23452696 [0,1,0,0,0,0|2,0,0]=3 1112 B12R1.17 CCNC(=O)c1c[n]cc(O)c1 Amb25085866 [0,1,0,0,0,0|2,0,0]=3 1113 B12R1.17 CCNC(=O)c1cc[n]c(Br)c1 Amb19959849 [0,1,0,0,0,0|2,0,0]=3 1114 B12R1.17 CCNC(=O)c1cc[n]c(F)c1 Amb18788750 [0,1,0,0,0,0|2,0,0]=3 1115 B12R1.17 CCNC(=O)c1cc[n]c(N)c1 Amb18959054 [0,1,0,0,0,0|2,0,0]=3 1116 B12R1.17 CCNC(=O)c1cccc(Cl)[n]1 Amb19075151 [0,1,0,0,0,0|2,0,0]=3 1117 B12R1.17 CCNC(=O)c1cccc(N)[n]1 Amb18959762 [0,1,0,0,0,0|2,0,0]=3 1118 B12R1.17 CCNC(=O)c1cccc(c1)N Amb2193629 [0,1,0,0,0,0|1,0,0]=2 1119 B12R1.17 CCNC(C)c1cccc(I)c1 Amb25061694 [0,1,0,0,0,0|2,0,1]=4 1120 B12R1.17 CCNC(C)c1cccc(S)c1 Amb25798719 [0,1,0,0,0,0|2,0,1]=4 1121 B12R1.17 CCN[C@@H](C)c1cccc(Cl)c1 Amb25081589 [0,1,0,0,0,0|2,0,1]=4 1122 B12R1.17 CCN[C@H](C)c1cccc(Br)c1 Amb25075777 [0,1,0,0,0,0|2,0,1]=4 1123 B12R1.17 CCN[C@H](C)c1cccc(Cl)c1 Amb25067502 [0,1,0,0,0,0|2,0,1]=4 1124 B12R1.17 CCOC(=C)c1cc(Cl)[n]c[n]1 Amb25217353 [0,1,0,0,0,0|3,0,0]=4 1125 B12R1.17 CCOC(=C)c1cc[n]c(Cl)[n]1 Amb25194927 [0,1,0,0,0,0|3,0,0]=4 1126 B12R1.17 CCOC(=N)c1c[n+]([O-])ccc1 Amb24567680 [0,1,0,0,0,0|2,0,0]=3 1127 B12R1.17 CCOC(=N)c1c[n]cc(Br)c1 Amb25047339 [0,1,0,0,0,0|2,0,0]=3 1128 B12R1.17 CCOC(=N)c1c[n]cc(Cl)[n]1 Amb24574377 [0,1,0,0,0,0|3,0,0]=4 1129 B12R1.17 CCOC(=N)c1cccc(Br)[n]1 Amb25771847 [0,1,0,0,0,0|2,0,0]=3 1130 B12R1.17 CCOC(=N)c1cccc(Br)c1 Amb20673168 [0,1,0,0,0,0|1,0,0]=2 1131 B12R1.17 CCOC(=N)c1cccc(Cl)[n]1 Amb25843265 [0,1,0,0,0,0|2,0,0]=3 1132 B12R1.17 CCOC(=N)c1cccc(Cl)c1 Amb19057375 [0,1,0,0,0,0|1,0,0]=2 1133 B12R1.17 CCOC(=N)c1cccc(Cl)c1 Amb20673138 [0,1,0,0,0,0|1,0,0]=2 1134 B12R1.17 CCOC(=N)c1cccc(F)c1 Amb18792899 [0,1,0,0,0,0|1,0,0]=2 1135 B12R1.17 CCOC(=N)c1cccc(F)c1 Amb20673134 [0,1,0,0,0,0|1,0,0]=2 1136 B12R1.17 CCOC(=N)c1cccc(O)c1 Amb18792624 [0,1,0,0,0,0|1,0,0]=2 1137 B12R1.17 CCOC(=O)C1=CC(=O)C=CO1 Amb21864798 [0,1,0,0,0,0|1,0,0]=2 1138 B12R1.17 CCOC(=O)C1=CC(=O)N=CN1 Amb22436856 [0,1,0,0,0,0|2,0,0]=3 1139 B12R1.17 CCOC(=O)C1=CC(=O)NC=C1 Amb22499695 [0,1,0,0,0,0|1,0,0]=2 1140 B12R1.17 CCOC(=O)C1=CC(=O)NC=N1 Amb20241522 [0,1,0,0,0,0|2,0,0]=3 1141 B12R1.17 CCOC(=O)C1=CC(=O)NN=C1 Amb22235582 [0,1,0,0,0,0|2,0,0]=3 1142 B12R1.17 CCOC(=O)C1=CCCC(=O)N1 Amb25152289 [0,1,0,0,0,0|1,0,2]=4 1143 B12R1.17 CCOC(=O)C1=CNN=C(N)S1 Amb24564196 [0,1,0,0,0,0|3,0,0]=4 1144 B12R1.17 CCOC(=O)C1CC(=O)C=CO1 Amb21963908 [0,1,0,0,0,0|1,0,2]=4 1145 B12R1.17 CCOC(=O)C=1C=NCC(=O)N1 Amb22388356 [0,1,0,0,0,0|2,0,1]=4 1146 B12R1.17 CCOC(=O)C=1CC(=O)CCC1 Amb24378463 [0,1,0,0,0,0|0,0,3]=4 1147 B12R1.17 CCOC(=O)[13c]1[13cH][13cH][13cH][13c]([13cH]1)I Amb17614091 [0,1,0,0,0,0|0,0,0]=1 1148 B12R1.17 CCOC(=O)[C@@H]1CC(=O)C=CN1 Amb24744164 [0,1,0,0,0,0|1,0,2]=4 1149 B12R1.17 CCOC(=O)c1[n]c(Br)cc[n]1 Amb22001873 [0,1,0,0,0,0|2,0,0]=3 1150 B12R1.17 CCOC(=O)c1[n]c(Cl)cc[n]1 Amb25744684 [0,1,0,0,0,0|2,0,0]=3 1151 B12R1.17 CCOC(=O)c1[n]c(I)cc[n]1 Amb25159690 [0,1,0,0,0,0|2,0,0]=3 1152 B12R1.17 CCOC(=O)c1c[n+]([O-])ccc1 Amb24109386 [0,1,0,0,0,0|1,0,0]=2 1153 B12R1.17 CCOC(=O)c1c[n][n]c(Br)c1 Amb24733666 [0,1,0,0,0,0|2,0,0]=3 1154 B12R1.17 CCOC(=O)c1c[n][n]c(Cl)c1 Amb22499174 [0,1,0,0,0,0|2,0,0]=3 1155 B12R1.17 CCOC(=O)c1c[n]cc(Br)[n]1 Amb25688725 [0,1,0,0,0,0|2,0,0]=3 1156 B12R1.17 CCOC(=O)c1c[n]cc(Cl)[n]1 Amb21964836 [0,1,0,0,0,0|2,0,0]=3 1157 B12R1.17 CCOC(=O)c1c[n]cc(N)[n]1 Amb18646708 [0,1,0,0,0,0|2,0,0]=3 1158 B12R1.17 CCOC(=O)c1c[n]cc(O)[n]1 Amb24649755 [0,1,0,0,0,0|2,0,0]=3 1159 B12R1.17 CCOC(=O)c1cc(Br)ccn1 Amb10603764 [0,1,0,0,0,0|1,0,0]=2 1160 B12R1.17 CCOC(=O)c1cc(Cl)[n]c[n]1 Amb22001535 [0,1,0,0,0,0|2,0,0]=3 1161 B12R1.17 CCOC(=O)c1cc(F)cc[n]1 Amb23412382 [0,1,0,0,0,0|1,0,0]=2 1162 B12R1.17 CCOC(=O)c1cc(N)[n]c[n]1 Amb24415295 [0,1,0,0,0,0|2,0,0]=3 1163 B12R1.17 CCOC(=O)c1cc(N)cc[n]1 Amb19516035 [0,1,0,0,0,0|1,0,0]=2 1164 B12R1.17 CCOC(=O)c1cc(O)[n]c[n]1 Amb21858021 [0,1,0,0,0,0|2,0,0]=3 1165 B12R1.17 CCOC(=O)c1cc(O)cc[n]1 Amb22741288 [0,1,0,0,0,0|1,0,0]=2 1166 B12R1.17 CCOC(=O)c1cc[n]c(Br)[n]1 Amb22499758 [0,1,0,0,0,0|2,0,0]=3 1167 B12R1.17 CCOC(=O)c1cc[n]c(Cl)[n]1 Amb19895063 [0,1,0,0,0,0|2,0,0]=3 1168 B12R1.17 CCOC(=O)c1cc[n]c(F)c1 Amb25034597 [0,1,0,0,0,0|1,0,0]=2 1169 B12R1.17 CCOC(=O)c1cc[n]c(I)c1 Amb25691095 [0,1,0,0,0,0|1,0,0]=2 1170 B12R1.17 CCOC(=O)c1cc[n]c(N)[n]1 Amb22275935 [0,1,0,0,0,0|2,0,0]=3 1171 B12R1.17 CCOC(=O)c1cc[n]c(O)[n]1 Amb21961011 [0,1,0,0,0,0|2,0,0]=3 1172 B12R1.17 CCOC(=O)c1cccc(Cl)[n]1 Amb19515866 [0,1,0,0,0,0|1,0,0]=2 1173 B12R1.17 CCOC(=O)c1cccc(F)[n]1 Amb23412379 [0,1,0,0,0,0|1,0,0]=2 1174 B12R1.17 CCOC(=O)c1cccc(I)[n]1 Amb25726964 [0,1,0,0,0,0|1,0,0]=2 1175 B12R1.17 CCOC(=O)c1cccc(S)[n]1 Amb25695577 [0,1,0,0,0,0|1,0,0]=2 1176 B12R1.17 CCOC(=O)c1cccc(c1)N Amb2337226 [0,1,0,0,0,0|0,0,0]=1 1177 B12R1.17 CCOC(=O)c1cccc(c1)O Amb1800779 [0,1,0,0,0,0|0,0,0]=1 1178 B12R1.17 CCOC(=O)c1cccc(n1)O Amb1094026 [0,1,0,0,0,0|1,0,0]=2 1179 B12R1.17 CCOC(=O)c1ccnc(c1)Br Amb10600785 [0,1,0,0,0,0|1,0,0]=2 1180 B12R1.17 CCOC(=O)c1cncc(O)c1 Amb17912115 [0,1,0,0,0,0|1,0,0]=2 1181 B12R1.17 CCOC(=O)c1cncc(c1)Br Amb1085854 [0,1,0,0,0,0|1,0,0]=2 1182 B12R1.17 CCOC(=O)c1cncc(c1)F Amb16230837 [0,1,0,0,0,0|1,0,0]=2 1183 B12R1.17 CCOC(=O)c1nccc(n1)N Amb16233845 [0,1,0,0,0,0|2,0,0]=3 1184 B12R1.17 CCOC(C)c1cc(Cl)cc[n]1 Amb24458654 [0,1,0,0,0,0|2,0,1]=4 1185 B12R1.17 CCOC(C)c1cccc(N)c1 Amb18973987 [0,1,0,0,0,0|1,0,1]=3 1186 B12R1.17 CCOC(Cl)c1cccc(F)c1 Amb24429076 [0,1,0,0,0,0|1,0,1]=3 1187 B12R1.17 CCSC(C)c1cccc(Cl)c1 Amb25036538 [0,1,0,0,0,0|1,1,1]=4 1188 B12R1.17 CCSC(C)c1cccc(N)c1 Amb18973995 [0,1,0,0,0,0|1,1,1]=4 1189 B12R1.17 CN(OCC)c1cc(N)cc[n]1 Amb24612016 [0,1,0,0,0,0|3,0,0]=4 1190 B12R1.17 CN1C=C(CC=C1)C(=O)OCCl Amb25240649 [0,1,0,0,0,0|2,0,1]=4 1191 B12R1.17 CNCC(=O)c1cc(Cl)cc[n]1 Amb24653655 [0,1,0,0,0,0|3,0,0]=4 1192 B12R1.17 CNCC(=O)c1cccc(Cl)c1 Amb18863066 [0,1,0,0,0,0|2,0,0]=3 1193 B12R1.17 CNCC(=O)c1cccc(F)c1 Amb18862706 [0,1,0,0,0,0|2,0,0]=3 1194 B12R1.17 CNCC(=O)c1cccc(N)c1 Amb18051532 [0,1,0,0,0,0|2,0,0]=3 1195 B12R1.17 CNCC(=O)c1cccc(O)c1 Amb18646278 [0,1,0,0,0,0|2,0,0]=3 1196 B12R1.17 CNCC(=O)c1cccc(c1)Br Amb17315041 [0,1,0,0,0,0|2,0,0]=3 1197 B12R1.17 CNCC(=O)c1cccc(c1)O Amb16231895 [0,1,0,0,0,0|2,0,0]=3 1198 B12R1.17 CNCC(=O)c1cccc(c1)O Amb17619313 [0,1,0,0,0,0|2,0,0]=3 1199 B12R1.17 COCC(=O)c1c[n]cc(F)c1 Amb18793273 [0,1,0,0,0,0|3,0,0]=4 1200 B12R1.17 COCS(=O)c1cccc(F)c1 Amb24487397 [0,1,0,0,0,0|3,0,0]=4 1201 B12R1.17 CONC(=O)c1c[n]cc(I)c1 Amb25036602 [0,1,0,0,0,0|3,0,0]=4 1202 B12R1.17 CONC(=O)c1c[n]cc(O)c1 Amb24390052 [0,1,0,0,0,0|3,0,0]=4 1203 B12R1.17 CONC(=O)c1cc(Cl)cc[n]1 Amb24469477 [0,1,0,0,0,0|3,0,0]=4 1204 B12R1.17 CONC(=O)c1cc[n]c(Br)c1 Amb25054462 [0,1,0,0,0,0|3,0,0]=4 1205 B12R1.17 CONC(=O)c1cc[n]c(Cl)c1 Amb24640070 [0,1,0,0,0,0|3,0,0]=4 1206 B12R1.17 CONC(=O)c1cccc(Br)[n]1 Amb24677210 [0,1,0,0,0,0|3,0,0]=4 1207 B12R1.17 CONC(=O)c1cccc(N)[n]1 Amb24650110 [0,1,0,0,0,0|3,0,0]=4 1208 B12R1.17 CONC(=O)c1cccc(c1)Br Amb16072963 [0,1,0,0,0,0|2,0,0]=3 1209 B12R1.17 CONC(=O)c1cccc(c1)C Amb16980458 [0,1,0,0,0,0|2,0,0]=3 1210 B12R1.17 CONC(=O)c1cccc(c1)Cl Amb16969942 [0,1,0,0,0,0|2,0,0]=3 1211 B12R1.17 CONC(=O)c1cccc(c1)F Amb16969918 [0,1,0,0,0,0|2,0,0]=3 1212 B12R1.17 CONC(=O)c1cncc(c1)Br Amb16072976 [0,1,0,0,0,0|3,0,0]=4 1213 B12R1.17 CO\N=C(/N)\c1cccc(Br)c1 Amb18227752 [0,1,0,0,0,0|3,0,0]=4 1214 B12R1.17 CO\N=C(/N)\c1cccc(Cl)c1 Amb18863110 [0,1,0,0,0,0|3,0,0]=4 1215 B12R1.17 CO\N=C(/N)\c1cccc(F)c1 Amb18862746 [0,1,0,0,0,0|3,0,0]=4 1216 B12R1.17 CSCC(=O)c1c[n]cc(F)c1 Amb19069248 [0,1,0,0,0,0|3,0,0]=4 1217 B12R1.17 CSCC(=O)c1cccc(Br)c1 Amb25149784 [0,1,0,0,0,0|2,0,0]=3 1218 B12R1.17 CSCC(=O)c1cccc(Cl)c1 Amb18320097 [0,1,0,0,0,0|2,0,0]=3 1219 B12R1.17 CSCC(=O)c1cccc(F)c1 Amb19057446 [0,1,0,0,0,0|2,0,0]=3 1220 B12R1.17 C[n+]1cc(ccc1)C(=O)OCC Amb19942302 [0,1,0,0,0,0|1,0,0]=2 1221 B12R1.17 C[n+]1cc(ccc1)C(=O)OCC Amb22369764 [0,1,0,0,0,0|1,0,0]=2 1222 B12R1.17 C\C(=C/CCl)\c1cc(Cl)ccc1 Amb25039232 [0,1,0,0,0,0|3,0,0]=4 1223 B12R1.17 C\C(=C\CN)\c1cccc(Cl)c1 Amb25723529 [0,1,0,0,0,0|3,0,0]=4 1224 B12R1.17 C\C(=C\CN)\c1cccc(F)c1 Amb24589057 [0,1,0,0,0,0|3,0,0]=4 1225 B12R1.17 C\C(=C\CO)\c1cccc(Br)c1 Amb25260939 [0,1,0,0,0,0|3,0,0]=4 1226 B12R1.17 C\C(=N/NC)\c1cc(O)ccc1 Amb24646585 [0,1,0,0,0,0|3,0,0]=4 1227 B12R1.17 C\C(=N/OC)\c1cc(O)ccc1 Amb25347420 [0,1,0,0,0,0|3,0,0]=4 1228 B12R1.17 C\C(=N\NC)\c1cc(Cl)ccc1 Amb25236437 [0,1,0,0,0,0|3,0,0]=4 1229 B12R1.17 C\C(=N\NC)\c1cc(O)ccc1 Amb25788840 [0,1,0,0,0,0|3,0,0]=4 1230 B12R1.17 C\C=C/C(=O)c1cccc(Br)c1 Amb22330548 [0,1,0,0,0,0|1,0,1]=3 1231 B12R1.17 C\C=C\C(=O)c1c[n]cc(F)c1 Amb24474303 [0,1,0,0,0,0|2,0,1]=4 1232 B12R1.17 C\C=C\C(=O)c1cccc(Br)c1 Amb24518563 [0,1,0,0,0,0|1,0,1]=3 1233 B12R1.17 C\C=C\C(=O)c1cccc(F)c1 Amb24640082 [0,1,0,0,0,0|1,0,1]=3 1234 B12R1.17 C\C=C\C(=O)c1cccc(O)c1 Amb25715332 [0,1,0,0,0,0|1,0,1]=3 1235 B12R1.17 Cc1[n]c(cc[n]1)C(=O)OCC Amb21962511 [0,1,0,0,0,0|2,0,0]=3 1236 B12R1.17 Cc1c[n]cc([n]1)C(=O)OCC Amb22276838 [0,1,0,0,0,0|2,0,0]=3 1237 B12R1.17 Cc1c[n]cc(c1)C(=O)CCC Amb24455314 [0,1,0,0,0,0|2,0,0]=3 1238 B12R1.17 Cc1c[n]cc(c1)C(=O)CNC Amb25041572 [0,1,0,0,0,0|3,0,0]=4 1239 B12R1.17 Cc1c[n]cc(c1)C(=O)NCC Amb25777879 [0,1,0,0,0,0|2,0,0]=3 1240 B12R1.17 Cc1cc([n]c[n]1)C(=O)OCC Amb22233998 [0,1,0,0,0,0|2,0,0]=3 1241 B12R1.17 Cc1cc(c[n][n]1)C(=O)NCC Amb24352788 [0,1,0,0,0,0|3,0,0]=4 1242 B12R1.17 Cc1cc(c[n]c1)C(=O)CCN Amb24460200 [0,1,0,0,0,0|3,0,0]=4 1243 B12R1.17 Cc1cc(c[n]c1)C(=O)\C=C\C Amb25123659 [0,1,0,0,0,0|2,0,1]=4 1244 B12R1.17 Cc1cc(cc[n]1)C(=O)NOC Amb25817301 [0,1,0,0,0,0|3,0,0]=4 1245 B12R1.17 Cc1cc(cc[n]1)C(=O)OCC Amb19944347 [0,1,0,0,0,0|1,0,0]=2 1246 B12R1.17 Cc1cc(cc[n]1)C(=O)OCC Amb21856459 [0,1,0,0,0,0|1,0,0]=2 1247 B12R1.17 Cc1cc(ccc1)C(=C)CCO Amb25056805 [0,1,0,0,0,0|3,0,0]=4 1248 B12R1.17 Cc1cc(ccc1)C(=N)OCC Amb18792488 [0,1,0,0,0,0|1,0,0]=2 1249 B12R1.17 Cc1cc(ccc1)C(=N)OCC Amb20673130 [0,1,0,0,0,0|1,0,0]=2 1250 B12R1.17 Cc1cc(ccc1)C(=O)C=C=C Amb24722812 [0,1,0,0,0,0|1,0,2]=4 1251 B12R1.17 Cc1cc(ccc1)C(=O)C=[N+]=[N-] Amb25761996 [0,1,0,0,0,0|3,0,0]=4 1252 B12R1.17 Cc1cc(ccc1)C(=O)CC#C Amb18799927 [0,1,0,0,0,0|1,0,2]=4 1253 B12R1.17 Cc1cc(ccc1)C(=O)CC=O Amb18788116 [0,1,0,0,0,0|2,0,1]=4 1254 B12R1.17 Cc1cc(ccc1)C(=O)CCN Amb24700399 [0,1,0,0,0,0|2,0,0]=3 1255 B12R1.17 Cc1cc(ccc1)C(=O)CCO Amb25735228 [0,1,0,0,0,0|2,0,0]=3 1256 B12R1.17 Cc1cc(ccc1)C(=O)CNC Amb18862586 [0,1,0,0,0,0|2,0,0]=3 1257 B12R1.17 Cc1cc(ccc1)C(=O)CSC Amb18796323 [0,1,0,0,0,0|2,0,0]=3 1258 B12R1.17 Cc1cc(ccc1)C(=O)\C=C\C Amb25742315 [0,1,0,0,0,0|1,0,1]=3 1259 B12R1.17 Cc1cc(ccc1)C(=O)\C=C\Cl Amb24563325 [0,1,0,0,0,0|2,0,1]=4 1260 B12R1.17 Cc1cc(ccc1)S(=O)CCCl Amb24428231 [0,1,0,0,0,0|3,0,0]=4 1261 B12R1.17 Cc1cc(ccc1)S(=O)CCN Amb18974528 [0,1,0,0,0,0|3,0,0]=4 1262 B12R1.17 Cc1cc[n]c([n]1)C(=O)NCC Amb25680404 [0,1,0,0,0,0|3,0,0]=4 1263 B12R1.17 Cc1cc[n]c([n]1)C(=O)OCC Amb21857463 [0,1,0,0,0,0|2,0,0]=3 1264 B12R1.17 Cc1cc[n]c(c1)C(=N)NCC Amb24572213 [0,1,0,0,0,0|3,0,0]=4 1265 B12R1.17 Cc1cc[n]c(c1)C(=O)OCC Amb20247629 [0,1,0,0,0,0|1,0,0]=2 1266 B12R1.17 Cc1cccc([n]1)C(=N)OCC Amb25133391 [0,1,0,0,0,0|2,0,0]=3 1267 B12R1.17 Cc1cccc(c1)C(C)SCC Amb25792019 [0,1,0,0,0,0|1,1,1]=4 1268 B12R1.17 Cc1cccc(c1)[C@@H](C)NCC Amb24448414 [0,1,0,0,0,0|2,0,1]=4 1269 B12R1.17 Cc1cccc(c1)[C@@H](N)CCC Amb22746897 [0,1,0,0,0,0|2,0,1]=4 1270 B12R1.17 Cc1cccc(c1)[C@H](N)CCC Amb22298528 [0,1,0,0,0,0|2,0,1]=4 1271 B12R1.17 Cc1cccc(c1)[C@H](N)CCC Amb25328596 [0,1,0,0,0,0|2,0,1]=4 1272 B12R1.17 Cc1cccc(c1)\C(\C)=C/CO Amb25852937 [0,1,0,0,0,0|3,0,0]=4 1273 B12R1.17 ClCCC(=O)c1cccc(c1)Br Amb17351482 [0,1,0,0,0,0|2,0,0]=3 1274 B12R1.17 N#CCC(=O)c1cccc(c1)C Amb1648833 [0,1,0,0,0,0|2,0,1]=4 1275 B12R1.17 N#CCC(=O)c1cccc(c1)Cl Amb1676838 [0,1,0,0,0,0|2,0,1]=4 1276 B12R1.17 N#CCC(=O)c1cccc(c1)O Amb10071608 [0,1,0,0,0,0|2,0,1]=4 1277 B12R1.17 N#CNC(=O)c1cccc(Cl)c1 Amb25725665 [0,1,0,0,0,0|2,0,1]=4 1278 B12R1.17 NCCC(=O)c1c[n]cc(F)c1 Amb25809288 [0,1,0,0,0,0|3,0,0]=4 1279 B12R1.17 NCCC(=O)c1cc(Br)ccc1 Amb18121501 [0,1,0,0,0,0|2,0,0]=3 1280 B12R1.17 NCCS(=O)c1cc(Br)ccc1 Amb18301434 [0,1,0,0,0,0|3,0,0]=4 1281 B12R1.17 NCCS(=O)c1cc(Cl)ccc1 Amb18299921 [0,1,0,0,0,0|3,0,0]=4 1282 B12R1.17 NCCS(=O)c1cc(F)ccc1 Amb24487393 [0,1,0,0,0,0|3,0,0]=4 1283 B12R1.17 Nc1cc(ccc1)C(=O)NC#N Amb24085853 [0,1,0,0,0,0|2,0,1]=4 1284 B12R1.17 O=C(CCBr)c1cccc(Cl)c1 Amb24483618 [0,1,0,0,0,0|2,0,0]=3 1285 B12R1.17 O=C(CCBr)c1cccc(F)c1 Amb25669661 [0,1,0,0,0,0|2,0,0]=3 1286 B12R1.17 O=C(CCBr)c1cccc(S)c1 Amb25312667 [0,1,0,0,0,0|2,0,0]=3 1287 B12R1.17 O=C(CCCl)c1cc(Cl)ccc1 Amb25742498 [0,1,0,0,0,0|2,0,0]=3 1288 B12R1.17 O=C=NC(=O)c1cccc(c1)Br Amb17247241 [0,1,0,0,0,0|2,0,1]=4 1289 B12R1.17 O=C[CH-]C(=O)c1cccc(c1)Br Amb17610055 [0,1,0,0,0,0|2,0,1]=4 1290 B12R1.17 O=S(CCF)c1cc(F)ccc1 Amb24602311 [0,1,0,0,0,0|3,0,0]=4 1291 B12R1.17 OCCC(=O)c1cc(Cl)[n]cc1 Amb25156807 [0,1,0,0,0,0|3,0,0]=4 1292 B12R1.17 OCCS(=O)c1cc(F)ccc1 Amb24354278 [0,1,0,0,0,0|3,0,0]=4 1293 B12R1.17 OCNC(=O)c1cccc(Cl)c1 Amb24666791 [0,1,0,0,0,0|2,0,0]=3 1294 B12R1.17 O\N=C\C(=O)c1cccc(F)c1 Amb25143495 [0,1,0,0,0,0|3,0,0]=4 1295 B12R1.17 Oc1cc(ccc1)C(=O)\C=N\O Amb25706998 [0,1,0,0,0,0|3,0,0]=4 1296 B12R1.17 [N-]=[N+]=CC(=O)c1cccc(F)c1 Amb25320625 [0,1,0,0,0,0|3,0,0]=4 1297 B12R1.17 [O-]\C=C/C(=O)c1cccc(Br)c1 Amb24121221 [0,1,0,0,0,0|2,0,1]=4 1298 B12R1.17 [O-]\C=C\C(=O)c1cccc(Br)c1 Amb25857751 [0,1,0,0,0,0|2,0,1]=4 1299 B12R1.17 [O-]\C=C\C(=O)c1cccc(Cl)c1 Amb24446187 [0,1,0,0,0,0|2,0,1]=4 1300 B12R1.17 [O-]\C=C\C(=O)c1cccc(F)c1 Amb24714203 [0,1,0,0,0,0|2,0,1]=4 1301 B12R1.30 BrCCCC(=O)c1ccccc1 Amb17247624 [0,1,0,0,0,0|1,0,0]=2 1302 B12R1.30 BrCC\C=C(\c1ccccc1)/C Amb17246875 [0,1,0,0,0,0|2,0,0]=3 1303 B12R1.30 C#CC#CC(=O)c1ccccc1 Amb25759534 [0,1,0,0,0,0|1,0,2]=4 1304 B12R1.30 C#CCCC(=O)c1cc[n]cc1 Amb24483375 [0,1,0,0,0,0|2,0,1]=4 1305 B12R1.30 C#CCCC(=O)c1ccc[n]c1 Amb24469940 [0,1,0,0,0,0|2,0,1]=4 1306 B12R1.30 C#CCNC(=O)c1cc[n]cc1 Amb18800328 [0,1,0,0,0,0|2,0,1]=4 1307 B12R1.30 C#CCOC(=O)c1c[n]c[n]c1 Amb24083494 [0,1,0,0,0,0|2,0,1]=4 1308 B12R1.30 C#CCOC(=O)c1cc[n][n]c1 Amb25072138 [0,1,0,0,0,0|2,0,1]=4 1309 B12R1.30 C#CCOC(=O)c1ccccc1 Amb22001698 [0,1,0,0,0,0|0,0,1]=2 1310 B12R1.30 C#CC\N=C(\N)/c1ccccc1 Amb25056544 [0,1,0,0,0,0|2,0,1]=4 1311 B12R1.30 C#CC\N=C(\N)/c1ccccc1 Amb25784600 [0,1,0,0,0,0|2,0,1]=4 1312 B12R1.30 C#C\C=C/C(=O)c1ccccc1 Amb25718417 [0,1,0,0,0,0|1,0,2]=4 1313 B12R1.30 C=CCNC(=O)c1cccnc1 Amb17794173 [0,1,0,0,0,0|2,0,1]=4 1314 B12R1.30 C=CCNC(=O)c1ccncc1 Amb1625184 [0,1,0,0,0,0|2,0,1]=4 1315 B12R1.30 C=CCNC(=[Cl])c1ccccc1 Amb10560950 [0,1,0,0,0,0|2,0,1]=4 1316 B12R1.30 C=CCOC(=O)c1c[n]cc[n]1 Amb24092492 [0,1,0,0,0,0|2,0,1]=4 1317 B12R1.30 C=CCOC(=O)c1cc[n]cc1 Amb22730922 [0,1,0,0,0,0|1,0,1]=3 1318 B12R1.30 C=CC\N=C(\Cl)/c1ccccc1 Amb25154360 [0,1,0,0,0,0|2,0,1]=4 1319 B12R1.30 C=CC\N=C(\N)/c1ccccc1 Amb25761905 [0,1,0,0,0,0|2,0,1]=4 1320 B12R1.30 C=CO\N=C(\N)/c1ccccc1 Amb24512338 [0,1,0,0,0,0|1,0,2]=4 1321 B12R1.30 C=C\C=N\C(=O)c1ccccc1 Amb24072845 [0,1,0,0,0,0|1,0,2]=4 1322 B12R1.30 CC#CCC(=O)c1c[n]ccc1 Amb18797504 [0,1,0,0,0,0|2,0,1]=4 1323 B12R1.30 CC#CCC(=O)c1cc[n]cc1 Amb18182412 [0,1,0,0,0,0|2,0,1]=4 1324 B12R1.30 CC#CCC(=O)c1cccc[n]1 Amb18797503 [0,1,0,0,0,0|2,0,1]=4 1325 B12R1.30 CC#CCC(=O)c1ccccc1 Amb18182348 [0,1,0,0,0,0|1,0,1]=3 1326 B12R1.30 CC(=C=CCO)c1ccccc1 Amb25855530 [0,1,0,0,0,0|2,0,1]=4 1327 B12R1.30 CC(=NOCC)c1c[n]c[n]c1 Amb25160396 [0,1,0,0,0,0|3,0,0]=4 1328 B12R1.30 CC(CCCN)c1ccccc1 Amb18563593 [0,1,0,0,0,0|2,0,1]=4 1329 B12R1.30 CC(OCCO)c1ccccc1 Amb24103429 [0,1,0,0,0,0|1,0,1]=3 1330 B12R1.30 CC=C=NC(=O)c1ccccc1 Amb24096356 [0,1,0,0,0,0|1,0,1]=3 1331 B12R1.30 CC=NNC(=O)c1c[n]ccc1 Amb24094200 [0,1,0,0,0,0|2,0,1]=4 1332 B12R1.30 CC=NNC(=O)c1cc[n]cc1 Amb24099555 [0,1,0,0,0,0|2,0,1]=4 1333 B12R1.30 CCC#CC(O)c1ccccc1 Amb24672537 [0,1,0,0,0,0|1,0,2]=4 1334 B12R1.30 CCC/N=C(\C)c1ccccc1 Amb17779516 [0,1,0,0,0,0|2,0,0]=3 1335 B12R1.30 CCCCC(=O)c1c[n]c[n]c1 Amb24090971 [0,1,0,0,0,0|3,0,0]=4 1336 B12R1.30 CCCCC(=O)c1c[n]cc[n]1 Amb18798311 [0,1,0,0,0,0|3,0,0]=4 1337 B12R1.30 CCCCC(=O)c1cccnc1 Amb10607964 [0,1,0,0,0,0|2,0,0]=3 1338 B12R1.30 CCCCC(=O)c1ccncc1 Amb10573758 [0,1,0,0,0,0|2,0,0]=3 1339 B12R1.30 CCCCN(c1ccccc1)N Amb17226670 [0,1,0,0,0,0|3,0,0]=4 1340 B12R1.30 CCCNC(=N)c1cc[n]cc1 Amb24483608 [0,1,0,0,0,0|3,0,0]=4 1341 B12R1.30 CCCNC(=N)c1cccc[n]1 Amb25332721 [0,1,0,0,0,0|3,0,0]=4 1342 B12R1.30 CCCNC(=N)c1ccccc1 Amb23447119 [0,1,0,0,0,0|2,0,0]=3 1343 B12R1.30 CCCNC(=O)c1c[n][n]cc1 Amb24614933 [0,1,0,0,0,0|3,0,0]=4 1344 B12R1.30 CCCNC(=O)c1c[n]c[n]c1 Amb25099890 [0,1,0,0,0,0|3,0,0]=4 1345 B12R1.30 CCCNC(=S)c1ccccc1 Amb25827093 [0,1,0,0,0,0|1,1,0]=3 1346 B12R1.30 CCCNC(c1ccccc1)C Amb1833463 [0,1,0,0,0,0|2,0,1]=4 1347 B12R1.30 CCCOC(=O)c1c[n]cc[n]1 Amb18801005 [0,1,0,0,0,0|2,0,0]=3 1348 B12R1.30 CCCOC(=O)c1cccnc1 Amb1958081 [0,1,0,0,0,0|1,0,0]=2 1349 B12R1.30 CCC\C=C(\N)/c1ccc[n]c1 Amb25059174 [0,1,0,0,0,0|3,0,0]=4 1350 B12R1.30 CCC\C=C(\N)/c1cccc[n]1 Amb25765706 [0,1,0,0,0,0|3,0,0]=4 1351 B12R1.30 CCC\N=C(/N)\c1c[n]ccc1 Amb21970337 [0,1,0,0,0,0|3,0,0]=4 1352 B12R1.30 CCC\N=C(\Cl)/c1ccccc1 Amb25142394 [0,1,0,0,0,0|2,0,0]=3 1353 B12R1.30 CCNCC(N)c1ccccc1 Amb19009737 [0,1,0,0,0,0|2,0,1]=4 1354 B12R1.30 CCNCC(O)c1ccccc1 Amb22491734 [0,1,0,0,0,0|1,0,2]=4 1355 B12R1.30 CCNCC(c1ccccc1)C Amb2119469 [0,1,0,0,0,0|2,0,1]=4 1356 B12R1.30 CCNN=C(N)c1ccccc1 Amb24096580 [0,1,0,0,0,0|2,0,0]=3 1357 B12R1.30 CCNNC(=O)c1cccc[n]1 Amb24379581 [0,1,0,0,0,0|2,0,0]=3 1358 B12R1.30 CCOC[C@H](c1ccccc1)N Amb17061646 [0,1,0,0,0,0|1,0,1]=3 1359 B12R1.30 CCONC(=O)c1c[n]c[n]c1 Amb25297324 [0,1,0,0,0,0|2,0,0]=3 1360 B12R1.30 CCONC(=O)c1cc[n][n]c1 Amb25360333 [0,1,0,0,0,0|2,0,0]=3 1361 B12R1.30 CCONC(=O)c1cc[n]c[n]1 Amb25816665 [0,1,0,0,0,0|2,0,0]=3 1362 B12R1.30 CCONC(=O)c1ccccc1 Amb10572541 [0,1,0,0,0,0|0,0,0]=1 1363 B12R1.30 CCONC(=O)c1ccccn1 Amb10572672 [0,1,0,0,0,0|1,0,0]=2 1364 B12R1.30 CCO\N=C(/N)\c1c[n]ccc1 Amb18862625 [0,1,0,0,0,0|2,0,0]=3 1365 B12R1.30 CCO\N=C(/N)\c1cc[n]cc1 Amb18862626 [0,1,0,0,0,0|2,0,0]=3 1366 B12R1.30 CCO\N=C(/N)\c1cccc[n]1 Amb18862624 [0,1,0,0,0,0|2,0,0]=3 1367 B12R1.30 CCO\N=C(/N)\c1ccccc1 Amb18862600 [0,1,0,0,0,0|1,0,0]=2 1368 B12R1.30 CCO\N=C(\N)/c1c[n]cc[n]1 Amb24343654 [0,1,0,0,0,0|3,0,0]=4 1369 B12R1.30 CC\C=C/C(=O)c1ccccc1 Amb24722785 [0,1,0,0,0,0|1,0,0]=2 1370 B12R1.30 CC\C=C/C(N)c1ccccc1 Amb25696046 [0,1,0,0,0,0|2,0,1]=4 1371 B12R1.30 CC\C=C/N(C)c1ccccc1 Amb24072870 [0,1,0,0,0,0|3,0,0]=4 1372 B12R1.30 CC\C=C\C(=O)c1c[n]cc[n]1 Amb25096745 [0,1,0,0,0,0|3,0,0]=4 1373 B12R1.30 CC\C=C\C(=O)c1ccccc1 Amb24532703 [0,1,0,0,0,0|1,0,0]=2 1374 B12R1.30 CC\C=C\C(O)c1ccccc1 Amb22546781 [0,1,0,0,0,0|1,0,2]=4 1375 B12R1.30 CC\C=C\N(C)c1ccccc1 Amb24575001 [0,1,0,0,0,0|3,0,0]=4 1376 B12R1.30 CC\C=N\C(C)c1ccccc1 Amb24436889 [0,1,0,0,0,0|2,0,1]=4 1377 B12R1.30 CN(OCC=C)c1ccccc1 Amb22366090 [0,1,0,0,0,0|2,0,1]=4 1378 B12R1.30 CN=C=CC(=O)c1ccccc1 Amb24497080 [0,1,0,0,0,0|1,0,1]=3 1379 B12R1.30 CNCCC(=O)c1ccccc1 Amb11032366 [0,1,0,0,0,0|1,0,0]=2 1380 B12R1.30 CNCC[C@@H](O)c1ccccc1 Amb20240620 [0,1,0,0,0,0|1,0,2]=4 1381 B12R1.30 CNCC[C@@H](O)c1ccccc1 Amb22747753 [0,1,0,0,0,0|1,0,2]=4 1382 B12R1.30 CN\C=C/C(=O)c1ccccc1 Amb2386631 [0,1,0,0,0,0|1,0,1]=3 1383 B12R1.30 CN\N=C\C(=O)c1ccccc1 Amb25202730 [0,1,0,0,0,0|2,0,0]=3 1384 B12R1.30 COCCC(=O)c1ccccc1 Amb10602329 [0,1,0,0,0,0|1,0,0]=2 1385 B12R1.30 COCCC(O)c1ccccc1 Amb18788453 [0,1,0,0,0,0|1,0,2]=4 1386 B12R1.30 CO\C=C/C(=O)c1ccccc1 Amb24523909 [0,1,0,0,0,0|1,0,1]=3 1387 B12R1.30 CO\C=C\C(=O)c1ccc[n]c1 Amb24736135 [0,1,0,0,0,0|2,0,1]=4 1388 B12R1.30 CO\C=C\C(=O)c1ccccc1 Amb24370151 [0,1,0,0,0,0|1,0,1]=3 1389 B12R1.30 CO\N=C\C(=O)c1ccccc1 Amb24512562 [0,1,0,0,0,0|2,0,0]=3 1390 B12R1.30 CSCNC(=O)c1cc[n]cc1 Amb25694773 [0,1,0,0,0,0|2,0,0]=3 1391 B12R1.30 CSCNC(=O)c1ccc[n]c1 Amb25674422 [0,1,0,0,0,0|2,0,0]=3 1392 B12R1.30 CSCNC(=S)c1ccccc1 Amb24634347 [0,1,0,0,0,0|1,1,0]=3 1393 B12R1.30 C[C@@H](OCC=O)c1ccccc1 Amb22896802 [0,1,0,0,0,0|1,0,2]=4 1394 B12R1.30 C[C@H]([NH2+]CCCl)c1ccccc1 Amb17773001 [0,1,0,0,0,0|2,0,1]=4 1395 B12R1.30 C\C(=C/CC=O)\c1ccccc1 Amb18645375 [0,1,0,0,0,0|2,0,1]=4 1396 B12R1.30 C\C(=C/CNC)\c1ccccc1 Amb23555664 [0,1,0,0,0,0|2,0,0]=3 1397 B12R1.30 C\C(=C\CC=O)\c1ccccc1 Amb24757521 [0,1,0,0,0,0|2,0,1]=4 1398 B12R1.30 C\C(=C\CCBr)\c1ccc[n]c1 Amb25839943 [0,1,0,0,0,0|3,0,0]=4 1399 B12R1.30 C\C(=C\CCCl)\c1ccccc1 Amb24394711 [0,1,0,0,0,0|2,0,0]=3 1400 B12R1.30 C\C(=C\CCN)\c1cc[n]cc1 Amb25349069 [0,1,0,0,0,0|3,0,0]=4 1401 B12R1.30 C\C(=C\CCN)\c1cccc[n]1 Amb25751310 [0,1,0,0,0,0|3,0,0]=4 1402 B12R1.30 C\C(=C\CNC)\c1cc[n]cc1 Amb24555199 [0,1,0,0,0,0|3,0,0]=4 1403 B12R1.30 C\C(=C\CNC)\c1cccc[n]1 Amb25699200 [0,1,0,0,0,0|3,0,0]=4 1404 B12R1.30 C\C(=N\CCN)\c1cccc[n]1 Amb24594968 [0,1,0,0,0,0|3,0,0]=4 1405 B12R1.30 C\C(=N\OCC)\c1c[n]ccc1 Amb25160171 [0,1,0,0,0,0|2,0,0]=3 1406 B12R1.30 C\C(=N\OCC)\c1cc[n]cc1 Amb25728837 [0,1,0,0,0,0|2,0,0]=3 1407 B12R1.30 C\C(=N\OCC)\c1ccccc1 Amb25833281 [0,1,0,0,0,0|1,0,0]=2 1408 B12R1.30 C\C=C/CC(=O)c1ccccc1 Amb24594702 [0,1,0,0,0,0|1,0,1]=3 1409 B12R1.30 C\C=C/NC(=O)c1ccccc1 Amb24072871 [0,1,0,0,0,0|1,0,1]=3 1410 B12R1.30 C\C=C/NC(=S)c1ccccc1 Amb25273960 [0,1,0,0,0,0|1,1,1]=4 1411 B12R1.30 C\C=N/NC(=O)c1ccccc1 Amb24072878 [0,1,0,0,0,0|1,0,1]=3 1412 B12R1.30 C\N=C\CC(=O)c1ccccc1 Amb25834458 [0,1,0,0,0,0|1,0,1]=3 1413 B12R1.30 ClCCCC(=O)c1ccccc1 Amb1229841 [0,1,0,0,0,0|1,0,0]=2 1414 B12R1.30 ClCCCC(c1ccccc1)O Amb17194564 [0,1,0,0,0,0|1,0,2]=4 1415 B12R1.30 ClCCCN(c1ccccc1)C Amb17335669 [0,1,0,0,0,0|3,0,0]=4 1416 B12R1.30 ClCCNC(=O)c1ccccc1 Amb2414312 [0,1,0,0,0,0|1,0,0]=2 1417 B12R1.30 ClCCNC(=O)c1cccnc1 Amb17103236 [0,1,0,0,0,0|2,0,0]=3 1418 B12R1.30 ClCCNC(c1ccccc1)C Amb10069614 [0,1,0,0,0,0|2,0,1]=4 1419 B12R1.30 ClCCNC(c1ccccc1)C Amb17335659 [0,1,0,0,0,0|2,0,1]=4 1420 B12R1.30 ClCC\C=C(\c1ccccc1)/C Amb17233775 [0,1,0,0,0,0|2,0,0]=3 1421 B12R1.30 Cl\C(=N/CCCl)\c1ccccc1 Amb25758706 [0,1,0,0,0,0|2,0,0]=3 1422 B12R1.30 ICCOC(=O)c1ccccc1 Amb16233230 [0,1,0,0,0,0|0,0,0]=1 1423 B12R1.30 N#CCCC(=O)c1ccccc1 Amb1672449 [0,1,0,0,0,0|1,0,1]=3 1424 B12R1.30 N#CCCS(=O)c1ccccc1 Amb18648265 [0,1,0,0,0,0|2,0,1]=4 1425 B12R1.30 N#CCNC(=O)c1cc[n]cc1 Amb18180002 [0,1,0,0,0,0|2,0,1]=4 1426 B12R1.30 N#CCNC(=O)c1cccc[n]1 Amb18180001 [0,1,0,0,0,0|2,0,1]=4 1427 B12R1.30 N#CCOC(=O)c1[n]ccc[n]1 Amb25795087 [0,1,0,0,0,0|2,0,1]=4 1428 B12R1.30 N#CCOC(=O)c1ccc[n]c1 Amb25761886 [0,1,0,0,0,0|1,0,1]=3 1429 B12R1.30 N#CCOC(=O)c1cccc[n]1 Amb22751030 [0,1,0,0,0,0|1,0,1]=3 1430 B12R1.30 N#C\C=C\C(=O)c1ccccc1 Amb18644896 [0,1,0,0,0,0|1,0,2]=4 1431 B12R1.30 N=C(NCCF)c1ccccc1 Amb25351227 [0,1,0,0,0,0|2,0,0]=3 1432 B12R1.30 N=C(OCCO)c1ccccc1 Amb22465986 [0,1,0,0,0,0|1,0,0]=2 1433 B12R1.30 N=C=NNC(=O)c1ccccc1 Amb24096514 [0,1,0,0,0,0|2,0,1]=4 1434 B12R1.30 NCCCC(=O)c1ccc[n][n]1 Amb18828327 [0,1,0,0,0,0|3,0,0]=4 1435 B12R1.30 NCCCC(=O)c1ccc[n]c1 Amb18120064 [0,1,0,0,0,0|2,0,0]=3 1436 B12R1.30 NCCCC(=O)c1ccc[n]c1 Amb22831532 [0,1,0,0,0,0|2,0,0]=3 1437 B12R1.30 NCCCC(=O)c1ccccc1 Amb18623671 [0,1,0,0,0,0|1,0,0]=2 1438 B12R1.30 NCCCC(=O)c1cccnc1 Amb10602572 [0,1,0,0,0,0|2,0,0]=3 1439 B12R1.30 NCCCC(=O)c1cccnc1 Amb17608288 [0,1,0,0,0,0|2,0,0]=3 1440 B12R1.30 NCCCC(O)c1ccccc1 Amb21984517 [0,1,0,0,0,0|1,0,2]=4 1441 B12R1.30 NCCCC(c1ccccc1)O Amb17079154 [0,1,0,0,0,0|1,0,2]=4 1442 B12R1.30 NCCNC(=O)c1c[n]ccc1 Amb21953968 [0,1,0,0,0,0|2,0,0]=3 1443 B12R1.30 NCCNC(=O)c1cc[n]cc1 Amb21955218 [0,1,0,0,0,0|2,0,0]=3 1444 B12R1.30 NCCNC(=O)c1cccc[n]1 Amb21953271 [0,1,0,0,0,0|2,0,0]=3 1445 B12R1.30 NCCNC(=O)c1ccccn1 Amb1124326 [0,1,0,0,0,0|2,0,0]=3 1446 B12R1.30 NCCNC(=O)c1cccnc1 Amb1129704 [0,1,0,0,0,0|2,0,0]=3 1447 B12R1.30 NCCNC(=O)c1ccncc1 Amb1136215 [0,1,0,0,0,0|2,0,0]=3 1448 B12R1.30 NCCNC(=O)c1cnccn1 Amb1129684 [0,1,0,0,0,0|3,0,0]=4 1449 B12R1.30 NCCNC(c1ccccc1)C Amb17091024 [0,1,0,0,0,0|2,0,1]=4 1450 B12R1.30 NCCOC(=O)c1ccccc1 Amb10807731 [0,1,0,0,0,0|0,0,0]=1 1451 B12R1.30 NCCSC(=O)c1ccccc1 Amb21618899 [0,1,0,0,0,0|0,1,0]=2 1452 B12R1.30 NCCSC(c1ccccc1)C Amb17500453 [0,1,0,0,0,0|1,1,1]=4 1453 B12R1.30 NCC\C=C(\c1ccccc1)/C Amb17232384 [0,1,0,0,0,0|2,0,0]=3 1454 B12R1.30 N[C@@H](CCCO)c1ccccc1 Amb23440411 [0,1,0,0,0,0|2,0,1]=4 1455 B12R1.30 N\C=N\OC(=O)c1ccccc1 Amb25363336 [0,1,0,0,0,0|1,0,1]=3 1456 B12R1.30 O=C(CNC=O)c1ccccc1 Amb20075907 [0,1,0,0,0,0|2,0,1]=4 1457 B12R1.30 O=C(NCCBr)c1c[n]cc[n]1 Amb24689945 [0,1,0,0,0,0|3,0,0]=4 1458 B12R1.30 O=C(NCCBr)c1cc[n]c[n]1 Amb25351879 [0,1,0,0,0,0|3,0,0]=4 1459 B12R1.30 O=C(NCCCl)c1c[n]c[n]c1 Amb24417396 [0,1,0,0,0,0|3,0,0]=4 1460 B12R1.30 O=C(NCCCl)c1cc[n]c[n]1 Amb25270439 [0,1,0,0,0,0|3,0,0]=4 1461 B12R1.30 O=C(NCCCl)c1cc[n]cc1 Amb19045652 [0,1,0,0,0,0|2,0,0]=3 1462 B12R1.30 O=C(NCCCl)c1cccc[n]1 Amb19045651 [0,1,0,0,0,0|2,0,0]=3 1463 B12R1.30 O=C(NCCF)c1[n]ccc[n]1 Amb24495859 [0,1,0,0,0,0|3,0,0]=4 1464 B12R1.30 O=C(NCCF)c1cc[n][n]c1 Amb25781556 [0,1,0,0,0,0|3,0,0]=4 1465 B12R1.30 O=C(NCCF)c1cc[n]cc1 Amb25048169 [0,1,0,0,0,0|2,0,0]=3 1466 B12R1.30 O=C(NCCF)c1ccc[n]c1 Amb24396901 [0,1,0,0,0,0|2,0,0]=3 1467 B12R1.30 O=C(NCCF)c1cccc[n]1 Amb25051024 [0,1,0,0,0,0|2,0,0]=3 1468 B12R1.30 O=C(NCCF)c1ccccc1 Amb25139529 [0,1,0,0,0,0|1,0,0]=2 1469 B12R1.30 O=C(NCCI)c1c[n]c[n]c1 Amb25073669 [0,1,0,0,0,0|3,0,0]=4 1470 B12R1.30 O=C(NCCI)c1cc[n][n]c1 Amb25287091 [0,1,0,0,0,0|3,0,0]=4 1471 B12R1.30 O=C(NCCI)c1cc[n]c[n]1 Amb25203866 [0,1,0,0,0,0|3,0,0]=4 1472 B12R1.30 O=C(NCCI)c1cc[n]cc1 Amb25374226 [0,1,0,0,0,0|2,0,0]=3 1473 B12R1.30 O=C(NCCI)c1cccc[n]1 Amb24427828 [0,1,0,0,0,0|2,0,0]=3 1474 B12R1.30 O=C(NCCI)c1ccccc1 Amb22753771 [0,1,0,0,0,0|1,0,0]=2 1475 B12R1.30 O=C(NCCS)c1cccc[n]1 Amb24669083 [0,1,0,0,0,0|2,0,0]=3 1476 B12R1.30 O=C(OCC=O)c1ccccc1 Amb18645965 [0,1,0,0,0,0|0,0,1]=2 1477 B12R1.30 O=C(O\N=C\Cl)c1ccccc1 Amb24557804 [0,1,0,0,0,0|1,0,1]=3 1478 B12R1.30 O=C(\C=C/C=O)c1ccccc1 Amb25359189 [0,1,0,0,0,0|1,0,2]=4 1479 B12R1.30 O=C(\C=C\C=O)c1ccccc1 Amb18645282 [0,1,0,0,0,0|1,0,2]=4 1480 B12R1.30 O=CCCC(=O)c1cccnc1 Amb17618984 [0,1,0,0,0,0|2,0,1]=4 1481 B12R1.30 O=CCNC(=O)c1ccccc1 Amb17102065 [0,1,0,0,0,0|1,0,1]=3 1482 B12R1.30 O=CCNC(=O)c1cccnc1 Amb17102107 [0,1,0,0,0,0|2,0,1]=4 1483 B12R1.30 OCC#CC(=O)c1ccccc1 Amb22495841 [0,1,0,0,0,0|1,0,1]=3 1484 B12R1.30 OCC#CS(=O)c1ccccc1 Amb24431904 [0,1,0,0,0,0|2,0,1]=4 1485 B12R1.30 OCCCC(=O)c1ccccc1 Amb17334609 [0,1,0,0,0,0|1,0,0]=2 1486 B12R1.30 OCCCC(=O)c1cccnc1 Amb17615812 [0,1,0,0,0,0|2,0,0]=3 1487 B12R1.30 OCCCC(c1ccccc1)O Amb17334675 [0,1,0,0,0,0|1,0,2]=4 1488 B12R1.30 OCCNC(=O)c1[n]ccc[n]1 Amb24717844 [0,1,0,0,0,0|3,0,0]=4 1489 B12R1.30 OCCNC(=O)c1c[n]c[n]c1 Amb25360437 [0,1,0,0,0,0|3,0,0]=4 1490 B12R1.30 OCCNC(=O)c1ccccn1 Amb1951218 [0,1,0,0,0,0|2,0,0]=3 1491 B12R1.30 OCCNC(=S)c1c[n]ccc1 Amb24407503 [0,1,0,0,0,0|2,1,0]=4 1492 B12R1.30 OCCNC(c1ccccc1)C Amb2092663 [0,1,0,0,0,0|2,0,1]=4 1493 B12R1.30 OCCOC(=N)c1ccccn1 Amb10553000 [0,1,0,0,0,0|2,0,0]=3 1494 B12R1.30 OCCOC(=O)c1ccccc1 Amb1110468 [0,1,0,0,0,0|0,0,0]=1 1495 B12R1.30 OCC\C=C(\Cl)/c1ccccc1 Amb25204635 [0,1,0,0,0,0|2,0,0]=3 1496 B12R1.30 OCNNC(=O)c1ccccc1 Amb24608056 [0,1,0,0,0,0|2,0,0]=3 1497 B12R1.30 OC\C=C\C(=O)c1ccccc1 Amb24706829 [0,1,0,0,0,0|1,0,1]=3 1498 B12R1.30 O\N=C/CC(=O)c1ccccc1 Amb25833653 [0,1,0,0,0,0|2,0,1]=4 1499 B12R1.30 [N-]=[N+]=NCC(=O)c1ccccc1 Amb18114574 [0,1,0,0,0,0|3,0,0]=4 1500 B12R1.30 [Na]O\C=C\C(=O)c1ccccc1 Amb2370899 [0,1,0,0,0,0|2,0,1]=4 1501 B12R1.34 BrCC(=O)C(=O)c1ccccc1 Amb17406921 [0,1,0,0,0,0|2,0,0]=3 1502 B12R1.34 C=C(C(O)CO)c1ccccc1 Amb25333663 [0,1,0,0,0,0|3,0,0]=4 1503 B12R1.34 C=C(CO)C(=O)c1ccccc1 Amb24645413 [0,1,0,0,0,0|2,0,0]=3 1504 B12R1.34 C=C(CO)S(=O)c1ccccc1 Amb24497581 [0,1,0,0,0,0|3,0,0]=4 1505 B12R1.34 CC(=C=C)C(=O)c1ccccc1 Amb25094427 [0,1,0,0,0,0|1,0,2]=4 1506 B12R1.34 CC(=C=O)C(=O)c1ccccc1 Amb24544636 [0,1,0,0,0,0|2,0,1]=4 1507 B12R1.34 CC(=[N+]=[N-])C(=O)c1ccccc1 Amb25238517 [0,1,0,0,0,0|3,0,0]=4 1508 B12R1.34 CC(C(Br)CC)c1ccccc1 Amb25805104 [0,1,0,0,0,0|2,0,1]=4 1509 B12R1.34 CC(C(N)CC)c1ccccc1 Amb18829127 [0,1,0,0,0,0|2,0,1]=4 1510 B12R1.34 CC(C(N)CC)c1ccccc1 Amb20623710 [0,1,0,0,0,0|2,0,1]=4 1511 B12R1.34 CC(C=O)C(=O)c1ccccc1 Amb18645647 [0,1,0,0,0,0|2,0,1]=4 1512 B12R1.34 CC(CC)C(=O)c1cc[n]c[n]1 Amb25313966 [0,1,0,0,0,0|3,0,0]=4 1513 B12R1.34 CC(CC)C(Br)c1ccccc1 Amb24618999 [0,1,0,0,0,0|2,0,1]=4 1514 B12R1.34 CC(CC)C(Cl)c1ccccc1 Amb19057046 [0,1,0,0,0,0|2,0,1]=4 1515 B12R1.34 CC(CC)C(O)c1ccccc1 Amb18792585 [0,1,0,0,0,0|1,0,2]=4 1516 B12R1.34 CC(CC)[C@@H](N)c1ccccc1 Amb23438852 [0,1,0,0,0,0|2,0,1]=4 1517 B12R1.34 CC(CC)[C@@H](O)c1ccccc1 Amb25158043 [0,1,0,0,0,0|1,0,2]=4 1518 B12R1.34 CC(CN)C(=O)c1ccccc1 Amb18829249 [0,1,0,0,0,0|2,0,0]=3 1519 B12R1.34 CC(CN)S(=O)c1ccccc1 Amb24469474 [0,1,0,0,0,0|3,0,0]=4 1520 B12R1.34 CC(N=O)C(=O)c1ccccc1 Amb24545660 [0,1,0,0,0,0|3,0,0]=4 1521 B12R1.34 CC(NO)C(=O)c1ccccc1 Amb25130640 [0,1,0,0,0,0|3,0,0]=4 1522 B12R1.34 CCC(=C)C(=O)c1ccccc1 Amb24722842 [0,1,0,0,0,0|1,0,0]=2 1523 B12R1.34 CCC(=C)C(C)c1ccccc1 Amb24617256 [0,1,0,0,0,0|2,0,1]=4 1524 B12R1.34 CCC(=C)[C@@H](O)c1ccccc1 Amb25356347 [0,1,0,0,0,0|1,0,2]=4 1525 B12R1.34 CCC(=O)C(=O)c1cc[n]cc1 Amb25245097 [0,1,0,0,0,0|2,0,0]=3 1526 B12R1.34 CCC(=O)C(=O)c1cccc[n]1 Amb25762144 [0,1,0,0,0,0|2,0,0]=3 1527 B12R1.34 CCC(=O)C(=O)c1ccccc1 Amb17400106 [0,1,0,0,0,0|1,0,0]=2 1528 B12R1.34 CCC(=O)C(c1ccccc1)Br Amb17596238 [0,1,0,0,0,0|2,0,1]=4 1529 B12R1.34 CCC(=O)[C@@H](C)c1ccccc1 Amb25706991 [0,1,0,0,0,0|2,0,1]=4 1530 B12R1.34 CCC(=O)[C@H](C)c1ccccc1 Amb25730209 [0,1,0,0,0,0|2,0,1]=4 1531 B12R1.34 CCC(=O)[C@H](N)c1ccccc1 Amb25757342 [0,1,0,0,0,0|2,0,1]=4 1532 B12R1.34 CCC(Br)C(=O)c1cccc[n]1 Amb19959526 [0,1,0,0,0,0|2,0,0]=3 1533 B12R1.34 CCC(C(=O)c1ccccc1)N Amb17138555 [0,1,0,0,0,0|1,0,0]=2 1534 B12R1.34 CCC(C)C(=C)c1ccccc1 Amb24598173 [0,1,0,0,0,0|2,0,0]=3 1535 B12R1.34 CCC(C)C(=O)c1[n]ccc[n]1 Amb24394066 [0,1,0,0,0,0|3,0,0]=4 1536 B12R1.34 CCC(C)C(=O)c1cccc[n]1 Amb24649735 [0,1,0,0,0,0|2,0,0]=3 1537 B12R1.34 CCC(C)N(C)c1ccccc1 Amb24525678 [0,1,0,0,0,0|3,0,0]=4 1538 B12R1.34 CCC(Cl)C(=O)c1ccccc1 Amb19074252 [0,1,0,0,0,0|1,0,0]=2 1539 B12R1.34 CCC(Cl)C(Cl)c1ccccc1 Amb25039087 [0,1,0,0,0,0|2,0,1]=4 1540 B12R1.34 CCC(F)C(O)c1ccccc1 Amb25158096 [0,1,0,0,0,0|1,0,2]=4 1541 B12R1.34 CCC(I)C(=O)c1ccccc1 Amb20621476 [0,1,0,0,0,0|1,0,0]=2 1542 B12R1.34 CCC(N)C(=O)c1c[n]cc[n]1 Amb25041507 [0,1,0,0,0,0|3,0,0]=4 1543 B12R1.34 CCC(N)C(=O)c1ccc[n]c1 Amb18828832 [0,1,0,0,0,0|2,0,0]=3 1544 B12R1.34 CCC(N)C(=O)c1ccccc1 Amb22549075 [0,1,0,0,0,0|1,0,0]=2 1545 B12R1.34 CCC(N)C(N)c1ccccc1 Amb25765179 [0,1,0,0,0,0|2,0,1]=4 1546 B12R1.34 CCC(N)C(O)c1ccccc1 Amb19373101 [0,1,0,0,0,0|1,0,2]=4 1547 B12R1.34 CCC(O)C(=O)c1ccccc1 Amb18800792 [0,1,0,0,0,0|1,0,0]=2 1548 B12R1.34 CC[C@@H](C)C(=O)c1ccccc1 Amb24724257 [0,1,0,0,0,0|1,0,0]=2 1549 B12R1.34 CC[C@@H](N)C(=O)c1ccccc1 Amb24595929 [0,1,0,0,0,0|1,0,0]=2 1550 B12R1.34 CC[C@@H](N)[C@@H](N)c1ccccc1 Amb25151083 [0,1,0,0,0,0|2,0,1]=4 1551 B12R1.34 CC[C@@H](N)[C@H](O)c1ccccc1 Amb25793544 [0,1,0,0,0,0|1,0,2]=4 1552 B12R1.34 CC[C@@H](O)C(=O)c1ccccc1 Amb24691713 [0,1,0,0,0,0|1,0,0]=2 1553 B12R1.34 CC[C@@H](O)[C@@H](N)c1ccccc1 Amb25760697 [0,1,0,0,0,0|2,0,1]=4 1554 B12R1.34 CC[C@@H](O)[C@H](N)c1ccccc1 Amb25301206 [0,1,0,0,0,0|2,0,1]=4 1555 B12R1.34 CC[C@H](C)C(=O)c1ccccc1 Amb24378367 [0,1,0,0,0,0|1,0,0]=2 1556 B12R1.34 CC[C@H](N)C(=O)c1ccccc1 Amb25302294 [0,1,0,0,0,0|1,0,0]=2 1557 B12R1.34 CC[C@H](N)[C@@H](O)c1ccccc1 Amb24677748 [0,1,0,0,0,0|1,0,2]=4 1558 B12R1.34 CC[C@H](O)C(=O)c1ccccc1 Amb25799278 [0,1,0,0,0,0|1,0,0]=2 1559 B12R1.34 CC[C@H](O)[C@@H](O)c1ccccc1 Amb25280169 [0,1,0,0,0,0|1,0,2]=4 1560 B12R1.34 CN(C#N)C(=O)c1ccccc1 Amb24096520 [0,1,0,0,0,0|2,0,1]=4 1561 B12R1.34 CN(C(=N)CC)c1ccccc1 Amb24634785 [0,1,0,0,0,0|3,0,0]=4 1562 B12R1.34 CN(C=C)C(=O)c1ccccc1 Amb24096799 [0,1,0,0,0,0|1,0,2]=4 1563 B12R1.34 CN(C=O)C(=O)c1ccccc1 Amb24096619 [0,1,0,0,0,0|2,0,1]=4 1564 B12R1.34 CN(CBr)C(=O)c1ccccc1 Amb24092624 [0,1,0,0,0,0|2,0,0]=3 1565 B12R1.34 CN(CC)C(=O)c1c[n]cc[n]1 Amb25128599 [0,1,0,0,0,0|3,0,0]=4 1566 B12R1.34 CN(CC)C(=O)c1cc[n][n]c1 Amb24404415 [0,1,0,0,0,0|3,0,0]=4 1567 B12R1.34 CN(CC)C(=O)c1cc[n]cc1 Amb24473622 [0,1,0,0,0,0|2,0,0]=3 1568 B12R1.34 CN(CC)C(=O)c1cc[n]cc1 Amb25818205 [0,1,0,0,0,0|2,0,0]=3 1569 B12R1.34 CN(CC)C(=O)c1cccc[n]1 Amb25749451 [0,1,0,0,0,0|2,0,0]=3 1570 B12R1.34 CN(CC)C(=O)c1ccccc1 Amb24096608 [0,1,0,0,0,0|1,0,0]=2 1571 B12R1.34 CN(CCl)C(=O)c1ccccc1 Amb25109907 [0,1,0,0,0,0|2,0,0]=3 1572 B12R1.34 CN(NC)C(=O)c1ccccc1 Amb25174185 [0,1,0,0,0,0|2,0,0]=3 1573 B12R1.34 CN(OC)C(=O)c1ccc[n]c1 Amb20673749 [0,1,0,0,0,0|3,0,0]=4 1574 B12R1.34 CN(OC)C(=O)c1cccc[n]1 Amb20673724 [0,1,0,0,0,0|3,0,0]=4 1575 B12R1.34 CNC(=O)C(=O)c1ccccc1 Amb17334577 [0,1,0,0,0,0|2,0,0]=3 1576 B12R1.34 CNC(C(=O)c1ccccc1)C Amb17616803 [0,1,0,0,0,0|2,0,0]=3 1577 B12R1.34 CNC(C)C(=O)c1cc[n]cc1 Amb25381151 [0,1,0,0,0,0|3,0,0]=4 1578 B12R1.34 CN[C@@H](C)C(=C)c1ccccc1 Amb24758988 [0,1,0,0,0,0|3,0,0]=4 1579 B12R1.34 CN[C@@H](C)C(=O)c1ccccc1 Amb25312230 [0,1,0,0,0,0|2,0,0]=3 1580 B12R1.34 CN[C@H](C)C(=C)c1ccccc1 Amb24697574 [0,1,0,0,0,0|3,0,0]=4 1581 B12R1.34 COC(=C)C(=O)c1ccccc1 Amb17594034 [0,1,0,0,0,0|2,0,0]=3 1582 B12R1.34 COC(=N)C(=O)c1ccccc1 Amb24647710 [0,1,0,0,0,0|2,0,0]=3 1583 B12R1.34 COC(=O)C(=O)c1cc[n]cc1 Amb25370850 [0,1,0,0,0,0|3,0,0]=4 1584 B12R1.34 COC(=O)C(=O)c1cccc[n]1 Amb25735105 [0,1,0,0,0,0|3,0,0]=4 1585 B12R1.34 COC(Br)C(=O)c1ccccc1 Amb25729950 [0,1,0,0,0,0|2,0,0]=3 1586 B12R1.34 COC(C)C(=O)c1cccc[n]1 Amb24434623 [0,1,0,0,0,0|3,0,0]=4 1587 B12R1.34 COC(O)C(=O)c1ccccc1 Amb24416714 [0,1,0,0,0,0|2,0,0]=3 1588 B12R1.34 CON(C(=O)c1ccncc1)C Amb10571540 [0,1,0,0,0,0|3,0,0]=4 1589 B12R1.34 CO[C@@H](C)C(=O)c1cccc[n]1 Amb25035202 [0,1,0,0,0,0|3,0,0]=4 1590 B12R1.34 CO[C@@H](C)C(=O)c1ccccc1 Amb25116501 [0,1,0,0,0,0|2,0,0]=3 1591 B12R1.34 CO[C@H](O)C(=O)c1ccccc1 Amb25735094 [0,1,0,0,0,0|2,0,0]=3 1592 B12R1.34 CSC(C(=O)c1ccccc1)O Amb17594697 [0,1,0,0,0,0|2,0,0]=3 1593 B12R1.34 CSC(C)C(=O)c1ccccc1 Amb18796322 [0,1,0,0,0,0|2,0,0]=3 1594 B12R1.34 C[C@@H](C=C)C(=O)c1ccccc1 Amb24621322 [0,1,0,0,0,0|1,0,2]=4 1595 B12R1.34 C[C@@H](CO)S(=O)c1ccccc1 Amb24733124 [0,1,0,0,0,0|3,0,0]=4 1596 B12R1.34 C[C@@H]([C@H](O)CC)c1ccccc1 Amb25317557 [0,1,0,0,0,0|2,0,1]=4 1597 B12R1.34 C[C@H](CC)C(O)c1ccccc1 Amb24735208 [0,1,0,0,0,0|1,0,2]=4 1598 B12R1.34 C[C@H](CC)[C@@H](O)c1ccccc1 Amb25047673 [0,1,0,0,0,0|1,0,2]=4 1599 B12R1.34 C[C@H](CO)C(=O)c1ccccc1 Amb25139941 [0,1,0,0,0,0|2,0,0]=3 1600 B12R1.34 C[C@H]([C@H](N)CC)c1ccccc1 Amb25800098 [0,1,0,0,0,0|2,0,1]=4 1601 B12R1.34 C\C(=C(\F)/CO)\c1ccccc1 Amb24412960 [0,1,0,0,0,0|3,0,0]=4 1602 B12R1.34 C\C(=C/F)\C(=O)c1ccccc1 Amb24737404 [0,1,0,0,0,0|2,0,1]=4 1603 B12R1.34 C\C(=C/N)\C(=O)c1ccccc1 Amb25320935 [0,1,0,0,0,0|2,0,1]=4 1604 B12R1.34 C\C(=C\C)\C(=O)c1ccccc1 Amb25730208 [0,1,0,0,0,0|1,0,1]=3 1605 B12R1.34 C\C(=C\O)\C(=O)c1ccccc1 Amb24725291 [0,1,0,0,0,0|2,0,1]=4 1606 B12R1.34 C\C(=N\N)\C(=O)c1ccccc1 Amb24745786 [0,1,0,0,0,0|3,0,0]=4 1607 B12R1.34 C\C(\CO)=C(\O)/c1ccccc1 Amb24520521 [0,1,0,0,0,0|2,0,1]=4 1608 B12R1.34 C\C(\c1ccccc1)=C(\C)/CCl Amb24652371 [0,1,0,0,0,0|3,0,0]=4 1609 B12R1.34 C\C=C(/Br)\C(=O)c1ccccc1 Amb22471932 [0,1,0,0,0,0|1,0,1]=3 1610 B12R1.34 C\C=C(/N)\C(=O)c1ccccc1 Amb25144133 [0,1,0,0,0,0|1,0,1]=3 1611 B12R1.34 C\C=C(\N)/C(=O)c1ccccc1 Amb25377894 [0,1,0,0,0,0|1,0,1]=3 1612 B12R1.34 ClCC(C(=O)c1ccccc1)Br Amb17351480 [0,1,0,0,0,0|2,0,0]=3 1613 B12R1.34 ClCC(C(=O)c1ccccc1)Cl Amb17337895 [0,1,0,0,0,0|2,0,0]=3 1614 B12R1.34 FC(C(=O)c1ccccc1)C#N Amb17621808 [0,1,0,0,0,0|2,0,1]=4 1615 B12R1.34 N#CC(Cl)C(=O)c1ccccc1 Amb25807933 [0,1,0,0,0,0|2,0,1]=4 1616 B12R1.34 N=C(CCl)C(=O)c1ccccc1 Amb25803467 [0,1,0,0,0,0|2,0,0]=3 1617 B12R1.34 NC(C=O)C(=O)c1ccccc1 Amb24106087 [0,1,0,0,0,0|2,0,1]=4 1618 B12R1.34 NC(CO)C(=O)c1ccccc1 Amb24711479 [0,1,0,0,0,0|2,0,0]=3 1619 B12R1.34 NCC(Br)C(=O)c1ccccc1 Amb25188302 [0,1,0,0,0,0|2,0,0]=3 1620 B12R1.34 NCC(C(=O)c1ccccc1)N Amb10843426 [0,1,0,0,0,0|2,0,0]=3 1621 B12R1.34 N\C=C(/C(=O)c1ccccc1)\C Amb2386654 [0,1,0,0,0,0|2,0,1]=4 1622 B12R1.34 N\C=C(/O)\C(=O)c1ccccc1 Amb25674167 [0,1,0,0,0,0|2,0,1]=4 1623 B12R1.34 N\C=C(\Br)/C(=O)c1ccccc1 Amb25048523 [0,1,0,0,0,0|2,0,1]=4 1624 B12R1.34 N\C=C(\O)/C(=O)c1ccccc1 Amb25179008 [0,1,0,0,0,0|2,0,1]=4 1625 B12R1.34 O=C(C(Br)CBr)c1ccccc1 Amb25087312 [0,1,0,0,0,0|2,0,0]=3 1626 B12R1.34 O=C(C(Cl)N=O)c1ccccc1 Amb24104253 [0,1,0,0,0,0|3,0,0]=4 1627 B12R1.34 OCC(Cl)C(=O)c1ccccc1 Amb24104261 [0,1,0,0,0,0|2,0,0]=3 1628 B12R1.34 OCC(F)C(=O)c1ccccc1 Amb24084171 [0,1,0,0,0,0|2,0,0]=3 1629 B12R1.34 OC[C@H](O)C(=O)c1ccccc1 Amb25086748 [0,1,0,0,0,0|2,0,0]=3 1630 B12R1.34 O[C@@H](CCl)C(=O)c1ccccc1 Amb24365917 [0,1,0,0,0,0|2,0,0]=3 1631 B12R1.34 O\C(=C/O)\C(=O)c1ccccc1 Amb24662497 [0,1,0,0,0,0|2,0,1]=4 1632 B12R1.34 O\C(=C\O)\C(=O)c1ccccc1 Amb25358915 [0,1,0,0,0,0|2,0,1]=4 1633 B12R1.34 O\C(=N\O)\C(=O)c1ccccc1 Amb25326728 [0,1,0,0,0,0|3,0,0]=4 1634 B12R1.34 O\N=C(\Cl)/C(=O)c1ccccc1 Amb24100191 [0,1,0,0,0,0|3,0,0]=4 1635 B12R1.34 [O-]\C=C(\C(=O)c1ccccc1)/C Amb10553865 [0,1,0,0,0,0|2,0,1]=4 1636 B12R1.39 BrCCS(=O)(=O)c1ccccc1 Amb17106167 [0,1,0,0,0,0|3,0,0]=4 1637 B12R1.39 CCCC(F)(F)c1ccccc1 Amb19894549 [0,1,0,0,0,0|2,0,1]=4 1638 B12R1.39 CCCS(=O)(=O)c1ccccc1 Amb24485446 [0,1,0,0,0,0|2,0,0]=3 1639 B12R1.39 CCOP(=O)(Cl)c1ccccc1 Amb24396234 [0,1,0,0,0,0|1,0,0]=2 1640 B12R1.39 CCOP(=O)(c1ccccc1)F Amb10839099 [0,1,0,0,0,0|1,0,0]=2 1641 B12R1.39 CCOP(C)(=O)c1ccccc1 Amb24487373 [0,1,0,0,0,0|1,0,0]=2 1642 B12R1.39 CCOP(O)(=O)c1ccccc1 Amb22230243 [0,1,0,0,0,0|1,0,0]=2 1643 B12R1.39 CCO[Si](C)(C)c1ccccc1 Amb19894004 [0,1,0,0,0,0|1,1,0]=3 1644 B12R1.39 COCS(=O)(=O)c1ccccc1 Amb24324970 [0,1,0,0,0,0|3,0,0]=4 1645 B12R1.39 CONS(=O)(=O)c1ccccc1 Amb16969978 [0,1,0,0,0,0|3,0,0]=4 1646 B12R1.39 C\C=C\S(=O)(=O)c1ccccc1 Amb24484200 [0,1,0,0,0,0|2,0,1]=4 1647 B12R1.39 ClCCS(=O)(=O)c1ccccc1 Amb1034876 [0,1,0,0,0,0|3,0,0]=4 1648 B12R1.39 NCC[S+](=O)(c1ccccc1)[O-] Amb10230992 [0,1,0,0,0,0|3,0,0]=4 1649 B12R1.39 O=S(=O)(CCF)c1ccccc1 Amb24734666 [0,1,0,0,0,0|3,0,0]=4 1650 B12R1.39 OCCP(O)(=O)c1ccccc1 Amb25706050 [0,1,0,0,0,0|3,0,0]=4 1651 B12R1.107 CC(=C)CC(=O)c1cc[n]cc1 Amb18563517 [0,1,0,0,0,0|2,0,1]=4 1652 B12R1.107 CC(=C)CC(=O)c1ccc[n]c1 Amb18563516 [0,1,0,0,0,0|2,0,1]=4 1653 B12R1.107 CC(=C)CC(=O)c1cccc[n]1 Amb18563515 [0,1,0,0,0,0|2,0,1]=4 1654 B12R1.107 CC(=C)CC(=O)c1ccccc1 Amb18563490 [0,1,0,0,0,0|1,0,1]=3 1655 B12R1.107 CC(=C)NC(=O)c1ccccc1 Amb24096681 [0,1,0,0,0,0|1,0,1]=3 1656 B12R1.107 CC(=C)OC(=O)c1cccc[n]1 Amb24643969 [0,1,0,0,0,0|1,0,1]=3 1657 B12R1.107 CC(=NN(C)C)c1ccccc1 Amb22230212 [0,1,0,0,0,0|3,0,0]=4 1658 B12R1.107 CC(=O)NC(=O)c1c[n]ccc1 Amb25756189 [0,1,0,0,0,0|2,0,1]=4 1659 B12R1.107 CC(=O)NC(=O)c1cccc[n]1 Amb25040960 [0,1,0,0,0,0|2,0,1]=4 1660 B12R1.107 CC(=O)NC(=O)c1ccccc1 Amb24073560 [0,1,0,0,0,0|1,0,1]=3 1661 B12R1.107 CC(=O)NC(=S)c1ccccc1 Amb24073591 [0,1,0,0,0,0|1,1,1]=4 1662 B12R1.107 CC(=O)OC(=C)c1ccccc1 Amb22730633 [0,1,0,0,0,0|1,0,1]=3 1663 B12R1.107 CC(=O)OC(=O)c1ccccc1 Amb17678790 [0,1,0,0,0,0|0,0,1]=2 1664 B12R1.107 CC(=O)O[C@@H](C)c1ccccc1 Amb25144207 [0,1,0,0,0,0|1,0,2]=4 1665 B12R1.107 CC(=O)O[C@H](C)c1ccccc1 Amb25160190 [0,1,0,0,0,0|1,0,2]=4 1666 B12R1.107 CC(=O)\C=C(/S)\c1ccccc1 Amb25730212 [0,1,0,0,0,0|1,1,1]=4 1667 B12R1.107 CC(=O)\C=C(\N)/c1ccccc1 Amb25309296 [0,1,0,0,0,0|2,0,1]=4 1668 B12R1.107 CC(=O)\N=C(\N)/c1ccccc1 Amb25150972 [0,1,0,0,0,0|2,0,1]=4 1669 B12R1.107 CC(=S)NC(=O)c1ccccc1 Amb24640397 [0,1,0,0,0,0|1,0,1]=3 1670 B12R1.107 CC(C)=CC(=O)c1cc[n]cc1 Amb24573701 [0,1,0,0,0,0|2,0,1]=4 1671 B12R1.107 CC(C)=NC(=O)c1ccccc1 Amb24096687 [0,1,0,0,0,0|1,0,1]=3 1672 B12R1.107 CC(C)CC(=O)c1[n]ccc[n]1 Amb18792555 [0,1,0,0,0,0|3,0,0]=4 1673 B12R1.107 CC(C)CC(=O)c1c[n]c[n]c1 Amb18800810 [0,1,0,0,0,0|3,0,0]=4 1674 B12R1.107 CC(C)CC(=O)c1c[n]cc[n]1 Amb18792554 [0,1,0,0,0,0|3,0,0]=4 1675 B12R1.107 CC(C)C[C@@H](Cl)c1ccccc1 Amb25667428 [0,1,0,0,0,0|2,0,1]=4 1676 B12R1.107 CC(C)C[C@@H](N)c1ccccc1 Amb22288660 [0,1,0,0,0,0|2,0,1]=4 1677 B12R1.107 CC(C)C[C@@H](O)c1ccccc1 Amb25816173 [0,1,0,0,0,0|1,0,2]=4 1678 B12R1.107 CC(C)C[C@H](N)c1ccccc1 Amb22288705 [0,1,0,0,0,0|2,0,1]=4 1679 B12R1.107 CC(C)C[C@H](O)c1ccccc1 Amb24344678 [0,1,0,0,0,0|1,0,2]=4 1680 B12R1.107 CC(C)NC(=N)c1cccc[n]1 Amb25148441 [0,1,0,0,0,0|3,0,0]=4 1681 B12R1.107 CC(C)NC(=O)c1cc[n][n]c1 Amb25360372 [0,1,0,0,0,0|3,0,0]=4 1682 B12R1.107 CC(C)NC(=O)c1cccc[n]1 Amb25152476 [0,1,0,0,0,0|2,0,0]=3 1683 B12R1.107 CC(C)NC(=S)c1cc[n]cc1 Amb24537888 [0,1,0,0,0,0|2,1,0]=4 1684 B12R1.107 CC(C)NC(=S)c1ccc[n]c1 Amb22641097 [0,1,0,0,0,0|2,1,0]=4 1685 B12R1.107 CC(C)NS(=O)c1ccccc1 Amb25177350 [0,1,0,0,0,0|2,0,0]=3 1686 B12R1.107 CC(C)N[C@@H](C)c1ccccc1 Amb22747560 [0,1,0,0,0,0|2,0,1]=4 1687 B12R1.107 CC(C)OC(=N)c1cc[n]cc1 Amb25751672 [0,1,0,0,0,0|2,0,0]=3 1688 B12R1.107 CC(C)OC(=O)c1cc[n][n]c1 Amb25778486 [0,1,0,0,0,0|2,0,0]=3 1689 B12R1.107 CC(C)OC(=O)c1cc[n]c[n]1 Amb25271292 [0,1,0,0,0,0|2,0,0]=3 1690 B12R1.107 CC(C)OC(O)c1cccc[n]1 Amb24496382 [0,1,0,0,0,0|1,0,2]=4 1691 B12R1.107 CC(C)OP(=O)c1ccccc1 Amb25042914 [0,1,0,0,0,0|1,0,0]=2 1692 B12R1.107 CC(C)SC(C)c1ccccc1 Amb24371858 [0,1,0,0,0,0|1,1,1]=4 1693 B12R1.107 CC(C)[NH2+][C@@H](C)c1ccccc1 Amb22049556 [0,1,0,0,0,0|2,0,1]=4 1694 B12R1.107 CC(C)\N=C(/N)\c1c[n]ccc1 Amb21970338 [0,1,0,0,0,0|3,0,0]=4 1695 B12R1.107 CC(CC(=O)c1cccnc1)C Amb10607962 [0,1,0,0,0,0|2,0,0]=3 1696 B12R1.107 CC(CC(=O)c1ccncc1)C Amb17334579 [0,1,0,0,0,0|2,0,0]=3 1697 B12R1.107 CC(CC(C)Br)c1ccccc1 Amb25273655 [0,1,0,0,0,0|2,0,1]=4 1698 B12R1.107 CC(CN(c1ccccc1)C)C Amb17232437 [0,1,0,0,0,0|3,0,0]=4 1699 B12R1.107 CC(CN(c1ccccc1)C)N Amb10610213 [0,1,0,0,0,0|3,0,0]=4 1700 B12R1.107 CC(CN(c1ccccc1)C)N Amb1137929 [0,1,0,0,0,0|3,0,0]=4 1701 B12R1.107 CC(CN(c1ccccc1)C)O Amb17138595 [0,1,0,0,0,0|3,0,0]=4 1702 B12R1.107 CC(CN(c1ccccc1)N)C Amb17226667 [0,1,0,0,0,0|3,0,0]=4 1703 B12R1.107 CC(Cl)CN(C)c1ccccc1 Amb24711498 [0,1,0,0,0,0|3,0,0]=4 1704 B12R1.107 CC(N)CC(=O)c1ccc[n]c1 Amb24758636 [0,1,0,0,0,0|2,0,0]=3 1705 B12R1.107 CC(N)CC(=O)c1ccccc1 Amb20668879 [0,1,0,0,0,0|1,0,0]=2 1706 B12R1.107 CC(N)CC(=O)c1ccccc1 Amb22059727 [0,1,0,0,0,0|1,0,0]=2 1707 B12R1.107 CC(N)CC(O)c1ccccc1 Amb18646365 [0,1,0,0,0,0|1,0,2]=4 1708 B12R1.107 CC(N)C[C@@H](O)c1ccccc1 Amb25719473 [0,1,0,0,0,0|1,0,2]=4 1709 B12R1.107 CC(O)CC(=C)c1ccc[n]c1 Amb25706101 [0,1,0,0,0,0|3,0,0]=4 1710 B12R1.107 CC(O)CC(=O)c1ccc[n]c1 Amb25060077 [0,1,0,0,0,0|2,0,0]=3 1711 B12R1.107 CC(O)CC(N)c1ccccc1 Amb18646382 [0,1,0,0,0,0|2,0,1]=4 1712 B12R1.107 CC(O)CC(P)c1ccccc1 Amb25157842 [0,1,0,0,0,0|2,0,1]=4 1713 B12R1.107 CC(O)CC(S)c1ccccc1 Amb24525704 [0,1,0,0,0,0|1,1,1]=4 1714 B12R1.107 CC(O)CS(=O)c1ccccc1 Amb25042910 [0,1,0,0,0,0|2,0,0]=3 1715 B12R1.107 CC(O)C[C@H](O)c1ccccc1 Amb24355251 [0,1,0,0,0,0|1,0,2]=4 1716 B12R1.107 CC(OC(=O)c1ccccc1)C Amb15740252 [0,1,0,0,0,0|0,0,0]=1 1717 B12R1.107 CC(OC(=O)c1ccccc1)Cl Amb10603969 [0,1,0,0,0,0|0,0,0]=1 1718 B12R1.107 CC(OC(=O)c1ccccn1)C Amb17509339 [0,1,0,0,0,0|1,0,0]=2 1719 B12R1.107 CC(OC(=O)c1cccnc1)C Amb1959307 [0,1,0,0,0,0|1,0,0]=2 1720 B12R1.107 CC(OC(=O)c1ccncc1)C Amb17509340 [0,1,0,0,0,0|1,0,0]=2 1721 B12R1.107 CC([O-])=CC(=O)c1ccccc1 Amb22446280 [0,1,0,0,0,0|1,0,1]=3 1722 B12R1.107 CC([O-])=CC(=O)c1ccccc1 Amb22446311 [0,1,0,0,0,0|1,0,1]=3 1723 B12R1.107 CC([O-])=CC(=O)c1ccccc1 Amb22474103 [0,1,0,0,0,0|1,0,1]=3 1724 B12R1.107 CC([O-])=CC(=O)c1ccccc1 Amb22474104 [0,1,0,0,0,0|1,0,1]=3 1725 B12R1.107 CC(\N=C(/c1ccccc1)\Cl)C Amb2371275 [0,1,0,0,0,0|2,0,0]=3 1726 B12R1.107 CN(C)CC(=O)c1cc[n]cc1 Amb25222976 [0,1,0,0,0,0|3,0,0]=4 1727 B12R1.107 CN(C)CC(=O)c1ccc[n]c1 Amb25054451 [0,1,0,0,0,0|3,0,0]=4 1728 B12R1.107 CN(C)CC(=O)c1ccccc1 Amb22264767 [0,1,0,0,0,0|2,0,0]=3 1729 B12R1.107 CN(C)NC(=N)c1ccccc1 Amb24720079 [0,1,0,0,0,0|3,0,0]=4 1730 B12R1.107 CN(C)\C=C(/O)\c1ccccc1 Amb24068870 [0,1,0,0,0,0|2,0,1]=4 1731 B12R1.107 CN(NC(=O)c1ccccc1)C Amb10574824 [0,1,0,0,0,0|2,0,0]=3 1732 B12R1.107 CS(=O)CC(=O)c1ccccc1 Amb24741512 [0,1,0,0,0,0|2,0,0]=3 1733 B12R1.107 C[C@@H](N)CN(C)c1ccccc1 Amb25058714 [0,1,0,0,0,0|3,0,0]=4 1734 B12R1.107 C[C@@H](N)CS(=O)c1ccccc1 Amb24381565 [0,1,0,0,0,0|2,0,0]=3 1735 B12R1.107 C[C@@H](N)C[C@@H]([O-])c1ccccc1 Amb25825094 [0,1,0,0,0,0|1,0,2]=4 1736 B12R1.107 C[C@@H](O)CN(C)c1ccccc1 Amb24663849 [0,1,0,0,0,0|3,0,0]=4 1737 B12R1.107 C[C@@H](O)CS(=O)c1ccccc1 Amb25788068 [0,1,0,0,0,0|2,0,0]=3 1738 B12R1.107 C[C@@H](O)C[C@@H](N)c1ccccc1 Amb24634311 [0,1,0,0,0,0|2,0,1]=4 1739 B12R1.107 C[C@@H](O)C[C@H](N)c1ccccc1 Amb24711221 [0,1,0,0,0,0|2,0,1]=4 1740 B12R1.107 C[C@H](C[C@H](C)O)c1ccccc1 Amb25741359 [0,1,0,0,0,0|2,0,1]=4 1741 B12R1.107 C[C@H](Cl)C[C@@H](Cl)c1ccccc1 Amb25119306 [0,1,0,0,0,0|2,0,1]=4 1742 B12R1.107 C[C@H](N)C[C@@H](O)c1ccccc1 Amb25362221 [0,1,0,0,0,0|1,0,2]=4 1743 B12R1.107 C[C@H](N)C[C@H]([O-])c1ccccc1 Amb25180739 [0,1,0,0,0,0|1,0,2]=4 1744 B12R1.107 C[C@H](O)CC(=C)c1ccccc1 Amb25741335 [0,1,0,0,0,0|2,0,0]=3 1745 B12R1.107 C[C@H](O)CC(N)c1ccccc1 Amb24608910 [0,1,0,0,0,0|2,0,1]=4 1746 B12R1.107 C[C@H](O)CC(O)c1ccccc1 Amb25846972 [0,1,0,0,0,0|1,0,2]=4 1747 B12R1.107 C[C@H](O)CS(=O)c1ccccc1 Amb24364273 [0,1,0,0,0,0|2,0,0]=3 1748 B12R1.107 C[C@H](O)C[C@@H](N)c1ccccc1 Amb25152440 [0,1,0,0,0,0|2,0,1]=4 1749 B12R1.107 C[C@H](O)C[C@@H](O)c1ccccc1 Amb24431811 [0,1,0,0,0,0|1,0,2]=4 1750 B12R1.107 C[C@H](O)C[C@H](S)c1ccccc1 Amb24398074 [0,1,0,0,0,0|1,1,1]=4 1751 B12R1.107 C\C(=C/C(=O)c1ccccn1)\N Amb10242646 [0,1,0,0,0,0|2,0,1]=4 1752 B12R1.107 C\C(=C\C(C)=O)\c1ccccc1 Amb24367599 [0,1,0,0,0,0|2,0,1]=4 1753 B12R1.107 C\C(=C\C(C)O)\c1cc[n]cc1 Amb24467242 [0,1,0,0,0,0|3,0,0]=4 1754 B12R1.107 C\C(=C\C(C)O)\c1ccccc1 Amb25823380 [0,1,0,0,0,0|2,0,0]=3 1755 B12R1.107 C\C(=C\N(C)C)\c1ccccc1 Amb25711045 [0,1,0,0,0,0|3,0,0]=4 1756 B12R1.107 C\C(=N/C(C)C)\c1ccccc1 Amb24053029 [0,1,0,0,0,0|2,0,0]=3 1757 B12R1.107 C\C(=N\N(C)C)\c1ccccc1 Amb22347640 [0,1,0,0,0,0|3,0,0]=4 1758 B12R1.107 C\C(\F)=C/C(=O)c1ccccc1 Amb24497135 [0,1,0,0,0,0|1,0,1]=3 1759 B12R1.107 C\C(\F)=C\C(=O)c1ccccc1 Amb24631194 [0,1,0,0,0,0|1,0,1]=3 1760 B12R1.107 C\C(\N)=C\C(=O)c1cccc[n]1 Amb25319980 [0,1,0,0,0,0|2,0,1]=4 1761 B12R1.107 C\C(\N)=C\C(=S)c1ccccc1 Amb25264968 [0,1,0,0,0,0|1,1,1]=4 1762 B12R1.107 C\C(\N)=N\C(=O)c1c[n]ccc1 Amb25049276 [0,1,0,0,0,0|2,0,1]=4 1763 B12R1.107 C\C(\N)=N\C(=S)c1ccccc1 Amb25669598 [0,1,0,0,0,0|1,1,1]=4 1764 B12R1.107 C\C(\[O-])=C/C(=O)c1ccccc1 Amb22043283 [0,1,0,0,0,0|1,0,1]=3 1765 B12R1.107 C\C(\[O-])=C/C(=O)c1ccccc1 Amb22729931 [0,1,0,0,0,0|1,0,1]=3 1766 B12R1.107 C\C(\[O-])=C/C(=O)c1ccccc1 Amb22729983 [0,1,0,0,0,0|1,0,1]=3 1767 B12R1.107 C\C(\[O-])=C/C(=O)c1ccccc1 Amb22733686 [0,1,0,0,0,0|1,0,1]=3 1768 B12R1.107 C\C(\[O-])=C\C(=O)c1ccccc1 Amb22729984 [0,1,0,0,0,0|1,0,1]=3 1769 B12R1.107 NC(=N)NC(=O)c1ccccc1 Amb22347479 [0,1,0,0,0,0|2,0,1]=4 1770 B12R1.107 NC(=N)NC(=O)c1ccccc1 Amb25703047 [0,1,0,0,0,0|2,0,1]=4 1771 B12R1.107 NC(=N)SC(=O)c1ccccc1 Amb21955775 [0,1,0,0,0,0|1,1,1]=4 1772 B12R1.107 NC(=S)SC(=O)c1ccccc1 Amb24390273 [0,1,0,0,0,0|1,1,1]=4 1773 B12R1.107 NC(N)=CC(=O)c1ccccc1 Amb25108111 [0,1,0,0,0,0|2,0,1]=4 1774 B12R1.107 NC(N)OC(=O)c1ccccc1 Amb24367346 [0,1,0,0,0,0|1,0,0]=2 1775 B12R1.107 NC(c1ccccc1)CC(C)C Amb1107536 [0,1,0,0,0,0|2,0,1]=4 1776 B12R1.107 O=C(CC(=O)[Na])c1ccccc1 Amb24364157 [0,1,0,0,0,0|2,0,1]=4 1777 B12R1.107 O=C(NC(P)=S)c1ccccc1 Amb25743007 [0,1,0,0,0,0|2,0,1]=4 1778 B12R1.107 O=C(c1ccccc1)C=C(C)C Amb10874044 [0,1,0,0,0,0|1,0,1]=3 1779 B12R1.107 O=C(c1ccccc1)CC(=O)O Amb10576353 [0,1,0,0,0,0|2,0,1]=4 1780 B12R1.107 O=C(c1ccccc1)C[NH+](C)C Amb10554030 [0,1,0,0,0,0|2,0,0]=3 1781 B12R1.107 O=C(c1ccccc1)C[S+](C)C Amb10838263 [0,1,0,0,0,0|2,0,0]=3 1782 B12R1.107 O=C(c1ccccc1)\C=C(/N)\C Amb2386640 [0,1,0,0,0,0|1,0,1]=3 1783 B12R1.107 O=C(c1ccccc1)\N=C(/N)\C Amb10553700 [0,1,0,0,0,0|1,0,1]=3 1784 B12R1.107 OC(c1ccccc1)CC(C)C Amb1110402 [0,1,0,0,0,0|1,0,2]=4 1785 B12R1.107 OC(c1ccccc1)CC(O)C Amb1110547 [0,1,0,0,0,0|1,0,2]=4 1786 B12R1.107 [O-]C(=O)CC(=O)c1ccccc1 Amb22491482 [0,1,0,0,0,0|2,0,1]=4 1787 B12R1.107 [O-]C(=O)CC(=O)c1ccccc1 Amb23401058 [0,1,0,0,0,0|2,0,1]=4 1788 B12R1.107 [O-][N+](=O)OC(=O)c1ccccc1 Amb17939330 [0,1,0,0,0,0|2,0,0]=3 1789 B12R1.107 [OH2+]\C(=C/C(=O)C)\c1ccccc1 Amb1395651 [0,1,0,0,0,0|1,0,2]=4 1790 B12R1.107 [OH2+]\C(=C/C(=O)C)\c1ccccc1 Amb2563772 [0,1,0,0,0,0|1,0,2]=4 1791 B12R1.308 C#CCC(=O)c1ccccc1Cl Amb18809132 [0,1,0,0,0,0|1,0,2]=4 1792 B12R1.308 C#CCC(=O)c1ccccc1F Amb18788109 [0,1,0,0,0,0|1,0,2]=4 1793 B12R1.308 C#CCC(=O)c1ccccc1N Amb25774111 [0,1,0,0,0,0|1,0,2]=4 1794 B12R1.308 C=C=CC(=O)c1ccccc1Cl Amb24614796 [0,1,0,0,0,0|1,0,2]=4 1795 B12R1.308 C=CCC(=O)c1ccccc1Br Amb25849337 [0,1,0,0,0,0|1,0,2]=4 1796 B12R1.308 C=CCC(=O)c1ccccc1C Amb17334496 [0,1,0,0,0,0|1,0,2]=4 1797 B12R1.308 C=CCC(=O)c1ccccc1Cl Amb17335455 [0,1,0,0,0,0|1,0,2]=4 1798 B12R1.308 C=CCC(=O)c1ccccc1F Amb17334599 [0,1,0,0,0,0|1,0,2]=4 1799 B12R1.308 C=CCC(=O)c1ccccc1O Amb24364098 [0,1,0,0,0,0|1,0,2]=4 1800 B12R1.308 C=COC(=O)c1ccccc1Cl Amb22277131 [0,1,0,0,0,0|0,0,2]=3 1801 B12R1.308 CCCC(=N)c1ccccc1O Amb24721703 [0,1,0,0,0,0|2,0,0]=3 1802 B12R1.308 CCCC(=O)c1[n]cc[n]c1Cl Amb24056189 [0,1,0,0,0,0|3,0,0]=4 1803 B12R1.308 CCCC(=O)c1c[n]ccc1Cl Amb25317694 [0,1,0,0,0,0|2,0,0]=3 1804 B12R1.308 CCCC(=O)c1c[n]ccc1N Amb25088017 [0,1,0,0,0,0|2,0,0]=3 1805 B12R1.308 CCCC(=O)c1cc[n]cc1O Amb24625330 [0,1,0,0,0,0|2,0,0]=3 1806 B12R1.308 CCCC(=O)c1ccccc1Br Amb17343723 [0,1,0,0,0,0|1,0,0]=2 1807 B12R1.308 CCCC(=O)c1ccccc1C Amb17198733 [0,1,0,0,0,0|1,0,0]=2 1808 B12R1.308 CCCC(=O)c1ccccc1Cl Amb17198743 [0,1,0,0,0,0|1,0,0]=2 1809 B12R1.308 CCCC(=O)c1ccccc1F Amb17198734 [0,1,0,0,0,0|1,0,0]=2 1810 B12R1.308 CCCC(=O)c1ccccc1I Amb24397248 [0,1,0,0,0,0|1,0,0]=2 1811 B12R1.308 CCCC(=O)c1ccccc1N Amb18645869 [0,1,0,0,0,0|1,0,0]=2 1812 B12R1.308 CCCC(C)c1ccccc1N Amb24729496 [0,1,0,0,0,0|2,0,1]=4 1813 B12R1.308 CCCC(Cl)c1ccccc1F Amb25127215 [0,1,0,0,0,0|2,0,1]=4 1814 B12R1.308 CCCC(N)c1ccccc1N Amb25119381 [0,1,0,0,0,0|2,0,1]=4 1815 B12R1.308 CCCC(N)c1ccccc1S Amb24488673 [0,1,0,0,0,0|2,0,1]=4 1816 B12R1.308 CCCC(O)c1ccccc1I Amb24623046 [0,1,0,0,0,0|1,0,2]=4 1817 B12R1.308 CCCC(O)c1ccccc1N Amb24473035 [0,1,0,0,0,0|1,0,2]=4 1818 B12R1.308 CCCC(O)c1ccccc1O Amb18646532 [0,1,0,0,0,0|1,0,2]=4 1819 B12R1.308 CCCC(c1ccccc1C)N Amb17232446 [0,1,0,0,0,0|2,0,1]=4 1820 B12R1.308 CCCC(c1ccccc1C)O Amb17232483 [0,1,0,0,0,0|1,0,2]=4 1821 B12R1.308 CCCC(c1ccccc1Cl)N Amb17234047 [0,1,0,0,0,0|2,0,1]=4 1822 B12R1.308 CCCC(c1ccccc1Cl)O Amb17234154 [0,1,0,0,0,0|1,0,2]=4 1823 B12R1.308 CCCC(c1ccccc1F)N Amb17232645 [0,1,0,0,0,0|2,0,1]=4 1824 B12R1.308 CCCC(c1ccccc1F)O Amb17232666 [0,1,0,0,0,0|1,0,2]=4 1825 B12R1.308 CCCN(C)c1ccccc1Br Amb25306279 [0,1,0,0,0,0|3,0,0]=4 1826 B12R1.308 CCCN(C)c1ccccc1F Amb25345830 [0,1,0,0,0,0|3,0,0]=4 1827 B12R1.308 CCCS(=O)c1[n]cccc1N Amb18977349 [0,1,0,0,0,0|3,0,0]=4 1828 B12R1.308 CCCS(=O)c1cc[n]cc1N Amb18295596 [0,1,0,0,0,0|3,0,0]=4 1829 B12R1.308 CCCS(=O)c1ccccc1N Amb18291960 [0,1,0,0,0,0|2,0,0]=3 1830 B12R1.308 CCCS(=O)c1ccccc1O Amb25143473 [0,1,0,0,0,0|2,0,0]=3 1831 B12R1.308 CCC[C@@H](N)c1ccccc1I Amb24443865 [0,1,0,0,0,0|2,0,1]=4 1832 B12R1.308 CCC[C@@H](O)c1ccccc1Br Amb24705993 [0,1,0,0,0,0|1,0,2]=4 1833 B12R1.308 CCC[C@@H](O)c1ccccc1Cl Amb25043992 [0,1,0,0,0,0|1,0,2]=4 1834 B12R1.308 CCC[C@H](N)c1ccccc1Br Amb25096337 [0,1,0,0,0,0|2,0,1]=4 1835 B12R1.308 CCC[C@H](N)c1ccccc1N Amb25088274 [0,1,0,0,0,0|2,0,1]=4 1836 B12R1.308 CCNC(=N)c1[n]cccc1Br Amb25856563 [0,1,0,0,0,0|3,0,0]=4 1837 B12R1.308 CCNC(=N)c1[n]cccc1Cl Amb24406890 [0,1,0,0,0,0|3,0,0]=4 1838 B12R1.308 CCNC(=N)c1ccccc1S Amb25804709 [0,1,0,0,0,0|2,0,0]=3 1839 B12R1.308 CCNC(=O)C1=CC=CNC1=O Amb24462761 [0,1,0,0,0,0|2,0,0]=3 1840 B12R1.308 CCNC(=O)C1=CC=CNC1=S Amb25667396 [0,1,0,0,0,0|2,0,0]=3 1841 B12R1.308 CCNC(=O)C1=CNC=CC1=O Amb24419199 [0,1,0,0,0,0|2,0,0]=3 1842 B12R1.308 CCNC(=O)c1[n]cc[n]c1N Amb24747852 [0,1,0,0,0,0|3,0,0]=4 1843 B12R1.308 CCNC(=O)c1[n]cccc1Cl Amb25669884 [0,1,0,0,0,0|2,0,0]=3 1844 B12R1.308 CCNC(=O)c1[n]cccc1N Amb18646314 [0,1,0,0,0,0|2,0,0]=3 1845 B12R1.308 CCNC(=O)c1[n]cccc1O Amb24066805 [0,1,0,0,0,0|2,0,0]=3 1846 B12R1.308 CCNC(=O)c1c[n]c[n]c1N Amb25787988 [0,1,0,0,0,0|3,0,0]=4 1847 B12R1.308 CCNC(=O)c1cc[n]cc1Br Amb24674893 [0,1,0,0,0,0|2,0,0]=3 1848 B12R1.308 CCNC(=O)c1cc[n]cc1Cl Amb25058672 [0,1,0,0,0,0|2,0,0]=3 1849 B12R1.308 CCNC(=O)c1cc[n]cc1N Amb23571475 [0,1,0,0,0,0|2,0,0]=3 1850 B12R1.308 CCNC(=O)c1ccc[n]c1F Amb25830343 [0,1,0,0,0,0|2,0,0]=3 1851 B12R1.308 CCNC(=O)c1ccc[n]c1I Amb25345655 [0,1,0,0,0,0|2,0,0]=3 1852 B12R1.308 CCNC(=O)c1ccc[n]c1N Amb18958809 [0,1,0,0,0,0|2,0,0]=3 1853 B12R1.308 CCNC(=O)c1ccccc1Cl Amb2222504 [0,1,0,0,0,0|1,0,0]=2 1854 B12R1.308 CCNC(=O)c1ccccc1N Amb1120573 [0,1,0,0,0,0|1,0,0]=2 1855 B12R1.308 CCNC(=O)c1ccccc1O Amb2137048 [0,1,0,0,0,0|1,0,0]=2 1856 B12R1.308 CCNC(=O)c1cccnc1Cl Amb2222505 [0,1,0,0,0,0|2,0,0]=3 1857 B12R1.308 CCNC(=S)c1c[n]ccc1Cl Amb24468181 [0,1,0,0,0,0|2,1,0]=4 1858 B12R1.308 CCNC(=S)c1ccccc1N Amb25804257 [0,1,0,0,0,0|1,1,0]=3 1859 B12R1.308 CCNC(=S)c1ccccc1O Amb25351661 [0,1,0,0,0,0|1,1,0]=3 1860 B12R1.308 CCN[C@@H](C)c1ccccc1Br Amb25073112 [0,1,0,0,0,0|2,0,1]=4 1861 B12R1.308 CCN[C@@H](C)c1ccccc1Cl Amb25764966 [0,1,0,0,0,0|2,0,1]=4 1862 B12R1.308 CCN[C@H](C)c1ccccc1F Amb24665516 [0,1,0,0,0,0|2,0,1]=4 1863 B12R1.308 CCOC(=C)c1[n]cc[n]c1Cl Amb24579132 [0,1,0,0,0,0|3,0,0]=4 1864 B12R1.308 CCOC(=N)C1=CC=CNC1=O Amb22261521 [0,1,0,0,0,0|2,0,0]=3 1865 B12R1.308 CCOC(=N)c1[n]cccc1O Amb24351097 [0,1,0,0,0,0|2,0,0]=3 1866 B12R1.308 CCOC(=N)c1cc[n]cc1Cl Amb25259909 [0,1,0,0,0,0|2,0,0]=3 1867 B12R1.308 CCOC(=N)c1ccccc1Br Amb24065424 [0,1,0,0,0,0|1,0,0]=2 1868 B12R1.308 CCOC(=N)c1ccccc1Cl Amb19057376 [0,1,0,0,0,0|1,0,0]=2 1869 B12R1.308 CCOC(=N)c1ccccc1F Amb20673133 [0,1,0,0,0,0|1,0,0]=2 1870 B12R1.308 CCOC(=O)C1=CC=CNC1=O Amb22751705 [0,1,0,0,0,0|1,0,0]=2 1871 B12R1.308 CCOC(=O)C1=CC=COC1=O Amb24365780 [0,1,0,0,0,0|1,0,0]=2 1872 B12R1.308 CCOC(=O)C1=CCCCC1=O Amb17594202 [0,1,0,0,0,0|0,0,3]=4 1873 B12R1.308 CCOC(=O)C1=CN=CNC1=O Amb19115311 [0,1,0,0,0,0|2,0,0]=3 1874 B12R1.308 CCOC(=O)C1=CNC=CC1=O Amb22522165 [0,1,0,0,0,0|1,0,0]=2 1875 B12R1.308 CCOC(=O)C1=CNNC=C1O Amb22552574 [0,1,0,0,0,0|2,0,0]=3 1876 B12R1.308 CCOC(=O)C1=COC=CC1=O Amb25066453 [0,1,0,0,0,0|1,0,0]=2 1877 B12R1.308 CCOC(=O)C1C=NC=NC1=O Amb22271310 [0,1,0,0,0,0|2,0,1]=4 1878 B12R1.308 CCOC(=O)C1CC=CCC1=O Amb24413617 [0,1,0,0,0,0|0,0,3]=4 1879 B12R1.308 CCOC(=O)N1CCC=CC1=O Amb22500511 [0,1,0,0,0,0|1,0,2]=4 1880 B12R1.308 CCOC(=O)c1[n][n]c[n]c1Cl Amb25760159 [0,1,0,0,0,0|3,0,0]=4 1881 B12R1.308 CCOC(=O)c1[n][n]c[n]c1N Amb24060435 [0,1,0,0,0,0|3,0,0]=4 1882 B12R1.308 CCOC(=O)c1[n][n]ccc1N Amb24062286 [0,1,0,0,0,0|2,0,0]=3 1883 B12R1.308 CCOC(=O)c1[n]c[n]cc1Br Amb22304687 [0,1,0,0,0,0|2,0,0]=3 1884 B12R1.308 CCOC(=O)c1[n]c[n]cc1Cl Amb24066535 [0,1,0,0,0,0|2,0,0]=3 1885 B12R1.308 CCOC(=O)c1[n]c[n]cc1F Amb25223619 [0,1,0,0,0,0|2,0,0]=3 1886 B12R1.308 CCOC(=O)c1[n]c[n]cc1N Amb18646707 [0,1,0,0,0,0|2,0,0]=3 1887 B12R1.308 CCOC(=O)c1[n]cc[n]c1Br Amb23400030 [0,1,0,0,0,0|2,0,0]=3 1888 B12R1.308 CCOC(=O)c1[n]cc[n]c1Cl Amb21858220 [0,1,0,0,0,0|2,0,0]=3 1889 B12R1.308 CCOC(=O)c1[n]cc[n]c1N Amb18646711 [0,1,0,0,0,0|2,0,0]=3 1890 B12R1.308 CCOC(=O)c1[n]cccc1Br Amb22233846 [0,1,0,0,0,0|1,0,0]=2 1891 B12R1.308 CCOC(=O)c1[n]cccc1F Amb19895590 [0,1,0,0,0,0|1,0,0]=2 1892 B12R1.308 CCOC(=O)c1[n]cccc1I Amb22752609 [0,1,0,0,0,0|1,0,0]=2 1893 B12R1.308 CCOC(=O)c1[n]cccc1O Amb22263028 [0,1,0,0,0,0|1,0,0]=2 1894 B12R1.308 CCOC(=O)c1c[n][n]cc1N Amb18646709 [0,1,0,0,0,0|2,0,0]=3 1895 B12R1.308 CCOC(=O)c1c[n]c[n]c1Br Amb25311643 [0,1,0,0,0,0|2,0,0]=3 1896 B12R1.308 CCOC(=O)c1c[n]c[n]c1F Amb25364409 [0,1,0,0,0,0|2,0,0]=3 1897 B12R1.308 CCOC(=O)c1c[n]c[n]c1O Amb19889858 [0,1,0,0,0,0|2,0,0]=3 1898 B12R1.308 CCOC(=O)c1c[n]cc[n+]1[O-] Amb24427127 [0,1,0,0,0,0|2,0,0]=3 1899 B12R1.308 CCOC(=O)c1c[n]ccc1I Amb24518710 [0,1,0,0,0,0|1,0,0]=2 1900 B12R1.308 CCOC(=O)c1c[n]ccc1N Amb20620300 [0,1,0,0,0,0|1,0,0]=2 1901 B12R1.308 CCOC(=O)c1cc[n][n]c1N Amb22499550 [0,1,0,0,0,0|2,0,0]=3 1902 B12R1.308 CCOC(=O)c1cc[n]cc1Cl Amb22730548 [0,1,0,0,0,0|1,0,0]=2 1903 B12R1.308 CCOC(=O)c1cc[n]cc1I Amb24350555 [0,1,0,0,0,0|1,0,0]=2 1904 B12R1.308 CCOC(=O)c1ccc[n]c1F Amb22233852 [0,1,0,0,0,0|1,0,0]=2 1905 B12R1.308 CCOC(=O)c1cccc[n+]1[O-] Amb21961772 [0,1,0,0,0,0|1,0,0]=2 1906 B12R1.308 CCOC(=O)c1ccccc1N Amb1229845 [0,1,0,0,0,0|0,0,0]=1 1907 B12R1.308 CCOC(=O)c1ccccc1S Amb16232237 [0,1,0,0,0,0|0,0,0]=1 1908 B12R1.308 CCOC(=O)c1cccnc1S Amb1130764 [0,1,0,0,0,0|1,0,0]=2 1909 B12R1.308 CCOC(=O)c1ccncc1Br Amb10606115 [0,1,0,0,0,0|1,0,0]=2 1910 B12R1.308 CCOC(=O)c1ccncc1F Amb13887029 [0,1,0,0,0,0|1,0,0]=2 1911 B12R1.308 CCOC(=O)c1ccnnc1Cl Amb17935804 [0,1,0,0,0,0|2,0,0]=3 1912 B12R1.308 CCOC(=O)c1ccnnc1O Amb17935805 [0,1,0,0,0,0|2,0,0]=3 1913 B12R1.308 CCOC(=O)c1cnccc1Br Amb16233313 [0,1,0,0,0,0|1,0,0]=2 1914 B12R1.308 CCOC(=O)c1cnccc1C Amb17843888 [0,1,0,0,0,0|1,0,0]=2 1915 B12R1.308 CCOC(=O)c1cnccc1Cl Amb10602708 [0,1,0,0,0,0|1,0,0]=2 1916 B12R1.308 CCOC(=O)c1cnccc1Cl Amb16230840 [0,1,0,0,0,0|1,0,0]=2 1917 B12R1.308 CCOC(=O)c1cncnc1C Amb10605132 [0,1,0,0,0,0|2,0,0]=3 1918 B12R1.308 CCOC(=O)c1cncnc1Cl Amb17935875 [0,1,0,0,0,0|2,0,0]=3 1919 B12R1.308 CCOC(=O)c1ncccc1Cl Amb10975716 [0,1,0,0,0,0|1,0,0]=2 1920 B12R1.308 CCOC(=S)c1ccccc1O Amb22230695 [0,1,0,0,0,0|0,1,0]=2 1921 B12R1.308 CCOC(C)c1ccccc1Cl Amb24061174 [0,1,0,0,0,0|1,0,1]=3 1922 B12R1.308 CCOC(C)c1ccccc1O Amb25667447 [0,1,0,0,0,0|1,0,1]=3 1923 B12R1.308 CCOP(=O)c1ccccc1O Amb21952130 [0,1,0,0,0,0|1,0,0]=2 1924 B12R1.308 CCSC(=O)c1ccccc1N Amb25685690 [0,1,0,0,0,0|0,1,0]=2 1925 B12R1.308 CCSC(=O)c1ccccc1O Amb20242722 [0,1,0,0,0,0|0,1,0]=2 1926 B12R1.308 CCSC(=S)c1ccccc1O Amb25759523 [0,1,0,0,0,0|0,2,0]=3 1927 B12R1.308 CCSC(C)c1ccccc1Br Amb24732685 [0,1,0,0,0,0|1,1,1]=4 1928 B12R1.308 CCSC(C)c1ccccc1O Amb18648671 [0,1,0,0,0,0|1,1,1]=4 1929 B12R1.308 CC\N=C(\F)/c1ccccc1O Amb25327906 [0,1,0,0,0,0|2,0,0]=3 1930 B12R1.308 CC\N=C(\N)/c1ccccc1O Amb25279414 [0,1,0,0,0,0|2,0,0]=3 1931 B12R1.308 CN(OCC)c1[n]cccc1Br Amb24550475 [0,1,0,0,0,0|3,0,0]=4 1932 B12R1.308 CN(OCC)c1c[n]ccc1N Amb24610026 [0,1,0,0,0,0|3,0,0]=4 1933 B12R1.308 CN(OCC)c1cc[n]cc1N Amb24540241 [0,1,0,0,0,0|3,0,0]=4 1934 B12R1.308 CN(OCC)c1ccc[n]c1N Amb25314537 [0,1,0,0,0,0|3,0,0]=4 1935 B12R1.308 CN(OCC)c1ccccc1N Amb24760740 [0,1,0,0,0,0|2,0,0]=3 1936 B12R1.308 CNCC(=O)c1cc[n]cc1F Amb25076936 [0,1,0,0,0,0|3,0,0]=4 1937 B12R1.308 CNCC(=O)c1ccccc1Br Amb18160384 [0,1,0,0,0,0|2,0,0]=3 1938 B12R1.308 CNCC(=O)c1ccccc1Cl Amb18863065 [0,1,0,0,0,0|2,0,0]=3 1939 B12R1.308 CNCC(=O)c1ccccc1F Amb18862705 [0,1,0,0,0,0|2,0,0]=3 1940 B12R1.308 CNNC(=O)c1ccc[n]c1N Amb24425491 [0,1,0,0,0,0|3,0,0]=4 1941 B12R1.308 CNNC(=O)c1ccccc1N Amb18646316 [0,1,0,0,0,0|2,0,0]=3 1942 B12R1.308 CNNC(=S)c1ccccc1O Amb25286654 [0,1,0,0,0,0|2,1,0]=4 1943 B12R1.308 CN\N=C(\N)/c1ccccc1N Amb24427653 [0,1,0,0,0,0|3,0,0]=4 1944 B12R1.308 COCC(=O)c1[n]cccc1Br Amb25101213 [0,1,0,0,0,0|3,0,0]=4 1945 B12R1.308 COCC(=O)c1[n]cccc1Cl Amb25720688 [0,1,0,0,0,0|3,0,0]=4 1946 B12R1.308 COCC(=O)c1[n]cccc1N Amb24446676 [0,1,0,0,0,0|3,0,0]=4 1947 B12R1.308 COCC(=O)c1cc[n]cc1Cl Amb24350742 [0,1,0,0,0,0|3,0,0]=4 1948 B12R1.308 COCC(=O)c1ccc[n]c1Br Amb25123759 [0,1,0,0,0,0|3,0,0]=4 1949 B12R1.308 COCC(=O)c1ccc[n]c1F Amb25669427 [0,1,0,0,0,0|3,0,0]=4 1950 B12R1.308 COCC(=O)c1ccccc1N Amb24449095 [0,1,0,0,0,0|2,0,0]=3 1951 B12R1.308 COCS(=O)c1ccccc1F Amb24603777 [0,1,0,0,0,0|3,0,0]=4 1952 B12R1.308 CONC(=O)C1=CNC=CC1=O Amb25062191 [0,1,0,0,0,0|3,0,0]=4 1953 B12R1.308 CONC(=O)c1[n]cccc1N Amb25132207 [0,1,0,0,0,0|3,0,0]=4 1954 B12R1.308 CONC(=O)c1cc[n]cc1I Amb25344548 [0,1,0,0,0,0|3,0,0]=4 1955 B12R1.308 CONC(=O)c1ccc[n]c1Br Amb24556520 [0,1,0,0,0,0|3,0,0]=4 1956 B12R1.308 CONC(=O)c1ccc[n]c1F Amb25370946 [0,1,0,0,0,0|3,0,0]=4 1957 B12R1.308 CONC(=O)c1ccc[n]c1O Amb24473764 [0,1,0,0,0,0|3,0,0]=4 1958 B12R1.308 CONC(=O)c1cccc[n+]1[O-] Amb25802619 [0,1,0,0,0,0|3,0,0]=4 1959 B12R1.308 CONC(=O)c1ccccc1Br Amb16072950 [0,1,0,0,0,0|2,0,0]=3 1960 B12R1.308 CONC(=O)c1ccccc1C Amb16969914 [0,1,0,0,0,0|2,0,0]=3 1961 B12R1.308 CONC(=O)c1ccccc1Cl Amb16980468 [0,1,0,0,0,0|2,0,0]=3 1962 B12R1.308 CONC(=O)c1ccccc1F Amb16980460 [0,1,0,0,0,0|2,0,0]=3 1963 B12R1.308 CONC(=O)c1ccccc1I Amb16072969 [0,1,0,0,0,0|2,0,0]=3 1964 B12R1.308 CO\N=C(/N)\c1ccccc1Br Amb18227754 [0,1,0,0,0,0|3,0,0]=4 1965 B12R1.308 CO\N=C(/N)\c1ccccc1Cl Amb18863109 [0,1,0,0,0,0|3,0,0]=4 1966 B12R1.308 CO\N=C(/N)\c1ccccc1F Amb18862744 [0,1,0,0,0,0|3,0,0]=4 1967 B12R1.308 CSCC(=O)c1ccc[n]c1N Amb24483355 [0,1,0,0,0,0|3,0,0]=4 1968 B12R1.308 CSCC(=O)c1ccccc1Cl Amb18320104 [0,1,0,0,0,0|2,0,0]=3 1969 B12R1.308 CSCC(=O)c1ccccc1F Amb19057447 [0,1,0,0,0,0|2,0,0]=3 1970 B12R1.308 CSCC(=O)c1ccccc1O Amb18648632 [0,1,0,0,0,0|2,0,0]=3 1971 B12R1.308 C\C(=C/CC)\c1ccccc1N Amb24347670 [0,1,0,0,0,0|2,0,0]=3 1972 B12R1.308 C\C(=C/CO)\c1ccccc1Br Amb24438353 [0,1,0,0,0,0|3,0,0]=4 1973 B12R1.308 C\C(=C\CC)\c1ccccc1N Amb25274437 [0,1,0,0,0,0|2,0,0]=3 1974 B12R1.308 C\C(=C\CN)\c1ccccc1Br Amb25346828 [0,1,0,0,0,0|3,0,0]=4 1975 B12R1.308 C\C(=C\CN)\c1ccccc1Cl Amb25713357 [0,1,0,0,0,0|3,0,0]=4 1976 B12R1.308 C\C(=C\CO)\c1ccccc1Br Amb24623710 [0,1,0,0,0,0|3,0,0]=4 1977 B12R1.308 C\C(=C\CO)\c1ccccc1Cl Amb25209579 [0,1,0,0,0,0|3,0,0]=4 1978 B12R1.308 C\C(=C\CO)\c1ccccc1F Amb24420735 [0,1,0,0,0,0|3,0,0]=4 1979 B12R1.308 C\C(=C\CO)\c1ccccc1O Amb18646033 [0,1,0,0,0,0|3,0,0]=4 1980 B12R1.308 C\C(=N/OC)\c1ccccc1N Amb25039197 [0,1,0,0,0,0|3,0,0]=4 1981 B12R1.308 C\C(=N\CC)\c1ccccc1O Amb24690698 [0,1,0,0,0,0|2,0,0]=3 1982 B12R1.308 C\C(=N\NC)\c1ccccc1Br Amb24720451 [0,1,0,0,0,0|3,0,0]=4 1983 B12R1.308 C\C(=N\NC)\c1ccccc1Cl Amb25066007 [0,1,0,0,0,0|3,0,0]=4 1984 B12R1.308 C\C(=N\NC)\c1ccccc1F Amb25369241 [0,1,0,0,0,0|3,0,0]=4 1985 B12R1.308 C\C(=N\OC)\c1ccccc1F Amb25681905 [0,1,0,0,0,0|3,0,0]=4 1986 B12R1.308 C\C(=N\OC)\c1ccccc1I Amb25284182 [0,1,0,0,0,0|3,0,0]=4 1987 B12R1.308 C\C(=N\OC)\c1ccccc1O Amb25080780 [0,1,0,0,0,0|3,0,0]=4 1988 B12R1.308 C\C(\NCC)=C\1/C=CC=CC1=O Amb25294420 [0,1,0,0,0,0|2,0,0]=3 1989 B12R1.308 C\C=C\C(=O)c1cc[n]cc1F Amb24454435 [0,1,0,0,0,0|2,0,1]=4 1990 B12R1.308 C\C=C\C(=O)c1ccccc1Br Amb24553093 [0,1,0,0,0,0|1,0,1]=3 1991 B12R1.308 C\C=C\C(=O)c1ccccc1Cl Amb25816329 [0,1,0,0,0,0|1,0,1]=3 1992 B12R1.308 C\C=C\C(=O)c1ccccc1F Amb24584448 [0,1,0,0,0,0|1,0,1]=3 1993 B12R1.308 C\C=C\C(=O)c1ccccc1O Amb18645634 [0,1,0,0,0,0|1,0,1]=3 1994 B12R1.308 C\C=N\C(=O)c1ccccc1O Amb25328850 [0,1,0,0,0,0|1,0,1]=3 1995 B12R1.308 Cc1[n][n]ccc1C(=O)NCC Amb25343500 [0,1,0,0,0,0|3,0,0]=4 1996 B12R1.308 Cc1[n][n]ccc1C(=O)OCC Amb22002136 [0,1,0,0,0,0|2,0,0]=3 1997 B12R1.308 Cc1[n]c[n][n]c1C(=O)OCC Amb25144034 [0,1,0,0,0,0|3,0,0]=4 1998 B12R1.308 Cc1[n]c[n]cc1C(=N)OCC Amb25292597 [0,1,0,0,0,0|3,0,0]=4 1999 B12R1.308 Cc1[n]c[n]cc1C(=O)NCC Amb25215572 [0,1,0,0,0,0|3,0,0]=4 2000 B12R1.308 Cc1[n]cc[n]c1C(=O)OCC Amb22284851 [0,1,0,0,0,0|2,0,0]=3 2001 B12R1.308 Cc1[n]cccc1C(=O)NCC Amb25071732 [0,1,0,0,0,0|2,0,0]=3 2002 B12R1.308 Cc1[n]cccc1C(=O)NOC Amb24537848 [0,1,0,0,0,0|3,0,0]=4 2003 B12R1.308 Cc1c[n][n]cc1C(=O)OCC Amb22284840 [0,1,0,0,0,0|2,0,0]=3 2004 B12R1.308 Cc1c[n]c[n]c1C(=O)OCC Amb24099654 [0,1,0,0,0,0|2,0,0]=3 2005 B12R1.308 Cc1c[n]ccc1C(=O)CCC Amb25250613 [0,1,0,0,0,0|2,0,0]=3 2006 B12R1.308 Cc1c[n]ccc1C(=O)OCC Amb20622211 [0,1,0,0,0,0|1,0,0]=2 2007 B12R1.308 Cc1cc[n][n]c1C(=O)OCC Amb24062287 [0,1,0,0,0,0|2,0,0]=3 2008 B12R1.308 Cc1cc[n]cc1C(=C)OCC Amb19958591 [0,1,0,0,0,0|2,0,0]=3 2009 B12R1.308 Cc1cc[n]cc1C(=N)NCC Amb24703355 [0,1,0,0,0,0|3,0,0]=4 2010 B12R1.308 Cc1cc[n]cc1C(=N)OCC Amb25797920 [0,1,0,0,0,0|2,0,0]=3 2011 B12R1.308 Cc1cc[n]cc1C(=O)CCC Amb25751729 [0,1,0,0,0,0|2,0,0]=3 2012 B12R1.308 Cc1cc[n]cc1C(=O)CCN Amb24524737 [0,1,0,0,0,0|3,0,0]=4 2013 B12R1.308 Cc1cc[n]cc1C(=O)NCC Amb25300412 [0,1,0,0,0,0|2,0,0]=3 2014 B12R1.308 Cc1cc[n]cc1C(=O)OCC Amb22295938 [0,1,0,0,0,0|1,0,0]=2 2015 B12R1.308 Cc1ccc[n]c1C(=N)NCC Amb24483601 [0,1,0,0,0,0|3,0,0]=4 2016 B12R1.308 Cc1ccc[n]c1C(=O)CCC Amb18798195 [0,1,0,0,0,0|2,0,0]=3 2017 B12R1.308 Cc1ccc[n]c1C(=O)COC Amb24605568 [0,1,0,0,0,0|3,0,0]=4 2018 B12R1.308 Cc1ccc[n]c1C(=O)OCC Amb18798397 [0,1,0,0,0,0|1,0,0]=2 2019 B12R1.308 Cc1ccccc1C(=N)OCC Amb18792487 [0,1,0,0,0,0|1,0,0]=2 2020 B12R1.308 Cc1ccccc1C(=O)C#CC Amb25767754 [0,1,0,0,0,0|1,0,1]=3 2021 B12R1.308 Cc1ccccc1C(=O)C=C=C Amb24364060 [0,1,0,0,0,0|1,0,2]=4 2022 B12R1.308 Cc1ccccc1C(=O)C=[N+]=[N-] Amb24644060 [0,1,0,0,0,0|3,0,0]=4 2023 B12R1.308 Cc1ccccc1C(=O)CC#C Amb18799926 [0,1,0,0,0,0|1,0,2]=4 2024 B12R1.308 Cc1ccccc1C(=O)CCN Amb25062867 [0,1,0,0,0,0|2,0,0]=3 2025 B12R1.308 Cc1ccccc1C(=O)CNC Amb18862585 [0,1,0,0,0,0|2,0,0]=3 2026 B12R1.308 Cc1ccccc1C(=O)CSC Amb18796321 [0,1,0,0,0,0|2,0,0]=3 2027 B12R1.308 Cc1ccccc1C(=O)\C=C\C Amb24360336 [0,1,0,0,0,0|1,0,1]=3 2028 B12R1.308 Cc1ccccc1C(=O)\C=C\Cl Amb25151142 [0,1,0,0,0,0|2,0,1]=4 2029 B12R1.308 Cc1ccccc1C(=O)\C=N\O Amb24706809 [0,1,0,0,0,0|3,0,0]=4 2030 B12R1.308 Cc1ccccc1C(C)SCC Amb25157280 [0,1,0,0,0,0|1,1,1]=4 2031 B12R1.308 Cc1ccccc1C(Cl)CCC Amb25157873 [0,1,0,0,0,0|2,0,1]=4 2032 B12R1.308 Cc1ccccc1S(=O)CCN Amb18974524 [0,1,0,0,0,0|3,0,0]=4 2033 B12R1.308 Cc1ccccc1[C@@H](N)CCC Amb22298562 [0,1,0,0,0,0|2,0,1]=4 2034 B12R1.308 Cc1ccccc1[C@H](C)NCC Amb24361005 [0,1,0,0,0,0|2,0,1]=4 2035 B12R1.308 Cc1ccccc1[C@H](N)CCC Amb22298519 [0,1,0,0,0,0|2,0,1]=4 2036 B12R1.308 Cc1ccccc1\C(\N)=N\OC Amb18862601 [0,1,0,0,0,0|3,0,0]=4 2037 B12R1.308 FCCC(=O)c1ccccc1Br Amb16231892 [0,1,0,0,0,0|2,0,0]=3 2038 B12R1.308 N#CCC(=O)c1ccccc1O Amb10071607 [0,1,0,0,0,0|2,0,1]=4 2039 B12R1.308 N#CNC(=O)c1ccccc1Br Amb25761710 [0,1,0,0,0,0|2,0,1]=4 2040 B12R1.308 N#CNC(=O)c1ccccc1F Amb24745052 [0,1,0,0,0,0|2,0,1]=4 2041 B12R1.308 N#CNC(=O)c1ccccc1O Amb24641335 [0,1,0,0,0,0|2,0,1]=4 2042 B12R1.308 N#CNC(=O)c1ccccc1S Amb25784069 [0,1,0,0,0,0|2,0,1]=4 2043 B12R1.308 NCCC(=O)c1cc[n]cc1F Amb24550937 [0,1,0,0,0,0|3,0,0]=4 2044 B12R1.308 NCCC(=O)c1ccccc1Cl Amb25709180 [0,1,0,0,0,0|2,0,0]=3 2045 B12R1.308 NCCC(=O)c1ccccc1O Amb24346596 [0,1,0,0,0,0|2,0,0]=3 2046 B12R1.308 NCCS(=O)c1ccccc1Br Amb18290922 [0,1,0,0,0,0|3,0,0]=4 2047 B12R1.308 NCCS(=O)c1ccccc1Cl Amb18290916 [0,1,0,0,0,0|3,0,0]=4 2048 B12R1.308 NCCS(=O)c1ccccc1F Amb18974522 [0,1,0,0,0,0|3,0,0]=4 2049 B12R1.308 NCCS(=O)c1ccccc1F Amb19373859 [0,1,0,0,0,0|3,0,0]=4 2050 B12R1.308 Nc1[n]cccc1C(=O)CCN Amb25789362 [0,1,0,0,0,0|3,0,0]=4 2051 B12R1.308 Nc1ccccc1C(=O)CC=O Amb25299151 [0,1,0,0,0,0|2,0,1]=4 2052 B12R1.308 Nc1ccccc1C(=O)CCN Amb21855941 [0,1,0,0,0,0|2,0,0]=3 2053 B12R1.308 Nc1ccccc1C(=O)CCN Amb22350218 [0,1,0,0,0,0|2,0,0]=3 2054 B12R1.308 Nc1ccccc1S(=O)CCF Amb25337402 [0,1,0,0,0,0|3,0,0]=4 2055 B12R1.308 Nc1ccccc1S(=O)CCO Amb25299207 [0,1,0,0,0,0|3,0,0]=4 2056 B12R1.308 O=C(CCBr)c1ccccc1Br Amb24695292 [0,1,0,0,0,0|2,0,0]=3 2057 B12R1.308 O=C(CCBr)c1ccccc1I Amb24696334 [0,1,0,0,0,0|2,0,0]=3 2058 B12R1.308 O=C(CCCl)c1ccccc1Br Amb25377082 [0,1,0,0,0,0|2,0,0]=3 2059 B12R1.308 O=C(CCCl)c1ccccc1Cl Amb22229247 [0,1,0,0,0,0|2,0,0]=3 2060 B12R1.308 O=C(CCCl)c1ccccc1I Amb25796603 [0,1,0,0,0,0|2,0,0]=3 2061 B12R1.308 O=C(\C=C\Cl)c1ccccc1F Amb25240661 [0,1,0,0,0,0|2,0,1]=4 2062 B12R1.308 O=C=NC(=O)c1ccccc1Br Amb17247240 [0,1,0,0,0,0|2,0,1]=4 2063 B12R1.308 O=C=NC(=O)c1ccccc1C Amb17232351 [0,1,0,0,0,0|2,0,1]=4 2064 B12R1.308 O=C=NC(=O)c1ccccc1Cl Amb17233863 [0,1,0,0,0,0|2,0,1]=4 2065 B12R1.308 O=C=NC(=O)c1ccccc1F Amb17232511 [0,1,0,0,0,0|2,0,1]=4 2066 B12R1.308 O=CNC(=O)c1ccccc1O Amb17621622 [0,1,0,0,0,0|2,0,1]=4 2067 B12R1.308 O=S(CCF)c1ccccc1F Amb25374903 [0,1,0,0,0,0|3,0,0]=4 2068 B12R1.308 OCCC(=O)c1ccccc1F Amb25159895 [0,1,0,0,0,0|2,0,0]=3 2069 B12R1.308 O\N=C\C(=O)c1ccccc1Br Amb24400242 [0,1,0,0,0,0|3,0,0]=4 2070 B12R1.308 O\N=C\C(=O)c1ccccc1Cl Amb24349760 [0,1,0,0,0,0|3,0,0]=4 2071 B12R1.308 Oc1ccccc1C(=O)CC=O Amb18645953 [0,1,0,0,0,0|2,0,1]=4 2072 B12R1.308 Oc1ccccc1C(=O)O[SiH2]O Amb24422475 [0,1,0,0,0,0|1,1,0]=3 2073 B12R1.308 Oc1ccccc1C(=O)\C=C/O Amb25712234 [0,1,0,0,0,0|2,0,1]=4 2074 B12R1.308 Oc1ccccc1C(=O)\C=C\O Amb24617224 [0,1,0,0,0,0|2,0,1]=4 2075 B12R1.308 Oc1ccccc1C(=O)\C=N\O Amb25730162 [0,1,0,0,0,0|3,0,0]=4 2076 B12R1.308 Oc1ccccc1\C(\Cl)=C/CO Amb24655131 [0,1,0,0,0,0|3,0,0]=4 2077 B12R1.308 [N-]=[N+]=CC(=O)c1ccccc1F Amb24497496 [0,1,0,0,0,0|3,0,0]=4 2078 B12R1.308 [N-]=[N+]=NC(=O)c1ccccc1S Amb25159419 [0,1,0,0,0,0|3,0,0]=4 2079 B12R1.308 [O-]\C=C\C(=O)c1ccccc1Br Amb24623983 [0,1,0,0,0,0|2,0,1]=4 2080 B10R0.1 CCOC(=O)C#C\C=C/C=O Amb25258835 [0,0,1,0,0,0|1,0,2]=4 2081 B10R0.1 CCOC(=O)C#C\C=C\C=O Amb24656033 [0,0,1,0,0,0|1,0,2]=4 2082 B10R0.1 CCOC(=O)C\C=C\NC=O Amb24766193 [0,0,1,0,0,0|2,0,1]=4 2083 B10R0.1 C\C=C\C=C\NC(=O)OCC Amb24383177 [0,0,1,0,0,0|1,0,1]=3 2084 B10R0.19 CCOC(=O)C(=O)NCC=C Amb10879992 [0,0,1,0,0,0|2,0,1]=4 2085 B10R0.19 CCOC(=O)C(=O)\C=C/NC Amb25386150 [0,0,1,0,0,0|2,0,1]=4 2086 B10R0.33 CCOC(=O)C(=CC=O)C#C Amb25385664 [0,0,1,0,0,0|1,0,2]=4 2087 B10R0.33 CCOC(=O)C(=CO)NC=O Amb24640164 [0,0,1,0,0,0|3,0,0]=4 2088 B10R0.33 CCOC(=O)\C(=C/O)\NC=O Amb22055322 [0,0,1,0,0,0|3,0,0]=4 2089 B10R0.33 CCOC(=O)\C(=C\C=O)\C#C Amb25384404 [0,0,1,0,0,0|1,0,2]=4 2090 B10R0.33 CCO[13C](=O)\[13C](=C/O)\NC=O Amb22055323 [0,0,1,0,0,0|3,0,0]=4 2091 B10R0.33 C\C=C(/NC=O)\C(=O)OCC Amb25800136 [0,0,1,0,0,0|2,0,1]=4 2092 B12R2.2 C1CC=C(N1)c2ccccc2 Amb17938860 [0,0,0,1,0,0|2,0,0]=3 2093 B12R2.2 C1CCC(O1)c2cccc[n]2 Amb24729132 [0,0,0,1,0,0|2,0,1]=4 2094 B12R2.2 C1CCC(S1)c2ccccc2 Amb25801021 [0,0,0,1,0,0|1,1,1]=4 2095 B12R2.2 C1CCC=C1c2c[n]ccc2 Amb25357774 [0,0,0,1,0,0|3,0,0]=4 2096 B12R2.2 C1CCC=C1c2cccc[n]2 Amb24563508 [0,0,0,1,0,0|3,0,0]=4 2097 B12R2.2 C1CCCB1c2ccccc2 Amb25240096 [0,0,0,1,0,0|3,0,0]=4 2098 B12R2.2 C1CCN=C1c2c[n]ccc2 Amb21917062 [0,0,0,1,0,0|3,0,0]=4 2099 B12R2.2 C1CC[C@@H](N1)c2ccccc2 Amb20241932 [0,0,0,1,0,0|2,0,1]=4 2100 B12R2.2 C1CC[C@H](N1)c2ccccc2 Amb20241933 [0,0,0,1,0,0|2,0,1]=4 2101 B12R2.2 C1CC[S+](C1)c2ccccc2 Amb10576181 [0,0,0,1,0,0|3,0,0]=4 2102 B12R2.2 C1CC[S+](C1)c2ccccc2 Amb2447150 [0,0,0,1,0,0|3,0,0]=4 2103 B12R2.2 C1CN=C(N1)c2ccccn2 Amb17836205 [0,0,0,1,0,0|3,0,0]=4 2104 B12R2.2 C1CNC(C1)c2ccccc2 Amb10808365 [0,0,0,1,0,0|2,0,1]=4 2105 B12R2.2 C1CNC(C1)c2ccccc2 Amb1106311 [0,0,0,1,0,0|2,0,1]=4 2106 B12R2.2 C1CNN=C1c2ccccc2 Amb25354740 [0,0,0,1,0,0|3,0,0]=4 2107 B12R2.2 C1COB(O1)c2c[n]ccc2 Amb25103771 [0,0,0,1,0,0|2,0,1]=4 2108 B12R2.2 C1COB(O1)c2cccc[n]2 Amb22490930 [0,0,0,1,0,0|2,0,1]=4 2109 B12R2.2 C1COC(=C1)c2cccc[n]2 Amb25358340 [0,0,0,1,0,0|2,0,0]=3 2110 B12R2.2 C1COC(=N1)c2cccc[n]2 Amb24100586 [0,0,0,1,0,0|2,0,0]=3 2111 B12R2.2 C1COC(=N1)c2ccccc2 Amb18063911 [0,0,0,1,0,0|1,0,0]=2 2112 B12R2.2 C1COC(C1)c2ccccc2 Amb17334283 [0,0,0,1,0,0|1,0,1]=3 2113 B12R2.2 C1COC(N1)c2ccccc2 Amb17334284 [0,0,0,1,0,0|1,0,1]=3 2114 B12R2.2 C1COC(N1)c2ccccn2 Amb17334298 [0,0,0,1,0,0|2,0,1]=4 2115 B12R2.2 C1COC(N1)c2cccnc2 Amb17334299 [0,0,0,1,0,0|2,0,1]=4 2116 B12R2.2 C1COC(N1)c2ccncc2 Amb17334300 [0,0,0,1,0,0|2,0,1]=4 2117 B12R2.2 C1COC(O1)c2ccccn2 Amb17334307 [0,0,0,1,0,0|1,0,2]=4 2118 B12R2.2 C1COC(O1)c2cccnc2 Amb17334308 [0,0,0,1,0,0|1,0,2]=4 2119 B12R2.2 C1COC(O1)c2ccncc2 Amb17334309 [0,0,0,1,0,0|1,0,2]=4 2120 B12R2.2 C1CSC(=N1)c2ccc[n]c2 Amb24097262 [0,0,0,1,0,0|2,1,0]=4 2121 B12R2.2 C1CSC(S1)c2ccccc2 Amb23401446 [0,0,0,1,0,0|0,2,1]=4 2122 B12R2.2 C1NCC(O1)c2ccccc2 Amb18065307 [0,0,0,1,0,0|2,0,1]=4 2123 B12R2.2 C1NCC=C1c2ccccc2 Amb22059494 [0,0,0,1,0,0|3,0,0]=4 2124 B12R2.2 C1OCOC1c2ccccc2 Amb24101078 [0,0,0,1,0,0|2,0,1]=4 2125 B12R2.2 c1ccc(cc1)C2=NCCC2 Amb1106418 [0,0,0,1,0,0|2,0,0]=3 2126 B12R2.2 c1ccc(cc1)C2=NCCS2 Amb10572887 [0,0,0,1,0,0|1,1,0]=3 2127 B12R2.2 c1ccc(cc1)c2ccno2 Amb2191136 [0,0,0,1,0,0|2,0,1]=4 2128 B12R2.2 c1ccc(cc1)c2ncno2 Amb10552927 [0,0,0,1,0,0|2,0,1]=4 2129 B12R2.2 c1ccc(cn1)C2=NCCO2 Amb10813641 [0,0,0,1,0,0|2,0,0]=3 2130 B12R2.2 c1ccc(nc1)C2=NCCC2 Amb10606648 [0,0,0,1,0,0|3,0,0]=4 2131 B12R2.2 c1ccc(nc1)C2=NCCN2 Amb11014515 [0,0,0,1,0,0|3,0,0]=4 2132 B12R2.2 n1ccc(cc1)C2=NCCC2 Amb10605642 [0,0,0,1,0,0|3,0,0]=4 2133 B12R2.2 n1ccc(cc1)C2=NCCN2 Amb11014520 [0,0,0,1,0,0|3,0,0]=4 2134 B12R2.22 BrC1CC(=C1)c2ccccc2 Amb24669104 [0,0,0,1,0,0|3,0,0]=4 2135 B12R2.22 OC1CC(=C1)c2ccccc2 Amb25198298 [0,0,0,1,0,0|3,0,0]=4 2136 B12R2.27 OC[C@@H]1N=C1c2ccccc2 Amb25346057 [0,0,0,1,0,0|3,0,0]=4 2137 B12R2.27 OC[C@H]1N=C1c2ccccc2 Amb25848732 [0,0,0,1,0,0|3,0,0]=4 2138 B12R2.116 CC1(CCO1)c2ccccc2 Amb22497354 [0,0,0,1,0,0|1,0,1]=3 2139 B12R2.116 NC1(CCC1)c2ccccc2 Amb2371533 [0,0,0,1,0,0|2,0,1]=4 2140 B12R2.116 OC1(CCC1)c2ccccc2 Amb20668463 [0,0,0,1,0,0|1,0,2]=4 2141 B12R2.931 OCCC1=Cc2ccccc21 Amb24414369 [0,0,0,1,0,0|3,0,0]=4 2142 B12R2.1081 BrC1OCCc2ccccc21 Amb23441457 [0,0,0,1,0,0|1,0,1]=3 2143 B12R2.1081 C=C1CCCc2ccccc21 Amb25736652 [0,0,0,1,0,0|2,0,0]=3 2144 B12R2.1081 C=C1CCSc2ccccc21 Amb25088063 [0,0,0,1,0,0|3,0,0]=4 2145 B12R2.1081 C=C1COCc2ccccc21 Amb24486797 [0,0,0,1,0,0|3,0,0]=4 2146 B12R2.1081 C=C1NCCc2ccccc21 Amb24685452 [0,0,0,1,0,0|2,0,0]=3 2147 B12R2.1081 CC1=CCCc2c1cccc2 Amb2439915 [0,0,0,1,0,0|2,0,0]=3 2148 B12R2.1081 CC1=CCOc2ccccc21 Amb25694360 [0,0,0,1,0,0|3,0,0]=4 2149 B12R2.1081 CC1=COCc2ccccc21 Amb24436497 [0,0,0,1,0,0|3,0,0]=4 2150 B12R2.1081 CC1=NCCc2[n]cccc21 Amb22751775 [0,0,0,1,0,0|3,0,0]=4 2151 B12R2.1081 CC1=NCCc2ccccc12 Amb17940779 [0,0,0,1,0,0|2,0,0]=3 2152 B12R2.1081 CC1CCCc2ccccc21 Amb22730060 [0,0,0,1,0,0|2,0,1]=4 2153 B12R2.1081 CC1NCCc2ccccc21 Amb19514854 [0,0,0,1,0,0|2,0,1]=4 2154 B12R2.1081 CC1OCCc2ccccc21 Amb25773190 [0,0,0,1,0,0|1,0,1]=3 2155 B12R2.1081 CC1OCOc2ccccc21 Amb24070527 [0,0,0,1,0,0|2,0,1]=4 2156 B12R2.1081 CN1CCCc2c1cccc2 Amb15692645 [0,0,0,1,0,0|3,0,0]=4 2157 B12R2.1081 C[C@@H]1NCCc2ccccc21 Amb22751772 [0,0,0,1,0,0|2,0,1]=4 2158 B12R2.1081 C[C@@H]1NCCc2ccccc21 Amb22756655 [0,0,0,1,0,0|2,0,1]=4 2159 B12R2.1081 ClC1=NOCc2ccccc21 Amb25111999 [0,0,0,1,0,0|3,0,0]=4 2160 B12R2.1081 ClC1SCCc2ccccc21 Amb24634203 [0,0,0,1,0,0|1,1,1]=4 2161 B12R2.1081 FC1OCCc2ccccc21 Amb25073157 [0,0,0,1,0,0|1,0,1]=3 2162 B12R2.1081 IC1OCCc2ccccc21 Amb25309346 [0,0,0,1,0,0|1,0,1]=3 2163 B12R2.1081 NC1=NCCc2ccccc21 Amb18644285 [0,0,0,1,0,0|2,0,0]=3 2164 B12R2.1081 NC1=NCNc2ccccc21 Amb24099678 [0,0,0,1,0,0|3,0,0]=4 2165 B12R2.1081 NC1CCCc2c1cccc2 Amb1154594 [0,0,0,1,0,0|2,0,1]=4 2166 B12R2.1081 NC1CCCc2ccccc21 Amb24273096 [0,0,0,1,0,0|2,0,1]=4 2167 B12R2.1081 NC1NCCc2ccccc21 Amb22491370 [0,0,0,1,0,0|2,0,1]=4 2168 B12R2.1081 NC1NCCc2ccccc21 Amb25798402 [0,0,0,1,0,0|2,0,1]=4 2169 B12R2.1081 NC=1NCN=C2C=CC=CC21 Amb24748169 [0,0,0,1,0,0|3,0,0]=4 2170 B12R2.1081 N[C@@H]1CCCc2c1cccc2 Amb10844952 [0,0,0,1,0,0|2,0,1]=4 2171 B12R2.1081 N[C@@H]1CCCc2ccccc21 Amb22167169 [0,0,0,1,0,0|2,0,1]=4 2172 B12R2.1081 N[C@H]1CCCc2ccccc21 Amb19929634 [0,0,0,1,0,0|2,0,1]=4 2173 B12R2.1081 O=C1C=CCc2[n]cccc21 Amb24093726 [0,0,0,1,0,0|2,0,1]=4 2174 B12R2.1081 O=C1C=CCc2c1cccc2 Amb2388336 [0,0,0,1,0,0|1,0,1]=3 2175 B12R2.1081 O=C1C=CNc2ccccc21 Amb18369085 [0,0,0,1,0,0|2,0,1]=4 2176 B12R2.1081 O=C1C=COc2ccccc21 Amb19894749 [0,0,0,1,0,0|2,0,1]=4 2177 B12R2.1081 O=C1C=CSc2ccccc21 Amb22347337 [0,0,0,1,0,0|2,0,1]=4 2178 B12R2.1081 O=C1C=C[Se]c2ccccc21 Amb22551504 [0,0,0,1,0,0|2,0,1]=4 2179 B12R2.1081 O=C1C=NCc2ccccc21 Amb25717685 [0,0,0,1,0,0|2,0,0]=3 2180 B12R2.1081 O=C1C=NNc2ccccc21 Amb18528334 [0,0,0,1,0,0|3,0,0]=4 2181 B12R2.1081 O=C1C=NOc2ccccc21 Amb25713023 [0,0,0,1,0,0|3,0,0]=4 2182 B12R2.1081 O=C1CC=Nc2ccccc21 Amb24062843 [0,0,0,1,0,0|2,0,1]=4 2183 B12R2.1081 O=C1CCC[13c]2[13cH][13cH][13cH][13cH][13c]21 Amb22056230 [0,0,0,1,0,0|1,0,0]=2 2184 B12R2.1081 O=C1CCC[n+]2c1cccc2 Amb16191924 [0,0,0,1,0,0|2,0,0]=3 2185 B12R2.1081 O=C1CCCc2[n]c[n]cc21 Amb21965046 [0,0,0,1,0,0|3,0,0]=4 2186 B12R2.1081 O=C1CCCc2[n]cc[n]c21 Amb25152857 [0,0,0,1,0,0|3,0,0]=4 2187 B12R2.1081 O=C1CCCc2[n]cccc21 Amb19515604 [0,0,0,1,0,0|2,0,0]=3 2188 B12R2.1081 O=C1CCCc2c1ccnc2 Amb10603887 [0,0,0,1,0,0|2,0,0]=3 2189 B12R2.1081 O=C1CCCc2c[n][n]cc21 Amb25073452 [0,0,0,1,0,0|3,0,0]=4 2190 B12R2.1081 O=C1CCCc2c[n]c[n]c21 Amb24071793 [0,0,0,1,0,0|3,0,0]=4 2191 B12R2.1081 O=C1CCCc2c[n]ccc21 Amb20621086 [0,0,0,1,0,0|2,0,0]=3 2192 B12R2.1081 O=C1CCCc2cc[n]cc21 Amb19888360 [0,0,0,1,0,0|2,0,0]=3 2193 B12R2.1081 O=C1CCCc2cc[n]cc21 Amb22727966 [0,0,0,1,0,0|2,0,0]=3 2194 B12R2.1081 O=C1CCNc2c1cccc2 Amb10067080 [0,0,0,1,0,0|2,0,0]=3 2195 B12R2.1081 O=C1CCNc2c1cccn2 Amb16233465 [0,0,0,1,0,0|3,0,0]=4 2196 B12R2.1081 O=C1CCNc2c[n]ccc21 Amb24631913 [0,0,0,1,0,0|3,0,0]=4 2197 B12R2.1081 O=C1CCOc2[n]cccc21 Amb24061183 [0,0,0,1,0,0|3,0,0]=4 2198 B12R2.1081 O=C1CCOc2c1cccc2 Amb1153759 [0,0,0,1,0,0|2,0,0]=3 2199 B12R2.1081 O=C1CCOc2c1nccc2 Amb10602517 [0,0,0,1,0,0|3,0,0]=4 2200 B12R2.1081 O=C1CCOc2cc[n]cc21 Amb21857915 [0,0,0,1,0,0|3,0,0]=4 2201 B12R2.1081 O=C1CCSc2c1cccc2 Amb1151631 [0,0,0,1,0,0|2,0,0]=3 2202 B12R2.1081 O=C1CCSc2cc[n]cc21 Amb25318965 [0,0,0,1,0,0|3,0,0]=4 2203 B12R2.1081 O=C1CNCc2[n]cccc21 Amb18202251 [0,0,0,1,0,0|3,0,0]=4 2204 B12R2.1081 O=C1CNCc2ccccc21 Amb22494722 [0,0,0,1,0,0|2,0,0]=3 2205 B12R2.1081 O=C1CNNc2ccccc21 Amb22057606 [0,0,0,1,0,0|3,0,0]=4 2206 B12R2.1081 O=C1CNNc2ccccc21 Amb22494235 [0,0,0,1,0,0|3,0,0]=4 2207 B12R2.1081 O=C1CNOc2ccccc21 Amb25086617 [0,0,0,1,0,0|3,0,0]=4 2208 B12R2.1081 O=C1COCc2[n]cccc21 Amb25152848 [0,0,0,1,0,0|3,0,0]=4 2209 B12R2.1081 O=C1COCc2c1cccc2 Amb10067824 [0,0,0,1,0,0|2,0,0]=3 2210 B12R2.1081 O=C1CSCc2[n]cccc21 Amb24686412 [0,0,0,1,0,0|3,0,0]=4 2211 B12R2.1081 O=C1CSCc2ccc[n]c21 Amb24645382 [0,0,0,1,0,0|3,0,0]=4 2212 B12R2.1081 O=C1N=NNc2ccccc21 Amb19653630 [0,0,0,1,0,0|3,0,0]=4 2213 B12R2.1081 O=C1NC=Cc2ccccc21 Amb18364338 [0,0,0,1,0,0|1,0,2]=4 2214 B12R2.1081 O=C1NC=Nc2ccccc21 Amb18012662 [0,0,0,1,0,0|2,0,1]=4 2215 B12R2.1081 O=C1NCC[n+]2ccccc21 Amb23437947 [0,0,0,1,0,0|2,0,0]=3 2216 B12R2.1081 O=C1NCCc2[n]cccc21 Amb22002362 [0,0,0,1,0,0|2,0,0]=3 2217 B12R2.1081 O=C1NCCc2c1cccc2 Amb2502473 [0,0,0,1,0,0|1,0,0]=2 2218 B12R2.1081 O=C1NCCc2c[n]ccc21 Amb23455308 [0,0,0,1,0,0|2,0,0]=3 2219 B12R2.1081 O=C1NCCc2cc[n]cc21 Amb18202262 [0,0,0,1,0,0|2,0,0]=3 2220 B12R2.1081 O=C1NCCc2ccc[n]c21 Amb22234340 [0,0,0,1,0,0|2,0,0]=3 2221 B12R2.1081 O=C1NCNc2[n]cccc21 Amb24101585 [0,0,0,1,0,0|3,0,0]=4 2222 B12R2.1081 O=C1NCNc2cc[n]cc21 Amb24419756 [0,0,0,1,0,0|3,0,0]=4 2223 B12R2.1081 O=C1NCOc2ccccc21 Amb24104580 [0,0,0,1,0,0|2,0,0]=3 2224 B12R2.1081 O=C1NCSc2[n]cccc21 Amb24484828 [0,0,0,1,0,0|3,0,0]=4 2225 B12R2.1081 O=C1NN=Cc2ccccc21 Amb19338634 [0,0,0,1,0,0|2,0,1]=4 2226 B12R2.1081 O=C1NN=Nc2ccccc21 Amb17933278 [0,0,0,1,0,0|3,0,0]=4 2227 B12R2.1081 O=C1OC=Cc2ccc[n]c21 Amb19323216 [0,0,0,1,0,0|1,0,2]=4 2228 B12R2.1081 O=C1OC=Cc2ccccc21 Amb25189261 [0,0,0,1,0,0|0,0,2]=3 2229 B12R2.1081 O=C1OCCc2[n]cccc21 Amb25200934 [0,0,0,1,0,0|1,0,0]=2 2230 B12R2.1081 O=C1OCCc2c1cccc2 Amb16232507 [0,0,0,1,0,0|0,0,0]=1 2231 B12R2.1081 O=C1OCCc2cc[n]cc21 Amb22372215 [0,0,0,1,0,0|1,0,0]=2 2232 B12R2.1081 O=C1OCOc2ccccc21 Amb24066081 [0,0,0,1,0,0|1,0,0]=2 2233 B12R2.1081 O=C1OS[PbH2]c2ccccc21 Amb22347227 [0,0,0,1,0,0|2,0,0]=3 2234 B12R2.1081 O=C1SCCc2ccccc21 Amb24484481 [0,0,0,1,0,0|0,1,0]=2 2235 B12R2.1081 O=S1CCNc2c1cccc2 Amb1106281 [0,0,0,1,0,0|3,0,0]=4 2236 B12R2.1081 O=c1[nH]ccc2c1cccc2 Amb1152413 [0,0,0,1,0,0|1,0,2]=4 2237 B12R2.1081 O=c1[nH]ncc2c1cccc2 Amb1149649 [0,0,0,1,0,0|2,0,1]=4 2238 B12R2.1081 O=c1oc[n]c2[n]cccc21 Amb24079515 [0,0,0,1,0,0|2,0,1]=4 2239 B12R2.1081 O=c1occc2c[n]ccc21 Amb24089103 [0,0,0,1,0,0|1,0,2]=4 2240 B12R2.1081 OB1OCCc2c1cccc2 Amb10070693 [0,0,0,1,0,0|1,0,1]=3 2241 B12R2.1081 OC1=COCc2c1cccc2 Amb10603427 [0,0,0,1,0,0|2,0,1]=4 2242 B12R2.1081 OC1CCCc2c1cccc2 Amb1151324 [0,0,0,1,0,0|1,0,2]=4 2243 B12R2.1081 ON1CCCc2ccccc12 Amb24085481 [0,0,0,1,0,0|2,0,1]=4 2244 B12R2.1081 O[C@@H]1CCCc2ccccc21 Amb22337827 [0,0,0,1,0,0|1,0,2]=4 2245 B12R2.1081 O[C@H]1CCCc2ccccc21 Amb22336192 [0,0,0,1,0,0|1,0,2]=4 2246 B12R2.1081 [NH3+]C1CCCc2ccccc21 Amb24113843 [0,0,0,1,0,0|2,0,1]=4 2247 B12R2.1313 O=C1NC(=O)c2ccc1cc2 Amb24441648 [0,0,0,1,0,0|2,0,1]=4 2248 B12R2.2028 C=C1CC(Cl)c2ccccc21 Amb24513606 [0,0,0,1,0,0|3,0,0]=4 2249 B12R2.2028 C=C1C[C@@H](O)c2ccccc21 Amb25149657 [0,0,0,1,0,0|3,0,0]=4 2250 B12R2.2028 C=C1NC(=O)c2ccccc21 Amb20671447 [0,0,0,1,0,0|1,0,2]=4 2251 B12R2.2028 C=C1OC(=O)c2ccccc21 Amb22229358 [0,0,0,1,0,0|0,0,2]=3 2252 B12R2.2028 CC1=CC(C)c2ccccc12 Amb24641446 [0,0,0,1,0,0|2,0,0]=3 2253 B12R2.2028 CC1=CC(O)c2ccccc12 Amb17778893 [0,0,0,1,0,0|3,0,0]=4 2254 B12R2.2028 CC1=C[C@@H](Br)c2ccccc21 Amb25827191 [0,0,0,1,0,0|3,0,0]=4 2255 B12R2.2028 CC1=NC(C)c2ccccc12 Amb25223537 [0,0,0,1,0,0|2,0,0]=3 2256 B12R2.2028 CC1C=C(Cl)c2ccccc12 Amb17778911 [0,0,0,1,0,0|2,0,0]=3 2257 B12R2.2028 CC1C=C(O)c2cc[n]cc21 Amb24092212 [0,0,0,1,0,0|2,0,1]=4 2258 B12R2.2028 CC1CC(=O)c2cc[n]cc21 Amb24071420 [0,0,0,1,0,0|2,0,0]=3 2259 B12R2.2028 CC1CC(Br)c2ccccc21 Amb25131825 [0,0,0,1,0,0|2,0,1]=4 2260 B12R2.2028 CC1CC(N)c2ccccc21 Amb19373084 [0,0,0,1,0,0|2,0,1]=4 2261 B12R2.2028 CC1CC(O)c2ccccc21 Amb25709313 [0,0,0,1,0,0|1,0,2]=4 2262 B12R2.2028 CC1CC(S)c2ccccc21 Amb24465175 [0,0,0,1,0,0|1,1,1]=4 2263 B12R2.2028 CC1CN(N)c2ccccc21 Amb24519067 [0,0,0,1,0,0|3,0,0]=4 2264 B12R2.2028 CC1N=C(N)c2ccccc21 Amb24426364 [0,0,0,1,0,0|2,0,0]=3 2265 B12R2.2028 CC1NC(=O)c2ccc[n]c21 Amb23536271 [0,0,0,1,0,0|2,0,0]=3 2266 B12R2.2028 CC1NC(=O)c2ccccc21 Amb24104648 [0,0,0,1,0,0|1,0,0]=2 2267 B12R2.2028 CC1NC(C)c2ccccc21 Amb20622620 [0,0,0,1,0,0|2,0,1]=4 2268 B12R2.2028 CC1OC(=O)c2[n]cccc21 Amb24071603 [0,0,0,1,0,0|1,0,0]=2 2269 B12R2.2028 CC1OC(=O)c2cc[n]cc21 Amb25373921 [0,0,0,1,0,0|1,0,0]=2 2270 B12R2.2028 CC1OC(=O)c2ccccc21 Amb24060113 [0,0,0,1,0,0|0,0,0]=1 2271 B12R2.2028 CC1OC(=S)c2ccccc21 Amb25115999 [0,0,0,1,0,0|0,1,0]=2 2272 B12R2.2028 CC=1NC(=O)N2C=CC=CC21 Amb24436390 [0,0,0,1,0,0|2,0,1]=4 2273 B12R2.2028 CN1NC(=O)c2ccc[n]c12 Amb19314984 [0,0,0,1,0,0|3,0,0]=4 2274 B12R2.2028 CN1NC(=O)c2ccccc12 Amb22372319 [0,0,0,1,0,0|2,0,0]=3 2275 B12R2.2028 CN1OC(=O)c2ccccc12 Amb24528970 [0,0,0,1,0,0|1,0,0]=2 2276 B12R2.2028 CN1SC(=O)c2ccccc12 Amb19664923 [0,0,0,1,0,0|1,1,0]=3 2277 B12R2.2028 CN1SC(=S)c2ccccc12 Amb20661436 [0,0,0,1,0,0|1,2,0]=4 2278 B12R2.2028 C[C@@H]1CC(=O)c2ccccc21 Amb24467053 [0,0,0,1,0,0|1,0,0]=2 2279 B12R2.2028 C[C@@H]1CC(O)c2ccccc21 Amb25188702 [0,0,0,1,0,0|1,0,2]=4 2280 B12R2.2028 C[C@@H]1C[C@H](Br)c2ccccc21 Amb24741831 [0,0,0,1,0,0|2,0,1]=4 2281 B12R2.2028 C[C@@H]1NC(=O)c2ccccc21 Amb22754730 [0,0,0,1,0,0|1,0,0]=2 2282 B12R2.2028 C[C@H]1CC(=O)c2ccccc21 Amb25768595 [0,0,0,1,0,0|1,0,0]=2 2283 B12R2.2028 C[C@H]1CC(O)c2ccccc21 Amb24533800 [0,0,0,1,0,0|1,0,2]=4 2284 B12R2.2028 C[C@H]1C[C@@H](O)c2ccccc21 Amb24740911 [0,0,0,1,0,0|1,0,2]=4 2285 B12R2.2028 C[C@H]1OC(=O)c2ccccc21 Amb24060118 [0,0,0,1,0,0|0,0,0]=1 2286 B12R2.2028 C[n]1[nH]c(=O)c2c[n]ccc12 Amb24082889 [0,0,0,1,0,0|3,0,0]=4 2287 B12R2.2028 C[n]1[n]c(Cl)c2ccccc12 Amb25327391 [0,0,0,1,0,0|3,0,0]=4 2288 B12R2.2028 C[n]1cc(I)c2ccccc12 Amb24067581 [0,0,0,1,0,0|3,0,0]=4 2289 B12R2.2028 C[n]1cc(N)c2ccccc12 Amb18064415 [0,0,0,1,0,0|3,0,0]=4 2290 B12R2.2028 C[n]1cc(O)c2ccccc12 Amb24069283 [0,0,0,1,0,0|2,0,1]=4 2291 B12R2.2028 C[n]1cc(S)c2ccccc12 Amb25721189 [0,0,0,1,0,0|2,1,0]=4 2292 B12R2.2028 Cc1[n][n](C)c2ccccc12 Amb22491231 [0,0,0,1,0,0|3,0,0]=4 2293 B12R2.2028 Cc1oc(C)c2c[n]ccc12 Amb24760345 [0,0,0,1,0,0|2,0,1]=4 2294 B12R2.2028 Cc1oc(C)c2ccccc12 Amb25702226 [0,0,0,1,0,0|1,0,1]=3 2295 B12R2.2028 Cn1nc(c2c1cccc2)Br Amb10604243 [0,0,0,1,0,0|3,0,0]=4 2296 B12R2.2028 Cn1nc(c2c1cccc2)I Amb10608014 [0,0,0,1,0,0|3,0,0]=4 2297 B12R2.2028 N=C1NC(=O)c2ccccc21 Amb21811514 [0,0,0,1,0,0|2,0,1]=4 2298 B12R2.2028 NC1CC(=O)c2ccccc21 Amb21955324 [0,0,0,1,0,0|2,0,0]=3 2299 B12R2.2028 NC1NC(=N)c2ccccc21 Amb24351491 [0,0,0,1,0,0|3,0,0]=4 2300 B12R2.2028 NC1NC(=O)c2ccc[n]c21 Amb24091953 [0,0,0,1,0,0|3,0,0]=4 2301 B12R2.2028 NC1NC(=O)c2ccccc21 Amb22372261 [0,0,0,1,0,0|2,0,0]=3 2302 B12R2.2028 O=C1CC(=O)c2c1cccc2 Amb1883008 [0,0,0,1,0,0|2,0,1]=4 2303 B12R2.2028 O=C1CC(c2c1cccc2)Br Amb10068269 [0,0,0,1,0,0|2,0,0]=3 2304 B12R2.2028 O=C1CC(c2c1cccc2)N Amb17470381 [0,0,0,1,0,0|2,0,0]=3 2305 B12R2.2028 O=C1NC(=O)c2c1cccc2 Amb10604058 [0,0,0,1,0,0|2,0,1]=4 2306 B12R2.2028 O=C1NC(=O)c2c1cccc2 Amb1934252 [0,0,0,1,0,0|2,0,1]=4 2307 B12R2.2028 O=C1NC(=O)c2ccccc12 Amb19944694 [0,0,0,1,0,0|2,0,1]=4 2308 B12R2.2028 O=C1NC(=S)c2ccccc21 Amb25277268 [0,0,0,1,0,0|2,0,1]=4 2309 B12R2.2028 O=C1NC(Br)c2ccccc21 Amb24728224 [0,0,0,1,0,0|2,0,0]=3 2310 B12R2.2028 O=C1NC(Cl)c2ccccc21 Amb25700425 [0,0,0,1,0,0|2,0,0]=3 2311 B12R2.2028 O=C1NC(I)c2ccccc21 Amb25149062 [0,0,0,1,0,0|2,0,0]=3 2312 B12R2.2028 O=C1NC(c2c1cccc2)O Amb17593710 [0,0,0,1,0,0|2,0,0]=3 2313 B12R2.2028 O=C1OC(=O)[13c]2[13cH][13cH][13cH][13cH][13c]21 Amb22339015 [0,0,0,1,0,0|1,0,1]=3 2314 B12R2.2028 O=C1OC(=O)c2c1nccc2 Amb1106402 [0,0,0,1,0,0|2,0,1]=4 2315 B12R2.2028 O=C1OC(=O)c2ccccc12 Amb17748796 [0,0,0,1,0,0|1,0,1]=3 2316 B12R2.2028 O=C1OC(c2c1cccc2)O Amb10552913 [0,0,0,1,0,0|1,0,0]=2 2317 B12R2.2028 O=C1OC(c2c1cccc2)O Amb16226896 [0,0,0,1,0,0|1,0,0]=2 2318 B12R2.2028 O=C1[15N-]C(=O)c2ccccc12 Amb22732113 [0,0,0,1,0,0|2,0,1]=4 2319 B12R2.2028 O=C1[15NH]C(=O)c2ccccc12 Amb22338958 [0,0,0,1,0,0|2,0,1]=4 2320 B12R2.2028 O=C1[N-]C(=O)c2ccccc12 Amb22411655 [0,0,0,1,0,0|2,0,1]=4 2321 B12R2.2028 O=C1[N-]C(=O)c2ccccc12 Amb22524346 [0,0,0,1,0,0|2,0,1]=4 2322 B12R2.2028 O=[13C]1O[13C](=O)c2ccccc12 Amb22056066 [0,0,0,1,0,0|1,0,1]=3 2323 B12R2.2028 OB1OC(=O)c2[n]cccc21 Amb25694435 [0,0,0,1,0,0|3,0,0]=4 2324 B12R2.2028 OC1CC(=O)c2[n]cccc21 Amb22750353 [0,0,0,1,0,0|3,0,0]=4 2325 B12R2.2028 OC1CC(=O)c2c[n]ccc21 Amb24071455 [0,0,0,1,0,0|3,0,0]=4 2326 B12R2.2028 OC1NC(=O)c2[n]cccc21 Amb24081300 [0,0,0,1,0,0|3,0,0]=4 2327 B12R2.2028 OC1NC(=O)c2ccc[n]c21 Amb22436854 [0,0,0,1,0,0|3,0,0]=4 2328 B12R2.2028 OC1OC(=O)c2[n]cccc21 Amb25222317 [0,0,0,1,0,0|2,0,0]=3 2329 B12R2.2028 OC1OC(=O)c2cc[n]cc21 Amb24426049 [0,0,0,1,0,0|2,0,0]=3 2330 B12R2.2028 OC1OC(=O)c2ccc[n]c21 Amb24092124 [0,0,0,1,0,0|2,0,0]=3 2331 B12R2.2028 OC1OS(=O)c2ccccc21 Amb25234822 [0,0,0,1,0,0|2,0,0]=3 2332 B12R2.2028 OI1OC(=O)c2ccccc12 Amb19958248 [0,0,0,1,0,0|2,0,0]=3 2333 B12R2.2028 ON1CC(=O)c2ccccc12 Amb24078911 [0,0,0,1,0,0|3,0,0]=4 2334 B12R2.2028 O[C@@H]1CC(=O)c2ccccc21 Amb24724027 [0,0,0,1,0,0|2,0,0]=3 2335 B12R2.2028 O[C@H]1CC(=O)c2ccccc21 Amb25188743 [0,0,0,1,0,0|2,0,0]=3 2336 B12R2.2028 [O-][N+]1=CC(=O)c2ccccc12 Amb17843025 [0,0,0,1,0,0|3,0,0]=4 2337 B12R2.2047 O=C1C(=C=O)c2ccccc12 Amb25707004 [0,0,0,1,0,0|2,0,1]=4 2338 B12R2.2075 BrC(C1CC1)c2ccccc2 Amb25205179 [0,0,0,1,0,0|2,0,1]=4 2339 B12R2.2075 ClC(C1CC1)c2ccccc2 Amb18792883 [0,0,0,1,0,0|2,0,1]=4 2340 B12R2.2075 NC(c1ccccc1)C2CC2 Amb2371625 [0,0,0,1,0,0|2,0,1]=4 2341 B12R2.2075 N[C@@H](C1CC1)c2ccccc2 Amb22406367 [0,0,0,1,0,0|2,0,1]=4 2342 B12R2.2075 N[C@@H](C1CC1)c2ccccc2 Amb22744981 [0,0,0,1,0,0|2,0,1]=4 2343 B12R2.2075 N[C@H](C1CC1)c2ccccc2 Amb22406366 [0,0,0,1,0,0|2,0,1]=4 2344 B12R2.2075 O=C(C1CC1)c2c[n]c[n]c2 Amb24098342 [0,0,0,1,0,0|3,0,0]=4 2345 B12R2.2075 O=C(C1CC1)c2c[n]cc[n]2 Amb25145785 [0,0,0,1,0,0|3,0,0]=4 2346 B12R2.2075 O=C(C1CC1)c2cc[n]c[n]2 Amb25071975 [0,0,0,1,0,0|3,0,0]=4 2347 B12R2.2075 O=C(C1CC1)c2cc[n]cc2 Amb23454989 [0,0,0,1,0,0|2,0,0]=3 2348 B12R2.2075 O=C(C1CC1)c2cccc[n]2 Amb20248180 [0,0,0,1,0,0|2,0,0]=3 2349 B12R2.2075 O=C(C1CO1)c2ccccc2 Amb24376086 [0,0,0,1,0,0|2,0,0]=3 2350 B12R2.2075 O=C([C@@H]1CO1)c2ccccc2 Amb25735777 [0,0,0,1,0,0|2,0,0]=3 2351 B12R2.2075 O=C(c1c[n]cc[n]1)N2CC2 Amb25848297 [0,0,0,1,0,0|3,0,0]=4 2352 B12R2.2075 O=C(c1ccccc1)N2CC2 Amb24078342 [0,0,0,1,0,0|1,0,0]=2 2353 B12R2.2075 O=C(c1cccnc1)C2CC2 Amb10607961 [0,0,0,1,0,0|2,0,0]=3 2354 B12R2.2075 O[C@H](C1CC1)c2ccccc2 Amb25260486 [0,0,0,1,0,0|1,0,2]=4 2355 B12R2.2075 SC(C1CC1)c2ccccc2 Amb18788326 [0,0,0,1,0,0|1,1,1]=4 2356 B10R1.11 BrCCC(=O)c1cccs1 Amb17437890 [0,0,0,0,1,0|3,0,0]=4 2357 B10R1.11 C=COC(=O)c1ccc[nH]1 Amb24518679 [0,0,0,0,1,0|1,0,2]=4 2358 B10R1.11 C=COC(=O)c1ccco1 Amb17934193 [0,0,0,0,1,0|1,0,2]=4 2359 B10R1.11 CC#CC(=O)c1ccco1 Amb25145523 [0,0,0,0,1,0|2,0,1]=4 2360 B10R1.11 CC(CCO)=C1C=CC=C1 Amb25050337 [0,0,0,0,1,0|3,0,0]=4 2361 B10R1.11 CCCC(=O)c1[n]cc[s]1 Amb19649390 [0,0,0,0,1,0|3,0,0]=4 2362 B10R1.11 CCCC(=O)c1c[nH][n]c1 Amb25094522 [0,0,0,0,1,0|3,0,0]=4 2363 B10R1.11 CCCC(=O)c1c[nH]c[n]1 Amb23402207 [0,0,0,0,1,0|3,0,0]=4 2364 B10R1.11 CCCC(=O)c1c[s]c[n]1 Amb25731997 [0,0,0,0,1,0|3,0,0]=4 2365 B10R1.11 CCCC(=O)c1cc[nH][n]1 Amb25719469 [0,0,0,0,1,0|3,0,0]=4 2366 B10R1.11 CCCC(=O)c1cc[nH]c1 Amb24476781 [0,0,0,0,1,0|2,0,0]=3 2367 B10R1.11 CCCC(=O)c1cc[n][s]1 Amb24657784 [0,0,0,0,1,0|3,0,0]=4 2368 B10R1.11 CCCC(=O)c1cc[s]c1 Amb18791600 [0,0,0,0,1,0|2,0,0]=3 2369 B10R1.11 CCCC(=O)n1cccn1 Amb17789979 [0,0,0,0,1,0|3,0,0]=4 2370 B10R1.11 CCNC(=N)c1ccc[s]1 Amb25729291 [0,0,0,0,1,0|3,0,0]=4 2371 B10R1.11 CCNC(=N)c1ccco1 Amb25053191 [0,0,0,0,1,0|3,0,0]=4 2372 B10R1.11 CCNC(=O)c1c[n]c[s]1 Amb25795211 [0,0,0,0,1,0|3,0,0]=4 2373 B10R1.11 CCNC(=O)c1c[n]co1 Amb22963680 [0,0,0,0,1,0|3,0,0]=4 2374 B10R1.11 CCNC(=O)c1cc[s]c1 Amb24451235 [0,0,0,0,1,0|2,0,0]=3 2375 B10R1.11 CCNC(=O)c1ccc[nH]1 Amb22001184 [0,0,0,0,1,0|2,0,0]=3 2376 B10R1.11 CCNC(=O)c1ccco1 Amb17755144 [0,0,0,0,1,0|2,0,0]=3 2377 B10R1.11 CCNC(=O)c1cco[n]1 Amb25064293 [0,0,0,0,1,0|3,0,0]=4 2378 B10R1.11 CCNC(=O)c1coc[n]1 Amb24403475 [0,0,0,0,1,0|3,0,0]=4 2379 B10R1.11 CCNC(=S)c1ccc[s]1 Amb25691238 [0,0,0,0,1,0|2,1,0]=4 2380 B10R1.11 CCOC(=C)c1c[n]c[s]1 Amb24070701 [0,0,0,0,1,0|3,0,0]=4 2381 B10R1.11 CCOC(=C)c1ccoc1 Amb24740354 [0,0,0,0,1,0|2,0,0]=3 2382 B10R1.11 CCOC(=N)[n]1c[n]cc1 Amb24089063 [0,0,0,0,1,0|3,0,0]=4 2383 B10R1.11 CCOC(=N)c1[n]cc[s]1 Amb25125001 [0,0,0,0,1,0|3,0,0]=4 2384 B10R1.11 CCOC(=N)c1c[nH][n]c1 Amb24442125 [0,0,0,0,1,0|3,0,0]=4 2385 B10R1.11 CCOC(=N)c1cc[s]c1 Amb18791659 [0,0,0,0,1,0|2,0,0]=3 2386 B10R1.11 CCOC(=N)c1ccc[nH]1 Amb24669196 [0,0,0,0,1,0|2,0,0]=3 2387 B10R1.11 CCOC(=N)c1ccc[s]1 Amb18791658 [0,0,0,0,1,0|2,0,0]=3 2388 B10R1.11 CCOC(=N)c1ccc[s]1 Amb20673166 [0,0,0,0,1,0|2,0,0]=3 2389 B10R1.11 CCOC(=O)C1=CCCN1 Amb22011810 [0,0,0,0,1,0|1,0,2]=4 2390 B10R1.11 CCOC(=O)C1CCC=C1 Amb24356534 [0,0,0,0,1,0|0,0,3]=4 2391 B10R1.11 CCOC(=O)N1CCC=C1 Amb25144136 [0,0,0,0,1,0|1,0,2]=4 2392 B10R1.11 CCOC(=O)N1CNC=C1 Amb25362994 [0,0,0,0,1,0|2,0,1]=4 2393 B10R1.11 CCOC(=O)[C@@H]1C=CCN1 Amb24433183 [0,0,0,0,1,0|1,0,2]=4 2394 B10R1.11 CCOC(=O)[C@@H]1CCC=C1 Amb25103016 [0,0,0,0,1,0|0,0,3]=4 2395 B10R1.11 CCOC(=O)[n]1[n]cc[n]1 Amb25838935 [0,0,0,0,1,0|3,0,0]=4 2396 B10R1.11 CCOC(=O)[n]1c[n][n]c1 Amb24607273 [0,0,0,0,1,0|3,0,0]=4 2397 B10R1.11 CCOC(=O)[n]1c[n]c[n]1 Amb25225238 [0,0,0,0,1,0|3,0,0]=4 2398 B10R1.11 CCOC(=O)[n]1c[n]cc1 Amb22492423 [0,0,0,0,1,0|2,0,0]=3 2399 B10R1.11 CCOC(=O)[n]1cc[n][n]1 Amb24555011 [0,0,0,0,1,0|3,0,0]=4 2400 B10R1.11 CCOC(=O)c1[nH][n]c[n]1 Amb19887074 [0,0,0,0,1,0|3,0,0]=4 2401 B10R1.11 CCOC(=O)c1[n][nH]c[p]1 Amb25174028 [0,0,0,0,1,0|3,0,0]=4 2402 B10R1.11 CCOC(=O)c1[n][n]c[s]1 Amb22498943 [0,0,0,0,1,0|3,0,0]=4 2403 B10R1.11 CCOC(=O)c1[n][n]co1 Amb25062996 [0,0,0,0,1,0|3,0,0]=4 2404 B10R1.11 CCOC(=O)c1[n]c[n][s]1 Amb22754133 [0,0,0,0,1,0|3,0,0]=4 2405 B10R1.11 CCOC(=O)c1[n]cco1 Amb19515922 [0,0,0,0,1,0|2,0,0]=3 2406 B10R1.11 CCOC(=O)c1c[nH]nn1 Amb16233445 [0,0,0,0,1,0|3,0,0]=4 2407 B10R1.11 CCOC(=O)c1c[s]c[n]1 Amb22000945 [0,0,0,0,1,0|2,0,0]=3 2408 B10R1.11 CCOC(=O)c1c[s]c[n]1 Amb22284159 [0,0,0,0,1,0|2,0,0]=3 2409 B10R1.11 CCOC(=O)c1cc[nH]c1 Amb20247140 [0,0,0,0,1,0|1,0,0]=2 2410 B10R1.11 CCOC(=O)c1cc[nH]n1 Amb1933790 [0,0,0,0,1,0|2,0,0]=3 2411 B10R1.11 CCOC(=O)c1cc[n]o1 Amb22000977 [0,0,0,0,1,0|2,0,0]=3 2412 B10R1.11 CCOC(=O)c1cco[n]1 Amb19930075 [0,0,0,0,1,0|2,0,0]=3 2413 B10R1.11 CCOC(=O)c1cnco1 Amb10070742 [0,0,0,0,1,0|2,0,0]=3 2414 B10R1.11 CCOC(=O)c1cncs1 Amb10071288 [0,0,0,0,1,0|2,0,0]=3 2415 B10R1.11 CCOC(=O)c1conc1 Amb2447445 [0,0,0,0,1,0|2,0,0]=3 2416 B10R1.11 CCOC(=O)c1cscn1 Amb1102588 [0,0,0,0,1,0|2,0,0]=3 2417 B10R1.11 CCOC(=O)c1csnn1 Amb1987227 [0,0,0,0,1,0|3,0,0]=4 2418 B10R1.11 CCOC(=O)n1cccc1 Amb17938697 [0,0,0,0,1,0|1,0,0]=2 2419 B10R1.11 CCOC(=S)[n]1c[n]cc1 Amb25786112 [0,0,0,0,1,0|2,1,0]=4 2420 B10R1.11 CCOC(O)c1ccco1 Amb24756827 [0,0,0,0,1,0|1,0,2]=4 2421 B10R1.11 CCSC(=N)c1ccoc1 Amb24078769 [0,0,0,0,1,0|2,1,0]=4 2422 B10R1.11 CNCC(=O)c1c[nH]cc1 Amb18561865 [0,0,0,0,1,0|3,0,0]=4 2423 B10R1.11 CNCC(=O)c1cc[s]c1 Amb24461147 [0,0,0,0,1,0|3,0,0]=4 2424 B10R1.11 CNCC(=O)c1ccc[nH]1 Amb21862063 [0,0,0,0,1,0|3,0,0]=4 2425 B10R1.11 CNCC(=O)c1ccco1 Amb21862170 [0,0,0,0,1,0|3,0,0]=4 2426 B10R1.11 CNCC(=O)c1cccs1 Amb17232156 [0,0,0,0,1,0|3,0,0]=4 2427 B10R1.11 CNCC(=O)c1ccoc1 Amb25369027 [0,0,0,0,1,0|3,0,0]=4 2428 B10R1.11 COCC(=O)c1cc[s]c1 Amb24400447 [0,0,0,0,1,0|3,0,0]=4 2429 B10R1.11 CONC(=O)c1cc[s]c1 Amb24546890 [0,0,0,0,1,0|3,0,0]=4 2430 B10R1.11 CONC(=O)c1ccco1 Amb25310801 [0,0,0,0,1,0|3,0,0]=4 2431 B10R1.11 CONC(=O)c1cccs1 Amb16969912 [0,0,0,0,1,0|3,0,0]=4 2432 B10R1.11 CSCC(=O)c1c[s]cc1 Amb24659443 [0,0,0,0,1,0|3,0,0]=4 2433 B10R1.11 CSCC(=O)c1ccc[nH]1 Amb18791660 [0,0,0,0,1,0|3,0,0]=4 2434 B10R1.11 CSCC(=O)c1ccc[s]1 Amb18180366 [0,0,0,0,1,0|3,0,0]=4 2435 B10R1.11 CSCC(=O)c1ccco1 Amb18791728 [0,0,0,0,1,0|3,0,0]=4 2436 B10R1.11 CSCC(=O)c1ccoc1 Amb25146358 [0,0,0,0,1,0|3,0,0]=4 2437 B10R1.11 C\C=C\C(=O)[n]1cccc1 Amb24708952 [0,0,0,0,1,0|2,0,1]=4 2438 B10R1.11 C\C=C\C(=O)c1cc[s]c1 Amb24578318 [0,0,0,0,1,0|2,0,1]=4 2439 B10R1.11 C\C=C\C(=O)c1ccc[s]1 Amb25078713 [0,0,0,0,1,0|2,0,1]=4 2440 B10R1.11 ClCCC(=O)c1ccco1 Amb17138476 [0,0,0,0,1,0|3,0,0]=4 2441 B10R1.11 NCCC(=O)c1cc[nH]c1 Amb18062705 [0,0,0,0,1,0|3,0,0]=4 2442 B10R1.11 NCCC(=O)c1ccc[nH]1 Amb24459967 [0,0,0,0,1,0|3,0,0]=4 2443 B10R1.11 NCCC(=O)c1ccco1 Amb18639567 [0,0,0,0,1,0|3,0,0]=4 2444 B10R1.11 NCCC(=O)c1cccs1 Amb17194466 [0,0,0,0,1,0|3,0,0]=4 2445 B10R1.11 NCCC(=O)c1ccoc1 Amb25142291 [0,0,0,0,1,0|3,0,0]=4 2446 B10R1.11 O=C(CCCl)[n]1cccc1 Amb24470700 [0,0,0,0,1,0|3,0,0]=4 2447 B10R1.11 O=C(CCCl)c1cc[s]c1 Amb25074631 [0,0,0,0,1,0|3,0,0]=4 2448 B10R1.11 O=C(OCF)c1ccco1 Amb24553124 [0,0,0,0,1,0|2,0,0]=3 2449 B10R1.11 OCCC(=O)c1cc[nH]c1 Amb18064961 [0,0,0,0,1,0|3,0,0]=4 2450 B10R1.11 OCCC(=O)c1ccc[nH]1 Amb25780948 [0,0,0,0,1,0|3,0,0]=4 2451 B10R1.11 OCCC(=O)c1ccc[s]1 Amb18563468 [0,0,0,0,1,0|3,0,0]=4 2452 B10R1.11 OCCC(=O)c1ccco1 Amb25234271 [0,0,0,0,1,0|3,0,0]=4 2453 B10R1.11 SCCC(=O)c1cccs1 Amb17400372 [0,0,0,0,1,0|3,0,0]=4 2454 B12R1.32 BrCCC(=O)Nc1ccccc1 Amb16191990 [0,0,0,0,0,1|2,0,0]=3 2455 B12R1.32 BrCCC(=O)Nc1ccccn1 Amb17324145 [0,0,0,0,0,1|3,0,0]=4 2456 B12R1.32 BrCCC(=O)Nc1cccnc1 Amb17330975 [0,0,0,0,0,1|3,0,0]=4 2457 B12R1.32 C#CCC(=O)Cc1ccccc1 Amb18799925 [0,0,0,0,0,1|1,0,2]=4 2458 B12R1.32 C=C=CC(=O)Cc1ccccc1 Amb25713668 [0,0,0,0,0,1|1,0,2]=4 2459 B12R1.32 C=CCC(=O)Nc1ccccc1 Amb25123880 [0,0,0,0,0,1|1,0,2]=4 2460 B12R1.32 C=CNC(=O)Oc1ccccc1 Amb25159436 [0,0,0,0,0,1|1,0,2]=4 2461 B12R1.32 C=COC(=O)Cc1ccccc1 Amb17934203 [0,0,0,0,0,1|0,0,2]=3 2462 B12R1.32 C=NNC(=O)Nc1ccccc1 Amb24488786 [0,0,0,0,0,1|2,0,1]=4 2463 B12R1.32 C=NOC(=O)Nc1ccccc1 Amb24420620 [0,0,0,0,0,1|1,0,1]=3 2464 B12R1.32 CC#CC(=O)Nc1ccccc1 Amb17940360 [0,0,0,0,0,1|1,0,1]=3 2465 B12R1.32 CCCC(=N)Nc1ccccc1 Amb24096810 [0,0,0,0,0,1|2,0,0]=3 2466 B12R1.32 CCCC(=O)Nc1c[n]c[n]c1 Amb24415042 [0,0,0,0,0,1|3,0,0]=4 2467 B12R1.32 CCCC(=O)Nc1c[n]cc[n]1 Amb24705198 [0,0,0,0,0,1|3,0,0]=4 2468 B12R1.32 CCCC(C)Cc1ccccc1 Amb22224920 [0,0,0,0,0,1|2,0,1]=4 2469 B12R1.32 CCCC(Cc1ccccc1)[NH3+] Amb10560244 [0,0,0,0,0,1|2,0,1]=4 2470 B12R1.32 CCCC(N)Cc1ccccc1 Amb18180073 [0,0,0,0,0,1|2,0,1]=4 2471 B12R1.32 CCC\C(\I)=C/c1ccccc1 Amb22546627 [0,0,0,0,0,1|2,0,0]=3 2472 B12R1.32 CCNC(=N)Cc1cc[n]cc1 Amb25064531 [0,0,0,0,0,1|3,0,0]=4 2473 B12R1.32 CCNC(=N)Nc1c[n]ccc1 Amb18798343 [0,0,0,0,0,1|3,0,0]=4 2474 B12R1.32 CCNC(=N)Nc1ccccc1 Amb18798223 [0,0,0,0,0,1|2,0,0]=3 2475 B12R1.32 CCNC(=O)Cc1c[n]c[n]c1 Amb25725133 [0,0,0,0,0,1|3,0,0]=4 2476 B12R1.32 CCNC(=O)Cc1c[n]ccc1 Amb25725646 [0,0,0,0,0,1|2,0,0]=3 2477 B12R1.32 CCNC(=O)Cc1cc[n]cc1 Amb25205151 [0,0,0,0,0,1|2,0,0]=3 2478 B12R1.32 CCNC(=O)Nc1[n]ccc[n]1 Amb24679552 [0,0,0,0,0,1|3,0,0]=4 2479 B12R1.32 CCNC(=O)Nc1c[n]c[n]c1 Amb24391347 [0,0,0,0,0,1|3,0,0]=4 2480 B12R1.32 CCNC(=O)Nc1c[n]cc[n]1 Amb24495397 [0,0,0,0,0,1|3,0,0]=4 2481 B12R1.32 CCNC(=O)Nc1cccc[n]1 Amb25240072 [0,0,0,0,0,1|2,0,0]=3 2482 B12R1.32 CCNC(=O)Nc1ccccc1 Amb1233665 [0,0,0,0,0,1|1,0,0]=2 2483 B12R1.32 CCNC(=O)Nc1cccnc1 Amb13958674 [0,0,0,0,0,1|2,0,0]=3 2484 B12R1.32 CCNC(=O)Sc1ccccc1 Amb25827115 [0,0,0,0,0,1|1,0,0]=2 2485 B12R1.32 CCNC(=S)Cc1ccccc1 Amb24066800 [0,0,0,0,0,1|1,1,0]=3 2486 B12R1.32 CCNC(=S)Nc1cc[n]cc1 Amb23244512 [0,0,0,0,0,1|2,1,0]=4 2487 B12R1.32 CCNC(=S)Nc1ccccc1 Amb2548953 [0,0,0,0,0,1|1,1,0]=3 2488 B12R1.32 CCNC(C)Cc1ccccc1 Amb18552940 [0,0,0,0,0,1|2,0,1]=4 2489 B12R1.32 CCNC(C)Cc1ccccc1 Amb22055190 [0,0,0,0,0,1|2,0,1]=4 2490 B12R1.32 CCO/C(C)=N/c1ccccc1 Amb17939699 [0,0,0,0,0,1|1,0,0]=2 2491 B12R1.32 CCOC(=N)Cc1cc[n]cc1 Amb18800815 [0,0,0,0,0,1|2,0,0]=3 2492 B12R1.32 CCOC(=N)Cc1cccc[n]1 Amb18792558 [0,0,0,0,0,1|2,0,0]=3 2493 B12R1.32 CCOC(=N)Cc1ccccc1 Amb20673132 [0,0,0,0,0,1|1,0,0]=2 2494 B12R1.32 CCOC(=N)Nc1ccccc1 Amb24496991 [0,0,0,0,0,1|1,0,0]=2 2495 B12R1.32 CCOC(=O)C=C1C=COC=C1 Amb25848212 [0,0,0,0,0,1|1,0,0]=2 2496 B12R1.32 CCOC(=O)C[n+]1ccncc1 Amb2228081 [0,0,0,0,0,1|2,0,0]=3 2497 B12R1.32 CCOC(=O)Cc1c[n]c[n]c1 Amb18801018 [0,0,0,0,0,1|2,0,0]=3 2498 B12R1.32 CCOC(=O)Cc1c[n]cc[n]1 Amb23399648 [0,0,0,0,0,1|2,0,0]=3 2499 B12R1.32 CCOC(=O)Cc1c[n]ccc1 Amb22478803 [0,0,0,0,0,1|1,0,0]=2 2500 B12R1.32 CCOC(=O)Cc1cc[n]c[n]1 Amb22001936 [0,0,0,0,0,1|2,0,0]=3 2501 B12R1.32 CCOC(=O)Cc1cc[n]cc1 Amb20621993 [0,0,0,0,0,1|1,0,0]=2 2502 B12R1.32 CCOC(=O)Cc1ccc[n][n]1 Amb23440008 [0,0,0,0,0,1|2,0,0]=3 2503 B12R1.32 CCOC(=O)Cc1ncccn1 Amb17935863 [0,0,0,0,0,1|2,0,0]=3 2504 B12R1.32 CCOC(=O)N[n+]1ccccc1 Amb10560832 [0,0,0,0,0,1|1,0,0]=2 2505 B12R1.32 CCOC(=O)Nc1ccncn1 Amb17602618 [0,0,0,0,0,1|2,0,0]=3 2506 B12R1.32 CCOC(=O)Nc1ncccn1 Amb17862869 [0,0,0,0,0,1|2,0,0]=3 2507 B12R1.32 CCOC(=S)Nc1cc[n]cc1 Amb25293795 [0,0,0,0,0,1|1,1,0]=3 2508 B12R1.32 CCOC(=S)Nc1cccc[n]1 Amb24640228 [0,0,0,0,0,1|1,1,0]=3 2509 B12R1.32 CCSC(=N)Nc1ccccc1 Amb17614151 [0,0,0,0,0,1|1,1,0]=3 2510 B12R1.32 CCSC(=O)Nc1cccc[n]1 Amb25131179 [0,0,0,0,0,1|1,1,0]=3 2511 B12R1.32 CCSC(=O)Nc1ccccc1 Amb24310273 [0,0,0,0,0,1|0,1,0]=2 2512 B12R1.32 CCSC(=S)Nc1ccc[n]c1 Amb24103663 [0,0,0,0,0,1|1,2,0]=4 2513 B12R1.32 CCSC(=S)Nc1cccc[n]1 Amb22733548 [0,0,0,0,0,1|1,2,0]=4 2514 B12R1.32 CCSC(=S)Nc1ccccc1 Amb24757680 [0,0,0,0,0,1|0,2,0]=3 2515 B12R1.32 CCSC(C)Nc1ccccc1 Amb24585828 [0,0,0,0,0,1|1,1,1]=4 2516 B12R1.32 CCS\C(=N\c1ccccc1)\N Amb11230603 [0,0,0,0,0,1|1,1,0]=3 2517 B12R1.32 CC[N]C(=S)Nc1ccccc1 Amb22731669 [0,0,0,0,0,1|1,1,0]=3 2518 B12R1.32 CC\N=C(\N)/Cc1ccccc1 Amb23569052 [0,0,0,0,0,1|2,0,0]=3 2519 B12R1.32 CNCC(=O)Nc1cccnc1 Amb15740831 [0,0,0,0,0,1|3,0,0]=4 2520 B12R1.32 CNC\C(=C\c1ccccc1)\C Amb17100030 [0,0,0,0,0,1|3,0,0]=4 2521 B12R1.32 CNNC(=O)Oc1cccc[n]1 Amb24704314 [0,0,0,0,0,1|3,0,0]=4 2522 B12R1.32 CNNC(=S)Nc1ccccc1 Amb25119287 [0,0,0,0,0,1|2,1,0]=4 2523 B12R1.32 COCC(=O)Nc1ccncc1 Amb1832638 [0,0,0,0,0,1|3,0,0]=4 2524 B12R1.32 CONC(=O)Cc1ccccc1 Amb16969924 [0,0,0,0,0,1|2,0,0]=3 2525 B12R1.32 CONC(=O)Oc1ccccc1 Amb16969957 [0,0,0,0,0,1|2,0,0]=3 2526 B12R1.32 CONC(=S)Nc1ccccc1 Amb24497042 [0,0,0,0,0,1|2,1,0]=4 2527 B12R1.32 CSCC(=O)Nc1cccc[n]1 Amb25133919 [0,0,0,0,0,1|3,0,0]=4 2528 B12R1.32 CSCC(=O)Nc1ccccc1 Amb2373904 [0,0,0,0,0,1|2,0,0]=3 2529 B12R1.32 CSCC(=O)Nc1cccnc1 Amb13957856 [0,0,0,0,0,1|3,0,0]=4 2530 B12R1.32 C[SiH2]OC(=O)Nc1ccccc1 Amb24682546 [0,0,0,0,0,1|0,1,0]=2 2531 B12R1.32 C\C(=C\CC)\Nc1ccccc1 Amb25678437 [0,0,0,0,0,1|2,0,0]=3 2532 B12R1.32 C\C(\CCBr)=C/c1ccccc1 Amb18063581 [0,0,0,0,0,1|3,0,0]=4 2533 B12R1.32 C\C(\CCN)=C/c1ccccc1 Amb18063553 [0,0,0,0,0,1|3,0,0]=4 2534 B12R1.32 C\C(\CCO)=C\c1ccccc1 Amb24576953 [0,0,0,0,0,1|3,0,0]=4 2535 B12R1.32 C\C(\Cc1ccccc1)=C\CN Amb25669583 [0,0,0,0,0,1|3,0,0]=4 2536 B12R1.32 C\C=C\C(=O)Nc1cccc[n]1 Amb25785202 [0,0,0,0,0,1|2,0,1]=4 2537 B12R1.32 C\C=C\C(=O)Nc1ccccc1 Amb24497299 [0,0,0,0,0,1|1,0,1]=3 2538 B12R1.32 C\C=C\C(=O)Oc1ccc[n]c1 Amb25154502 [0,0,0,0,0,1|2,0,1]=4 2539 B12R1.32 ClCCC(=O)Nc1ccccn1 Amb1141371 [0,0,0,0,0,1|3,0,0]=4 2540 B12R1.32 ClCCC(=O)Nc1cccnc1 Amb1133566 [0,0,0,0,0,1|3,0,0]=4 2541 B12R1.32 ClCCC(=O)Nc1ccncc1 Amb1128057 [0,0,0,0,0,1|3,0,0]=4 2542 B12R1.32 ClCCC(=O)Oc1ccccc1 Amb16230794 [0,0,0,0,0,1|2,0,0]=3 2543 B12R1.32 Cl\C(\Cc1ccccc1)=C/CCl Amb25035226 [0,0,0,0,0,1|3,0,0]=4 2544 B12R1.32 Cl\C(\Cc1ccccc1)=C\CCl Amb24563867 [0,0,0,0,0,1|3,0,0]=4 2545 B12R1.32 N#CCC(=O)Cc1ccccc1 Amb17232286 [0,0,0,0,0,1|2,0,1]=4 2546 B12R1.32 N#CCC(=O)Nc1ccccc1 Amb1634628 [0,0,0,0,0,1|2,0,1]=4 2547 B12R1.32 N#CCC(=O)Oc1ccccc1 Amb18645449 [0,0,0,0,0,1|2,0,1]=4 2548 B12R1.32 N#CNC(=O)Cc1ccccc1 Amb25149956 [0,0,0,0,0,1|2,0,1]=4 2549 B12R1.32 NCCC(=O)Nc1ccccc1 Amb1125528 [0,0,0,0,0,1|2,0,0]=3 2550 B12R1.32 NCCC(=O)Nc1ccccc1 Amb15740909 [0,0,0,0,0,1|2,0,0]=3 2551 B12R1.32 NCCC(=O)Nc1ccccn1 Amb1124759 [0,0,0,0,0,1|3,0,0]=4 2552 B12R1.32 NCCC(=O)Nc1cccnc1 Amb1141841 [0,0,0,0,0,1|3,0,0]=4 2553 B12R1.32 NCCC(=O)Nc1cccnc1 Amb13952219 [0,0,0,0,0,1|3,0,0]=4 2554 B12R1.32 NCCC(=O)Nc1ccncc1 Amb1126146 [0,0,0,0,0,1|3,0,0]=4 2555 B12R1.32 NCCC(=O)Nc1ccncc1 Amb13952138 [0,0,0,0,0,1|3,0,0]=4 2556 B12R1.32 NCCC(=O)Nc1ccncc1 Amb13952153 [0,0,0,0,0,1|3,0,0]=4 2557 B12R1.32 NCCC(=O)Oc1ccccc1 Amb17334633 [0,0,0,0,0,1|2,0,0]=3 2558 B12R1.32 NCCS(=O)Cc1ccccc1 Amb18306046 [0,0,0,0,0,1|3,0,0]=4 2559 B12R1.32 NOCC(=O)Nc1ccccc1 Amb24596278 [0,0,0,0,0,1|3,0,0]=4 2560 B12R1.32 NOCC(=O)Oc1ccccc1 Amb24096859 [0,0,0,0,0,1|3,0,0]=4 2561 B12R1.32 N\N=C\C(=O)Cc1ccccc1 Amb25046103 [0,0,0,0,0,1|3,0,0]=4 2562 B12R1.32 O=C(C#CBr)Nc1ccccc1 Amb24621200 [0,0,0,0,0,1|2,0,1]=4 2563 B12R1.32 O=C(C=C=O)Nc1ccccc1 Amb24441652 [0,0,0,0,0,1|2,0,1]=4 2564 B12R1.32 O=C(CCCl)Nc1ccc[n]c1 Amb22587747 [0,0,0,0,0,1|3,0,0]=4 2565 B12R1.32 O=C(CCF)Nc1ccccc1 Amb25276540 [0,0,0,0,0,1|2,0,0]=3 2566 B12R1.32 O=C(CCI)Nc1ccccc1 Amb23447340 [0,0,0,0,0,1|2,0,0]=3 2567 B12R1.32 O=C(Cc1ccccc1)\C=C\Cl Amb25216983 [0,0,0,0,0,1|2,0,1]=4 2568 B12R1.32 O=C(N=C=O)Oc1ccccc1 Amb22348017 [0,0,0,0,0,1|2,0,1]=4 2569 B12R1.32 O=C(NC#N)Nc1ccccc1 Amb17939016 [0,0,0,0,0,1|2,0,1]=4 2570 B12R1.32 O=C(NC=O)Nc1ccccc1 Amb22347423 [0,0,0,0,0,1|2,0,1]=4 2571 B12R1.32 O=C(Nc1ccccc1)N=C=S Amb24724734 [0,0,0,0,0,1|2,0,1]=4 2572 B12R1.32 O=C(\C=C\F)Nc1ccccc1 Amb24386157 [0,0,0,0,0,1|2,0,1]=4 2573 B12R1.32 O=C=NC(=O)Cc1ccccc1 Amb17232352 [0,0,0,0,0,1|2,0,1]=4 2574 B12R1.32 OCNC(=O)C[n+]1ccccc1 Amb25046777 [0,0,0,0,0,1|3,0,0]=4 2575 B12R1.32 OCNC(=O)Oc1ccccc1 Amb10552983 [0,0,0,0,0,1|2,0,0]=3 2576 B12R1.32 ONCC(=O)Nc1ccccc1 Amb24495972 [0,0,0,0,0,1|3,0,0]=4 2577 B12R1.32 O\C=C\C(=O)Cc1ccccc1 Amb25093804 [0,0,0,0,0,1|2,0,1]=4 2578 B12R1.32 O\N=C\C(=O)Cc1ccccc1 Amb24577781 [0,0,0,0,0,1|3,0,0]=4 2579 B12R1.32 O\N=C\C(=O)Nc1ccccc1 Amb1205570 [0,0,0,0,0,1|3,0,0]=4 2580 B12R1.32 SCCC(=O)Nc1ccccc1 Amb17305724 [0,0,0,0,0,1|2,0,0]=3 2581 B12R1.32 [BH3]N(CCC)Cc1ccccc1 Amb24678772 [0,0,0,0,0,1|3,0,0]=4 2582 B12R1.32 [C-]#[N+]CC(=O)Nc1ccccc1 Amb25695864 [0,0,0,0,0,1|2,0,1]=4 2583 B12R1.32 [K]ONC(=O)Cc1ccccc1 Amb10558422 [0,0,0,0,0,1|3,0,0]=4 2584 B12R1.32 [N-]=[N+]=CC(=O)Oc1ccccc1 Amb24576332 [0,0,0,0,0,1|3,0,0]=4 2585 B12R1.32 [N-]=[N+]=NC(=O)Nc1ccccc1 Amb25233093 [0,0,0,0,0,1|3,0,0]=4 2586 B12R1.1564 CCOC(=O)C1C=CC=CC=C1 Amb25348912 [0,0,0,0,0,1|0,0,1]=2 2587 B12R1.1564 CONC(=O)C1C=CC=CC=C1 Amb25816679 [0,0,0,0,0,1|2,0,1]=4 2588 B9R0.5 CC=C\C=C\C(=O)NCC Amb25787729 [1,0,1,0,0,0|1,0,1]=4 2589 B9R0.5 CC=C\C=C\C(=O)OCC Amb25115104 [1,0,1,0,0,0|0,0,1]=3 2590 B9R0.5 CCOC(=O)N\C=C\C=O Amb18124624 [1,0,1,0,0,0|2,0,0]=4 2591 B9R0.5 CCOC(=O)O\C=C\C=O Amb25367363 [1,0,1,0,0,0|2,0,0]=4 2592 B9R0.5 CCOC(=O)\C=C/NC=O Amb24549045 [1,0,1,0,0,0|2,0,0]=4 2593 B9R0.5 CCOC(=O)\C=C\C=CBr Amb24634643 [1,0,1,0,0,0|1,0,0]=3 2594 B9R0.5 CCOC(=O)\C=C\C=C\Br Amb10066940 [1,0,1,0,0,0|1,0,0]=3 2595 B9R0.5 CCOC(=O)\C=C\C=C\Cl Amb24389501 [1,0,1,0,0,0|1,0,0]=3 2596 B9R0.5 CCOC(=O)\C=C\CC=C Amb25242691 [1,0,1,0,0,0|0,0,1]=3 2597 B9R0.5 CCOC(=O)\C=C\NC=O Amb24629777 [1,0,1,0,0,0|2,0,0]=4 2598 B9R0.5 CCO\C(\Cl)=C\C=CC=O Amb24583017 [1,0,1,0,0,0|2,0,0]=4 2599 B9R0.5 C\C=C\C=C\C(=O)CCC Amb25793055 [1,0,1,0,0,0|1,0,1]=4 2600 B9R0.45 C=CC=CC=CC=CCO Amb25052157 [1,0,1,0,0,0|2,0,0]=4 2601 B9R0.45 CC\C=C/C=C/C=C/C=O Amb25678603 [1,0,1,0,0,0|2,0,0]=4 2602 B9R0.45 C\C=C\C=C/C=C/CCC Amb22641677 [1,0,1,0,0,0|1,0,1]=4 2603 B9R0.46 CCC(=O)\C=C\C=C\C=O Amb24633418 [1,0,1,0,0,0|1,0,0]=3 2604 B9R0.46 CCC(=O)\C=C\C=C\CC Amb25046076 [1,0,1,0,0,0|0,0,2]=4 2605 B9R0.46 CC\C=C/C=C/C(=O)OC Amb10067166 [1,0,1,0,0,0|0,0,2]=4 2606 B9R0.46 CC\C=C\C=CC(=O)OC Amb24606658 [1,0,1,0,0,0|0,0,2]=4 2607 B9R0.46 COC(=O)CC\C=C\C=C Amb10605293 [1,0,1,0,0,0|0,0,2]=4 2608 B9R0.46 COC(=O)N\C=C/CC=C Amb24396233 [1,0,1,0,0,0|1,0,1]=4 2609 B9R0.46 COC(=O)\C=C/C=C/C=O Amb24663130 [1,0,1,0,0,0|1,0,0]=3 2610 B9R0.46 COC(=O)\C=C\C=C/C=O Amb25137299 [1,0,1,0,0,0|1,0,0]=3 2611 B9R0.46 COC(=O)\C=C\C=CC=O Amb25223129 [1,0,1,0,0,0|1,0,0]=3 2612 B9R0.46 COC(=O)\C=C\C=CCBr Amb25350207 [1,0,1,0,0,0|1,0,1]=4 2613 B9R0.46 COC(=O)\C=C\C=C\C=O Amb18643494 [1,0,1,0,0,0|1,0,0]=3 2614 B9R0.46 COC(=O)\C=C\NCC=C Amb24479656 [1,0,1,0,0,0|1,0,1]=4 2615 B9R0.46 C\C=C\C\C=C\C(=O)OC Amb22346863 [1,0,1,0,0,0|0,0,2]=4 2616 B9R0.35 CCOC(=O)C(=C)CC=O Amb24722871 [1,0,1,0,0,0|1,0,1]=4 2617 B9R0.35 CCOC(=O)C(=C)NC=O Amb25840842 [1,0,1,0,0,0|2,0,0]=4 2618 B9R0.35 CCOC(=O)C(=O)CC=C Amb25315928 [1,0,1,0,0,0|1,0,1]=4 2619 B9R0.35 CCOC(=O)C(Br)=CC=O Amb25227659 [1,0,1,0,0,0|2,0,0]=4 2620 B9R0.35 CCOC(=O)C(Cl)=CC=O Amb24512560 [1,0,1,0,0,0|2,0,0]=4 2621 B9R0.35 CCOC(=O)C(F)=CC=O Amb25179801 [1,0,1,0,0,0|2,0,0]=4 2622 B9R0.35 CCOC(=O)\C(\Cl)=C\C=O Amb25730095 [1,0,1,0,0,0|2,0,0]=4 2623 B9R0.35 CCOC(=O)\C(\F)=C\C=O Amb25838712 [1,0,1,0,0,0|2,0,0]=4 2624 B9R0.35 C\C(=C\C=O)\C(=O)OCC Amb19516315 [1,0,1,0,0,0|1,0,1]=4 2625 B9R0.12 COC(=O)\C(=C\C=C)\C=O Amb24512884 [1,0,1,0,0,0|1,0,0]=3 2626 B9R0.12 COC(=O)\C(\CC=C)=C\Cl Amb24482337 [1,0,1,0,0,0|1,0,1]=4 2627 B9R0.12 COC(=O)\C(\CC=C)=C\O Amb25346134 [1,0,1,0,0,0|1,0,1]=4 2628 B9R0.12 COC(=O)\C(\CN)=C\C=C Amb18643728 [1,0,1,0,0,0|1,0,1]=4 2629 B9R0.12 COC(=O)\C(\CO)=C\C=C Amb25092063 [1,0,1,0,0,0|1,0,1]=4 2630 B9R0.37 CCOC(=O)\C(=C/O)\C=O Amb24524334 [1,0,1,0,0,0|2,0,0]=4 2631 B9R0.37 CCOC(=O)\C(=C/[O-])\C=O Amb22436469 [1,0,1,0,0,0|2,0,0]=4 2632 B9R1.6 C=C(F)c1ccccc1 Amb22738583 [2,0,0,0,0,0|1,0,1]=4 2633 B9R1.6 C=C([Zn+])c1ccccc1 Amb22228006 [2,0,0,0,0,0|1,0,1]=4 2634 B9R1.6 CC(=C)c1cc[n]cc1 Amb25126374 [2,0,0,0,0,0|2,0,0]=4 2635 B9R1.6 CC(=C)c1cccc[n]1 Amb25077592 [2,0,0,0,0,0|2,0,0]=4 2636 B9R1.6 CC(=C)c1ccccc1 Amb22338342 [2,0,0,0,0,0|1,0,0]=3 2637 B9R1.6 CC(=C)c1ccccc1 Amb22338444 [2,0,0,0,0,0|1,0,0]=3 2638 B9R1.6 CC(=N)c1cc[n]cc1 Amb24478617 [2,0,0,0,0,0|2,0,0]=4 2639 B9R1.6 CC(=N)c1ccc[n]c1 Amb22170296 [2,0,0,0,0,0|2,0,0]=4 2640 B9R1.6 CC(=O)C1=CC=CCS1 Amb24582465 [2,0,0,0,0,0|1,0,1]=4 2641 B9R1.6 CC(=O)C1C=CNC=C1 Amb24707722 [2,0,0,0,0,0|1,0,1]=4 2642 B9R1.6 CC(=O)C=1CCC=CC1 Amb22232236 [2,0,0,0,0,0|0,0,2]=4 2643 B9R1.6 CC(=O)C=1CNC=CC1 Amb25700322 [2,0,0,0,0,0|1,0,1]=4 2644 B9R1.6 CC(=O)[n+]1ccccc1 Amb24692607 [2,0,0,0,0,0|1,0,0]=3 2645 B9R1.6 CC(=O)c1cc[n][n]c1 Amb19958070 [2,0,0,0,0,0|2,0,0]=4 2646 B9R1.6 CC(=O)c1cc[n]c[n]1 Amb19959228 [2,0,0,0,0,0|2,0,0]=4 2647 B9R1.6 CC(=O)c1ccc[nH+]c1 Amb10552777 [2,0,0,0,0,0|1,0,0]=3 2648 B9R1.6 CC(=O)c1ccc[n][n]1 Amb20242017 [2,0,0,0,0,0|2,0,0]=4 2649 B9R1.6 CC(=O)c1cccc[nH+]1 Amb10552776 [2,0,0,0,0,0|1,0,0]=3 2650 B9R1.6 CC(C)c1ccccc1 Amb24052959 [2,0,0,0,0,0|1,0,1]=4 2651 B9R1.6 CC(F)c1ccccc1 Amb24555504 [2,0,0,0,0,0|1,0,1]=4 2652 B9R1.6 CC(I)c1ccccc1 Amb24064714 [2,0,0,0,0,0|1,0,1]=4 2653 B9R1.6 CC(c1ccccc1)[NH3+] Amb10560245 [2,0,0,0,0,0|1,0,1]=4 2654 B9R1.6 CN(C)c1ccccc1 Amb22040069 [2,0,0,0,0,0|2,0,0]=4 2655 B9R1.6 CN(N)c1ccccc1 Amb22346095 [2,0,0,0,0,0|2,0,0]=4 2656 B9R1.6 CN(N)c1ccccc1 Amb22754142 [2,0,0,0,0,0|2,0,0]=4 2657 B9R1.6 CN(c1ccccc1)N Amb1153615 [2,0,0,0,0,0|2,0,0]=4 2658 B9R1.6 CP(=O)c1ccccc1 Amb21858071 [2,0,0,0,0,0|1,0,0]=3 2659 B9R1.6 CP(C)c1ccccc1 Amb22369673 [2,0,0,0,0,0|2,0,0]=4 2660 B9R1.6 CP(C)c1ccccc1 Amb24325382 [2,0,0,0,0,0|2,0,0]=4 2661 B9R1.6 CP(Cl)c1ccccc1 Amb25837553 [2,0,0,0,0,0|2,0,0]=4 2662 B9R1.6 CS(=O)c1c[n]ccc1 Amb24102456 [2,0,0,0,0,0|2,0,0]=4 2663 B9R1.6 CS(=O)c1cc[n]cc1 Amb24103016 [2,0,0,0,0,0|2,0,0]=4 2664 B9R1.6 CS(=O)c1cccc[n]1 Amb24562247 [2,0,0,0,0,0|2,0,0]=4 2665 B9R1.6 C[13C](=O)c1ccccc1 Amb22337854 [2,0,0,0,0,0|0,0,0]=2 2666 B9R1.6 C[C@@H](Br)c1ccccc1 Amb25055693 [2,0,0,0,0,0|1,0,1]=4 2667 B9R1.6 C[C@@H](Cl)c1ccccc1 Amb25772789 [2,0,0,0,0,0|1,0,1]=4 2668 B9R1.6 C[C@@H](N)c1ccccc1 Amb22168000 [2,0,0,0,0,0|1,0,1]=4 2669 B9R1.6 C[C@H](Br)c1ccccc1 Amb24355307 [2,0,0,0,0,0|1,0,1]=4 2670 B9R1.6 C[C@H](Cl)c1ccccc1 Amb24391406 [2,0,0,0,0,0|1,0,1]=4 2671 B9R1.6 C[S@@](=O)c1ccccc1 Amb22747474 [2,0,0,0,0,0|1,0,0]=3 2672 B9R1.6 C[SiH](C)c1ccccc1 Amb19894005 [2,0,0,0,0,0|1,1,0]=4 2673 B9R1.6 C[Si](=O)c1ccccc1 Amb22053625 [2,0,0,0,0,0|0,1,0]=3 2674 B9R1.6 C[Te+](C)c1ccccc1 Amb22345602 [2,0,0,0,0,0|2,0,0]=4 2675 B9R1.6 ClS(=O)c1ccccc1 Amb13881360 [2,0,0,0,0,0|2,0,0]=4 2676 B9R1.6 FC(=O)c1ccccc1 Amb10607152 [2,0,0,0,0,0|1,0,0]=3 2677 B9R1.6 NC(=N)c1ccccc1 Amb10068704 [2,0,0,0,0,0|2,0,0]=4 2678 B9R1.6 NC(=N)c1ccccc1 Amb2371546 [2,0,0,0,0,0|2,0,0]=4 2679 B9R1.6 NC(=O)c1cc[n]cc1 Amb24066211 [2,0,0,0,0,0|2,0,0]=4 2680 B9R1.6 NC(=O)c1cccc[p]1 Amb25353307 [2,0,0,0,0,0|2,0,0]=4 2681 B9R1.6 NC(=O)c1ccccn1 Amb1219876 [2,0,0,0,0,0|2,0,0]=4 2682 B9R1.6 NC(=O)c1cccnc1 Amb16231206 [2,0,0,0,0,0|2,0,0]=4 2683 B9R1.6 N[13C](=O)c1ccccc1 Amb22351604 [2,0,0,0,0,0|1,0,0]=3 2684 B9R1.6 O=C(Br)c1cc[n]cc1 Amb24536581 [2,0,0,0,0,0|2,0,0]=4 2685 B9R1.6 O=C(Cl)c1cc[nH+]cc1 Amb21952993 [2,0,0,0,0,0|2,0,0]=4 2686 B9R1.6 O=C(Cl)c1cccc[n]1 Amb22492448 [2,0,0,0,0,0|2,0,0]=4 2687 B9R1.6 O=C(F)c1ccc[n]c1 Amb25146722 [2,0,0,0,0,0|2,0,0]=4 2688 B9R1.6 O=[13C](Cl)[13c]1[13cH][13cH][13cH][13cH][13cH]1 Amb22054407 [2,0,0,0,0,0|1,0,0]=3 2689 B9R1.6 O=[13C](Cl)c1ccccc1 Amb22167795 [2,0,0,0,0,0|1,0,0]=3 2690 B9R1.6 OB(O)c1ccccc1 Amb22587706 [2,0,0,0,0,0|1,0,1]=4 2691 B9R1.6 OC(=O)C1=CC=CCS1 Amb22831443 [2,0,0,0,0,0|1,0,1]=4 2692 B9R1.6 OC(=O)C1=COC=CO1 Amb25305603 [2,0,0,0,0,0|2,0,0]=4 2693 B9R1.6 OC(=O)C1C=CC=CN1 Amb24746571 [2,0,0,0,0,0|1,0,1]=4 2694 B9R1.6 OC(=O)C1C=CC=CO1 Amb18642363 [2,0,0,0,0,0|1,0,1]=4 2695 B9R1.6 OC(=O)C1C=CCC=C1 Amb17593268 [2,0,0,0,0,0|0,0,2]=4 2696 B9R1.6 OC(=O)C1C=CNC=C1 Amb24099560 [2,0,0,0,0,0|1,0,1]=4 2697 B9R1.6 OC(=O)C=1CC=CNC1 Amb25293556 [2,0,0,0,0,0|1,0,1]=4 2698 B9R1.6 OC(=O)C=1CNC=CC1 Amb25823057 [2,0,0,0,0,0|1,0,1]=4 2699 B9R1.6 OC(=O)[13c]1[13cH][13cH][13cH][13cH][13cH]1 Amb22054405 [2,0,0,0,0,0|0,0,0]=2 2700 B9R1.6 OC(=O)[13c]1ccccc1 Amb22353371 [2,0,0,0,0,0|0,0,0]=2 2701 B9R1.6 OC(=O)c1[n]ccc[n]1 Amb19330380 [2,0,0,0,0,0|2,0,0]=4 2702 B9R1.6 OC(=O)c1c[n]c[n]c1 Amb24099331 [2,0,0,0,0,0|2,0,0]=4 2703 B9R1.6 OC(=O)c1cc[13cH]cc1 Amb22367544 [2,0,0,0,0,0|0,0,0]=2 2704 B9R1.6 OC(=O)c1ccccc1 Amb16232256 [2,0,0,0,0,0|0,0,0]=2 2705 B9R1.6 OC(=O)c1ccccc1 Amb1935196 [2,0,0,0,0,0|0,0,0]=2 2706 B9R1.6 OC(=O)c1ccccc1 Amb22002523 [2,0,0,0,0,0|0,0,0]=2 2707 B9R1.6 OC(=O)c1ccccc1 Amb22279605 [2,0,0,0,0,0|0,0,0]=2 2708 B9R1.6 OC(=O)c1ccccc1 Amb22336602 [2,0,0,0,0,0|0,0,0]=2 2709 B9R1.6 OC(=O)c1ccccc1 Amb22338105 [2,0,0,0,0,0|0,0,0]=2 2710 B9R1.6 OC(=O)c1ccccc1 Amb22351742 [2,0,0,0,0,0|0,0,0]=2 2711 B9R1.6 OC(=O)c1ccccc1 Amb22472602 [2,0,0,0,0,0|0,0,0]=2 2712 B9R1.6 OC(=O)c1ccccc1 Amb22491636 [2,0,0,0,0,0|0,0,0]=2 2713 B9R1.6 OC(=O)c1ccccn1 Amb1227737 [2,0,0,0,0,0|1,0,0]=3 2714 B9R1.6 OC(=O)c1cccnc1 Amb1195995 [2,0,0,0,0,0|1,0,0]=3 2715 B9R1.6 OC(=O)c1ccncn1 Amb1102414 [2,0,0,0,0,0|2,0,0]=4 2716 B9R1.6 OC(=O)c1cnccn1 Amb2455963 [2,0,0,0,0,0|2,0,0]=4 2717 B9R1.6 OC(=O)c1cncnc1 Amb2455830 [2,0,0,0,0,0|2,0,0]=4 2718 B9R1.6 OC(=S)c1ccc[n]c1 Amb22731908 [2,0,0,0,0,0|1,1,0]=4 2719 B9R1.6 OC(=S)c1ccccc1 Amb17942862 [2,0,0,0,0,0|0,1,0]=3 2720 B9R1.6 OC(Br)c1ccccc1 Amb24693764 [2,0,0,0,0,0|1,0,1]=4 2721 B9R1.6 OC(Cl)c1ccccc1 Amb24480238 [2,0,0,0,0,0|1,0,1]=4 2722 B9R1.6 OC(P)c1ccccc1 Amb24448419 [2,0,0,0,0,0|1,0,1]=4 2723 B9R1.6 OP(=O)c1ccccc1 Amb10571098 [2,0,0,0,0,0|1,0,0]=3 2724 B9R1.6 OS(=O)c1c[n]ccc1 Amb24062548 [2,0,0,0,0,0|2,0,0]=4 2725 B9R1.6 OS(=O)c1cc[n]cc1 Amb24099594 [2,0,0,0,0,0|2,0,0]=4 2726 B9R1.6 OS(=O)c1ccccc1 Amb17939345 [2,0,0,0,0,0|1,0,0]=3 2727 B9R1.6 O[12C](=O)[12c]1[12cH][12cH][12cH][12cH][12cH]1 Amb22338193 [2,0,0,0,0,0|0,0,0]=2 2728 B9R1.6 O[13C](=O)[13c]1[13cH][13cH][13cH][13cH][13cH]1 Amb22367547 [2,0,0,0,0,0|0,0,0]=2 2729 B9R1.6 O[13C](=O)[13c]1[13cH][13cH][13cH]n[13cH]1 Amb17618353 [2,0,0,0,0,0|1,0,0]=3 2730 B9R1.6 O[13C](=O)c1ccccc1 Amb22338753 [2,0,0,0,0,0|0,0,0]=2 2731 B9R1.6 O[14C](=O)c1ccccc1 Amb22352700 [2,0,0,0,0,0|0,0,0]=2 2732 B9R1.6 O[C@H](Br)c1ccccc1 Amb25114797 [2,0,0,0,0,0|1,0,1]=4 2733 B9R1.6 S=C(Cl)c1ccccc1 Amb25294215 [2,0,0,0,0,0|1,1,0]=4 2734 B9R1.6 SC(=S)c1ccccc1 Amb22051683 [2,0,0,0,0,0|0,2,0]=4 2735 B9R1.6 [13CH3]C(=O)c1ccccc1 Amb22353264 [2,0,0,0,0,0|0,0,0]=2 2736 B9R1.6 [13CH3][13CH](O)c1ccccc1 Amb22363197 [2,0,0,0,0,0|0,0,2]=4 2737 B9R1.6 [13CH3][13C](=O)c1ccccc1 Amb22366852 [2,0,0,0,0,0|0,0,0]=2 2738 B9R1.6 [15NH2]C(=O)c1ccc[n]c1 Amb22367445 [2,0,0,0,0,0|2,0,0]=4 2739 B9R1.6 [15NH2]C(=O)c1ccccc1 Amb22366901 [2,0,0,0,0,0|1,0,0]=3 2740 B9R1.6 [2H]C(=C)c1ccccc1 Amb22337758 [2,0,0,0,0,0|1,0,1]=4 2741 B9R1.6 [2H]C(=O)c1ccccc1 Amb22043987 [2,0,0,0,0,0|1,0,0]=3 2742 B9R1.6 [2H][13C](=O)c1ccccc1 Amb22369001 [2,0,0,0,0,0|1,0,0]=3 2743 B9R1.6 [CH2-]C(=O)c1ccc[n]c1 Amb25692916 [2,0,0,0,0,0|1,0,1]=4 2744 B9R1.6 [O-]C(=O)c1cc[n]cc1 Amb22730239 [2,0,0,0,0,0|1,0,1]=4 2745 B9R1.6 [O-]C(=O)c1ccc[n]c1 Amb22043320 [2,0,0,0,0,0|1,0,1]=4 2746 B9R1.6 [O-]C(=O)c1cccc[n]1 Amb22058087 [2,0,0,0,0,0|1,0,1]=4 2747 B9R1.6 [O-]C(=O)c1cccc[n]1 Amb22411648 [2,0,0,0,0,0|1,0,1]=4 2748 B9R1.6 [O-]C(=O)c1cccc[n]1 Amb22734923 [2,0,0,0,0,0|1,0,1]=4 2749 B9R1.6 [O-]C(=O)c1ccccc1 Amb22053472 [2,0,0,0,0,0|0,0,1]=3 2750 B9R1.6 [O-]C(=O)c1ccccc1 Amb22053705 [2,0,0,0,0,0|0,0,1]=3 2751 B9R1.6 [O-]C(=O)c1ccccc1 Amb22167689 [2,0,0,0,0,0|0,0,1]=3 2752 B9R1.6 [O-]C(=O)c1ccccc1 Amb22168438 [2,0,0,0,0,0|0,0,1]=3 2753 B9R1.6 [O-]C(=O)c1ccccc1 Amb22168439 [2,0,0,0,0,0|0,0,1]=3 2754 B9R1.6 [O-]C(=O)c1ccccc1 Amb22351958 [2,0,0,0,0,0|0,0,1]=3 2755 B9R1.6 [O-]C(=O)c1ccccc1 Amb22353183 [2,0,0,0,0,0|0,0,1]=3 2756 B9R1.6 [O-]C(=O)c1ccccc1 Amb22732264 [2,0,0,0,0,0|0,0,1]=3 2757 B9R1.6 [O-]C(=O)c1ccccc1 Amb22732273 [2,0,0,0,0,0|0,0,1]=3 2758 B9R1.6 [O-]C(=O)c1ccccc1 Amb22732500 [2,0,0,0,0,0|0,0,1]=3 2759 B9R1.6 [O-]C(=O)c1ccccc1 Amb22734002 [2,0,0,0,0,0|0,0,1]=3 2760 B9R1.6 [O-]P(=O)c1ccccc1 Amb21618955 [2,0,0,0,0,0|1,0,1]=4 2761 B9R1.6 [O-]S(=O)c1ccccc1 Amb10790483 [2,0,0,0,0,0|1,0,1]=4 2762 B9R1.6 [O-]S(=O)c1ccccc1 Amb22043426 [2,0,0,0,0,0|1,0,1]=4 2763 B9R1.6 [O-]S(=O)c1ccccc1 Amb22053867 [2,0,0,0,0,0|1,0,1]=4 2764 B9R1.6 [O-]S(=O)c1ccccc1 Amb22352998 [2,0,0,0,0,0|1,0,1]=4 2765 B9R1.6 [O-][15N+](=O)c1ccccc1 Amb22351461 [2,0,0,0,0,0|1,0,1]=4 2766 B9R1.6 [O-][N+](=O)[13c]1[13cH][13cH][13cH][13cH][13cH]1 Amb22351475 [2,0,0,0,0,0|1,0,1]=4 2767 B9R1.6 [O-][N+](=O)c1ccccc1 Amb24061309 [2,0,0,0,0,0|1,0,1]=4 2768 B9R1.6 [O-][P](=O)c1ccccc1 Amb22731674 [2,0,0,0,0,0|1,0,1]=4 2769 B9R1.6 [S-]C(=O)c1ccccc1 Amb10555187 [2,0,0,0,0,0|0,1,0]=3 2770 B9R1.8 BrCNc1ccccc1 Amb25758335 [2,0,0,0,0,0|2,0,0]=4 2771 B9R1.8 Br\C=C/c1ccccc1 Amb24117456 [2,0,0,0,0,0|1,0,1]=4 2772 B9R1.8 C=COc1ccccc1 Amb10564213 [2,0,0,0,0,0|0,0,2]=4 2773 B9R1.8 CCC[n+]1ccccc1 Amb24325390 [2,0,0,0,0,0|1,0,1]=4 2774 B9R1.8 CCCc1ccccc1 Amb2447143 [2,0,0,0,0,0|0,0,1]=3 2775 B9R1.8 CCNc1ccccc1 Amb22731692 [2,0,0,0,0,0|1,0,0]=3 2776 B9R1.8 CCOc1[n]ccc[n]1 Amb22498694 [2,0,0,0,0,0|2,0,0]=4 2777 B9R1.8 CCOc1c[n][n]cc1 Amb22500251 [2,0,0,0,0,0|2,0,0]=4 2778 B9R1.8 CCOc1c[n]c[n]c1 Amb23412498 [2,0,0,0,0,0|2,0,0]=4 2779 B9R1.8 CCOc1cc[n]c[n]1 Amb24091512 [2,0,0,0,0,0|2,0,0]=4 2780 B9R1.8 CCOc1ccc[n][n]1 Amb19958352 [2,0,0,0,0,0|2,0,0]=4 2781 B9R1.8 CCOc1cccnc1 Amb10573342 [2,0,0,0,0,0|1,0,0]=3 2782 B9R1.8 CNNc1ccccc1 Amb20242875 [2,0,0,0,0,0|2,0,0]=4 2783 B9R1.8 CNSc1ccccc1 Amb25811332 [2,0,0,0,0,0|1,1,0]=4 2784 B9R1.8 COC[n+]1ccccc1 Amb25309455 [2,0,0,0,0,0|1,0,1]=4 2785 B9R1.8 COCc1c[n]ccc1 Amb24106446 [2,0,0,0,0,0|1,0,1]=4 2786 B9R1.8 COCc1cc[n]cc1 Amb24075931 [2,0,0,0,0,0|1,0,1]=4 2787 B9R1.8 CONc1c[n]ccc1 Amb25347084 [2,0,0,0,0,0|2,0,0]=4 2788 B9R1.8 COPc1ccccc1 Amb22729661 [2,0,0,0,0,0|1,0,0]=3 2789 B9R1.8 C[NH2+]Cc1ccccc1 Amb20648430 [2,0,0,0,0,0|1,0,1]=4 2790 B9R1.8 C\C=C/c1c[n]ccc1 Amb25147168 [2,0,0,0,0,0|1,0,1]=4 2791 B9R1.8 C\C=C/c1cc[n]cc1 Amb25064785 [2,0,0,0,0,0|1,0,1]=4 2792 B9R1.8 C\C=C\[n+]1ccccc1 Amb22485619 [2,0,0,0,0,0|1,0,1]=4 2793 B9R1.8 C\C=C\c1c[n]ccc1 Amb25290985 [2,0,0,0,0,0|1,0,1]=4 2794 B9R1.8 C\N=C/c1cccc[n]1 Amb25337459 [2,0,0,0,0,0|2,0,0]=4 2795 B9R1.8 C\N=C\c1c[n]ccc1 Amb21962079 [2,0,0,0,0,0|2,0,0]=4 2796 B9R1.8 C\N=C\c1cc[n]cc1 Amb22330508 [2,0,0,0,0,0|2,0,0]=4 2797 B9R1.8 C\N=C\c1cccc[n]1 Amb24553183 [2,0,0,0,0,0|2,0,0]=4 2798 B9R1.8 ClCNc1ccccc1 Amb25836772 [2,0,0,0,0,0|2,0,0]=4 2799 B9R1.8 ClCOc1c[n]ccc1 Amb25780203 [2,0,0,0,0,0|2,0,0]=4 2800 B9R1.8 ClCOc1ccccc1 Amb22059503 [2,0,0,0,0,0|1,0,0]=3 2801 B9R1.8 ClCPc1ccccc1 Amb25294535 [2,0,0,0,0,0|2,0,0]=4 2802 B9R1.8 ClC[SiH2]c1ccccc1 Amb22230170 [2,0,0,0,0,0|1,1,0]=4 2803 B9R1.8 Cl\C=C\c1ccccc1 Amb10572872 [2,0,0,0,0,0|1,0,1]=4 2804 B9R1.8 FCOc1ccccc1 Amb24099991 [2,0,0,0,0,0|1,0,0]=3 2805 B9R1.8 F\C=C\c1ccccc1 Amb22641699 [2,0,0,0,0,0|1,0,1]=4 2806 B9R1.8 I\C=C\c1ccccc1 Amb24646418 [2,0,0,0,0,0|1,0,1]=4 2807 B9R1.8 N#COc1ccccc1 Amb15692860 [2,0,0,0,0,0|1,0,1]=4 2808 B9R1.8 NCCc1ccccc1 Amb17772283 [2,0,0,0,0,0|1,0,1]=4 2809 B9R1.8 NCCc1ccccc1 Amb17843439 [2,0,0,0,0,0|1,0,1]=4 2810 B9R1.8 NCCc1ccccc1 Amb22360716 [2,0,0,0,0,0|1,0,1]=4 2811 B9R1.8 NCCc1ccccc1 Amb24325112 [2,0,0,0,0,0|1,0,1]=4 2812 B9R1.8 NCCc1ccccc1 Amb24325408 [2,0,0,0,0,0|1,0,1]=4 2813 B9R1.8 NCNc1ccccc1 Amb17117015 [2,0,0,0,0,0|2,0,0]=4 2814 B9R1.8 NCOc1ccccc1 Amb25128781 [2,0,0,0,0,0|1,0,0]=3 2815 B9R1.8 NCSc1ccccc1 Amb25128061 [2,0,0,0,0,0|1,1,0]=4 2816 B9R1.8 NC[13CH2]c1ccccc1 Amb22367506 [2,0,0,0,0,0|1,0,1]=4 2817 B9R1.8 NOCc1ccccc1 Amb1154307 [2,0,0,0,0,0|1,0,1]=4 2818 B9R1.8 NOCc1ccccc1 Amb16204809 [2,0,0,0,0,0|1,0,1]=4 2819 B9R1.8 NOCc1ccccc1 Amb22489499 [2,0,0,0,0,0|1,0,1]=4 2820 B9R1.8 N[13CH2][13CH2]c1ccccc1 Amb22367507 [2,0,0,0,0,0|1,0,1]=4 2821 B9R1.8 N\N=C\c1ccccc1 Amb2539422 [2,0,0,0,0,0|2,0,0]=4 2822 B9R1.8 O=C=Cc1ccccc1 Amb25348365 [2,0,0,0,0,0|1,0,1]=4 2823 B9R1.8 O=COc1ccccc1 Amb22002710 [2,0,0,0,0,0|1,0,1]=4 2824 B9R1.8 OCOc1ccccc1 Amb25847006 [2,0,0,0,0,0|1,0,0]=3 2825 B9R1.8 O\N=C\c1ccccc1 Amb2223191 [2,0,0,0,0,0|2,0,0]=4 2826 B9R1.8 S=C=Cc1ccccc1 Amb24084687 [2,0,0,0,0,0|1,0,1]=4 2827 B9R1.8 [2H]\C=C/c1ccccc1 Amb22338396 [2,0,0,0,0,0|1,0,1]=4 2828 B9R1.8 [2H]\C=C\c1ccccc1 Amb22351848 [2,0,0,0,0,0|1,0,1]=4 2829 B9R1.8 [CH2-]\C=C\c1ccccc1 Amb22748801 [2,0,0,0,0,0|0,0,2]=4 2830 B9R1.8 [N-]=[N+]=Cc1ccccc1 Amb15692850 [2,0,0,0,0,0|2,0,0]=4 2831 B9R1.8 [NH3+]CCc1ccccc1 Amb17843435 [2,0,0,0,0,0|1,0,1]=4 2832 B11R0.4 CCC\C=C/C=C/C(=O)OCC Amb10067180 [0,1,1,0,0,0|0,0,2]=4 2833 B11R0.4 CCOC(=O)C\C=C\C=C\C=C Amb17618812 [0,1,1,0,0,0|0,0,0]=2 2834 B11R0.4 CCOC(=O)N\C=C/C=CC#N Amb24497095 [0,1,1,0,0,0|1,0,1]=4 2835 B11R1.7 CCC(F)(F)c1ccccc1 Amb20670157 [1,1,0,0,0,0|1,0,1]=4 2836 B11R1.7 CCC(N)(O)c1ccccc1 Amb24756540 [1,1,0,0,0,0|0,0,2]=4 2837 B11R1.7 CC[Si](Cl)(Cl)c1ccccc1 Amb19893874 [1,1,0,0,0,0|1,1,0]=4 2838 B11R1.7 CN=[S@@](C)(=O)c1ccccc1 Amb22800519 [1,1,0,0,0,0|2,0,0]=4 2839 B11R1.7 CNS(=O)(=O)c1ccccc1 Amb1152097 [1,1,0,0,0,0|2,0,0]=4 2840 B11R1.7 CNS(C)(=O)c1ccccc1 Amb17836794 [1,1,0,0,0,0|2,0,0]=4 2841 B11R1.7 COC(O)(O)c1ccccc1 Amb22749915 [1,1,0,0,0,0|0,0,2]=4 2842 B11R1.7 COS(=O)(=O)c1c[n]ccc1 Amb24466050 [1,1,0,0,0,0|2,0,0]=4 2843 B11R1.7 CO[Si](C)(C)c1ccccc1 Amb22047319 [1,1,0,0,0,0|1,1,0]=4 2844 B11R1.7 CP(=O)(CO)c1ccccc1 Amb24675382 [1,1,0,0,0,0|2,0,0]=4 2845 B11R1.7 ClCS(=O)(=O)c1ccccc1 Amb1158067 [1,1,0,0,0,0|2,0,0]=4 2846 B11R1.7 N=S(=O)(CCl)c1ccccc1 Amb25362285 [1,1,0,0,0,0|2,0,0]=4 2847 B11R1.7 O=P(Cl)(CCl)c1ccccc1 Amb22831089 [1,1,0,0,0,0|2,0,0]=4 2848 B11R1.7 O=S(=O)(CBr)c1ccccc1 Amb22353468 [1,1,0,0,0,0|2,0,0]=4 2849 B11R1.7 O=S(=S)(O[Na])c1ccccc1 Amb22338687 [1,1,0,0,0,0|2,0,0]=4 2850 B11R1.7 OCS(=O)(=O)c1ccccc1 Amb25802022 [1,1,0,0,0,0|2,0,0]=4 2851 B11R1.7 OP(=O)(CCl)c1ccccc1 Amb24440175 [1,1,0,0,0,0|2,0,0]=4 2852 B11R1.7 OP(=O)(CS)c1ccccc1 Amb24599412 [1,1,0,0,0,0|2,0,0]=4 2853 B11R1.7 [2H]C(C)(OC)c1ccccc1 Amb22365991 [1,1,0,0,0,0|1,0,1]=4 2854 B11R1.12 BrC\C(=N/O)\c1ccccc1 Amb1047358 [1,1,0,0,0,0|1,0,1]=4 2855 B11R1.12 C=C=C(CN)c1ccccc1 Amb25791349 [1,1,0,0,0,0|2,0,0]=4 2856 B11R1.12 C=C=C(CO)c1ccccc1 Amb24362821 [1,1,0,0,0,0|2,0,0]=4 2857 B11R1.12 CCC(C=C)c1ccccc1 Amb24485761 [1,1,0,0,0,0|1,0,1]=4 2858 B11R1.12 CCC(NC)c1ccccc1 Amb22492401 [1,1,0,0,0,0|1,0,1]=4 2859 B11R1.12 CCC(SC)c1ccccc1 Amb24484978 [1,1,0,0,0,0|0,1,1]=4 2860 B11R1.12 CCC(c1ccccc1)C=O Amb17138422 [1,1,0,0,0,0|0,0,1]=3 2861 B11R1.12 CCC(c1ccccc1)CBr Amb17241352 [1,1,0,0,0,0|1,0,1]=4 2862 B11R1.12 CCC(c1ccccc1)CN Amb2371100 [1,1,0,0,0,0|1,0,1]=4 2863 B11R1.12 CCC(c1ccccc1)NC Amb1116786 [1,1,0,0,0,0|1,0,1]=4 2864 B11R1.12 CCC(c1ccccc1)NO Amb10605010 [1,1,0,0,0,0|0,0,2]=4 2865 B11R1.12 CCN(C#N)c1ccccc1 Amb25759456 [1,1,0,0,0,0|2,0,0]=4 2866 B11R1.12 CCN(C=O)c1cc[n]cc1 Amb25330483 [1,1,0,0,0,0|2,0,0]=4 2867 B11R1.12 CCN(C=O)c1cccc[n]1 Amb24096603 [1,1,0,0,0,0|2,0,0]=4 2868 B11R1.12 CCN(C=O)c1ccccc1 Amb17672982 [1,1,0,0,0,0|1,0,0]=3 2869 B11R1.12 CCN(CO)c1ccccc1 Amb20621228 [1,1,0,0,0,0|1,0,1]=4 2870 B11R1.12 CCN(c1ccccc1)CC Amb10072363 [1,1,0,0,0,0|2,0,0]=4 2871 B11R1.12 CCN(c1ccccc1)N=O Amb17618581 [1,1,0,0,0,0|1,0,0]=3 2872 B11R1.12 CCP(CO)c1ccccc1 Amb25822323 [1,1,0,0,0,0|1,0,1]=4 2873 B11R1.12 CC[C@@H](CCl)c1ccccc1 Amb25250668 [1,1,0,0,0,0|1,0,1]=4 2874 B11R1.12 CC[C@@H](CN)c1ccccc1 Amb22746798 [1,1,0,0,0,0|1,0,1]=4 2875 B11R1.12 CC[C@@H](NO)c1ccccc1 Amb25303906 [1,1,0,0,0,0|0,0,2]=4 2876 B11R1.12 CC[C@H](C=O)c1ccccc1 Amb25731916 [1,1,0,0,0,0|0,0,1]=3 2877 B11R1.12 CC[C@H](CO)c1ccccc1 Amb25684561 [1,1,0,0,0,0|0,0,2]=4 2878 B11R1.12 CC\C(=C/Cl)\c1ccccc1 Amb24373905 [1,1,0,0,0,0|1,0,0]=3 2879 B11R1.12 CC\C(=C\Cl)\c1ccccc1 Amb25227191 [1,1,0,0,0,0|1,0,0]=3 2880 B11R1.12 CC\C(=N\N)\c1ccccc1 Amb24396664 [1,1,0,0,0,0|1,0,0]=3 2881 B11R1.12 CC\C(=N\O)\c1cc[n]cc1 Amb24100300 [1,1,0,0,0,0|1,0,1]=4 2882 B11R1.12 CC\C(=N\O)\c1cccc[n]1 Amb24100299 [1,1,0,0,0,0|1,0,1]=4 2883 B11R1.12 CN=C(NN)c1ccccc1 Amb22447540 [1,1,0,0,0,0|2,0,0]=4 2884 B11R1.12 CN\C(=N\O)\c1ccccc1 Amb25293329 [1,1,0,0,0,0|1,0,1]=4 2885 B11R1.12 COB(OC)c1ccccc1 Amb24103414 [1,1,0,0,0,0|1,0,1]=4 2886 B11R1.12 COC(=C=O)c1c[n]ccc1 Amb24084533 [1,1,0,0,0,0|1,0,0]=3 2887 B11R1.12 COC(=C=O)c1cccc[n]1 Amb24084532 [1,1,0,0,0,0|1,0,0]=3 2888 B11R1.12 COC(C#C)c1ccccc1 Amb25242698 [1,1,0,0,0,0|1,0,1]=4 2889 B11R1.12 COC(C=C)c1ccccc1 Amb22002227 [1,1,0,0,0,0|1,0,1]=4 2890 B11R1.12 COC(C=O)c1cccc[n]1 Amb25364326 [1,1,0,0,0,0|1,0,1]=4 2891 B11R1.12 COC(C=O)c1ccccc1 Amb18125121 [1,1,0,0,0,0|0,0,1]=3 2892 B11R1.12 COC(CBr)c1ccccc1 Amb24079930 [1,1,0,0,0,0|1,0,1]=4 2893 B11R1.12 COC(CCl)c1ccccc1 Amb17674030 [1,1,0,0,0,0|1,0,1]=4 2894 B11R1.12 CO[C+](OC)c1ccccc1 Amb25369960 [1,1,0,0,0,0|0,0,2]=4 2895 B11R1.12 CO[C@@H](C=O)c1ccccc1 Amb25252891 [1,1,0,0,0,0|0,0,1]=3 2896 B11R1.12 CO[C@@H](CO)c1ccccc1 Amb21617903 [1,1,0,0,0,0|0,0,2]=4 2897 B11R1.12 CO[C@H](CBr)c1ccccc1 Amb24760200 [1,1,0,0,0,0|1,0,1]=4 2898 B11R1.12 CO\C(=C\Cl)\c1ccccc1 Amb24710342 [1,1,0,0,0,0|1,0,0]=3 2899 B11R1.12 CSC(C=O)c1ccccc1 Amb18646623 [1,1,0,0,0,0|0,1,1]=4 2900 B11R1.12 CS\C(=C\Cl)\c1ccccc1 Amb24511893 [1,1,0,0,0,0|1,1,0]=4 2901 B11R1.12 C\C=C(/C=O)\c1cc[n]cc1 Amb24418258 [1,1,0,0,0,0|1,0,1]=4 2902 B11R1.12 C\C=C(/C=O)\c1ccccc1 Amb18644269 [1,1,0,0,0,0|0,0,1]=3 2903 B11R1.12 C\C=C(/CBr)\c1ccccc1 Amb24356608 [1,1,0,0,0,0|1,0,1]=4 2904 B11R1.12 C\C=C(/CC)\c1cccc[n]1 Amb24101962 [1,1,0,0,0,0|2,0,0]=4 2905 B11R1.12 C\C=C(\C#N)/c1ccccc1 Amb24595488 [1,1,0,0,0,0|1,0,1]=4 2906 B11R1.12 C\C=C(\C=O)/c1cc[n]cc1 Amb24588747 [1,1,0,0,0,0|1,0,1]=4 2907 B11R1.12 C\C=C(\C=O)/c1ccccc1 Amb20242407 [1,1,0,0,0,0|0,0,1]=3 2908 B11R1.12 C\C=C(\CC)/c1cccc[n]1 Amb25152130 [1,1,0,0,0,0|2,0,0]=4 2909 B11R1.12 C\C=C(\CO)/c1ccccc1 Amb25084503 [1,1,0,0,0,0|0,0,2]=4 2910 B11R1.12 C\C=C(\c1ccccc1)/C#N Amb17231965 [1,1,0,0,0,0|1,0,1]=4 2911 B11R1.12 ClC\C(=N\O)\c1ccccc1 Amb10569199 [1,1,0,0,0,0|1,0,1]=4 2912 B11R1.12 Cl\C=C(/CCl)\c1ccccc1 Amb24426186 [1,1,0,0,0,0|2,0,0]=4 2913 B11R1.12 Cl\C=C(/c1ccccc1)\C=O Amb17594154 [1,1,0,0,0,0|1,0,1]=4 2914 B11R1.12 NCC(c1ccccc1)OC Amb10609834 [1,1,0,0,0,0|1,0,1]=4 2915 B11R1.12 NC\C(=C/Br)\c1ccccc1 Amb24401627 [1,1,0,0,0,0|2,0,0]=4 2916 B11R1.12 NC\C(=C\F)\c1ccccc1 Amb24538168 [1,1,0,0,0,0|2,0,0]=4 2917 B11R1.12 NC\C(=N/O)\c1ccccc1 Amb10606191 [1,1,0,0,0,0|1,0,1]=4 2918 B11R1.12 NC\C(=N\O)\c1ccccc1 Amb25368564 [1,1,0,0,0,0|1,0,1]=4 2919 B11R1.12 N\C=C(/C=O)\c1ccccc1 Amb24468220 [1,1,0,0,0,0|1,0,1]=4 2920 B11R1.12 N\C=C(\C=O)/c1ccccc1 Amb25103676 [1,1,0,0,0,0|1,0,1]=4 2921 B11R1.12 N\N=C(\CO)/c1ccccc1 Amb25032443 [1,1,0,0,0,0|2,0,0]=4 2922 B11R1.12 O=CC(CF)c1ccccc1 Amb25243376 [1,1,0,0,0,0|1,0,1]=4 2923 B11R1.12 O=CN(CCl)c1ccccc1 Amb24619702 [1,1,0,0,0,0|2,0,0]=4 2924 B11R1.12 O=C\C(=C/Br)\c1ccccc1 Amb25778114 [1,1,0,0,0,0|1,0,1]=4 2925 B11R1.12 O=C\C(=C/S)\c1ccccc1 Amb18126408 [1,1,0,0,0,0|1,0,1]=4 2926 B11R1.12 O=C\C(=C\Br)\c1ccccc1 Amb24634608 [1,1,0,0,0,0|1,0,1]=4 2927 B11R1.12 OCC([C+]=O)c1ccccc1 Amb22231741 [1,1,0,0,0,0|1,0,1]=4 2928 B11R1.12 OCC([C+]=O)c1ccccc1 Amb22232765 [1,1,0,0,0,0|1,0,1]=4 2929 B11R1.12 OC[C@H](c1ccccc1)OC Amb10807423 [1,1,0,0,0,0|0,0,2]=4 2930 B11R1.12 OC\C(=C\Cl)\c1ccccc1 Amb25179241 [1,1,0,0,0,0|2,0,0]=4 2931 B11R1.12 OC\C(=N\O)\c1ccccc1 Amb25133838 [1,1,0,0,0,0|1,0,1]=4 2932 B11R1.12 O\C=C(\C=O)/c1ccccc1 Amb25092916 [1,1,0,0,0,0|1,0,1]=4 2933 B11R1.12 O\C=C(\c1ccccc1)/C=O Amb10576572 [1,1,0,0,0,0|1,0,1]=4 2934 B11R1.12 O\N=C(\CBr)/c1ccccc1 Amb22489773 [1,1,0,0,0,0|1,0,1]=4 2935 B11R1.22 BrCC(=O)c1ccc(cc1)C Amb1981331 [1,1,0,0,0,0|1,0,0]=3 2936 B11R1.22 BrCC(=O)c1ccc(cc1)Cl Amb2505006 [1,1,0,0,0,0|1,0,0]=3 2937 B11R1.22 BrCC(=O)c1ccc(cc1)F Amb1885038 [1,1,0,0,0,0|1,0,0]=3 2938 B11R1.22 C#CC(=O)c1ccc(Cl)cc1 Amb25720663 [1,1,0,0,0,0|0,0,2]=4 2939 B11R1.22 C#CC(=O)c1ccc(F)cc1 Amb24447227 [1,1,0,0,0,0|0,0,2]=4 2940 B11R1.22 C#CC(=O)c1ccc(I)cc1 Amb25106761 [1,1,0,0,0,0|0,0,2]=4 2941 B11R1.22 C#CC(=O)c1ccc(N)cc1 Amb24488157 [1,1,0,0,0,0|0,0,2]=4 2942 B11R1.22 C=C(CBr)c1ccc(Br)cc1 Amb25148237 [1,1,0,0,0,0|2,0,0]=4 2943 B11R1.22 C=C(CCl)c1ccc(F)cc1 Amb25279495 [1,1,0,0,0,0|2,0,0]=4 2944 B11R1.22 C=C(CN)c1ccc(Br)cc1 Amb25121108 [1,1,0,0,0,0|2,0,0]=4 2945 B11R1.22 C=C(CN)c1ccc(Cl)cc1 Amb18908725 [1,1,0,0,0,0|2,0,0]=4 2946 B11R1.22 C=C(CN)c1ccc(F)cc1 Amb18125278 [1,1,0,0,0,0|2,0,0]=4 2947 B11R1.22 C=C(CN)c1ccc(I)cc1 Amb25163247 [1,1,0,0,0,0|2,0,0]=4 2948 B11R1.22 C=CC(=O)c1ccc(Br)cc1 Amb18066306 [1,1,0,0,0,0|0,0,2]=4 2949 B11R1.22 C=CC(=O)c1ccc(Cl)cc1 Amb18563779 [1,1,0,0,0,0|0,0,2]=4 2950 B11R1.22 C=CC(=O)c1ccc(F)cc1 Amb18065313 [1,1,0,0,0,0|0,0,2]=4 2951 B11R1.22 C=CC(=O)c1ccc(I)cc1 Amb24567537 [1,1,0,0,0,0|0,0,2]=4 2952 B11R1.22 C=CC(=O)c1ccc(O)cc1 Amb24121488 [1,1,0,0,0,0|0,0,2]=4 2953 B11R1.22 CC=1C=CN(CC1)C(=O)OC Amb24060040 [1,1,0,0,0,0|1,0,1]=4 2954 B11R1.22 CCC(=C)c1ccc(Br)cc1 Amb20668394 [1,1,0,0,0,0|1,0,0]=3 2955 B11R1.22 CCC(=C)c1ccc(F)c[n]1 Amb25343130 [1,1,0,0,0,0|2,0,0]=4 2956 B11R1.22 CCC(=O)N1C=CC(=O)C=C1 Amb25838673 [1,1,0,0,0,0|1,0,0]=3 2957 B11R1.22 CCC(=O)c1[n]cc(Br)c[n]1 Amb22236248 [1,1,0,0,0,0|2,0,0]=4 2958 B11R1.22 CCC(=O)c1ccc(Br)[n]c1 Amb23446252 [1,1,0,0,0,0|1,0,0]=3 2959 B11R1.22 CCC(=O)c1ccc(F)c[n]1 Amb25759749 [1,1,0,0,0,0|1,0,0]=3 2960 B11R1.22 CCC(=O)c1ccc(I)[n]c1 Amb23446977 [1,1,0,0,0,0|1,0,0]=3 2961 B11R1.22 CCC(=O)c1ccc(N)[n]c1 Amb23446324 [1,1,0,0,0,0|1,0,0]=3 2962 B11R1.22 CCC(=O)c1ccc(O)[n]c1 Amb23446708 [1,1,0,0,0,0|1,0,0]=3 2963 B11R1.22 CCC(=O)c1ccc(O)c[n]1 Amb25028212 [1,1,0,0,0,0|1,0,0]=3 2964 B11R1.22 CCC(=O)c1ccc(S)[n]c1 Amb23446721 [1,1,0,0,0,0|1,0,0]=3 2965 B11R1.22 CCC(=O)c1ccc(S)cc1 Amb25273108 [1,1,0,0,0,0|0,0,0]=2 2966 B11R1.22 CCC(=O)c1ccc(cc1)O Amb1336085 [1,1,0,0,0,0|0,0,0]=2 2967 B11R1.22 CCC(=S)c1ccc(O)cc1 Amb25258595 [1,1,0,0,0,0|0,1,0]=3 2968 B11R1.22 CCC(C)c1ccc(Cl)cc1 Amb25715889 [1,1,0,0,0,0|1,0,1]=4 2969 B11R1.22 CCC(N)c1ccc(Cl)cc1 Amb22904363 [1,1,0,0,0,0|1,0,1]=4 2970 B11R1.22 CCC(N)c1ccc(F)cc1 Amb21955200 [1,1,0,0,0,0|1,0,1]=4 2971 B11R1.22 CCC(N)c1ccc(I)cc1 Amb24695228 [1,1,0,0,0,0|1,0,1]=4 2972 B11R1.22 CCC(N)c1ccc(N)cc1 Amb24102643 [1,1,0,0,0,0|1,0,1]=4 2973 B11R1.22 CCC(c1ccc(cc1)Br)N Amb1106008 [1,1,0,0,0,0|1,0,1]=4 2974 B11R1.22 CCC(c1ccc(cc1)Br)O Amb1110057 [1,1,0,0,0,0|0,0,2]=4 2975 B11R1.22 CCC(c1ccc(cc1)C)N Amb10778749 [1,1,0,0,0,0|1,0,1]=4 2976 B11R1.22 CCC(c1ccc(cc1)C)O Amb1110039 [1,1,0,0,0,0|0,0,2]=4 2977 B11R1.22 CCC(c1ccc(cc1)Cl)N Amb1995281 [1,1,0,0,0,0|1,0,1]=4 2978 B11R1.22 CCC(c1ccc(cc1)Cl)O Amb1109844 [1,1,0,0,0,0|0,0,2]=4 2979 B11R1.22 CCC(c1ccc(cc1)F)N Amb1108504 [1,1,0,0,0,0|1,0,1]=4 2980 B11R1.22 CCC(c1ccc(cc1)F)O Amb1111265 [1,1,0,0,0,0|0,0,2]=4 2981 B11R1.22 CCC(c1ccc(cc1)O)N Amb1117697 [1,1,0,0,0,0|1,0,1]=4 2982 B11R1.22 CCC(c1ccc(cc1)O)N Amb17622108 [1,1,0,0,0,0|1,0,1]=4 2983 B11R1.22 CCC(c1ccc(cc1)O)O Amb1111179 [1,1,0,0,0,0|0,0,2]=4 2984 B11R1.22 CCN(O)c1ccc(N)cc1 Amb24538174 [1,1,0,0,0,0|1,0,1]=4 2985 B11R1.22 CCS(=O)c1ccc(Br)c[n]1 Amb25152177 [1,1,0,0,0,0|2,0,0]=4 2986 B11R1.22 CCS(=O)c1ccc(F)cc1 Amb25771877 [1,1,0,0,0,0|1,0,0]=3 2987 B11R1.22 CCS(=O)c1ccc(N)cc1 Amb18284277 [1,1,0,0,0,0|1,0,0]=3 2988 B11R1.22 CC[C@@H](C)c1ccc(N)cc1 Amb24103200 [1,1,0,0,0,0|1,0,1]=4 2989 B11R1.22 CC[C@@H](N)c1ccc(Br)cc1 Amb23440385 [1,1,0,0,0,0|1,0,1]=4 2990 B11R1.22 CC[C@@H](N)c1ccc(Cl)cc1 Amb22288632 [1,1,0,0,0,0|1,0,1]=4 2991 B11R1.22 CC[C@@H](N)c1ccc(Cl)cc1 Amb22747472 [1,1,0,0,0,0|1,0,1]=4 2992 B11R1.22 CC[C@@H](N)c1ccc(F)cc1 Amb22298536 [1,1,0,0,0,0|1,0,1]=4 2993 B11R1.22 CC[C@@H](N)c1ccc(I)cc1 Amb25364125 [1,1,0,0,0,0|1,0,1]=4 2994 B11R1.22 CC[C@@H](N)c1ccc(O)cc1 Amb25247808 [1,1,0,0,0,0|1,0,1]=4 2995 B11R1.22 CC[C@@H](N)c1ccc(S)cc1 Amb25295395 [1,1,0,0,0,0|1,0,1]=4 2996 B11R1.22 CC[C@@H](O)c1ccc(Br)cc1 Amb20241514 [1,1,0,0,0,0|0,0,2]=4 2997 B11R1.22 CC[C@@H](O)c1ccc(Cl)cc1 Amb20240761 [1,1,0,0,0,0|0,0,2]=4 2998 B11R1.22 CC[C@@H](O)c1ccc(F)cc1 Amb20240757 [1,1,0,0,0,0|0,0,2]=4 2999 B11R1.22 CC[C@@H](O)c1ccc(I)cc1 Amb25204389 [1,1,0,0,0,0|0,0,2]=4 3000 B11R1.22 CC[C@@H](O)c1ccc(O)cc1 Amb25345214 [1,1,0,0,0,0|0,0,2]=4 3001 B11R1.22 CC[C@H](N)c1ccc(Br)cc1 Amb24718653 [1,1,0,0,0,0|1,0,1]=4 3002 B11R1.22 CC[C@H](N)c1ccc(Cl)cc1 Amb22288689 [1,1,0,0,0,0|1,0,1]=4 3003 B11R1.22 CC[C@H](N)c1ccc(Cl)cc1 Amb25848651 [1,1,0,0,0,0|1,0,1]=4 3004 B11R1.22 CC[C@H](N)c1ccc(F)cc1 Amb22298579 [1,1,0,0,0,0|1,0,1]=4 3005 B11R1.22 CC[C@H](N)c1ccc(F)cc1 Amb24477560 [1,1,0,0,0,0|1,0,1]=4 3006 B11R1.22 CC[C@H](N)c1ccc(N)cc1 Amb25368363 [1,1,0,0,0,0|1,0,1]=4 3007 B11R1.22 CC[C@H](N)c1ccc(O)cc1 Amb24758224 [1,1,0,0,0,0|1,0,1]=4 3008 B11R1.22 CC[C@H](O)c1ccc(Cl)cc1 Amb19889432 [1,1,0,0,0,0|0,0,2]=4 3009 B11R1.22 CC[C@H](O)c1ccc(I)cc1 Amb25732463 [1,1,0,0,0,0|0,0,2]=4 3010 B11R1.22 CN(CC)c1ccc(Cl)cc1 Amb24066026 [1,1,0,0,0,0|2,0,0]=4 3011 B11R1.22 CN(CC)c1ccc(F)cc1 Amb25163174 [1,1,0,0,0,0|2,0,0]=4 3012 B11R1.22 CN(CC)c1ccc(I)cc1 Amb25681250 [1,1,0,0,0,0|2,0,0]=4 3013 B11R1.22 CN=C(N)c1ccc(F)cc1 Amb24070278 [1,1,0,0,0,0|2,0,0]=4 3014 B11R1.22 CN=C(N)c1ccc(N)cc1 Amb24091300 [1,1,0,0,0,0|2,0,0]=4 3015 B11R1.22 CNC(=N)c1ccc(Cl)cc1 Amb24415099 [1,1,0,0,0,0|2,0,0]=4 3016 B11R1.22 CNC(=N)c1ccc(O)cc1 Amb18125142 [1,1,0,0,0,0|2,0,0]=4 3017 B11R1.22 CNC(=O)C1=CNC(=O)C=C1 Amb18799400 [1,1,0,0,0,0|2,0,0]=4 3018 B11R1.22 CNC(=O)c1ccc(Br)[n]c1 Amb19959847 [1,1,0,0,0,0|2,0,0]=4 3019 B11R1.22 CNC(=O)c1ccc(F)[n]c1 Amb24660138 [1,1,0,0,0,0|2,0,0]=4 3020 B11R1.22 CNC(=O)c1ccc(N)[n]c1 Amb18946779 [1,1,0,0,0,0|2,0,0]=4 3021 B11R1.22 CNC(=O)c1ccc(O)c[n]1 Amb19895115 [1,1,0,0,0,0|2,0,0]=4 3022 B11R1.22 CNC(=O)c1ccc(S)cc1 Amb24486099 [1,1,0,0,0,0|1,0,0]=3 3023 B11R1.22 CNC(=O)c1ccc(cc1)Br Amb1232931 [1,1,0,0,0,0|1,0,0]=3 3024 B11R1.22 CNC(=O)c1ccc(cc1)Br Amb1774478 [1,1,0,0,0,0|1,0,0]=3 3025 B11R1.22 CNC(=O)c1ccc(cc1)Br Amb1774979 [1,1,0,0,0,0|1,0,0]=3 3026 B11R1.22 CNC(=O)c1ccc(cc1)Br Amb1797209 [1,1,0,0,0,0|1,0,0]=3 3027 B11R1.22 CNC(=O)c1ccc(cc1)C Amb1771439 [1,1,0,0,0,0|1,0,0]=3 3028 B11R1.22 CNC(=O)c1ccc(cc1)C Amb1796878 [1,1,0,0,0,0|1,0,0]=3 3029 B11R1.22 CNC(=O)c1ccc(cc1)C Amb1806248 [1,1,0,0,0,0|1,0,0]=3 3030 B11R1.22 CNC(=O)c1ccc(cc1)C Amb1814728 [1,1,0,0,0,0|1,0,0]=3 3031 B11R1.22 CNC(=O)c1ccc(cc1)I Amb1230427 [1,1,0,0,0,0|1,0,0]=3 3032 B11R1.22 CNC(=O)c1ccc(cn1)Br Amb10068169 [1,1,0,0,0,0|2,0,0]=4 3033 B11R1.22 CNC(=O)c1ccc(nc1)Cl Amb2106608 [1,1,0,0,0,0|2,0,0]=4 3034 B11R1.22 CNC(=S)c1ccc(Br)cc1 Amb24528870 [1,1,0,0,0,0|1,1,0]=4 3035 B11R1.22 CNS(=O)c1ccc(N)cc1 Amb18862841 [1,1,0,0,0,0|2,0,0]=4 3036 B11R1.22 COC(=C)c1ccc(Br)cc1 Amb25325540 [1,1,0,0,0,0|1,0,0]=3 3037 B11R1.22 COC(=N)c1ccc(Br)cc1 Amb24056401 [1,1,0,0,0,0|1,0,0]=3 3038 B11R1.22 COC(=N)c1ccc(Cl)cc1 Amb18180239 [1,1,0,0,0,0|1,0,0]=3 3039 B11R1.22 COC(=N)c1ccc(Cl)cc1 Amb22736537 [1,1,0,0,0,0|1,0,0]=3 3040 B11R1.22 COC(=N)c1ccc(F)c[n]1 Amb25286867 [1,1,0,0,0,0|2,0,0]=4 3041 B11R1.22 COC(=N)c1ccc(F)cc1 Amb18791533 [1,1,0,0,0,0|1,0,0]=3 3042 B11R1.22 COC(=N)c1ccc(N)cc1 Amb24096140 [1,1,0,0,0,0|1,0,0]=3 3043 B11R1.22 COC(=N)c1ccc(O)cc1 Amb18181685 [1,1,0,0,0,0|1,0,0]=3 3044 B11R1.22 COC(=O)C1=CNC(=O)C=C1 Amb18182832 [1,1,0,0,0,0|1,0,0]=3 3045 B11R1.22 COC(=O)C1=CNC(=O)C=C1 Amb19372931 [1,1,0,0,0,0|1,0,0]=3 3046 B11R1.22 COC(=O)C1=CNC(=O)N=C1 Amb21964436 [1,1,0,0,0,0|2,0,0]=4 3047 B11R1.22 COC(=O)C1=CNC(=O)N=C1 Amb22495305 [1,1,0,0,0,0|2,0,0]=4 3048 B11R1.22 COC(=O)C1=COC(=O)C=C1 Amb18796753 [1,1,0,0,0,0|1,0,0]=3 3049 B11R1.22 COC(=O)C1C=CN(C)C=C1 Amb24099561 [1,1,0,0,0,0|1,0,1]=4 3050 B11R1.22 COC(=O)C=1C=CC(=O)NN1 Amb18372542 [1,1,0,0,0,0|2,0,0]=4 3051 B11R1.22 COC(=O)C=1C=CN(C)CC1 Amb24099559 [1,1,0,0,0,0|1,0,1]=4 3052 B11R1.22 COC(=O)C=1CCC(N)=CC1 Amb24099079 [1,1,0,0,0,0|0,0,2]=4 3053 B11R1.22 COC(=O)N1C=CC(C)C=C1 Amb24060187 [1,1,0,0,0,0|1,0,1]=4 3054 B11R1.22 COC(=O)c1[n]cc(Cl)c[n]1 Amb22886749 [1,1,0,0,0,0|2,0,0]=4 3055 B11R1.22 COC(=O)c1[n]cc(F)c[n]1 Amb22263818 [1,1,0,0,0,0|2,0,0]=4 3056 B11R1.22 COC(=O)c1[n]cc(N)c[n]1 Amb22899758 [1,1,0,0,0,0|2,0,0]=4 3057 B11R1.22 COC(=O)c1[n]cc(O)c[n]1 Amb25697454 [1,1,0,0,0,0|2,0,0]=4 3058 B11R1.22 COC(=O)c1c[nH]c(=S)c[n]1 Amb24096177 [1,1,0,0,0,0|2,0,0]=4 3059 B11R1.22 COC(=O)c1c[n]c(Br)[n]c1 Amb22751737 [1,1,0,0,0,0|2,0,0]=4 3060 B11R1.22 COC(=O)c1c[n]c(F)c[n]1 Amb24096170 [1,1,0,0,0,0|2,0,0]=4 3061 B11R1.22 COC(=O)c1c[n]c(N)c[n]1 Amb21960728 [1,1,0,0,0,0|2,0,0]=4 3062 B11R1.22 COC(=O)c1c[n]c(O)[n]c1 Amb18125641 [1,1,0,0,0,0|2,0,0]=4 3063 B11R1.22 COC(=O)c1cc[n+](cc1)C Amb2502553 [1,1,0,0,0,0|1,0,0]=3 3064 B11R1.22 COC(=O)c1ccc(Br)[n][n]1 Amb22277068 [1,1,0,0,0,0|2,0,0]=4 3065 B11R1.22 COC(=O)c1ccc(C)nn1 Amb17798484 [1,1,0,0,0,0|2,0,0]=4 3066 B11R1.22 COC(=O)c1ccc(Cl)c[n]1 Amb22751028 [1,1,0,0,0,0|1,0,0]=3 3067 B11R1.22 COC(=O)c1ccc(F)[n][n]1 Amb22750322 [1,1,0,0,0,0|2,0,0]=4 3068 B11R1.22 COC(=O)c1ccc(F)c[n]1 Amb19930069 [1,1,0,0,0,0|1,0,0]=3 3069 B11R1.22 COC(=O)c1ccc(I)[nH+]c1 Amb22474983 [1,1,0,0,0,0|1,0,0]=3 3070 B11R1.22 COC(=O)c1ccc(I)[n][n]1 Amb24066762 [1,1,0,0,0,0|2,0,0]=4 3071 B11R1.22 COC(=O)c1ccc(I)[n]c1 Amb22057831 [1,1,0,0,0,0|1,0,0]=3 3072 B11R1.22 COC(=O)c1ccc(N)[n][n]1 Amb22492029 [1,1,0,0,0,0|2,0,0]=4 3073 B11R1.22 COC(=O)c1ccc(N)[n]c1 Amb24066753 [1,1,0,0,0,0|1,0,0]=3 3074 B11R1.22 COC(=O)c1ccc(N)c[n]1 Amb22751029 [1,1,0,0,0,0|1,0,0]=3 3075 B11R1.22 COC(=O)c1ccc(N)nn1 Amb17935795 [1,1,0,0,0,0|2,0,0]=4 3076 B11R1.22 COC(=O)c1ccc(O)[n][n]1 Amb21811761 [1,1,0,0,0,0|2,0,0]=4 3077 B11R1.22 COC(=O)c1ccc(S)[n]c1 Amb23446717 [1,1,0,0,0,0|1,0,0]=3 3078 B11R1.22 COC(=O)c1ccc(S)c[n]1 Amb25216569 [1,1,0,0,0,0|1,0,0]=3 3079 B11R1.22 COC(=O)c1ccc(cc1)Br Amb1394975 [1,1,0,0,0,0|0,0,0]=2 3080 B11R1.22 COC(=O)c1ccc(cc1)C Amb1210121 [1,1,0,0,0,0|0,0,0]=2 3081 B11R1.22 COC(=O)c1ccc(cc1)F Amb2227542 [1,1,0,0,0,0|0,0,0]=2 3082 B11R1.22 COC(=O)c1ccc(cc1)I Amb2411582 [1,1,0,0,0,0|0,0,0]=2 3083 B11R1.22 COC(=O)c1ccc(cc1)N Amb1215269 [1,1,0,0,0,0|0,0,0]=2 3084 B11R1.22 COC(=O)c1ccc(cn1)Cl Amb15695243 [1,1,0,0,0,0|1,0,0]=3 3085 B11R1.22 COC(=O)c1ccc(cn1)N Amb10603994 [1,1,0,0,0,0|1,0,0]=3 3086 B11R1.22 COC(=O)c1ccc(cn1)O Amb2236633 [1,1,0,0,0,0|1,0,0]=3 3087 B11R1.22 COC(=O)c1ccc(nc1)Cl Amb16207561 [1,1,0,0,0,0|1,0,0]=3 3088 B11R1.22 COC(=O)c1ccc(nc1)N Amb2413102 [1,1,0,0,0,0|1,0,0]=3 3089 B11R1.22 COC(=O)c1cnc(cn1)Br Amb10603997 [1,1,0,0,0,0|2,0,0]=4 3090 B11R1.22 COC(=O)c1cnc(cn1)N Amb17608285 [1,1,0,0,0,0|2,0,0]=4 3091 B11R1.22 COC(=O)c1cnc(cn1)O Amb1093992 [1,1,0,0,0,0|2,0,0]=4 3092 B11R1.22 COC(=O)c1cnc(nc1)C Amb13892051 [1,1,0,0,0,0|2,0,0]=4 3093 B11R1.22 COC(=O)c1ncc(cn1)Br Amb10606664 [1,1,0,0,0,0|2,0,0]=4 3094 B11R1.22 COC(=O)c1ncc(cn1)N Amb16231456 [1,1,0,0,0,0|2,0,0]=4 3095 B11R1.22 COC(=S)c1ccc(Br)cc1 Amb25288803 [1,1,0,0,0,0|0,1,0]=3 3096 B11R1.22 COC(=S)c1ccc(Cl)cc1 Amb25300049 [1,1,0,0,0,0|0,1,0]=3 3097 B11R1.22 COC(=S)c1ccc(N)cc1 Amb25758861 [1,1,0,0,0,0|0,1,0]=3 3098 B11R1.22 COC(C)c1ccc(F)cc1 Amb18633172 [1,1,0,0,0,0|1,0,1]=4 3099 B11R1.22 COC(C)c1ccc(I)cc1 Amb23568516 [1,1,0,0,0,0|1,0,1]=4 3100 B11R1.22 COC(C)c1ccc(N)cc1 Amb18952191 [1,1,0,0,0,0|1,0,1]=4 3101 B11R1.22 COC(C)c1ccc(O)cc1 Amb18644512 [1,1,0,0,0,0|1,0,1]=4 3102 B11R1.22 COC(C)c1ccc(S)cc1 Amb23568715 [1,1,0,0,0,0|1,0,1]=4 3103 B11R1.22 COC(O)c1ccc(O)cc1 Amb25714240 [1,1,0,0,0,0|0,0,2]=4 3104 B11R1.22 COP(=O)c1ccc(O)cc1 Amb25713698 [1,1,0,0,0,0|1,0,0]=3 3105 B11R1.22 COS(=O)c1ccc(cc1)Cl Amb10070067 [1,1,0,0,0,0|1,0,0]=3 3106 B11R1.22 CO[C@H](C)c1ccc(Br)cc1 Amb25739065 [1,1,0,0,0,0|1,0,1]=4 3107 B11R1.22 CO\C(\O)=C/1\C=CC(=O)C=N1 Amb24389848 [1,1,0,0,0,0|1,0,1]=4 3108 B11R1.22 CSC(=O)c1ccc(Cl)cc1 Amb25061919 [1,1,0,0,0,0|0,1,0]=3 3109 B11R1.22 C[n+]1ccc(cc1)C(=O)CN Amb25276869 [1,1,0,0,0,0|2,0,0]=4 3110 B11R1.22 C[n+]1ccc(cc1)C(=O)NC Amb22475467 [1,1,0,0,0,0|2,0,0]=4 3111 B11R1.22 C\C(=C/C)\c1ccc(N)cc1 Amb25834627 [1,1,0,0,0,0|1,0,1]=4 3112 B11R1.22 C\C(=C/C)\c1ccc(O)cc1 Amb25807631 [1,1,0,0,0,0|1,0,1]=4 3113 B11R1.22 C\C(=C\C)\c1ccc(N)cc1 Amb24574842 [1,1,0,0,0,0|1,0,1]=4 3114 B11R1.22 C\C=C(/Cl)\c1ccc(O)cc1 Amb25371858 [1,1,0,0,0,0|1,0,1]=4 3115 B11R1.22 C\C=C(/O)\c1ccc(F)cc1 Amb24100278 [1,1,0,0,0,0|0,0,2]=4 3116 B11R1.22 C\C=C(\Cl)/c1ccc(O)cc1 Amb24697857 [1,1,0,0,0,0|1,0,1]=4 3117 B11R1.22 Cc1c[n]c([n]c1)C(=O)OC Amb22304676 [1,1,0,0,0,0|2,0,0]=4 3118 B11R1.22 Cc1c[n]c(c[n]1)C(=O)CC Amb24557354 [1,1,0,0,0,0|2,0,0]=4 3119 B11R1.22 Cc1ccc([n][n]1)C(=O)CC Amb25376333 [1,1,0,0,0,0|2,0,0]=4 3120 B11R1.22 Cc1ccc([n]c1)C(=N)OC Amb24475317 [1,1,0,0,0,0|2,0,0]=4 3121 B11R1.22 Cc1ccc([n]c1)C(=O)CBr Amb24053939 [1,1,0,0,0,0|2,0,0]=4 3122 B11R1.22 Cc1ccc([n]c1)C(=O)CC Amb22898827 [1,1,0,0,0,0|1,0,0]=3 3123 B11R1.22 Cc1ccc([n]c1)C(=O)CCl Amb25189273 [1,1,0,0,0,0|2,0,0]=4 3124 B11R1.22 Cc1ccc([n]c1)C(=O)NC Amb25151403 [1,1,0,0,0,0|2,0,0]=4 3125 B11R1.22 Cc1ccc([n]c1)C(=O)OC Amb19958650 [1,1,0,0,0,0|1,0,0]=3 3126 B11R1.22 Cc1ccc([n]c1)S(=O)CC Amb24584263 [1,1,0,0,0,0|2,0,0]=4 3127 B11R1.22 Cc1ccc(c[n]1)C(=O)CBr Amb22277086 [1,1,0,0,0,0|2,0,0]=4 3128 B11R1.22 Cc1ccc(c[n]1)C(=O)CCl Amb24104209 [1,1,0,0,0,0|2,0,0]=4 3129 B11R1.22 Cc1ccc(c[n]1)C(=O)NC Amb24072724 [1,1,0,0,0,0|2,0,0]=4 3130 B11R1.22 Cc1ccc(cc1)C(=C)CN Amb18124857 [1,1,0,0,0,0|2,0,0]=4 3131 B11R1.22 Cc1ccc(cc1)C(=N)OC Amb22269339 [1,1,0,0,0,0|1,0,0]=3 3132 B11R1.22 Cc1ccc(cc1)C(=O)C=C Amb18063916 [1,1,0,0,0,0|0,0,2]=4 3133 B11R1.22 Cc1ccc(cc1)C(=O)CF Amb24084136 [1,1,0,0,0,0|1,0,0]=3 3134 B11R1.22 Cc1ccc(cc1)C(=O)CN Amb22490690 [1,1,0,0,0,0|1,0,0]=3 3135 B11R1.22 Cc1ccc(cc1)C(=O)SC Amb25305675 [1,1,0,0,0,0|0,1,0]=3 3136 B11R1.22 Cc1ccc(cc1)C(=S)NC Amb24739783 [1,1,0,0,0,0|1,1,0]=4 3137 B11R1.22 Cc1ccc(cc1)C(C)CC Amb24064768 [1,1,0,0,0,0|1,0,1]=4 3138 B11R1.22 Cc1ccc(cc1)N(C)CC Amb25189550 [1,1,0,0,0,0|2,0,0]=4 3139 B11R1.22 Cc1ccc(cc1)N(N)CC Amb18799372 [1,1,0,0,0,0|2,0,0]=4 3140 B11R1.22 Cc1ccc(cc1)N(O)CC Amb24096604 [1,1,0,0,0,0|1,0,1]=4 3141 B11R1.22 Cc1ccc(cc1)S(=O)OC Amb22230928 [1,1,0,0,0,0|1,0,0]=3 3142 B11R1.22 Cc1ccc(cc1)[C@@H](N)CC Amb22288701 [1,1,0,0,0,0|1,0,1]=4 3143 B11R1.22 Cc1ccc(cc1)[C@@H](O)CC Amb25289840 [1,1,0,0,0,0|0,0,2]=4 3144 B11R1.22 Cc1ccc(cc1)[C@H](N)CC Amb22284758 [1,1,0,0,0,0|1,0,1]=4 3145 B11R1.22 Cc1ccc(cc1)[C@H](N)CC Amb22288651 [1,1,0,0,0,0|1,0,1]=4 3146 B11R1.22 Cc1ccc(cc1)[S@@](=O)CF Amb24309140 [1,1,0,0,0,0|2,0,0]=4 3147 B11R1.22 ClCC(=O)c1ccc(cc1)Br Amb1103620 [1,1,0,0,0,0|1,0,0]=3 3148 B11R1.22 ClCC(=O)c1ccc(cc1)C Amb1105496 [1,1,0,0,0,0|1,0,0]=3 3149 B11R1.22 ClCC(=O)c1ccc(cc1)F Amb1221364 [1,1,0,0,0,0|1,0,0]=3 3150 B11R1.22 ClCC(=O)c1ccc(cc1)O Amb1218323 [1,1,0,0,0,0|1,0,0]=3 3151 B11R1.22 Clc1ccc(cc1)C(=O)C#N Amb17939433 [1,1,0,0,0,0|1,0,1]=4 3152 B11R1.22 FCC(=O)c1ccc(cc1)Cl Amb10603324 [1,1,0,0,0,0|1,0,0]=3 3153 B11R1.22 N#CC(=O)c1ccc(I)cc1 Amb22495535 [1,1,0,0,0,0|1,0,1]=4 3154 B11R1.22 N#CC(=O)c1ccc(O)cc1 Amb25842027 [1,1,0,0,0,0|1,0,1]=4 3155 B11R1.22 N#CC(=O)c1ccc(cc1)C Amb17231996 [1,1,0,0,0,0|1,0,1]=4 3156 B11R1.22 N#CC(=O)c1ccc(cc1)F Amb17232050 [1,1,0,0,0,0|1,0,1]=4 3157 B11R1.22 NCC(=N)c1ccc(O)cc1 Amb24102720 [1,1,0,0,0,0|2,0,0]=4 3158 B11R1.22 NCC(=O)c1ccc(Br)[n]c1 Amb25778172 [1,1,0,0,0,0|2,0,0]=4 3159 B11R1.22 NCC(=O)c1ccc(Cl)cc1 Amb19884070 [1,1,0,0,0,0|1,0,0]=3 3160 B11R1.22 NCC(=O)c1ccc(F)[n]c1 Amb24106028 [1,1,0,0,0,0|2,0,0]=4 3161 B11R1.22 NCC(=O)c1ccc(I)cc1 Amb21962789 [1,1,0,0,0,0|1,0,0]=3 3162 B11R1.22 NCC(=O)c1ccc(O)cc1 Amb22001575 [1,1,0,0,0,0|1,0,0]=3 3163 B11R1.22 NCC(=O)c1ccc(S)cc1 Amb25082898 [1,1,0,0,0,0|1,0,0]=3 3164 B11R1.22 NCC(=O)c1ccc(cc1)Br Amb1811968 [1,1,0,0,0,0|1,0,0]=3 3165 B11R1.22 NCC(=O)c1ccc(cc1)Cl Amb1208662 [1,1,0,0,0,0|1,0,0]=3 3166 B11R1.22 NCC(=O)c1ccc(cc1)Cl Amb2370537 [1,1,0,0,0,0|1,0,0]=3 3167 B11R1.22 NCC(=O)c1ccc(cc1)F Amb1419069 [1,1,0,0,0,0|1,0,0]=3 3168 B11R1.22 NCC(=O)c1ccc(cc1)O Amb17593762 [1,1,0,0,0,0|1,0,0]=3 3169 B11R1.22 NNC(=O)c1ccc(S)cc1 Amb25228454 [1,1,0,0,0,0|2,0,0]=4 3170 B11R1.22 NNC(=O)c1ccc(cc1)Br Amb1207367 [1,1,0,0,0,0|2,0,0]=4 3171 B11R1.22 NNC(=O)c1ccc(cc1)Cl Amb1209335 [1,1,0,0,0,0|2,0,0]=4 3172 B11R1.22 NNC(=O)c1ccc(cc1)F Amb1104475 [1,1,0,0,0,0|2,0,0]=4 3173 B11R1.22 NNC(=O)c1ccc(cc1)I Amb1788092 [1,1,0,0,0,0|2,0,0]=4 3174 B11R1.22 NNC(=O)c1ccc(cc1)O Amb1212100 [1,1,0,0,0,0|2,0,0]=4 3175 B11R1.22 NOC(=O)c1ccc(Cl)cc1 Amb24539350 [1,1,0,0,0,0|1,0,0]=3 3176 B11R1.22 Nc1ccc(cc1)C(=O)C#N Amb24068507 [1,1,0,0,0,0|1,0,1]=4 3177 B11R1.22 Nc1ccc(cc1)C(=O)CI Amb25317674 [1,1,0,0,0,0|1,0,0]=3 3178 B11R1.22 Nc1ccc(cc1)C(=O)CN Amb24106018 [1,1,0,0,0,0|1,0,0]=3 3179 B11R1.22 Nc1ccc(cc1)C(=O)CS Amb25169304 [1,1,0,0,0,0|1,0,0]=3 3180 B11R1.22 Nc1ccc(cc1)C(=O)O[Na] Amb22338470 [1,1,0,0,0,0|1,0,0]=3 3181 B11R1.22 O=C(CBr)c1ccc(Br)c[n]1 Amb22831861 [1,1,0,0,0,0|2,0,0]=4 3182 B11R1.22 O=C(CBr)c1ccc(Cl)[n]c1 Amb19944611 [1,1,0,0,0,0|2,0,0]=4 3183 B11R1.22 O=C(CBr)c1ccc(Cl)c[n]1 Amb21858525 [1,1,0,0,0,0|2,0,0]=4 3184 B11R1.22 O=C(CBr)c1ccc(Cl)c[n]1 Amb22001890 [1,1,0,0,0,0|2,0,0]=4 3185 B11R1.22 O=C(CBr)c1ccc(Cl)c[n]1 Amb22899199 [1,1,0,0,0,0|2,0,0]=4 3186 B11R1.22 O=C(CBr)c1ccc(F)[n]c1 Amb24104044 [1,1,0,0,0,0|2,0,0]=4 3187 B11R1.22 O=C(CBr)c1ccc(F)c[n]1 Amb23412381 [1,1,0,0,0,0|2,0,0]=4 3188 B11R1.22 O=C(CCl)c1ccc(Br)c[n]1 Amb24695456 [1,1,0,0,0,0|2,0,0]=4 3189 B11R1.22 O=C(CCl)c1ccc(Cl)[n]c1 Amb24104206 [1,1,0,0,0,0|2,0,0]=4 3190 B11R1.22 O=C(CCl)c1ccc(Cl)c[n]1 Amb24104200 [1,1,0,0,0,0|2,0,0]=4 3191 B11R1.22 O=C(CCl)c1ccc(F)[n]c1 Amb24104207 [1,1,0,0,0,0|2,0,0]=4 3192 B11R1.22 O=C(CF)c1ccc(F)cc1 Amb22490651 [1,1,0,0,0,0|1,0,0]=3 3193 B11R1.22 O=C(CI)c1ccc(Br)cc1 Amb23579956 [1,1,0,0,0,0|1,0,0]=3 3194 B11R1.22 O=C(CI)c1ccc(Cl)cc1 Amb23579973 [1,1,0,0,0,0|1,0,0]=3 3195 B11R1.22 O=C1C=CN(C=C1)C(=O)CCl Amb24062625 [1,1,0,0,0,0|2,0,0]=4 3196 B11R1.22 O=CC(=O)c1ccc(cc1)Br Amb10067934 [1,1,0,0,0,0|1,0,1]=4 3197 B11R1.22 O=CC(=O)c1ccc(cc1)C Amb10067935 [1,1,0,0,0,0|1,0,1]=4 3198 B11R1.22 O=CC(=O)c1ccc(cc1)Cl Amb10067933 [1,1,0,0,0,0|1,0,1]=4 3199 B11R1.22 O=CC(=O)c1ccc(cc1)O Amb10069044 [1,1,0,0,0,0|1,0,1]=4 3200 B11R1.22 OCC(=O)c1ccc(Cl)[n]c1 Amb25798404 [1,1,0,0,0,0|2,0,0]=4 3201 B11R1.22 Oc1ccc(cc1)C(=O)CF Amb24084117 [1,1,0,0,0,0|1,0,0]=3 3202 B11R1.22 Oc1ccc(cc1)C(=O)CS Amb24486187 [1,1,0,0,0,0|1,0,0]=3 3203 B11R1.22 SCC(=O)c1ccc(cc1)Br Amb17407556 [1,1,0,0,0,0|1,0,0]=3 3204 B11R1.22 SCC(=O)c1ccc(cc1)C Amb17400215 [1,1,0,0,0,0|1,0,0]=3 3205 B11R1.22 SCC(=O)c1ccc(cc1)Cl Amb17401093 [1,1,0,0,0,0|1,0,0]=3 3206 B11R1.22 SCC(=O)c1ccc(cc1)F Amb17400324 [1,1,0,0,0,0|1,0,0]=3 3207 B11R1.22 [NH3+]CC(=O)c1ccc(Br)cc1 Amb24113825 [1,1,0,0,0,0|1,0,0]=3 3208 B11R1.22 [NH3+]CC(=O)c1ccc(cc1)C Amb10606218 [1,1,0,0,0,0|1,0,0]=3 3209 B11R1.23 BrCC(=O)c1cccc(c1)Cl Amb1224657 [1,1,0,0,0,0|1,0,0]=3 3210 B11R1.23 BrCC(=O)c1cccc(c1)I Amb1885036 [1,1,0,0,0,0|1,0,0]=3 3211 B11R1.23 BrCC(=O)c1cccc(c1)O Amb1981340 [1,1,0,0,0,0|1,0,0]=3 3212 B11R1.23 C#CC(=O)c1cccc(Br)c1 Amb25842033 [1,1,0,0,0,0|0,0,2]=4 3213 B11R1.23 C#CC(=O)c1cccc(Cl)c1 Amb25687191 [1,1,0,0,0,0|0,0,2]=4 3214 B11R1.23 C#CC(=O)c1cccc(I)c1 Amb24421428 [1,1,0,0,0,0|0,0,2]=4 3215 B11R1.23 C#CC(=O)c1cccc(N)c1 Amb24550417 [1,1,0,0,0,0|0,0,2]=4 3216 B11R1.23 C=C(CN)c1cccc(O)c1 Amb25326353 [1,1,0,0,0,0|2,0,0]=4 3217 B11R1.23 C=C(CO)c1cccc(F)c1 Amb24100536 [1,1,0,0,0,0|2,0,0]=4 3218 B11R1.23 C=CC(=O)c1cccc(Cl)c1 Amb25783480 [1,1,0,0,0,0|0,0,2]=4 3219 B11R1.23 C=CC(=O)c1cccc(N)c1 Amb25291745 [1,1,0,0,0,0|0,0,2]=4 3220 B11R1.23 C=CC(=O)c1cccc(O)c1 Amb18124877 [1,1,0,0,0,0|0,0,2]=4 3221 B11R1.23 CC=1CN(C=CC1)C(=O)OC Amb24060030 [1,1,0,0,0,0|1,0,1]=4 3222 B11R1.23 CCC(=O)c1c[n]cc(Br)c1 Amb23450052 [1,1,0,0,0,0|1,0,0]=3 3223 B11R1.23 CCC(=O)c1c[n]cc(Cl)c1 Amb25185418 [1,1,0,0,0,0|1,0,0]=3 3224 B11R1.23 CCC(=O)c1c[n]cc(F)c1 Amb18791535 [1,1,0,0,0,0|1,0,0]=3 3225 B11R1.23 CCC(=O)c1cc[n]c(Br)c1 Amb25032550 [1,1,0,0,0,0|1,0,0]=3 3226 B11R1.23 CCC(=O)c1cc[n]c(N)c1 Amb18125140 [1,1,0,0,0,0|1,0,0]=3 3227 B11R1.23 CCC(=O)c1cccc(N)[n]1 Amb25314535 [1,1,0,0,0,0|1,0,0]=3 3228 B11R1.23 CCC(=O)c1cccc(S)c1 Amb24549290 [1,1,0,0,0,0|0,0,0]=2 3229 B11R1.23 CCC(=O)c1cccc(c1)Br Amb1233199 [1,1,0,0,0,0|0,0,0]=2 3230 B11R1.23 CCC(Br)c1cc(Br)ccc1 Amb25330622 [1,1,0,0,0,0|1,0,1]=4 3231 B11R1.23 CCC(Br)c1cccc(F)c1 Amb25116208 [1,1,0,0,0,0|1,0,1]=4 3232 B11R1.23 CCC(C)c1cccc(Br)c1 Amb24321311 [1,1,0,0,0,0|1,0,1]=4 3233 B11R1.23 CCC(C)c1cccc(I)c1 Amb25217267 [1,1,0,0,0,0|1,0,1]=4 3234 B11R1.23 CCC(C)c1cccc(O)c1 Amb18644439 [1,1,0,0,0,0|1,0,1]=4 3235 B11R1.23 CCC(Cl)c1cccc(Br)c1 Amb25698929 [1,1,0,0,0,0|1,0,1]=4 3236 B11R1.23 CCC(N)c1cc(N)ccc1 Amb22754502 [1,1,0,0,0,0|1,0,1]=4 3237 B11R1.23 CCC(N)c1cccc(S)c1 Amb25716248 [1,1,0,0,0,0|1,0,1]=4 3238 B11R1.23 CCC(O)c1cc(O)ccc1 Amb18125404 [1,1,0,0,0,0|0,0,2]=4 3239 B11R1.23 CCC(O)c1cccc(F)c1 Amb18035934 [1,1,0,0,0,0|0,0,2]=4 3240 B11R1.23 CCC(O)c1cccc(I)c1 Amb25841716 [1,1,0,0,0,0|0,0,2]=4 3241 B11R1.23 CCC(O)c1cccc(N)c1 Amb18644476 [1,1,0,0,0,0|0,0,2]=4 3242 B11R1.23 CCC(S)c1cccc(Br)c1 Amb25853905 [1,1,0,0,0,0|0,1,1]=4 3243 B11R1.23 CCC(c1cccc(c1)Br)O Amb1111136 [1,1,0,0,0,0|0,0,2]=4 3244 B11R1.23 CCC(c1cccc(c1)C)N Amb17232059 [1,1,0,0,0,0|1,0,1]=4 3245 B11R1.23 CCC(c1cccc(c1)C)O Amb17232070 [1,1,0,0,0,0|0,0,2]=4 3246 B11R1.23 CCC(c1cccc(c1)Cl)N Amb1126296 [1,1,0,0,0,0|1,0,1]=4 3247 B11R1.23 CCC(c1cccc(c1)F)N Amb10839631 [1,1,0,0,0,0|1,0,1]=4 3248 B11R1.23 CCN(c1cccc(c1)C)N Amb17232077 [1,1,0,0,0,0|2,0,0]=4 3249 B11R1.23 CCS(=O)c1cccc(F)c1 Amb24689196 [1,1,0,0,0,0|1,0,0]=3 3250 B11R1.23 CCS(=O)c1cccc(N)c1 Amb25363005 [1,1,0,0,0,0|1,0,0]=3 3251 B11R1.23 CCS(=O)c1cccc(O)c1 Amb25085240 [1,1,0,0,0,0|1,0,0]=3 3252 B11R1.23 CC[C@@H](N)c1cc(N)ccc1 Amb25707453 [1,1,0,0,0,0|1,0,1]=4 3253 B11R1.23 CC[C@@H](N)c1cccc(Br)c1 Amb24533197 [1,1,0,0,0,0|1,0,1]=4 3254 B11R1.23 CC[C@@H](N)c1cccc(Cl)c1 Amb22232293 [1,1,0,0,0,0|1,0,1]=4 3255 B11R1.23 CC[C@@H](N)c1cccc(Cl)c1 Amb22288625 [1,1,0,0,0,0|1,0,1]=4 3256 B11R1.23 CC[C@@H](N)c1cccc(F)c1 Amb22288627 [1,1,0,0,0,0|1,0,1]=4 3257 B11R1.23 CC[C@@H](N)c1cccc(F)c1 Amb24426877 [1,1,0,0,0,0|1,0,1]=4 3258 B11R1.23 CC[C@@H](N)c1cccc(O)c1 Amb25074061 [1,1,0,0,0,0|1,0,1]=4 3259 B11R1.23 CC[C@@H](O)c1cccc(Br)c1 Amb25048807 [1,1,0,0,0,0|0,0,2]=4 3260 B11R1.23 CC[C@@H](O)c1cccc(Cl)c1 Amb24477555 [1,1,0,0,0,0|0,0,2]=4 3261 B11R1.23 CC[C@H](N)c1cc(N)ccc1 Amb25169299 [1,1,0,0,0,0|1,0,1]=4 3262 B11R1.23 CC[C@H](N)c1cccc(Cl)c1 Amb22232288 [1,1,0,0,0,0|1,0,1]=4 3263 B11R1.23 CC[C@H](N)c1cccc(F)c1 Amb22288686 [1,1,0,0,0,0|1,0,1]=4 3264 B11R1.23 CC[C@H](N)c1cccc(I)c1 Amb25288823 [1,1,0,0,0,0|1,0,1]=4 3265 B11R1.23 CC[C@H](N)c1cccc(O)c1 Amb24460783 [1,1,0,0,0,0|1,0,1]=4 3266 B11R1.23 CC[C@H](N)c1cccc(S)c1 Amb25726439 [1,1,0,0,0,0|1,0,1]=4 3267 B11R1.23 CC[C@H](O)c1cc(O)ccc1 Amb24484509 [1,1,0,0,0,0|0,0,2]=4 3268 B11R1.23 CC[C@H](O)c1cccc(F)c1 Amb24447234 [1,1,0,0,0,0|0,0,2]=4 3269 B11R1.23 CN(CC)c1cccc(Br)c1 Amb25711222 [1,1,0,0,0,0|2,0,0]=4 3270 B11R1.23 CN(CC)c1cccc(Cl)c1 Amb25332688 [1,1,0,0,0,0|2,0,0]=4 3271 B11R1.23 CN(CC)c1cccc(F)c1 Amb25163175 [1,1,0,0,0,0|2,0,0]=4 3272 B11R1.23 CN(CC)c1cccc(O)c1 Amb18125288 [1,1,0,0,0,0|2,0,0]=4 3273 B11R1.23 CN(OC)c1cccc(Cl)c1 Amb20620735 [1,1,0,0,0,0|2,0,0]=4 3274 B11R1.23 CN1C=C(CC=C1)C(=O)OC Amb24062401 [1,1,0,0,0,0|1,0,1]=4 3275 B11R1.23 CNC(=N)c1cccc(Cl)c1 Amb24533036 [1,1,0,0,0,0|2,0,0]=4 3276 B11R1.23 CNC(=O)c1c[n+]([O-])ccc1 Amb25822992 [1,1,0,0,0,0|2,0,0]=4 3277 B11R1.23 CNC(=O)c1c[n]cc(F)c1 Amb25052399 [1,1,0,0,0,0|2,0,0]=4 3278 B11R1.23 CNC(=O)c1c[n]cc(I)c1 Amb25272275 [1,1,0,0,0,0|2,0,0]=4 3279 B11R1.23 CNC(=O)c1c[n]cc(N)c1 Amb23452695 [1,1,0,0,0,0|2,0,0]=4 3280 B11R1.23 CNC(=O)c1c[n]cc(O)c1 Amb24062366 [1,1,0,0,0,0|2,0,0]=4 3281 B11R1.23 CNC(=O)c1cc(Br)cc[n]1 Amb25312186 [1,1,0,0,0,0|2,0,0]=4 3282 B11R1.23 CNC(=O)c1cc(Cl)ccn1 Amb1216582 [1,1,0,0,0,0|2,0,0]=4 3283 B11R1.23 CNC(=O)c1cc(Cl)ccn1 Amb17611087 [1,1,0,0,0,0|2,0,0]=4 3284 B11R1.23 CNC(=O)c1cc(F)cc[n]1 Amb25714403 [1,1,0,0,0,0|2,0,0]=4 3285 B11R1.23 CNC(=O)c1cc(O)cc[n]1 Amb22755769 [1,1,0,0,0,0|2,0,0]=4 3286 B11R1.23 CNC(=O)c1cc[n]c(F)c1 Amb18787496 [1,1,0,0,0,0|2,0,0]=4 3287 B11R1.23 CNC(=O)c1cc[n]c(N)c1 Amb18946781 [1,1,0,0,0,0|2,0,0]=4 3288 B11R1.23 CNC(=O)c1cccc(=O)[nH]1 Amb24096727 [1,1,0,0,0,0|2,0,0]=4 3289 B11R1.23 CNC(=O)c1cccc(Br)[n]1 Amb19959848 [1,1,0,0,0,0|2,0,0]=4 3290 B11R1.23 CNC(=O)c1cccc(N)[n]1 Amb18946961 [1,1,0,0,0,0|2,0,0]=4 3291 B11R1.23 CNC(=O)c1cccc(N)c1 Amb24053079 [1,1,0,0,0,0|1,0,0]=3 3292 B11R1.23 CNC(=O)c1cccc(S)c1 Amb25188808 [1,1,0,0,0,0|1,0,0]=3 3293 B11R1.23 CNC(=O)c1cccc(c1)N Amb1212262 [1,1,0,0,0,0|1,0,0]=3 3294 B11R1.23 CNC(=O)c1cccc(n1)Cl Amb10877696 [1,1,0,0,0,0|2,0,0]=4 3295 B11R1.23 CNC(=O)c1ccnc(c1)Br Amb15691039 [1,1,0,0,0,0|2,0,0]=4 3296 B11R1.23 COC(=N)c1cccc(Br)c1 Amb24420410 [1,1,0,0,0,0|1,0,0]=3 3297 B11R1.23 COC(=N)c1cccc(Cl)c1 Amb18180240 [1,1,0,0,0,0|1,0,0]=3 3298 B11R1.23 COC(=N)c1cccc(F)c1 Amb18791534 [1,1,0,0,0,0|1,0,0]=3 3299 B11R1.23 COC(=N)c1cccc(I)c1 Amb25829119 [1,1,0,0,0,0|1,0,0]=3 3300 B11R1.23 COC(=N)c1cccc(N)c1 Amb24096058 [1,1,0,0,0,0|1,0,0]=3 3301 B11R1.23 COC(=N)c1cccc(O)c1 Amb18179386 [1,1,0,0,0,0|1,0,0]=3 3302 B11R1.23 COC(=O)C1=CC(=O)C=CS1 Amb25348661 [1,1,0,0,0,0|1,0,0]=3 3303 B11R1.23 COC(=O)C1=CC(=O)C=NN1 Amb24359096 [1,1,0,0,0,0|2,0,0]=4 3304 B11R1.23 COC(=O)C1=CC(=O)N=CN1 Amb22497602 [1,1,0,0,0,0|2,0,0]=4 3305 B11R1.23 COC(=O)C1=CC(=O)NC=C1 Amb19895329 [1,1,0,0,0,0|1,0,0]=3 3306 B11R1.23 COC(=O)C1=CC(=O)NN=C1 Amb22235613 [1,1,0,0,0,0|2,0,0]=4 3307 B11R1.23 COC(=O)C1=CC=CC(=O)N1 Amb21963502 [1,1,0,0,0,0|1,0,0]=3 3308 B11R1.23 COC(=O)C=1C=CCN(C)C1 Amb24062405 [1,1,0,0,0,0|1,0,1]=4 3309 B11R1.23 COC(=O)C=1C=CNC(=N)C1 Amb19281876 [1,1,0,0,0,0|1,0,0]=3 3310 B11R1.23 COC(=O)C=1C=CNC(=O)N1 Amb22275937 [1,1,0,0,0,0|2,0,0]=4 3311 B11R1.23 COC(=O)C=1NC(=S)C=CN1 Amb24354855 [1,1,0,0,0,0|2,0,0]=4 3312 B11R1.23 COC(=O)c1[n]c(Br)cc[n]1 Amb22001872 [1,1,0,0,0,0|2,0,0]=4 3313 B11R1.23 COC(=O)c1[n]c(Cl)cc[n]1 Amb20617427 [1,1,0,0,0,0|2,0,0]=4 3314 B11R1.23 COC(=O)c1[n]c(I)cc[n]1 Amb24602324 [1,1,0,0,0,0|2,0,0]=4 3315 B11R1.23 COC(=O)c1[n]ccc(=O)o1 Amb24096201 [1,1,0,0,0,0|2,0,0]=4 3316 B11R1.23 COC(=O)c1c[n]cc(Br)[n]1 Amb19958092 [1,1,0,0,0,0|2,0,0]=4 3317 B11R1.23 COC(=O)c1c[n]cc(N)[n]1 Amb19879012 [1,1,0,0,0,0|2,0,0]=4 3318 B11R1.23 COC(=O)c1c[n]cc(N)c1 Amb22756402 [1,1,0,0,0,0|1,0,0]=3 3319 B11R1.23 COC(=O)c1c[n]cc(O)[n]1 Amb18125640 [1,1,0,0,0,0|2,0,0]=4 3320 B11R1.23 COC(=O)c1c[n]cc(S)[n]1 Amb24720136 [1,1,0,0,0,0|2,0,0]=4 3321 B11R1.23 COC(=O)c1cc(Br)[n]c[n]1 Amb22752399 [1,1,0,0,0,0|2,0,0]=4 3322 B11R1.23 COC(=O)c1cc(Br)ccn1 Amb10072124 [1,1,0,0,0,0|1,0,0]=3 3323 B11R1.23 COC(=O)c1cc(Cl)[n]c[n]1 Amb20241221 [1,1,0,0,0,0|2,0,0]=4 3324 B11R1.23 COC(=O)c1cc(Cl)cc[n]1 Amb22489514 [1,1,0,0,0,0|1,0,0]=3 3325 B11R1.23 COC(=O)c1cc(Cl)ccn1 Amb2425400 [1,1,0,0,0,0|1,0,0]=3 3326 B11R1.23 COC(=O)c1cc(F)cc[n]1 Amb21857845 [1,1,0,0,0,0|1,0,0]=3 3327 B11R1.23 COC(=O)c1cc(I)ccn1 Amb10072115 [1,1,0,0,0,0|1,0,0]=3 3328 B11R1.23 COC(=O)c1cc(N)[n]c[n]1 Amb21963300 [1,1,0,0,0,0|2,0,0]=4 3329 B11R1.23 COC(=O)c1cc(O)cc[n]1 Amb22754537 [1,1,0,0,0,0|1,0,0]=3 3330 B11R1.23 COC(=O)c1cc(O)ccn1 Amb10603787 [1,1,0,0,0,0|1,0,0]=3 3331 B11R1.23 COC(=O)c1cc(S)cc[n]1 Amb25691218 [1,1,0,0,0,0|1,0,0]=3 3332 B11R1.23 COC(=O)c1cc[n]c(Br)[n]1 Amb21964601 [1,1,0,0,0,0|2,0,0]=4 3333 B11R1.23 COC(=O)c1cc[n]c(F)[n]1 Amb25249346 [1,1,0,0,0,0|2,0,0]=4 3334 B11R1.23 COC(=O)c1cc[n]c(N)[n]1 Amb22275936 [1,1,0,0,0,0|2,0,0]=4 3335 B11R1.23 COC(=O)c1cc[n]c(N)c1 Amb20621557 [1,1,0,0,0,0|1,0,0]=3 3336 B11R1.23 COC(=O)c1cc[n]c(O)c1 Amb22741052 [1,1,0,0,0,0|1,0,0]=3 3337 B11R1.23 COC(=O)c1ccc[n+](c1)C Amb10573203 [1,1,0,0,0,0|1,0,0]=3 3338 B11R1.23 COC(=O)c1cccc(N)c1 Amb22001392 [1,1,0,0,0,0|0,0,0]=2 3339 B11R1.23 COC(=O)c1cccc(c1)S Amb17617595 [1,1,0,0,0,0|0,0,0]=2 3340 B11R1.23 COC(=O)c1cccc(n1)Cl Amb1197599 [1,1,0,0,0,0|1,0,0]=3 3341 B11R1.23 COC(=O)c1cccc(n1)F Amb16231928 [1,1,0,0,0,0|1,0,0]=3 3342 B11R1.23 COC(=O)c1ccnc(c1)F Amb16231929 [1,1,0,0,0,0|1,0,0]=3 3343 B11R1.23 COC(=O)c1cncc(O)c1 Amb17739876 [1,1,0,0,0,0|1,0,0]=3 3344 B11R1.23 COC(=O)c1cncc(c1)Br Amb2446343 [1,1,0,0,0,0|1,0,0]=3 3345 B11R1.23 COC(=O)c1cncc(c1)Cl Amb10603998 [1,1,0,0,0,0|1,0,0]=3 3346 B11R1.23 COC(=O)c1cncc(c1)F Amb10606907 [1,1,0,0,0,0|1,0,0]=3 3347 B11R1.23 COC(=O)c1cncc(c1)I Amb13887026 [1,1,0,0,0,0|1,0,0]=3 3348 B11R1.23 COC(=O)c1cncc(n1)Cl Amb10067228 [1,1,0,0,0,0|2,0,0]=4 3349 B11R1.23 COC(=O)c1cnnc(c1)Cl Amb10604004 [1,1,0,0,0,0|2,0,0]=4 3350 B11R1.23 COC(=O)c1ncc[n+](c1)C Amb10573253 [1,1,0,0,0,0|2,0,0]=4 3351 B11R1.23 COC(=O)c1nccc(n1)N Amb10067821 [1,1,0,0,0,0|2,0,0]=4 3352 B11R1.23 COC(C)c1cccc(Br)c1 Amb25242655 [1,1,0,0,0,0|1,0,1]=4 3353 B11R1.23 COC(c1cccc(c1)N)C Amb13952800 [1,1,0,0,0,0|1,0,1]=4 3354 B11R1.23 CSC(=N)c1cccc(Cl)c1 Amb22472392 [1,1,0,0,0,0|1,1,0]=4 3355 B11R1.23 C[n+]1cc(ccc1)C(=O)NC Amb19942299 [1,1,0,0,0,0|2,0,0]=4 3356 B11R1.23 C\C(=C/C)\c1cc(F)ccc1 Amb25837290 [1,1,0,0,0,0|1,0,1]=4 3357 B11R1.23 C\C(=C\C)\c1cc(Br)ccc1 Amb25674836 [1,1,0,0,0,0|1,0,1]=4 3358 B11R1.23 Cc1[n]c(cc[n]1)C(=O)OC Amb20171561 [1,1,0,0,0,0|2,0,0]=4 3359 B11R1.23 Cc1c[n]cc([n]1)C(=O)CC Amb24538142 [1,1,0,0,0,0|2,0,0]=4 3360 B11R1.23 Cc1c[n]cc([n]1)C(=O)OC Amb22236001 [1,1,0,0,0,0|2,0,0]=4 3361 B11R1.23 Cc1c[n]cc(c1)C(=O)CC Amb25782565 [1,1,0,0,0,0|1,0,0]=3 3362 B11R1.23 Cc1cc([n][n]c1)C(=O)OC Amb24183592 [1,1,0,0,0,0|2,0,0]=4 3363 B11R1.23 Cc1cc([n]c[n]1)C(=O)CC Amb24407276 [1,1,0,0,0,0|2,0,0]=4 3364 B11R1.23 Cc1cc([n]c[n]1)C(=O)OC Amb22233997 [1,1,0,0,0,0|2,0,0]=4 3365 B11R1.23 Cc1cc([n]cc1)C(=O)CBr Amb24104033 [1,1,0,0,0,0|2,0,0]=4 3366 B11R1.23 Cc1cc([n]cc1)C(=O)CN Amb24564185 [1,1,0,0,0,0|2,0,0]=4 3367 B11R1.23 Cc1cc(c[n][n]1)C(=O)OC Amb24639931 [1,1,0,0,0,0|2,0,0]=4 3368 B11R1.23 Cc1cc(c[n]c1)C(=O)CBr Amb24104041 [1,1,0,0,0,0|2,0,0]=4 3369 B11R1.23 Cc1cc(c[n]c1)C(=O)CN Amb25800562 [1,1,0,0,0,0|2,0,0]=4 3370 B11R1.23 Cc1cc(cc[n]1)C(=O)CCl Amb24605579 [1,1,0,0,0,0|2,0,0]=4 3371 B11R1.23 Cc1cc(cc[n]1)C(=O)CN Amb24106014 [1,1,0,0,0,0|2,0,0]=4 3372 B11R1.23 Cc1cc(cc[n]1)C(=O)NC Amb25678971 [1,1,0,0,0,0|2,0,0]=4 3373 B11R1.23 Cc1cc(cc[n]1)C(=O)OC Amb19944358 [1,1,0,0,0,0|1,0,0]=3 3374 B11R1.23 Cc1cc(ccc1)C(=C)CC Amb25151911 [1,1,0,0,0,0|1,0,0]=3 3375 B11R1.23 Cc1cc(ccc1)C(=C)CCl Amb25185402 [1,1,0,0,0,0|2,0,0]=4 3376 B11R1.23 Cc1cc(ccc1)C(=C)CO Amb25065515 [1,1,0,0,0,0|2,0,0]=4 3377 B11R1.23 Cc1cc(ccc1)C(=N)NC Amb24520876 [1,1,0,0,0,0|2,0,0]=4 3378 B11R1.23 Cc1cc(ccc1)C(=O)C#C Amb25086983 [1,1,0,0,0,0|0,0,2]=4 3379 B11R1.23 Cc1cc(ccc1)C(=O)C=O Amb18124885 [1,1,0,0,0,0|1,0,1]=4 3380 B11R1.23 Cc1cc(ccc1)C(=O)C=O Amb24055227 [1,1,0,0,0,0|1,0,1]=4 3381 B11R1.23 Cc1cc(ccc1)C(=O)CCl Amb18806064 [1,1,0,0,0,0|1,0,0]=3 3382 B11R1.23 Cc1cc(ccc1)C(=O)CF Amb24084129 [1,1,0,0,0,0|1,0,0]=3 3383 B11R1.23 Cc1cc(ccc1)C(=O)CN Amb20171473 [1,1,0,0,0,0|1,0,0]=3 3384 B11R1.23 Cc1cc(ccc1)C(=O)CO Amb18182731 [1,1,0,0,0,0|1,0,0]=3 3385 B11R1.23 Cc1cc(ccc1)C(=S)NC Amb24635576 [1,1,0,0,0,0|1,1,0]=4 3386 B11R1.23 Cc1cc[n]c([n]1)C(=O)OC Amb21857157 [1,1,0,0,0,0|2,0,0]=4 3387 B11R1.23 Cc1cc[n]c(c1)C(=O)CC Amb20247623 [1,1,0,0,0,0|1,0,0]=3 3388 B11R1.23 Cc1cc[n]c(c1)C(=O)OC Amb21963460 [1,1,0,0,0,0|1,0,0]=3 3389 B11R1.23 Cc1cccc([n]1)C(=O)CBr Amb22295844 [1,1,0,0,0,0|2,0,0]=4 3390 B11R1.23 Cc1cccc([n]1)C(=O)CC Amb24182056 [1,1,0,0,0,0|1,0,0]=3 3391 B11R1.23 Cc1cccc([n]1)C(=O)CCl Amb24676223 [1,1,0,0,0,0|2,0,0]=4 3392 B11R1.23 Cc1cccc([n]1)C(=O)CN Amb25152776 [1,1,0,0,0,0|2,0,0]=4 3393 B11R1.23 Cc1cccc(c1)C(Br)CC Amb25131128 [1,1,0,0,0,0|1,0,1]=4 3394 B11R1.23 Cc1cccc(c1)C(C)CC Amb22755118 [1,1,0,0,0,0|1,0,1]=4 3395 B11R1.23 Cc1cccc(c1)C(Cl)CC Amb24739513 [1,1,0,0,0,0|1,0,1]=4 3396 B11R1.23 Cc1cccc(c1)C(O)OC Amb24661117 [1,1,0,0,0,0|0,0,2]=4 3397 B11R1.23 Cc1cccc(c1)C(S)CC Amb25703808 [1,1,0,0,0,0|0,1,1]=4 3398 B11R1.23 Cc1cccc(c1)N(C)CC Amb24689118 [1,1,0,0,0,0|2,0,0]=4 3399 B11R1.23 Cc1cccc(c1)[C@@H](N)CC Amb22298573 [1,1,0,0,0,0|1,0,1]=4 3400 B11R1.23 Cc1cccc(c1)[C@@H](O)CC Amb25794428 [1,1,0,0,0,0|0,0,2]=4 3401 B11R1.23 Cc1cccc(c1)[C@H](N)CC Amb22298529 [1,1,0,0,0,0|1,0,1]=4 3402 B11R1.23 Cc1cccc(c1)[C@H](N)CC Amb25145723 [1,1,0,0,0,0|1,0,1]=4 3403 B11R1.23 Cc1cccc(c1)[C@H](O)CC Amb25151427 [1,1,0,0,0,0|0,0,2]=4 3404 B11R1.23 ClCC(=O)c1cccc(c1)Br Amb17345812 [1,1,0,0,0,0|1,0,0]=3 3405 B11R1.23 ClCC(=O)c1cccc(c1)F Amb10873159 [1,1,0,0,0,0|1,0,0]=3 3406 B11R1.23 N#CC(=O)c1cccc(Br)c1 Amb22269768 [1,1,0,0,0,0|1,0,1]=4 3407 B11R1.23 N#CC(=O)c1cccc(c1)C Amb17231995 [1,1,0,0,0,0|1,0,1]=4 3408 B11R1.23 N#CC(=O)c1cccc(c1)F Amb17232049 [1,1,0,0,0,0|1,0,1]=4 3409 B11R1.23 NCC(=O)c1c[n]cc(Br)c1 Amb23586097 [1,1,0,0,0,0|2,0,0]=4 3410 B11R1.23 NCC(=O)c1cc[n]c(Cl)c1 Amb25152794 [1,1,0,0,0,0|2,0,0]=4 3411 B11R1.23 NCC(=O)c1cccc(Br)c1 Amb18281391 [1,1,0,0,0,0|1,0,0]=3 3412 B11R1.23 NCC(=O)c1cccc(Cl)c1 Amb18951219 [1,1,0,0,0,0|1,0,0]=3 3413 B11R1.23 NCC(=O)c1cccc(F)c1 Amb18951218 [1,1,0,0,0,0|1,0,0]=3 3414 B11R1.23 NCC(=O)c1cccc(c1)C Amb10976904 [1,1,0,0,0,0|1,0,0]=3 3415 B11R1.23 NCC(=O)c1cccc(c1)F Amb10840040 [1,1,0,0,0,0|1,0,0]=3 3416 B11R1.23 NCC(=O)c1cccc(c1)O Amb17593761 [1,1,0,0,0,0|1,0,0]=3 3417 B11R1.23 NNC(=O)c1cccc(S)c1 Amb24460345 [1,1,0,0,0,0|2,0,0]=4 3418 B11R1.23 NNC(=O)c1cccc(c1)Br Amb1906809 [1,1,0,0,0,0|2,0,0]=4 3419 B11R1.23 NNC(=O)c1cccc(c1)Cl Amb1207384 [1,1,0,0,0,0|2,0,0]=4 3420 B11R1.23 NNC(=O)c1cccc(c1)F Amb1129033 [1,1,0,0,0,0|2,0,0]=4 3421 B11R1.23 NNC(=O)c1cccc(c1)O Amb1208719 [1,1,0,0,0,0|2,0,0]=4 3422 B11R1.23 Nc1cc(c[n]c1)C(=O)CBr Amb25200142 [1,1,0,0,0,0|2,0,0]=4 3423 B11R1.23 Nc1cc(cc[n]1)C(=O)CBr Amb20670962 [1,1,0,0,0,0|2,0,0]=4 3424 B11R1.23 Nc1cc(cc[n]1)C(=O)CN Amb25820947 [1,1,0,0,0,0|2,0,0]=4 3425 B11R1.23 Nc1cc(ccc1)C(=O)CBr Amb24064137 [1,1,0,0,0,0|1,0,0]=3 3426 B11R1.23 Nc1cc(ccc1)C(=O)CO Amb24630822 [1,1,0,0,0,0|1,0,0]=3 3427 B11R1.23 Nc1cc(ccc1)C(=O)NO Amb24729125 [1,1,0,0,0,0|2,0,0]=4 3428 B11R1.23 O=C(C=O)c1cc(Br)ccc1 Amb20671217 [1,1,0,0,0,0|1,0,1]=4 3429 B11R1.23 O=C(C=O)c1cc(Cl)ccc1 Amb18126569 [1,1,0,0,0,0|1,0,1]=4 3430 B11R1.23 O=C(CBr)c1c[n]cc(Cl)c1 Amb24415497 [1,1,0,0,0,0|2,0,0]=4 3431 B11R1.23 O=C(CBr)c1cc(Br)[n]cc1 Amb24663322 [1,1,0,0,0,0|2,0,0]=4 3432 B11R1.23 O=C(CBr)c1cc(Br)cc[n]1 Amb24420774 [1,1,0,0,0,0|2,0,0]=4 3433 B11R1.23 O=C(CBr)c1cc(Cl)cc[n]1 Amb22728908 [1,1,0,0,0,0|2,0,0]=4 3434 B11R1.23 O=C(CBr)c1cc(F)cc[n]1 Amb25706118 [1,1,0,0,0,0|2,0,0]=4 3435 B11R1.23 O=C(CBr)c1cc[n]c(Cl)c1 Amb21964312 [1,1,0,0,0,0|2,0,0]=4 3436 B11R1.23 O=C(CBr)c1cccc(Br)[n]1 Amb22756086 [1,1,0,0,0,0|2,0,0]=4 3437 B11R1.23 O=C(CBr)c1cccc(Br)[n]1 Amb22756097 [1,1,0,0,0,0|2,0,0]=4 3438 B11R1.23 O=C(CCl)c1cc(Br)cc[n]1 Amb24554934 [1,1,0,0,0,0|2,0,0]=4 3439 B11R1.23 O=C(CCl)c1cc(Cl)[n]cc1 Amb25101602 [1,1,0,0,0,0|2,0,0]=4 3440 B11R1.23 O=C(CCl)c1cc(Cl)c[n]c1 Amb25053296 [1,1,0,0,0,0|2,0,0]=4 3441 B11R1.23 O=C(CCl)c1cc(Cl)cc[n]1 Amb25748945 [1,1,0,0,0,0|2,0,0]=4 3442 B11R1.23 O=C(CCl)c1cc[n]c(Br)c1 Amb25697728 [1,1,0,0,0,0|2,0,0]=4 3443 B11R1.23 O=C(CCl)c1cccc(Cl)[n]1 Amb24104205 [1,1,0,0,0,0|2,0,0]=4 3444 B11R1.23 O=C(CCl)c1cccc(F)[n]1 Amb24660267 [1,1,0,0,0,0|2,0,0]=4 3445 B11R1.23 O=C(CCl)c1cccc(I)c1 Amb25826664 [1,1,0,0,0,0|1,0,0]=3 3446 B11R1.23 O=C(CF)c1cc(F)ccc1 Amb23454840 [1,1,0,0,0,0|1,0,0]=3 3447 B11R1.23 O=C(CF)c1cccc(Br)[n]1 Amb25189530 [1,1,0,0,0,0|2,0,0]=4 3448 B11R1.23 O=C(CF)c1cccc(Cl)c1 Amb25714827 [1,1,0,0,0,0|1,0,0]=3 3449 B11R1.23 O=C(O[Na])c1cc(I)cc[n]1 Amb21955171 [1,1,0,0,0,0|2,0,0]=4 3450 B11R1.23 O=CC(=O)c1cccc(c1)Br Amb10067951 [1,1,0,0,0,0|1,0,1]=4 3451 B11R1.23 O=CC(=O)c1cccc(c1)Cl Amb10067952 [1,1,0,0,0,0|1,0,1]=4 3452 B11R1.23 O=CC(=O)c1cccc(c1)F Amb10605526 [1,1,0,0,0,0|1,0,1]=4 3453 B11R1.23 O=CC(=O)c1cccc(c1)F Amb10982490 [1,1,0,0,0,0|1,0,1]=4 3454 B11R1.23 OCC(=O)c1cccc(Br)[n]1 Amb24448164 [1,1,0,0,0,0|2,0,0]=4 3455 B11R1.23 OCC(=O)c1cccc(Br)c1 Amb24579747 [1,1,0,0,0,0|1,0,0]=3 3456 B11R1.23 OCC(=O)c1cccc(Cl)c1 Amb18185666 [1,1,0,0,0,0|1,0,0]=3 3457 B11R1.23 OCC(=O)c1cccc(F)c1 Amb18182894 [1,1,0,0,0,0|1,0,0]=3 3458 B11R1.23 Oc1cc(c[n]c1)C(=O)CBr Amb24743438 [1,1,0,0,0,0|2,0,0]=4 3459 B11R1.23 Oc1cc(c[n]c1)C(=O)CCl Amb25723762 [1,1,0,0,0,0|2,0,0]=4 3460 B11R1.23 Oc1cc(ccc1)C(=O)C=O Amb18125054 [1,1,0,0,0,0|1,0,1]=4 3461 B11R1.23 Oc1cc(ccc1)C(=O)CCl Amb18126733 [1,1,0,0,0,0|1,0,0]=3 3462 B11R1.23 Oc1cc(ccc1)C(=O)CO Amb24334804 [1,1,0,0,0,0|1,0,0]=3 3463 B11R1.23 Oc1cc(ccc1)C(=O)OF Amb25334914 [1,1,0,0,0,0|1,0,0]=3 3464 B11R1.23 [Na]OC(=O)c1cccc(c1)I Amb10564565 [1,1,0,0,0,0|1,0,0]=3 3465 B11R1.23 [O-][n+]1cc(ncc1)C(=O)OC Amb10552567 [1,1,0,0,0,0|2,0,0]=4 3466 B11R1.36 BrC(Br)C(=O)c1ccccc1 Amb17940392 [1,1,0,0,0,0|1,0,0]=3 3467 B11R1.36 C=C(Br)C(=O)c1ccccc1 Amb25208336 [1,1,0,0,0,0|0,0,2]=4 3468 B11R1.36 C=C(C(F)F)c1ccccc1 Amb22008092 [1,1,0,0,0,0|2,0,0]=4 3469 B11R1.36 C=C(F)C(=O)c1ccccc1 Amb25347602 [1,1,0,0,0,0|0,0,2]=4 3470 B11R1.36 C=[N+]([O-])C(=O)c1ccccc1 Amb24069126 [1,1,0,0,0,0|1,0,1]=4 3471 B11R1.36 CC(=C)C(=O)c1cc[n]cc1 Amb24413658 [1,1,0,0,0,0|1,0,1]=4 3472 B11R1.36 CC(=C)C(=O)c1ccc[n]c1 Amb25139926 [1,1,0,0,0,0|1,0,1]=4 3473 B11R1.36 CC(=N)C(=O)c1ccccc1 Amb24612580 [1,1,0,0,0,0|0,0,1]=3 3474 B11R1.36 CC(=O)C(=C)c1ccccc1 Amb24062191 [1,1,0,0,0,0|1,0,1]=4 3475 B11R1.36 CC(=O)C(=O)c1c[n]ccc1 Amb25152863 [1,1,0,0,0,0|1,0,1]=4 3476 B11R1.36 CC(Br)C(=N)c1ccccc1 Amb25770551 [1,1,0,0,0,0|1,0,0]=3 3477 B11R1.36 CC(Br)C(=O)c1c[n]c[n]c1 Amb22500051 [1,1,0,0,0,0|2,0,0]=4 3478 B11R1.36 CC(Br)C(=O)c1cc[n]cc1 Amb22500048 [1,1,0,0,0,0|1,0,0]=3 3479 B11R1.36 CC(Br)C(=O)c1ccc[n]c1 Amb22500049 [1,1,0,0,0,0|1,0,0]=3 3480 B11R1.36 CC(Br)C(=O)c1cccc[n]1 Amb22500042 [1,1,0,0,0,0|1,0,0]=3 3481 B11R1.36 CC(Br)C(Br)c1ccccc1 Amb25067299 [1,1,0,0,0,0|1,0,1]=4 3482 B11R1.36 CC(Br)C(F)c1ccccc1 Amb24375780 [1,1,0,0,0,0|1,0,1]=4 3483 B11R1.36 CC(Br)C(N)c1ccccc1 Amb24542749 [1,1,0,0,0,0|1,0,1]=4 3484 B11R1.36 CC(Br)[C@@H](O)c1ccccc1 Amb25218214 [1,1,0,0,0,0|0,0,2]=4 3485 B11R1.36 CC(Br)[C@H](O)c1ccccc1 Amb25835623 [1,1,0,0,0,0|0,0,2]=4 3486 B11R1.36 CC(C(=O)c1ccccc1)F Amb10603603 [1,1,0,0,0,0|0,0,0]=2 3487 B11R1.36 CC(C(=O)c1cccnc1)C Amb10607959 [1,1,0,0,0,0|1,0,0]=3 3488 B11R1.36 CC(C(C)Br)c1ccccc1 Amb25191202 [1,1,0,0,0,0|1,0,1]=4 3489 B11R1.36 CC(C(C)Cl)c1ccccc1 Amb25832184 [1,1,0,0,0,0|1,0,1]=4 3490 B11R1.36 CC(C(C)N)c1ccccc1 Amb18125050 [1,1,0,0,0,0|1,0,1]=4 3491 B11R1.36 CC(C(C)N)c1ccccc1 Amb22477704 [1,1,0,0,0,0|1,0,1]=4 3492 B11R1.36 CC(C)=C(N)c1ccccc1 Amb24453064 [1,1,0,0,0,0|1,0,1]=4 3493 B11R1.36 CC(C)C(=O)c1[n]ccc[n]1 Amb18791459 [1,1,0,0,0,0|2,0,0]=4 3494 B11R1.36 CC(C)C(=O)c1c[n]c[n]c1 Amb18182734 [1,1,0,0,0,0|2,0,0]=4 3495 B11R1.36 CC(C)C(=O)c1c[n]cc[n]1 Amb18179374 [1,1,0,0,0,0|2,0,0]=4 3496 B11R1.36 CC(C)C(=O)c1cc[n]c[n]1 Amb25278086 [1,1,0,0,0,0|2,0,0]=4 3497 B11R1.36 CC(C)C(=O)c1cc[n]cc1 Amb19374024 [1,1,0,0,0,0|1,0,0]=3 3498 B11R1.36 CC(C)C(=O)c1ccc[n][n]1 Amb24697040 [1,1,0,0,0,0|2,0,0]=4 3499 B11R1.36 CC(C)C(Br)c1ccccc1 Amb20667915 [1,1,0,0,0,0|1,0,1]=4 3500 B11R1.36 CC(C)C(N)c1ccccc1 Amb22001648 [1,1,0,0,0,0|1,0,1]=4 3501 B11R1.36 CC(C)C(S)c1ccccc1 Amb18180117 [1,1,0,0,0,0|0,1,1]=4 3502 B11R1.36 CC(C)N(C)c1ccccc1 Amb24096678 [1,1,0,0,0,0|2,0,0]=4 3503 B11R1.36 CC(C)N(N)c1ccccc1 Amb18125185 [1,1,0,0,0,0|2,0,0]=4 3504 B11R1.36 CC(C)S(=O)c1ccccc1 Amb24484364 [1,1,0,0,0,0|1,0,0]=3 3505 B11R1.36 CC(C)[C@@H](N)c1ccccc1 Amb22288656 [1,1,0,0,0,0|1,0,1]=4 3506 B11R1.36 CC(C)[C@@H](O)c1ccccc1 Amb22225177 [1,1,0,0,0,0|0,0,2]=4 3507 B11R1.36 CC(C)[C@H](Cl)c1ccccc1 Amb25028094 [1,1,0,0,0,0|1,0,1]=4 3508 B11R1.36 CC(C)[C@H](N)c1ccccc1 Amb22284327 [1,1,0,0,0,0|1,0,1]=4 3509 B11R1.36 CC(C)[C@H](N)c1ccccc1 Amb22288702 [1,1,0,0,0,0|1,0,1]=4 3510 B11R1.36 CC(C)[C@H](O)c1ccccc1 Amb22226521 [1,1,0,0,0,0|0,0,2]=4 3511 B11R1.36 CC(Cl)C(=O)C1C=CC=CO1 Amb24104144 [1,1,0,0,0,0|1,0,1]=4 3512 B11R1.36 CC(Cl)C(=O)c1ccc[n]c1 Amb24104182 [1,1,0,0,0,0|1,0,0]=3 3513 B11R1.36 CC(Cl)C(=O)c1cccc[n]1 Amb25700298 [1,1,0,0,0,0|1,0,0]=3 3514 B11R1.36 CC(Cl)C(F)c1ccccc1 Amb25095827 [1,1,0,0,0,0|1,0,1]=4 3515 B11R1.36 CC(Cl)S(=O)c1ccccc1 Amb25273905 [1,1,0,0,0,0|1,0,0]=3 3516 B11R1.36 CC(N)C(=C)c1ccccc1 Amb23536391 [1,1,0,0,0,0|1,0,0]=3 3517 B11R1.36 CC(N)C(=O)c1c[n]c[n]c1 Amb25291754 [1,1,0,0,0,0|2,0,0]=4 3518 B11R1.36 CC(N)C(=O)c1cc[n]cc1 Amb18201927 [1,1,0,0,0,0|1,0,0]=3 3519 B11R1.36 CC(N)C(=O)c1ccc[n]c1 Amb18201928 [1,1,0,0,0,0|1,0,0]=3 3520 B11R1.36 CC(N)C(=O)c1cccc[n]1 Amb18201931 [1,1,0,0,0,0|1,0,0]=3 3521 B11R1.36 CC(N)C(Br)c1ccccc1 Amb24542874 [1,1,0,0,0,0|1,0,1]=4 3522 B11R1.36 CC(N)C(F)c1ccccc1 Amb25189148 [1,1,0,0,0,0|1,0,1]=4 3523 B11R1.36 CC(N)C(N)c1ccccc1 Amb18644444 [1,1,0,0,0,0|1,0,1]=4 3524 B11R1.36 CC(O)C(=C)c1ccccc1 Amb25226435 [1,1,0,0,0,0|1,0,0]=3 3525 B11R1.36 CC(O)C(=O)c1c[n]c[n]c1 Amb24384663 [1,1,0,0,0,0|2,0,0]=4 3526 B11R1.36 CC(O)C(=O)c1c[n]cc[n]1 Amb25133379 [1,1,0,0,0,0|2,0,0]=4 3527 B11R1.36 CC(O)C(=O)c1ccc[n]c1 Amb25712989 [1,1,0,0,0,0|1,0,0]=3 3528 B11R1.36 CC(O)C(=O)c1ccccc1 Amb18799361 [1,1,0,0,0,0|0,0,0]=2 3529 B11R1.36 CC(O)C(Cl)c1ccccc1 Amb25724947 [1,1,0,0,0,0|1,0,1]=4 3530 B11R1.36 CC(O)C(F)c1ccccc1 Amb25148218 [1,1,0,0,0,0|1,0,1]=4 3531 B11R1.36 CC(O)C(S)c1ccccc1 Amb25145349 [1,1,0,0,0,0|0,1,1]=4 3532 B11R1.36 CC(O)[C@H](N)c1ccccc1 Amb24659547 [1,1,0,0,0,0|1,0,1]=4 3533 B11R1.36 CC(S)C(=O)c1ccccc1 Amb25142605 [1,1,0,0,0,0|0,0,0]=2 3534 B11R1.36 CN(C(=N)c1ccccc1)N Amb10870953 [1,1,0,0,0,0|2,0,0]=4 3535 B11R1.36 CN(C(=O)c1ccccn1)O Amb10572675 [1,1,0,0,0,0|2,0,0]=4 3536 B11R1.36 CN(C)C(=N)c1ccccc1 Amb23447126 [1,1,0,0,0,0|2,0,0]=4 3537 B11R1.36 CN(N)C(=O)c1cc[n]cc1 Amb24566840 [1,1,0,0,0,0|2,0,0]=4 3538 B11R1.36 CN(N)C(=O)c1ccccc1 Amb18125146 [1,1,0,0,0,0|1,0,0]=3 3539 B11R1.36 CN(O)C(=O)c1ccc[n]c1 Amb24062385 [1,1,0,0,0,0|2,0,0]=4 3540 B11R1.36 CN(O)C(=O)c1ccccc1 Amb25082592 [1,1,0,0,0,0|1,0,0]=3 3541 B11R1.36 C[C@@H](C(=O)c1ccccc1)N Amb17610655 [1,1,0,0,0,0|0,0,0]=2 3542 B11R1.36 C[C@@H](C(C)N)c1ccccc1 Amb25200252 [1,1,0,0,0,0|1,0,1]=4 3543 B11R1.36 C[C@@H](Cl)C(=O)c1ccccc1 Amb24068213 [1,1,0,0,0,0|0,0,0]=2 3544 B11R1.36 C[C@@H](Cl)[C@@H](Cl)c1ccccc1 Amb24635727 [1,1,0,0,0,0|1,0,1]=4 3545 B11R1.36 C[C@@H](Cl)[C@@H](O)c1ccccc1 Amb24602441 [1,1,0,0,0,0|0,0,2]=4 3546 B11R1.36 C[C@@H](Cl)[C@H](O)c1ccccc1 Amb24433948 [1,1,0,0,0,0|0,0,2]=4 3547 B11R1.36 C[C@@H](F)C(=O)c1ccccc1 Amb24068215 [1,1,0,0,0,0|0,0,0]=2 3548 B11R1.36 C[C@@H](F)[C@@H](O)c1ccccc1 Amb25346193 [1,1,0,0,0,0|0,0,2]=4 3549 B11R1.36 C[C@@H](N)C(=O)c1ccccc1 Amb19131140 [1,1,0,0,0,0|0,0,0]=2 3550 B11R1.36 C[C@@H](N)C(=O)c1ccccc1 Amb25757602 [1,1,0,0,0,0|0,0,0]=2 3551 B11R1.36 C[C@@H](N)[C@@H](S)c1ccccc1 Amb25129484 [1,1,0,0,0,0|0,1,1]=4 3552 B11R1.36 C[C@@H](O)C(=O)c1ccc[n]c1 Amb24608705 [1,1,0,0,0,0|1,0,0]=3 3553 B11R1.36 C[C@@H](O)[C@@H](Br)c1ccccc1 Amb25075563 [1,1,0,0,0,0|1,0,1]=4 3554 B11R1.36 C[C@@H](O)[C@@H](Cl)c1ccccc1 Amb25310965 [1,1,0,0,0,0|1,0,1]=4 3555 B11R1.36 C[C@@H](O)[C@@H](N)c1ccccc1 Amb24695036 [1,1,0,0,0,0|1,0,1]=4 3556 B11R1.36 C[C@@H](O)[C@@H](O)c1ccccc1 Amb23604600 [1,1,0,0,0,0|0,0,2]=4 3557 B11R1.36 C[C@@H](O)[C@H](Cl)c1ccccc1 Amb24433930 [1,1,0,0,0,0|1,0,1]=4 3558 B11R1.36 C[C@@H](O)[C@H](N)c1ccccc1 Amb25794225 [1,1,0,0,0,0|1,0,1]=4 3559 B11R1.36 C[C@@H](O)[C@H](O)c1ccccc1 Amb25789551 [1,1,0,0,0,0|0,0,2]=4 3560 B11R1.36 C[C@@H]([C@@H](C)N)c1ccccc1 Amb25789348 [1,1,0,0,0,0|1,0,1]=4 3561 B11R1.36 C[C@@H](c1ccccc1)[C@@H](O)C Amb16210577 [1,1,0,0,0,0|1,0,1]=4 3562 B11R1.36 C[C@H](Br)C(=O)c1ccccc1 Amb25689646 [1,1,0,0,0,0|0,0,0]=2 3563 B11R1.36 C[C@H](Br)[C@@H](F)c1ccccc1 Amb25055861 [1,1,0,0,0,0|1,0,1]=4 3564 B11R1.36 C[C@H](Br)[C@@H](O)c1ccccc1 Amb25844405 [1,1,0,0,0,0|0,0,2]=4 3565 B11R1.36 C[C@H](Br)[C@H](F)c1ccccc1 Amb25313145 [1,1,0,0,0,0|1,0,1]=4 3566 B11R1.36 C[C@H](C(C)N)c1ccccc1 Amb25339523 [1,1,0,0,0,0|1,0,1]=4 3567 B11R1.36 C[C@H](C(C)O)c1ccccc1 Amb24372048 [1,1,0,0,0,0|1,0,1]=4 3568 B11R1.36 C[C@H](Cl)C(=O)c1ccccc1 Amb24068277 [1,1,0,0,0,0|0,0,0]=2 3569 B11R1.36 C[C@H](Cl)S(=O)c1ccccc1 Amb25111210 [1,1,0,0,0,0|1,0,0]=3 3570 B11R1.36 C[C@H](Cl)[C@@H](N)c1ccccc1 Amb25211090 [1,1,0,0,0,0|1,0,1]=4 3571 B11R1.36 C[C@H](Cl)[C@H](Cl)c1ccccc1 Amb25322171 [1,1,0,0,0,0|1,0,1]=4 3572 B11R1.36 C[C@H](Cl)[C@H](O)c1ccccc1 Amb24442982 [1,1,0,0,0,0|0,0,2]=4 3573 B11R1.36 C[C@H](N)C(=O)c1ccccc1 Amb25853969 [1,1,0,0,0,0|0,0,0]=2 3574 B11R1.36 C[C@H](N)[C@@H](Cl)c1ccccc1 Amb24740855 [1,1,0,0,0,0|1,0,1]=4 3575 B11R1.36 C[C@H](N)[C@@H](F)c1ccccc1 Amb25251481 [1,1,0,0,0,0|1,0,1]=4 3576 B11R1.36 C[C@H](N)[C@@H](N)c1ccccc1 Amb25053950 [1,1,0,0,0,0|1,0,1]=4 3577 B11R1.36 C[C@H](N)[C@@H](O)c1ccccc1 Amb22349976 [1,1,0,0,0,0|0,0,2]=4 3578 B11R1.36 C[C@H](N)[C@@H](S)c1ccccc1 Amb25241973 [1,1,0,0,0,0|0,1,1]=4 3579 B11R1.36 C[C@H](N)[C@H](F)c1ccccc1 Amb25073105 [1,1,0,0,0,0|1,0,1]=4 3580 B11R1.36 C[C@H](O)C(=C)c1ccccc1 Amb25188700 [1,1,0,0,0,0|1,0,0]=3 3581 B11R1.36 C[C@H](O)C(=O)c1ccc[n]c1 Amb25714471 [1,1,0,0,0,0|1,0,0]=3 3582 B11R1.36 C[C@H](O)C(=O)c1cccc[n]1 Amb24486355 [1,1,0,0,0,0|1,0,0]=3 3583 B11R1.36 C[C@H](O)C(=O)c1ccccc1 Amb25151480 [1,1,0,0,0,0|0,0,0]=2 3584 B11R1.36 C[C@H](O)C(O)c1ccccc1 Amb25806789 [1,1,0,0,0,0|0,0,2]=4 3585 B11R1.36 C[C@H](O)[C@@H](Cl)c1ccccc1 Amb25288148 [1,1,0,0,0,0|1,0,1]=4 3586 B11R1.36 C[C@H](O)[C@@H](N)c1ccccc1 Amb25791116 [1,1,0,0,0,0|1,0,1]=4 3587 B11R1.36 C[C@H](O)[C@@H](O)c1ccccc1 Amb25149680 [1,1,0,0,0,0|0,0,2]=4 3588 B11R1.36 C[C@H](O)[C@H](Cl)c1ccccc1 Amb25211675 [1,1,0,0,0,0|1,0,1]=4 3589 B11R1.36 C[C@H](O)[C@H](O)c1ccccc1 Amb25362712 [1,1,0,0,0,0|0,0,2]=4 3590 B11R1.36 C[C@H]([C@@H](C)Cl)c1ccccc1 Amb24652492 [1,1,0,0,0,0|1,0,1]=4 3591 B11R1.36 C\C(\N)=C(/O)\c1ccccc1 Amb24097762 [1,1,0,0,0,0|0,0,2]=4 3592 B11R1.36 C\C(\c1ccccc1)=C(\C)/Br Amb25211055 [1,1,0,0,0,0|1,0,1]=4 3593 B11R1.36 ClC(c1ccccc1)C(C)C Amb17138646 [1,1,0,0,0,0|1,0,1]=4 3594 B11R1.36 ClC(c1ccccc1)C(N)C Amb17594246 [1,1,0,0,0,0|1,0,1]=4 3595 B11R1.36 FC(C(=O)c1ccccn1)F Amb10839623 [1,1,0,0,0,0|2,0,0]=4 3596 B11R1.36 NC(=O)C(=O)c1ccccc1 Amb18560879 [1,1,0,0,0,0|1,0,1]=4 3597 B11R1.36 NC(c1ccccc1)C(C)C Amb1129834 [1,1,0,0,0,0|1,0,1]=4 3598 B11R1.36 N[C@@H](c1ccccc1)C(C)C Amb10608147 [1,1,0,0,0,0|1,0,1]=4 3599 B11R1.36 O=C(C(=S)Cl)c1ccccc1 Amb24096825 [1,1,0,0,0,0|1,0,1]=4 3600 B11R1.36 O=C(C(Br)Br)c1cccc[n]1 Amb24528971 [1,1,0,0,0,0|2,0,0]=4 3601 B11R1.36 O=C(C(Cl)Br)c1ccccc1 Amb25240116 [1,1,0,0,0,0|1,0,0]=3 3602 B11R1.36 O=C(C(F)Br)c1ccccc1 Amb24104059 [1,1,0,0,0,0|1,0,0]=3 3603 B11R1.36 O=C(C(F)Cl)c1ccccc1 Amb24104242 [1,1,0,0,0,0|1,0,0]=3 3604 B11R1.36 O=C(C(F)F)c1cc[n]cc1 Amb22388666 [1,1,0,0,0,0|2,0,0]=4 3605 B11R1.36 O=C(C(F)F)c1ccc[n]c1 Amb24487720 [1,1,0,0,0,0|2,0,0]=4 3606 B11R1.36 O=C(c1ccccc1)C(=C)C Amb17593661 [1,1,0,0,0,0|0,0,1]=3 3607 B11R1.36 O=C(c1ccccc1)C(=O)Br Amb24096833 [1,1,0,0,0,0|1,0,1]=4 3608 B11R1.36 O=C(c1ccccc1)C(=O)C Amb2099500 [1,1,0,0,0,0|0,0,1]=3 3609 B11R1.36 O=C(c1ccccc1)C(=O)Cl Amb17594226 [1,1,0,0,0,0|1,0,1]=4 3610 B11R1.36 O=S(C(F)F)c1ccccc1 Amb25275653 [1,1,0,0,0,0|2,0,0]=4 3611 B11R1.36 OB(O)C(=O)c1ccccc1 Amb25260688 [1,1,0,0,0,0|2,0,0]=4 3612 B11R1.36 OC(Br)C(=O)c1ccccc1 Amb24104060 [1,1,0,0,0,0|1,0,0]=3 3613 B11R1.36 OC(Cl)C(=O)c1ccccc1 Amb24528115 [1,1,0,0,0,0|1,0,0]=3 3614 B11R1.36 OC(O)C(=O)c1ccc[n]c1 Amb24408354 [1,1,0,0,0,0|2,0,0]=4 3615 B11R1.36 OC(c1ccccc1)C(Br)C Amb17595842 [1,1,0,0,0,0|0,0,2]=4 3616 B11R1.36 O[C@@H](c1ccccc1)[C@@H](N)C Amb17619646 [1,1,0,0,0,0|0,0,2]=4 3617 B11R1.36 O[C@H](c1ccccc1)[C@H](N)C Amb10071337 [1,1,0,0,0,0|0,0,2]=4 3618 B11R1.222 BrCC(=O)c1ccccc1Br Amb1106771 [1,1,0,0,0,0|1,0,0]=3 3619 B11R1.222 BrCC(=O)c1ccccc1F Amb1106770 [1,1,0,0,0,0|1,0,0]=3 3620 B11R1.222 BrCC(=O)c1ncccc1O Amb16233294 [1,1,0,0,0,0|2,0,0]=4 3621 B11R1.222 C#CC(=O)c1ccccc1N Amb24351123 [1,1,0,0,0,0|0,0,2]=4 3622 B11R1.222 C=C(CO)c1ccccc1N Amb24685499 [1,1,0,0,0,0|2,0,0]=4 3623 B11R1.222 C=CC(=O)c1ccccc1Cl Amb25307612 [1,1,0,0,0,0|0,0,2]=4 3624 B11R1.222 C=CC(=O)c1ccccc1O Amb17593686 [1,1,0,0,0,0|0,0,2]=4 3625 B11R1.222 CCC(=C)c1ccccc1N Amb24069947 [1,1,0,0,0,0|1,0,0]=3 3626 B11R1.222 CCC(=C)c1ccccc1O Amb25718309 [1,1,0,0,0,0|1,0,0]=3 3627 B11R1.222 CCC(=O)c1[n]c[n]cc1Br Amb23455705 [1,1,0,0,0,0|2,0,0]=4 3628 B11R1.222 CCC(=O)c1[n]cc[n]c1Cl Amb25793998 [1,1,0,0,0,0|2,0,0]=4 3629 B11R1.222 CCC(=O)c1[n]cccc1Br Amb25133542 [1,1,0,0,0,0|1,0,0]=3 3630 B11R1.222 CCC(=O)c1[n]cccc1Cl Amb25687164 [1,1,0,0,0,0|1,0,0]=3 3631 B11R1.222 CCC(=O)c1[n]cccc1F Amb23412453 [1,1,0,0,0,0|1,0,0]=3 3632 B11R1.222 CCC(=O)c1[n]cccc1N Amb24433161 [1,1,0,0,0,0|1,0,0]=3 3633 B11R1.222 CCC(=O)c1c[n]ccc1N Amb25293482 [1,1,0,0,0,0|1,0,0]=3 3634 B11R1.222 CCC(=O)c1cc[n]cc1F Amb23455228 [1,1,0,0,0,0|1,0,0]=3 3635 B11R1.222 CCC(=O)c1cc[n]cc1N Amb23401919 [1,1,0,0,0,0|1,0,0]=3 3636 B11R1.222 CCC(=O)c1ccc[n]c1Br Amb24533130 [1,1,0,0,0,0|1,0,0]=3 3637 B11R1.222 CCC(=O)c1ccc[n]c1F Amb25723783 [1,1,0,0,0,0|1,0,0]=3 3638 B11R1.222 CCC(=O)c1ccccc1Br Amb17339933 [1,1,0,0,0,0|0,0,0]=2 3639 B11R1.222 CCC(=O)c1ccccc1C Amb16185657 [1,1,0,0,0,0|0,0,0]=2 3640 B11R1.222 CCC(=O)c1ccccc1Cl Amb17198735 [1,1,0,0,0,0|0,0,0]=2 3641 B11R1.222 CCC(=O)c1ccccc1N Amb1772753 [1,1,0,0,0,0|0,0,0]=2 3642 B11R1.222 CCC(=O)c1ccccc1O Amb1210123 [1,1,0,0,0,0|0,0,0]=2 3643 B11R1.222 CCC(=O)c1cccnc1Cl Amb10976561 [1,1,0,0,0,0|1,0,0]=3 3644 B11R1.222 CCC(Br)c1ccccc1Br Amb25797706 [1,1,0,0,0,0|1,0,1]=4 3645 B11R1.222 CCC(C)c1ccccc1Br Amb20617128 [1,1,0,0,0,0|1,0,1]=4 3646 B11R1.222 CCC(C)c1ccccc1I Amb24564175 [1,1,0,0,0,0|1,0,1]=4 3647 B11R1.222 CCC(Cl)c1ccccc1Br Amb25028217 [1,1,0,0,0,0|1,0,1]=4 3648 B11R1.222 CCC(Cl)c1ccccc1F Amb24440580 [1,1,0,0,0,0|1,0,1]=4 3649 B11R1.222 CCC(N)c1ccccc1Br Amb18966096 [1,1,0,0,0,0|1,0,1]=4 3650 B11R1.222 CCC(N)c1ccccc1Cl Amb22276945 [1,1,0,0,0,0|1,0,1]=4 3651 B11R1.222 CCC(N)c1ccccc1N Amb24069932 [1,1,0,0,0,0|1,0,1]=4 3652 B11R1.222 CCC(N)c1ccccc1O Amb19404313 [1,1,0,0,0,0|1,0,1]=4 3653 B11R1.222 CCC(N)c1ccccc1S Amb25225261 [1,1,0,0,0,0|1,0,1]=4 3654 B11R1.222 CCC(O)c1ccccc1I Amb25214528 [1,1,0,0,0,0|0,0,2]=4 3655 B11R1.222 CCC(O)c1ccccc1N Amb18125284 [1,1,0,0,0,0|0,0,2]=4 3656 B11R1.222 CCC(c1ccccc1C)N Amb17232057 [1,1,0,0,0,0|1,0,1]=4 3657 B11R1.222 CCC(c1ccccc1C)O Amb17232069 [1,1,0,0,0,0|0,0,2]=4 3658 B11R1.222 CCC(c1ccccc1Cl)N Amb17232736 [1,1,0,0,0,0|1,0,1]=4 3659 B11R1.222 CCC(c1ccccc1Cl)O Amb17232794 [1,1,0,0,0,0|0,0,2]=4 3660 B11R1.222 CCC(c1ccccc1F)N Amb10840595 [1,1,0,0,0,0|1,0,1]=4 3661 B11R1.222 CCC(c1ccccc1O)N Amb1118100 [1,1,0,0,0,0|1,0,1]=4 3662 B11R1.222 CCC(c1ccccc1O)O Amb1111067 [1,1,0,0,0,0|0,0,2]=4 3663 B11R1.222 CCS(=O)c1[n]cccc1N Amb18284953 [1,1,0,0,0,0|2,0,0]=4 3664 B11R1.222 CCS(=O)c1cc[n]cc1N Amb18284722 [1,1,0,0,0,0|2,0,0]=4 3665 B11R1.222 CCS(=O)c1ccccc1Br Amb24502060 [1,1,0,0,0,0|1,0,0]=3 3666 B11R1.222 CCS(=O)c1ccccc1F Amb25312077 [1,1,0,0,0,0|1,0,0]=3 3667 B11R1.222 CCS(=O)c1ccccc1N Amb18955435 [1,1,0,0,0,0|1,0,0]=3 3668 B11R1.222 CC[C@@H](C)c1ccccc1N Amb24101983 [1,1,0,0,0,0|1,0,1]=4 3669 B11R1.222 CC[C@@H](N)c1ccccc1Br Amb25095650 [1,1,0,0,0,0|1,0,1]=4 3670 B11R1.222 CC[C@@H](N)c1ccccc1Cl Amb22298516 [1,1,0,0,0,0|1,0,1]=4 3671 B11R1.222 CC[C@@H](N)c1ccccc1F Amb22288620 [1,1,0,0,0,0|1,0,1]=4 3672 B11R1.222 CC[C@@H](N)c1ccccc1I Amb24383024 [1,1,0,0,0,0|1,0,1]=4 3673 B11R1.222 CC[C@@H](N)c1ccccc1O Amb24477566 [1,1,0,0,0,0|1,0,1]=4 3674 B11R1.222 CC[C@@H](N)c1ccccc1S Amb24726023 [1,1,0,0,0,0|1,0,1]=4 3675 B11R1.222 CC[C@@H](O)c1ccccc1F Amb25719414 [1,1,0,0,0,0|0,0,2]=4 3676 B11R1.222 CC[C@@H](O)c1ccccc1O Amb24477561 [1,1,0,0,0,0|0,0,2]=4 3677 B11R1.222 CC[C@H](N)c1ccccc1Br Amb25149042 [1,1,0,0,0,0|1,0,1]=4 3678 B11R1.222 CC[C@H](N)c1ccccc1Cl Amb22298557 [1,1,0,0,0,0|1,0,1]=4 3679 B11R1.222 CC[C@H](N)c1ccccc1Cl Amb24616798 [1,1,0,0,0,0|1,0,1]=4 3680 B11R1.222 CC[C@H](N)c1ccccc1F Amb22288682 [1,1,0,0,0,0|1,0,1]=4 3681 B11R1.222 CC[C@H](O)c1ccccc1Br Amb24447235 [1,1,0,0,0,0|0,0,2]=4 3682 B11R1.222 CC[C@H](O)c1ccccc1Cl Amb25188608 [1,1,0,0,0,0|0,0,2]=4 3683 B11R1.222 CN(CC)c1ccccc1I Amb25226039 [1,1,0,0,0,0|2,0,0]=4 3684 B11R1.222 CN(CC)c1ccccc1O Amb24079727 [1,1,0,0,0,0|2,0,0]=4 3685 B11R1.222 CN1CC=CC=C1C(=O)OC Amb24095929 [1,1,0,0,0,0|1,0,1]=4 3686 B11R1.222 CNC(=N)c1ccccc1Br Amb24458040 [1,1,0,0,0,0|2,0,0]=4 3687 B11R1.222 CNC(=N)c1ccccc1Cl Amb24509222 [1,1,0,0,0,0|2,0,0]=4 3688 B11R1.222 CNC(=N)c1ccccc1S Amb25805303 [1,1,0,0,0,0|2,0,0]=4 3689 B11R1.222 CNC(=O)c1[n]cccc1Br Amb24526721 [1,1,0,0,0,0|2,0,0]=4 3690 B11R1.222 CNC(=O)c1[n]cccc1N Amb18125265 [1,1,0,0,0,0|2,0,0]=4 3691 B11R1.222 CNC(=O)c1[n]cccc1O Amb22754647 [1,1,0,0,0,0|2,0,0]=4 3692 B11R1.222 CNC(=O)c1c[n]ccc1N Amb22263729 [1,1,0,0,0,0|2,0,0]=4 3693 B11R1.222 CNC(=O)c1cc[n]cc1F Amb25027872 [1,1,0,0,0,0|2,0,0]=4 3694 B11R1.222 CNC(=O)c1cc[n]cc1N Amb23556941 [1,1,0,0,0,0|2,0,0]=4 3695 B11R1.222 CNC(=O)c1cc[n]cc1O Amb25707778 [1,1,0,0,0,0|2,0,0]=4 3696 B11R1.222 CNC(=O)c1ccc[n]c1I Amb24421976 [1,1,0,0,0,0|2,0,0]=4 3697 B11R1.222 CNC(=O)c1ccc[n]c1O Amb18125363 [1,1,0,0,0,0|2,0,0]=4 3698 B11R1.222 CNC(=O)c1cccc[n+]1[O-] Amb24370487 [1,1,0,0,0,0|2,0,0]=4 3699 B11R1.222 CNC(=O)c1ccccc1F Amb1648925 [1,1,0,0,0,0|1,0,0]=3 3700 B11R1.222 CNC(=O)c1cccnc1N Amb16233797 [1,1,0,0,0,0|2,0,0]=4 3701 B11R1.222 CNC(=S)c1ccccc1Cl Amb22484599 [1,1,0,0,0,0|1,1,0]=4 3702 B11R1.222 CN\C(\F)=C/1\C=CC=CC1=O Amb24440975 [1,1,0,0,0,0|2,0,0]=4 3703 B11R1.222 CN\C(\N)=C/1\C=CC=CC1=O Amb24681966 [1,1,0,0,0,0|2,0,0]=4 3704 B11R1.222 COC(=C)c1ccccc1Br Amb20671367 [1,1,0,0,0,0|1,0,0]=3 3705 B11R1.222 COC(=N)C1=CC=CNC1=O Amb19650675 [1,1,0,0,0,0|2,0,0]=4 3706 B11R1.222 COC(=N)C1=CC=CNC1=O Amb21959612 [1,1,0,0,0,0|2,0,0]=4 3707 B11R1.222 COC(=N)c1[n]cccc1Br Amb25778892 [1,1,0,0,0,0|2,0,0]=4 3708 B11R1.222 COC(=N)c1[n]cccc1Cl Amb25149516 [1,1,0,0,0,0|2,0,0]=4 3709 B11R1.222 COC(=N)c1[n]cccc1F Amb24736447 [1,1,0,0,0,0|2,0,0]=4 3710 B11R1.222 COC(=N)c1cc[n]cc1Br Amb25259404 [1,1,0,0,0,0|2,0,0]=4 3711 B11R1.222 COC(=N)c1ccccc1Cl Amb18180241 [1,1,0,0,0,0|1,0,0]=3 3712 B11R1.222 COC(=N)c1ccccc1F Amb18065389 [1,1,0,0,0,0|1,0,0]=3 3713 B11R1.222 COC(=N)c1ccccc1O Amb25729105 [1,1,0,0,0,0|1,0,0]=3 3714 B11R1.222 COC(=O)C1=C(O)C=CCC1 Amb17593845 [1,1,0,0,0,0|0,0,2]=4 3715 B11R1.222 COC(=O)C1=CC=CNC1=O Amb19894701 [1,1,0,0,0,0|1,0,0]=3 3716 B11R1.222 COC(=O)C1=CC=COC1=O Amb19894704 [1,1,0,0,0,0|1,0,0]=3 3717 B11R1.222 COC(=O)C1=CC=NNC1=O Amb21857256 [1,1,0,0,0,0|2,0,0]=4 3718 B11R1.222 COC(=O)C1=CN=CNC1=O Amb19887177 [1,1,0,0,0,0|2,0,0]=4 3719 B11R1.222 COC(=O)C1=CSC=CC1=O Amb25142716 [1,1,0,0,0,0|1,0,0]=3 3720 B11R1.222 COC(=O)C=1NC=CNC1N Amb24483579 [1,1,0,0,0,0|2,0,0]=4 3721 B11R1.222 COC(=O)N1C=CC=CC1C Amb24060018 [1,1,0,0,0,0|1,0,1]=4 3722 B11R1.222 COC(=O)[C@H]1OC=CC=C1O Amb25074507 [1,1,0,0,0,0|1,0,1]=4 3723 B11R1.222 COC(=O)c1[n]c[n]cc1O Amb24648769 [1,1,0,0,0,0|2,0,0]=4 3724 B11R1.222 COC(=O)c1[n]cc[n]c1I Amb19958598 [1,1,0,0,0,0|2,0,0]=4 3725 B11R1.222 COC(=O)c1[n]cccc1Br Amb20247124 [1,1,0,0,0,0|1,0,0]=3 3726 B11R1.222 COC(=O)c1[n]cccc1Cl Amb19957514 [1,1,0,0,0,0|1,0,0]=3 3727 B11R1.222 COC(=O)c1c[n]c[n]c1Br Amb22496090 [1,1,0,0,0,0|2,0,0]=4 3728 B11R1.222 COC(=O)c1c[n]c[n]c1Cl Amb22262999 [1,1,0,0,0,0|2,0,0]=4 3729 B11R1.222 COC(=O)c1c[n]c[n]c1N Amb19957748 [1,1,0,0,0,0|2,0,0]=4 3730 B11R1.222 COC(=O)c1c[n]c[n]c1S Amb25300939 [1,1,0,0,0,0|2,0,0]=4 3731 B11R1.222 COC(=O)c1c[n]ccc1Cl Amb19957887 [1,1,0,0,0,0|1,0,0]=3 3732 B11R1.222 COC(=O)c1c[n]ccc1S Amb25242589 [1,1,0,0,0,0|1,0,0]=3 3733 B11R1.222 COC(=O)c1cc[n][n]c1N Amb22523474 [1,1,0,0,0,0|2,0,0]=4 3734 B11R1.222 COC(=O)c1cc[n]cc1F Amb22411142 [1,1,0,0,0,0|1,0,0]=3 3735 B11R1.222 COC(=O)c1ccc[nH]c1=O Amb2445310 [1,1,0,0,0,0|1,0,0]=3 3736 B11R1.222 COC(=O)c1ccc[n]c1S Amb22282222 [1,1,0,0,0,0|1,0,0]=3 3737 B11R1.222 COC(=O)c1cccc[n+]1[O-] Amb10573355 [1,1,0,0,0,0|1,0,0]=3 3738 B11R1.222 COC(=O)c1ccccc1N Amb1229837 [1,1,0,0,0,0|0,0,0]=2 3739 B11R1.222 COC(=O)c1ccccc1N Amb22741062 [1,1,0,0,0,0|0,0,0]=2 3740 B11R1.222 COC(=O)c1ccccc1O Amb1200750 [1,1,0,0,0,0|0,0,0]=2 3741 B11R1.222 COC(=O)c1ccccc1[NH3+] Amb22445985 [1,1,0,0,0,0|0,0,0]=2 3742 B11R1.222 COC(=O)c1cccnc1Cl Amb1241121 [1,1,0,0,0,0|1,0,0]=3 3743 B11R1.222 COC(=O)c1cccnc1I Amb10070314 [1,1,0,0,0,0|1,0,0]=3 3744 B11R1.222 COC(=O)c1cccnc1N Amb1049688 [1,1,0,0,0,0|1,0,0]=3 3745 B11R1.222 COC(=O)c1cccnc1O Amb10601402 [1,1,0,0,0,0|1,0,0]=3 3746 B11R1.222 COC(=O)c1ccncc1Br Amb10606114 [1,1,0,0,0,0|1,0,0]=3 3747 B11R1.222 COC(=O)c1ccncc1I Amb10602323 [1,1,0,0,0,0|1,0,0]=3 3748 B11R1.222 COC(=O)c1ccncc1N Amb2440807 [1,1,0,0,0,0|1,0,0]=3 3749 B11R1.222 COC(=O)c1cnccc1Br Amb10603765 [1,1,0,0,0,0|1,0,0]=3 3750 B11R1.222 COC(=O)c1cnccc1Cl Amb10603776 [1,1,0,0,0,0|1,0,0]=3 3751 B11R1.222 COC(=O)c1ncccc1Br Amb10975828 [1,1,0,0,0,0|1,0,0]=3 3752 B11R1.222 COC(=O)c1ncccc1C Amb16233270 [1,1,0,0,0,0|1,0,0]=3 3753 B11R1.222 COC(=O)c1ncccc1F Amb10602313 [1,1,0,0,0,0|1,0,0]=3 3754 B11R1.222 COC(=O)c1ncccc1O Amb2417381 [1,1,0,0,0,0|1,0,0]=3 3755 B11R1.222 COC(=O)c1nccnc1N Amb1157799 [1,1,0,0,0,0|2,0,0]=4 3756 B11R1.222 COC(=O)c1ncncc1Br Amb10603996 [1,1,0,0,0,0|2,0,0]=4 3757 B11R1.222 COC(=S)c1ccccc1O Amb22232674 [1,1,0,0,0,0|0,1,0]=3 3758 B11R1.222 COC(C)c1ccccc1N Amb24468018 [1,1,0,0,0,0|1,0,1]=4 3759 B11R1.222 COC(C)c1ccccc1O Amb18125398 [1,1,0,0,0,0|1,0,1]=4 3760 B11R1.222 CSC(=O)c1ccccc1O Amb25094287 [1,1,0,0,0,0|0,1,0]=3 3761 B11R1.222 C\C(=C/C)\c1ccccc1N Amb18124838 [1,1,0,0,0,0|1,0,1]=4 3762 B11R1.222 C\C(=C/C)\c1ccccc1O Amb18124922 [1,1,0,0,0,0|1,0,1]=4 3763 B11R1.222 C\C(=C\C)\c1ccccc1O Amb25707041 [1,1,0,0,0,0|1,0,1]=4 3764 B11R1.222 C\N=C(/Cl)\c1ccccc1O Amb25066402 [1,1,0,0,0,0|2,0,0]=4 3765 B11R1.222 C\N=C(/F)\c1ccccc1O Amb24570847 [1,1,0,0,0,0|2,0,0]=4 3766 B11R1.222 C\N=C(\Cl)/c1ccccc1O Amb24629208 [1,1,0,0,0,0|2,0,0]=4 3767 B11R1.222 Cc1[n]c[n]cc1C(=O)OC Amb23401793 [1,1,0,0,0,0|2,0,0]=4 3768 B11R1.222 Cc1[n]cc[n]c1C(=O)OC Amb21962549 [1,1,0,0,0,0|2,0,0]=4 3769 B11R1.222 Cc1[n]cccc1C(=O)CBr Amb24106265 [1,1,0,0,0,0|2,0,0]=4 3770 B11R1.222 Cc1[n]cccc1C(=O)CCl Amb24104158 [1,1,0,0,0,0|2,0,0]=4 3771 B11R1.222 Cc1[n]cccc1C(=O)CN Amb18201918 [1,1,0,0,0,0|2,0,0]=4 3772 B11R1.222 Cc1[n]cccc1C(=O)NC Amb24062374 [1,1,0,0,0,0|2,0,0]=4 3773 B11R1.222 Cc1c[n][n]cc1C(=O)CC Amb25094292 [1,1,0,0,0,0|2,0,0]=4 3774 B11R1.222 Cc1c[n][n]cc1C(=O)OC Amb22406186 [1,1,0,0,0,0|2,0,0]=4 3775 B11R1.222 Cc1c[n]ccc1C(=N)OC Amb25150164 [1,1,0,0,0,0|2,0,0]=4 3776 B11R1.222 Cc1c[n]ccc1C(=O)CCl Amb25080273 [1,1,0,0,0,0|2,0,0]=4 3777 B11R1.222 Cc1c[n]ccc1C(=O)NC Amb24463193 [1,1,0,0,0,0|2,0,0]=4 3778 B11R1.222 Cc1cc[n]cc1C(=O)CBr Amb24104035 [1,1,0,0,0,0|2,0,0]=4 3779 B11R1.222 Cc1cc[n]cc1C(=O)CC Amb25346959 [1,1,0,0,0,0|1,0,0]=3 3780 B11R1.222 Cc1cc[n]cc1C(=O)CCl Amb24104195 [1,1,0,0,0,0|2,0,0]=4 3781 B11R1.222 Cc1cc[n]cc1C(=O)CN Amb18201929 [1,1,0,0,0,0|2,0,0]=4 3782 B11R1.222 Cc1cc[n]cc1C(=O)NC Amb24062378 [1,1,0,0,0,0|2,0,0]=4 3783 B11R1.222 Cc1cc[n]cc1C(=O)OC Amb21857718 [1,1,0,0,0,0|1,0,0]=3 3784 B11R1.222 Cc1ccc[n]c1C(=O)CBr Amb24106285 [1,1,0,0,0,0|2,0,0]=4 3785 B11R1.222 Cc1ccc[n]c1C(=O)NC Amb24413396 [1,1,0,0,0,0|2,0,0]=4 3786 B11R1.222 Cc1ccc[n]c1C(=O)OC Amb22886637 [1,1,0,0,0,0|1,0,0]=3 3787 B11R1.222 Cc1ccc[n]c1C(=O)SC Amb25334811 [1,1,0,0,0,0|1,1,0]=4 3788 B11R1.222 Cc1ccccc1C(=C)CO Amb25749030 [1,1,0,0,0,0|2,0,0]=4 3789 B11R1.222 Cc1ccccc1C(=O)C=O Amb18124884 [1,1,0,0,0,0|1,0,1]=4 3790 B11R1.222 Cc1ccccc1C(=O)CCl Amb18185586 [1,1,0,0,0,0|1,0,0]=3 3791 B11R1.222 Cc1ccccc1C(=O)CF Amb25807621 [1,1,0,0,0,0|1,0,0]=3 3792 B11R1.222 Cc1ccccc1C(=O)CN Amb18281552 [1,1,0,0,0,0|1,0,0]=3 3793 B11R1.222 Cc1ccccc1C(=O)CO Amb18182730 [1,1,0,0,0,0|1,0,0]=3 3794 B11R1.222 Cc1ccccc1C(=S)NC Amb25775044 [1,1,0,0,0,0|1,1,0]=4 3795 B11R1.222 Cc1ccccc1C(Cl)CC Amb24388659 [1,1,0,0,0,0|1,0,1]=4 3796 B11R1.222 Cc1ccccc1N(N)CC Amb18125192 [1,1,0,0,0,0|2,0,0]=4 3797 B11R1.222 Cc1ccccc1S(=O)OC Amb25241886 [1,1,0,0,0,0|1,0,0]=3 3798 B11R1.222 Cc1ccccc1[C@@H](N)CC Amb22298563 [1,1,0,0,0,0|1,0,1]=4 3799 B11R1.222 Cc1ccccc1[C@@H](N)CC Amb25145851 [1,1,0,0,0,0|1,0,1]=4 3800 B11R1.222 Cc1ccccc1[C@H](N)CC Amb22298520 [1,1,0,0,0,0|1,0,1]=4 3801 B11R1.222 Cc1ccccc1[C@H](N)CC Amb25335271 [1,1,0,0,0,0|1,0,1]=4 3802 B11R1.222 Cc1ccncc1C(=O)OC Amb16230838 [1,1,0,0,0,0|1,0,0]=3 3803 B11R1.222 ClCC(=O)c1ccccc1Br Amb10602047 [1,1,0,0,0,0|1,0,0]=3 3804 B11R1.222 ClCC(=O)c1ccccc1N Amb10068396 [1,1,0,0,0,0|1,0,0]=3 3805 B11R1.222 ClCC(=O)c1ccccc1N Amb10603305 [1,1,0,0,0,0|1,0,0]=3 3806 B11R1.222 ClCC(=O)c1ccccc1O Amb2209413 [1,1,0,0,0,0|1,0,0]=3 3807 B11R1.222 N#CC(=O)c1ccccc1Br Amb22269824 [1,1,0,0,0,0|1,0,1]=4 3808 B11R1.222 N#CC(=O)c1ccccc1C Amb16231820 [1,1,0,0,0,0|1,0,1]=4 3809 B11R1.222 N#CC(=O)c1ccccc1F Amb17232048 [1,1,0,0,0,0|1,0,1]=4 3810 B11R1.222 N#CC(=O)c1ccccc1I Amb22367991 [1,1,0,0,0,0|1,0,1]=4 3811 B11R1.222 NCC(=O)c1[n]cccc1Cl Amb24601329 [1,1,0,0,0,0|2,0,0]=4 3812 B11R1.222 NCC(=O)c1cc[n]cc1F Amb24680459 [1,1,0,0,0,0|2,0,0]=4 3813 B11R1.222 NCC(=O)c1ccc[n]c1Br Amb25718599 [1,1,0,0,0,0|2,0,0]=4 3814 B11R1.222 NCC(=O)c1ccc[n]c1F Amb24106012 [1,1,0,0,0,0|2,0,0]=4 3815 B11R1.222 NCC(=O)c1ccccc1Br Amb10069326 [1,1,0,0,0,0|1,0,0]=3 3816 B11R1.222 NCC(=O)c1ccccc1Cl Amb10069325 [1,1,0,0,0,0|1,0,0]=3 3817 B11R1.222 NCC(=O)c1ccccc1F Amb10840039 [1,1,0,0,0,0|1,0,0]=3 3818 B11R1.222 NCC(=O)c1ccccc1I Amb25172792 [1,1,0,0,0,0|1,0,0]=3 3819 B11R1.222 NCC(=O)c1ccccc1O Amb18125235 [1,1,0,0,0,0|1,0,0]=3 3820 B11R1.222 NNC(=O)c1ccccc1F Amb1104489 [1,1,0,0,0,0|2,0,0]=4 3821 B11R1.222 NNC(=O)c1ccccc1N Amb1775193 [1,1,0,0,0,0|2,0,0]=4 3822 B11R1.222 NNC(=O)c1ccccc1O Amb1796080 [1,1,0,0,0,0|2,0,0]=4 3823 B11R1.222 NOC(=O)c1ccccc1O Amb25803293 [1,1,0,0,0,0|1,0,0]=3 3824 B11R1.222 Nc1[n]cccc1C(=O)CO Amb24105366 [1,1,0,0,0,0|2,0,0]=4 3825 B11R1.222 Nc1cc[n]cc1C(=O)CN Amb24586812 [1,1,0,0,0,0|2,0,0]=4 3826 B11R1.222 Nc1ccccc1C(=O)CBr Amb24063936 [1,1,0,0,0,0|1,0,0]=3 3827 B11R1.222 Nc1ccccc1C(=O)CN Amb18125141 [1,1,0,0,0,0|1,0,0]=3 3828 B11R1.222 Nc1ccccc1C(=O)ON Amb25322080 [1,1,0,0,0,0|1,0,0]=3 3829 B11R1.222 Nc1ncccc1C(=O)CBr Amb17595839 [1,1,0,0,0,0|2,0,0]=4 3830 B11R1.222 O=C(C=O)c1ccccc1Br Amb18131520 [1,1,0,0,0,0|1,0,1]=4 3831 B11R1.222 O=C(C=O)c1ccccc1Cl Amb18126568 [1,1,0,0,0,0|1,0,1]=4 3832 B11R1.222 O=C(C=O)c1ccccc1F Amb22011841 [1,1,0,0,0,0|1,0,1]=4 3833 B11R1.222 O=C(CBr)c1[n]cccc1F Amb24377689 [1,1,0,0,0,0|2,0,0]=4 3834 B11R1.222 O=C(CBr)c1cc[n]cc1Br Amb25678043 [1,1,0,0,0,0|2,0,0]=4 3835 B11R1.222 O=C(CBr)c1cc[n]cc1Cl Amb24087519 [1,1,0,0,0,0|2,0,0]=4 3836 B11R1.222 O=C(CBr)c1ccc[n]c1Cl Amb24056345 [1,1,0,0,0,0|2,0,0]=4 3837 B11R1.222 O=C(CBr)c1ccc[n]c1F Amb25301266 [1,1,0,0,0,0|2,0,0]=4 3838 B11R1.222 O=C(CBr)c1ccccc1I Amb22737619 [1,1,0,0,0,0|1,0,0]=3 3839 B11R1.222 O=C(CCl)c1[n]cccc1Br Amb25105288 [1,1,0,0,0,0|2,0,0]=4 3840 B11R1.222 O=C(CCl)c1[n]cccc1F Amb25069387 [1,1,0,0,0,0|2,0,0]=4 3841 B11R1.222 O=C(CCl)c1ccc[n]c1Cl Amb24538128 [1,1,0,0,0,0|2,0,0]=4 3842 B11R1.222 O=C(CCl)c1ccc[n]c1F Amb24736127 [1,1,0,0,0,0|2,0,0]=4 3843 B11R1.222 O=C(CCl)c1ccccc1Cl Amb18330058 [1,1,0,0,0,0|1,0,0]=3 3844 B11R1.222 O=C(CCl)c1ccccc1F Amb18807753 [1,1,0,0,0,0|1,0,0]=3 3845 B11R1.222 O=C(CCl)c1ccccc1I Amb25147916 [1,1,0,0,0,0|1,0,0]=3 3846 B11R1.222 O=C(CF)c1ccc[n]c1F Amb24084121 [1,1,0,0,0,0|2,0,0]=4 3847 B11R1.222 O=C(CF)c1ccccc1Br Amb22489704 [1,1,0,0,0,0|1,0,0]=3 3848 B11R1.222 O=C(CF)c1ccccc1Cl Amb23454835 [1,1,0,0,0,0|1,0,0]=3 3849 B11R1.222 O=C(CF)c1ccccc1F Amb23454839 [1,1,0,0,0,0|1,0,0]=3 3850 B11R1.222 O=C(CS)c1ccccc1Cl Amb25801973 [1,1,0,0,0,0|1,0,0]=3 3851 B11R1.222 O=C1NC=CC=C1C(=O)CBr Amb25149054 [1,1,0,0,0,0|2,0,0]=4 3852 B11R1.222 O=CC(=O)c1ccccc1F Amb10838623 [1,1,0,0,0,0|1,0,1]=4 3853 B11R1.222 OCC(=O)c1cc[n]cc1Br Amb25280133 [1,1,0,0,0,0|2,0,0]=4 3854 B11R1.222 OCC(=O)c1ccccc1Br Amb24639690 [1,1,0,0,0,0|1,0,0]=3 3855 B11R1.222 OCC(=O)c1ccccc1Cl Amb18185665 [1,1,0,0,0,0|1,0,0]=3 3856 B11R1.222 OCC(=O)c1ccccc1F Amb18182895 [1,1,0,0,0,0|1,0,0]=3 3857 B11R1.222 ONC(=O)c1ccccc1O Amb2504335 [1,1,0,0,0,0|2,0,0]=4 3858 B11R1.222 ONC(=O)c1ccccc1S Amb25855420 [1,1,0,0,0,0|2,0,0]=4 3859 B11R1.222 Oc1cc[n]cc1C(=O)CBr Amb24533152 [1,1,0,0,0,0|2,0,0]=4 3860 B11R1.222 Oc1ccccc1C(=O)C=O Amb25269559 [1,1,0,0,0,0|1,0,1]=4 3861 B11R1.222 Oc1ccccc1C(=O)CF Amb24084122 [1,1,0,0,0,0|1,0,0]=3 3862 B11R1.222 Oc1ccccc1C(=O)CO Amb18125347 [1,1,0,0,0,0|1,0,0]=3 3863 B11R1.222 Oc1ccccc1C(=O)NBr Amb25807582 [1,1,0,0,0,0|2,0,0]=4 3864 B11R1.222 Oc1ccccc1C(=O)O[Ag] Amb22053970 [1,1,0,0,0,0|1,0,0]=3 3865 B11R1.222 [Na]OC(=O)c1ncccc1Br Amb10071517 [1,1,0,0,0,0|2,0,0]=4 3866 B11R1.1 CCC#Cc1ccc(F)cc1 Amb24730740 [1,1,0,0,0,0|1,0,1]=4 3867 B11R1.1 CCCCc1ccc(F)cc1 Amb22730516 [1,1,0,0,0,0|1,0,1]=4 3868 B11R1.1 CCCNc1ccc(Cl)cc1 Amb19407162 [1,1,0,0,0,0|2,0,0]=4 3869 B11R1.1 CCCOc1ccc(Cl)cc1 Amb25126411 [1,1,0,0,0,0|2,0,0]=4 3870 B11R1.1 CCCOc1ccc(F)cc1 Amb24105714 [1,1,0,0,0,0|2,0,0]=4 3871 B11R1.1 CCCOc1ccc(I)cc1 Amb24064716 [1,1,0,0,0,0|2,0,0]=4 3872 B11R1.1 CCCOc1ccc(S)cc1 Amb25225762 [1,1,0,0,0,0|2,0,0]=4 3873 B11R1.1 CCCOc1ccc(cc1)N Amb1125044 [1,1,0,0,0,0|2,0,0]=4 3874 B11R1.1 CCCOc1ccc(cc1)O Amb1810008 [1,1,0,0,0,0|2,0,0]=4 3875 B11R1.1 CCCSc1ccc(N)cc1 Amb22588114 [1,1,0,0,0,0|2,0,0]=4 3876 B11R1.1 CCCSc1ccc(O)cc1 Amb18180159 [1,1,0,0,0,0|2,0,0]=4 3877 B11R1.1 CCCSc1ccc(S)cc1 Amb24362640 [1,1,0,0,0,0|2,0,0]=4 3878 B11R1.1 CCNCc1ccc(I)cc1 Amb25050868 [1,1,0,0,0,0|1,0,1]=4 3879 B11R1.1 CCNCc1ccc(cc1)O Amb13952053 [1,1,0,0,0,0|1,0,1]=4 3880 B11R1.1 CCNNc1ccc(F)cc1 Amb24086321 [1,1,0,0,0,0|2,0,0]=4 3881 B11R1.1 CCOCc1ccc(Br)[n]c1 Amb20618627 [1,1,0,0,0,0|1,0,1]=4 3882 B11R1.1 CCOCc1ccc(Br)c[n]1 Amb25213350 [1,1,0,0,0,0|1,0,1]=4 3883 B11R1.1 CCOCc1ccc(Br)cc1 Amb19415022 [1,1,0,0,0,0|0,0,1]=3 3884 B11R1.1 CCOCc1ccc(N)[n]c1 Amb18295807 [1,1,0,0,0,0|1,0,1]=4 3885 B11R1.1 CCOCc1ccc(O)cc1 Amb18125402 [1,1,0,0,0,0|0,0,1]=3 3886 B11R1.1 CCOCc1ccc(cc1)N Amb1125782 [1,1,0,0,0,0|0,0,1]=3 3887 B11R1.1 CCON=C1C=CC(=O)C=C1 Amb25128866 [1,1,0,0,0,0|1,0,0]=3 3888 B11R1.1 CCOOc1ccc(O)cc1 Amb24102976 [1,1,0,0,0,0|1,0,0]=3 3889 B11R1.1 CCSCc1ccc(Br)cc1 Amb25684606 [1,1,0,0,0,0|0,1,1]=4 3890 B11R1.1 CCSCc1ccc(Cl)cc1 Amb24402210 [1,1,0,0,0,0|0,1,1]=4 3891 B11R1.1 CCSCc1ccc(F)cc1 Amb24486978 [1,1,0,0,0,0|0,1,1]=4 3892 B11R1.1 CCSCc1ccc(O)cc1 Amb18126551 [1,1,0,0,0,0|0,1,1]=4 3893 B11R1.1 CCSSc1ccc(N)cc1 Amb24396326 [1,1,0,0,0,0|1,1,0]=4 3894 B11R1.1 CC\C=C/c1ccc(F)cc1 Amb24725207 [1,1,0,0,0,0|1,0,0]=3 3895 B11R1.1 CC\C=C\c1ccc(N)[n]c1 Amb24745451 [1,1,0,0,0,0|2,0,0]=4 3896 B11R1.1 CC\C=C\c1ccc(O)cc1 Amb24655008 [1,1,0,0,0,0|1,0,0]=3 3897 B11R1.1 CC\N=C\c1ccc(cc1)C Amb10553998 [1,1,0,0,0,0|1,0,0]=3 3898 B11R1.1 CN/N=C/c1ccc(F)cc1 Amb17805862 [1,1,0,0,0,0|2,0,0]=4 3899 B11R1.1 CN/N=C/c1ccc(O)cc1 Amb17696985 [1,1,0,0,0,0|2,0,0]=4 3900 B11R1.1 CN\N=C/c1ccc(F)cc1 Amb24100277 [1,1,0,0,0,0|2,0,0]=4 3901 B11R1.1 CN\N=C\c1ccc(cc1)Br Amb16842488 [1,1,0,0,0,0|2,0,0]=4 3902 B11R1.1 CO\C=C\c1ccc(Br)cc1 Amb21962688 [1,1,0,0,0,0|2,0,0]=4 3903 B11R1.1 CO\C=C\c1ccc(O)cc1 Amb25231662 [1,1,0,0,0,0|2,0,0]=4 3904 B11R1.1 CO\N=C\c1ccc(Cl)cc1 Amb24673208 [1,1,0,0,0,0|2,0,0]=4 3905 B11R1.1 CO\N=C\c1ccc(F)cc1 Amb24528867 [1,1,0,0,0,0|2,0,0]=4 3906 B11R1.1 CO\N=C\c1ccc(O)cc1 Amb25370742 [1,1,0,0,0,0|2,0,0]=4 3907 B11R1.1 Cc1ccc(C=CCO)cc1 Amb22345885 [1,1,0,0,0,0|2,0,0]=4 3908 B11R1.1 Cc1ccc(CCCC)cc1 Amb22002059 [1,1,0,0,0,0|1,0,1]=4 3909 B11R1.1 Cc1ccc(COCC)[n]c1 Amb24723080 [1,1,0,0,0,0|1,0,1]=4 3910 B11R1.1 Cc1ccc(CSCC)cc1 Amb24536616 [1,1,0,0,0,0|0,1,1]=4 3911 B11R1.1 Cc1ccc(\C=C\CBr)cc1 Amb24575176 [1,1,0,0,0,0|2,0,0]=4 3912 B11R1.1 Cc1ccc(\C=C\CN)cc1 Amb18563249 [1,1,0,0,0,0|2,0,0]=4 3913 B11R1.1 Cc1ccc(\C=C\CO)cc1 Amb23442829 [1,1,0,0,0,0|2,0,0]=4 3914 B11R1.1 Cc1ccc(\C=N\NC)cc1 Amb25333383 [1,1,0,0,0,0|2,0,0]=4 3915 B11R1.1 ClCOCc1ccc(Br)cc1 Amb24376347 [1,1,0,0,0,0|1,0,1]=4 3916 B11R1.1 ClC\C=C\c1ccc(Br)cc1 Amb21926649 [1,1,0,0,0,0|2,0,0]=4 3917 B11R1.1 ClC\C=C\c1ccc(I)cc1 Amb24614945 [1,1,0,0,0,0|2,0,0]=4 3918 B11R1.1 Clc1ccc(\C=C\CBr)cc1 Amb22007806 [1,1,0,0,0,0|2,0,0]=4 3919 B11R1.1 Clc1ccc(\C=C\CCl)cc1 Amb25185292 [1,1,0,0,0,0|2,0,0]=4 3920 B11R1.1 Fc1ccc(\C=C\CCl)cc1 Amb25074621 [1,1,0,0,0,0|2,0,0]=4 3921 B11R1.1 NC\C=C/c1ccc(cc1)C Amb10560257 [1,1,0,0,0,0|2,0,0]=4 3922 B11R1.1 NC\C=C\c1ccc(Br)cc1 Amb18066634 [1,1,0,0,0,0|2,0,0]=4 3923 B11R1.1 NC\C=C\c1ccc(Cl)cc1 Amb18563824 [1,1,0,0,0,0|2,0,0]=4 3924 B11R1.1 NC\C=C\c1ccc(F)cc1 Amb18065348 [1,1,0,0,0,0|2,0,0]=4 3925 B11R1.1 NC\C=C\c1ccc(O)cc1 Amb18124993 [1,1,0,0,0,0|2,0,0]=4 3926 B11R1.1 Nc1ccc(COCF)cc1 Amb25764872 [1,1,0,0,0,0|1,0,1]=4 3927 B11R1.1 Nc1ccc(\C=C\CN)cc1 Amb24527675 [1,1,0,0,0,0|2,0,0]=4 3928 B11R1.1 OC\C=C\c1ccc(Cl)cc1 Amb21964138 [1,1,0,0,0,0|2,0,0]=4 3929 B11R1.1 OC\C=C\c1ccc(F)cc1 Amb23442931 [1,1,0,0,0,0|2,0,0]=4 3930 B11R1.1 OC\C=C\c1ccc(I)cc1 Amb24418980 [1,1,0,0,0,0|2,0,0]=4 3931 B11R1.1 OC\C=C\c1ccc(cc1)O Amb2445151 [1,1,0,0,0,0|2,0,0]=4 3932 B11R1.1 OC\N=C\c1ccc(Cl)cc1 Amb24466242 [1,1,0,0,0,0|2,0,0]=4 3933 B11R1.1 Oc1ccc(\C=C/CO)cc1 Amb25720012 [1,1,0,0,0,0|2,0,0]=4 3934 B11R1.1 Oc1ccc(\C=C\CCl)cc1 Amb24598884 [1,1,0,0,0,0|2,0,0]=4 3935 B11R1.17 Brc1ccccc1\C=C\CBr Amb25149093 [1,1,0,0,0,0|2,0,0]=4 3936 B11R1.17 CCC#Cc1ccccc1Cl Amb25198269 [1,1,0,0,0,0|1,0,1]=4 3937 B11R1.17 CCC#Cc1ccccc1I Amb24447638 [1,1,0,0,0,0|1,0,1]=4 3938 B11R1.17 CCC#Cc1ccccc1N Amb24670207 [1,1,0,0,0,0|1,0,1]=4 3939 B11R1.17 CCC#Cc1ccccc1O Amb25320119 [1,1,0,0,0,0|1,0,1]=4 3940 B11R1.17 CCCCc1ccccc1Br Amb15690808 [1,1,0,0,0,0|1,0,1]=4 3941 B11R1.17 CCCCc1ccccc1F Amb24426932 [1,1,0,0,0,0|1,0,1]=4 3942 B11R1.17 CCCCc1ccccc1O Amb25744605 [1,1,0,0,0,0|1,0,1]=4 3943 B11R1.17 CCCNc1ccccc1O Amb18644480 [1,1,0,0,0,0|2,0,0]=4 3944 B11R1.17 CCCOc1ccccc1Cl Amb25216415 [1,1,0,0,0,0|2,0,0]=4 3945 B11R1.17 CCCOc1ccccc1F Amb21856719 [1,1,0,0,0,0|2,0,0]=4 3946 B11R1.17 CCCOc1ccccc1N Amb1210617 [1,1,0,0,0,0|2,0,0]=4 3947 B11R1.17 CCCSc1ccccc1N Amb22588094 [1,1,0,0,0,0|2,0,0]=4 3948 B11R1.17 CCCSc1ccccc1O Amb18177881 [1,1,0,0,0,0|2,0,0]=4 3949 B11R1.17 CCNCc1ccccc1I Amb21861742 [1,1,0,0,0,0|1,0,1]=4 3950 B11R1.17 CCOCc1[n]cccc1Br Amb25209748 [1,1,0,0,0,0|1,0,1]=4 3951 B11R1.17 CCOCc1ccc[n]c1Cl Amb18185709 [1,1,0,0,0,0|1,0,1]=4 3952 B11R1.17 CCOCc1ccc[n]c1N Amb18991377 [1,1,0,0,0,0|1,0,1]=4 3953 B11R1.17 CCOCc1ccccc1Br Amb22227882 [1,1,0,0,0,0|0,0,1]=3 3954 B11R1.17 CCOCc1ccccc1O Amb10560038 [1,1,0,0,0,0|0,0,1]=3 3955 B11R1.17 CCO\C=C/1\C=CC=CC1=O Amb24645462 [1,1,0,0,0,0|0,0,0]=2 3956 B11R1.17 CCSCc1ccccc1Br Amb22228180 [1,1,0,0,0,0|0,1,1]=4 3957 B11R1.17 CCSCc1ccccc1Cl Amb25676288 [1,1,0,0,0,0|0,1,1]=4 3958 B11R1.17 CCSCc1ccccc1O Amb18126550 [1,1,0,0,0,0|0,1,1]=4 3959 B11R1.17 CC\C=C/c1ccccc1O Amb25713551 [1,1,0,0,0,0|1,0,0]=3 3960 B11R1.17 CC\C=C\c1ccccc1N Amb22751020 [1,1,0,0,0,0|1,0,0]=3 3961 B11R1.17 CC\C=C\c1ccccc1O Amb18124914 [1,1,0,0,0,0|1,0,0]=3 3962 B11R1.17 CC\C=N\c1ccccc1N Amb24060501 [1,1,0,0,0,0|2,0,0]=4 3963 B11R1.17 CC\C=N\c1ccccc1O Amb24486452 [1,1,0,0,0,0|2,0,0]=4 3964 B11R1.17 CC\N=C\c1ccccc1Br Amb25250885 [1,1,0,0,0,0|1,0,0]=3 3965 B11R1.17 CC\N=C\c1ccccc1O Amb25793010 [1,1,0,0,0,0|1,0,0]=3 3966 B11R1.17 CN/N=C/c1ccccc1Cl Amb17866944 [1,1,0,0,0,0|2,0,0]=4 3967 B11R1.17 CN/N=C/c1ccccc1F Amb17704011 [1,1,0,0,0,0|2,0,0]=4 3968 B11R1.17 CN/N=C/c1ccccc1O Amb17705197 [1,1,0,0,0,0|2,0,0]=4 3969 B11R1.17 CN\N=C/c1ccccc1F Amb24100270 [1,1,0,0,0,0|2,0,0]=4 3970 B11R1.17 CN\N=C\c1ccccc1Br Amb16842474 [1,1,0,0,0,0|2,0,0]=4 3971 B11R1.17 CO\C=C/c1ccccc1O Amb24485852 [1,1,0,0,0,0|2,0,0]=4 3972 B11R1.17 CO\C=C\c1ccccc1Cl Amb25802000 [1,1,0,0,0,0|2,0,0]=4 3973 B11R1.17 CO\C=C\c1ccccc1O Amb25715988 [1,1,0,0,0,0|2,0,0]=4 3974 B11R1.17 CO\N=C/c1ccccc1F Amb24068859 [1,1,0,0,0,0|2,0,0]=4 3975 B11R1.17 CO\N=C/c1ccccc1N Amb24106779 [1,1,0,0,0,0|2,0,0]=4 3976 B11R1.17 CO\N=C\c1ccccc1Cl Amb24430655 [1,1,0,0,0,0|2,0,0]=4 3977 B11R1.17 CO\N=C\c1ccccc1F Amb25098221 [1,1,0,0,0,0|2,0,0]=4 3978 B11R1.17 CO\N=C\c1ccccc1N Amb24605335 [1,1,0,0,0,0|2,0,0]=4 3979 B11R1.17 CO\N=C\c1ccccc1O Amb25740232 [1,1,0,0,0,0|2,0,0]=4 3980 B11R1.17 CS\C=C/c1ccccc1N Amb18646409 [1,1,0,0,0,0|2,0,0]=4 3981 B11R1.17 CS\C=C\c1ccccc1O Amb18646619 [1,1,0,0,0,0|2,0,0]=4 3982 B11R1.17 CS\N=C\c1ccccc1O Amb24714934 [1,1,0,0,0,0|2,0,0]=4 3983 B11R1.17 Cc1ccccc1CCCC Amb25825024 [1,1,0,0,0,0|1,0,1]=4 3984 B11R1.17 Cc1ccccc1COCCl Amb24352480 [1,1,0,0,0,0|1,0,1]=4 3985 B11R1.17 Cc1ccccc1CSCC Amb24690023 [1,1,0,0,0,0|0,1,1]=4 3986 B11R1.17 Cc1ccccc1SCCC Amb24674923 [1,1,0,0,0,0|2,0,0]=4 3987 B11R1.17 Cc1ccccc1\C=C\CBr Amb25169542 [1,1,0,0,0,0|2,0,0]=4 3988 B11R1.17 Cc1ccccc1\C=C\CN Amb18065178 [1,1,0,0,0,0|2,0,0]=4 3989 B11R1.17 Cc1ccccc1\C=C\CO Amb23442935 [1,1,0,0,0,0|2,0,0]=4 3990 B11R1.17 ClCOCc1ccccc1Br Amb25679464 [1,1,0,0,0,0|1,0,1]=4 3991 B11R1.17 Fc1ccccc1\C=C\CBr Amb24374006 [1,1,0,0,0,0|2,0,0]=4 3992 B11R1.17 NC\C=C\c1ccccc1Br Amb18569373 [1,1,0,0,0,0|2,0,0]=4 3993 B11R1.17 NC\C=C\c1ccccc1Cl Amb18065473 [1,1,0,0,0,0|2,0,0]=4 3994 B11R1.17 NC\C=C\c1ccccc1F Amb18065347 [1,1,0,0,0,0|2,0,0]=4 3995 B11R1.17 Nc1ccccc1\C=C\CO Amb25353301 [1,1,0,0,0,0|2,0,0]=4 3996 B11R1.17 OCC=Cc1ccccc1F Amb22228953 [1,1,0,0,0,0|2,0,0]=4 3997 B11R1.17 OC\C=C\c1ccccc1Br Amb25149289 [1,1,0,0,0,0|2,0,0]=4 3998 B11R1.17 OC\C=C\c1ccccc1F Amb23442840 [1,1,0,0,0,0|2,0,0]=4 3999 B11R1.17 Oc1ccccc1\C=C/CCl Amb24401534 [1,1,0,0,0,0|2,0,0]=4 4000 B11R1.17 Oc1ccccc1\C=C/CO Amb18125107 [1,1,0,0,0,0|2,0,0]=4 4001 B11R1.17 Oc1ccccc1\C=C\CBr Amb25225899 [1,1,0,0,0,0|2,0,0]=4 4002 B11R1.17 Oc1ccccc1\C=C\CO Amb25300470 [1,1,0,0,0,0|2,0,0]=4 4003 B11R1.24 CCC#Cc1cc(O)ccc1 Amb25139990 [1,1,0,0,0,0|1,0,1]=4 4004 B11R1.24 CCCCc1cccc(Br)c1 Amb19944057 [1,1,0,0,0,0|1,0,1]=4 4005 B11R1.24 CCCCc1cccc(I)c1 Amb19944046 [1,1,0,0,0,0|1,0,1]=4 4006 B11R1.24 CCCCc1cccc(S)c1 Amb24415059 [1,1,0,0,0,0|1,0,1]=4 4007 B11R1.24 CCCCc1cccc(c1)N Amb17593719 [1,1,0,0,0,0|1,0,1]=4 4008 B11R1.24 CCCOc1cc(Cl)ccc1 Amb25787001 [1,1,0,0,0,0|2,0,0]=4 4009 B11R1.24 CCCOc1cc(F)ccc1 Amb25700428 [1,1,0,0,0,0|2,0,0]=4 4010 B11R1.24 CCCOc1cccc(c1)C Amb10573406 [1,1,0,0,0,0|2,0,0]=4 4011 B11R1.24 CCCOc1cccc(c1)N Amb1138945 [1,1,0,0,0,0|2,0,0]=4 4012 B11R1.24 CCCSc1cc(Br)ccc1 Amb24538191 [1,1,0,0,0,0|2,0,0]=4 4013 B11R1.24 CCCSc1cc(Cl)ccc1 Amb25801816 [1,1,0,0,0,0|2,0,0]=4 4014 B11R1.24 CCCSc1cc(F)ccc1 Amb25806371 [1,1,0,0,0,0|2,0,0]=4 4015 B11R1.24 CCCSc1cc(N)ccc1 Amb18289141 [1,1,0,0,0,0|2,0,0]=4 4016 B11R1.24 CCCSc1cc(O)ccc1 Amb18126556 [1,1,0,0,0,0|2,0,0]=4 4017 B11R1.24 CCNCc1cc(I)ccc1 Amb24066806 [1,1,0,0,0,0|1,0,1]=4 4018 B11R1.24 CCNCc1cc(I)ccc1 Amb24066807 [1,1,0,0,0,0|1,0,1]=4 4019 B11R1.24 CCNCc1cc(N)ccc1 Amb18290000 [1,1,0,0,0,0|1,0,1]=4 4020 B11R1.24 CCNCc1cc(S)ccc1 Amb25705598 [1,1,0,0,0,0|1,0,1]=4 4021 B11R1.24 CCNCc1cccc(c1)Br Amb13949217 [1,1,0,0,0,0|1,0,1]=4 4022 B11R1.24 CCOCc1cc(Br)[n]cc1 Amb20618632 [1,1,0,0,0,0|1,0,1]=4 4023 B11R1.24 CCOCc1cc(Br)ccc1 Amb23512545 [1,1,0,0,0,0|0,0,1]=3 4024 B11R1.24 CCOCc1cc(Cl)[n]cc1 Amb18185710 [1,1,0,0,0,0|1,0,1]=4 4025 B11R1.24 CCOCc1cc(Cl)ccc1 Amb24486866 [1,1,0,0,0,0|0,0,1]=3 4026 B11R1.24 CCOCc1cc(N)[n]cc1 Amb18298616 [1,1,0,0,0,0|1,0,1]=4 4027 B11R1.24 CCOCc1cc(O)ccc1 Amb23443319 [1,1,0,0,0,0|0,0,1]=3 4028 B11R1.24 CCSCc1cc(Br)ccc1 Amb24476579 [1,1,0,0,0,0|0,1,1]=4 4029 B11R1.24 CCSCc1cc(O)ccc1 Amb18126555 [1,1,0,0,0,0|0,1,1]=4 4030 B11R1.24 CC\C=C\c1cccc(Br)c1 Amb25132907 [1,1,0,0,0,0|1,0,0]=3 4031 B11R1.24 CC\C=C\c1cccc(c1)O Amb16231489 [1,1,0,0,0,0|1,0,0]=3 4032 B11R1.24 CC\N=C\c1cccc(O)c1 Amb24662288 [1,1,0,0,0,0|1,0,0]=3 4033 B11R1.24 CN/N=C/c1cccc(O)c1 Amb17803818 [1,1,0,0,0,0|2,0,0]=4 4034 B11R1.24 CN\N=C/c1cccc(F)c1 Amb24100271 [1,1,0,0,0,0|2,0,0]=4 4035 B11R1.24 CN\N=C/c1cccc(O)c1 Amb24085681 [1,1,0,0,0,0|2,0,0]=4 4036 B11R1.24 CN\N=C\c1cccc(F)c1 Amb24371798 [1,1,0,0,0,0|2,0,0]=4 4037 B11R1.24 CN\N=C\c1cccc(c1)Br Amb16842805 [1,1,0,0,0,0|2,0,0]=4 4038 B11R1.24 CO\C=C/c1cccc(F)c1 Amb25837369 [1,1,0,0,0,0|2,0,0]=4 4039 B11R1.24 CO\C=C\c1cccc(O)c1 Amb25373359 [1,1,0,0,0,0|2,0,0]=4 4040 B11R1.24 CO\N=C/c1cccc(F)c1 Amb24068856 [1,1,0,0,0,0|2,0,0]=4 4041 B11R1.24 CO\N=C\c1cccc(N)c1 Amb24105789 [1,1,0,0,0,0|2,0,0]=4 4042 B11R1.24 CO\N=C\c1cccc(O)c1 Amb25262276 [1,1,0,0,0,0|2,0,0]=4 4043 B11R1.24 Cc1c[n]cc(c1)\C=C\CC Amb24062206 [1,1,0,0,0,0|2,0,0]=4 4044 B11R1.24 Cc1cc(COCCl)ccc1 Amb24443129 [1,1,0,0,0,0|1,0,1]=4 4045 B11R1.24 Cc1cc(\C=C\CBr)ccc1 Amb25068031 [1,1,0,0,0,0|2,0,0]=4 4046 B11R1.24 Cc1cc(\C=C\CN)ccc1 Amb18065182 [1,1,0,0,0,0|2,0,0]=4 4047 B11R1.24 Cc1cc(\C=C\CO)ccc1 Amb23442940 [1,1,0,0,0,0|2,0,0]=4 4048 B11R1.24 Cc1cccc(CCCC)c1 Amb22730119 [1,1,0,0,0,0|1,0,1]=4 4049 B11R1.24 Cc1cccc(CSCC)c1 Amb25838308 [1,1,0,0,0,0|0,1,1]=4 4050 B11R1.24 Cc1cccc(\C=C/CC)[n]1 Amb24101904 [1,1,0,0,0,0|2,0,0]=4 4051 B11R1.24 Cc1cccc(\C=C\CC)[n]1 Amb25247816 [1,1,0,0,0,0|2,0,0]=4 4052 B11R1.24 ClC\C=C\c1cccc(Br)c1 Amb25149089 [1,1,0,0,0,0|2,0,0]=4 4053 B11R1.24 Clc1cc(\C=C\CBr)ccc1 Amb25117084 [1,1,0,0,0,0|2,0,0]=4 4054 B11R1.24 Clc1cccc(c1)\C=C\CCl Amb25858073 [1,1,0,0,0,0|2,0,0]=4 4055 B11R1.24 Fc1cc(\C=C\CCl)ccc1 Amb25103585 [1,1,0,0,0,0|2,0,0]=4 4056 B11R1.24 NC\C=C\c1cccc(Br)c1 Amb18066633 [1,1,0,0,0,0|2,0,0]=4 4057 B11R1.24 NC\C=C\c1cccc(Cl)c1 Amb18065474 [1,1,0,0,0,0|2,0,0]=4 4058 B11R1.24 NC\C=C\c1cccc(F)c1 Amb18065349 [1,1,0,0,0,0|2,0,0]=4 4059 B11R1.24 Nc1cc(\C=C\CO)ccc1 Amb24462850 [1,1,0,0,0,0|2,0,0]=4 4060 B11R1.24 OC\C=C\c1cccc(Br)c1 Amb19516160 [1,1,0,0,0,0|2,0,0]=4 4061 B11R1.24 OC\C=C\c1cccc(Cl)c1 Amb23442783 [1,1,0,0,0,0|2,0,0]=4 4062 B11R1.24 OC\C=C\c1cccc(F)c1 Amb23442888 [1,1,0,0,0,0|2,0,0]=4 4063 B11R1.24 Oc1cccc(c1)\C=C\CO Amb18125120 [1,1,0,0,0,0|2,0,0]=4 4064 B11R1.28 BrCC=C=Cc1ccccc1 Amb24624052 [1,1,0,0,0,0|1,0,1]=4 4065 B11R1.28 BrCCCOc1ccccc1 Amb1154134 [1,1,0,0,0,0|2,0,0]=4 4066 B11R1.28 BrCCNCc1ccccc1 Amb18131678 [1,1,0,0,0,0|1,0,1]=4 4067 B11R1.28 BrCC\C=C\c1ccccc1 Amb17140564 [1,1,0,0,0,0|1,0,0]=3 4068 B11R1.28 BrCC\N=C\c1ccccc1 Amb25076253 [1,1,0,0,0,0|1,0,0]=3 4069 B11R1.28 BrC\C=C\Cc1ccccc1 Amb25039914 [1,1,0,0,0,0|2,0,0]=4 4070 B11R1.28 C#CC\N=C\c1ccccc1 Amb17609064 [1,1,0,0,0,0|1,0,1]=4 4071 B11R1.28 C/C=C/C=C/c1ccccc1 Amb17939507 [1,1,0,0,0,0|1,0,1]=4 4072 B11R1.28 C=CCOCc1ccccc1 Amb17933917 [1,1,0,0,0,0|0,0,2]=4 4073 B11R1.28 C=CC\N=C/c1ccccc1 Amb24108502 [1,1,0,0,0,0|1,0,1]=4 4074 B11R1.28 CCCC=Cc1cc[n]cc1 Amb24073920 [1,1,0,0,0,0|2,0,0]=4 4075 B11R1.28 CCCNCc1ccccc1 Amb1105937 [1,1,0,0,0,0|1,0,1]=4 4076 B11R1.28 CCCSSc1ccccc1 Amb25383743 [1,1,0,0,0,0|1,1,0]=4 4077 B11R1.28 CCC\C=C/c1cccc[n]1 Amb24101905 [1,1,0,0,0,0|2,0,0]=4 4078 B11R1.28 CCC\C=C\c1cc[n]cc1 Amb24103147 [1,1,0,0,0,0|2,0,0]=4 4079 B11R1.28 CCC\C=C\c1cccc[n]1 Amb22170161 [1,1,0,0,0,0|2,0,0]=4 4080 B11R1.28 CCC\C=N\c1ccccc1 Amb16231172 [1,1,0,0,0,0|1,0,0]=3 4081 B11R1.28 CCNCCc1ccccc1 Amb2119468 [1,1,0,0,0,0|1,0,1]=4 4082 B11R1.28 CCN\C=N\c1c[n]ccc1 Amb24700068 [1,1,0,0,0,0|2,0,0]=4 4083 B11R1.28 CCN\C=N\c1cc[n]cc1 Amb24746463 [1,1,0,0,0,0|2,0,0]=4 4084 B11R1.28 CCOC#Cc1c[n]ccc1 Amb24085358 [1,1,0,0,0,0|1,0,1]=4 4085 B11R1.28 CCOC#Cc1cc[n]cc1 Amb24102974 [1,1,0,0,0,0|1,0,1]=4 4086 B11R1.28 CCOC#Cc1cccc[n]1 Amb24101280 [1,1,0,0,0,0|1,0,1]=4 4087 B11R1.28 CCOCC[n+]1ccccc1 Amb24762647 [1,1,0,0,0,0|1,0,1]=4 4088 B11R1.28 CCOCNc1ccccc1 Amb25856976 [1,1,0,0,0,0|0,0,1]=3 4089 B11R1.28 CCOCOc1c[n]ccc1 Amb25383033 [1,1,0,0,0,0|1,0,1]=4 4090 B11R1.28 CCOCSc1cc[n]cc1 Amb24762594 [1,1,0,0,0,0|1,0,1]=4 4091 B11R1.28 CCOCSc1cccc[n]1 Amb24762592 [1,1,0,0,0,0|1,0,1]=4 4092 B11R1.28 CCOCSc1ccccc1 Amb24762591 [1,1,0,0,0,0|0,0,1]=3 4093 B11R1.28 CCONCc1ccccc1 Amb25151184 [1,1,0,0,0,0|0,0,1]=3 4094 B11R1.28 CCO\C=N\c1[n]ccc[n]1 Amb24566674 [1,1,0,0,0,0|2,0,0]=4 4095 B11R1.28 CCO\C=N\c1cccc[n]1 Amb24517123 [1,1,0,0,0,0|1,0,0]=3 4096 B11R1.28 CCO\N=C\c1c[n]ccc1 Amb22169409 [1,1,0,0,0,0|1,0,0]=3 4097 B11R1.28 CCO\N=C\c1ccccc1 Amb25712631 [1,1,0,0,0,0|0,0,0]=2 4098 B11R1.28 CCSCSc1ccccc1 Amb25380606 [1,1,0,0,0,0|0,1,1]=4 4099 B11R1.28 CC\C=C/Cc1cc[n]cc1 Amb24103208 [1,1,0,0,0,0|2,0,0]=4 4100 B11R1.28 CC\N=C\Nc1ccccc1 Amb24384245 [1,1,0,0,0,0|1,0,0]=3 4101 B11R1.28 CNCC#Cc1ccccc1 Amb18296119 [1,1,0,0,0,0|1,0,1]=4 4102 B11R1.28 CNCCCc1ccccc1 Amb21954280 [1,1,0,0,0,0|1,0,1]=4 4103 B11R1.28 CNCCOc1ccccc1 Amb1105525 [1,1,0,0,0,0|2,0,0]=4 4104 B11R1.28 CNCCSc1ccccc1 Amb10608735 [1,1,0,0,0,0|2,0,0]=4 4105 B11R1.28 CNCCSc1ccccc1 Amb17622507 [1,1,0,0,0,0|2,0,0]=4 4106 B11R1.28 CNC\C=C\c1c[n]ccc1 Amb23442752 [1,1,0,0,0,0|2,0,0]=4 4107 B11R1.28 CNC\C=C\c1ccccc1 Amb2114273 [1,1,0,0,0,0|1,0,0]=3 4108 B11R1.28 COCC#Cc1ccccc1 Amb25308232 [1,1,0,0,0,0|1,0,1]=4 4109 B11R1.28 COCNCc1ccccc1 Amb25053350 [1,1,0,0,0,0|1,0,1]=4 4110 B11R1.28 COC\C=C\c1cccc[n]1 Amb24101883 [1,1,0,0,0,0|2,0,0]=4 4111 B11R1.28 CO\C=C/Oc1ccccc1 Amb24069136 [1,1,0,0,0,0|2,0,0]=4 4112 B11R1.28 CO\C=C\Oc1ccccc1 Amb24069134 [1,1,0,0,0,0|2,0,0]=4 4113 B11R1.28 CSCCCc1ccccc1 Amb25383748 [1,1,0,0,0,0|1,0,1]=4 4114 B11R1.28 CSCCNc1ccccc1 Amb17307504 [1,1,0,0,0,0|2,0,0]=4 4115 B11R1.28 CSCSCc1ccccc1 Amb25380610 [1,1,0,0,0,0|0,1,1]=4 4116 B11R1.28 C\C=N\OCc1ccccc1 Amb24334870 [1,1,0,0,0,0|0,0,2]=4 4117 B11R1.28 ClCCC#Cc1ccccc1 Amb18792613 [1,1,0,0,0,0|1,0,1]=4 4118 B11R1.28 ClCCCOc1ccccc1 Amb1128627 [1,1,0,0,0,0|2,0,0]=4 4119 B11R1.28 ClCCCSc1ccccc1 Amb1132759 [1,1,0,0,0,0|2,0,0]=4 4120 B11R1.28 ClCC\C=C\c1ccccc1 Amb17232628 [1,1,0,0,0,0|1,0,0]=3 4121 B11R1.28 ClCO\N=C\c1ccccc1 Amb25838175 [1,1,0,0,0,0|1,0,0]=3 4122 B11R1.28 ClC\C=C\Cc1ccccc1 Amb24462747 [1,1,0,0,0,0|2,0,0]=4 4123 B11R1.28 ClC\C=C\Oc1ccccc1 Amb24548862 [1,1,0,0,0,0|2,0,0]=4 4124 B11R1.28 Cl[Zn]C\C=C\c1ccccc1 Amb22897734 [1,1,0,0,0,0|2,0,0]=4 4125 B11R1.28 FCCCOc1ccccc1 Amb22008296 [1,1,0,0,0,0|2,0,0]=4 4126 B11R1.28 FCCCSc1ccccc1 Amb25382654 [1,1,0,0,0,0|2,0,0]=4 4127 B11R1.28 FCCNCc1ccccc1 Amb24611358 [1,1,0,0,0,0|1,0,1]=4 4128 B11R1.28 ICCCCc1ccccc1 Amb25380384 [1,1,0,0,0,0|1,0,1]=4 4129 B11R1.28 ICCNCc1ccccc1 Amb25188796 [1,1,0,0,0,0|1,0,1]=4 4130 B11R1.28 ICCOCc1ccccc1 Amb16191915 [1,1,0,0,0,0|0,0,1]=3 4131 B11R1.28 NCCC#Cc1ccccc1 Amb18993041 [1,1,0,0,0,0|1,0,1]=4 4132 B11R1.28 NCCCCc1ccccc1 Amb1227740 [1,1,0,0,0,0|1,0,1]=4 4133 B11R1.28 NCCCCc1ccccc1 Amb19929939 [1,1,0,0,0,0|1,0,1]=4 4134 B11R1.28 NCCCNc1ccccc1 Amb10086594 [1,1,0,0,0,0|2,0,0]=4 4135 B11R1.28 NCCCOc1ccccc1 Amb1108619 [1,1,0,0,0,0|2,0,0]=4 4136 B11R1.28 NCCCSc1ccccc1 Amb1089343 [1,1,0,0,0,0|2,0,0]=4 4137 B11R1.28 NCCCSc1ccccc1 Amb2099802 [1,1,0,0,0,0|2,0,0]=4 4138 B11R1.28 NCCNNc1ccccc1 Amb24763429 [1,1,0,0,0,0|2,0,0]=4 4139 B11R1.28 NCCOCc1c[n]ccc1 Amb18307736 [1,1,0,0,0,0|1,0,1]=4 4140 B11R1.28 NCCOCc1cc[n]cc1 Amb19020767 [1,1,0,0,0,0|1,0,1]=4 4141 B11R1.28 NCCOCc1cccc[n]1 Amb18181726 [1,1,0,0,0,0|1,0,1]=4 4142 B11R1.28 NCCOCc1ccccc1 Amb1081962 [1,1,0,0,0,0|0,0,1]=3 4143 B11R1.28 NCCOCc1ccccc1 Amb2137059 [1,1,0,0,0,0|0,0,1]=3 4144 B11R1.28 NCC\C=C\c1c[n]ccc1 Amb25061778 [1,1,0,0,0,0|2,0,0]=4 4145 B11R1.28 NCC\C=C\c1cc[n]cc1 Amb24678309 [1,1,0,0,0,0|2,0,0]=4 4146 B11R1.28 NCC\C=C\c1cccc[n]1 Amb24383569 [1,1,0,0,0,0|2,0,0]=4 4147 B11R1.28 NCC\C=C\c1ccccc1 Amb17138419 [1,1,0,0,0,0|1,0,0]=3 4148 B11R1.28 NCC\N=C\c1cc[n]cc1 Amb24486118 [1,1,0,0,0,0|2,0,0]=4 4149 B11R1.28 NC\C=C\Cc1ccccc1 Amb24351087 [1,1,0,0,0,0|2,0,0]=4 4150 B11R1.28 NNC\C=C\c1ccccc1 Amb24563952 [1,1,0,0,0,0|2,0,0]=4 4151 B11R1.28 NOCOCc1ccccc1 Amb10606697 [1,1,0,0,0,0|1,0,1]=4 4152 B11R1.28 NOC\C=C\c1ccccc1 Amb18124997 [1,1,0,0,0,0|2,0,0]=4 4153 B11R1.28 O=CCONc1ccccc1 Amb24434643 [1,1,0,0,0,0|1,0,1]=4 4154 B11R1.28 O=CC\C=C\c1ccccc1 Amb18644267 [1,1,0,0,0,0|1,0,1]=4 4155 B11R1.28 OCC=C=Cc1ccccc1 Amb24398063 [1,1,0,0,0,0|1,0,1]=4 4156 B11R1.28 OCCCNc1ccccc1 Amb17307125 [1,1,0,0,0,0|2,0,0]=4 4157 B11R1.28 OCCCNc1ccccc1 Amb17772314 [1,1,0,0,0,0|2,0,0]=4 4158 B11R1.28 OCCN=Cc1ccccc1 Amb24065097 [1,1,0,0,0,0|1,0,0]=3 4159 B11R1.28 OCCNCc1ccccc1 Amb1835287 [1,1,0,0,0,0|1,0,1]=4 4160 B11R1.28 OCC\C=C\c1cc[n]cc1 Amb24666733 [1,1,0,0,0,0|2,0,0]=4 4161 B11R1.28 OCC\C=C\c1cccc[n]1 Amb25233577 [1,1,0,0,0,0|2,0,0]=4 4162 B11R1.28 OCC\C=C\c1ccccc1 Amb24756581 [1,1,0,0,0,0|1,0,0]=3 4163 B11R1.28 OCC\N=C/c1cc[n]cc1 Amb24106776 [1,1,0,0,0,0|2,0,0]=4 4164 B11R1.28 OCC\N=C\c1ccccc1 Amb20622247 [1,1,0,0,0,0|1,0,0]=3 4165 B11R1.28 OC\C=C\Cc1ccccc1 Amb25074433 [1,1,0,0,0,0|2,0,0]=4 4166 B11R1.28 OC\C=C\Nc1ccccc1 Amb25228349 [1,1,0,0,0,0|2,0,0]=4 4167 B11R1.28 OC\C=C\Oc1ccccc1 Amb25283274 [1,1,0,0,0,0|2,0,0]=4 4168 B11R1.28 SCCCCc1ccccc1 Amb17400224 [1,1,0,0,0,0|1,0,1]=4 4169 B11R1.28 SCC\C=C\c1ccccc1 Amb24390438 [1,1,0,0,0,0|1,0,0]=3 4170 B11R1.28 [NH3+]CCCCc1ccccc1 Amb22733934 [1,1,0,0,0,0|1,0,1]=4 4171 B11R1.40 CCC(=S)Nc1ccccc1 Amb24757738 [1,1,0,0,0,0|2,0,0]=4 4172 B11R1.40 CCC(Br)Cc1ccccc1 Amb25189250 [1,1,0,0,0,0|1,0,1]=4 4173 B11R1.40 CCC(C)Oc1ccccc1 Amb24350256 [1,1,0,0,0,0|2,0,0]=4 4174 B11R1.40 CCC(C)Sc1ccccc1 Amb25698974 [1,1,0,0,0,0|2,0,0]=4 4175 B11R1.40 CCC(Cl)Cc1ccccc1 Amb18177890 [1,1,0,0,0,0|1,0,1]=4 4176 B11R1.40 CCN(Cc1ccccc1)C Amb10807414 [1,1,0,0,0,0|1,0,1]=4 4177 B11R1.40 CCN(Cc1ccccc1)N Amb17232076 [1,1,0,0,0,0|1,0,1]=4 4178 B11R1.40 CCP(=O)Oc1ccccc1 Amb21963209 [1,1,0,0,0,0|2,0,0]=4 4179 B11R1.40 CCS(=O)Cc1ccccc1 Amb24485048 [1,1,0,0,0,0|0,1,1]=4 4180 B11R1.40 CCS(=O)Nc1ccccc1 Amb24752666 [1,1,0,0,0,0|1,1,0]=4 4181 B11R1.40 CC[C@@H](Br)Cc1ccccc1 Amb25770013 [1,1,0,0,0,0|1,0,1]=4 4182 B11R1.40 CC[C@@H](Cl)Cc1ccccc1 Amb24710145 [1,1,0,0,0,0|1,0,1]=4 4183 B11R1.40 CC[C@@H](N)Cc1ccccc1 Amb22748727 [1,1,0,0,0,0|1,0,1]=4 4184 B11R1.40 CC[C@@H](N)Cc1ccccc1 Amb25141525 [1,1,0,0,0,0|1,0,1]=4 4185 B11R1.40 CC[C@@H](O)Cc1ccccc1 Amb19375372 [1,1,0,0,0,0|1,0,1]=4 4186 B11R1.40 CC[C@H](Cl)Cc1ccccc1 Amb25765719 [1,1,0,0,0,0|1,0,1]=4 4187 B11R1.40 CC[C@H](N)Cc1ccccc1 Amb19929690 [1,1,0,0,0,0|1,0,1]=4 4188 B11R1.40 CC\C(\I)=C/c1ccccc1 Amb22641702 [1,1,0,0,0,0|1,0,0]=3 4189 B11R1.40 CC\C(\N)=N\c1ccccc1 Amb24453266 [1,1,0,0,0,0|2,0,0]=4 4190 B11R1.40 CC\[N+](\[O-])=C/c1cc[n]cc1 Amb24096595 [1,1,0,0,0,0|2,0,0]=4 4191 B11R1.40 CC\[N+](\[O-])=C/c1cccc[n]1 Amb24096599 [1,1,0,0,0,0|2,0,0]=4 4192 B11R1.40 CC\[N+](\[O-])=C\c1cccc[n]1 Amb24518451 [1,1,0,0,0,0|2,0,0]=4 4193 B11R1.40 C\C(=C/c1ccccc1)\NC Amb25825428 [1,1,0,0,0,0|2,0,0]=4 4194 B11R1.40 C\C(\CBr)=C/c1ccccc1 Amb24605004 [1,1,0,0,0,0|2,0,0]=4 4195 B11R1.40 C\C(\CC)=C\c1ccccc1 Amb22546773 [1,1,0,0,0,0|1,0,0]=3 4196 B11R1.40 C\C(\CN)=C/c1ccccc1 Amb25076849 [1,1,0,0,0,0|2,0,0]=4 4197 B11R1.40 C\C(\CN)=C\c1ccccc1 Amb24634730 [1,1,0,0,0,0|2,0,0]=4 4198 B11R1.40 ClC\C(\Br)=C\c1ccccc1 Amb25283246 [1,1,0,0,0,0|2,0,0]=4 4199 B11R1.40 Cl\C(\CCl)=C/c1ccccc1 Amb25362063 [1,1,0,0,0,0|2,0,0]=4 4200 B11R1.40 F\C(\CBr)=C\c1ccccc1 Amb24745736 [1,1,0,0,0,0|2,0,0]=4 4201 B11R1.40 NC\C(\Cl)=C\c1ccccc1 Amb25259250 [1,1,0,0,0,0|2,0,0]=4 4202 B11R1.40 OC\C(\Br)=C\c1ccccc1 Amb25187542 [1,1,0,0,0,0|2,0,0]=4 4203 B11R1.91 CC(=C)OCc1ccccc1 Amb22731238 [1,1,0,0,0,0|0,0,2]=4 4204 B11R1.91 CC(=C)\C=C\c1ccccc1 Amb22546632 [1,1,0,0,0,0|1,0,1]=4 4205 B11R1.91 CC(=O)\C=C/c1ccccc1 Amb24380759 [1,1,0,0,0,0|1,0,1]=4 4206 B11R1.91 CC(=O)\C=C\c1ccccc1 Amb1658842 [1,1,0,0,0,0|1,0,1]=4 4207 B11R1.91 CC(=S)OCc1ccccc1 Amb22168133 [1,1,0,0,0,0|0,0,2]=4 4208 B11R1.91 CC(Br)C#Cc1ccccc1 Amb25827119 [1,1,0,0,0,0|1,0,1]=4 4209 B11R1.91 CC(Br)COc1ccccc1 Amb25278262 [1,1,0,0,0,0|2,0,0]=4 4210 B11R1.91 CC(Br)\C=C\c1c[n]ccc1 Amb25150522 [1,1,0,0,0,0|2,0,0]=4 4211 B11R1.91 CC(Br)\C=C\c1cccc[n]1 Amb25115437 [1,1,0,0,0,0|2,0,0]=4 4212 B11R1.91 CC(C)NNc1ccccc1 Amb24586606 [1,1,0,0,0,0|2,0,0]=4 4213 B11R1.91 CC(C)OCc1cc[n]cc1 Amb24649842 [1,1,0,0,0,0|1,0,1]=4 4214 B11R1.91 CC(C)OCc1cccc[n]1 Amb24485831 [1,1,0,0,0,0|1,0,1]=4 4215 B11R1.91 CC(C)\C=C/c1ccccc1 Amb22546593 [1,1,0,0,0,0|1,0,0]=3 4216 B11R1.91 CC(C)\N=C\c1ccccc1 Amb22734192 [1,1,0,0,0,0|1,0,0]=3 4217 B11R1.91 CC(COc1ccccc1)N Amb10609380 [1,1,0,0,0,0|2,0,0]=4 4218 B11R1.91 CC(COc1ccccc1)N Amb1126967 [1,1,0,0,0,0|2,0,0]=4 4219 B11R1.91 CC(Cl)COc1ccccc1 Amb20248050 [1,1,0,0,0,0|2,0,0]=4 4220 B11R1.91 CC(Cl)CSc1ccccc1 Amb25361088 [1,1,0,0,0,0|2,0,0]=4 4221 B11R1.91 CC(N)C=Cc1ccccc1 Amb23536549 [1,1,0,0,0,0|1,0,0]=3 4222 B11R1.91 CC(N)CNc1ccccc1 Amb18972362 [1,1,0,0,0,0|2,0,0]=4 4223 B11R1.91 CC(N)CSc1ccccc1 Amb18065472 [1,1,0,0,0,0|2,0,0]=4 4224 B11R1.91 CC(N)CSc1ccccc1 Amb21988436 [1,1,0,0,0,0|2,0,0]=4 4225 B11R1.91 CC(N)OCc1cccc[n]1 Amb24432123 [1,1,0,0,0,0|1,0,1]=4 4226 B11R1.91 CC(N)\C=C\c1c[n]ccc1 Amb24664994 [1,1,0,0,0,0|2,0,0]=4 4227 B11R1.91 CC(N)\C=C\c1ccccc1 Amb18124854 [1,1,0,0,0,0|1,0,0]=3 4228 B11R1.91 CC(N)\C=C\c1ccccc1 Amb21961471 [1,1,0,0,0,0|1,0,0]=3 4229 B11R1.91 CC(NCc1ccccc1)C Amb2118435 [1,1,0,0,0,0|1,0,1]=4 4230 B11R1.91 CC(O)C#Cc1ccccc1 Amb24101080 [1,1,0,0,0,0|1,0,1]=4 4231 B11R1.91 CC(O)CSc1ccccc1 Amb18793066 [1,1,0,0,0,0|2,0,0]=4 4232 B11R1.91 CC(O)OCc1ccccc1 Amb25070837 [1,1,0,0,0,0|0,0,1]=3 4233 B11R1.91 CC(O)\C=C\c1c[n]ccc1 Amb25847379 [1,1,0,0,0,0|2,0,0]=4 4234 B11R1.91 CC(S)CNc1ccccc1 Amb25701720 [1,1,0,0,0,0|2,0,0]=4 4235 B11R1.91 CC(\C=C\c1ccccc1)O Amb17593695 [1,1,0,0,0,0|1,0,0]=3 4236 B11R1.91 CC(\C=C\c1ccccn1)C Amb10574376 [1,1,0,0,0,0|2,0,0]=4 4237 B11R1.91 CN(C)/N=C/c1ccccc1 Amb17703328 [1,1,0,0,0,0|2,0,0]=4 4238 B11R1.91 CN(C)OCc1ccccc1 Amb24735469 [1,1,0,0,0,0|1,0,1]=4 4239 B11R1.91 CN(C)\C=C\c1ccccc1 Amb25056753 [1,1,0,0,0,0|2,0,0]=4 4240 B11R1.91 C[C@@H](COc1ccccc1)N Amb17232092 [1,1,0,0,0,0|2,0,0]=4 4241 B11R1.91 C[C@@H](N)CNc1ccccc1 Amb24392348 [1,1,0,0,0,0|2,0,0]=4 4242 B11R1.91 C[C@@H](N)COc1ccccc1 Amb18538481 [1,1,0,0,0,0|2,0,0]=4 4243 B11R1.91 C[C@@H](N)CSc1ccccc1 Amb24692771 [1,1,0,0,0,0|2,0,0]=4 4244 B11R1.91 C[C@@H](N)\C=C\c1ccccc1 Amb24359903 [1,1,0,0,0,0|1,0,0]=3 4245 B11R1.91 C[C@@H](O)CCc1ccccc1 Amb22049565 [1,1,0,0,0,0|1,0,1]=4 4246 B11R1.91 C[C@@H](O)CSc1ccccc1 Amb25148170 [1,1,0,0,0,0|2,0,0]=4 4247 B11R1.91 C[C@@H](O)\C=C\c1c[n]ccc1 Amb24698684 [1,1,0,0,0,0|2,0,0]=4 4248 B11R1.91 C[C@H](N)C#Cc1ccccc1 Amb24408567 [1,1,0,0,0,0|1,0,1]=4 4249 B11R1.91 C[C@H](N)CNc1ccccc1 Amb24423922 [1,1,0,0,0,0|2,0,0]=4 4250 B11R1.91 C[C@H](N)CSc1ccccc1 Amb24486596 [1,1,0,0,0,0|2,0,0]=4 4251 B11R1.91 C[C@H](N)\C=C\c1ccccc1 Amb25809484 [1,1,0,0,0,0|1,0,0]=3 4252 B11R1.91 C[C@H](O)CCc1ccccc1 Amb19929325 [1,1,0,0,0,0|1,0,1]=4 4253 B11R1.91 C[C@H](O)CNc1ccccc1 Amb25060992 [1,1,0,0,0,0|2,0,0]=4 4254 B11R1.91 C[C@H](O)COc1ccccc1 Amb25786939 [1,1,0,0,0,0|2,0,0]=4 4255 B11R1.91 C[C@H](O)CSc1ccccc1 Amb25852129 [1,1,0,0,0,0|2,0,0]=4 4256 B11R1.91 ClC(Cl)\C=C\c1ccccc1 Amb24634340 [1,1,0,0,0,0|2,0,0]=4 4257 B11R1.2 CCO\C(=C\Cl)\c1ccc[s]1 Amb25774965 [0,1,0,0,1,0|2,0,0]=4 4258 B11R1.15 CCCC(=O)c1cc(Br)c[s]1 Amb24485927 [0,1,0,0,1,0|2,0,0]=4 4259 B11R1.15 CCCC(=O)c1cc[n](C)c1 Amb25149096 [0,1,0,0,1,0|2,0,0]=4 4260 B11R1.15 CCCC(=O)c1ccc(Cl)o1 Amb24380091 [0,1,0,0,1,0|2,0,0]=4 4261 B11R1.15 CCCC(=O)c1ccc(s1)C Amb2154724 [0,1,0,0,1,0|2,0,0]=4 4262 B11R1.15 CCCC(=O)c1coc(Br)c1 Amb25838232 [0,1,0,0,1,0|2,0,0]=4 4263 B11R1.15 CCNC(=O)c1c[s]c(Cl)c1 Amb25356933 [0,1,0,0,1,0|2,0,0]=4 4264 B11R1.15 CCNC(=O)c1c[s]c(I)c1 Amb20643992 [0,1,0,0,1,0|2,0,0]=4 4265 B11R1.15 CCNC(=O)c1cc(Cl)c[s]1 Amb24485286 [0,1,0,0,1,0|2,0,0]=4 4266 B11R1.15 CCNC(=O)c1cc(F)c[nH]1 Amb25336848 [0,1,0,0,1,0|2,0,0]=4 4267 B11R1.15 CCNC(=O)c1cc(N)c[s]1 Amb24515911 [0,1,0,0,1,0|2,0,0]=4 4268 B11R1.15 CCNC(=O)c1cc(O)c[s]1 Amb25822103 [0,1,0,0,1,0|2,0,0]=4 4269 B11R1.15 CCNC(=O)c1cc(cs1)Br Amb14325062 [0,1,0,0,1,0|2,0,0]=4 4270 B11R1.15 CCNC(=O)c1ccc(N)o1 Amb18101835 [0,1,0,0,1,0|2,0,0]=4 4271 B11R1.15 CCNC(=O)c1ccc(s1)Br Amb2111444 [0,1,0,0,1,0|2,0,0]=4 4272 B11R1.15 CCNC(=O)c1ccc(s1)Cl Amb2227896 [0,1,0,0,1,0|2,0,0]=4 4273 B11R1.15 CCOC(=N)c1c[s]c(Br)c1 Amb24465339 [0,1,0,0,1,0|2,0,0]=4 4274 B11R1.15 CCOC(=N)c1ccc(Cl)[s]1 Amb19060816 [0,1,0,0,1,0|2,0,0]=4 4275 B11R1.15 CCOC(=O)C1=CC(=O)N=N1 Amb24062010 [0,1,0,0,1,0|2,0,0]=4 4276 B11R1.15 CCOC(=O)C1=CC(=O)NN1 Amb21970994 [0,1,0,0,1,0|2,0,0]=4 4277 B11R1.15 CCOC(=O)C1=CC(=O)ON1 Amb25373977 [0,1,0,0,1,0|2,0,0]=4 4278 B11R1.15 CCOC(=O)C1=CCC(N)=N1 Amb25148278 [0,1,0,0,1,0|1,0,1]=4 4279 B11R1.15 CCOC(=O)C1=CNC(=O)O1 Amb19959311 [0,1,0,0,1,0|2,0,0]=4 4280 B11R1.15 CCOC(=O)C1=COC(=O)N1 Amb20171080 [0,1,0,0,1,0|2,0,0]=4 4281 B11R1.15 CCOC(=O)C1=CSC(=N)N1 Amb19914391 [0,1,0,0,1,0|2,0,0]=4 4282 B11R1.15 CCOC(=O)C=1CC(=C)CC1 Amb24378921 [0,1,0,0,1,0|0,0,2]=4 4283 B11R1.15 CCOC(=O)C=1CCC(=O)C1 Amb22736093 [0,1,0,0,1,0|0,0,2]=4 4284 B11R1.15 CCOC(=O)c1[nH]cc(Cl)[n]1 Amb22495054 [0,1,0,0,1,0|2,0,0]=4 4285 B11R1.15 CCOC(=O)c1[nH]cc(I)[n]1 Amb22495048 [0,1,0,0,1,0|2,0,0]=4 4286 B11R1.15 CCOC(=O)c1[nH]cc(N)[n]1 Amb18125829 [0,1,0,0,1,0|2,0,0]=4 4287 B11R1.15 CCOC(=O)c1[n]c(Br)co1 Amb25148088 [0,1,0,0,1,0|2,0,0]=4 4288 B11R1.15 CCOC(=O)c1[n]c(Cl)c[s]1 Amb24465884 [0,1,0,0,1,0|2,0,0]=4 4289 B11R1.15 CCOC(=O)c1[n]cc(Br)[s]1 Amb22233824 [0,1,0,0,1,0|2,0,0]=4 4290 B11R1.15 CCOC(=O)c1[n]cc(N)[s]1 Amb20668232 [0,1,0,0,1,0|2,0,0]=4 4291 B11R1.15 CCOC(=O)c1c[nH]c(Br)c1 Amb23555565 [0,1,0,0,1,0|1,0,0]=3 4292 B11R1.15 CCOC(=O)c1c[nH]c(Cl)[n]1 Amb24371428 [0,1,0,0,1,0|2,0,0]=4 4293 B11R1.15 CCOC(=O)c1c[nH]c(N)c1 Amb24486572 [0,1,0,0,1,0|1,0,0]=3 4294 B11R1.15 CCOC(=O)c1c[nH]c(O)c1 Amb25360874 [0,1,0,0,1,0|1,0,0]=3 4295 B11R1.15 CCOC(=O)c1c[n]c(Br)[nH]1 Amb22741299 [0,1,0,0,1,0|2,0,0]=4 4296 B11R1.15 CCOC(=O)c1c[n]c(Br)o1 Amb19957768 [0,1,0,0,1,0|2,0,0]=4 4297 B11R1.15 CCOC(=O)c1c[n]c(I)[s]1 Amb24331943 [0,1,0,0,1,0|2,0,0]=4 4298 B11R1.15 CCOC(=O)c1c[n]c(O)[s]1 Amb24330425 [0,1,0,0,1,0|2,0,0]=4 4299 B11R1.15 CCOC(=O)c1c[n]c(S)[s]1 Amb22757479 [0,1,0,0,1,0|2,0,0]=4 4300 B11R1.15 CCOC(=O)c1c[s]c(Br)c1 Amb21520180 [0,1,0,0,1,0|1,0,0]=3 4301 B11R1.15 CCOC(=O)c1c[s]c(F)[n]1 Amb21964349 [0,1,0,0,1,0|2,0,0]=4 4302 B11R1.15 CCOC(=O)c1c[s]c(N)[n]1 Amb17659102 [0,1,0,0,1,0|2,0,0]=4 4303 B11R1.15 CCOC(=O)c1c[s]c(N)[n]1 Amb21520416 [0,1,0,0,1,0|2,0,0]=4 4304 B11R1.15 CCOC(=O)c1c[s]c(N)c1 Amb18302898 [0,1,0,0,1,0|1,0,0]=3 4305 B11R1.15 CCOC(=O)c1c[s]c(O)[n]1 Amb25114134 [0,1,0,0,1,0|2,0,0]=4 4306 B11R1.15 CCOC(=O)c1cc(Br)[nH][n]1 Amb22275952 [0,1,0,0,1,0|2,0,0]=4 4307 B11R1.15 CCOC(=O)c1cc(Br)[n]o1 Amb19957462 [0,1,0,0,1,0|2,0,0]=4 4308 B11R1.15 CCOC(=O)c1cc(Br)c[s]1 Amb21963828 [0,1,0,0,1,0|1,0,0]=3 4309 B11R1.15 CCOC(=O)c1cc(Br)co1 Amb21857051 [0,1,0,0,1,0|1,0,0]=3 4310 B11R1.15 CCOC(=O)c1cc(Cl)[nH][n]1 Amb24183366 [0,1,0,0,1,0|2,0,0]=4 4311 B11R1.15 CCOC(=O)c1cc(Cl)[n]o1 Amb25749009 [0,1,0,0,1,0|2,0,0]=4 4312 B11R1.15 CCOC(=O)c1cc(Cl)c[nH]1 Amb22900077 [0,1,0,0,1,0|1,0,0]=3 4313 B11R1.15 CCOC(=O)c1cc(Cl)c[s]1 Amb21857348 [0,1,0,0,1,0|1,0,0]=3 4314 B11R1.15 CCOC(=O)c1cc(Cl)o[n]1 Amb23441000 [0,1,0,0,1,0|2,0,0]=4 4315 B11R1.15 CCOC(=O)c1cc(F)[nH][n]1 Amb22491549 [0,1,0,0,1,0|2,0,0]=4 4316 B11R1.15 CCOC(=O)c1cc(F)c[nH]1 Amb23412352 [0,1,0,0,1,0|1,0,0]=3 4317 B11R1.15 CCOC(=O)c1cc(I)[nH][n]1 Amb22494371 [0,1,0,0,1,0|2,0,0]=4 4318 B11R1.15 CCOC(=O)c1cc(I)c[nH]1 Amb19895277 [0,1,0,0,1,0|1,0,0]=3 4319 B11R1.15 CCOC(=O)c1cc(N)[nH][n]1 Amb19944226 [0,1,0,0,1,0|2,0,0]=4 4320 B11R1.15 CCOC(=O)c1cc(N)[n]o1 Amb22001692 [0,1,0,0,1,0|2,0,0]=4 4321 B11R1.15 CCOC(=O)c1cc(N)c[nH]1 Amb19149276 [0,1,0,0,1,0|1,0,0]=3 4322 B11R1.15 CCOC(=O)c1cc(N)o[n]1 Amb20670689 [0,1,0,0,1,0|2,0,0]=4 4323 B11R1.15 CCOC(=O)c1cc(N)o[n]1 Amb22298599 [0,1,0,0,1,0|2,0,0]=4 4324 B11R1.15 CCOC(=O)c1cc(O)[n]o1 Amb22498284 [0,1,0,0,1,0|2,0,0]=4 4325 B11R1.15 CCOC(=O)c1cc(S)c[s]1 Amb25136146 [0,1,0,0,1,0|1,0,0]=3 4326 B11R1.15 CCOC(=O)c1cc([nH]n1)O Amb10242634 [0,1,0,0,1,0|2,0,0]=4 4327 B11R1.15 CCOC(=O)c1cc(c[nH]1)N Amb16232513 [0,1,0,0,1,0|1,0,0]=3 4328 B11R1.15 CCOC(=O)c1cc(n[nH]1)N Amb16186039 [0,1,0,0,1,0|2,0,0]=4 4329 B11R1.15 CCOC(=O)c1ccc(Br)[nH]1 Amb20669032 [0,1,0,0,1,0|1,0,0]=3 4330 B11R1.15 CCOC(=O)c1ccc(Cl)[nH]1 Amb20669031 [0,1,0,0,1,0|1,0,0]=3 4331 B11R1.15 CCOC(=O)c1ccc(F)[s]1 Amb19892818 [0,1,0,0,1,0|1,0,0]=3 4332 B11R1.15 CCOC(=O)c1ccc(I)[nH]1 Amb22498459 [0,1,0,0,1,0|1,0,0]=3 4333 B11R1.15 CCOC(=O)c1ccc(I)[s]1 Amb25188527 [0,1,0,0,1,0|1,0,0]=3 4334 B11R1.15 CCOC(=O)c1ccc(I)o1 Amb24504907 [0,1,0,0,1,0|1,0,0]=3 4335 B11R1.15 CCOC(=O)c1ccc(N)[nH]1 Amb19930072 [0,1,0,0,1,0|1,0,0]=3 4336 B11R1.15 CCOC(=O)c1ccc(N)[nH]1 Amb22831286 [0,1,0,0,1,0|1,0,0]=3 4337 B11R1.15 CCOC(=O)c1ccc(N)o1 Amb18125820 [0,1,0,0,1,0|1,0,0]=3 4338 B11R1.15 CCOC(=O)c1ccc(O)[s]1 Amb20242357 [0,1,0,0,1,0|1,0,0]=3 4339 B11R1.15 CCOC(=O)c1ccc([nH]1)C Amb16233444 [0,1,0,0,1,0|1,0,0]=3 4340 B11R1.15 CCOC(=O)c1ccc(s1)N Amb17109293 [0,1,0,0,1,0|1,0,0]=3 4341 B11R1.15 CCOC(=O)c1cn(C)cn1 Amb17739732 [0,1,0,0,1,0|2,0,0]=4 4342 B11R1.15 CCOC(=O)c1cnc([nH]1)N Amb10607928 [0,1,0,0,1,0|2,0,0]=4 4343 B11R1.15 CCOC(=O)c1cnc(o1)C Amb13890525 [0,1,0,0,1,0|2,0,0]=4 4344 B11R1.15 CCOC(=O)c1cnc(o1)Cl Amb10069143 [0,1,0,0,1,0|2,0,0]=4 4345 B11R1.15 CCOC(=O)c1cnc(o1)N Amb10071289 [0,1,0,0,1,0|2,0,0]=4 4346 B11R1.15 CCOC(=O)c1cnc(s1)Br Amb2455930 [0,1,0,0,1,0|2,0,0]=4 4347 B11R1.15 CCOC(=O)c1cnc(s1)Cl Amb16232258 [0,1,0,0,1,0|2,0,0]=4 4348 B11R1.15 CCOC(=O)c1cnc(s1)N Amb10068446 [0,1,0,0,1,0|2,0,0]=4 4349 B11R1.15 CCOC(=O)c1cnc(s1)N Amb2455927 [0,1,0,0,1,0|2,0,0]=4 4350 B11R1.15 CCOC(=O)c1coc(Br)c1 Amb22583751 [0,1,0,0,1,0|1,0,0]=3 4351 B11R1.15 CCOC(=O)c1coc(Cl)c1 Amb24651519 [0,1,0,0,1,0|1,0,0]=3 4352 B11R1.15 CCOC(=O)c1coc(F)[n]1 Amb24329327 [0,1,0,0,1,0|2,0,0]=4 4353 B11R1.15 CCOC(=O)c1coc(I)[n]1 Amb22504351 [0,1,0,0,1,0|2,0,0]=4 4354 B11R1.15 CCOC(=O)c1coc(I)c1 Amb25162858 [0,1,0,0,1,0|1,0,0]=3 4355 B11R1.15 CCOC(=O)c1coc(n1)Br Amb10069182 [0,1,0,0,1,0|2,0,0]=4 4356 B11R1.15 CCOC(=O)c1coc(n1)Cl Amb2455677 [0,1,0,0,1,0|2,0,0]=4 4357 B11R1.15 CCOC(=O)c1coc(n1)N Amb2455681 [0,1,0,0,1,0|2,0,0]=4 4358 B11R1.15 CCOC(=O)c1csc(n1)Br Amb2455713 [0,1,0,0,1,0|2,0,0]=4 4359 B11R1.15 CCOC(=O)c1csc(n1)Cl Amb10067792 [0,1,0,0,1,0|2,0,0]=4 4360 B11R1.15 CCOC(=O)c1csc(n1)N Amb1106793 [0,1,0,0,1,0|2,0,0]=4 4361 B11R1.15 CCOC(=O)c1csc(n1)N Amb2235516 [0,1,0,0,1,0|2,0,0]=4 4362 B11R1.15 CCOC(=O)c1n[nH]c(c1)C Amb2236249 [0,1,0,0,1,0|2,0,0]=4 4363 B11R1.15 CCOC(=O)c1nc(c[nH]1)Br Amb10603431 [0,1,0,0,1,0|2,0,0]=4 4364 B11R1.15 CCOC(=O)c1nc(cs1)Br Amb13883509 [0,1,0,0,1,0|2,0,0]=4 4365 B11R1.15 CCOC(=O)c1ncc(s1)C Amb10842188 [0,1,0,0,1,0|2,0,0]=4 4366 B11R1.15 CCOC(=O)c1noc(c1)C Amb1953489 [0,1,0,0,1,0|2,0,0]=4 4367 B11R1.15 CCOC(=O)c1scc(n1)C Amb10842198 [0,1,0,0,1,0|2,0,0]=4 4368 B11R1.15 CCO\C(\O)=C\1/C=CC(=O)S1 Amb25706105 [0,1,0,0,1,0|1,0,1]=4 4369 B11R1.15 C[n]1cc(cc1)C(=O)OCC Amb23441089 [0,1,0,0,1,0|1,0,0]=3 4370 B11R1.15 Cc1c[nH]c([n]1)C(=O)OCC Amb21964492 [0,1,0,0,1,0|2,0,0]=4 4371 B11R1.15 Cc1c[n]c(o1)C(=O)OCC Amb20621703 [0,1,0,0,1,0|2,0,0]=4 4372 B11R1.15 Cc1cc([nH]c1)C(=O)OCC Amb19944690 [0,1,0,0,1,0|1,0,0]=3 4373 B11R1.15 Cc1cc([s]c1)C(=O)OCC Amb22498281 [0,1,0,0,1,0|1,0,0]=3 4374 B11R1.15 Cc1cc(c[nH]1)C(=O)OCC Amb25693705 [0,1,0,0,1,0|1,0,0]=3 4375 B11R1.15 Cc1cc(c[s]1)C(=N)OCC Amb25712854 [0,1,0,0,1,0|2,0,0]=4 4376 B11R1.15 Cc1cc(c[s]1)C(=O)CCC Amb24533082 [0,1,0,0,1,0|2,0,0]=4 4377 B11R1.15 Cc1cc(c[s]1)C(=O)NCC Amb25750965 [0,1,0,0,1,0|2,0,0]=4 4378 B11R1.15 Cc1cc(c[s]1)C(=O)OCC Amb22494673 [0,1,0,0,1,0|1,0,0]=3 4379 B11R1.15 Cc1cc(co1)C(=O)CCC Amb24467253 [0,1,0,0,1,0|2,0,0]=4 4380 B11R1.15 Cc1cc(co1)C(=O)NCC Amb25102882 [0,1,0,0,1,0|2,0,0]=4 4381 B11R1.15 Cc1cc(co1)C(=O)OCC Amb21964297 [0,1,0,0,1,0|1,0,0]=3 4382 B11R1.15 Cc1ccc([nH]1)C(=O)CCC Amb24453300 [0,1,0,0,1,0|2,0,0]=4 4383 B11R1.15 Cc1ccc([s]1)C(=N)OCC Amb18793455 [0,1,0,0,1,0|2,0,0]=4 4384 B11R1.15 Cc1ccc(o1)C(=N)OCC Amb18179471 [0,1,0,0,1,0|2,0,0]=4 4385 B11R1.15 Cc1ccc(o1)C(=O)CCC Amb18181721 [0,1,0,0,1,0|2,0,0]=4 4386 B11R1.15 Cc1coc([n]1)C(=O)OCC Amb21964399 [0,1,0,0,1,0|2,0,0]=4 4387 B11R1.29 BrCCCC(=O)c1ccco1 Amb10562218 [0,1,0,0,1,0|2,0,0]=4 4388 B11R1.29 BrCCCC(=O)c1cccs1 Amb17250552 [0,1,0,0,1,0|2,0,0]=4 4389 B11R1.29 C#CCOC(=O)c1cc[s]c1 Amb24734712 [0,1,0,0,1,0|1,0,1]=4 4390 B11R1.29 C=CCOC(=O)C=1CC=CC1 Amb24762934 [0,1,0,0,1,0|0,0,2]=4 4391 B11R1.29 C=CCOC(=O)[n]1cccc1 Amb24763032 [0,1,0,0,1,0|1,0,1]=4 4392 B11R1.29 C=CCOC(=O)c1cc[nH]c1 Amb25372167 [0,1,0,0,1,0|1,0,1]=4 4393 B11R1.29 C=CCOC(=O)c1ccc[nH]1 Amb25379549 [0,1,0,0,1,0|1,0,1]=4 4394 B11R1.29 C=CCOC(=O)c1ccc[s]1 Amb25372184 [0,1,0,0,1,0|1,0,1]=4 4395 B11R1.29 C=CCOC(=O)c1ccoc1 Amb24763033 [0,1,0,0,1,0|1,0,1]=4 4396 B11R1.29 CC(CCCO)=C1C=CC=C1 Amb24353028 [0,1,0,0,1,0|2,0,0]=4 4397 B11R1.29 CCCCC(=O)[n]1cccc1 Amb25383159 [0,1,0,0,1,0|2,0,0]=4 4398 B11R1.29 CCCCC(=O)c1ccc[nH]1 Amb25380459 [0,1,0,0,1,0|2,0,0]=4 4399 B11R1.29 CCCCC(=O)c1ccco1 Amb10070291 [0,1,0,0,1,0|2,0,0]=4 4400 B11R1.29 CCCCC(=O)c1cocc1 Amb10562664 [0,1,0,0,1,0|2,0,0]=4 4401 B11R1.29 CCCCC(=O)c1cscc1 Amb10562660 [0,1,0,0,1,0|2,0,0]=4 4402 B11R1.29 CCCNC(=O)c1ccc[nH]1 Amb24378766 [0,1,0,0,1,0|2,0,0]=4 4403 B11R1.29 CCCOC(=O)c1[nH]cc[n]1 Amb24764561 [0,1,0,0,1,0|2,0,0]=4 4404 B11R1.29 CCCOC(=O)c1c[nH][n]c1 Amb18181851 [0,1,0,0,1,0|2,0,0]=4 4405 B11R1.29 CCCOC(=O)c1c[n]c[s]1 Amb24755533 [0,1,0,0,1,0|2,0,0]=4 4406 B11R1.29 CCCOC(=O)c1c[s]c[n]1 Amb18185680 [0,1,0,0,1,0|2,0,0]=4 4407 B11R1.29 CCCOC(=O)c1ccc[nH]1 Amb23512510 [0,1,0,0,1,0|1,0,0]=3 4408 B11R1.29 CCCOC(=O)c1cco[n]1 Amb18182961 [0,1,0,0,1,0|2,0,0]=4 4409 B11R1.29 CCNCC(=O)c1cc[nH]c1 Amb18563447 [0,1,0,0,1,0|2,0,0]=4 4410 B11R1.29 CCNCC(=O)c1ccc[nH]1 Amb24755211 [0,1,0,0,1,0|2,0,0]=4 4411 B11R1.29 CCNCC(=O)c1cccs1 Amb17314790 [0,1,0,0,1,0|2,0,0]=4 4412 B11R1.29 CCOCC(=O)c1c[nH][n]c1 Amb24750294 [0,1,0,0,1,0|2,0,0]=4 4413 B11R1.29 CCOCC(=O)c1cc[n][s]1 Amb24764334 [0,1,0,0,1,0|2,0,0]=4 4414 B11R1.29 CCOCC(=O)c1cc[s][n]1 Amb24762796 [0,1,0,0,1,0|2,0,0]=4 4415 B11R1.29 CCOCC(=O)c1ccc[nH]1 Amb25386145 [0,1,0,0,1,0|1,0,0]=3 4416 B11R1.29 CCONC(=O)c1c[n]c[s]1 Amb25106214 [0,1,0,0,1,0|2,0,0]=4 4417 B11R1.29 CCONC(=O)c1c[s]c[n]1 Amb25151204 [0,1,0,0,1,0|2,0,0]=4 4418 B11R1.29 CCONC(=O)c1cc[nH][n]1 Amb25294986 [0,1,0,0,1,0|2,0,0]=4 4419 B11R1.29 CCONC(=O)c1cc[nH]c1 Amb25358592 [0,1,0,0,1,0|1,0,0]=3 4420 B11R1.29 CCONC(=O)c1cc[s]c1 Amb24725974 [0,1,0,0,1,0|1,0,0]=3 4421 B11R1.29 CCONC(=O)c1ccco1 Amb10572673 [0,1,0,0,1,0|1,0,0]=3 4422 B11R1.29 CCONC(=O)c1cccs1 Amb10704838 [0,1,0,0,1,0|1,0,0]=3 4423 B11R1.29 CCONC(=O)c1co[n]c1 Amb25730903 [0,1,0,0,1,0|2,0,0]=4 4424 B11R1.29 CCONC(=O)c1coc[n]1 Amb25767470 [0,1,0,0,1,0|2,0,0]=4 4425 B11R1.29 CCO\N=C(/N)\c1ccc[s]1 Amb18862840 [0,1,0,0,1,0|2,0,0]=4 4426 B11R1.29 CCO\N=C(/N)\c1ccco1 Amb18224352 [0,1,0,0,1,0|2,0,0]=4 4427 B11R1.29 CCSCC(=O)c1cc[s]c1 Amb24761970 [0,1,0,0,1,0|1,1,0]=4 4428 B11R1.29 CCSCC(=O)c1ccoc1 Amb24761969 [0,1,0,0,1,0|1,1,0]=4 4429 B11R1.29 CC\C=C\C(=O)c1ccc[nH]1 Amb25121492 [0,1,0,0,1,0|2,0,0]=4 4430 B11R1.29 CC\C=C\C(=O)c1ccco1 Amb25149501 [0,1,0,0,1,0|2,0,0]=4 4431 B11R1.29 CNCCC(=O)c1c[nH]cc1 Amb18563449 [0,1,0,0,1,0|2,0,0]=4 4432 B11R1.29 CNCCC(=O)c1ccc[s]1 Amb22235115 [0,1,0,0,1,0|2,0,0]=4 4433 B11R1.29 CNCCC(=O)c1ccco1 Amb25382971 [0,1,0,0,1,0|2,0,0]=4 4434 B11R1.29 CNCCC(=O)c1cccs1 Amb17334774 [0,1,0,0,1,0|2,0,0]=4 4435 B11R1.29 COCCC(=O)c1cc[s]c1 Amb18801855 [0,1,0,0,1,0|2,0,0]=4 4436 B11R1.29 COCCC(=O)c1ccco1 Amb18181848 [0,1,0,0,1,0|2,0,0]=4 4437 B11R1.29 COCCC(=O)c1cccs1 Amb17201826 [0,1,0,0,1,0|2,0,0]=4 4438 B11R1.29 COCOC(=O)c1c[n]c[s]1 Amb24751034 [0,1,0,0,1,0|2,0,0]=4 4439 B11R1.29 COCOC(=O)c1cc[s]c1 Amb24751033 [0,1,0,0,1,0|1,0,0]=3 4440 B11R1.29 COCOC(=O)c1ccc[nH]1 Amb24751010 [0,1,0,0,1,0|1,0,0]=3 4441 B11R1.29 COCOC(=O)c1ccc[s]1 Amb24751030 [0,1,0,0,1,0|1,0,0]=3 4442 B11R1.29 COCOC(=O)c1ccco1 Amb24751029 [0,1,0,0,1,0|1,0,0]=3 4443 B11R1.29 COCOC(=O)c1ccoc1 Amb24751031 [0,1,0,0,1,0|1,0,0]=3 4444 B11R1.29 CSCCC(=O)c1c[s]cc1 Amb25379583 [0,1,0,0,1,0|2,0,0]=4 4445 B11R1.29 CSCCC(=O)c1ccc[s]1 Amb25379577 [0,1,0,0,1,0|2,0,0]=4 4446 B11R1.29 CSCCC(=O)c1ccco1 Amb25379567 [0,1,0,0,1,0|2,0,0]=4 4447 B11R1.29 CSCCC(=O)c1ccoc1 Amb25379573 [0,1,0,0,1,0|2,0,0]=4 4448 B11R1.29 C\C(=N\OCC)\c1c[s]cc1 Amb25833364 [0,1,0,0,1,0|2,0,0]=4 4449 B11R1.29 C\C(=N\OCC)\c1ccc[nH]1 Amb24485307 [0,1,0,0,1,0|2,0,0]=4 4450 B11R1.29 C\C(=N\OCC)\c1cocc1 Amb25066141 [0,1,0,0,1,0|2,0,0]=4 4451 B11R1.29 ClCCCC(=O)c1ccco1 Amb17138699 [0,1,0,0,1,0|2,0,0]=4 4452 B11R1.29 ClCCCC(=O)c1cccs1 Amb1159154 [0,1,0,0,1,0|2,0,0]=4 4453 B11R1.29 ClCCNC(=O)c1ccco1 Amb17103197 [0,1,0,0,1,0|2,0,0]=4 4454 B11R1.29 ClCCNC(=O)c1cccs1 Amb17103198 [0,1,0,0,1,0|2,0,0]=4 4455 B11R1.29 ClCCOC(=O)c1ccco1 Amb17939073 [0,1,0,0,1,0|1,0,0]=3 4456 B11R1.29 N#CCOC(=O)c1cc[nH]c1 Amb25071399 [0,1,0,0,1,0|1,0,1]=4 4457 B11R1.29 N#CCOC(=O)c1ccc[s]1 Amb24502117 [0,1,0,0,1,0|1,0,1]=4 4458 B11R1.29 N#CCOC(=O)c1ccco1 Amb25061211 [0,1,0,0,1,0|1,0,1]=4 4459 B11R1.29 N#CCOC(=O)c1ccoc1 Amb25187540 [0,1,0,0,1,0|1,0,1]=4 4460 B11R1.29 NCCCC(=O)c1cc[nH]c1 Amb18201353 [0,1,0,0,1,0|2,0,0]=4 4461 B11R1.29 NCCCC(=O)c1ccc[s]1 Amb18623716 [0,1,0,0,1,0|2,0,0]=4 4462 B11R1.29 NCCCC(=O)c1ccco1 Amb18120247 [0,1,0,0,1,0|2,0,0]=4 4463 B11R1.29 NCCNC(=O)c1ccc[nH]1 Amb18970497 [0,1,0,0,1,0|2,0,0]=4 4464 B11R1.29 NCCNC(=O)c1ccco1 Amb1869482 [0,1,0,0,1,0|2,0,0]=4 4465 B11R1.29 NCCNC(=O)c1cccs1 Amb1133695 [0,1,0,0,1,0|2,0,0]=4 4466 B11R1.29 NCCNC(=O)c1cocc1 Amb10610129 [0,1,0,0,1,0|2,0,0]=4 4467 B11R1.29 NCCNC(=O)c1cocc1 Amb1124187 [0,1,0,0,1,0|2,0,0]=4 4468 B11R1.29 NCCNC(=O)c1cscc1 Amb1125650 [0,1,0,0,1,0|2,0,0]=4 4469 B11R1.29 O=C(CCCCl)c1cc[s]c1 Amb25380210 [0,1,0,0,1,0|2,0,0]=4 4470 B11R1.29 O=C(CCCCl)c1ccc[nH]1 Amb24764863 [0,1,0,0,1,0|2,0,0]=4 4471 B11R1.29 O=C(CCCCl)c1ccoc1 Amb25380214 [0,1,0,0,1,0|2,0,0]=4 4472 B11R1.29 O=C(NCCCl)c1cc[s]c1 Amb18317275 [0,1,0,0,1,0|2,0,0]=4 4473 B11R1.29 O=C(NCCCl)c1ccc[nH]1 Amb25710874 [0,1,0,0,1,0|2,0,0]=4 4474 B11R1.29 O=C(NCCCl)c1ccoc1 Amb18178080 [0,1,0,0,1,0|2,0,0]=4 4475 B11R1.29 O=C(NCCF)c1cc[nH]c1 Amb24686075 [0,1,0,0,1,0|2,0,0]=4 4476 B11R1.29 O=C(NCCF)c1ccco1 Amb25150620 [0,1,0,0,1,0|2,0,0]=4 4477 B11R1.29 O=C(NCCI)c1cc[s]c1 Amb24488071 [0,1,0,0,1,0|2,0,0]=4 4478 B11R1.29 O=C(NCCI)c1ccco1 Amb24432553 [0,1,0,0,1,0|2,0,0]=4 4479 B11R1.29 O=C(NCCI)c1ccoc1 Amb25129300 [0,1,0,0,1,0|2,0,0]=4 4480 B11R1.29 O=C(NCCS)c1ccc[s]1 Amb24485072 [0,1,0,0,1,0|2,0,0]=4 4481 B11R1.29 OCCCC(=O)C=1CC=CC1 Amb25382995 [0,1,0,0,1,0|1,0,1]=4 4482 B11R1.29 OCCCC(=O)c1cc[nH]c1 Amb18224329 [0,1,0,0,1,0|2,0,0]=4 4483 B11R1.29 OCCCC(=O)c1ccco1 Amb24766213 [0,1,0,0,1,0|2,0,0]=4 4484 B11R1.29 OCCCC(=O)c1cccs1 Amb1110142 [0,1,0,0,1,0|2,0,0]=4 4485 B11R1.29 OCCNC(=O)[n]1cccc1 Amb25350251 [0,1,0,0,1,0|2,0,0]=4 4486 B11R1.29 OCCNC(=O)c1c[nH]cc1 Amb18224356 [0,1,0,0,1,0|2,0,0]=4 4487 B11R1.29 OCCOC(=O)C1C=CC=C1 Amb25382184 [0,1,0,0,1,0|0,0,1]=3 4488 B11R1.31 CC(CC)C(=O)c1cc[nH]c1 Amb25693841 [0,1,0,0,1,0|2,0,0]=4 4489 B11R1.31 CC(CC)C(=O)c1ccoc1 Amb25837292 [0,1,0,0,1,0|2,0,0]=4 4490 B11R1.31 CCC(=O)C(=O)c1c[nH]cc1 Amb24732173 [0,1,0,0,1,0|2,0,0]=4 4491 B11R1.31 CCC(=O)C(=O)c1cccs1 Amb17400253 [0,1,0,0,1,0|2,0,0]=4 4492 B11R1.31 CCC(Br)C(=O)c1cc[nH]c1 Amb25821806 [0,1,0,0,1,0|2,0,0]=4 4493 B11R1.31 CCC(Br)C(=O)c1cc[s]c1 Amb24528880 [0,1,0,0,1,0|2,0,0]=4 4494 B11R1.31 CCC(Br)C(=O)c1ccco1 Amb22500045 [0,1,0,0,1,0|2,0,0]=4 4495 B11R1.31 CCC(C(=O)c1cccs1)Br Amb17437828 [0,1,0,0,1,0|2,0,0]=4 4496 B11R1.31 CCC(C)C(=O)c1ccco1 Amb18181720 [0,1,0,0,1,0|2,0,0]=4 4497 B11R1.31 CCC(Cl)C(=O)c1ccc[s]1 Amb18049327 [0,1,0,0,1,0|2,0,0]=4 4498 B11R1.31 CCC(N)C(=O)c1cc[s]c1 Amb25824262 [0,1,0,0,1,0|2,0,0]=4 4499 B11R1.31 CCC(N)C(=O)c1ccco1 Amb18201130 [0,1,0,0,1,0|2,0,0]=4 4500 B11R1.31 CCC(N)C(=O)c1ccoc1 Amb24667990 [0,1,0,0,1,0|2,0,0]=4 4501 B11R1.31 CCC(O)C(=O)c1cc[s]c1 Amb25128212 [0,1,0,0,1,0|2,0,0]=4 4502 B11R1.31 CCC(O)C(=O)c1ccc[nH]1 Amb24598073 [0,1,0,0,1,0|2,0,0]=4 4503 B11R1.31 CN(CC)C(=O)c1cc[nH]c1 Amb24613316 [0,1,0,0,1,0|2,0,0]=4 4504 B11R1.31 CN(CC)C(=O)c1cc[s]c1 Amb25120598 [0,1,0,0,1,0|2,0,0]=4 4505 B11R1.31 CN(CC)C(=O)c1ccc[nH]1 Amb25158492 [0,1,0,0,1,0|2,0,0]=4 4506 B11R1.31 CN(CC)C(=O)c1ccc[nH]1 Amb25344571 [0,1,0,0,1,0|2,0,0]=4 4507 B11R1.31 CN(CC)C(=O)c1ccoc1 Amb25158498 [0,1,0,0,1,0|2,0,0]=4 4508 B11R1.31 CN(CC)C(=O)c1ccoc1 Amb25806353 [0,1,0,0,1,0|2,0,0]=4 4509 B11R1.77 CC(=O)OC(=O)c1ccc[nH]1 Amb25771862 [0,1,0,0,1,0|1,0,1]=4 4510 B11R1.77 CC(C)CC(=O)c1cc[nH]c1 Amb18065353 [0,1,0,0,1,0|2,0,0]=4 4511 B11R1.77 CC(C)CC(=O)c1cc[s]c1 Amb18180157 [0,1,0,0,1,0|2,0,0]=4 4512 B11R1.77 CC(C)CC(=O)c1ccc[nH]1 Amb24742837 [0,1,0,0,1,0|2,0,0]=4 4513 B11R1.77 CC(C)CC(=O)c1ccoc1 Amb25068245 [0,1,0,0,1,0|2,0,0]=4 4514 B11R1.77 CC(C)OC(=O)c1c[nH][n]c1 Amb24464334 [0,1,0,0,1,0|2,0,0]=4 4515 B11R1.77 CC(C)OC(=O)c1c[s]c[n]1 Amb25787053 [0,1,0,0,1,0|2,0,0]=4 4516 B11R1.77 CC(C)OC(=O)c1cc[nH][n]1 Amb19747548 [0,1,0,0,1,0|2,0,0]=4 4517 B11R1.77 CC(C)OC(=O)c1cc[nH]c1 Amb24362964 [0,1,0,0,1,0|1,0,0]=3 4518 B11R1.77 CC(C)OC(=O)c1ccoc1 Amb24368186 [0,1,0,0,1,0|1,0,0]=3 4519 B11R1.77 CC(C)OC(=O)c1coc[n]1 Amb24415735 [0,1,0,0,1,0|2,0,0]=4 4520 B11R1.77 CC(CC(=O)c1ccco1)C Amb17334321 [0,1,0,0,1,0|2,0,0]=4 4521 B11R1.77 CC(Cl)CC(=O)c1ccc[s]1 Amb25201052 [0,1,0,0,1,0|2,0,0]=4 4522 B11R1.77 CC(Cl)OC(=O)c1[nH]cc[n]1 Amb25189144 [0,1,0,0,1,0|2,0,0]=4 4523 B11R1.77 CC(N)CC(=O)c1cc[s]c1 Amb24745178 [0,1,0,0,1,0|2,0,0]=4 4524 B11R1.77 CC(N)CC(=O)c1ccc[s]1 Amb25328083 [0,1,0,0,1,0|2,0,0]=4 4525 B11R1.77 CC(N)CC(=O)c1ccco1 Amb20668936 [0,1,0,0,1,0|2,0,0]=4 4526 B11R1.77 CC(N)CC(=O)c1ccco1 Amb22157232 [0,1,0,0,1,0|2,0,0]=4 4527 B11R1.77 CC(N)CC(=O)c1ccoc1 Amb25188641 [0,1,0,0,1,0|2,0,0]=4 4528 B11R1.77 CC(O)CC(=O)c1ccco1 Amb25116510 [0,1,0,0,1,0|2,0,0]=4 4529 B11R1.77 CC(OC(=O)c1ccco1)C Amb10572174 [0,1,0,0,1,0|1,0,0]=3 4530 B11R1.77 CC(OC(=O)c1cccs1)C Amb17509337 [0,1,0,0,1,0|1,0,0]=3 4531 B11R1.199 CC1=CN=CC1C(=O)OCC Amb24062036 [0,1,0,0,1,0|1,0,1]=4 4532 B11R1.199 CCCC(=O)c1[nH]ccc1Cl Amb24366084 [0,1,0,0,1,0|2,0,0]=4 4533 B11R1.199 CCCC(=O)c1[s]ccc1Br Amb25256898 [0,1,0,0,1,0|2,0,0]=4 4534 B11R1.199 CCCC(=O)c1[s]ccc1Cl Amb25118237 [0,1,0,0,1,0|2,0,0]=4 4535 B11R1.199 CCCC(=O)c1ccoc1Cl Amb25148366 [0,1,0,0,1,0|2,0,0]=4 4536 B11R1.199 CCCC(=O)c1occc1Br Amb25073086 [0,1,0,0,1,0|2,0,0]=4 4537 B11R1.199 CCNC(=O)c1[s]ccc1Br Amb24689773 [0,1,0,0,1,0|2,0,0]=4 4538 B11R1.199 CCNC(=O)c1[s]ccc1Cl Amb24533861 [0,1,0,0,1,0|2,0,0]=4 4539 B11R1.199 CCNC(=O)c1[s]ccc1N Amb18281745 [0,1,0,0,1,0|2,0,0]=4 4540 B11R1.199 CCNC(=O)c1c[s]cc1Br Amb24457599 [0,1,0,0,1,0|2,0,0]=4 4541 B11R1.199 CCNC(=O)c1occc1Br Amb24485287 [0,1,0,0,1,0|2,0,0]=4 4542 B11R1.199 CCOC(=N)c1c[s]cc1Br Amb24571529 [0,1,0,0,1,0|2,0,0]=4 4543 B11R1.199 CCOC(=O)C1=CC=CC1=O Amb24608577 [0,1,0,0,1,0|0,0,0]=2 4544 B11R1.199 CCOC(=O)C1=CNOC1=N Amb18526953 [0,1,0,0,1,0|2,0,0]=4 4545 B11R1.199 CCOC(=O)C1=CNOC1=O Amb24053122 [0,1,0,0,1,0|2,0,0]=4 4546 B11R1.199 CCOC(=O)C1=COCC1=O Amb24078816 [0,1,0,0,1,0|1,0,1]=4 4547 B11R1.199 CCOC(=O)C1=CONC1=O Amb20000465 [0,1,0,0,1,0|2,0,0]=4 4548 B11R1.199 CCOC(=O)C1=CSSC1=S Amb24701476 [0,1,0,0,1,0|2,0,0]=4 4549 B11R1.199 CCOC(=O)C1CC=CC1=O Amb25838672 [0,1,0,0,1,0|0,0,2]=4 4550 B11R1.199 CCOC(=O)N1C=CNC1=O Amb24682622 [0,1,0,0,1,0|2,0,0]=4 4551 B11R1.199 CCOC(=O)N1CC=CC1=O Amb22494811 [0,1,0,0,1,0|1,0,1]=4 4552 B11R1.199 CCOC(=O)[n]1[n]ccc1N Amb24485887 [0,1,0,0,1,0|2,0,0]=4 4553 B11R1.199 CCOC(=O)[n]1cccc1Br Amb25305656 [0,1,0,0,1,0|1,0,0]=3 4554 B11R1.199 CCOC(=O)c1[nH][n]cc1F Amb25840664 [0,1,0,0,1,0|2,0,0]=4 4555 B11R1.199 CCOC(=O)c1[nH][n]cc1N Amb19943939 [0,1,0,0,1,0|2,0,0]=4 4556 B11R1.199 CCOC(=O)c1[nH][n]cc1S Amb24681380 [0,1,0,0,1,0|2,0,0]=4 4557 B11R1.199 CCOC(=O)c1[nH]c[n]c1Br Amb22462547 [0,1,0,0,1,0|2,0,0]=4 4558 B11R1.199 CCOC(=O)c1[nH]c[n]c1F Amb24728246 [0,1,0,0,1,0|2,0,0]=4 4559 B11R1.199 CCOC(=O)c1[nH]ccc1Cl Amb25322219 [0,1,0,0,1,0|1,0,0]=3 4560 B11R1.199 CCOC(=O)c1[nH]ccc1F Amb21963525 [0,1,0,0,1,0|1,0,0]=3 4561 B11R1.199 CCOC(=O)c1[nH]ccc1N Amb16232297 [0,1,0,0,1,0|1,0,0]=3 4562 B11R1.199 CCOC(=O)c1[nH]ccc1N Amb2455699 [0,1,0,0,1,0|1,0,0]=3 4563 B11R1.199 CCOC(=O)c1[nH]ccc1O Amb25268916 [0,1,0,0,1,0|1,0,0]=3 4564 B11R1.199 CCOC(=O)c1[nH]cnc1C Amb1148606 [0,1,0,0,1,0|2,0,0]=4 4565 B11R1.199 CCOC(=O)c1[n][nH]cc1Cl Amb22886754 [0,1,0,0,1,0|2,0,0]=4 4566 B11R1.199 CCOC(=O)c1[n][s]cc1Br Amb25303410 [0,1,0,0,1,0|2,0,0]=4 4567 B11R1.199 CCOC(=O)c1[n][s]cc1N Amb25760710 [0,1,0,0,1,0|2,0,0]=4 4568 B11R1.199 CCOC(=O)c1[n]c[s]c1Cl Amb21964354 [0,1,0,0,1,0|2,0,0]=4 4569 B11R1.199 CCOC(=O)c1[n]c[s]c1I Amb20171522 [0,1,0,0,1,0|2,0,0]=4 4570 B11R1.199 CCOC(=O)c1[n]c[s]c1N Amb18126892 [0,1,0,0,1,0|2,0,0]=4 4571 B11R1.199 CCOC(=O)c1[n]c[s]c1N Amb22494301 [0,1,0,0,1,0|2,0,0]=4 4572 B11R1.199 CCOC(=O)c1[n]c[s]c1S Amb18640249 [0,1,0,0,1,0|2,0,0]=4 4573 B11R1.199 CCOC(=O)c1[n]cc[n]1N Amb22292353 [0,1,0,0,1,0|2,0,0]=4 4574 B11R1.199 CCOC(=O)c1[n]coc1N Amb25198093 [0,1,0,0,1,0|2,0,0]=4 4575 B11R1.199 CCOC(=O)c1[n]occ1O Amb24485944 [0,1,0,0,1,0|2,0,0]=4 4576 B11R1.199 CCOC(=O)c1[s]c[n]c1N Amb21864786 [0,1,0,0,1,0|2,0,0]=4 4577 B11R1.199 CCOC(=O)c1[s]c[n]c1S Amb24665942 [0,1,0,0,1,0|2,0,0]=4 4578 B11R1.199 CCOC(=O)c1[s]ccc1Br Amb21858437 [0,1,0,0,1,0|1,0,0]=3 4579 B11R1.199 CCOC(=O)c1[s]ccc1Cl Amb21961313 [0,1,0,0,1,0|1,0,0]=3 4580 B11R1.199 CCOC(=O)c1[s]ccc1F Amb25191175 [0,1,0,0,1,0|1,0,0]=3 4581 B11R1.199 CCOC(=O)c1[s]ccc1I Amb25751041 [0,1,0,0,1,0|1,0,0]=3 4582 B11R1.199 CCOC(=O)c1[s]ccc1O Amb21964174 [0,1,0,0,1,0|1,0,0]=3 4583 B11R1.199 CCOC(=O)c1[s]ccc1S Amb18636637 [0,1,0,0,1,0|1,0,0]=3 4584 B11R1.199 CCOC(=O)c1c(Br)cn[nH]1 Amb15701548 [0,1,0,0,1,0|2,0,0]=4 4585 B11R1.199 CCOC(=O)c1c(N)cn[nH]1 Amb1928592 [0,1,0,0,1,0|2,0,0]=4 4586 B11R1.199 CCOC(=O)c1c[nH][n]c1Br Amb21857749 [0,1,0,0,1,0|2,0,0]=4 4587 B11R1.199 CCOC(=O)c1c[nH][n]c1I Amb19958588 [0,1,0,0,1,0|2,0,0]=4 4588 B11R1.199 CCOC(=O)c1c[nH]nc1C Amb1161616 [0,1,0,0,1,0|2,0,0]=4 4589 B11R1.199 CCOC(=O)c1c[nH]nc1N Amb1048151 [0,1,0,0,1,0|2,0,0]=4 4590 B11R1.199 CCOC(=O)c1c[nH]nc1O Amb17621629 [0,1,0,0,1,0|2,0,0]=4 4591 B11R1.199 CCOC(=O)c1c[n]c[n]1N Amb22292038 [0,1,0,0,1,0|2,0,0]=4 4592 B11R1.199 CCOC(=O)c1c[n]oc1F Amb24551866 [0,1,0,0,1,0|2,0,0]=4 4593 B11R1.199 CCOC(=O)c1c[s][n]c1Cl Amb25783150 [0,1,0,0,1,0|2,0,0]=4 4594 B11R1.199 CCOC(=O)c1c[s]cc1Cl Amb24664583 [0,1,0,0,1,0|1,0,0]=3 4595 B11R1.199 CCOC(=O)c1c[s]cc1I Amb25761084 [0,1,0,0,1,0|1,0,0]=3 4596 B11R1.199 CCOC(=O)c1c[s]cc1N Amb18118353 [0,1,0,0,1,0|1,0,0]=3 4597 B11R1.199 CCOC(=O)c1cc[nH]c1Cl Amb22831507 [0,1,0,0,1,0|1,0,0]=3 4598 B11R1.199 CCOC(=O)c1cc[nH]c1N Amb20241372 [0,1,0,0,1,0|1,0,0]=3 4599 B11R1.199 CCOC(=O)c1cc[s]c1Cl Amb22750949 [0,1,0,0,1,0|1,0,0]=3 4600 B11R1.199 CCOC(=O)c1ccc[n]1N Amb19889828 [0,1,0,0,1,0|1,0,0]=3 4601 B11R1.199 CCOC(=O)c1ccc[n]1N Amb22233849 [0,1,0,0,1,0|1,0,0]=3 4602 B11R1.199 CCOC(=O)c1ccoc1Br Amb24760713 [0,1,0,0,1,0|1,0,0]=3 4603 B11R1.199 CCOC(=O)c1ccsc1C Amb16233433 [0,1,0,0,1,0|1,0,0]=3 4604 B11R1.199 CCOC(=O)c1cn[nH]c1C Amb10975223 [0,1,0,0,1,0|2,0,0]=4 4605 B11R1.199 CCOC(=O)c1cn[nH]c1N Amb1159221 [0,1,0,0,1,0|2,0,0]=4 4606 B11R1.199 CCOC(=O)c1cn[nH]c1O Amb2389798 [0,1,0,0,1,0|2,0,0]=4 4607 B11R1.199 CCOC(=O)c1cncn1C Amb16233121 [0,1,0,0,1,0|2,0,0]=4 4608 B11R1.199 CCOC(=O)c1cnoc1N Amb1092565 [0,1,0,0,1,0|2,0,0]=4 4609 B11R1.199 CCOC(=O)c1co[n]c1Br Amb24533126 [0,1,0,0,1,0|2,0,0]=4 4610 B11R1.199 CCOC(=O)c1co[n]c1N Amb25837458 [0,1,0,0,1,0|2,0,0]=4 4611 B11R1.199 CCOC(=O)c1cocc1Br Amb24730657 [0,1,0,0,1,0|1,0,0]=3 4612 B11R1.199 CCOC(=O)c1conc1O Amb10604754 [0,1,0,0,1,0|2,0,0]=4 4613 B11R1.199 CCOC(=O)c1csnc1C Amb10071450 [0,1,0,0,1,0|2,0,0]=4 4614 B11R1.199 CCOC(=O)c1n[nH]cc1Br Amb16187065 [0,1,0,0,1,0|2,0,0]=4 4615 B11R1.199 CCOC(=O)c1n[nH]cc1N Amb1084723 [0,1,0,0,1,0|2,0,0]=4 4616 B11R1.199 CCOC(=O)c1nc[nH]c1Cl Amb1981342 [0,1,0,0,1,0|2,0,0]=4 4617 B11R1.199 CCOC(=O)c1nc[nH]c1N Amb1980807 [0,1,0,0,1,0|2,0,0]=4 4618 B11R1.199 CCOC(=O)c1nc[nH]c1S Amb1980930 [0,1,0,0,1,0|2,0,0]=4 4619 B11R1.199 CCOC(=O)c1nccn1C Amb1071172 [0,1,0,0,1,0|2,0,0]=4 4620 B11R1.199 CCOC(=O)c1ncsc1Br Amb10067421 [0,1,0,0,1,0|2,0,0]=4 4621 B11R1.199 CCOC(=O)c1nocc1C Amb13883732 [0,1,0,0,1,0|2,0,0]=4 4622 B11R1.199 CCOC(=O)c1oc[n]c1Br Amb19958101 [0,1,0,0,1,0|2,0,0]=4 4623 B11R1.199 CCOC(=O)c1oc[n]c1I Amb22493901 [0,1,0,0,1,0|2,0,0]=4 4624 B11R1.199 CCOC(=O)c1occc1Br Amb24486752 [0,1,0,0,1,0|1,0,0]=3 4625 B11R1.199 CCOC(=O)c1occc1N Amb21857505 [0,1,0,0,1,0|1,0,0]=3 4626 B11R1.199 CCOC(=O)c1ocnc1C Amb1085910 [0,1,0,0,1,0|2,0,0]=4 4627 B11R1.199 CCOC(=O)c1sccc1N Amb13889596 [0,1,0,0,1,0|1,0,0]=3 4628 B11R1.199 CCOC(=O)c1scnc1Br Amb10602634 [0,1,0,0,1,0|2,0,0]=4 4629 B11R1.199 CCSC(=O)c1c[s]cc1Br Amb25850085 [0,1,0,0,1,0|1,1,0]=4 4630 B11R1.199 C[n]1cccc1C(=O)NCC Amb22001194 [0,1,0,0,1,0|2,0,0]=4 4631 B11R1.199 C[n]1cccc1C(=O)OCC Amb20621241 [0,1,0,0,1,0|1,0,0]=3 4632 B11R1.199 Cc1[s][n]cc1C(=O)OCC Amb25751076 [0,1,0,0,1,0|2,0,0]=4 4633 B11R1.199 Cc1[s]c[n]c1C(=O)OCC Amb19737364 [0,1,0,0,1,0|2,0,0]=4 4634 B11R1.199 Cc1[s]ccc1C(=N)OCC Amb25311826 [0,1,0,0,1,0|2,0,0]=4 4635 B11R1.199 Cc1[s]ccc1C(=O)CCC Amb25355270 [0,1,0,0,1,0|2,0,0]=4 4636 B11R1.199 Cc1c[n][nH]c1C(=O)OCC Amb20171580 [0,1,0,0,1,0|2,0,0]=4 4637 B11R1.199 Cc1c[s]cc1C(=N)OCC Amb25228228 [0,1,0,0,1,0|2,0,0]=4 4638 B11R1.199 Cc1c[s]cc1C(=O)CCC Amb24423827 [0,1,0,0,1,0|2,0,0]=4 4639 B11R1.199 Cc1c[s]cc1C(=O)NCC Amb24463114 [0,1,0,0,1,0|2,0,0]=4 4640 B11R1.199 Cc1c[s]cc1C(=O)OCC Amb22886613 [0,1,0,0,1,0|1,0,0]=3 4641 B11R1.199 Cc1cc[nH]c1C(=O)NCC Amb25058198 [0,1,0,0,1,0|2,0,0]=4 4642 B11R1.199 Cc1cc[s]c1C(=N)OCC Amb18180214 [0,1,0,0,1,0|2,0,0]=4 4643 B11R1.199 Cc1cocc1C(=O)OCC Amb24078782 [0,1,0,0,1,0|1,0,0]=3 4644 B11R1.199 Cc1oc[n]c1C(=O)OCC Amb18179574 [0,1,0,0,1,0|2,0,0]=4 4645 B11R1.199 Cc1occc1C(=O)CCC Amb25151463 [0,1,0,0,1,0|2,0,0]=4 4646 B13R1.19 BrCCC(=O)Nc1ccc(cc1)C Amb17325059 [0,1,0,0,0,1|2,0,0]=4 4647 B13R1.19 BrCCC(=O)Nc1ccc(cc1)Cl Amb17324293 [0,1,0,0,0,1|2,0,0]=4 4648 B13R1.19 BrCCC(=O)Nc1ccc(cc1)F Amb17331898 [0,1,0,0,0,1|2,0,0]=4 4649 B13R1.19 BrCCC(=O)Nc1ccc(cc1)O Amb17332019 [0,1,0,0,0,1|2,0,0]=4 4650 B13R1.19 C=NOC(=O)Nc1ccc(Cl)cc1 Amb24570200 [0,1,0,0,0,1|1,0,1]=4 4651 B13R1.19 CC#CC(=O)Nc1ccc(Cl)cc1 Amb22462112 [0,1,0,0,0,1|1,0,1]=4 4652 B13R1.19 CC#CC(=O)Nc1ccc(F)cc1 Amb25115581 [0,1,0,0,0,1|1,0,1]=4 4653 B13R1.19 CC#CC(=O)Nc1ccc(O)cc1 Amb25285960 [0,1,0,0,0,1|1,0,1]=4 4654 B13R1.19 CC#CC(=O)Oc1ccc(F)cc1 Amb25333147 [0,1,0,0,0,1|1,0,1]=4 4655 B13R1.19 CC=CC(=O)Nc1ccc(Cl)cc1 Amb22466818 [0,1,0,0,0,1|1,0,1]=4 4656 B13R1.19 CCCC(=N)Nc1ccc(Cl)cc1 Amb25370912 [0,1,0,0,0,1|2,0,0]=4 4657 B13R1.19 CCCC(=N)Nc1ccc(I)cc1 Amb25372369 [0,1,0,0,0,1|2,0,0]=4 4658 B13R1.19 CCCC(=O)Cc1ccc(cc1)C Amb17138797 [0,1,0,0,0,1|1,0,0]=3 4659 B13R1.19 CCCC(=O)Cc1ccc(cc1)Cl Amb17139628 [0,1,0,0,0,1|1,0,0]=3 4660 B13R1.19 CCCC(=O)Cc1ccc(cc1)F Amb17138963 [0,1,0,0,0,1|1,0,0]=3 4661 B13R1.19 CCCC(=O)N=C1C=CC(=O)C=C1 Amb24492406 [0,1,0,0,0,1|1,0,0]=3 4662 B13R1.19 CCCC(=O)Nc1c[n]c(Cl)cc1 Amb25835341 [0,1,0,0,0,1|2,0,0]=4 4663 B13R1.19 CCCC(=O)Nc1c[n]c(F)cc1 Amb24544142 [0,1,0,0,0,1|2,0,0]=4 4664 B13R1.19 CCCC(=O)Nc1c[n]c(N)cc1 Amb18999671 [0,1,0,0,0,1|2,0,0]=4 4665 B13R1.19 CCCC(=O)Nc1ccc(F)c[n]1 Amb17964822 [0,1,0,0,0,1|2,0,0]=4 4666 B13R1.19 CCCC(=O)Nc1ccc(cc1)Br Amb1195957 [0,1,0,0,0,1|1,0,0]=3 4667 B13R1.19 CCCC(=O)Nc1ccc(cc1)N Amb1790767 [0,1,0,0,0,1|1,0,0]=3 4668 B13R1.19 CCCC(=O)Nc1ccc(nc1)Br Amb16982133 [0,1,0,0,0,1|2,0,0]=4 4669 B13R1.19 CCCC(=O)Nc1ccc(nc1)S Amb17206133 [0,1,0,0,0,1|2,0,0]=4 4670 B13R1.19 CCCS(=O)Nc1ccc(N)cc1 Amb25263934 [0,1,0,0,0,1|2,0,0]=4 4671 B13R1.19 CCNC(=N)Cc1ccc(Cl)cc1 Amb25120194 [0,1,0,0,0,1|2,0,0]=4 4672 B13R1.19 CCNC(=N)Nc1ccc(Cl)cc1 Amb19066808 [0,1,0,0,0,1|2,0,0]=4 4673 B13R1.19 CCNC(=N)Nc1ccc(F)cc1 Amb18185014 [0,1,0,0,0,1|2,0,0]=4 4674 B13R1.19 CCNC(=N)Nc1ccc(I)cc1 Amb25140628 [0,1,0,0,0,1|2,0,0]=4 4675 B13R1.19 CCNC(=O)CN1C=CC(=O)C=C1 Amb25142335 [0,1,0,0,0,1|2,0,0]=4 4676 B13R1.19 CCNC(=O)Cc1ccc(Br)c[n]1 Amb23586126 [0,1,0,0,0,1|2,0,0]=4 4677 B13R1.19 CCNC(=O)Cc1ccc(Cl)[n]c1 Amb24362448 [0,1,0,0,0,1|2,0,0]=4 4678 B13R1.19 CCNC(=O)Cc1ccc(Cl)c[n]1 Amb25345609 [0,1,0,0,0,1|2,0,0]=4 4679 B13R1.19 CCNC(=O)Cc1ccc(S)cc1 Amb25358208 [0,1,0,0,0,1|1,0,0]=3 4680 B13R1.19 CCNC(=O)Cc1ccc(cc1)N Amb1112064 [0,1,0,0,0,1|1,0,0]=3 4681 B13R1.19 CCNC(=O)NC1=CNC(=O)C=C1 Amb24368477 [0,1,0,0,0,1|2,0,0]=4 4682 B13R1.19 CCNC(=O)Nc1c[n]c(Br)cc1 Amb25295775 [0,1,0,0,0,1|2,0,0]=4 4683 B13R1.19 CCNC(=O)Nc1c[n]c(Cl)cc1 Amb25204486 [0,1,0,0,0,1|2,0,0]=4 4684 B13R1.19 CCNC(=O)Nc1c[n]c(F)cc1 Amb25795297 [0,1,0,0,0,1|2,0,0]=4 4685 B13R1.19 CCNC(=O)Nc1c[n]c(N)cc1 Amb18287784 [0,1,0,0,0,1|2,0,0]=4 4686 B13R1.19 CCNC(=O)Nc1ccc(Br)c[n]1 Amb24065474 [0,1,0,0,0,1|2,0,0]=4 4687 B13R1.19 CCNC(=O)Nc1ccc(Cl)c[n]1 Amb25309531 [0,1,0,0,0,1|2,0,0]=4 4688 B13R1.19 CCNC(=O)Nc1ccc(F)c[n]1 Amb25283974 [0,1,0,0,0,1|2,0,0]=4 4689 B13R1.19 CCNC(=O)Nc1ccc(cc1)C Amb1240612 [0,1,0,0,0,1|1,0,0]=3 4690 B13R1.19 CCNC(=O)Nc1ccc(cc1)Cl Amb1233667 [0,1,0,0,0,1|1,0,0]=3 4691 B13R1.19 CCNC(=O)Oc1ccc(Br)cc1 Amb25681097 [0,1,0,0,0,1|1,0,0]=3 4692 B13R1.19 CCNC(=O)Oc1ccc(Cl)cc1 Amb22466857 [0,1,0,0,0,1|1,0,0]=3 4693 B13R1.19 CCNC(=O)Oc1ccc(F)cc1 Amb24588134 [0,1,0,0,0,1|1,0,0]=3 4694 B13R1.19 CCNC(=O)Oc1ccc(I)cc1 Amb24414718 [0,1,0,0,0,1|1,0,0]=3 4695 B13R1.19 CCNC(=O)Sc1ccc(Cl)cc1 Amb24534155 [0,1,0,0,0,1|1,0,0]=3 4696 B13R1.19 CCNC(=S)Nc1ccc(cc1)C Amb2503024 [0,1,0,0,0,1|1,1,0]=4 4697 B13R1.19 CCNC(=S)Nc1ccc(cc1)O Amb2459583 [0,1,0,0,0,1|1,1,0]=4 4698 B13R1.19 CCNC(=S)Oc1ccc(Cl)cc1 Amb25102711 [0,1,0,0,0,1|1,1,0]=4 4699 B13R1.19 CCOC(=N)Cc1ccc(Br)cc1 Amb20673163 [0,1,0,0,0,1|1,0,0]=3 4700 B13R1.19 CCOC(=N)Cc1ccc(Br)cc1 Amb24089938 [0,1,0,0,0,1|1,0,0]=3 4701 B13R1.19 CCOC(=N)Cc1ccc(Cl)cc1 Amb18321860 [0,1,0,0,0,1|1,0,0]=3 4702 B13R1.19 CCOC(=N)Cc1ccc(Cl)cc1 Amb20673154 [0,1,0,0,0,1|1,0,0]=3 4703 B13R1.19 CCOC(=N)Cc1ccc(F)cc1 Amb20673149 [0,1,0,0,0,1|1,0,0]=3 4704 B13R1.19 CCOC(=O)C[n+]1ccc(cc1)C Amb10554031 [0,1,0,0,0,1|1,0,0]=3 4705 B13R1.19 CCOC(=O)Cc1[n]cc(F)c[n]1 Amb21857271 [0,1,0,0,0,1|2,0,0]=4 4706 B13R1.19 CCOC(=O)Cc1c[n]c(Br)[n]c1 Amb23439669 [0,1,0,0,0,1|2,0,0]=4 4707 B13R1.19 CCOC(=O)Cc1c[n]c(Cl)[n]c1 Amb23439853 [0,1,0,0,0,1|2,0,0]=4 4708 B13R1.19 CCOC(=O)Cc1cc[n+](cc1)C Amb10553743 [0,1,0,0,0,1|1,0,0]=3 4709 B13R1.19 CCOC(=O)Cc1ccc(Br)[n]c1 Amb23452632 [0,1,0,0,0,1|1,0,0]=3 4710 B13R1.19 CCOC(=O)Cc1ccc(Br)c[n]1 Amb21963596 [0,1,0,0,0,1|1,0,0]=3 4711 B13R1.19 CCOC(=O)Cc1ccc(Cl)[n][n]1 Amb22499434 [0,1,0,0,0,1|2,0,0]=4 4712 B13R1.19 CCOC(=O)Cc1ccc(Cl)[n]c1 Amb19515857 [0,1,0,0,0,1|1,0,0]=3 4713 B13R1.19 CCOC(=O)Cc1ccc(Cl)c[n]1 Amb23402253 [0,1,0,0,0,1|1,0,0]=3 4714 B13R1.19 CCOC(=O)Cc1ccc(I)c[n]1 Amb24183400 [0,1,0,0,0,1|1,0,0]=3 4715 B13R1.19 CCOC(=O)Cc1ccc(N)[n]c1 Amb22899575 [0,1,0,0,0,1|1,0,0]=3 4716 B13R1.19 CCOC(=O)Cc1ccc(N)c[n]1 Amb22234417 [0,1,0,0,0,1|1,0,0]=3 4717 B13R1.19 CCOC(=O)Cc1ccc(N)cc1 Amb22234960 [0,1,0,0,0,1|0,0,0]=2 4718 B13R1.19 CCOC(=O)Cc1ccc(O)c[n]1 Amb22405966 [0,1,0,0,0,1|1,0,0]=3 4719 B13R1.19 CCOC(=O)Cc1ccc(cc1)I Amb16230826 [0,1,0,0,0,1|0,0,0]=2 4720 B13R1.19 CCOC(=O)Cc1ncc(cn1)Br Amb10603178 [0,1,0,0,0,1|2,0,0]=4 4721 B13R1.19 CCOC(=O)NC1=CNC(=O)C=C1 Amb25753387 [0,1,0,0,0,1|1,0,0]=3 4722 B13R1.19 CCOC(=O)Nc1ccc(F)[n]c1 Amb25114046 [0,1,0,0,0,1|1,0,0]=3 4723 B13R1.19 CCOC(=O)Nc1ccc(F)c[n]1 Amb24362486 [0,1,0,0,0,1|1,0,0]=3 4724 B13R1.19 CCOC(=O)Nc1ccc(I)c[n]1 Amb25134763 [0,1,0,0,0,1|1,0,0]=3 4725 B13R1.19 CCOC(=O)Nc1ccc(N)[n]c1 Amb18999686 [0,1,0,0,0,1|1,0,0]=3 4726 B13R1.19 CCOC(=O)Nc1ccc(N)c[n]1 Amb18128861 [0,1,0,0,0,1|1,0,0]=3 4727 B13R1.19 CCOC(=O)Nc1ccc(S)cc1 Amb25062910 [0,1,0,0,0,1|0,0,0]=2 4728 B13R1.19 CCOC(=O)Nc1ccc(cc1)C Amb2500803 [0,1,0,0,0,1|0,0,0]=2 4729 B13R1.19 CCOC(=O)Nc1ccc(cc1)Cl Amb1625034 [0,1,0,0,0,1|0,0,0]=2 4730 B13R1.19 CCOC(=O)Nc1ccc(cc1)F Amb1095971 [0,1,0,0,0,1|0,0,0]=2 4731 B13R1.19 CCOC(=O)Nc1ccc(cc1)I Amb1538826 [0,1,0,0,0,1|0,0,0]=2 4732 B13R1.19 CCOC(=O)Nc1ccc(nc1)Br Amb16982207 [0,1,0,0,0,1|1,0,0]=3 4733 B13R1.19 CCOC(=S)Nc1ccc(Cl)cc1 Amb25309515 [0,1,0,0,0,1|0,1,0]=3 4734 B13R1.19 CCOC(=S)Nc1ccc(F)cc1 Amb25759074 [0,1,0,0,0,1|0,1,0]=3 4735 B13R1.19 CCSC(=N)Nc1ccc(O)cc1 Amb24181835 [0,1,0,0,0,1|1,1,0]=4 4736 B13R1.19 CCSC(=O)Nc1ccc(Cl)cc1 Amb22446313 [0,1,0,0,0,1|0,1,0]=3 4737 B13R1.19 CCSC(=O)Nc1ccc(F)cc1 Amb25249741 [0,1,0,0,0,1|0,1,0]=3 4738 B13R1.19 CCSC(=S)Nc1ccc(O)cc1 Amb25044790 [0,1,0,0,0,1|0,2,0]=4 4739 B13R1.19 CCSC(=S)Nc1ccc(cc1)C Amb2459592 [0,1,0,0,0,1|0,2,0]=4 4740 B13R1.19 CC\C=C(\C)/Nc1ccc(C)cc1 Amb25701882 [0,1,0,0,0,1|2,0,0]=4 4741 B13R1.19 CNCC(=O)Nc1ccc(F)cc1 Amb19372369 [0,1,0,0,0,1|2,0,0]=4 4742 B13R1.19 CNCC(=O)Nc1ccc(N)cc1 Amb24749388 [0,1,0,0,0,1|2,0,0]=4 4743 B13R1.19 CNCC(=O)Nc1ccc(cc1)C Amb1105856 [0,1,0,0,0,1|2,0,0]=4 4744 B13R1.19 CNCC(=O)Nc1ccc(cc1)Cl Amb2276036 [0,1,0,0,0,1|2,0,0]=4 4745 B13R1.19 CNCC(=O)Nc1ccc(cc1)Cl Amb2370653 [0,1,0,0,0,1|2,0,0]=4 4746 B13R1.19 CNCC(=O)Nc1ccc(cc1)F Amb2370688 [0,1,0,0,0,1|2,0,0]=4 4747 B13R1.19 CNCC(=O)Nc1ccc(cc1)O Amb13951398 [0,1,0,0,0,1|2,0,0]=4 4748 B13R1.19 COCC(=O)Nc1ccc(cc1)Br Amb1884869 [0,1,0,0,0,1|2,0,0]=4 4749 B13R1.19 COCC(=O)Nc1ccc(cc1)Cl Amb1775119 [0,1,0,0,0,1|2,0,0]=4 4750 B13R1.19 COCC(=O)Nc1ccc(cc1)N Amb1118735 [0,1,0,0,0,1|2,0,0]=4 4751 B13R1.19 COCC(=O)Nc1ccc(cc1)N Amb13949207 [0,1,0,0,0,1|2,0,0]=4 4752 B13R1.19 CONC(=O)Cc1ccc(I)cc1 Amb24592331 [0,1,0,0,0,1|2,0,0]=4 4753 B13R1.19 CONC(=O)Cc1ccc(cc1)Br Amb16072995 [0,1,0,0,0,1|2,0,0]=4 4754 B13R1.19 CONC(=O)Cc1ccc(cc1)Cl Amb16969926 [0,1,0,0,0,1|2,0,0]=4 4755 B13R1.19 CONC(=O)Cc1ccc(cc1)F Amb16969925 [0,1,0,0,0,1|2,0,0]=4 4756 B13R1.19 CONC(=O)Nc1ccc(cc1)Cl Amb16980467 [0,1,0,0,0,1|2,0,0]=4 4757 B13R1.19 CSCC(=O)Nc1ccc(F)cc1 Amb24459101 [0,1,0,0,0,1|2,0,0]=4 4758 B13R1.19 CSCC(=O)Nc1ccc(N)cc1 Amb18971638 [0,1,0,0,0,1|2,0,0]=4 4759 B13R1.19 CSCC(=O)Nc1ccc(cc1)Cl Amb15701919 [0,1,0,0,0,1|2,0,0]=4 4760 B13R1.19 CSCC(=O)Oc1ccc(Br)cc1 Amb20685496 [0,1,0,0,0,1|2,0,0]=4 4761 B13R1.19 C\C=C\C(=O)Cc1ccc(Br)cc1 Amb24367570 [0,1,0,0,0,1|1,0,1]=4 4762 B13R1.19 C\C=C\C(=O)Cc1ccc(Cl)cc1 Amb25704097 [0,1,0,0,0,1|1,0,1]=4 4763 B13R1.19 C\C=C\C(=O)Cc1ccc(F)cc1 Amb25728225 [0,1,0,0,0,1|1,0,1]=4 4764 B13R1.19 C\C=C\C(=O)Nc1ccc(Cl)cc1 Amb22478485 [0,1,0,0,0,1|1,0,1]=4 4765 B13R1.19 C\C=C\C(=O)Nc1ccc(N)cc1 Amb24375849 [0,1,0,0,0,1|1,0,1]=4 4766 B13R1.19 C\C=C\C(=O)Nc1ccc(O)cc1 Amb25156905 [0,1,0,0,0,1|1,0,1]=4 4767 B13R1.19 C\C=C\C(=O)Oc1ccc(Br)cc1 Amb25356972 [0,1,0,0,0,1|1,0,1]=4 4768 B13R1.19 C\C=C\C(=O)Oc1ccc(F)cc1 Amb24703921 [0,1,0,0,0,1|1,0,1]=4 4769 B13R1.19 C\C=C\C(=O)Oc1ccc(I)cc1 Amb24732795 [0,1,0,0,0,1|1,0,1]=4 4770 B13R1.19 Cc1[n]cc(c[n]1)NC(=O)OCC Amb25135983 [0,1,0,0,0,1|2,0,0]=4 4771 B13R1.19 Cc1ccc(CC(=N)NCC)cc1 Amb25854695 [0,1,0,0,0,1|2,0,0]=4 4772 B13R1.19 Cc1ccc(CC(=N)OCC)cc1 Amb20673135 [0,1,0,0,0,1|1,0,0]=3 4773 B13R1.19 Cc1ccc(CC(=O)OCC)c[n]1 Amb22899586 [0,1,0,0,0,1|1,0,0]=3 4774 B13R1.19 Cc1ccc(c[n]1)NC(=O)NCC Amb25853382 [0,1,0,0,0,1|2,0,0]=4 4775 B13R1.19 Cc1ccc(c[n]1)NC(=O)OCC Amb24103504 [0,1,0,0,0,1|1,0,0]=3 4776 B13R1.19 Cc1ccc(cc1)NC(=N)CCC Amb24689739 [0,1,0,0,0,1|2,0,0]=4 4777 B13R1.19 Cc1ccc(cc1)NC(=N)NCC Amb18804672 [0,1,0,0,0,1|2,0,0]=4 4778 B13R1.19 Cc1ccc(cc1)NC(=N)SCC Amb25683372 [0,1,0,0,0,1|1,1,0]=4 4779 B13R1.19 Cc1ccc(cc1)NC(=O)NCO Amb25054096 [0,1,0,0,0,1|2,0,0]=4 4780 B13R1.19 Cc1ccc(cc1)NC(=O)SCC Amb24383156 [0,1,0,0,0,1|0,1,0]=3 4781 B13R1.19 Cc1ccc(cc1)NC(=O)\C=C\C Amb22366072 [0,1,0,0,0,1|1,0,1]=4 4782 B13R1.19 Cc1ccc(cc1)NC(=S)CCC Amb24724786 [0,1,0,0,0,1|1,1,0]=4 4783 B13R1.19 Cc1ccc(cc1)NC(=S)OCC Amb24308972 [0,1,0,0,0,1|0,1,0]=3 4784 B13R1.19 Cc1ccc(cc1)OC(=O)C#CC Amb25832612 [0,1,0,0,0,1|1,0,1]=4 4785 B13R1.19 Cc1ccc(cc1)OC(=O)NCC Amb22359936 [0,1,0,0,0,1|1,0,0]=3 4786 B13R1.19 Cc1ccc(cc1)OC(=O)\C=C\C Amb22734867 [0,1,0,0,0,1|1,0,1]=4 4787 B13R1.19 Cc1ccc(cc1)SC(=O)NCC Amb24585739 [0,1,0,0,0,1|1,0,0]=3 4788 B13R1.19 Cc1ccc(cc1)SC(=S)NCC Amb25804596 [0,1,0,0,0,1|1,1,0]=4 4789 B13R1.19 ClCCC(=O)Nc1ccc(cc1)Cl Amb1130646 [0,1,0,0,0,1|2,0,0]=4 4790 B13R1.19 ClCCC(=O)Nc1ccc(cc1)F Amb1134991 [0,1,0,0,0,1|2,0,0]=4 4791 B13R1.19 NCCC(=O)Nc1ccc(cc1)Br Amb10609613 [0,1,0,0,0,1|2,0,0]=4 4792 B13R1.19 NCCC(=O)Nc1ccc(cc1)C Amb1132101 [0,1,0,0,0,1|2,0,0]=4 4793 B13R1.19 NCCC(=O)Nc1ccc(cc1)C Amb13949218 [0,1,0,0,0,1|2,0,0]=4 4794 B13R1.19 NCCC(=O)Nc1ccc(cc1)Cl Amb15740945 [0,1,0,0,0,1|2,0,0]=4 4795 B13R1.19 NCCC(=O)Nc1ccc(cc1)F Amb1137438 [0,1,0,0,0,1|2,0,0]=4 4796 B13R1.19 NCCC(=O)Nc1ccc(cc1)F Amb17622065 [0,1,0,0,0,1|2,0,0]=4 4797 B13R1.19 NCCC(=O)Oc1ccc(cc1)Br Amb17349677 [0,1,0,0,0,1|2,0,0]=4 4798 B13R1.19 NCCC(=O)Oc1ccc(cc1)C Amb17335316 [0,1,0,0,0,1|2,0,0]=4 4799 B13R1.19 NCCC(=O)Oc1ccc(cc1)Cl Amb17337486 [0,1,0,0,0,1|2,0,0]=4 4800 B13R1.19 NCCC(=O)Oc1ccc(cc1)F Amb17335605 [0,1,0,0,0,1|2,0,0]=4 4801 B13R1.19 Nc1ccc(cc1)NC(=O)CCN Amb24717984 [0,1,0,0,0,1|2,0,0]=4 4802 B13R1.19 O=C(CCBr)Nc1ccc(I)cc1 Amb25778088 [0,1,0,0,0,1|2,0,0]=4 4803 B13R1.19 O=C(CCCl)Oc1ccc(Cl)cc1 Amb22499422 [0,1,0,0,0,1|2,0,0]=4 4804 B13R1.19 O=C(NCS)Oc1ccc(F)cc1 Amb25752655 [0,1,0,0,0,1|2,0,0]=4 4805 B13R1.19 OCCC(=O)Nc1ccc(cc1)Br Amb17349664 [0,1,0,0,0,1|2,0,0]=4 4806 B13R1.19 OCCC(=O)Nc1ccc(cc1)Cl Amb17337474 [0,1,0,0,0,1|2,0,0]=4 4807 B13R1.19 OCCC(=O)Nc1ccc(cc1)F Amb17335594 [0,1,0,0,0,1|2,0,0]=4 4808 B13R1.19 OCNC(=O)Nc1ccc(Cl)cc1 Amb25249714 [0,1,0,0,0,1|2,0,0]=4 4809 B13R1.19 Oc1ccc(cc1)NC(=O)CCS Amb25854965 [0,1,0,0,0,1|2,0,0]=4 4810 B13R1.19 SCCC(=O)Nc1ccc(cc1)Br Amb17305728 [0,1,0,0,0,1|2,0,0]=4 4811 B13R1.19 SCCC(=O)Nc1ccc(cc1)Cl Amb17305726 [0,1,0,0,0,1|2,0,0]=4 4812 B13R1.19 SCCC(=O)Nc1ccc(cc1)F Amb17305727 [0,1,0,0,0,1|2,0,0]=4 4813 B13R1.20 BrCCC(=O)Nc1cccc(c1)Cl Amb17328448 [0,1,0,0,0,1|2,0,0]=4 4814 B13R1.20 BrCCC(=O)Nc1cccc(c1)F Amb17323635 [0,1,0,0,0,1|2,0,0]=4 4815 B13R1.20 BrCCC(=O)Nc1cccc(c1)O Amb17324280 [0,1,0,0,0,1|2,0,0]=4 4816 B13R1.20 CC#CC(=O)Nc1cc(Cl)ccc1 Amb22462111 [0,1,0,0,0,1|1,0,1]=4 4817 B13R1.20 CC#CC(=O)Nc1cc(F)ccc1 Amb24583999 [0,1,0,0,0,1|1,0,1]=4 4818 B13R1.20 CC#CC(=O)Nc1cc(I)ccc1 Amb24460603 [0,1,0,0,0,1|1,0,1]=4 4819 B13R1.20 CC#CC(=O)Nc1cc(O)ccc1 Amb24645586 [0,1,0,0,0,1|1,0,1]=4 4820 B13R1.20 CC#CC(=O)Oc1cc(Br)ccc1 Amb24393733 [0,1,0,0,0,1|1,0,1]=4 4821 B13R1.20 CCCC(=N)Nc1cc(Cl)ccc1 Amb25370911 [0,1,0,0,0,1|2,0,0]=4 4822 B13R1.20 CCCC(=N)Nc1cc(F)ccc1 Amb25834503 [0,1,0,0,0,1|2,0,0]=4 4823 B13R1.20 CCCC(=N)Nc1cc(I)ccc1 Amb25319141 [0,1,0,0,0,1|2,0,0]=4 4824 B13R1.20 CCCC(=O)Cc1cccc(c1)C Amb17138796 [0,1,0,0,0,1|1,0,0]=3 4825 B13R1.20 CCCC(=O)Cc1cccc(c1)Cl Amb17139627 [0,1,0,0,0,1|1,0,0]=3 4826 B13R1.20 CCCC(=O)Cc1cccc(c1)F Amb17138962 [0,1,0,0,0,1|1,0,0]=3 4827 B13R1.20 CCCC(=O)Nc1cc(Cl)cc[n]1 Amb25308762 [0,1,0,0,0,1|2,0,0]=4 4828 B13R1.20 CCCC(=O)Nc1cc(F)c[n]c1 Amb24692387 [0,1,0,0,0,1|2,0,0]=4 4829 B13R1.20 CCCC(=O)Nc1cccc(N)[n]1 Amb24692877 [0,1,0,0,0,1|2,0,0]=4 4830 B13R1.20 CCCC(=O)Nc1cccc(c1)N Amb10609260 [0,1,0,0,0,1|1,0,0]=3 4831 B13R1.20 CCCC(=O)Nc1cccc(c1)N Amb1798141 [0,1,0,0,0,1|1,0,0]=3 4832 B13R1.20 CCCS(=O)Nc1cc(Br)ccc1 Amb25177338 [0,1,0,0,0,1|2,0,0]=4 4833 B13R1.20 CCCS(=O)Nc1cc(N)ccc1 Amb25272905 [0,1,0,0,0,1|2,0,0]=4 4834 B13R1.20 CCCS(=O)Nc1cc(O)ccc1 Amb25177266 [0,1,0,0,0,1|2,0,0]=4 4835 B13R1.20 CCNC(=N)Cc1cc(Br)ccc1 Amb25057852 [0,1,0,0,0,1|2,0,0]=4 4836 B13R1.20 CCNC(=N)Cc1cc(F)ccc1 Amb24465561 [0,1,0,0,0,1|2,0,0]=4 4837 B13R1.20 CCNC(=N)Nc1cc(Cl)ccc1 Amb18325455 [0,1,0,0,0,1|2,0,0]=4 4838 B13R1.20 CCNC(=N)Nc1cc(F)ccc1 Amb18185013 [0,1,0,0,0,1|2,0,0]=4 4839 B13R1.20 CCNC(=N)Nc1cc(I)ccc1 Amb25190024 [0,1,0,0,0,1|2,0,0]=4 4840 B13R1.20 CCNC(=O)Cc1cc(Br)ccc1 Amb23111024 [0,1,0,0,0,1|1,0,0]=3 4841 B13R1.20 CCNC(=O)Cc1cc(Cl)ccc1 Amb23086727 [0,1,0,0,0,1|1,0,0]=3 4842 B13R1.20 CCNC(=O)Cc1cc(I)ccc1 Amb25832331 [0,1,0,0,0,1|1,0,0]=3 4843 B13R1.20 CCNC(=O)Cc1cc(O)ccc1 Amb18178662 [0,1,0,0,0,1|1,0,0]=3 4844 B13R1.20 CCNC(=O)Nc1cc(Br)[n]cc1 Amb24411741 [0,1,0,0,0,1|2,0,0]=4 4845 B13R1.20 CCNC(=O)Nc1cccc(F)[n]1 Amb24556715 [0,1,0,0,0,1|2,0,0]=4 4846 B13R1.20 CCNC(=O)Nc1cccc(c1)C Amb1233666 [0,1,0,0,0,1|1,0,0]=3 4847 B13R1.20 CCNC(=O)Nc1cccc(c1)Cl Amb1234227 [0,1,0,0,0,1|1,0,0]=3 4848 B13R1.20 CCNC(=O)Oc1cccc(Br)c1 Amb25057413 [0,1,0,0,0,1|1,0,0]=3 4849 B13R1.20 CCNC(=O)Oc1cccc(Cl)c1 Amb25802684 [0,1,0,0,0,1|1,0,0]=3 4850 B13R1.20 CCNC(=S)Nc1cc(F)ccc1 Amb23151503 [0,1,0,0,0,1|1,1,0]=4 4851 B13R1.20 CCNC(=S)Nc1cc(I)ccc1 Amb25730691 [0,1,0,0,0,1|1,1,0]=4 4852 B13R1.20 CCNC(=S)Nc1cccc(c1)C Amb2459582 [0,1,0,0,0,1|1,1,0]=4 4853 B13R1.20 CCOC(=N)Cc1cc(Cl)ccc1 Amb20673155 [0,1,0,0,0,1|1,0,0]=3 4854 B13R1.20 CCOC(=O)Cc1c[n]cc(Cl)[n]1 Amb24087729 [0,1,0,0,0,1|2,0,0]=4 4855 B13R1.20 CCOC(=O)Cc1c[n]cc(N)[n]1 Amb24087728 [0,1,0,0,0,1|2,0,0]=4 4856 B13R1.20 CCOC(=O)Cc1cc(Br)c[n]c1 Amb21857707 [0,1,0,0,0,1|1,0,0]=3 4857 B13R1.20 CCOC(=O)Cc1cc(F)c[n]c1 Amb19068169 [0,1,0,0,0,1|1,0,0]=3 4858 B13R1.20 CCOC(=O)Cc1cc(I)ccc1 Amb23402106 [0,1,0,0,0,1|0,0,0]=2 4859 B13R1.20 CCOC(=O)Cc1cc[n]c(N)[n]1 Amb22899362 [0,1,0,0,0,1|2,0,0]=4 4860 B13R1.20 CCOC(=O)Cc1ccc[n+](c1)[O-] Amb10553693 [0,1,0,0,0,1|1,0,0]=3 4861 B13R1.20 CCOC(=O)Cc1cccc(Br)[n]1 Amb22001965 [0,1,0,0,0,1|1,0,0]=3 4862 B13R1.20 CCOC(=O)Cc1cccc(Cl)[n]1 Amb22490590 [0,1,0,0,0,1|1,0,0]=3 4863 B13R1.20 CCOC(=O)Cc1cccc(c1)Br Amb17349305 [0,1,0,0,0,1|0,0,0]=2 4864 B13R1.20 CCOC(=O)Cc1cccc(c1)O Amb17614082 [0,1,0,0,0,1|0,0,0]=2 4865 B13R1.20 CCOC(=O)Cc1cccc(n1)C Amb15692898 [0,1,0,0,0,1|1,0,0]=3 4866 B13R1.20 CCOC(=O)Nc1[n]c(O)cc[n]1 Amb18129188 [0,1,0,0,0,1|2,0,0]=4 4867 B13R1.20 CCOC(=O)Nc1c[n+]([O-])ccc1 Amb24310155 [0,1,0,0,0,1|1,0,0]=3 4868 B13R1.20 CCOC(=O)Nc1c[n]cc(Cl)c1 Amb24490168 [0,1,0,0,0,1|1,0,0]=3 4869 B13R1.20 CCOC(=O)Nc1cc(Cl)[n]c[n]1 Amb25160987 [0,1,0,0,0,1|2,0,0]=4 4870 B13R1.20 CCOC(=O)Nc1cc(N)[n]c[n]1 Amb25174311 [0,1,0,0,0,1|2,0,0]=4 4871 B13R1.20 CCOC(=O)Nc1cc[n]c(Br)c1 Amb24470608 [0,1,0,0,0,1|1,0,0]=3 4872 B13R1.20 CCOC(=O)Nc1cc[n]c(Cl)c1 Amb22462755 [0,1,0,0,0,1|1,0,0]=3 4873 B13R1.20 CCOC(=O)Nc1cc[n]c(N)c1 Amb24737296 [0,1,0,0,0,1|1,0,0]=3 4874 B13R1.20 CCOC(=O)Nc1cc[n]c(O)[n]1 Amb18129187 [0,1,0,0,0,1|2,0,0]=4 4875 B13R1.20 CCOC(=O)Nc1ccc[n+](c1)C Amb10553788 [0,1,0,0,0,1|1,0,0]=3 4876 B13R1.20 CCOC(=O)Nc1cccc(F)[n]1 Amb24330398 [0,1,0,0,0,1|1,0,0]=3 4877 B13R1.20 CCOC(=O)Nc1cccc(F)c1 Amb17786024 [0,1,0,0,0,1|0,0,0]=2 4878 B13R1.20 CCOC(=O)Nc1cccc(I)c1 Amb24400790 [0,1,0,0,0,1|0,0,0]=2 4879 B13R1.20 CCOC(=O)Nc1cccc(c1)N Amb13949212 [0,1,0,0,0,1|0,0,0]=2 4880 B13R1.20 CCOC(=O)Nc1cccc(n1)C Amb10553731 [0,1,0,0,0,1|1,0,0]=3 4881 B13R1.20 CCOC(=O)Nc1nccc(c1)C Amb10553730 [0,1,0,0,0,1|1,0,0]=3 4882 B13R1.20 CCSC(=N)Nc1cccc(Cl)c1 Amb25229939 [0,1,0,0,0,1|1,1,0]=4 4883 B13R1.20 CCSC(=O)Nc1cccc(O)c1 Amb24724710 [0,1,0,0,0,1|0,1,0]=3 4884 B13R1.20 CNCC(=O)Nc1cc(O)ccc1 Amb18290512 [0,1,0,0,0,1|2,0,0]=4 4885 B13R1.20 CNCC(=O)Nc1cccc(c1)F Amb2277698 [0,1,0,0,0,1|2,0,0]=4 4886 B13R1.20 CNCC(=O)Nc1cccc(c1)F Amb2370682 [0,1,0,0,0,1|2,0,0]=4 4887 B13R1.20 CNNC(=O)Nc1cc(F)ccc1 Amb25695436 [0,1,0,0,0,1|2,0,0]=4 4888 B13R1.20 COCC(=O)Nc1cccc(c1)I Amb1882946 [0,1,0,0,0,1|2,0,0]=4 4889 B13R1.20 COCC(=O)Nc1cccc(c1)N Amb1112513 [0,1,0,0,0,1|2,0,0]=4 4890 B13R1.20 COCC(=O)Nc1cccc(c1)N Amb17622107 [0,1,0,0,0,1|2,0,0]=4 4891 B13R1.20 CONC(=O)Cc1cccc(I)c1 Amb24363298 [0,1,0,0,0,1|2,0,0]=4 4892 B13R1.20 CONC(=O)Cc1cccc(O)c1 Amb25060914 [0,1,0,0,0,1|2,0,0]=4 4893 B13R1.20 CONC(=O)Cc1cccc(c1)F Amb10704852 [0,1,0,0,0,1|2,0,0]=4 4894 B13R1.20 CONC(=O)Nc1cc(Br)ccc1 Amb24719165 [0,1,0,0,0,1|2,0,0]=4 4895 B13R1.20 CONC(=O)Nc1cccc(c1)Cl Amb16969938 [0,1,0,0,0,1|2,0,0]=4 4896 B13R1.20 CSCC(=O)Nc1cccc(F)c1 Amb19382420 [0,1,0,0,0,1|2,0,0]=4 4897 B13R1.20 CSCC(=O)Nc1cccc(N)c1 Amb18971630 [0,1,0,0,0,1|2,0,0]=4 4898 B13R1.20 CSCC(=O)Nc1cccc(c1)Cl Amb15701918 [0,1,0,0,0,1|2,0,0]=4 4899 B13R1.20 C\C=C\C(=O)Cc1cccc(Cl)c1 Amb24496476 [0,1,0,0,0,1|1,0,1]=4 4900 B13R1.20 C\C=C\C(=O)Cc1cccc(F)c1 Amb24496477 [0,1,0,0,0,1|1,0,1]=4 4901 B13R1.20 C\C=C\C(=O)Oc1cccc(F)c1 Amb24393532 [0,1,0,0,0,1|1,0,1]=4 4902 B13R1.20 C\C=C\C(=O)Oc1cccc(I)c1 Amb24703922 [0,1,0,0,0,1|1,0,1]=4 4903 B13R1.20 C\C=C\C(=O)Oc1cccc(O)c1 Amb24745741 [0,1,0,0,0,1|1,0,1]=4 4904 B13R1.20 Cc1[n]c(cc[n]1)NC(=O)OCC Amb24530142 [0,1,0,0,0,1|2,0,0]=4 4905 B13R1.20 Cc1c[n]cc(CC(=O)NCC)c1 Amb25846053 [0,1,0,0,0,1|2,0,0]=4 4906 B13R1.20 Cc1c[n]cc(c1)NC(=O)NCC Amb24692381 [0,1,0,0,0,1|2,0,0]=4 4907 B13R1.20 Cc1cc(CC(=N)OCC)ccc1 Amb20673148 [0,1,0,0,0,1|1,0,0]=3 4908 B13R1.20 Cc1cc(cc[n]1)NC(=O)NCC Amb24473555 [0,1,0,0,0,1|2,0,0]=4 4909 B13R1.20 Cc1cc(cc[n]1)NC(=O)OCC Amb24721987 [0,1,0,0,0,1|1,0,0]=3 4910 B13R1.20 Cc1cc(ccc1)NC(=N)CCC Amb25817535 [0,1,0,0,0,1|2,0,0]=4 4911 B13R1.20 Cc1cc(ccc1)NC(=N)NCC Amb18804673 [0,1,0,0,0,1|2,0,0]=4 4912 B13R1.20 Cc1cc(ccc1)NC(=O)CCBr Amb19748477 [0,1,0,0,0,1|2,0,0]=4 4913 B13R1.20 Cc1cc(ccc1)NC(=O)CNC Amb21959010 [0,1,0,0,0,1|2,0,0]=4 4914 B13R1.20 Cc1cc(ccc1)NC(=O)NNC Amb24374004 [0,1,0,0,0,1|2,0,0]=4 4915 B13R1.20 Cc1cc(ccc1)NC(=O)ON=C Amb24631799 [0,1,0,0,0,1|1,0,1]=4 4916 B13R1.20 Cc1cc(ccc1)NC(=S)CCC Amb25034558 [0,1,0,0,0,1|1,1,0]=4 4917 B13R1.20 Cc1cc(ccc1)NC(=S)OCC Amb24308973 [0,1,0,0,0,1|0,1,0]=3 4918 B13R1.20 Cc1cc(ccc1)OC(=O)CCC Amb24063564 [0,1,0,0,0,1|1,0,0]=3 4919 B13R1.20 Cc1cc(ccc1)OC(=O)NCC Amb24490235 [0,1,0,0,0,1|1,0,0]=3 4920 B13R1.20 Cc1cc(ccc1)OC(=O)NCO Amb25082891 [0,1,0,0,0,1|2,0,0]=4 4921 B13R1.20 Cc1cc(ccc1)OC(=O)\C=C\C Amb25787919 [0,1,0,0,0,1|1,0,1]=4 4922 B13R1.20 Cc1cc(ccc1)SC(=O)NCC Amb22486823 [0,1,0,0,0,1|1,0,0]=3 4923 B13R1.20 Cc1cc(ccc1)SC(=S)NCC Amb24663129 [0,1,0,0,0,1|1,1,0]=4 4924 B13R1.20 Cc1cc[n]c(c1)NC(=S)OCC Amb25766405 [0,1,0,0,0,1|1,1,0]=4 4925 B13R1.20 Cc1cccc(CC(=O)OCC)[n]1 Amb24081752 [0,1,0,0,0,1|1,0,0]=3 4926 B13R1.20 Cc1cccc(NC(=O)NCC)[n]1 Amb24089805 [0,1,0,0,0,1|2,0,0]=4 4927 B13R1.20 ClCCC(=O)Nc1cccc(c1)Br Amb1126487 [0,1,0,0,0,1|2,0,0]=4 4928 B13R1.20 ClCCC(=O)Nc1cccc(c1)C Amb1126815 [0,1,0,0,0,1|2,0,0]=4 4929 B13R1.20 ClCCC(=O)Nc1cccc(c1)O Amb10608630 [0,1,0,0,0,1|2,0,0]=4 4930 B13R1.20 NCCC(=O)Nc1cc(O)ccc1 Amb18290511 [0,1,0,0,0,1|2,0,0]=4 4931 B13R1.20 NCCC(=O)Nc1cccc(c1)C Amb1138768 [0,1,0,0,0,1|2,0,0]=4 4932 B13R1.20 NCCC(=O)Nc1cccc(c1)C Amb17622066 [0,1,0,0,0,1|2,0,0]=4 4933 B13R1.20 NCCC(=O)Nc1cccc(c1)Cl Amb15740944 [0,1,0,0,0,1|2,0,0]=4 4934 B13R1.20 NCCC(=O)Nc1cccc(c1)F Amb1102412 [0,1,0,0,0,1|2,0,0]=4 4935 B13R1.20 NCCC(=O)Nc1cccc(c1)F Amb13949209 [0,1,0,0,0,1|2,0,0]=4 4936 B13R1.20 NCCC(=O)Oc1cccc(c1)Br Amb17349675 [0,1,0,0,0,1|2,0,0]=4 4937 B13R1.20 NCCC(=O)Oc1cccc(c1)C Amb17335314 [0,1,0,0,0,1|2,0,0]=4 4938 B13R1.20 NCCC(=O)Oc1cccc(c1)Cl Amb17337484 [0,1,0,0,0,1|2,0,0]=4 4939 B13R1.20 NCCC(=O)Oc1cccc(c1)F Amb17335603 [0,1,0,0,0,1|2,0,0]=4 4940 B13R1.20 O=C(CCBr)Nc1cc(Br)ccc1 Amb25364215 [0,1,0,0,0,1|2,0,0]=4 4941 B13R1.20 O=C(CCS)Nc1cc(I)ccc1 Amb24603317 [0,1,0,0,0,1|2,0,0]=4 4942 B13R1.20 OCCC(=O)Nc1cccc(c1)Br Amb17349666 [0,1,0,0,0,1|2,0,0]=4 4943 B13R1.20 OCCC(=O)Nc1cccc(c1)C Amb17335301 [0,1,0,0,0,1|2,0,0]=4 4944 B13R1.20 SCCC(=O)Nc1cccc(c1)C Amb17305730 [0,1,0,0,0,1|2,0,0]=4 4945 B13R1.44 C#CCNC(=O)Cc1ccccc1 Amb18185767 [0,1,0,0,0,1|1,0,1]=4 4946 B13R1.44 C#CCNC(=O)Oc1ccccc1 Amb18808641 [0,1,0,0,0,1|1,0,1]=4 4947 B13R1.44 C#CCOC(=O)Nc1ccccc1 Amb2505044 [0,1,0,0,0,1|0,0,1]=3 4948 B13R1.44 C=CCCC(=O)Nc1ccccc1 Amb20655805 [0,1,0,0,0,1|1,0,1]=4 4949 B13R1.44 C=CCNC(=O)Nc1ccccc1 Amb1233611 [0,1,0,0,0,1|1,0,1]=4 4950 B13R1.44 C=CCOC(=O)Cc1ccccc1 Amb22230218 [0,1,0,0,0,1|0,0,1]=3 4951 B13R1.44 C=CCOC(=O)Nc1ccc[n]c1 Amb25854033 [0,1,0,0,0,1|1,0,1]=4 4952 B13R1.44 C=CCOC(=O)Nc1cccc[n]1 Amb25721848 [0,1,0,0,0,1|1,0,1]=4 4953 B13R1.44 C=CCOC(=O)Nc1ccccc1 Amb24365247 [0,1,0,0,0,1|0,0,1]=3 4954 B13R1.44 C=CCOC(=O)Oc1ccccc1 Amb22360640 [0,1,0,0,0,1|0,0,1]=3 4955 B13R1.44 C=CCSC(=O)Nc1ccccc1 Amb24728386 [0,1,0,0,0,1|0,1,1]=4 4956 B13R1.44 CC#CCC(=O)Cc1ccccc1 Amb18183692 [0,1,0,0,0,1|1,0,1]=4 4957 B13R1.44 CCC#CC(=O)Cc1ccccc1 Amb25834345 [0,1,0,0,0,1|1,0,0]=3 4958 B13R1.44 CCCCC(=N)Nc1ccccc1 Amb25192472 [0,1,0,0,0,1|2,0,0]=4 4959 B13R1.44 CCCCC(=S)Nc1ccccc1 Amb25785161 [0,1,0,0,0,1|1,1,0]=4 4960 B13R1.44 CCCNC(=N)Nc1ccccc1 Amb18184209 [0,1,0,0,0,1|2,0,0]=4 4961 B13R1.44 CCCNC(=O)Nc1c[n]ccc1 Amb23263124 [0,1,0,0,0,1|2,0,0]=4 4962 B13R1.44 CCCNC(=O)Nc1ccccc1 Amb1233730 [0,1,0,0,0,1|1,0,0]=3 4963 B13R1.44 CCCNC(=S)Nc1ccccc1 Amb2458951 [0,1,0,0,0,1|1,1,0]=4 4964 B13R1.44 CCCOC(=O)Nc1c[n]c[n]c1 Amb25246032 [0,1,0,0,0,1|2,0,0]=4 4965 B13R1.44 CCCOC(=O)Nc1c[n]ccc1 Amb25237614 [0,1,0,0,0,1|1,0,0]=3 4966 B13R1.44 CCCOC(=O)Nc1cc[n]cc1 Amb25334198 [0,1,0,0,0,1|1,0,0]=3 4967 B13R1.44 CCCOC(=S)Nc1cccc[n]1 Amb24096831 [0,1,0,0,0,1|1,1,0]=4 4968 B13R1.44 CCC\N=C(\N)/Cc1ccccc1 Amb23569054 [0,1,0,0,0,1|2,0,0]=4 4969 B13R1.44 CCNCC(=O)Nc1cc[n]cc1 Amb18809185 [0,1,0,0,0,1|2,0,0]=4 4970 B13R1.44 CCNCC(=O)Nc1ccc[n]c1 Amb18809184 [0,1,0,0,0,1|2,0,0]=4 4971 B13R1.44 CCNCC(=O)Nc1cccc[n]1 Amb18186353 [0,1,0,0,0,1|2,0,0]=4 4972 B13R1.44 CCNNC(=S)Nc1ccccc1 Amb25276309 [0,1,0,0,0,1|1,1,0]=4 4973 B13R1.44 CCOCC(=O)Cc1cccc[n]1 Amb22754014 [0,1,0,0,0,1|1,0,0]=3 4974 B13R1.44 CCOCC(=O)Nc1c[n]c[n]c1 Amb25780829 [0,1,0,0,0,1|2,0,0]=4 4975 B13R1.44 CCOCC(=O)Nc1c[n]cc[n]1 Amb24614073 [0,1,0,0,0,1|2,0,0]=4 4976 B13R1.44 CCOCC(=O)Nc1ccc[n][n]1 Amb24372648 [0,1,0,0,0,1|2,0,0]=4 4977 B13R1.44 CCONC(=N)Nc1ccccc1 Amb25804276 [0,1,0,0,0,1|1,0,0]=3 4978 B13R1.44 CCONC(=O)Nc1c[n]ccc1 Amb24422225 [0,1,0,0,0,1|1,0,0]=3 4979 B13R1.44 CCONC(=S)Nc1c[n]ccc1 Amb25847669 [0,1,0,0,0,1|1,1,0]=4 4980 B13R1.44 CCONC(=S)Nc1ccccc1 Amb25733078 [0,1,0,0,0,1|0,1,0]=3 4981 B13R1.44 CCSSC(=O)Nc1ccccc1 Amb25289236 [0,1,0,0,0,1|0,1,0]=3 4982 B13R1.44 CNCCC(=O)Nc1c[n]ccc1 Amb18184496 [0,1,0,0,0,1|2,0,0]=4 4983 B13R1.44 CNCCC(=O)Nc1c[n]ccc1 Amb22014620 [0,1,0,0,0,1|2,0,0]=4 4984 B13R1.44 CNCCC(=O)Nc1cc[n]cc1 Amb18804877 [0,1,0,0,0,1|2,0,0]=4 4985 B13R1.44 CNCCC(=O)Nc1cccc[n]1 Amb18184495 [0,1,0,0,0,1|2,0,0]=4 4986 B13R1.44 CNCCC(=O)Nc1ccccc1 Amb15740952 [0,1,0,0,0,1|1,0,0]=3 4987 B13R1.44 COCCC(=O)Nc1cc[n]cc1 Amb25807306 [0,1,0,0,0,1|2,0,0]=4 4988 B13R1.44 COCCC(=O)Nc1ccc[n]c1 Amb25370207 [0,1,0,0,0,1|2,0,0]=4 4989 B13R1.44 COCCC(=O)Nc1cccc[n]1 Amb24510311 [0,1,0,0,0,1|2,0,0]=4 4990 B13R1.44 COCCC(=O)Nc1ccccc1 Amb24493758 [0,1,0,0,0,1|1,0,0]=3 4991 B13R1.44 COCNC(=O)Nc1cc[n]cc1 Amb24640396 [0,1,0,0,0,1|2,0,0]=4 4992 B13R1.44 COCNC(=S)Nc1ccccc1 Amb25223180 [0,1,0,0,0,1|1,1,0]=4 4993 B13R1.44 CONCC(=O)Nc1ccccc1 Amb25039334 [0,1,0,0,0,1|2,0,0]=4 4994 B13R1.44 CSCNC(=O)Nc1ccccc1 Amb24741724 [0,1,0,0,0,1|1,0,0]=3 4995 B13R1.44 C\C=C\NC(=O)Nc1ccccc1 Amb24654984 [0,1,0,0,0,1|1,0,1]=4 4996 B13R1.44 C\C=N\NC(=O)Nc1ccccc1 Amb24417963 [0,1,0,0,0,1|1,0,1]=4 4997 B13R1.44 C\C=N\OC(=O)Nc1ccccc1 Amb24505322 [0,1,0,0,0,1|0,0,1]=3 4998 B13R1.44 C\N=C\NC(=O)Nc1ccccc1 Amb24728367 [0,1,0,0,0,1|1,0,1]=4 4999 B13R1.44 ClCCCC(=O)Nc1ccccc1 Amb1125144 [0,1,0,0,0,1|1,0,0]=3 5000 B13R1.44 ClCCCC(=O)Nc1ccccn1 Amb1140060 [0,1,0,0,0,1|2,0,0]=4 5001 B13R1.44 ClCCCC(=O)Nc1cccnc1 Amb1136391 [0,1,0,0,0,1|2,0,0]=4 5002 B13R1.44 ClCCCC(=O)Nc1ccncc1 Amb1124110 [0,1,0,0,0,1|2,0,0]=4 5003 B13R1.44 ClCCNC(=O)Cc1ccccc1 Amb2429404 [0,1,0,0,0,1|1,0,0]=3 5004 B13R1.44 ClCCOC(=O)Nc1cccnc1 Amb13952803 [0,1,0,0,0,1|1,0,0]=3 5005 B13R1.44 FCCNC(=S)Nc1ccccc1 Amb25780679 [0,1,0,0,0,1|1,1,0]=4 5006 B13R1.44 N#CCCC(=O)Nc1ccccc1 Amb17334976 [0,1,0,0,0,1|1,0,1]=4 5007 B13R1.44 N#CCCC(=O)Oc1ccccc1 Amb17335036 [0,1,0,0,0,1|1,0,1]=4 5008 B13R1.44 N#CCNC(=O)Oc1ccccc1 Amb18180566 [0,1,0,0,0,1|1,0,1]=4 5009 B13R1.44 N=C(Nc1ccccc1)NCCF Amb24369281 [0,1,0,0,0,1|2,0,0]=4 5010 B13R1.44 N=C(Nc1ccccc1)NCCO Amb18809195 [0,1,0,0,0,1|2,0,0]=4 5011 B13R1.44 N=C(Nc1ccccc1)NCCS Amb24695463 [0,1,0,0,0,1|2,0,0]=4 5012 B13R1.44 NCCCC(=O)Nc1cc[n]cc1 Amb19881194 [0,1,0,0,0,1|2,0,0]=4 5013 B13R1.44 NCCCC(=O)Nc1ccc[n]c1 Amb21895277 [0,1,0,0,0,1|2,0,0]=4 5014 B13R1.44 NCCCC(=O)Nc1ccccc1 Amb13952779 [0,1,0,0,0,1|1,0,0]=3 5015 B13R1.44 NCCNC(=N)Nc1ccccc1 Amb24375516 [0,1,0,0,0,1|2,0,0]=4 5016 B13R1.44 NCCNC(=O)Nc1cc[n]cc1 Amb18252551 [0,1,0,0,0,1|2,0,0]=4 5017 B13R1.44 NCCNC(=O)Nc1ccccc1 Amb10808639 [0,1,0,0,0,1|1,0,0]=3 5018 B13R1.44 NCCNC(=O)Nc1ccccc1 Amb15741119 [0,1,0,0,0,1|1,0,0]=3 5019 B13R1.44 NCCNC(=S)Nc1ccccc1 Amb1254362 [0,1,0,0,0,1|1,1,0]=4 5020 B13R1.44 NCCOC(=O)Nc1ccccc1 Amb25856964 [0,1,0,0,0,1|0,0,0]=2 5021 B13R1.44 NC\C=C\C(=O)Nc1ccccc1 Amb25697858 [0,1,0,0,0,1|1,0,1]=4 5022 B13R1.44 O=C(CCC=O)Nc1ccccc1 Amb25163545 [0,1,0,0,0,1|1,0,1]=4 5023 B13R1.44 O=C(CCCS)Nc1cccc[n]1 Amb24424958 [0,1,0,0,0,1|2,0,0]=4 5024 B13R1.44 O=C(CCCS)Nc1ccccc1 Amb25234554 [0,1,0,0,0,1|1,0,0]=3 5025 B13R1.44 O=C(Cc1ccccc1)OCCBr Amb24065428 [0,1,0,0,0,1|0,0,0]=2 5026 B13R1.44 O=C(Cc1ccccc1)OCCCl Amb24065572 [0,1,0,0,0,1|0,0,0]=2 5027 B13R1.44 O=C(NCCF)Oc1ccccc1 Amb24096857 [0,1,0,0,0,1|1,0,0]=3 5028 B13R1.44 O=C(Nc1cc[n]cc1)OCCF Amb25685862 [0,1,0,0,0,1|1,0,0]=3 5029 B13R1.44 O=C(Nc1ccc[n]c1)OCCF Amb25694770 [0,1,0,0,0,1|1,0,0]=3 5030 B13R1.44 O=C(Nc1ccccc1)NCCF Amb25289085 [0,1,0,0,0,1|1,0,0]=3 5031 B13R1.44 O=C(Nc1ccccc1)OCCBr Amb22346582 [0,1,0,0,0,1|0,0,0]=2 5032 B13R1.44 O=C(Nc1ccccc1)OCCCl Amb22369350 [0,1,0,0,0,1|0,0,0]=2 5033 B13R1.44 O=CCNC(=O)Cc1ccccc1 Amb17102089 [0,1,0,0,0,1|1,0,1]=4 5034 B13R1.44 OCC#CC(=O)Cc1ccccc1 Amb24584488 [0,1,0,0,0,1|1,0,1]=4 5035 B13R1.44 OCCCC(=O)Nc1ccccc1 Amb17233533 [0,1,0,0,0,1|1,0,0]=3 5036 B13R1.44 OCCNC(=O)Cc1ccccc1 Amb2437031 [0,1,0,0,0,1|1,0,0]=3 5037 B13R1.44 OCCNC(=O)Nc1c[n]ccc1 Amb24555049 [0,1,0,0,0,1|2,0,0]=4 5038 B13R1.44 OCCNC(=O)Nc1cc[n]cc1 Amb25079733 [0,1,0,0,0,1|2,0,0]=4 5039 B13R1.44 OCCOC(=O)Nc1c[n]ccc1 Amb24489996 [0,1,0,0,0,1|1,0,0]=3 5040 B13R1.44 OCCOC(=O)Nc1cc[n]cc1 Amb25100115 [0,1,0,0,0,1|1,0,0]=3 5041 B13R1.44 OCCSC(=O)Nc1ccccc1 Amb22466796 [0,1,0,0,0,1|0,1,0]=3 5042 B13R1.44 OC\C=C\C(=O)Nc1ccccc1 Amb24727001 [0,1,0,0,0,1|1,0,1]=4 5043 B13R1.47 BrCCC(=O)N(c1ccccc1)C Amb17324151 [0,1,0,0,0,1|2,0,0]=4 5044 B13R1.47 CCCC(=O)C(=O)c1ccccc1 Amb17594478 [0,1,0,0,0,1|1,0,0]=3 5045 B13R1.47 CCCC(=O)N(N)c1ccccc1 Amb24096809 [0,1,0,0,0,1|1,0,0]=3 5046 B13R1.47 CCNC(=O)C(=O)c1ccccc1 Amb17335165 [0,1,0,0,0,1|1,0,0]=3 5047 B13R1.47 CCNC(=O)C(Br)c1ccccc1 Amb24534740 [0,1,0,0,0,1|1,0,0]=3 5048 B13R1.47 CCNC(=O)C(C)c1ccccc1 Amb24490195 [0,1,0,0,0,1|1,0,0]=3 5049 B13R1.47 CCNC(=O)C(Cl)c1ccc[n]c1 Amb18332182 [0,1,0,0,0,1|2,0,0]=4 5050 B13R1.47 CCNC(=O)C(N)c1cc[n]cc1 Amb24361723 [0,1,0,0,0,1|2,0,0]=4 5051 B13R1.47 CCNC(=O)C(N)c1ccc[n]c1 Amb24623445 [0,1,0,0,0,1|2,0,0]=4 5052 B13R1.47 CCNC(=O)C(O)c1ccc[n]c1 Amb24347416 [0,1,0,0,0,1|2,0,0]=4 5053 B13R1.47 CCNC(=O)C(c1ccccc1)O Amb17400707 [0,1,0,0,0,1|1,0,0]=3 5054 B13R1.47 CCNC(=O)N(N)c1ccccc1 Amb24490460 [0,1,0,0,0,1|1,0,0]=3 5055 B13R1.47 CCNC(=O)[C@@H](O)c1ccccc1 Amb24358180 [0,1,0,0,0,1|1,0,0]=3 5056 B13R1.47 CCNC(=O)[C@H](C)c1ccccc1 Amb25780108 [0,1,0,0,0,1|1,0,0]=3 5057 B13R1.47 CCNC(=O)[C@H](O)c1ccccc1 Amb24468904 [0,1,0,0,0,1|1,0,0]=3 5058 B13R1.47 CCNC(=O)[C@H](c1ccccc1)N Amb17233443 [0,1,0,0,0,1|1,0,0]=3 5059 B13R1.47 CCNC(=S)N(N)c1ccccc1 Amb25072948 [0,1,0,0,0,1|1,1,0]=4 5060 B13R1.47 CCOC(=O)C(=C)c1ccccc1 Amb10602132 [0,1,0,0,0,1|0,0,0]=2 5061 B13R1.47 CCOC(=O)C(=O)c1c[n]ccc1 Amb19957923 [0,1,0,0,0,1|1,0,0]=3 5062 B13R1.47 CCOC(=O)C(=O)c1ccccc1 Amb1216483 [0,1,0,0,0,1|0,0,0]=2 5063 B13R1.47 CCOC(=O)C(Br)c1cc[n]cc1 Amb24309216 [0,1,0,0,0,1|1,0,0]=3 5064 B13R1.47 CCOC(=O)C(Br)c1cccc[n]1 Amb24066454 [0,1,0,0,0,1|1,0,0]=3 5065 B13R1.47 CCOC(=O)C(Cl)[N]1=CC=CC=C1 Amb17772423 [0,1,0,0,0,1|1,0,0]=3 5066 B13R1.47 CCOC(=O)C(N)c1c[n]cc[n]1 Amb23401467 [0,1,0,0,0,1|2,0,0]=4 5067 B13R1.47 CCOC(=O)C(N)c1ccc[n]c1 Amb19003474 [0,1,0,0,0,1|1,0,0]=3 5068 B13R1.47 CCOC(=O)C(N)c1ccc[n]c1 Amb23401703 [0,1,0,0,0,1|1,0,0]=3 5069 B13R1.47 CCOC(=O)C(N)c1ccccn1 Amb17935885 [0,1,0,0,0,1|1,0,0]=3 5070 B13R1.47 CCOC(=O)C(N)c1ccncc1 Amb17935886 [0,1,0,0,0,1|1,0,0]=3 5071 B13R1.47 CCOC(=O)C(O)c1ccc[n]c1 Amb18186776 [0,1,0,0,0,1|1,0,0]=3 5072 B13R1.47 CCOC(=O)C(O)c1ccc[n]c1 Amb19351688 [0,1,0,0,0,1|1,0,0]=3 5073 B13R1.47 CCOC(=O)C([n+]1ccccc1)C Amb10554473 [0,1,0,0,0,1|1,0,0]=3 5074 B13R1.47 CCOC(=O)C(c1ccccc1)Cl Amb1647396 [0,1,0,0,0,1|0,0,0]=2 5075 B13R1.47 CCOC(=O)C(c1ccccc1)[NH3+] Amb1865585 [0,1,0,0,0,1|0,0,0]=2 5076 B13R1.47 CCOC(=O)[C@@H](N)c1ccccc1 Amb17678824 [0,1,0,0,0,1|0,0,0]=2 5077 B13R1.47 CCOC(=O)[C@H](N)c1ccccc1 Amb19889826 [0,1,0,0,0,1|0,0,0]=2 5078 B13R1.47 CCOC(=O)[C@H](c1ccccc1)N Amb10844947 [0,1,0,0,0,1|0,0,0]=2 5079 B13R1.47 CC\C=C(/Cl)\C(=O)c1ccccc1 Amb24394890 [0,1,0,0,0,1|2,0,0]=4 5080 B13R1.47 CC\C=C(/F)\C(=O)c1ccccc1 Amb24584481 [0,1,0,0,0,1|2,0,0]=4 5081 B13R1.47 CN(C(=N)NCC)c1ccccc1 Amb18184208 [0,1,0,0,0,1|2,0,0]=4 5082 B13R1.47 CN(C(=O)NCC)c1ccc[n]c1 Amb24749572 [0,1,0,0,0,1|2,0,0]=4 5083 B13R1.47 CN(C(=O)NCC)c1cccc[n]1 Amb25153593 [0,1,0,0,0,1|2,0,0]=4 5084 B13R1.47 CN(C(=O)NCC)c1ccccc1 Amb25237616 [0,1,0,0,0,1|1,0,0]=3 5085 B13R1.47 CN(C(=O)OCC)c1cccc[n]1 Amb24095648 [0,1,0,0,0,1|1,0,0]=3 5086 B13R1.47 CONC(=O)C(O)c1ccccc1 Amb24739076 [0,1,0,0,0,1|2,0,0]=4 5087 B13R1.47 CONC(=O)[C@H](C)c1ccccc1 Amb24660692 [0,1,0,0,0,1|2,0,0]=4 5088 B13R1.47 CONC(=O)[C@H](O)c1ccccc1 Amb24335120 [0,1,0,0,0,1|2,0,0]=4 5089 B13R1.47 C\C(=C/CC)\C(O)c1ccccc1 Amb22546638 [0,1,0,0,0,1|2,0,0]=4 5090 B13R1.47 C\C=C\C(=O)C(=C)c1ccccc1 Amb25190287 [0,1,0,0,0,1|1,0,1]=4 5091 B13R1.47 C\C=C\C(=O)C(C)c1ccccc1 Amb24529691 [0,1,0,0,0,1|1,0,1]=4 5092 B13R1.47 C\C=C\C(=O)C(O)c1ccccc1 Amb25179529 [0,1,0,0,0,1|1,0,1]=4 5093 B13R1.47 C\C=C\C(=O)[C@@H](O)c1ccccc1 Amb24577753 [0,1,0,0,0,1|1,0,1]=4 5094 B13R1.47 ClCCC(=O)N(c1ccccc1)C Amb1141646 [0,1,0,0,0,1|2,0,0]=4 5095 B13R1.47 NCCC(=O)N(c1ccccc1)C Amb1134878 [0,1,0,0,0,1|2,0,0]=4 5096 B13R1.47 OCCC(=O)N(c1ccccc1)C Amb17335302 [0,1,0,0,0,1|2,0,0]=4 5097 B13R1.79 CCCC(Nc1ccccc1)=NN Amb18790856 [0,1,0,0,0,1|2,0,0]=4 5098 B13R1.79 CCCN(Cc1ccccc1)C=O Amb25251924 [0,1,0,0,0,1|2,0,0]=4 5099 B13R1.79 CCN\C(=N\c1ccccc1)\OC Amb25731849 [0,1,0,0,0,1|1,0,1]=4 5100 B13R1.79 CCN\C(\Cc1ccccc1)=N/N Amb18178429 [0,1,0,0,0,1|2,0,0]=4 5101 B13R1.79 CCN\C(\Nc1ccccc1)=N\N Amb24386394 [0,1,0,0,0,1|2,0,0]=4 5102 B13R1.79 CCOC(Nc1ccccc1)=S=O Amb24490202 [0,1,0,0,0,1|0,0,0]=2 5103 B13R1.79 CCO\C(=N\c1ccccc1)\S[Na] Amb22443641 [0,1,0,0,0,1|0,1,0]=3 5104 B13R1.79 CCO\C(\C=O)=C/c1ccccc1 Amb22546895 [0,1,0,0,0,1|0,0,0]=2 5105 B13R1.79 CCO\C(\NC)=N\c1ccccc1 Amb24374042 [0,1,0,0,0,1|1,0,0]=3 5106 B13R1.79 CSC\C(=C/c1ccccc1)\C=O Amb16232251 [0,1,0,0,0,1|2,0,0]=4 5107 B13R1.135 CC(CCl)C(=O)Nc1ccccc1 Amb18325437 [0,1,0,0,0,1|2,0,0]=4 5108 B13R1.135 CC(CN)C(=O)Nc1ccccc1 Amb18983419 [0,1,0,0,0,1|2,0,0]=4 5109 B13R1.135 CC=C(Br)C(=O)Nc1ccccc1 Amb22460381 [0,1,0,0,0,1|1,0,1]=4 5110 B13R1.135 CCC(=C)C(=O)Nc1ccccc1 Amb25207052 [0,1,0,0,0,1|1,0,0]=3 5111 B13R1.135 CCC(=C)C(=S)Nc1ccccc1 Amb25276320 [0,1,0,0,0,1|1,1,0]=4 5112 B13R1.135 CCC(=O)C(=O)Nc1ccccc1 Amb25770102 [0,1,0,0,0,1|1,0,0]=3 5113 B13R1.135 CCC(=O)\C(=C/c1ccccc1)\C Amb10565329 [0,1,0,0,0,1|2,0,0]=4 5114 B13R1.135 CCC(=O)\C(\F)=C\c1ccccc1 Amb25706957 [0,1,0,0,0,1|2,0,0]=4 5115 B13R1.135 CCC(Br)C(=O)Nc1cc[n]cc1 Amb25308738 [0,1,0,0,0,1|2,0,0]=4 5116 B13R1.135 CCC(C(=O)Nc1ccccc1)Br Amb10786674 [0,1,0,0,0,1|1,0,0]=3 5117 B13R1.135 CCC(C(=O)Nc1ccccc1)Cl Amb1676622 [0,1,0,0,0,1|1,0,0]=3 5118 B13R1.135 CCC(N)C(=O)Nc1cccc[n]1 Amb25109535 [0,1,0,0,0,1|2,0,0]=4 5119 B13R1.135 CCC(O)C(=O)Nc1cc[n]cc1 Amb25686819 [0,1,0,0,0,1|2,0,0]=4 5120 B13R1.135 CCC(O)C(=O)Nc1ccc[n]c1 Amb25740369 [0,1,0,0,0,1|2,0,0]=4 5121 B13R1.135 CCC(O)\C(\Cl)=C\c1ccccc1 Amb25045703 [0,1,0,0,0,1|2,0,0]=4 5122 B13R1.135 CCC(S)C(=O)Nc1ccc[n]c1 Amb24532135 [0,1,0,0,0,1|2,0,0]=4 5123 B13R1.135 CC[C@@H](N)C(=O)Nc1cc[n]cc1 Amb25155048 [0,1,0,0,0,1|2,0,0]=4 5124 B13R1.135 CC[C@@H](N)C(=O)Nc1ccc[n]c1 Amb25683938 [0,1,0,0,0,1|2,0,0]=4 5125 B13R1.135 CC[C@@H](N)C(=O)Nc1ccccc1 Amb25155001 [0,1,0,0,0,1|1,0,0]=3 5126 B13R1.135 CC[C@H](C)C(=O)Nc1ccccc1 Amb24598281 [0,1,0,0,0,1|1,0,0]=3 5127 B13R1.135 CC[C@H](N)C(=O)Nc1cc[n]cc1 Amb24558140 [0,1,0,0,0,1|2,0,0]=4 5128 B13R1.135 CC[C@H](N)C(=O)Nc1ccc[n]c1 Amb24520849 [0,1,0,0,0,1|2,0,0]=4 5129 B13R1.135 CC[C@H](O)\C(\Cl)=C\c1ccccc1 Amb24533619 [0,1,0,0,0,1|2,0,0]=4 5130 B13R1.135 CN(CC)C(=N)Nc1ccccc1 Amb18804668 [0,1,0,0,0,1|2,0,0]=4 5131 B13R1.135 CN(CC)C(=O)Nc1ccc[n]c1 Amb24422148 [0,1,0,0,0,1|2,0,0]=4 5132 B13R1.135 CN(CC)C(=O)Nc1ccccc1 Amb24678753 [0,1,0,0,0,1|1,0,0]=3 5133 B13R1.135 CN(CC)C(=S)Nc1ccccc1 Amb25730690 [0,1,0,0,0,1|1,1,0]=4 5134 B13R1.135 CN(OC)C(=O)Cc1ccccc1 Amb20673721 [0,1,0,0,0,1|2,0,0]=4 5135 B13R1.135 CN(OC)C(=O)Nc1ccccc1 Amb22369280 [0,1,0,0,0,1|2,0,0]=4 5136 B13R1.135 CNC(=O)C(=O)Cc1ccccc1 Amb17400596 [0,1,0,0,0,1|2,0,0]=4 5137 B13R1.135 CNC(=O)C(=O)Nc1ccccc1 Amb1798389 [0,1,0,0,0,1|2,0,0]=4 5138 B13R1.135 CNC(=S)C(=O)Nc1ccccc1 Amb24759766 [0,1,0,0,0,1|2,0,0]=4 5139 B13R1.135 COC(=C)C(=O)Nc1ccccc1 Amb25752695 [0,1,0,0,0,1|2,0,0]=4 5140 B13R1.135 COC(=O)C(=O)Cc1ccccc1 Amb17138843 [0,1,0,0,0,1|2,0,0]=4 5141 B13R1.135 COC(=O)C(=O)Nc1ccccc1 Amb24529368 [0,1,0,0,0,1|2,0,0]=4 5142 B13R1.135 COC(C)C(=O)Nc1ccccc1 Amb24399219 [0,1,0,0,0,1|2,0,0]=4 5143 B13R1.135 CON(Cl)C(=O)Nc1ccccc1 Amb24658395 [0,1,0,0,0,1|2,0,0]=4 5144 B13R1.135 CO[C@@H](C)C(=O)Nc1ccccc1 Amb24490481 [0,1,0,0,0,1|2,0,0]=4 5145 B13R1.135 CO[C@H](C)C(=O)Nc1ccccc1 Amb24728406 [0,1,0,0,0,1|2,0,0]=4 5146 B13R1.135 C\C(=C/C)\C(=O)Cc1ccccc1 Amb24721728 [0,1,0,0,0,1|1,0,1]=4 5147 B13R1.135 C\C(=C/C)\C(=O)Nc1ccccc1 Amb25366214 [0,1,0,0,0,1|1,0,1]=4 5148 B13R1.135 C\C(=C/c1ccccc1)\C(O)CC Amb25687882 [0,1,0,0,0,1|2,0,0]=4 5149 B13R1.135 C\C(=C\C)\C(=O)Cc1ccccc1 Amb25245373 [0,1,0,0,0,1|1,0,1]=4 5150 B13R1.135 C\C(=N\C)\C(=O)Nc1ccccc1 Amb25714546 [0,1,0,0,0,1|2,0,0]=4 5151 B13R1.135 C\C=C(\Br)/C(=O)Nc1ccccc1 Amb22460386 [0,1,0,0,0,1|1,0,1]=4 5152 B13R1.135 C\C=C(\Cl)/C(=O)Nc1ccccc1 Amb24462846 [0,1,0,0,0,1|1,0,1]=4 5153 B13R1.135 ClCC(=O)C(=O)Nc1ccccc1 Amb1039065 [0,1,0,0,0,1|2,0,0]=4 5154 B13R1.135 O=C(Nc1ccccc1)C(=O)CBr Amb25732064 [0,1,0,0,0,1|2,0,0]=4 5155 B13R1.135 O=C(Nc1ccccc1)C(Cl)CCl Amb22353137 [0,1,0,0,0,1|2,0,0]=4 5156 B13R1.135 O=C(Nc1ccccc1)C(F)CCl Amb25293331 [0,1,0,0,0,1|2,0,0]=4 5157 B13R1.135 O=C(Nc1ccccc1)C(F)CF Amb24724668 [0,1,0,0,0,1|2,0,0]=4 5158 B13R1.135 OCC(O)C(=O)Nc1ccccc1 Amb25195876 [0,1,0,0,0,1|2,0,0]=4 5159 B13R1.135 SCC(C(=O)Nc1ccccc1)C Amb11032426 [0,1,0,0,0,1|2,0,0]=4 5160 B13R1.348 CC(=C)CC(=O)Nc1ccccc1 Amb24759109 [0,1,0,0,0,1|1,0,1]=4 5161 B13R1.348 CC(=C)OC(=O)Nc1ccccc1 Amb25121132 [0,1,0,0,0,1|0,0,1]=3 5162 B13R1.348 CC(=N)NC(=O)Oc1ccccc1 Amb25288293 [0,1,0,0,0,1|1,0,1]=4 5163 B13R1.348 CC(=O)CC(=O)Oc1ccccc1 Amb22586480 [0,1,0,0,0,1|1,0,1]=4 5164 B13R1.348 CC(=O)NC(=O)Cc1ccccc1 Amb24073557 [0,1,0,0,0,1|1,0,1]=4 5165 B13R1.348 CC(=O)SC(=O)Nc1ccccc1 Amb24396677 [0,1,0,0,0,1|0,1,1]=4 5166 B13R1.348 CC(=S)NC(=O)Cc1ccccc1 Amb25835179 [0,1,0,0,0,1|1,0,1]=4 5167 B13R1.348 CC(=S)NC(=O)Nc1ccccc1 Amb25104910 [0,1,0,0,0,1|1,0,1]=4 5168 B13R1.348 CC(C)CC(=N)Nc1ccccc1 Amb25081075 [0,1,0,0,0,1|2,0,0]=4 5169 B13R1.348 CC(C)CC(=O)Sc1cccc[n]1 Amb24097109 [0,1,0,0,0,1|2,0,0]=4 5170 B13R1.348 CC(C)CC(=S)Nc1ccccc1 Amb25857081 [0,1,0,0,0,1|1,1,0]=4 5171 B13R1.348 CC(C)NC(=N)Nc1ccccc1 Amb18804677 [0,1,0,0,0,1|2,0,0]=4 5172 B13R1.348 CC(C)NC(=O)Cc1ccc[n]c1 Amb25307733 [0,1,0,0,0,1|2,0,0]=4 5173 B13R1.348 CC(C)NC(=O)Cc1cccc[n]1 Amb25221330 [0,1,0,0,0,1|2,0,0]=4 5174 B13R1.348 CC(C)NC(=O)Nc1c[n]ccc1 Amb24476438 [0,1,0,0,0,1|2,0,0]=4 5175 B13R1.348 CC(C)NC(=O)Nc1cc[n]cc1 Amb24398713 [0,1,0,0,0,1|2,0,0]=4 5176 B13R1.348 CC(C)NC(=S)Oc1ccccc1 Amb24451784 [0,1,0,0,0,1|1,1,0]=4 5177 B13R1.348 CC(C)OC(=O)Nc1c[n]c[n]c1 Amb25828185 [0,1,0,0,0,1|2,0,0]=4 5178 B13R1.348 CC(C)OC(=O)Nc1ccc[n]c1 Amb24668962 [0,1,0,0,0,1|1,0,0]=3 5179 B13R1.348 CC(C)\N=C(\N)/Cc1ccccc1 Amb23569053 [0,1,0,0,0,1|2,0,0]=4 5180 B13R1.348 CC(CC(=O)Cc1ccccc1)C Amb15690932 [0,1,0,0,0,1|1,0,0]=3 5181 B13R1.348 CC(Cl)CC(=O)Nc1ccccc1 Amb17836214 [0,1,0,0,0,1|1,0,0]=3 5182 B13R1.348 CC(Cl)OC(=O)Oc1ccccc1 Amb22054620 [0,1,0,0,0,1|0,0,0]=2 5183 B13R1.348 CC(N)CC(=O)Nc1ccc[n]c1 Amb18968732 [0,1,0,0,0,1|2,0,0]=4 5184 B13R1.348 CC(N)CC(=O)Nc1ccccc1 Amb18968728 [0,1,0,0,0,1|1,0,0]=3 5185 B13R1.348 CC(N)C\C(\Br)=C\c1ccccc1 Amb25258493 [0,1,0,0,0,1|2,0,0]=4 5186 B13R1.348 CC(N)C\C(\Cl)=C/c1ccccc1 Amb25684851 [0,1,0,0,0,1|2,0,0]=4 5187 B13R1.348 CC(O)CC(=O)Sc1ccccc1 Amb20671502 [0,1,0,0,0,1|1,0,0]=3 5188 B13R1.348 CC(O)NC(=O)Cc1ccccc1 Amb25737869 [0,1,0,0,0,1|1,0,0]=3 5189 B13R1.348 CC(OC(=S)Nc1ccccc1)C Amb1625289 [0,1,0,0,0,1|0,1,0]=3 5190 B13R1.348 CN(C)NC(=O)Cc1ccccc1 Amb24350087 [0,1,0,0,0,1|2,0,0]=4 5191 B13R1.348 CN(C)OC(=O)Nc1ccccc1 Amb25293780 [0,1,0,0,0,1|1,0,0]=3 5192 B13R1.348 CN(O)CC(=O)Nc1ccccc1 Amb25790561 [0,1,0,0,0,1|2,0,0]=4 5193 B13R1.348 CS(C)=CC(=O)Cc1ccccc1 Amb18048727 [0,1,0,0,0,1|2,0,0]=4 5194 B13R1.348 C[C@@H](N)CC(=O)Nc1ccccc1 Amb25312054 [0,1,0,0,0,1|1,0,0]=3 5195 B13R1.348 C[C@@H](O)CC(=O)Nc1ccccc1 Amb25075634 [0,1,0,0,0,1|1,0,0]=3 5196 B13R1.348 C[C@H](O)CC(=O)Nc1ccccc1 Amb24452163 [0,1,0,0,0,1|1,0,0]=3 5197 B13R1.348 C\C(\CC(C)N)=C/c1ccccc1 Amb25113467 [0,1,0,0,0,1|2,0,0]=4 5198 B13R1.348 C\C(\C[C@@H](C)O)=C/c1ccccc1 Amb24495452 [0,1,0,0,0,1|2,0,0]=4 5199 B13R1.348 C\C(\C[C@H](C)O)=C/c1ccccc1 Amb24576963 [0,1,0,0,0,1|2,0,0]=4 5200 B13R1.348 C\C(\Cc1ccccc1)=C\C(C)O Amb25092323 [0,1,0,0,0,1|2,0,0]=4 5201 B13R1.348 C\C(\Cl)=C\C(=O)Nc1ccccc1 Amb22462104 [0,1,0,0,0,1|1,0,1]=4 5202 B13R1.348 C\C(\N)=C\C(=O)Cc1ccccc1 Amb25767909 [0,1,0,0,0,1|1,0,1]=4 5203 B13R1.348 C\C(\Nc1ccccc1)=N\C(C)C Amb25798345 [0,1,0,0,0,1|2,0,0]=4 5204 B13R1.348 C\C(\O)=C\C(=O)Cc1ccccc1 Amb24492639 [0,1,0,0,0,1|1,0,1]=4 5205 B13R1.348 NC(=O)OC(=O)Nc1ccccc1 Amb25350415 [0,1,0,0,0,1|1,0,1]=4 5206 B13R1.348 O=C(Cc1ccccc1)CC(=O)C Amb15692856 [0,1,0,0,0,1|1,0,1]=4 5207 B13R1.348 O=C(Nc1ccccc1)CC(=O)C Amb1210069 [0,1,0,0,0,1|1,0,1]=4 5208 B13R1.470 BrCCC(=O)Nc1ccccc1C Amb17327783 [0,1,0,0,0,1|2,0,0]=4 5209 B13R1.470 BrCCC(=O)Nc1ccccc1Cl Amb17332540 [0,1,0,0,0,1|2,0,0]=4 5210 B13R1.470 BrCCC(=O)Nc1ccccc1O Amb17331112 [0,1,0,0,0,1|2,0,0]=4 5211 B13R1.470 CC#CC(=O)Nc1ccccc1Br Amb24533498 [0,1,0,0,0,1|1,0,1]=4 5212 B13R1.470 CC#CC(=O)Nc1ccccc1Cl Amb25058406 [0,1,0,0,0,1|1,0,1]=4 5213 B13R1.470 CC#CC(=O)Nc1ccccc1N Amb24370425 [0,1,0,0,0,1|1,0,1]=4 5214 B13R1.470 CC=CC(=O)Nc1ccccc1Cl Amb22485115 [0,1,0,0,0,1|1,0,1]=4 5215 B13R1.470 CCCC(=N)Nc1ccccc1Br Amb25730577 [0,1,0,0,0,1|2,0,0]=4 5216 B13R1.470 CCCC(=N)Nc1ccccc1Cl Amb25093168 [0,1,0,0,0,1|2,0,0]=4 5217 B13R1.470 CCCC(=N)Nc1ccccc1I Amb24458938 [0,1,0,0,0,1|2,0,0]=4 5218 B13R1.470 CCCC(=O)Cc1ccccc1C Amb17138794 [0,1,0,0,0,1|1,0,0]=3 5219 B13R1.470 CCCC(=O)Cc1ccccc1Cl Amb17139625 [0,1,0,0,0,1|1,0,0]=3 5220 B13R1.470 CCCC(=O)Cc1ccccc1F Amb17138960 [0,1,0,0,0,1|1,0,0]=3 5221 B13R1.470 CCCC(=O)Nc1[n]cccc1F Amb25763662 [0,1,0,0,0,1|2,0,0]=4 5222 B13R1.470 CCCC(=O)Nc1[n]cccc1I Amb25344435 [0,1,0,0,0,1|2,0,0]=4 5223 B13R1.470 CCCC(=O)Nc1[n]cccc1N Amb25123005 [0,1,0,0,0,1|2,0,0]=4 5224 B13R1.470 CCCC(=O)Nc1[n]cccc1O Amb25125888 [0,1,0,0,0,1|2,0,0]=4 5225 B13R1.470 CCCC(=O)Nc1c[n]ccc1Cl Amb24565855 [0,1,0,0,0,1|2,0,0]=4 5226 B13R1.470 CCCC(=O)Nc1cc[n]cc1N Amb18303241 [0,1,0,0,0,1|2,0,0]=4 5227 B13R1.470 CCCC(=O)Nc1ccc[n]c1O Amb24450717 [0,1,0,0,0,1|2,0,0]=4 5228 B13R1.470 CCCS(=O)Nc1ccccc1Br Amb25348359 [0,1,0,0,0,1|2,0,0]=4 5229 B13R1.470 CCCS(=O)Nc1ccccc1I Amb25177341 [0,1,0,0,0,1|2,0,0]=4 5230 B13R1.470 CCCS(=O)Nc1ccccc1N Amb25177139 [0,1,0,0,0,1|2,0,0]=4 5231 B13R1.470 CCNC(=N)Cc1ccccc1Br Amb24747330 [0,1,0,0,0,1|2,0,0]=4 5232 B13R1.470 CCNC(=N)Cc1ccccc1Cl Amb24430254 [0,1,0,0,0,1|2,0,0]=4 5233 B13R1.470 CCNC(=N)Cc1ccccc1F Amb25686401 [0,1,0,0,0,1|2,0,0]=4 5234 B13R1.470 CCNC(=N)Nc1ccccc1Cl Amb19066809 [0,1,0,0,0,1|2,0,0]=4 5235 B13R1.470 CCNC(=N)Nc1ccccc1F Amb18185015 [0,1,0,0,0,1|2,0,0]=4 5236 B13R1.470 CCNC(=O)Cc1ccccc1Br Amb22230625 [0,1,0,0,0,1|1,0,0]=3 5237 B13R1.470 CCNC(=O)Cc1ccccc1Cl Amb23014083 [0,1,0,0,0,1|1,0,0]=3 5238 B13R1.470 CCNC(=O)Cc1ccccc1N Amb1121104 [0,1,0,0,0,1|1,0,0]=3 5239 B13R1.470 CCNC(=O)Cn1ccccc1=O Amb13961279 [0,1,0,0,0,1|2,0,0]=4 5240 B13R1.470 CCNC(=O)Nc1[n]cccc1Br Amb25213867 [0,1,0,0,0,1|2,0,0]=4 5241 B13R1.470 CCNC(=O)Nc1[n]cccc1Cl Amb24371568 [0,1,0,0,0,1|2,0,0]=4 5242 B13R1.470 CCNC(=O)Nc1[n]cccc1F Amb24718112 [0,1,0,0,0,1|2,0,0]=4 5243 B13R1.470 CCNC(=O)Nc1[n]cccc1N Amb25689259 [0,1,0,0,0,1|2,0,0]=4 5244 B13R1.470 CCNC(=O)Nc1[n]cccc1O Amb25670439 [0,1,0,0,0,1|2,0,0]=4 5245 B13R1.470 CCNC(=O)Nc1cc[n]cc1N Amb18967352 [0,1,0,0,0,1|2,0,0]=4 5246 B13R1.470 CCNC(=O)Nc1ccc[n]c1Br Amb24403477 [0,1,0,0,0,1|2,0,0]=4 5247 B13R1.470 CCNC(=O)Nc1ccc[n]c1Cl Amb24555422 [0,1,0,0,0,1|2,0,0]=4 5248 B13R1.470 CCNC(=O)Nc1ccccc1C Amb2236972 [0,1,0,0,0,1|1,0,0]=3 5249 B13R1.470 CCNC(=O)Nc1ccccc1F Amb2236700 [0,1,0,0,0,1|1,0,0]=3 5250 B13R1.470 CCNC(=O)OC1=CC=CNC1=O Amb25690364 [0,1,0,0,0,1|2,0,0]=4 5251 B13R1.470 CCNC(=O)Oc1ccccc1Br Amb24414719 [0,1,0,0,0,1|1,0,0]=3 5252 B13R1.470 CCNC(=O)Oc1ccccc1Cl Amb22486818 [0,1,0,0,0,1|1,0,0]=3 5253 B13R1.470 CCNC(=O)Oc1ccccc1F Amb25057414 [0,1,0,0,0,1|1,0,0]=3 5254 B13R1.470 CCNC(=O)Oc1ccccc1O Amb24611188 [0,1,0,0,0,1|1,0,0]=3 5255 B13R1.470 CCNC(=O)Oc1cccnc1I Amb2405499 [0,1,0,0,0,1|2,0,0]=4 5256 B13R1.470 CCNC(=S)Nc1ccccc1I Amb17712785 [0,1,0,0,0,1|1,1,0]=4 5257 B13R1.470 CCNC(=S)Nc1ccccc1N Amb2426399 [0,1,0,0,0,1|1,1,0]=4 5258 B13R1.470 CCOC(=N)Cc1ccccc1Cl Amb19083262 [0,1,0,0,0,1|1,0,0]=3 5259 B13R1.470 CCOC(=N)Cc1ccccc1Cl Amb20673156 [0,1,0,0,0,1|1,0,0]=3 5260 B13R1.470 CCOC(=N)Cc1ccccc1F Amb20673150 [0,1,0,0,0,1|1,0,0]=3 5261 B13R1.470 CCOC(=N)Nc1ccccc1O Amb24557161 [0,1,0,0,0,1|1,0,0]=3 5262 B13R1.470 CCOC(=O)CC1=CN=CNC1=O Amb19516969 [0,1,0,0,0,1|2,0,0]=4 5263 B13R1.470 CCOC(=O)CN1C=CC=CC1=O Amb18186767 [0,1,0,0,0,1|1,0,0]=3 5264 B13R1.470 CCOC(=O)CN1N=CC=CC1=O Amb18181548 [0,1,0,0,0,1|2,0,0]=4 5265 B13R1.470 CCOC(=O)C[n+]1ccccc1C Amb10553985 [0,1,0,0,0,1|1,0,0]=3 5266 B13R1.470 CCOC(=O)Cc1[n]c[n]cc1Br Amb22499191 [0,1,0,0,0,1|2,0,0]=4 5267 B13R1.470 CCOC(=O)Cc1[n]cccc1Br Amb21963898 [0,1,0,0,0,1|1,0,0]=3 5268 B13R1.470 CCOC(=O)Cc1[n]cccc1I Amb22499041 [0,1,0,0,0,1|1,0,0]=3 5269 B13R1.470 CCOC(=O)Cc1[n]cccc1N Amb22295863 [0,1,0,0,0,1|1,0,0]=3 5270 B13R1.470 CCOC(=O)Cc1[n]cccc1O Amb18648470 [0,1,0,0,0,1|1,0,0]=3 5271 B13R1.470 CCOC(=O)Cc1c[n]c[n]c1Cl Amb22494259 [0,1,0,0,0,1|2,0,0]=4 5272 B13R1.470 CCOC(=O)Cc1c[n]c[n]c1O Amb22002045 [0,1,0,0,0,1|2,0,0]=4 5273 B13R1.470 CCOC(=O)Cc1cc[n]cc1Br Amb21962528 [0,1,0,0,0,1|1,0,0]=3 5274 B13R1.470 CCOC(=O)Cc1cc[n]cc1N Amb18128678 [0,1,0,0,0,1|1,0,0]=3 5275 B13R1.470 CCOC(=O)Cc1cc[n]cc1N Amb24086005 [0,1,0,0,0,1|1,0,0]=3 5276 B13R1.470 CCOC(=O)Cc1ccc[n]c1Cl Amb21960759 [0,1,0,0,0,1|1,0,0]=3 5277 B13R1.470 CCOC(=O)Cc1cccc[n+]1C Amb10554009 [0,1,0,0,0,1|1,0,0]=3 5278 B13R1.470 CCOC(=O)Cc1ccccc1I Amb22475916 [0,1,0,0,0,1|0,0,0]=2 5279 B13R1.470 CCOC(=O)Cc1ccccc1O Amb17614081 [0,1,0,0,0,1|0,0,0]=2 5280 B13R1.470 CCOC(=O)Nc1[n]cccc1Br Amb25715056 [0,1,0,0,0,1|1,0,0]=3 5281 B13R1.470 CCOC(=O)Nc1[n]cccc1N Amb18128862 [0,1,0,0,0,1|1,0,0]=3 5282 B13R1.470 CCOC(=O)Nc1c[n]ccc1O Amb18129000 [0,1,0,0,0,1|1,0,0]=3 5283 B13R1.470 CCOC(=O)Nc1cc[n]cc1F Amb24684630 [0,1,0,0,0,1|1,0,0]=3 5284 B13R1.470 CCOC(=O)Nc1cc[n]cc1N Amb19002524 [0,1,0,0,0,1|1,0,0]=3 5285 B13R1.470 CCOC(=O)Nc1cc[n]cc1O Amb25120613 [0,1,0,0,0,1|1,0,0]=3 5286 B13R1.470 CCOC(=O)Nc1ccc[n]c1Br Amb18155630 [0,1,0,0,0,1|1,0,0]=3 5287 B13R1.470 CCOC(=O)Nc1ccc[n]c1N Amb18128863 [0,1,0,0,0,1|1,0,0]=3 5288 B13R1.470 CCOC(=O)Nc1ccc[n]c1O Amb24490364 [0,1,0,0,0,1|1,0,0]=3 5289 B13R1.470 CCOC(=O)Nc1cccc[n+]1[O-] Amb10553013 [0,1,0,0,0,1|1,0,0]=3 5290 B13R1.470 CCOC(=O)Nc1ccccc1O Amb18128818 [0,1,0,0,0,1|0,0,0]=2 5291 B13R1.470 CCOC(=O)Nc1ccccc1S Amb24444867 [0,1,0,0,0,1|0,0,0]=2 5292 B13R1.470 CCOC(=O)Nc1cccnc1Cl Amb17792635 [0,1,0,0,0,1|1,0,0]=3 5293 B13R1.470 CCOC(=O)Nc1ncccc1O Amb15692884 [0,1,0,0,0,1|1,0,0]=3 5294 B13R1.470 CNCC(=O)Nc1ccccc1Br Amb2277697 [0,1,0,0,0,1|2,0,0]=4 5295 B13R1.470 CNCC(=O)Nc1ccccc1Br Amb2370683 [0,1,0,0,0,1|2,0,0]=4 5296 B13R1.470 CNCC(=O)Nc1ccccc1Cl Amb2281752 [0,1,0,0,0,1|2,0,0]=4 5297 B13R1.470 CNCC(=O)Nc1ccccc1Cl Amb2370637 [0,1,0,0,0,1|2,0,0]=4 5298 B13R1.470 COCC(=O)Nc1ccccc1N Amb1121544 [0,1,0,0,0,1|2,0,0]=4 5299 B13R1.470 COCC(=O)Nc1ccccc1N Amb17622091 [0,1,0,0,0,1|2,0,0]=4 5300 B13R1.470 CONC(=O)Cc1ccccc1C Amb10694421 [0,1,0,0,0,1|2,0,0]=4 5301 B13R1.470 CONC(=O)Cc1ccccc1Cl Amb10704853 [0,1,0,0,0,1|2,0,0]=4 5302 B13R1.470 CONC(=O)Cc1ccccc1F Amb10704850 [0,1,0,0,0,1|2,0,0]=4 5303 B13R1.470 CONC(=O)Cc1ccccc1I Amb24660656 [0,1,0,0,0,1|2,0,0]=4 5304 B13R1.470 CONC(=O)Cc1ccccc1O Amb24489195 [0,1,0,0,0,1|2,0,0]=4 5305 B13R1.470 CONC(=O)Nc1ccccc1F Amb25153723 [0,1,0,0,0,1|2,0,0]=4 5306 B13R1.470 CONC(=O)Nc1ccccc1I Amb24529694 [0,1,0,0,0,1|2,0,0]=4 5307 B13R1.470 CONC(=O)Nc1ccccc1O Amb24718194 [0,1,0,0,0,1|2,0,0]=4 5308 B13R1.470 CSCC(=O)Nc1ccccc1Cl Amb15701901 [0,1,0,0,0,1|2,0,0]=4 5309 B13R1.470 CSCC(=O)Nc1ccccc1I Amb11214963 [0,1,0,0,0,1|2,0,0]=4 5310 B13R1.470 CSCC(=O)Nc1ccccc1O Amb25818151 [0,1,0,0,0,1|2,0,0]=4 5311 B13R1.470 C\C=C\C(=O)Cc1ccccc1Br Amb25670609 [0,1,0,0,0,1|1,0,1]=4 5312 B13R1.470 C\C=C\C(=O)Cc1ccccc1Cl Amb24496371 [0,1,0,0,0,1|1,0,1]=4 5313 B13R1.470 C\C=C\C(=O)Cc1ccccc1F Amb24377009 [0,1,0,0,0,1|1,0,1]=4 5314 B13R1.470 C\C=C\C(=O)Nc1ccccc1Cl Amb24688589 [0,1,0,0,0,1|1,0,1]=4 5315 B13R1.470 C\C=C\C(=O)Nc1ccccc1I Amb25695751 [0,1,0,0,0,1|1,0,1]=4 5316 B13R1.470 C\C=C\C(=O)Oc1ccccc1F Amb24502526 [0,1,0,0,0,1|1,0,1]=4 5317 B13R1.470 C\C=C\C(=O)Oc1ccccc1I Amb24502527 [0,1,0,0,0,1|1,0,1]=4 5318 B13R1.470 C\C=C\C(=O)Oc1ccccc1O Amb24583610 [0,1,0,0,0,1|1,0,1]=4 5319 B13R1.470 Cc1[n][n]ccc1NC(=O)OCC Amb24386563 [0,1,0,0,0,1|2,0,0]=4 5320 B13R1.470 Cc1[n]cccc1CC(=O)OCC Amb24097206 [0,1,0,0,0,1|1,0,0]=3 5321 B13R1.470 Cc1c[n][n]cc1NC(=O)OCC Amb25680391 [0,1,0,0,0,1|2,0,0]=4 5322 B13R1.470 Cc1c[n]ccc1CC(=O)NCC Amb25822145 [0,1,0,0,0,1|2,0,0]=4 5323 B13R1.470 Cc1c[n]ccc1CC(=O)OCC Amb22739815 [0,1,0,0,0,1|1,0,0]=3 5324 B13R1.470 Cc1c[n]ccc1NC(=O)CCC Amb25119201 [0,1,0,0,0,1|2,0,0]=4 5325 B13R1.470 Cc1c[n]ccc1NC(=O)NCC Amb24740311 [0,1,0,0,0,1|2,0,0]=4 5326 B13R1.470 Cc1cc[n]cc1NC(=O)CCC Amb25706420 [0,1,0,0,0,1|2,0,0]=4 5327 B13R1.470 Cc1cc[n]cc1NC(=O)OCC Amb25372328 [0,1,0,0,0,1|1,0,0]=3 5328 B13R1.470 Cc1ccccc1CC(=N)OCC Amb20673147 [0,1,0,0,0,1|1,0,0]=3 5329 B13R1.470 Cc1ccccc1NC(=N)NCC Amb18804674 [0,1,0,0,0,1|2,0,0]=4 5330 B13R1.470 Cc1ccccc1NC(=N)OCC Amb25375687 [0,1,0,0,0,1|1,0,0]=3 5331 B13R1.470 Cc1ccccc1NC(=N)SCC Amb24600073 [0,1,0,0,0,1|1,1,0]=4 5332 B13R1.470 Cc1ccccc1NC(=O)CCS Amb24490204 [0,1,0,0,0,1|2,0,0]=4 5333 B13R1.470 Cc1ccccc1NC(=O)CNC Amb21958993 [0,1,0,0,0,1|2,0,0]=4 5334 B13R1.470 Cc1ccccc1NC(=O)CSC Amb25766404 [0,1,0,0,0,1|2,0,0]=4 5335 B13R1.470 Cc1ccccc1NC(=O)\C=C\C Amb25098097 [0,1,0,0,0,1|1,0,1]=4 5336 B13R1.470 Cc1ccccc1OC(=O)NCC Amb24490439 [0,1,0,0,0,1|1,0,0]=3 5337 B13R1.470 Cc1ccccc1OC(=O)OCC Amb22733215 [0,1,0,0,0,1|0,0,0]=2 5338 B13R1.470 ClCCC(=O)Nc1ccccc1Br Amb1133055 [0,1,0,0,0,1|2,0,0]=4 5339 B13R1.470 ClCCC(=O)Nc1ccccc1O Amb1928974 [0,1,0,0,0,1|2,0,0]=4 5340 B13R1.470 NCCC(=O)Nc1ccccc1C Amb17622092 [0,1,0,0,0,1|2,0,0]=4 5341 B13R1.470 NCCC(=O)Nc1ccccc1Cl Amb15740943 [0,1,0,0,0,1|2,0,0]=4 5342 B13R1.470 NCCC(=O)Nc1ccccc1F Amb1130030 [0,1,0,0,0,1|2,0,0]=4 5343 B13R1.470 NCCC(=O)Nc1ccccc1F Amb17622104 [0,1,0,0,0,1|2,0,0]=4 5344 B13R1.470 NCCC(=O)Nc1ccccc1O Amb25058089 [0,1,0,0,0,1|2,0,0]=4 5345 B13R1.470 NCCC(=O)Oc1ccccc1Br Amb17349673 [0,1,0,0,0,1|2,0,0]=4 5346 B13R1.470 NCCC(=O)Oc1ccccc1C Amb17335312 [0,1,0,0,0,1|2,0,0]=4 5347 B13R1.470 NCCC(=O)Oc1ccccc1Cl Amb17337482 [0,1,0,0,0,1|2,0,0]=4 5348 B13R1.470 NCCC(=O)Oc1ccccc1F Amb17335601 [0,1,0,0,0,1|2,0,0]=4 5349 B13R1.470 O=C(CCBr)Nc1ccccc1I Amb25105122 [0,1,0,0,0,1|2,0,0]=4 5350 B13R1.470 O=C(CCI)Nc1ccccc1Cl Amb24630912 [0,1,0,0,0,1|2,0,0]=4 5351 B13R1.470 O=C(CCS)Nc1ccccc1F Amb25316210 [0,1,0,0,0,1|2,0,0]=4 5352 B13R1.470 OCCC(=O)Nc1ccccc1Br Amb17349665 [0,1,0,0,0,1|2,0,0]=4 5353 B13R1.470 OCCC(=O)Nc1ccccc1C Amb17335300 [0,1,0,0,0,1|2,0,0]=4 5354 B13R1.1327 CCCS(=O)(=O)Nc1ccccc1 Amb23496993 [0,1,0,0,0,1|2,0,0]=4 5355 B13R1.1327 CCCS(=O)(=O)Oc1ccccc1 Amb23497027 [0,1,0,0,0,1|2,0,0]=4 5356 B13R1.1327 CCNS(=O)(=O)Nc1ccccc1 Amb16962119 [0,1,0,0,0,1|2,0,0]=4 5357 B13R1.1327 CCOP(O)(=O)Cc1ccccc1 Amb22487252 [0,1,0,0,0,1|1,0,0]=3 5358 B13R1.1327 CCO[Si](Cl)(Cl)Cc1ccccc1 Amb22369271 [0,1,0,0,0,1|1,1,0]=4 5359 B13R1.463 CCOC(=O)C1=CC=CC=CC1=O Amb24633659 [0,1,0,0,0,1|0,0,0]=2 5360 B13R1.1462 CCOC(=O)C1=CC(=O)C=CC=C1 Amb24492591 [0,1,0,0,0,1|0,0,0]=2 5361 B13R1.1463 CCOC(=O)C1=CC=CC(Cl)CO1 Amb25857466 [0,1,0,0,0,1|0,0,2]=4 5362 B13R1.1463 CCOC(=O)C=1C=CC(=O)C=CC1 Amb25318875 [0,1,0,0,0,1|0,0,0]=2 5363 B13R1.1463 CCOC(=O)C=1CCC(O)C=CC1 Amb24379927 [0,1,0,0,0,1|0,0,2]=4 5364 B13R1.1463 CCOC(=O)N1C=CC(=O)NC=C1 Amb25380742 [0,1,0,0,0,1|1,0,0]=3 5365 B13R1.7456 CC(C)NC(=O)C1C=CC=CC=C1 Amb25365124 [0,1,0,0,0,1|1,0,1]=4 5366 B13R1.1 CCC(OCC)c1ccc(Br)cc1 Amb23443745 [0,2,0,0,0,0|1,0,1]=4 5367 B13R1.1 CCC(OCC)c1ccc(S)cc1 Amb23568733 [0,2,0,0,0,0|1,0,1]=4 5368 B13R1.1 CCC\C(=N\O)\c1ccc(Cl)cc1 Amb24720872 [0,2,0,0,0,0|1,0,1]=4 5369 B13R1.1 CCC\C(=N\O)\c1ccc(O)cc1 Amb25366459 [0,2,0,0,0,0|1,0,1]=4 5370 B13R1.1 CCN\C(=N\N)\c1ccc(Br)cc1 Amb25154806 [0,2,0,0,0,0|2,0,0]=4 5371 B13R1.1 CCN\C(=N\N)\c1ccc(Cl)cc1 Amb18318339 [0,2,0,0,0,0|2,0,0]=4 5372 B13R1.1 CCN\C(=N\N)\c1ccc(F)cc1 Amb18179032 [0,2,0,0,0,0|2,0,0]=4 5373 B13R1.1 CCOC(C#N)c1ccc(Br)cc1 Amb25786055 [0,2,0,0,0,0|1,0,1]=4 5374 B13R1.1 CCOC(c1ccc(cc1)C)CN Amb17606011 [0,2,0,0,0,0|1,0,1]=4 5375 B13R1.1 CC\C=C(\C#N)/c1ccc(Br)cc1 Amb24572888 [0,2,0,0,0,0|2,0,0]=4 5376 B13R1.1 CC\C=C(\C#N)/c1ccc(F)cc1 Amb24611560 [0,2,0,0,0,0|2,0,0]=4 5377 B13R1.1 CC\C=C(\c1ccc(cc1)Br)/C#N Amb17252668 [0,2,0,0,0,0|2,0,0]=4 5378 B13R1.1 CC\C=C(\c1ccc(cc1)C)/C#N Amb17232823 [0,2,0,0,0,0|2,0,0]=4 5379 B13R1.1 CC\C=C(\c1ccc(cc1)Cl)/C#N Amb17235304 [0,2,0,0,0,0|2,0,0]=4 5380 B13R1.1 CC\C=C(\c1ccc(cc1)F)/C#N Amb17233073 [0,2,0,0,0,0|2,0,0]=4 5381 B13R1.1 CS\C=C(/C=O)\c1ccc(F)cc1 Amb18130284 [0,2,0,0,0,0|2,0,0]=4 5382 B13R1.1 Cc1ccc(cc1)C(C#N)OCC Amb20623868 [0,2,0,0,0,0|1,0,1]=4 5383 B13R1.1 Cc1ccc(cc1)\C(\C=O)=C/CC Amb25179883 [0,2,0,0,0,0|1,0,0]=3 5384 B13R1.1 Cc1ccc(cc1)\C(\C=O)=C/OC Amb25835619 [0,2,0,0,0,0|2,0,0]=4 5385 B13R1.1 Cc1ccc(cc1)\C(\C=O)=C\SC Amb18129958 [0,2,0,0,0,0|2,0,0]=4 5386 B13R1.1 Cc1ccc(cc1)\C(\NCC)=N/N Amb18178430 [0,2,0,0,0,0|2,0,0]=4 5387 B13R1.1 Cc1ccc(cc1)\C(\NCC)=N\O Amb24526777 [0,2,0,0,0,0|1,0,1]=4 5388 B13R1.1 NCC(c1ccc(cc1)Br)OCC Amb17605996 [0,2,0,0,0,0|1,0,1]=4 5389 B13R1.1 NCC(c1ccc(cc1)Cl)OCC Amb17606012 [0,2,0,0,0,0|1,0,1]=4 5390 B13R1.2 CCC(OCC)c1cccc(N)c1 Amb23443787 [0,2,0,0,0,0|1,0,1]=4 5391 B13R1.2 CCN\C(=N\N)\c1cc(Br)ccc1 Amb24451460 [0,2,0,0,0,0|2,0,0]=4 5392 B13R1.2 CCN\C(=N\N)\c1cc(Cl)ccc1 Amb19044791 [0,2,0,0,0,0|2,0,0]=4 5393 B13R1.2 CCN\C(=N\N)\c1cc(F)ccc1 Amb18179030 [0,2,0,0,0,0|2,0,0]=4 5394 B13R1.2 CCOC(C#N)c1cccc(Br)c1 Amb24419121 [0,2,0,0,0,0|1,0,1]=4 5395 B13R1.2 CCOC(C#N)c1cccc(F)c1 Amb25756616 [0,2,0,0,0,0|1,0,1]=4 5396 B13R1.2 CCOC(c1cccc(c1)Br)CN Amb17606016 [0,2,0,0,0,0|1,0,1]=4 5397 B13R1.2 CCOC(c1cccc(c1)Cl)CN Amb17605998 [0,2,0,0,0,0|1,0,1]=4 5398 B13R1.2 CCOC(c1cccc(c1)F)CN Amb17606013 [0,2,0,0,0,0|1,0,1]=4 5399 B13R1.2 Cc1cc(ccc1)\C(\NCC)=N/N Amb18790852 [0,2,0,0,0,0|2,0,0]=4 5400 B13R1.26 C=CCNC(=S=O)c1ccccc1 Amb24610571 [0,2,0,0,0,0|1,0,1]=4 5401 B13R1.26 CCCC\C(=C/[Pr])\c1ccccc1 Amb10559340 [0,2,0,0,0,0|2,0,0]=4 5402 B13R1.26 CCCN\C(=N\N)\c1ccccc1 Amb18178436 [0,2,0,0,0,0|2,0,0]=4 5403 B13R1.26 CCN\C=C(\C#N)/c1ccccc1 Amb25179139 [0,2,0,0,0,0|2,0,0]=4 5404 B13R1.26 CCOCN(c1ccccc1)CC Amb10559528 [0,2,0,0,0,0|2,0,0]=4 5405 B13R1.26 CCO\C=C(\C#N)/c1cccc[n]1 Amb24655680 [0,2,0,0,0,0|2,0,0]=4 5406 B13R1.26 C\N=C(\NCCO)/c1ccccc1 Amb24422189 [0,2,0,0,0,0|2,0,0]=4 5407 B13R1.26 N#C\C(=C\CCO)\c1ccccc1 Amb24577379 [0,2,0,0,0,0|2,0,0]=4 5408 B13R1.26 NCC(OCCO)c1ccccc1 Amb23580589 [0,2,0,0,0,0|1,0,1]=4 5409 B13R1.26 NCCN\C(=N\O)\c1ccccc1 Amb25724803 [0,2,0,0,0,0|1,0,1]=4 5410 B13R1.26 OCCN\C(=N\O)\c1ccccc1 Amb24564487 [0,2,0,0,0,0|1,0,1]=4 5411 B13R1.173 CCC\C(=N\C)\c1ccccc1O Amb24598943 [0,2,0,0,0,0|2,0,0]=4 5412 B13R1.173 CCNC(=NN)c1ccccc1Cl Amb18318342 [0,2,0,0,0,0|2,0,0]=4 5413 B13R1.173 CCN\C(=N\N)\c1ccccc1Br Amb25712548 [0,2,0,0,0,0|2,0,0]=4 5414 B13R1.173 CCN\C(=N\N)\c1ccccc1F Amb18179031 [0,2,0,0,0,0|2,0,0]=4 5415 B13R1.173 CCN\C(=N\O)\c1ccccc1Cl Amb25689602 [0,2,0,0,0,0|1,0,1]=4 5416 B13R1.173 CCOC(C#N)c1ccccc1Br Amb25808836 [0,2,0,0,0,0|1,0,1]=4 5417 B13R1.173 CCOC(C#N)c1ccccc1Cl Amb25742839 [0,2,0,0,0,0|1,0,1]=4 5418 B13R1.173 CCOC(c1ccccc1C)CN Amb17606025 [0,2,0,0,0,0|1,0,1]=4 5419 B13R1.173 CCOC(c1ccccc1Cl)CN Amb17606018 [0,2,0,0,0,0|1,0,1]=4 5420 B13R1.173 CCOC(c1ccccc1F)CN Amb17606019 [0,2,0,0,0,0|1,0,1]=4 5421 B13R1.173 Cc1ccccc1C(C#N)OCC Amb25737385 [0,2,0,0,0,0|1,0,1]=4 5422 B13R1.173 Cc1ccccc1\C(\NCC)=N/N Amb18178431 [0,2,0,0,0,0|2,0,0]=4 5423 B13R1.398 CCN\C(=C\C#N)\c1ccccc1 Amb24666497 [0,2,0,0,0,0|2,0,0]=4 5424 B13R1.398 CCOC(CCCl)c1ccccc1 Amb24093905 [0,2,0,0,0,0|1,0,1]=4 5425 B13R1.398 CCOC(c1ccccc1)OCC Amb10561865 [0,2,0,0,0,0|0,0,2]=4 5426 B13R1.398 CCO[SiH](OCC)c1ccccc1 Amb22002687 [0,2,0,0,0,0|0,1,1]=4 5427 B13R1.398 CCO\C(=N\C#N)\c1ccccc1 Amb24455739 [0,2,0,0,0,0|1,0,0]=3 5428 B13R1.398 CC\C=C(/N=C=O)\c1ccccc1 Amb25799649 [0,2,0,0,0,0|1,0,0]=3 5429 B13R1.398 CNCC(c1ccccc1)OCC Amb17605900 [0,2,0,0,0,0|1,0,1]=4 5430 B13R1.398 C\C=C\C(=C\C=O)\c1ccccc1 Amb24640215 [0,2,0,0,0,0|1,0,1]=4 5431 B13R1.405 CC(=O)\C(=C/CC)\c1ccccc1 Amb25767023 [0,2,0,0,0,0|1,0,0]=3 5432 B13R1.405 CC(=O)\C(=C/NC)\c1ccccc1 Amb24399834 [0,2,0,0,0,0|2,0,0]=4 5433 B13R1.405 CC(=O)\C(=C\NC)\c1ccccc1 Amb24567970 [0,2,0,0,0,0|2,0,0]=4 5434 B13R1.405 CC(=O)\C(=N/OC)\c1ccccc1 Amb24690856 [0,2,0,0,0,0|2,0,0]=4 5435 B13R1.405 CC(=O)\C(=N\OC)\c1ccccc1 Amb25073360 [0,2,0,0,0,0|2,0,0]=4 5436 B13R1.405 CCCC(C(N)=O)c1ccccc1 Amb19186061 [0,2,0,0,0,0|1,0,1]=4 5437 B13R1.405 CCNC(c1ccccc1)C(=O)N Amb17335239 [0,2,0,0,0,0|1,0,1]=4 5438 B13R1.405 CCOC(C(N)=N)c1ccccc1 Amb24065595 [0,2,0,0,0,0|1,0,1]=4 5439 B13R1.405 CC\C=C(/C(N)=O)\c1ccccc1 Amb25108114 [0,2,0,0,0,0|1,0,0]=3 5440 B13R1.405 CC\C=C(\C(C)O)/c1ccccc1 Amb24531668 [0,2,0,0,0,0|1,0,1]=4 5441 B13R1.405 CO\C=C(\C(O)=O)/c1ccccc1 Amb24426177 [0,2,0,0,0,0|2,0,0]=4 5442 B13R1.405 CO\N=C(\C(O)=O)/c1ccccc1 Amb25201826 [0,2,0,0,0,0|2,0,0]=4 5443 B13R1.532 CCC(=O)\C(=N\O)\c1ccccc1 Amb25059632 [0,2,0,0,0,0|1,0,1]=4 5444 B13R1.532 CCC(O)C(=C=C)c1ccccc1 Amb24698640 [0,2,0,0,0,0|2,0,0]=4 5445 B13R1.532 CC\C(\N)=C(\C#N)/c1ccccc1 Amb24520900 [0,2,0,0,0,0|2,0,0]=4 5446 B13R1.532 C\C(\CC)=C(/C=O)\c1ccccc1 Amb25725942 [0,2,0,0,0,0|1,0,0]=3 5447 B13R1.532 C\C=C(\C(=O)CC)/c1ccccc1 Amb25318877 [0,2,0,0,0,0|2,0,0]=4 5448 B13R1.713 CC(=O)\C=C(\C=O)/c1ccccc1 Amb24610113 [0,2,0,0,0,0|1,0,1]=4 5449 B13R1.713 CC(C)C\C(=N\O)\c1ccccc1 Amb25055997 [0,2,0,0,0,0|1,0,1]=4 5450 B13R1.713 CC(C)N\C(=N\N)\c1ccccc1 Amb18178437 [0,2,0,0,0,0|2,0,0]=4 5451 B13R1.713 CC(C)OC(C#N)c1ccccc1 Amb25323301 [0,2,0,0,0,0|1,0,1]=4 5452 B13R1.713 CC(C)\C=C(/C=O)\c1ccccc1 Amb21618696 [0,2,0,0,0,0|1,0,0]=3 5453 B13R1.713 CC(C)\C=C(/CO)\c1ccccc1 Amb25113870 [0,2,0,0,0,0|1,0,1]=4 5454 B13R1.713 CC(C)\C=C(\CO)/c1ccccc1 Amb25216807 [0,2,0,0,0,0|1,0,1]=4 5455 B13R1.713 CC(O)\C=C(\C#C)/c1ccccc1 Amb24431905 [0,2,0,0,0,0|2,0,0]=4 5456 B13R1.713 CC(\C=C(\c1ccccc1)/C#N)C Amb17232821 [0,2,0,0,0,0|2,0,0]=4 5457 B13R1.713 CN(C)\C=C(\C=O)/c1ccccc1 Amb24712659 [0,2,0,0,0,0|2,0,0]=4 5458 B13R1.713 CN(C)\N=C(/C=O)\c1ccccc1 Amb18127767 [0,2,0,0,0,0|2,0,0]=4 5459 B13R1.713 C\N=C(\NC(C)C)/c1ccccc1 Amb25805222 [0,2,0,0,0,0|2,0,0]=4 5460 B13R1.713 NCC(c1ccccc1)OC(C)C Amb17605965 [0,2,0,0,0,0|1,0,1]=4 5461 B13R1.713 O=C\C(=C/N(C)C)\c1ccccc1 Amb17335056 [0,2,0,0,0,0|2,0,0]=4 5462 B13R1.713 O=C\C(=C\C(F)F)\c1ccccc1 Amb24676774 [0,2,0,0,0,0|2,0,0]=4 5463 B13R1.17 BrCCCC(=O)c1ccc(cc1)C Amb17255484 [0,2,0,0,0,0|1,0,0]=3 5464 B13R1.17 BrCCCC(=O)c1ccc(cc1)Cl Amb17268805 [0,2,0,0,0,0|1,0,0]=3 5465 B13R1.17 BrCCCC(=O)c1ccc(cc1)F Amb17257478 [0,2,0,0,0,0|1,0,0]=3 5466 B13R1.17 BrCC\C=C(\c1ccc(cc1)C)/C Amb17254612 [0,2,0,0,0,0|2,0,0]=4 5467 B13R1.17 BrCC\C=C(\c1ccc(cc1)Cl)/C Amb17267353 [0,2,0,0,0,0|2,0,0]=4 5468 B13R1.17 BrCC\C=C(\c1ccc(cc1)F)/C Amb17256417 [0,2,0,0,0,0|2,0,0]=4 5469 B13R1.17 C#CCCC(=O)c1ccc(Br)cc1 Amb18636141 [0,2,0,0,0,0|1,0,1]=4 5470 B13R1.17 C#CCCC(=O)c1ccc(Cl)cc1 Amb18118077 [0,2,0,0,0,0|1,0,1]=4 5471 B13R1.17 C#CCCC(=O)c1ccc(F)cc1 Amb18636117 [0,2,0,0,0,0|1,0,1]=4 5472 B13R1.17 C#CCCC(=O)c1ccc(N)cc1 Amb24698247 [0,2,0,0,0,0|1,0,1]=4 5473 B13R1.17 C#CCOC(=O)c1ccc(Br)cc1 Amb21525232 [0,2,0,0,0,0|0,0,1]=3 5474 B13R1.17 C#CCOC(=O)c1ccc(I)cc1 Amb24734731 [0,2,0,0,0,0|0,0,1]=3 5475 B13R1.17 C#CCOC(=O)c1ccc(N)cc1 Amb24391549 [0,2,0,0,0,0|0,0,1]=3 5476 B13R1.17 C#CCOC(=O)c1ccc(O)cc1 Amb18929622 [0,2,0,0,0,0|0,0,1]=3 5477 B13R1.17 C=CCNC(=O)c1ccc(cc1)C Amb2552445 [0,2,0,0,0,0|1,0,1]=4 5478 B13R1.17 C=CCNC(=O)c1ccc(cc1)Cl Amb2457969 [0,2,0,0,0,0|1,0,1]=4 5479 B13R1.17 C=CCNC(=O)c1ccc(cc1)I Amb1770773 [0,2,0,0,0,0|1,0,1]=4 5480 B13R1.17 C=CCOC(=O)c1ccc(Cl)cc1 Amb24092505 [0,2,0,0,0,0|0,0,1]=3 5481 B13R1.17 C=CCOC(=O)c1ccc(O)cc1 Amb18128069 [0,2,0,0,0,0|0,0,1]=3 5482 B13R1.17 CC#CCC(=O)c1ccc(Br)cc1 Amb25260653 [0,2,0,0,0,0|1,0,1]=4 5483 B13R1.17 CC#CCC(=O)c1ccc(Cl)cc1 Amb19061627 [0,2,0,0,0,0|1,0,1]=4 5484 B13R1.17 CC#CCC(=O)c1ccc(F)cc1 Amb18184039 [0,2,0,0,0,0|1,0,1]=4 5485 B13R1.17 CC#CCC(=O)c1ccc(N)cc1 Amb25155948 [0,2,0,0,0,0|1,0,1]=4 5486 B13R1.17 CC(OCCN)c1ccc(Br)cc1 Amb18071618 [0,2,0,0,0,0|1,0,1]=4 5487 B13R1.17 CCCCC(=O)c1ccc(cc1)F Amb1233185 [0,2,0,0,0,0|1,0,0]=3 5488 B13R1.17 CCCCC(=O)c1ccc(cc1)N Amb17138824 [0,2,0,0,0,0|1,0,0]=3 5489 B13R1.17 CCCNC(=O)C1=CNC(=O)C=C1 Amb18186545 [0,2,0,0,0,0|2,0,0]=4 5490 B13R1.17 CCCNC(=O)c1c[n]c(F)cc1 Amb25678433 [0,2,0,0,0,0|2,0,0]=4 5491 B13R1.17 CCCNC(=O)c1c[n]c(N)cc1 Amb18295533 [0,2,0,0,0,0|2,0,0]=4 5492 B13R1.17 CCCNC(=O)c1ccc(Cl)c[n]1 Amb25083919 [0,2,0,0,0,0|2,0,0]=4 5493 B13R1.17 CCCNC(=O)c1ccc(N)c[n]1 Amb25744147 [0,2,0,0,0,0|2,0,0]=4 5494 B13R1.17 CCCNC(=O)c1ccc(S)cc1 Amb24495186 [0,2,0,0,0,0|1,0,0]=3 5495 B13R1.17 CCCNC(=O)c1ccc(cc1)N Amb1112696 [0,2,0,0,0,0|1,0,0]=3 5496 B13R1.17 CCCNC(=O)c1ccc(cn1)Br Amb10068261 [0,2,0,0,0,0|2,0,0]=4 5497 B13R1.17 CCCNC(=S)c1ccc(Cl)cc1 Amb25253513 [0,2,0,0,0,0|1,1,0]=4 5498 B13R1.17 CCCNC(=S)c1ccc(cc1)Br Amb1091837 [0,2,0,0,0,0|1,1,0]=4 5499 B13R1.17 CCCNS(=O)c1ccc(N)cc1 Amb18864175 [0,2,0,0,0,0|2,0,0]=4 5500 B13R1.17 CCCOC(=O)C1=CNC(=O)C=C1 Amb18184978 [0,2,0,0,0,0|1,0,0]=3 5501 B13R1.17 CCCOC(=O)C1=COC(=O)C=C1 Amb19772200 [0,2,0,0,0,0|1,0,0]=3 5502 B13R1.17 CCCOC(=O)C=1C=CC(=O)NN1 Amb23401889 [0,2,0,0,0,0|2,0,0]=4 5503 B13R1.17 CCCOC(=O)c1[n]cc(O)c[n]1 Amb22499487 [0,2,0,0,0,0|2,0,0]=4 5504 B13R1.17 CCCOC(=O)c1cc[n+](C)cc1 Amb22474978 [0,2,0,0,0,0|1,0,0]=3 5505 B13R1.17 CCCOC(=O)c1ccc(Cl)[n][n]1 Amb22490785 [0,2,0,0,0,0|2,0,0]=4 5506 B13R1.17 CCCOC(=O)c1ccc([O-])cc1 Amb21928228 [0,2,0,0,0,0|0,0,0]=2 5507 B13R1.17 CCCOC(C)c1ccc(Br)cc1 Amb23443735 [0,2,0,0,0,0|1,0,1]=4 5508 B13R1.17 CCNCC(=O)c1ccc(N)cc1 Amb18550894 [0,2,0,0,0,0|1,0,0]=3 5509 B13R1.17 CCNCC(=O)c1ccc(cc1)F Amb17314099 [0,2,0,0,0,0|1,0,0]=3 5510 B13R1.17 CCONC(=O)C1=CNC(=O)C=N1 Amb25807255 [0,2,0,0,0,0|2,0,0]=4 5511 B13R1.17 CCONC(=O)c1c[n]c(Cl)[n]c1 Amb24412417 [0,2,0,0,0,0|2,0,0]=4 5512 B13R1.17 CCONC(=O)c1c[n]c(N)c[n]1 Amb24720378 [0,2,0,0,0,0|2,0,0]=4 5513 B13R1.17 CCONC(=O)c1cc[n+]([O-])cc1 Amb25672076 [0,2,0,0,0,0|1,0,0]=3 5514 B13R1.17 CCONC(=O)c1ccc(Br)[n][n]1 Amb25672077 [0,2,0,0,0,0|2,0,0]=4 5515 B13R1.17 CCONC(=O)c1ccc(Br)[n]c1 Amb24659451 [0,2,0,0,0,0|1,0,0]=3 5516 B13R1.17 CCONC(=O)c1ccc(Br)c[n]1 Amb25815201 [0,2,0,0,0,0|1,0,0]=3 5517 B13R1.17 CCONC(=O)c1ccc(Br)cc1 Amb20813597 [0,2,0,0,0,0|0,0,0]=2 5518 B13R1.17 CCONC(=O)c1ccc(Cl)[n][n]1 Amb25346502 [0,2,0,0,0,0|2,0,0]=4 5519 B13R1.17 CCONC(=O)c1ccc(Cl)c[n]1 Amb24455403 [0,2,0,0,0,0|1,0,0]=3 5520 B13R1.17 CCONC(=O)c1ccc(Cl)cc1 Amb25704919 [0,2,0,0,0,0|0,0,0]=2 5521 B13R1.17 CCONC(=O)c1ccc(F)[n]c1 Amb25819882 [0,2,0,0,0,0|1,0,0]=3 5522 B13R1.17 CCONC(=O)c1ccc(F)c[n]1 Amb24619759 [0,2,0,0,0,0|1,0,0]=3 5523 B13R1.17 CCONC(=O)c1ccc(N)c[n]1 Amb25742763 [0,2,0,0,0,0|1,0,0]=3 5524 B13R1.17 CCONC(=O)c1ccc(nc1)Cl Amb11278325 [0,2,0,0,0,0|1,0,0]=3 5525 B13R1.17 CCO\N=C(/N)\c1ccc(Br)cc1 Amb18227772 [0,2,0,0,0,0|1,0,0]=3 5526 B13R1.17 CCO\N=C(/N)\c1ccc(Cl)cc1 Amb18225012 [0,2,0,0,0,0|1,0,0]=3 5527 B13R1.17 CCO\N=C(/N)\c1ccc(F)cc1 Amb18224739 [0,2,0,0,0,0|1,0,0]=3 5528 B13R1.17 CCSCC(=O)c1ccc(cc1)N Amb17202017 [0,2,0,0,0,0|0,1,0]=3 5529 B13R1.17 CC\C=C\C(=O)c1ccc(Br)cc1 Amb25329848 [0,2,0,0,0,0|1,0,0]=3 5530 B13R1.17 CC\C=C\C(=O)c1ccc(Cl)cc1 Amb24595289 [0,2,0,0,0,0|1,0,0]=3 5531 B13R1.17 CNCCC(=O)c1ccc(F)cc1 Amb23458615 [0,2,0,0,0,0|1,0,0]=3 5532 B13R1.17 CNCCC(=O)c1ccc(cc1)Br Amb17349007 [0,2,0,0,0,0|1,0,0]=3 5533 B13R1.17 CNCCC(=O)c1ccc(cc1)C Amb17335181 [0,2,0,0,0,0|1,0,0]=3 5534 B13R1.17 CNCCC(=O)c1ccc(cc1)Cl Amb17337252 [0,2,0,0,0,0|1,0,0]=3 5535 B13R1.17 CNCCC(=O)c1ccc(cc1)F Amb17335484 [0,2,0,0,0,0|1,0,0]=3 5536 B13R1.17 CN\C=C\C(=O)c1ccc(F)cc1 Amb25190609 [0,2,0,0,0,0|1,0,1]=4 5537 B13R1.17 COCCC(=O)c1ccc(cc1)C Amb17233414 [0,2,0,0,0,0|1,0,0]=3 5538 B13R1.17 COCCC(=O)c1ccc(cc1)N Amb17202007 [0,2,0,0,0,0|1,0,0]=3 5539 B13R1.17 C\C(=C\CCBr)\c1ccc(F)cc1 Amb24458171 [0,2,0,0,0,0|2,0,0]=4 5540 B13R1.17 C\C(=C\CCN)\c1ccc(Br)cc1 Amb25118420 [0,2,0,0,0,0|2,0,0]=4 5541 B13R1.17 C\C(=C\CCN)\c1ccc(I)cc1 Amb25782743 [0,2,0,0,0,0|2,0,0]=4 5542 B13R1.17 C\C(=C\CNC)\c1ccc(Br)cc1 Amb24685017 [0,2,0,0,0,0|2,0,0]=4 5543 B13R1.17 C\C(=C\CNC)\c1ccc(Cl)cc1 Amb24396190 [0,2,0,0,0,0|2,0,0]=4 5544 B13R1.17 C\C(=N\OCC)\c1ccc(Cl)c[n]1 Amb24347542 [0,2,0,0,0,0|2,0,0]=4 5545 B13R1.17 C\C(=N\OCC)\c1ccc(Cl)cc1 Amb24474094 [0,2,0,0,0,0|1,0,0]=3 5546 B13R1.17 C\C(=N\OCC)\c1ccc(F)c[n]1 Amb25711958 [0,2,0,0,0,0|2,0,0]=4 5547 B13R1.17 C\C(=N\OCC)\c1ccc(F)cc1 Amb25358453 [0,2,0,0,0,0|1,0,0]=3 5548 B13R1.17 C\C(=N\OCC)\c1ccc(I)cc1 Amb25853247 [0,2,0,0,0,0|1,0,0]=3 5549 B13R1.17 C\C(=N\OCC)\c1ccc(N)cc1 Amb24733814 [0,2,0,0,0,0|1,0,0]=3 5550 B13R1.17 C\C=N\NC(=O)c1ccc(cc1)Br Amb2465871 [0,2,0,0,0,0|1,0,1]=4 5551 B13R1.17 C\C=N\NC(=O)c1ccc(cc1)Cl Amb1675058 [0,2,0,0,0,0|1,0,1]=4 5552 B13R1.17 C\C=N\NC(=O)c1ccc(cc1)O Amb1628305 [0,2,0,0,0,0|1,0,1]=4 5553 B13R1.17 Cc1c[n]c(cc1)C(=O)NCCO Amb25099832 [0,2,0,0,0,0|2,0,0]=4 5554 B13R1.17 Cc1ccc([n]c1)C(=O)NOCC Amb25323374 [0,2,0,0,0,0|1,0,0]=3 5555 B13R1.17 Cc1ccc(c[n]1)C(=O)CCCN Amb18824862 [0,2,0,0,0,0|2,0,0]=4 5556 B13R1.17 Cc1ccc(c[n]1)C(=O)NCCCl Amb18316690 [0,2,0,0,0,0|2,0,0]=4 5557 B13R1.17 Cc1ccc(c[n]1)C(=O)NCCF Amb25032860 [0,2,0,0,0,0|2,0,0]=4 5558 B13R1.17 Cc1ccc(c[n]1)C(=O)NCCI Amb24534465 [0,2,0,0,0,0|2,0,0]=4 5559 B13R1.17 Cc1ccc(c[n]1)C(=O)OCC#N Amb24590870 [0,2,0,0,0,0|1,0,1]=4 5560 B13R1.17 Cc1ccc(cc1)C(=N)NCCC Amb25187703 [0,2,0,0,0,0|2,0,0]=4 5561 B13R1.17 Cc1ccc(cc1)C(=O)C=C=CC Amb24647782 [0,2,0,0,0,0|1,0,1]=4 5562 B13R1.17 Cc1ccc(cc1)C(=O)CC#CC Amb18183691 [0,2,0,0,0,0|1,0,1]=4 5563 B13R1.17 Cc1ccc(cc1)C(=O)CCC#C Amb18118076 [0,2,0,0,0,0|1,0,1]=4 5564 B13R1.17 Cc1ccc(cc1)C(=O)CCCN Amb18623672 [0,2,0,0,0,0|1,0,0]=3 5565 B13R1.17 Cc1ccc(cc1)C(=O)C\C=C\C Amb25373277 [0,2,0,0,0,0|1,0,1]=4 5566 B13R1.17 Cc1ccc(cc1)C(=O)NCC#C Amb18185768 [0,2,0,0,0,0|1,0,1]=4 5567 B13R1.17 Cc1ccc(cc1)C(=O)NCCN Amb19514976 [0,2,0,0,0,0|1,0,0]=3 5568 B13R1.17 Cc1ccc(cc1)C(=O)N\C=C\C Amb25229949 [0,2,0,0,0,0|1,0,1]=4 5569 B13R1.17 Cc1ccc(cc1)C(=O)OCC#N Amb25297175 [0,2,0,0,0,0|0,0,1]=3 5570 B13R1.17 Cc1ccc(cc1)C(=O)OCCBr Amb24065429 [0,2,0,0,0,0|0,0,0]=2 5571 B13R1.17 Cc1ccc(cc1)C(=O)\C=C/NC Amb25826672 [0,2,0,0,0,0|1,0,1]=4 5572 B13R1.17 Cc1ccc(cc1)C(=O)\C=C\CC Amb25341827 [0,2,0,0,0,0|1,0,0]=3 5573 B13R1.17 Cc1ccc(cc1)C(=O)\C=C\CO Amb24544650 [0,2,0,0,0,0|1,0,1]=4 5574 B13R1.17 Cc1ccc(cc1)C(=O)\C=C\OC Amb25358882 [0,2,0,0,0,0|1,0,1]=4 5575 B13R1.17 Cc1ccc(cc1)C(=S)NCCC Amb25191843 [0,2,0,0,0,0|1,1,0]=4 5576 B13R1.17 Cc1ccc(cc1)\C(\C)=C/CCBr Amb25678999 [0,2,0,0,0,0|2,0,0]=4 5577 B13R1.17 Cc1ccc(cc1)\C(\C)=C/CCO Amb24431785 [0,2,0,0,0,0|2,0,0]=4 5578 B13R1.17 Cc1ccc(cc1)\C(\C)=C/CNC Amb25721188 [0,2,0,0,0,0|2,0,0]=4 5579 B13R1.17 Cc1ccc(cc1)\C(\N)=N\OCC Amb18224608 [0,2,0,0,0,0|1,0,0]=3 5580 B13R1.17 ClCCCC(=O)c1ccc(cc1)N Amb17202013 [0,2,0,0,0,0|1,0,0]=3 5581 B13R1.17 ClCCNC(=O)c1ccc(cc1)Br Amb17103206 [0,2,0,0,0,0|1,0,0]=3 5582 B13R1.17 ClCCNC(=O)c1ccc(cc1)Cl Amb17103234 [0,2,0,0,0,0|1,0,0]=3 5583 B13R1.17 ClCCNC(=O)c1ccc(cc1)F Amb17103203 [0,2,0,0,0,0|1,0,0]=3 5584 B13R1.17 ClCC\C=C(\c1ccc(cc1)Br)/C Amb17267355 [0,2,0,0,0,0|2,0,0]=4 5585 B13R1.17 ClCC\C=C(\c1ccc(cc1)C)/C Amb17236136 [0,2,0,0,0,0|2,0,0]=4 5586 B13R1.17 ClCC\C=C(\c1ccc(cc1)Cl)/C Amb17241874 [0,2,0,0,0,0|2,0,0]=4 5587 B13R1.17 ClCC\C=C(\c1ccc(cc1)F)/C Amb17236847 [0,2,0,0,0,0|2,0,0]=4 5588 B13R1.17 N#CCCC(=O)c1ccc(cc1)C Amb2436500 [0,2,0,0,0,0|1,0,1]=4 5589 B13R1.17 N#CCCC(=O)c1ccc(cc1)Cl Amb2433159 [0,2,0,0,0,0|1,0,1]=4 5590 B13R1.17 N#CCCC(=O)c1ccc(cc1)O Amb17133644 [0,2,0,0,0,0|1,0,1]=4 5591 B13R1.17 N#CCNC(=O)c1ccc(O)cc1 Amb18180565 [0,2,0,0,0,0|1,0,1]=4 5592 B13R1.17 N#CCNC(=O)c1ccc(cc1)C Amb1632834 [0,2,0,0,0,0|1,0,1]=4 5593 B13R1.17 N#CCOC(=O)c1ccc(Br)[n]c1 Amb25822760 [0,2,0,0,0,0|1,0,1]=4 5594 B13R1.17 N#CCOC(=O)c1ccc(F)[n]c1 Amb24396819 [0,2,0,0,0,0|1,0,1]=4 5595 B13R1.17 N#CCOC(=O)c1ccc(F)c[n]1 Amb25042473 [0,2,0,0,0,0|1,0,1]=4 5596 B13R1.17 N#CCOC(=O)c1ccc(O)cc1 Amb25663664 [0,2,0,0,0,0|0,0,1]=3 5597 B13R1.17 N=C1C=CN(C=C1)C(=O)CCCO Amb22343965 [0,2,0,0,0,0|2,0,0]=4 5598 B13R1.17 NCCCC(=O)c1ccc(Br)cc1 Amb18105772 [0,2,0,0,0,0|1,0,0]=3 5599 B13R1.17 NCCCC(=O)c1ccc(Cl)cc1 Amb18105773 [0,2,0,0,0,0|1,0,0]=3 5600 B13R1.17 NCCCC(=O)c1ccc(F)cc1 Amb18105774 [0,2,0,0,0,0|1,0,0]=3 5601 B13R1.17 NCCNC(=O)C1=CNC(=O)C=C1 Amb18252631 [0,2,0,0,0,0|2,0,0]=4 5602 B13R1.17 NCCNC(=O)C1=COC(=O)C=C1 Amb18970494 [0,2,0,0,0,0|2,0,0]=4 5603 B13R1.17 NCCNC(=O)c1c[n]c(Cl)cc1 Amb18290740 [0,2,0,0,0,0|2,0,0]=4 5604 B13R1.17 NCCNC(=O)c1cc[n+]([O-])cc1 Amb25295641 [0,2,0,0,0,0|2,0,0]=4 5605 B13R1.17 NCCNC(=O)c1cc[n+]([O-])cc1 Amb25781621 [0,2,0,0,0,0|2,0,0]=4 5606 B13R1.17 NCCNC(=O)c1ccc(Br)c[n]1 Amb19000785 [0,2,0,0,0,0|2,0,0]=4 5607 B13R1.17 NCCNC(=O)c1ccc(Br)c[n]1 Amb24768800 [0,2,0,0,0,0|2,0,0]=4 5608 B13R1.17 NCCNC(=O)c1ccc(Cl)c[n]1 Amb22265049 [0,2,0,0,0,0|2,0,0]=4 5609 B13R1.17 NCCNC(=O)c1ccc(Cl)c[n]1 Amb22370035 [0,2,0,0,0,0|2,0,0]=4 5610 B13R1.17 NCCNC(=O)c1ccc(F)c[n]1 Amb25844094 [0,2,0,0,0,0|2,0,0]=4 5611 B13R1.17 NCCNC(=O)c1ccc(F)cc1 Amb19373529 [0,2,0,0,0,0|1,0,0]=3 5612 B13R1.17 NCCNC(=O)c1ccc(cc1)Br Amb1138758 [0,2,0,0,0,0|1,0,0]=3 5613 B13R1.17 NCCNC(=O)c1ccc(cc1)C Amb1130582 [0,2,0,0,0,0|1,0,0]=3 5614 B13R1.17 NCCNC(=O)c1ccc(cc1)Cl Amb1136020 [0,2,0,0,0,0|1,0,0]=3 5615 B13R1.17 NCCNC(=O)c1ccc(cc1)F Amb1126919 [0,2,0,0,0,0|1,0,0]=3 5616 B13R1.17 NCCNC(=O)c1ccc(nc1)C Amb1138112 [0,2,0,0,0,0|2,0,0]=4 5617 B13R1.17 NCCOC(c1ccc(cc1)C)C Amb17079448 [0,2,0,0,0,0|1,0,1]=4 5618 B13R1.17 NCCOC(c1ccc(cc1)Cl)C Amb17079523 [0,2,0,0,0,0|1,0,1]=4 5619 B13R1.17 NCCOC(c1ccc(cc1)F)C Amb17079492 [0,2,0,0,0,0|1,0,1]=4 5620 B13R1.17 NCC\C=C(\c1ccc(cc1)Br)/C Amb17255080 [0,2,0,0,0,0|2,0,0]=4 5621 B13R1.17 NCC\C=C(\c1ccc(cc1)C)/C Amb17233136 [0,2,0,0,0,0|2,0,0]=4 5622 B13R1.17 NCC\C=C(\c1ccc(cc1)Cl)/C Amb17236337 [0,2,0,0,0,0|2,0,0]=4 5623 B13R1.17 NCC\C=C(\c1ccc(cc1)F)/C Amb17233548 [0,2,0,0,0,0|2,0,0]=4 5624 B13R1.17 Nc1ccc([n]c1)C(=O)NCCF Amb25042005 [0,2,0,0,0,0|2,0,0]=4 5625 B13R1.17 Nc1ccc([n]c1)C(=O)NCCN Amb25702907 [0,2,0,0,0,0|2,0,0]=4 5626 B13R1.17 Nc1ccc([n]c1)C(=O)OCC#N Amb24434378 [0,2,0,0,0,0|1,0,1]=4 5627 B13R1.17 Nc1ccc(c[n]1)C(=O)NCCF Amb24736821 [0,2,0,0,0,0|2,0,0]=4 5628 B13R1.17 Nc1ccc(cc1)C(=O)CCCO Amb22755517 [0,2,0,0,0,0|1,0,0]=3 5629 B13R1.17 Nc1ccc(cc1)C(=O)NCC#N Amb18952115 [0,2,0,0,0,0|1,0,1]=4 5630 B13R1.17 Nc1ccc(cc1)C(=O)NCCF Amb24437952 [0,2,0,0,0,0|1,0,0]=3 5631 B13R1.17 Nc1ccc(cc1)C(=O)NCCN Amb18290747 [0,2,0,0,0,0|1,0,0]=3 5632 B13R1.17 Nc1ccc(cc1)C(=O)OCC#N Amb18291099 [0,2,0,0,0,0|0,0,1]=3 5633 B13R1.17 O=C(CCCI)c1ccc(F)cc1 Amb24066073 [0,2,0,0,0,0|1,0,0]=3 5634 B13R1.17 O=C(NCCBr)c1ccc(Br)c[n]1 Amb25768608 [0,2,0,0,0,0|2,0,0]=4 5635 B13R1.17 O=C(NCCCl)C1=CNC(=O)C=C1 Amb25180109 [0,2,0,0,0,0|2,0,0]=4 5636 B13R1.17 O=C(NCCCl)c1ccc(Br)c[n]1 Amb25073420 [0,2,0,0,0,0|2,0,0]=4 5637 B13R1.17 O=C(NCCCl)c1ccc(Cl)c[n]1 Amb25848180 [0,2,0,0,0,0|2,0,0]=4 5638 B13R1.17 O=C(NCCCl)c1ccc(F)c[n]1 Amb24694850 [0,2,0,0,0,0|2,0,0]=4 5639 B13R1.17 O=C(NCCCl)c1ccc(I)cc1 Amb25357717 [0,2,0,0,0,0|1,0,0]=3 5640 B13R1.17 O=C(NCCF)C1=CNC(=O)C=C1 Amb24720880 [0,2,0,0,0,0|2,0,0]=4 5641 B13R1.17 O=C(NCCF)c1c[n]c(Br)cc1 Amb24415784 [0,2,0,0,0,0|2,0,0]=4 5642 B13R1.17 O=C(NCCF)c1ccc(Br)c[n]1 Amb24679817 [0,2,0,0,0,0|2,0,0]=4 5643 B13R1.17 O=C(NCCF)c1ccc(Br)cc1 Amb25153438 [0,2,0,0,0,0|1,0,0]=3 5644 B13R1.17 O=C(NCCF)c1ccc(F)c[n]1 Amb25854803 [0,2,0,0,0,0|2,0,0]=4 5645 B13R1.17 O=C(NCCF)c1ccc(F)cc1 Amb22472484 [0,2,0,0,0,0|1,0,0]=3 5646 B13R1.17 O=C(NCCF)c1ccc(I)cc1 Amb25153439 [0,2,0,0,0,0|1,0,0]=3 5647 B13R1.17 O=C(NCCI)C1=CNC(=O)C=C1 Amb25158601 [0,2,0,0,0,0|2,0,0]=4 5648 B13R1.17 O=C(NCCI)c1ccc(Br)c[n]1 Amb25034383 [0,2,0,0,0,0|2,0,0]=4 5649 B13R1.17 O=C(NCCI)c1ccc(F)c[n]1 Amb25153701 [0,2,0,0,0,0|2,0,0]=4 5650 B13R1.17 O=C(NCCI)c1ccc(F)cc1 Amb24702138 [0,2,0,0,0,0|1,0,0]=3 5651 B13R1.17 O=C(NCCI)c1ccc(I)cc1 Amb24490595 [0,2,0,0,0,0|1,0,0]=3 5652 B13R1.17 O=C(NCCS)c1ccc(Br)cc1 Amb25066219 [0,2,0,0,0,0|1,0,0]=3 5653 B13R1.17 O=C(NCCS)c1ccc(Cl)cc1 Amb25818259 [0,2,0,0,0,0|1,0,0]=3 5654 B13R1.17 O=C(NCCS)c1ccc(F)cc1 Amb24525274 [0,2,0,0,0,0|1,0,0]=3 5655 B13R1.17 O=CCNC(=O)c1ccc(cc1)Br Amb17102074 [0,2,0,0,0,0|1,0,1]=4 5656 B13R1.17 O=CCNC(=O)c1ccc(cc1)C Amb17102068 [0,2,0,0,0,0|1,0,1]=4 5657 B13R1.17 O=CCNC(=O)c1ccc(cc1)Cl Amb17102105 [0,2,0,0,0,0|1,0,1]=4 5658 B13R1.17 O=CCNC(=O)c1ccc(cc1)F Amb17102071 [0,2,0,0,0,0|1,0,1]=4 5659 B13R1.17 OCCCC(=O)c1ccc(cc1)Br Amb17349306 [0,2,0,0,0,0|1,0,0]=3 5660 B13R1.17 OCCCC(=O)c1ccc(cc1)C Amb17335232 [0,2,0,0,0,0|1,0,0]=3 5661 B13R1.17 OCCCC(=O)c1ccc(cc1)Cl Amb17337360 [0,2,0,0,0,0|1,0,0]=3 5662 B13R1.17 OCCCC(=O)c1ccc(cc1)F Amb1110902 [0,2,0,0,0,0|1,0,0]=3 5663 B13R1.17 OCCNC(=O)C1=CNC(=O)C=C1 Amb18187061 [0,2,0,0,0,0|2,0,0]=4 5664 B13R1.17 OCCNC(=O)C1=COC(=O)C=C1 Amb18328066 [0,2,0,0,0,0|2,0,0]=4 5665 B13R1.17 OCCNC(=O)c1c[n]c(F)cc1 Amb25756398 [0,2,0,0,0,0|2,0,0]=4 5666 B13R1.17 OCCNC(=O)c1cc[n+](cc1)C Amb1790779 [0,2,0,0,0,0|2,0,0]=4 5667 B13R1.17 OCCNC(=O)c1cc[n+](cc1)C Amb2581657 [0,2,0,0,0,0|2,0,0]=4 5668 B13R1.17 OCCNC(=O)c1ccc(Br)c[n]1 Amb19356851 [0,2,0,0,0,0|2,0,0]=4 5669 B13R1.17 OCCNC(=O)c1ccc(Cl)c[n]1 Amb24370830 [0,2,0,0,0,0|2,0,0]=4 5670 B13R1.17 OCCNC(=O)c1ccc(F)c[n]1 Amb24633728 [0,2,0,0,0,0|2,0,0]=4 5671 B13R1.17 OCCNC(=O)c1ccc(S)cc1 Amb25088494 [0,2,0,0,0,0|1,0,0]=3 5672 B13R1.17 OCCNC(=O)c1ccc(cc1)Cl Amb2228542 [0,2,0,0,0,0|1,0,0]=3 5673 B13R1.17 OCCNC(=S)c1ccc(Br)cc1 Amb22356238 [0,2,0,0,0,0|1,1,0]=4 5674 B13R1.17 OCCNC(=S)c1ccc(cc1)C Amb1091835 [0,2,0,0,0,0|1,1,0]=4 5675 B13R1.17 OC\C=C\C(=O)c1ccc(F)cc1 Amb25105972 [0,2,0,0,0,0|1,0,1]=4 5676 B13R1.17 Oc1ccc(cc1)C(=O)NCCBr Amb25234531 [0,2,0,0,0,0|1,0,0]=3 5677 B13R1.17 Oc1ccc(cc1)C(=O)NCCI Amb24534466 [0,2,0,0,0,0|1,0,0]=3 5678 B13R1.17 Oc1ccc(cc1)C(=O)OCCO Amb18128983 [0,2,0,0,0,0|0,0,0]=2 5679 B13R1.17 [2H]c1ccc(cc1)C(=O)OCCBr Amb22345886 [0,2,0,0,0,0|0,0,0]=2 5680 B13R1.17 [O-][n+]1ccc(cc1)C(=O)NCCF Amb25818097 [0,2,0,0,0,0|2,0,0]=4 5681 B13R1.17 [O-][n+]1ccc(cc1)C(=O)NCCO Amb25127525 [0,2,0,0,0,0|2,0,0]=4 5682 B13R1.21 BrCC(=O)C(=O)c1ccc(cc1)C Amb17410341 [0,2,0,0,0,0|2,0,0]=4 5683 B13R1.21 BrCC(=O)C(=O)c1ccc(cc1)Cl Amb17416542 [0,2,0,0,0,0|2,0,0]=4 5684 B13R1.21 BrCC(=O)C(=O)c1ccc(cc1)F Amb17411210 [0,2,0,0,0,0|2,0,0]=4 5685 B13R1.21 CC(CCl)C(=O)c1ccc(F)cc1 Amb24611263 [0,2,0,0,0,0|2,0,0]=4 5686 B13R1.21 CC(CCl)C(=O)c1ccc(O)cc1 Amb18130561 [0,2,0,0,0,0|2,0,0]=4 5687 B13R1.21 CC(CN)C(=O)c1ccc(Cl)cc1 Amb18188155 [0,2,0,0,0,0|2,0,0]=4 5688 B13R1.21 CC(CO)C(=O)c1ccc(F)cc1 Amb24495613 [0,2,0,0,0,0|2,0,0]=4 5689 B13R1.21 CCC(=O)C(=O)c1ccc(cc1)Br Amb17410342 [0,2,0,0,0,0|1,0,0]=3 5690 B13R1.21 CCC(=O)C(=O)c1ccc(cc1)C Amb17400549 [0,2,0,0,0,0|1,0,0]=3 5691 B13R1.21 CCC(=O)C(=O)c1ccc(cc1)Cl Amb17402166 [0,2,0,0,0,0|1,0,0]=3 5692 B13R1.21 CCC(=O)C(=O)c1ccc(cc1)F Amb17400753 [0,2,0,0,0,0|1,0,0]=3 5693 B13R1.21 CCC(C(=O)c1ccc(cc1)Br)Br Amb17437807 [0,2,0,0,0,0|1,0,0]=3 5694 B13R1.21 CCC(C(=O)c1ccc(cc1)Br)N Amb17159231 [0,2,0,0,0,0|1,0,0]=3 5695 B13R1.21 CCC(C(=O)c1ccc(cc1)C)Br Amb17437802 [0,2,0,0,0,0|1,0,0]=3 5696 B13R1.21 CCC(C(=O)c1ccc(cc1)C)N Amb17138820 [0,2,0,0,0,0|1,0,0]=3 5697 B13R1.21 CCC(C(=O)c1ccc(cc1)Cl)Br Amb17437808 [0,2,0,0,0,0|1,0,0]=3 5698 B13R1.21 CCC(C(=O)c1ccc(cc1)F)Br Amb17437809 [0,2,0,0,0,0|1,0,0]=3 5699 B13R1.21 CCC(C(=O)c1ccc(cc1)F)N Amb16765989 [0,2,0,0,0,0|1,0,0]=3 5700 B13R1.21 CCC(C)C(=O)c1ccc(N)c[n]1 Amb24377788 [0,2,0,0,0,0|2,0,0]=4 5701 B13R1.21 CCC(C)S(=O)c1ccc(N)cc1 Amb18291947 [0,2,0,0,0,0|2,0,0]=4 5702 B13R1.21 CCC(Cl)C(=O)c1ccc(Br)cc1 Amb18049316 [0,2,0,0,0,0|1,0,0]=3 5703 B13R1.21 CCC(Cl)C(=O)c1ccc(Cl)cc1 Amb18049317 [0,2,0,0,0,0|1,0,0]=3 5704 B13R1.21 CCC(Cl)C(=O)c1ccc(F)cc1 Amb18049089 [0,2,0,0,0,0|1,0,0]=3 5705 B13R1.21 CCC(O)C(=O)c1ccc(O)cc1 Amb24474159 [0,2,0,0,0,0|1,0,0]=3 5706 B13R1.21 CCN(C)C(=O)C1=CNC(=O)C=C1 Amb18178808 [0,2,0,0,0,0|2,0,0]=4 5707 B13R1.21 CC[C@@H](C)C(=O)c1ccc(O)cc1 Amb25768472 [0,2,0,0,0,0|1,0,0]=3 5708 B13R1.21 CN(CC)C(=O)c1ccc(Br)[n]c1 Amb24369316 [0,2,0,0,0,0|2,0,0]=4 5709 B13R1.21 CN(CC)C(=O)c1ccc(Cl)c[n]1 Amb24474875 [0,2,0,0,0,0|2,0,0]=4 5710 B13R1.21 CN(CC)C(=O)c1ccc(Cl)cc1 Amb25740390 [0,2,0,0,0,0|1,0,0]=3 5711 B13R1.21 CN(CC)C(=O)c1ccc(F)[n]c1 Amb24653455 [0,2,0,0,0,0|2,0,0]=4 5712 B13R1.21 CN(CC)C(=O)c1ccc(F)cc1 Amb18791225 [0,2,0,0,0,0|1,0,0]=3 5713 B13R1.21 CN(CC)C(=O)c1ccc(N)[n]c1 Amb18284842 [0,2,0,0,0,0|2,0,0]=4 5714 B13R1.21 CN(CC)C(=O)c1ccc(S)cc1 Amb24495393 [0,2,0,0,0,0|1,0,0]=3 5715 B13R1.21 CN(OC)C(=O)c1ccc(I)cc1 Amb19888546 [0,2,0,0,0,0|2,0,0]=4 5716 B13R1.21 CNC(=O)C(=O)c1ccc(O)cc1 Amb25714583 [0,2,0,0,0,0|2,0,0]=4 5717 B13R1.21 CNC(=O)C(=O)c1ccc(cc1)Br Amb17349001 [0,2,0,0,0,0|2,0,0]=4 5718 B13R1.21 CNC(=O)C(=O)c1ccc(cc1)C Amb17335167 [0,2,0,0,0,0|2,0,0]=4 5719 B13R1.21 CNC(=O)C(=O)c1ccc(cc1)Cl Amb17337245 [0,2,0,0,0,0|2,0,0]=4 5720 B13R1.21 CNC(=O)C(=O)c1ccc(cc1)F Amb17335466 [0,2,0,0,0,0|2,0,0]=4 5721 B13R1.21 CNC(C(=O)c1ccc(cc1)Br)C Amb17312906 [0,2,0,0,0,0|2,0,0]=4 5722 B13R1.21 CNC(C(=O)c1ccc(cc1)C)C Amb17312656 [0,2,0,0,0,0|2,0,0]=4 5723 B13R1.21 CNC(C(=O)c1ccc(cc1)Cl)C Amb17312952 [0,2,0,0,0,0|2,0,0]=4 5724 B13R1.21 CNC(C(=O)c1ccc(cc1)F)C Amb17313013 [0,2,0,0,0,0|2,0,0]=4 5725 B13R1.21 CNC(C(=O)c1ccc(cc1)F)C Amb17614417 [0,2,0,0,0,0|2,0,0]=4 5726 B13R1.21 CNC(C)C(=O)c1ccc(N)cc1 Amb18051421 [0,2,0,0,0,0|2,0,0]=4 5727 B13R1.21 COC(=O)C(=O)c1ccc(I)cc1 Amb25844137 [0,2,0,0,0,0|2,0,0]=4 5728 B13R1.21 COC(=O)C(=O)c1ccc(O)cc1 Amb18128547 [0,2,0,0,0,0|2,0,0]=4 5729 B13R1.21 COC(=O)C(=O)c1ccc(cc1)Br Amb17349298 [0,2,0,0,0,0|2,0,0]=4 5730 B13R1.21 COC(=O)C(=O)c1ccc(cc1)C Amb17335210 [0,2,0,0,0,0|2,0,0]=4 5731 B13R1.21 COC(=O)C(=O)c1ccc(cc1)Cl Amb10562341 [0,2,0,0,0,0|2,0,0]=4 5732 B13R1.21 COC(=O)C(=O)c1ccc(cc1)F Amb17335522 [0,2,0,0,0,0|2,0,0]=4 5733 B13R1.21 CSC(C)C(=O)c1ccc(Br)cc1 Amb24356936 [0,2,0,0,0,0|2,0,0]=4 5734 B13R1.21 CSC(C)C(=O)c1ccc(F)cc1 Amb19055166 [0,2,0,0,0,0|2,0,0]=4 5735 B13R1.21 C[C@@H](CO)C(=O)c1ccc(Cl)cc1 Amb24412996 [0,2,0,0,0,0|2,0,0]=4 5736 B13R1.21 C\C(=C/C)\C(=O)c1ccc(O)cc1 Amb25359006 [0,2,0,0,0,0|1,0,1]=4 5737 B13R1.21 C\C(=C\C)\C(=O)c1ccc(O)cc1 Amb25262706 [0,2,0,0,0,0|1,0,1]=4 5738 B13R1.21 C\C=C(\C)/C(=O)c1ccc(C)cc1 Amb25370756 [0,2,0,0,0,0|1,0,1]=4 5739 B13R1.21 Cc1ccc(c[n]1)C(=O)C(N)CC Amb25192409 [0,2,0,0,0,0|2,0,0]=4 5740 B13R1.21 Cc1ccc(c[n]1)C(=O)N(C)CC Amb25098369 [0,2,0,0,0,0|2,0,0]=4 5741 B13R1.21 Cc1ccc(cc1)C(=O)C(C)CN Amb18195913 [0,2,0,0,0,0|2,0,0]=4 5742 B13R1.21 Cc1ccc(cc1)C(=O)C(C)NC Amb18540236 [0,2,0,0,0,0|2,0,0]=4 5743 B13R1.21 Cc1ccc(cc1)C(=O)C(C)SC Amb18321261 [0,2,0,0,0,0|2,0,0]=4 5744 B13R1.21 Cc1ccc(cc1)C(=O)C(Cl)CC Amb18048914 [0,2,0,0,0,0|1,0,0]=3 5745 B13R1.21 Cc1ccc(cc1)C(=O)C(F)CO Amb24084170 [0,2,0,0,0,0|2,0,0]=4 5746 B13R1.21 Cc1ccc(cc1)C(=O)C(N)CO Amb25074464 [0,2,0,0,0,0|2,0,0]=4 5747 B13R1.21 Cc1ccc(cc1)C(=O)C(O)SC Amb22471670 [0,2,0,0,0,0|2,0,0]=4 5748 B13R1.21 Cc1ccc(cc1)C(=O)\C(\O)=C\C Amb25838689 [0,2,0,0,0,0|1,0,1]=4 5749 B13R1.21 ClCC(C(=O)c1ccc(cc1)Br)Cl Amb17371795 [0,2,0,0,0,0|2,0,0]=4 5750 B13R1.21 ClCC(C(=O)c1ccc(cc1)C)Br Amb17358595 [0,2,0,0,0,0|2,0,0]=4 5751 B13R1.21 ClCC(C(=O)c1ccc(cc1)C)Cl Amb17340710 [0,2,0,0,0,0|2,0,0]=4 5752 B13R1.21 ClCC(C(=O)c1ccc(cc1)Cl)Br Amb17371794 [0,2,0,0,0,0|2,0,0]=4 5753 B13R1.21 ClCC(C(=O)c1ccc(cc1)Cl)Cl Amb17347590 [0,2,0,0,0,0|2,0,0]=4 5754 B13R1.21 ClCC(C(=O)c1ccc(cc1)F)Br Amb17361080 [0,2,0,0,0,0|2,0,0]=4 5755 B13R1.21 ClCC(C(=O)c1ccc(cc1)F)Cl Amb17341867 [0,2,0,0,0,0|2,0,0]=4 5756 B13R1.21 O=C(C(Br)CBr)c1ccc(F)cc1 Amb24400289 [0,2,0,0,0,0|2,0,0]=4 5757 B13R1.21 Oc1ccc(cc1)C(=O)[C@@H](O)CO Amb24344324 [0,2,0,0,0,0|2,0,0]=4 5758 B13R1.29 CCCP(O)(=O)c1ccc(N)cc1 Amb25322087 [0,2,0,0,0,0|2,0,0]=4 5759 B13R1.29 CCCS(=O)(=O)c1ccc(Br)cc1 Amb18065195 [0,2,0,0,0,0|2,0,0]=4 5760 B13R1.29 CCCS(=O)(=O)c1ccc(Cl)cc1 Amb25220282 [0,2,0,0,0,0|2,0,0]=4 5761 B13R1.29 CCCS(=O)(=O)c1ccc(O)cc1 Amb22449200 [0,2,0,0,0,0|2,0,0]=4 5762 B13R1.29 CCNS(=O)(=O)c1ccc(S)cc1 Amb24456814 [0,2,0,0,0,0|2,0,0]=4 5763 B13R1.29 CCNS(=O)(=O)c1ccc(cc1)Br Amb1570719 [0,2,0,0,0,0|2,0,0]=4 5764 B13R1.29 CCNS(=O)(=O)c1ccc(cc1)N Amb1129488 [0,2,0,0,0,0|2,0,0]=4 5765 B13R1.29 CCOP(=O)(Cl)c1ccc(N)cc1 Amb24597707 [0,2,0,0,0,0|1,0,0]=3 5766 B13R1.29 CCOS(=O)(=O)c1ccc(F)cc1 Amb25209086 [0,2,0,0,0,0|1,0,0]=3 5767 B13R1.29 CCOS(=O)(=O)c1ccc(cc1)O Amb17613792 [0,2,0,0,0,0|1,0,0]=3 5768 B13R1.29 CCSS(=O)(=O)c1ccc(N)cc1 Amb25365201 [0,2,0,0,0,0|1,1,0]=4 5769 B13R1.29 C[Si](C)(OCC)c1ccc(O)cc1 Amb24344198 [0,2,0,0,0,0|1,1,0]=4 5770 B13R1.29 Cc1ccc(cc1)P(=O)(=O)OCC Amb20246811 [0,2,0,0,0,0|1,0,0]=3 5771 B13R1.29 Cc1ccc(cc1)S(=O)(=O)NCC Amb22731034 [0,2,0,0,0,0|2,0,0]=4 5772 B13R1.29 Cc1ccc(cc1)S(=O)(=O)OCC Amb22284535 [0,2,0,0,0,0|1,0,0]=3 5773 B13R1.29 Cc1ccc(cc1)S(=O)(=O)OCCl Amb20248148 [0,2,0,0,0,0|2,0,0]=4 5774 B13R1.29 Cc1ccc(cc1)S(=O)(=O)OCF Amb22737786 [0,2,0,0,0,0|2,0,0]=4 5775 B13R1.29 Cc1ccc(cc1)S(=O)(=O)ONC Amb25353774 [0,2,0,0,0,0|2,0,0]=4 5776 B13R1.132 CC(=C)CC(=O)c1ccc(Br)cc1 Amb18071332 [0,2,0,0,0,0|1,0,1]=4 5777 B13R1.132 CC(=C)CC(=O)c1ccc(Cl)cc1 Amb18066346 [0,2,0,0,0,0|1,0,1]=4 5778 B13R1.132 CC(=C)CC(=O)c1ccc(F)cc1 Amb18065745 [0,2,0,0,0,0|1,0,1]=4 5779 B13R1.132 CC(=C)CC(=O)c1ccc(I)cc1 Amb25715081 [0,2,0,0,0,0|1,0,1]=4 5780 B13R1.132 CC(=C)CC(=O)c1ccc(N)cc1 Amb25843570 [0,2,0,0,0,0|1,0,1]=4 5781 B13R1.132 CC(=O)CC(=O)c1ccc(I)cc1 Amb25040567 [0,2,0,0,0,0|1,0,1]=4 5782 B13R1.132 CC(=O)CC(=O)c1ccc(O)cc1 Amb18128073 [0,2,0,0,0,0|1,0,1]=4 5783 B13R1.132 CC(=O)CC(=O)c1ccc(cc1)C Amb1209108 [0,2,0,0,0,0|1,0,1]=4 5784 B13R1.132 CC(=O)NC(=O)c1ccc(F)cc1 Amb18178968 [0,2,0,0,0,0|1,0,1]=4 5785 B13R1.132 CC(=O)NC(=O)c1ccc(I)cc1 Amb25779064 [0,2,0,0,0,0|1,0,1]=4 5786 B13R1.132 CC(=O)NC(=O)c1ccc(O)cc1 Amb18128318 [0,2,0,0,0,0|1,0,1]=4 5787 B13R1.132 CC(C)=CC(=O)c1ccc(Cl)cc1 Amb25855876 [0,2,0,0,0,0|1,0,1]=4 5788 B13R1.132 CC(C)=CC(=O)c1ccc(F)cc1 Amb24567517 [0,2,0,0,0,0|1,0,1]=4 5789 B13R1.132 CC(C)=CC(=O)c1ccc(N)cc1 Amb24411218 [0,2,0,0,0,0|1,0,1]=4 5790 B13R1.132 CC(C)=CC(=O)c1ccc(O)cc1 Amb25116064 [0,2,0,0,0,0|1,0,1]=4 5791 B13R1.132 CC(C)CC(=O)c1ccc(Br)c[n]1 Amb25229902 [0,2,0,0,0,0|2,0,0]=4 5792 B13R1.132 CC(C)CC(=O)c1ccc(O)[n]c1 Amb25205763 [0,2,0,0,0,0|2,0,0]=4 5793 B13R1.132 CC(C)CS(=O)c1ccc(Br)cc1 Amb22371609 [0,2,0,0,0,0|2,0,0]=4 5794 B13R1.132 CC(C)CS(=O)c1ccc(N)cc1 Amb18302288 [0,2,0,0,0,0|2,0,0]=4 5795 B13R1.132 CC(C)CS(=O)c1ccc(O)cc1 Amb24494255 [0,2,0,0,0,0|2,0,0]=4 5796 B13R1.132 CC(C)NC(=N)c1ccc(Br)cc1 Amb24372340 [0,2,0,0,0,0|2,0,0]=4 5797 B13R1.132 CC(C)NC(=N)c1ccc(N)cc1 Amb24425514 [0,2,0,0,0,0|2,0,0]=4 5798 B13R1.132 CC(C)NC(=N)c1ccc(O)cc1 Amb25262990 [0,2,0,0,0,0|2,0,0]=4 5799 B13R1.132 CC(C)NC(=O)C1=CNC(=O)C=C1 Amb18809305 [0,2,0,0,0,0|2,0,0]=4 5800 B13R1.132 CC(C)NC(=O)C1=COC(=O)C=C1 Amb24704208 [0,2,0,0,0,0|2,0,0]=4 5801 B13R1.132 CC(C)NC(=O)c1ccc(Cl)c[n]1 Amb25099587 [0,2,0,0,0,0|2,0,0]=4 5802 B13R1.132 CC(C)NC(=O)c1ccc(F)[n]c1 Amb25726164 [0,2,0,0,0,0|2,0,0]=4 5803 B13R1.132 CC(C)NC(=O)c1ccc(F)c[n]1 Amb25376767 [0,2,0,0,0,0|2,0,0]=4 5804 B13R1.132 CC(C)NC(=O)c1ccc(N)[n]c1 Amb18284688 [0,2,0,0,0,0|2,0,0]=4 5805 B13R1.132 CC(C)NC(=S)c1ccc(Cl)cc1 Amb25253562 [0,2,0,0,0,0|1,1,0]=4 5806 B13R1.132 CC(C)NS(=O)c1ccc(N)cc1 Amb18225002 [0,2,0,0,0,0|2,0,0]=4 5807 B13R1.132 CC(C)OC(=O)C=1C=CC(=S)NC1 Amb25742507 [0,2,0,0,0,0|1,0,0]=3 5808 B13R1.132 CC(C)OC(=O)c1ccc(Br)[n]c1 Amb24449739 [0,2,0,0,0,0|1,0,0]=3 5809 B13R1.132 CC(C)OC(=O)c1ccc(Br)c[n]1 Amb24759647 [0,2,0,0,0,0|1,0,0]=3 5810 B13R1.132 CC(C)OC(=O)c1ccc(Cl)[n][n]1 Amb19957705 [0,2,0,0,0,0|2,0,0]=4 5811 B13R1.132 CC(C)OC(=O)c1ccc(Cl)[n]c1 Amb22167146 [0,2,0,0,0,0|1,0,0]=3 5812 B13R1.132 CC(C)OC(=O)c1ccc(N)[n][n]1 Amb25732707 [0,2,0,0,0,0|2,0,0]=4 5813 B13R1.132 CC(C)OC(=O)c1ccc(N)[n]c1 Amb22831621 [0,2,0,0,0,0|1,0,0]=3 5814 B13R1.132 CC(C)OC(=O)c1ccc(S)cc1 Amb24452390 [0,2,0,0,0,0|0,0,0]=2 5815 B13R1.132 CC(C)OC(C)c1ccc(Br)cc1 Amb23443734 [0,2,0,0,0,0|1,0,1]=4 5816 B13R1.132 CC(C)OC(C)c1ccc(N)cc1 Amb18292845 [0,2,0,0,0,0|1,0,1]=4 5817 B13R1.132 CC(CC(=O)c1ccc(cc1)N)C Amb17101638 [0,2,0,0,0,0|1,0,0]=3 5818 B13R1.132 CC(CC(=O)c1ccc(cc1)O)C Amb17233400 [0,2,0,0,0,0|1,0,0]=3 5819 B13R1.132 CC(Cl)CC(=O)c1ccc(Cl)cc1 Amb25081389 [0,2,0,0,0,0|1,0,0]=3 5820 B13R1.132 CC(Cl)CC(=O)c1ccc(F)cc1 Amb24669020 [0,2,0,0,0,0|1,0,0]=3 5821 B13R1.132 CC(N)CC(=O)c1ccc(F)cc1 Amb20669281 [0,2,0,0,0,0|1,0,0]=3 5822 B13R1.132 CC(N)CC(=O)c1ccc(F)cc1 Amb22059436 [0,2,0,0,0,0|1,0,0]=3 5823 B13R1.132 CC(N)CC(=O)c1ccc(I)cc1 Amb25683902 [0,2,0,0,0,0|1,0,0]=3 5824 B13R1.132 CC(N)CC(=O)c1ccc(O)cc1 Amb24391918 [0,2,0,0,0,0|1,0,0]=3 5825 B13R1.132 CC(NC(=O)c1ccc(cc1)Cl)C Amb1251856 [0,2,0,0,0,0|1,0,0]=3 5826 B13R1.132 CC(NC(=O)c1ccc(cc1)N)C Amb1118876 [0,2,0,0,0,0|1,0,0]=3 5827 B13R1.132 CC(NC(=O)c1ccc(cn1)Br)C Amb10068271 [0,2,0,0,0,0|2,0,0]=4 5828 B13R1.132 CC(O)CC(=C)c1ccc(F)cc1 Amb25847861 [0,2,0,0,0,0|2,0,0]=4 5829 B13R1.132 CC(OC(=O)c1ccc(cc1)Cl)C Amb17509361 [0,2,0,0,0,0|0,0,0]=2 5830 B13R1.132 CC(OC(=O)c1ccc(cc1)F)C Amb17509362 [0,2,0,0,0,0|0,0,0]=2 5831 B13R1.132 CC(OC(=O)c1ccc(cc1)O)C Amb2122034 [0,2,0,0,0,0|0,0,0]=2 5832 B13R1.132 CN(C)NC(=O)c1ccc(F)cc1 Amb24387242 [0,2,0,0,0,0|2,0,0]=4 5833 B13R1.132 CN(C)NC(=O)c1ccc(N)cc1 Amb25738528 [0,2,0,0,0,0|2,0,0]=4 5834 B13R1.132 CN(C)NC(=O)c1ccc(O)cc1 Amb25807570 [0,2,0,0,0,0|2,0,0]=4 5835 B13R1.132 CN(C)NC(=O)c1ccc(S)cc1 Amb25832376 [0,2,0,0,0,0|2,0,0]=4 5836 B13R1.132 CN(CC(=O)c1ccc(cc1)Br)C Amb10563747 [0,2,0,0,0,0|2,0,0]=4 5837 B13R1.132 CN(CC(=O)c1ccc(cc1)F)C Amb17598448 [0,2,0,0,0,0|2,0,0]=4 5838 B13R1.132 CN(CC(=O)c1ccc(cc1)N)C Amb17090484 [0,2,0,0,0,0|2,0,0]=4 5839 B13R1.132 CS(=O)CC(=O)c1ccc(F)cc1 Amb24679757 [0,2,0,0,0,0|2,0,0]=4 5840 B13R1.132 C\C(=C\C(C)O)\c1ccc(I)cc1 Amb25286093 [0,2,0,0,0,0|2,0,0]=4 5841 B13R1.132 C\C(\N)=C\C(=O)c1ccc(Cl)cc1 Amb24373097 [0,2,0,0,0,0|1,0,1]=4 5842 B13R1.132 C\C(\N)=N/C(=O)c1ccc(N)cc1 Amb18127912 [0,2,0,0,0,0|1,0,1]=4 5843 B13R1.132 Cc1c[n]c(c[n]1)C(=O)OC(C)C Amb24436955 [0,2,0,0,0,0|2,0,0]=4 5844 B13R1.132 Cc1ccc([n]c1)C(=O)CC(C)C Amb25292847 [0,2,0,0,0,0|2,0,0]=4 5845 B13R1.132 Cc1ccc([n]c1)C(=O)NC(C)C Amb24458291 [0,2,0,0,0,0|2,0,0]=4 5846 B13R1.132 Cc1ccc(c[n]1)C(=O)NC(C)C Amb24388098 [0,2,0,0,0,0|2,0,0]=4 5847 B13R1.132 Cc1ccc(cc1)C(=O)CC(C)=C Amb18065524 [0,2,0,0,0,0|1,0,1]=4 5848 B13R1.132 Cc1ccc(cc1)C(=O)CS(C)=O Amb24656908 [0,2,0,0,0,0|2,0,0]=4 5849 B13R1.132 Cc1ccc(cc1)C(=O)C[C@H](C)O Amb25712933 [0,2,0,0,0,0|1,0,0]=3 5850 B13R1.132 Cc1ccc(cc1)C(=O)OC(C)C Amb18940752 [0,2,0,0,0,0|0,0,0]=2 5851 B13R1.132 Cc1ccc(cc1)C(=O)[CH-]S(C)=O Amb22471669 [0,2,0,0,0,0|2,0,0]=4 5852 B13R1.132 Cc1ccc(cc1)C(=O)\C=C(\C)/N Amb25253088 [0,2,0,0,0,0|1,0,1]=4 5853 B13R1.132 Cc1ccc(cc1)C(=S)NC(C)C Amb24488869 [0,2,0,0,0,0|1,1,0]=4 5854 B13R1.132 Cc1ccc(cc1)S(=O)N[C@@H](C)O Amb25681391 [0,2,0,0,0,0|2,0,0]=4 5855 B13R1.132 Nc1ccc([n]c1)C(=O)OC(F)F Amb25737237 [0,2,0,0,0,0|2,0,0]=4 5856 B13R1.132 Nc1ccc(cc1)C(=O)CC(N)O Amb25375812 [0,2,0,0,0,0|2,0,0]=4 5857 B13R1.132 Nc1ccc(cc1)C(=O)OC(F)F Amb18291258 [0,2,0,0,0,0|1,0,0]=3 5858 B13R1.452 BrCCC(=O)c1ccc(cc1)CC Amb17437863 [0,2,0,0,0,0|2,0,0]=4 5859 B13R1.452 C=Cc1ccc(cc1)C(=O)NCO Amb24440977 [0,2,0,0,0,0|2,0,0]=4 5860 B13R1.452 CC#CC(=O)c1ccc(cc1)OC Amb25116500 [0,2,0,0,0,0|1,0,1]=4 5861 B13R1.452 CCCC(=O)c1ccc(cc1)C#N Amb17334930 [0,2,0,0,0,0|1,0,0]=3 5862 B13R1.452 CCCC(=O)c1ccc(cc1)SC Amb17481545 [0,2,0,0,0,0|1,0,0]=3 5863 B13R1.452 CCNC(=N)c1ccc(CC)cc1 Amb24474410 [0,2,0,0,0,0|2,0,0]=4 5864 B13R1.452 CCNC(=N)c1ccc(cc1)OC Amb24513800 [0,2,0,0,0,0|2,0,0]=4 5865 B13R1.452 CCNC(=O)c1c[n]c(cc1)C#N Amb24474781 [0,2,0,0,0,0|2,0,0]=4 5866 B13R1.452 CCNC(=O)c1c[n]c(cc1)NN Amb18186576 [0,2,0,0,0,0|2,0,0]=4 5867 B13R1.452 CCNC(=O)c1c[n]c(cc1)OC Amb25323090 [0,2,0,0,0,0|2,0,0]=4 5868 B13R1.452 CCNC(=O)c1ccc(C=C)c[n]1 Amb24405066 [0,2,0,0,0,0|2,0,0]=4 5869 B13R1.452 CCNC(=O)c1ccc(CN)c[n]1 Amb18252482 [0,2,0,0,0,0|2,0,0]=4 5870 B13R1.452 CCNC(=O)c1ccc(CN)cc1 Amb21988247 [0,2,0,0,0,0|1,0,0]=3 5871 B13R1.452 CCNC(=O)c1ccc(c[n]1)OC Amb25057416 [0,2,0,0,0,0|2,0,0]=4 5872 B13R1.452 CCNC(=O)c1ccc(cc1)C=O Amb18648034 [0,2,0,0,0,0|1,0,0]=3 5873 B13R1.452 CCNC(=O)c1ccc(cc1)CBr Amb17330983 [0,2,0,0,0,0|1,0,0]=3 5874 B13R1.452 CCNC(=O)c1ccc(cc1)CN Amb1121471 [0,2,0,0,0,0|1,0,0]=3 5875 B13R1.452 CCNC(=O)c1ccc(cc1)CO Amb16182967 [0,2,0,0,0,0|1,0,0]=3 5876 B13R1.452 CCNC(=O)c1ccc(cc1)NN Amb18809198 [0,2,0,0,0,0|1,0,0]=3 5877 B13R1.452 CCNC(=O)c1ccc(cc1)SC Amb25285776 [0,2,0,0,0,0|1,0,0]=3 5878 B13R1.452 CCNC(=S)c1ccc(cc1)OC Amb25359994 [0,2,0,0,0,0|1,1,0]=4 5879 B13R1.452 CCOC(=C)c1ccc(c[n]1)C#N Amb24439505 [0,2,0,0,0,0|2,0,0]=4 5880 B13R1.452 CCOC(=N)c1ccc(cn1)C#N Amb17594443 [0,2,0,0,0,0|2,0,0]=4 5881 B13R1.452 CCOC(=O)N1C=CC(C=C1)C#N Amb24060185 [0,2,0,0,0,0|1,0,1]=4 5882 B13R1.452 CCOC(=O)c1c[n]c(CC)[n]c1 Amb23401502 [0,2,0,0,0,0|2,0,0]=4 5883 B13R1.452 CCOC(=O)c1c[n]c(CCl)cc1 Amb22235467 [0,2,0,0,0,0|1,0,0]=3 5884 B13R1.452 CCOC(=O)c1c[n]c(CN)cc1 Amb22728822 [0,2,0,0,0,0|1,0,0]=3 5885 B13R1.452 CCOC(=O)c1c[n]c(CO)c[n]1 Amb22284544 [0,2,0,0,0,0|2,0,0]=4 5886 B13R1.452 CCOC(=O)c1c[n]c(NC)[n]c1 Amb25027321 [0,2,0,0,0,0|2,0,0]=4 5887 B13R1.452 CCOC(=O)c1c[n]c(NN)[n]c1 Amb23450350 [0,2,0,0,0,0|2,0,0]=4 5888 B13R1.452 CCOC(=O)c1c[n]c(c[n]1)NC Amb24430631 [0,2,0,0,0,0|2,0,0]=4 5889 B13R1.452 CCOC(=O)c1c[n]c(cc1)C#C Amb24095625 [0,2,0,0,0,0|1,0,0]=3 5890 B13R1.452 CCOC(=O)c1c[n]c(cc1)NN Amb19651320 [0,2,0,0,0,0|1,0,0]=3 5891 B13R1.452 CCOC(=O)c1c[n]c(cc1)NO Amb25296481 [0,2,0,0,0,0|1,0,0]=3 5892 B13R1.452 CCOC(=O)c1ccc(C=O)[n]c1 Amb18648223 [0,2,0,0,0,0|1,0,0]=3 5893 B13R1.452 CCOC(=O)c1ccc(CCl)c[n]1 Amb24106334 [0,2,0,0,0,0|1,0,0]=3 5894 B13R1.452 CCOC(=O)c1ccc(CO)c[n]1 Amb22263372 [0,2,0,0,0,0|1,0,0]=3 5895 B13R1.452 CCOC(=O)c1ccc(NN)[n][n]1 Amb24386011 [0,2,0,0,0,0|2,0,0]=4 5896 B13R1.452 CCOC(=O)c1ccc(cc1)C#C Amb22411554 [0,2,0,0,0,0|0,0,0]=2 5897 B13R1.452 CCOC(=O)c1ccc(cc1)C#N Amb1770679 [0,2,0,0,0,0|0,0,0]=2 5898 B13R1.452 CCOC(=O)c1ccc(cc1)C=O Amb18128103 [0,2,0,0,0,0|0,0,0]=2 5899 B13R1.452 CCOC(=O)c1ccc(cc1)CCl Amb16231654 [0,2,0,0,0,0|0,0,0]=2 5900 B13R1.452 CCOC(=O)c1ccc(cc1)NC Amb17305788 [0,2,0,0,0,0|0,0,0]=2 5901 B13R1.452 CCOC(=O)c1ccc(cc1)NO Amb22753287 [0,2,0,0,0,0|0,0,0]=2 5902 B13R1.452 CCOC(=O)c1ccc(cc1)SC Amb18942913 [0,2,0,0,0,0|0,0,0]=2 5903 B13R1.452 CCOC(=O)c1ccc(cc1)[Zn]Br Amb22337141 [0,2,0,0,0,0|0,0,0]=2 5904 B13R1.452 CCOC(=O)c1ccc(cc1)[Zn]I Amb22000408 [0,2,0,0,0,0|0,0,0]=2 5905 B13R1.452 CCOC(=O)c1ccc(cn1)OC Amb2386889 [0,2,0,0,0,0|1,0,0]=3 5906 B13R1.452 CCOC(=O)c1ccc(nc1)CBr Amb17621484 [0,2,0,0,0,0|1,0,0]=3 5907 B13R1.452 CCOC(=O)c1ccc(nc1)CO Amb17621633 [0,2,0,0,0,0|1,0,0]=3 5908 B13R1.452 CCOC(O)c1ccc(cc1)C#N Amb25343732 [0,2,0,0,0,0|0,0,2]=4 5909 B13R1.452 CCON(C)c1ccc(cc1)C#N Amb25358591 [0,2,0,0,0,0|2,0,0]=4 5910 B13R1.452 CCSC(=N)c1ccc(cc1)OC Amb24095600 [0,2,0,0,0,0|1,1,0]=4 5911 B13R1.452 CCc1ccc(cc1)C(=O)CCO Amb18065757 [0,2,0,0,0,0|2,0,0]=4 5912 B13R1.452 CNCC(=O)c1ccc(cc1)CC Amb17233277 [0,2,0,0,0,0|2,0,0]=4 5913 B13R1.452 CNCC(=O)c1ccc(cc1)OC Amb17233534 [0,2,0,0,0,0|2,0,0]=4 5914 B13R1.452 CNCC(=O)c1ccc(cc1)SC Amb18894528 [0,2,0,0,0,0|2,0,0]=4 5915 B13R1.452 CNNC(=O)c1ccc(cc1)OC Amb24070474 [0,2,0,0,0,0|2,0,0]=4 5916 B13R1.452 CNc1ccc([n]c1)C(=O)NCC Amb24388932 [0,2,0,0,0,0|2,0,0]=4 5917 B13R1.452 CNc1ccc(c[n]1)C(=O)NCC Amb18986989 [0,2,0,0,0,0|2,0,0]=4 5918 B13R1.452 COC1=CCN(C=C1)C(=O)OCC Amb24060039 [0,2,0,0,0,0|1,0,1]=4 5919 B13R1.452 CONC(=O)c1ccc(CBr)cc1 Amb25833070 [0,2,0,0,0,0|2,0,0]=4 5920 B13R1.452 CONC(=O)c1ccc(CN)cc1 Amb25237192 [0,2,0,0,0,0|2,0,0]=4 5921 B13R1.452 CONC(=O)c1ccc(cc1)C#N Amb10693925 [0,2,0,0,0,0|2,0,0]=4 5922 B13R1.452 CONC(=O)c1ccc(cc1)C=O Amb24557067 [0,2,0,0,0,0|2,0,0]=4 5923 B13R1.452 CONC(=O)c1ccc(cc1)OC Amb10703357 [0,2,0,0,0,0|2,0,0]=4 5924 B13R1.452 CONC(=O)c1ccc(cc1)SC Amb24623502 [0,2,0,0,0,0|2,0,0]=4 5925 B13R1.452 COc1c[n]c(c[n]1)C(=O)OCC Amb21857364 [0,2,0,0,0,0|2,0,0]=4 5926 B13R1.452 COc1ccc(cc1)C(=N)OCC Amb18796121 [0,2,0,0,0,0|1,0,0]=3 5927 B13R1.452 COc1ccc(cc1)C(=N)OCC Amb20673136 [0,2,0,0,0,0|1,0,0]=3 5928 B13R1.452 COc1ccc(cc1)C(=O)CCO Amb18065906 [0,2,0,0,0,0|2,0,0]=4 5929 B13R1.452 CSCC(=O)c1ccc(cc1)C#N Amb19050196 [0,2,0,0,0,0|2,0,0]=4 5930 B13R1.452 CSc1ccc(cc1)C(=O)CCN Amb18244070 [0,2,0,0,0,0|2,0,0]=4 5931 B13R1.452 C\C=C/C(=O)c1ccc(cc1)OC Amb24491381 [0,2,0,0,0,0|1,0,1]=4 5932 B13R1.452 C\C=C\C(=O)c1ccc(cc1)C#N Amb25272971 [0,2,0,0,0,0|1,0,1]=4 5933 B13R1.452 C\C=C\C(=O)c1ccc(cc1)SC Amb25835807 [0,2,0,0,0,0|1,0,1]=4 5934 B13R1.452 ClCCC(=O)c1ccc(cc1)CC Amb17109137 [0,2,0,0,0,0|2,0,0]=4 5935 B13R1.452 NCCC(=O)c1ccc(cc1)CC Amb17194508 [0,2,0,0,0,0|2,0,0]=4 5936 B13R1.452 NCCC(=O)c1ccc(cc1)OC Amb17194534 [0,2,0,0,0,0|2,0,0]=4 5937 B13R1.452 SCCC(=O)c1ccc(cc1)CC Amb17401969 [0,2,0,0,0,0|2,0,0]=4 5938 B13R1.452 SCCC(=O)c1ccc(cc1)OC Amb17402127 [0,2,0,0,0,0|2,0,0]=4 5939 B13R1.466 BrCCC(=O)c1ccc(c(c1)C)C Amb17437862 [0,2,0,0,0,0|2,0,0]=4 5940 B13R1.466 BrCCC(=O)c1ccc(c(c1)C)Cl Amb17437875 [0,2,0,0,0,0|2,0,0]=4 5941 B13R1.466 BrCCC(=O)c1ccc(c(c1)C)F Amb17437901 [0,2,0,0,0,0|2,0,0]=4 5942 B13R1.466 BrCCC(=O)c1ccc(c(c1)Cl)Cl Amb17437916 [0,2,0,0,0,0|2,0,0]=4 5943 B13R1.466 BrCCC(=O)c1ccc(c(c1)F)F Amb17437923 [0,2,0,0,0,0|2,0,0]=4 5944 B13R1.466 CC1=CC(=CNC1=O)C(=O)OCC Amb22494893 [0,2,0,0,0,0|1,0,0]=3 5945 B13R1.466 CCCC(=O)c1cc(Br)c(Cl)cc1 Amb21856728 [0,2,0,0,0,0|1,0,0]=3 5946 B13R1.466 CCCC(=O)c1cc(Br)c(O)cc1 Amb24556288 [0,2,0,0,0,0|1,0,0]=3 5947 B13R1.466 CCCC(=O)c1cc(Cl)c(Br)cc1 Amb25161228 [0,2,0,0,0,0|1,0,0]=3 5948 B13R1.466 CCCC(=O)c1cc(Cl)c(I)cc1 Amb24393305 [0,2,0,0,0,0|1,0,0]=3 5949 B13R1.466 CCCC(=O)c1cc(Cl)c(N)cc1 Amb24415147 [0,2,0,0,0,0|1,0,0]=3 5950 B13R1.466 CCCC(=O)c1cc(N)c(Br)cc1 Amb25115972 [0,2,0,0,0,0|1,0,0]=3 5951 B13R1.466 CCCC(=O)c1cc(O)c(N)cc1 Amb18128406 [0,2,0,0,0,0|1,0,0]=3 5952 B13R1.466 CCCC(=O)c1ccc(c(c1)Br)C Amb17193988 [0,2,0,0,0,0|1,0,0]=3 5953 B13R1.466 CCCC(=O)c1ccc(c(c1)Br)F Amb17193989 [0,2,0,0,0,0|1,0,0]=3 5954 B13R1.466 CCCC(=O)c1ccc(c(c1)C)Br Amb17348646 [0,2,0,0,0,0|1,0,0]=3 5955 B13R1.466 CCCC(=O)c1ccc(c(c1)C)Cl Amb17109158 [0,2,0,0,0,0|1,0,0]=3 5956 B13R1.466 CCCC(=O)c1ccc(c(c1)C)F Amb17109190 [0,2,0,0,0,0|1,0,0]=3 5957 B13R1.466 CCCC(=O)c1ccc(c(c1)C)N Amb17138826 [0,2,0,0,0,0|1,0,0]=3 5958 B13R1.466 CCCC(=O)c1ccc(c(c1)C)O Amb17233423 [0,2,0,0,0,0|1,0,0]=3 5959 B13R1.466 CCCC(=O)c1ccc(c(c1)Cl)C Amb17337143 [0,2,0,0,0,0|1,0,0]=3 5960 B13R1.466 CCCC(=O)c1ccc(c(c1)Cl)F Amb17337616 [0,2,0,0,0,0|1,0,0]=3 5961 B13R1.466 CCCC(=O)c1ccc(c(c1)Cl)O Amb17236842 [0,2,0,0,0,0|1,0,0]=3 5962 B13R1.466 CCCC(=O)c1ccc(c(c1)N)N Amb17202028 [0,2,0,0,0,0|1,0,0]=3 5963 B13R1.466 CCCC(=O)c1ccc(c(c1)N)O Amb17218506 [0,2,0,0,0,0|1,0,0]=3 5964 B13R1.466 CCCC(=O)c1ccc(c(c1)O)O Amb17613040 [0,2,0,0,0,0|1,0,0]=3 5965 B13R1.466 CCCS(=O)c1cc(F)c(N)cc1 Amb24714447 [0,2,0,0,0,0|2,0,0]=4 5966 B13R1.466 CCNC(=N)c1ccc(F)c(Br)c1 Amb24743191 [0,2,0,0,0,0|2,0,0]=4 5967 B13R1.466 CCNC(=O)C1=CC(=O)N(C)C=C1 Amb25767232 [0,2,0,0,0,0|2,0,0]=4 5968 B13R1.466 CCNC(=O)C1=CN(C)C(=O)C=C1 Amb25835724 [0,2,0,0,0,0|2,0,0]=4 5969 B13R1.466 CCNC(=O)C=1C=C(Br)C(=O)NC1 Amb25235531 [0,2,0,0,0,0|2,0,0]=4 5970 B13R1.466 CCNC(=O)c1c[n]c(Br)c(Cl)c1 Amb24502596 [0,2,0,0,0,0|2,0,0]=4 5971 B13R1.466 CCNC(=O)c1c[n]c(N)c(Cl)c1 Amb18959193 [0,2,0,0,0,0|2,0,0]=4 5972 B13R1.466 CCNC(=O)c1ccc(Br)c(O)c1 Amb24626487 [0,2,0,0,0,0|1,0,0]=3 5973 B13R1.466 CCNC(=O)c1ccc(Cl)c(F)c1 Amb25722518 [0,2,0,0,0,0|1,0,0]=3 5974 B13R1.466 CCNC(=O)c1ccc(F)c(Br)c1 Amb22231308 [0,2,0,0,0,0|1,0,0]=3 5975 B13R1.466 CCNC(=O)c1ccc(F)c(O)c1 Amb24658606 [0,2,0,0,0,0|1,0,0]=3 5976 B13R1.466 CCNC(=O)c1ccc(F)c(S)c1 Amb25741118 [0,2,0,0,0,0|1,0,0]=3 5977 B13R1.466 CCNC(=O)c1ccc(I)c(Cl)c1 Amb24701892 [0,2,0,0,0,0|1,0,0]=3 5978 B13R1.466 CCNC(=O)c1ccc(I)c(F)c1 Amb24747897 [0,2,0,0,0,0|1,0,0]=3 5979 B13R1.466 CCNC(=O)c1ccc(N)c(Br)c1 Amb19981760 [0,2,0,0,0,0|1,0,0]=3 5980 B13R1.466 CCNC(=O)c1ccc(N)c(F)c1 Amb18963303 [0,2,0,0,0,0|1,0,0]=3 5981 B13R1.466 CCNC(=O)c1ccc(O)c(N)c1 Amb24669872 [0,2,0,0,0,0|1,0,0]=3 5982 B13R1.466 CCNC(=O)c1ccc(S)c(N)c1 Amb24394183 [0,2,0,0,0,0|1,0,0]=3 5983 B13R1.466 CCNC(=O)c1ccc(c(c1)Br)I Amb11321783 [0,2,0,0,0,0|1,0,0]=3 5984 B13R1.466 CCNC(=O)c1ccc(c(c1)C)N Amb1112970 [0,2,0,0,0,0|1,0,0]=3 5985 B13R1.466 CCNC(=O)c1ccc(c(c1)C)N Amb17622101 [0,2,0,0,0,0|1,0,0]=3 5986 B13R1.466 CCNC(=O)c1ccc(c(c1)Cl)Cl Amb1791085 [0,2,0,0,0,0|1,0,0]=3 5987 B13R1.466 CCNC(=O)c1ccc(c(c1)F)Br Amb12605722 [0,2,0,0,0,0|1,0,0]=3 5988 B13R1.466 CCNC(=O)c1ccc(c(c1)I)Cl Amb11335179 [0,2,0,0,0,0|1,0,0]=3 5989 B13R1.466 CCNC(=O)c1ccc(c(c1)N)Br Amb17159429 [0,2,0,0,0,0|1,0,0]=3 5990 B13R1.466 CCNC(=O)c1ccc(c(c1)N)C Amb1116889 [0,2,0,0,0,0|1,0,0]=3 5991 B13R1.466 CCNC(=O)c1ccc(c(c1)N)C Amb17622100 [0,2,0,0,0,0|1,0,0]=3 5992 B13R1.466 CCNC(=O)c1ccc(c(c1)N)Cl Amb1117288 [0,2,0,0,0,0|1,0,0]=3 5993 B13R1.466 CCOC(=N)c1cc(F)c(F)cc1 Amb19057848 [0,2,0,0,0,0|1,0,0]=3 5994 B13R1.466 CCOC(=N)c1cc(F)c(F)cc1 Amb22285009 [0,2,0,0,0,0|1,0,0]=3 5995 B13R1.466 CCOC(=N)c1ccc(Br)c(F)c1 Amb24637804 [0,2,0,0,0,0|1,0,0]=3 5996 B13R1.466 CCOC(=N)c1ccc(Cl)c(Br)c1 Amb24545601 [0,2,0,0,0,0|1,0,0]=3 5997 B13R1.466 CCOC(=N)c1ccc(N)c(N)c1 Amb25378186 [0,2,0,0,0,0|1,0,0]=3 5998 B13R1.466 CCOC(=N)c1ccc(O)c(Cl)c1 Amb18331433 [0,2,0,0,0,0|1,0,0]=3 5999 B13R1.466 CCOC(=O)C1=CC(=O)C(N)=CN1 Amb24426941 [0,2,0,0,0,0|1,0,0]=3 6000 B13R1.466 CCOC(=O)C1=CC(=O)C(O)=CO1 Amb25842152 [0,2,0,0,0,0|1,0,0]=3 6001 B13R1.466 CCOC(=O)C1=CC(=O)N(C)C=C1 Amb19374603 [0,2,0,0,0,0|1,0,0]=3 6002 B13R1.466 CCOC(=O)C1=CC=C(Br)C(=O)N1 Amb21857419 [0,2,0,0,0,0|1,0,0]=3 6003 B13R1.466 CCOC(=O)C1=CN(C)C(=O)C=C1 Amb22277008 [0,2,0,0,0,0|1,0,0]=3 6004 B13R1.466 CCOC(=O)C=1C=CC(=O)N(C)N1 Amb24623723 [0,2,0,0,0,0|2,0,0]=4 6005 B13R1.466 CCOC(=O)c1[n]cc(Br)c(Cl)[n]1 Amb24396678 [0,2,0,0,0,0|2,0,0]=4 6006 B13R1.466 CCOC(=O)c1[n]cc(Cl)c(Cl)[n]1 Amb24664602 [0,2,0,0,0,0|2,0,0]=4 6007 B13R1.466 CCOC(=O)c1c[n](C)c(=O)cc1 Amb22227993 [0,2,0,0,0,0|1,0,0]=3 6008 B13R1.466 CCOC(=O)c1c[n]c(Br)c(Cl)c1 Amb24677538 [0,2,0,0,0,0|1,0,0]=3 6009 B13R1.466 CCOC(=O)c1c[n]c(Cl)c(Br)c1 Amb22752622 [0,2,0,0,0,0|1,0,0]=3 6010 B13R1.466 CCOC(=O)c1c[n]c(Cl)c(I)[n]1 Amb25286791 [0,2,0,0,0,0|2,0,0]=4 6011 B13R1.466 CCOC(=O)c1c[n]c(Cl)c(N)c1 Amb22739938 [0,2,0,0,0,0|1,0,0]=3 6012 B13R1.466 CCOC(=O)c1c[n]c(Cl)c(O)c1 Amb25729833 [0,2,0,0,0,0|1,0,0]=3 6013 B13R1.466 CCOC(=O)c1c[n]c(F)c(Br)c1 Amb23400017 [0,2,0,0,0,0|1,0,0]=3 6014 B13R1.466 CCOC(=O)c1c[n]c(F)c(Cl)c1 Amb23399973 [0,2,0,0,0,0|1,0,0]=3 6015 B13R1.466 CCOC(=O)c1c[n]c(F)c(N)c1 Amb24363081 [0,2,0,0,0,0|1,0,0]=3 6016 B13R1.466 CCOC(=O)c1c[n]c(I)c(Br)c1 Amb24758935 [0,2,0,0,0,0|1,0,0]=3 6017 B13R1.466 CCOC(=O)c1c[n]c(I)c(O)c1 Amb20242056 [0,2,0,0,0,0|1,0,0]=3 6018 B13R1.466 CCOC(=O)c1c[n]c(N)c(Cl)c1 Amb22736300 [0,2,0,0,0,0|1,0,0]=3 6019 B13R1.466 CCOC(=O)c1c[n]c(O)c(Br)c1 Amb22736446 [0,2,0,0,0,0|1,0,0]=3 6020 B13R1.466 CCOC(=O)c1c[n]c(O)c(Cl)c1 Amb22736448 [0,2,0,0,0,0|1,0,0]=3 6021 B13R1.466 CCOC(=O)c1cc(Br)c(Br)[n]c1 Amb24066522 [0,2,0,0,0,0|1,0,0]=3 6022 B13R1.466 CCOC(=O)c1cc(Br)c(Br)cc1 Amb20621214 [0,2,0,0,0,0|0,0,0]=2 6023 B13R1.466 CCOC(=O)c1cc(Br)c(F)c[n]1 Amb25312387 [0,2,0,0,0,0|1,0,0]=3 6024 B13R1.466 CCOC(=O)c1cc(Br)c(N)c[n]1 Amb25780919 [0,2,0,0,0,0|1,0,0]=3 6025 B13R1.466 CCOC(=O)c1cc(Br)c(O)c[n]1 Amb25276666 [0,2,0,0,0,0|1,0,0]=3 6026 B13R1.466 CCOC(=O)c1cc(Cl)c(Br)c[n]1 Amb25723985 [0,2,0,0,0,0|1,0,0]=3 6027 B13R1.466 CCOC(=O)c1cc(Cl)c(N)c[n]1 Amb25291401 [0,2,0,0,0,0|1,0,0]=3 6028 B13R1.466 CCOC(=O)c1cc(F)c(F)[n]c1 Amb25728168 [0,2,0,0,0,0|1,0,0]=3 6029 B13R1.466 CCOC(=O)c1cc(I)c(I)cc1 Amb25155255 [0,2,0,0,0,0|0,0,0]=2 6030 B13R1.466 CCOC(=O)c1cc(N)c(Br)c[n]1 Amb24501517 [0,2,0,0,0,0|1,0,0]=3 6031 B13R1.466 CCOC(=O)c1cc(N)c(N)c[n]1 Amb21963956 [0,2,0,0,0,0|1,0,0]=3 6032 B13R1.466 CCOC(=O)c1cc(O)c(Br)c[n]1 Amb24441130 [0,2,0,0,0,0|1,0,0]=3 6033 B13R1.466 CCOC(=O)c1cc(O)c(F)c[n]1 Amb24743788 [0,2,0,0,0,0|1,0,0]=3 6034 B13R1.466 CCOC(=O)c1cc(O)c(O)c[n]1 Amb18648725 [0,2,0,0,0,0|1,0,0]=3 6035 B13R1.466 CCOC(=O)c1cc[n+]([O-])c(Cl)c1 Amb22486428 [0,2,0,0,0,0|1,0,0]=3 6036 B13R1.466 CCOC(=O)c1ccc(Br)c(Br)[n]1 Amb21857415 [0,2,0,0,0,0|1,0,0]=3 6037 B13R1.466 CCOC(=O)c1ccc(Br)c(Cl)[n]1 Amb21857413 [0,2,0,0,0,0|1,0,0]=3 6038 B13R1.466 CCOC(=O)c1ccc(Br)c(Cl)c1 Amb21981731 [0,2,0,0,0,0|0,0,0]=2 6039 B13R1.466 CCOC(=O)c1ccc(Br)c(F)c1 Amb22057676 [0,2,0,0,0,0|0,0,0]=2 6040 B13R1.466 CCOC(=O)c1ccc(Br)c(N)[n]1 Amb22498431 [0,2,0,0,0,0|1,0,0]=3 6041 B13R1.466 CCOC(=O)c1ccc(Br)c(N)c1 Amb18294790 [0,2,0,0,0,0|0,0,0]=2 6042 B13R1.466 CCOC(=O)c1ccc(Br)c(O)[n]1 Amb21857420 [0,2,0,0,0,0|1,0,0]=3 6043 B13R1.466 CCOC(=O)c1ccc(Br)c(O)c1 Amb22500445 [0,2,0,0,0,0|0,0,0]=2 6044 B13R1.466 CCOC(=O)c1ccc(Br)c(S)c1 Amb24433671 [0,2,0,0,0,0|0,0,0]=2 6045 B13R1.466 CCOC(=O)c1ccc(Cl)c(Br)c1 Amb22001520 [0,2,0,0,0,0|0,0,0]=2 6046 B13R1.466 CCOC(=O)c1ccc(Cl)c(F)[n]1 Amb25851775 [0,2,0,0,0,0|1,0,0]=3 6047 B13R1.466 CCOC(=O)c1ccc(Cl)c(F)c1 Amb21964735 [0,2,0,0,0,0|0,0,0]=2 6048 B13R1.466 CCOC(=O)c1ccc(Cl)c(I)c1 Amb19888181 [0,2,0,0,0,0|0,0,0]=2 6049 B13R1.466 CCOC(=O)c1ccc(Cl)c(O)[n]1 Amb25195300 [0,2,0,0,0,0|1,0,0]=3 6050 B13R1.466 CCOC(=O)c1ccc(Cl)c(O)c1 Amb21961764 [0,2,0,0,0,0|0,0,0]=2 6051 B13R1.466 CCOC(=O)c1ccc(F)c(Cl)[n]1 Amb24381595 [0,2,0,0,0,0|1,0,0]=3 6052 B13R1.466 CCOC(=O)c1ccc(F)c(N)[n]1 Amb25365584 [0,2,0,0,0,0|1,0,0]=3 6053 B13R1.466 CCOC(=O)c1ccc(F)c(O)[n]1 Amb24468644 [0,2,0,0,0,0|1,0,0]=3 6054 B13R1.466 CCOC(=O)c1ccc(F)c(O)c1 Amb23437510 [0,2,0,0,0,0|0,0,0]=2 6055 B13R1.466 CCOC(=O)c1ccc(F)c(S)c1 Amb24652013 [0,2,0,0,0,0|0,0,0]=2 6056 B13R1.466 CCOC(=O)c1ccc(I)c(Br)c1 Amb22371469 [0,2,0,0,0,0|0,0,0]=2 6057 B13R1.466 CCOC(=O)c1ccc(I)c(Cl)c1 Amb19887811 [0,2,0,0,0,0|0,0,0]=2 6058 B13R1.466 CCOC(=O)c1ccc(I)c(F)[n]1 Amb24740257 [0,2,0,0,0,0|1,0,0]=3 6059 B13R1.466 CCOC(=O)c1ccc(I)c(F)c1 Amb19887815 [0,2,0,0,0,0|0,0,0]=2 6060 B13R1.466 CCOC(=O)c1ccc(I)c(N)c1 Amb21857083 [0,2,0,0,0,0|0,0,0]=2 6061 B13R1.466 CCOC(=O)c1ccc(I)c(O)c1 Amb20621412 [0,2,0,0,0,0|0,0,0]=2 6062 B13R1.466 CCOC(=O)c1ccc(I)c(S)c1 Amb25046069 [0,2,0,0,0,0|0,0,0]=2 6063 B13R1.466 CCOC(=O)c1ccc(N)c(F)c1 Amb18994988 [0,2,0,0,0,0|0,0,0]=2 6064 B13R1.466 CCOC(=O)c1ccc(N)c(S)c1 Amb18652688 [0,2,0,0,0,0|0,0,0]=2 6065 B13R1.466 CCOC(=O)c1ccc(O)c(F)c1 Amb18648839 [0,2,0,0,0,0|0,0,0]=2 6066 B13R1.466 CCOC(=O)c1ccc(O)c(N)[n]1 Amb24343137 [0,2,0,0,0,0|1,0,0]=3 6067 B13R1.466 CCOC(=O)c1ccc(S)c(Br)c1 Amb25324014 [0,2,0,0,0,0|0,0,0]=2 6068 B13R1.466 CCOC(=O)c1ccc([n+](c1)C)C Amb1798592 [0,2,0,0,0,0|1,0,0]=3 6069 B13R1.466 CCOC(=O)c1ccc(c(c1)Br)F Amb10839797 [0,2,0,0,0,0|0,0,0]=2 6070 B13R1.466 CCOC(=O)c1ccc(c(c1)C)Br Amb16231785 [0,2,0,0,0,0|0,0,0]=2 6071 B13R1.466 CCOC(=O)c1ccc(c(c1)I)Br Amb10601545 [0,2,0,0,0,0|0,0,0]=2 6072 B13R1.466 CCOC(=O)c1ccc(c(c1)I)C Amb16232640 [0,2,0,0,0,0|0,0,0]=2 6073 B13R1.466 CCOC(=O)c1ccc(c(c1)I)O Amb16232641 [0,2,0,0,0,0|0,0,0]=2 6074 B13R1.466 CCOC(=O)c1ccc(c(c1)N)O Amb1950700 [0,2,0,0,0,0|0,0,0]=2 6075 B13R1.466 CCOC(=O)c1ccc(c(c1)O)N Amb17205818 [0,2,0,0,0,0|0,0,0]=2 6076 B13R1.466 CCOC(=O)c1cnc(c(c1)Br)N Amb10069041 [0,2,0,0,0,0|1,0,0]=3 6077 B13R1.466 CCOC(=O)c1cnc(c(c1)C)C Amb17614029 [0,2,0,0,0,0|1,0,0]=3 6078 B13R1.466 CCOC(=O)c1cnc(c(c1)Cl)Cl Amb1094135 [0,2,0,0,0,0|1,0,0]=3 6079 B13R1.466 CNCC(=O)c1ccc(Br)c(Cl)c1 Amb24379078 [0,2,0,0,0,0|2,0,0]=4 6080 B13R1.466 CNCC(=O)c1ccc(Br)c(F)c1 Amb25342778 [0,2,0,0,0,0|2,0,0]=4 6081 B13R1.466 CNCC(=O)c1ccc(Br)c(N)c1 Amb18227846 [0,2,0,0,0,0|2,0,0]=4 6082 B13R1.466 CNCC(=O)c1ccc(Cl)c(F)c1 Amb25180475 [0,2,0,0,0,0|2,0,0]=4 6083 B13R1.466 CNCC(=O)c1ccc(Cl)c(N)c1 Amb18864185 [0,2,0,0,0,0|2,0,0]=4 6084 B13R1.466 CNCC(=O)c1ccc(F)c(Br)c1 Amb25158269 [0,2,0,0,0,0|2,0,0]=4 6085 B13R1.466 CNCC(=O)c1ccc(F)c(Cl)c1 Amb18864487 [0,2,0,0,0,0|2,0,0]=4 6086 B13R1.466 CNCC(=O)c1ccc(F)c(N)c1 Amb18863009 [0,2,0,0,0,0|2,0,0]=4 6087 B13R1.466 CNCC(=O)c1ccc(c(c1)C)C Amb17233278 [0,2,0,0,0,0|2,0,0]=4 6088 B13R1.466 CNCC(=O)c1ccc(c(c1)C)Cl Amb17314398 [0,2,0,0,0,0|2,0,0]=4 6089 B13R1.466 CNCC(=O)c1ccc(c(c1)C)F Amb17233788 [0,2,0,0,0,0|2,0,0]=4 6090 B13R1.466 CNCC(=O)c1ccc(c(c1)Cl)Cl Amb17314508 [0,2,0,0,0,0|2,0,0]=4 6091 B13R1.466 CNCC(=O)c1ccc(c(c1)F)F Amb17335732 [0,2,0,0,0,0|2,0,0]=4 6092 B13R1.466 COCC(=O)c1ccc(Br)c(Cl)c1 Amb25782675 [0,2,0,0,0,0|2,0,0]=4 6093 B13R1.466 COCC(=O)c1ccc(Cl)c(Br)c1 Amb24378381 [0,2,0,0,0,0|2,0,0]=4 6094 B13R1.466 COCC(=O)c1ccc(Cl)c(N)c1 Amb25820505 [0,2,0,0,0,0|2,0,0]=4 6095 B13R1.466 COCC(=O)c1ccc(I)c(Cl)c1 Amb25829280 [0,2,0,0,0,0|2,0,0]=4 6096 B13R1.466 COCC(=O)c1ccc(N)c(Cl)c1 Amb24699930 [0,2,0,0,0,0|2,0,0]=4 6097 B13R1.466 COCC(=O)c1ccc(N)c(F)c1 Amb25809249 [0,2,0,0,0,0|2,0,0]=4 6098 B13R1.466 COCC(=O)c1ccc(c(c1)C)Cl Amb17198822 [0,2,0,0,0,0|2,0,0]=4 6099 B13R1.466 COCC(=O)c1ccc(c(c1)C)F Amb17198971 [0,2,0,0,0,0|2,0,0]=4 6100 B13R1.466 COCC(=O)c1ccc(c(c1)N)N Amb17202029 [0,2,0,0,0,0|2,0,0]=4 6101 B13R1.466 CONC(=O)c1cc(I)c(I)cc1 Amb25355927 [0,2,0,0,0,0|2,0,0]=4 6102 B13R1.466 CONC(=O)c1ccc(Br)c(Cl)c1 Amb24534083 [0,2,0,0,0,0|2,0,0]=4 6103 B13R1.466 CONC(=O)c1ccc(Cl)c(F)c1 Amb25266202 [0,2,0,0,0,0|2,0,0]=4 6104 B13R1.466 CONC(=O)c1ccc(Cl)c(N)c1 Amb24588003 [0,2,0,0,0,0|2,0,0]=4 6105 B13R1.466 CONC(=O)c1ccc(F)c(Br)c1 Amb25102197 [0,2,0,0,0,0|2,0,0]=4 6106 B13R1.466 CONC(=O)c1ccc(I)c(Cl)c1 Amb25846431 [0,2,0,0,0,0|2,0,0]=4 6107 B13R1.466 CONC(=O)c1ccc(I)c(F)c1 Amb19480405 [0,2,0,0,0,0|2,0,0]=4 6108 B13R1.466 CONC(=O)c1ccc(I)c(O)c1 Amb25100785 [0,2,0,0,0,0|2,0,0]=4 6109 B13R1.466 CONC(=O)c1ccc(N)c(Br)c1 Amb25782271 [0,2,0,0,0,0|2,0,0]=4 6110 B13R1.466 CONC(=O)c1ccc(N)c(Cl)c1 Amb24684609 [0,2,0,0,0,0|2,0,0]=4 6111 B13R1.466 CONC(=O)c1ccc(N)c(I)c1 Amb25152949 [0,2,0,0,0,0|2,0,0]=4 6112 B13R1.466 CONC(=O)c1ccc(O)c(Cl)c1 Amb25716354 [0,2,0,0,0,0|2,0,0]=4 6113 B13R1.466 CONC(=O)c1ccc(O)c(F)c1 Amb25058205 [0,2,0,0,0,0|2,0,0]=4 6114 B13R1.466 CONC(=O)c1ccc(O)c(O)c1 Amb25342946 [0,2,0,0,0,0|2,0,0]=4 6115 B13R1.466 CONC(=O)c1ccc(c(c1)Br)Cl Amb16989017 [0,2,0,0,0,0|2,0,0]=4 6116 B13R1.466 CONC(=O)c1ccc(c(c1)C)C Amb10704851 [0,2,0,0,0,0|2,0,0]=4 6117 B13R1.466 CONC(=O)c1ccc(c(c1)Cl)Cl Amb16072959 [0,2,0,0,0,0|2,0,0]=4 6118 B13R1.466 CONC(=O)c1ccc(c(c1)F)Br Amb11600891 [0,2,0,0,0,0|2,0,0]=4 6119 B13R1.466 CONC(=O)c1ccc(c(c1)F)C Amb10704856 [0,2,0,0,0,0|2,0,0]=4 6120 B13R1.466 CONC(=O)c1ccc(c(c1)F)F Amb16980472 [0,2,0,0,0,0|2,0,0]=4 6121 B13R1.466 CSCC(=O)c1ccc(Br)c(Cl)c1 Amb25285225 [0,2,0,0,0,0|2,0,0]=4 6122 B13R1.466 CSCC(=O)c1ccc(F)c(Cl)c1 Amb25692261 [0,2,0,0,0,0|2,0,0]=4 6123 B13R1.466 CSCC(=O)c1ccc(O)c(O)c1 Amb18321908 [0,2,0,0,0,0|2,0,0]=4 6124 B13R1.466 C[NH2+]CC(=O)c1ccc(O)c(O)c1 Amb24113842 [0,2,0,0,0,0|2,0,0]=4 6125 B13R1.466 C\C=C\C(=O)c1cc(F)c(F)cc1 Amb24623296 [0,2,0,0,0,0|1,0,1]=4 6126 B13R1.466 C\C=C\C(=O)c1ccc(C)c(C)c1 Amb25679180 [0,2,0,0,0,0|1,0,1]=4 6127 B13R1.466 C\C=C\C(=O)c1ccc(Cl)c(F)c1 Amb24710644 [0,2,0,0,0,0|1,0,1]=4 6128 B13R1.466 C\C=C\C(=O)c1ccc(O)c(O)c1 Amb18128091 [0,2,0,0,0,0|1,0,1]=4 6129 B13R1.466 Cc1[n]c([n]cc1O)C(=O)OCC Amb25364471 [0,2,0,0,0,0|2,0,0]=4 6130 B13R1.466 Cc1[n]c(c[n]c1C)C(=O)OCC Amb21857431 [0,2,0,0,0,0|2,0,0]=4 6131 B13R1.466 Cc1[n]c(c[n]c1N)C(=O)OCC Amb24441342 [0,2,0,0,0,0|2,0,0]=4 6132 B13R1.466 Cc1[n]c(ccc1Br)C(=O)OCC Amb22494647 [0,2,0,0,0,0|1,0,0]=3 6133 B13R1.466 Cc1[n]c(ccc1C)C(=N)OCC Amb24678224 [0,2,0,0,0,0|2,0,0]=4 6134 B13R1.466 Cc1[n]c(ccc1C)C(=O)NCC Amb25046315 [0,2,0,0,0,0|2,0,0]=4 6135 B13R1.466 Cc1[n]c(ccc1C)C(=O)OCC Amb25801930 [0,2,0,0,0,0|1,0,0]=3 6136 B13R1.466 Cc1[n]cc([n]c1N)C(=O)OCC Amb24463729 [0,2,0,0,0,0|2,0,0]=4 6137 B13R1.466 Cc1[n]cc(cc1Br)C(=O)OCC Amb22728303 [0,2,0,0,0,0|1,0,0]=3 6138 B13R1.466 Cc1[n]cc(cc1Cl)C(=O)OCC Amb25815285 [0,2,0,0,0,0|1,0,0]=3 6139 B13R1.466 Cc1[n]cc(cc1N)C(=O)OCC Amb22235230 [0,2,0,0,0,0|1,0,0]=3 6140 B13R1.466 Cc1[n]cc(cc1O)C(=O)OCC Amb18648472 [0,2,0,0,0,0|1,0,0]=3 6141 B13R1.466 Cc1c[n]c(c[n+]1[O-])C(=O)OCC Amb25739029 [0,2,0,0,0,0|2,0,0]=4 6142 B13R1.466 Cc1c[n]c(cc1Br)C(=O)OCC Amb22495199 [0,2,0,0,0,0|1,0,0]=3 6143 B13R1.466 Cc1c[n]c(cc1Cl)C(=O)OCC Amb22436778 [0,2,0,0,0,0|1,0,0]=3 6144 B13R1.466 Cc1cc([n]cc1Br)C(=O)OCC Amb22388891 [0,2,0,0,0,0|1,0,0]=3 6145 B13R1.466 Cc1cc([n]cc1N)C(=O)OCC Amb25073961 [0,2,0,0,0,0|1,0,0]=3 6146 B13R1.466 Cc1cc([n]cc1O)C(=O)OCC Amb24567705 [0,2,0,0,0,0|1,0,0]=3 6147 B13R1.466 Cc1cc(c[n]c1Br)C(=O)OCC Amb24654001 [0,2,0,0,0,0|1,0,0]=3 6148 B13R1.466 Cc1cc(c[n]c1Cl)C(=O)OCC Amb22492869 [0,2,0,0,0,0|1,0,0]=3 6149 B13R1.466 Cc1cc(c[n]c1F)C(=O)OCC Amb24679502 [0,2,0,0,0,0|1,0,0]=3 6150 B13R1.466 Cc1cc(ccc1Br)C(=O)CCBr Amb24426339 [0,2,0,0,0,0|2,0,0]=4 6151 B13R1.466 Cc1cc(ccc1Br)C(=O)CCCl Amb18554192 [0,2,0,0,0,0|2,0,0]=4 6152 B13R1.466 Cc1cc(ccc1Br)C(=O)CNC Amb18227887 [0,2,0,0,0,0|2,0,0]=4 6153 B13R1.466 Cc1cc(ccc1Br)C(=O)COC Amb25675422 [0,2,0,0,0,0|2,0,0]=4 6154 B13R1.466 Cc1cc(ccc1Br)C(=O)CSC Amb25784560 [0,2,0,0,0,0|2,0,0]=4 6155 B13R1.466 Cc1cc(ccc1Br)C(=O)NCC Amb22001134 [0,2,0,0,0,0|1,0,0]=3 6156 B13R1.466 Cc1cc(ccc1Br)C(=O)NOC Amb25773958 [0,2,0,0,0,0|2,0,0]=4 6157 B13R1.466 Cc1cc(ccc1Br)C(=O)\C=C\C Amb25180147 [0,2,0,0,0,0|1,0,1]=4 6158 B13R1.466 Cc1cc(ccc1C)C(=N)OCC Amb18180669 [0,2,0,0,0,0|1,0,0]=3 6159 B13R1.466 Cc1cc(ccc1C)C(=O)CCO Amb18065758 [0,2,0,0,0,0|2,0,0]=4 6160 B13R1.466 Cc1cc(ccc1C)C(=O)CSC Amb18321258 [0,2,0,0,0,0|2,0,0]=4 6161 B13R1.466 Cc1cc(ccc1Cl)C(=O)CCN Amb18105611 [0,2,0,0,0,0|2,0,0]=4 6162 B13R1.466 Cc1cc(ccc1Cl)C(=O)NOC Amb24743088 [0,2,0,0,0,0|2,0,0]=4 6163 B13R1.466 Cc1cc(ccc1Cl)C(=O)OCC Amb18277108 [0,2,0,0,0,0|0,0,0]=2 6164 B13R1.466 Cc1cc(ccc1F)C(=N)OCC Amb18179020 [0,2,0,0,0,0|1,0,0]=3 6165 B13R1.466 Cc1cc(ccc1F)C(=O)CCO Amb18066061 [0,2,0,0,0,0|2,0,0]=4 6166 B13R1.466 Cc1cc(ccc1F)C(=O)CSC Amb18325535 [0,2,0,0,0,0|2,0,0]=4 6167 B13R1.466 Cc1cc(ccc1F)C(=O)NCC Amb25070163 [0,2,0,0,0,0|1,0,0]=3 6168 B13R1.466 Cc1cc(ccc1F)C(=O)OCC Amb18940053 [0,2,0,0,0,0|0,0,0]=2 6169 B13R1.466 Cc1cc(ccc1F)C(=O)\C=C\C Amb25076195 [0,2,0,0,0,0|1,0,1]=4 6170 B13R1.466 Cc1cc(ccc1I)C(=O)CCBr Amb24382171 [0,2,0,0,0,0|2,0,0]=4 6171 B13R1.466 Cc1cc(ccc1I)C(=O)CCCl Amb25099023 [0,2,0,0,0,0|2,0,0]=4 6172 B13R1.466 Cc1cc(ccc1I)C(=O)NCC Amb24430723 [0,2,0,0,0,0|1,0,0]=3 6173 B13R1.466 Cc1cc(ccc1I)C(=O)NOC Amb19477393 [0,2,0,0,0,0|2,0,0]=4 6174 B13R1.466 Cc1cc(ccc1I)C(=O)OCC Amb22886738 [0,2,0,0,0,0|0,0,0]=2 6175 B13R1.466 Cc1cc(ccc1N)C(=O)COC Amb24351264 [0,2,0,0,0,0|2,0,0]=4 6176 B13R1.466 Cc1cc(ccc1N)C(=O)NOC Amb24473408 [0,2,0,0,0,0|2,0,0]=4 6177 B13R1.466 Cc1cc(ccc1N)N(C)OCC Amb24610027 [0,2,0,0,0,0|2,0,0]=4 6178 B13R1.466 Cc1cc(ccc1N)S(=O)CCC Amb24359525 [0,2,0,0,0,0|2,0,0]=4 6179 B13R1.466 Cc1cc(ccc1O)C(=O)OCC Amb18128630 [0,2,0,0,0,0|0,0,0]=2 6180 B13R1.466 Cc1cc(ccc1S)C(=O)OCC Amb25320752 [0,2,0,0,0,0|0,0,0]=2 6181 B13R1.466 Cc1ccc([n]c1Br)C(=O)OCC Amb22495089 [0,2,0,0,0,0|1,0,0]=3 6182 B13R1.466 Cc1ccc([n]c1Cl)C(=O)OCC Amb22001691 [0,2,0,0,0,0|1,0,0]=3 6183 B13R1.466 Cc1ccc([n]c1N)C(=O)OCC Amb25073595 [0,2,0,0,0,0|1,0,0]=3 6184 B13R1.466 Cc1ccc(cc1Br)C(=N)NCC Amb24449825 [0,2,0,0,0,0|2,0,0]=4 6185 B13R1.466 Cc1ccc(cc1Br)C(=N)OCC Amb24745126 [0,2,0,0,0,0|1,0,0]=3 6186 B13R1.466 Cc1ccc(cc1Br)C(=O)CNC Amb18872420 [0,2,0,0,0,0|2,0,0]=4 6187 B13R1.466 Cc1ccc(cc1Br)C(=O)COC Amb25158779 [0,2,0,0,0,0|2,0,0]=4 6188 B13R1.466 Cc1ccc(cc1Br)C(=O)OCC Amb22288817 [0,2,0,0,0,0|0,0,0]=2 6189 B13R1.466 Cc1ccc(cc1Br)S(=O)CCC Amb25237284 [0,2,0,0,0,0|2,0,0]=4 6190 B13R1.466 Cc1ccc(cc1Cl)C(=O)CCBr Amb25286794 [0,2,0,0,0,0|2,0,0]=4 6191 B13R1.466 Cc1ccc(cc1Cl)C(=O)CNC Amb18224989 [0,2,0,0,0,0|2,0,0]=4 6192 B13R1.466 Cc1ccc(cc1Cl)C(=O)NCC Amb24361009 [0,2,0,0,0,0|1,0,0]=3 6193 B13R1.466 Cc1ccc(cc1Cl)C(=O)NOC Amb25070934 [0,2,0,0,0,0|2,0,0]=4 6194 B13R1.466 Cc1ccc(cc1Cl)C(=O)OCC Amb22750096 [0,2,0,0,0,0|0,0,0]=2 6195 B13R1.466 Cc1ccc(cc1F)C(=N)OCC Amb18796415 [0,2,0,0,0,0|1,0,0]=3 6196 B13R1.466 Cc1ccc(cc1F)C(=O)CCC Amb18181101 [0,2,0,0,0,0|1,0,0]=3 6197 B13R1.466 Cc1ccc(cc1F)C(=O)CCCl Amb25804266 [0,2,0,0,0,0|2,0,0]=4 6198 B13R1.466 Cc1ccc(cc1F)C(=O)NCC Amb25101170 [0,2,0,0,0,0|1,0,0]=3 6199 B13R1.466 Cc1ccc(cc1I)C(=O)CCCl Amb25771854 [0,2,0,0,0,0|2,0,0]=4 6200 B13R1.466 Cc1ccc(cc1I)C(=O)NCC Amb20642284 [0,2,0,0,0,0|1,0,0]=3 6201 B13R1.466 Cc1ccc(cc1I)C(=O)NOC Amb19473098 [0,2,0,0,0,0|2,0,0]=4 6202 B13R1.466 Cc1ccc(cc1N)C(=O)CCBr Amb24679225 [0,2,0,0,0,0|2,0,0]=4 6203 B13R1.466 Cc1ccc(cc1N)C(=O)CCCl Amb25270772 [0,2,0,0,0,0|2,0,0]=4 6204 B13R1.466 Cc1ccc(cc1N)C(=O)CNC Amb18862930 [0,2,0,0,0,0|2,0,0]=4 6205 B13R1.466 Cc1ccc(cc1N)C(=O)NOC Amb24708982 [0,2,0,0,0,0|2,0,0]=4 6206 B13R1.466 Cc1ccc(cc1N)C(C)OCC Amb23541108 [0,2,0,0,0,0|1,0,1]=4 6207 B13R1.466 Cc1ccc(cc1N)N(C)OCC Amb24573439 [0,2,0,0,0,0|2,0,0]=4 6208 B13R1.466 Cc1ccc(cc1O)C(=O)CNC Amb25786501 [0,2,0,0,0,0|2,0,0]=4 6209 B13R1.466 Cc1ccc(cc1O)C(=O)NOC Amb25817501 [0,2,0,0,0,0|2,0,0]=4 6210 B13R1.466 Cc1ccc(cc1S)C(=O)OCC Amb25153675 [0,2,0,0,0,0|0,0,0]=2 6211 B13R1.466 ClCCC(=O)c1ccc(c(c1)Br)C Amb17358597 [0,2,0,0,0,0|2,0,0]=4 6212 B13R1.466 ClCCC(=O)c1ccc(c(c1)Br)Cl Amb17371796 [0,2,0,0,0,0|2,0,0]=4 6213 B13R1.466 ClCCC(=O)c1ccc(c(c1)Br)F Amb17361081 [0,2,0,0,0,0|2,0,0]=4 6214 B13R1.466 ClCCC(=O)c1ccc(c(c1)C)C Amb17109230 [0,2,0,0,0,0|2,0,0]=4 6215 B13R1.466 ClCCC(=O)c1ccc(c(c1)C)Cl Amb17109160 [0,2,0,0,0,0|2,0,0]=4 6216 B13R1.466 ClCCC(=O)c1ccc(c(c1)C)F Amb17109193 [0,2,0,0,0,0|2,0,0]=4 6217 B13R1.466 ClCCC(=O)c1ccc(c(c1)Cl)Cl Amb17198800 [0,2,0,0,0,0|2,0,0]=4 6218 B13R1.466 ClCCC(=O)c1ccc(c(c1)F)F Amb17194890 [0,2,0,0,0,0|2,0,0]=4 6219 B13R1.466 ClCCC(=O)c1ccc(c(c1)N)N Amb17202032 [0,2,0,0,0,0|2,0,0]=4 6220 B13R1.466 NCCC(=O)c1cc(Cl)c(Cl)cc1 Amb18623874 [0,2,0,0,0,0|2,0,0]=4 6221 B13R1.466 NCCC(=O)c1cc(Cl)c(F)cc1 Amb18244117 [0,2,0,0,0,0|2,0,0]=4 6222 B13R1.466 NCCC(=O)c1ccc(c(c1)C)C Amb17194509 [0,2,0,0,0,0|2,0,0]=4 6223 B13R1.466 NCCC(=O)c1ccc(c(c1)C)F Amb17194545 [0,2,0,0,0,0|2,0,0]=4 6224 B13R1.466 NCCC(=O)c1ccc(c(c1)F)F Amb17194570 [0,2,0,0,0,0|2,0,0]=4 6225 B13R1.466 Nc1cc(ccc1F)C(=O)CCBr Amb24639290 [0,2,0,0,0,0|2,0,0]=4 6226 B13R1.466 Nc1cc(ccc1F)C(=O)CCCl Amb24596634 [0,2,0,0,0,0|2,0,0]=4 6227 B13R1.466 Nc1cc(ccc1O)C(=O)CCCl Amb24727373 [0,2,0,0,0,0|2,0,0]=4 6228 B13R1.466 Nc1cc(ccc1S)C(=O)CCBr Amb24742456 [0,2,0,0,0,0|2,0,0]=4 6229 B13R1.466 Nc1ccc(cc1Br)C(=O)CCCl Amb24566647 [0,2,0,0,0,0|2,0,0]=4 6230 B13R1.466 Nc1ccc(cc1Cl)C(=O)CCBr Amb25352155 [0,2,0,0,0,0|2,0,0]=4 6231 B13R1.466 Nc1ccc(cc1Cl)C(=O)CCCl Amb25325145 [0,2,0,0,0,0|2,0,0]=4 6232 B13R1.466 Nc1ccc(cc1O)C(=O)CCBr Amb25248649 [0,2,0,0,0,0|2,0,0]=4 6233 B13R1.466 Nc1ccc(cc1O)C(=O)CCCl Amb24537046 [0,2,0,0,0,0|2,0,0]=4 6234 B13R1.466 Nc1ccc(cc1S)C(=O)CCBr Amb25269694 [0,2,0,0,0,0|2,0,0]=4 6235 B13R1.466 Nc1ccc(cc1S)C(=O)CCCl Amb24536915 [0,2,0,0,0,0|2,0,0]=4 6236 B13R1.466 O=C(CCBr)c1cc(Br)c(Cl)cc1 Amb25131203 [0,2,0,0,0,0|2,0,0]=4 6237 B13R1.466 O=C(CCBr)c1cc(Br)c(I)cc1 Amb25827605 [0,2,0,0,0,0|2,0,0]=4 6238 B13R1.466 O=C(CCBr)c1cc(Cl)c(I)cc1 Amb25103233 [0,2,0,0,0,0|2,0,0]=4 6239 B13R1.466 O=C(CCBr)c1ccc(Br)c(F)c1 Amb25732374 [0,2,0,0,0,0|2,0,0]=4 6240 B13R1.466 O=C(CCBr)c1ccc(Br)c(I)c1 Amb25155358 [0,2,0,0,0,0|2,0,0]=4 6241 B13R1.466 O=C(CCCl)c1cc(Cl)c(Br)cc1 Amb25376944 [0,2,0,0,0,0|2,0,0]=4 6242 B13R1.466 O=C(CCCl)c1cc(Cl)c(F)cc1 Amb25252942 [0,2,0,0,0,0|2,0,0]=4 6243 B13R1.466 O=C(CCCl)c1cc(Cl)c(S)cc1 Amb24697054 [0,2,0,0,0,0|2,0,0]=4 6244 B13R1.466 O=C(CCCl)c1cc(F)c(I)cc1 Amb24678889 [0,2,0,0,0,0|2,0,0]=4 6245 B13R1.466 O=C(CCCl)c1cc(I)c(F)cc1 Amb25800207 [0,2,0,0,0,0|2,0,0]=4 6246 B13R1.466 O=C(CCCl)c1ccc(Cl)c(F)c1 Amb24461725 [0,2,0,0,0,0|2,0,0]=4 6247 B13R1.466 O=C(CCCl)c1ccc(Cl)c(I)c1 Amb25154874 [0,2,0,0,0,0|2,0,0]=4 6248 B13R1.466 O=C(CCCl)c1ccc(S)c(F)c1 Amb25253267 [0,2,0,0,0,0|2,0,0]=4 6249 B13R1.466 OCCC(=O)c1cc(Cl)c(Cl)cc1 Amb24397009 [0,2,0,0,0,0|2,0,0]=4 6250 B13R1.466 OCCC(=O)c1cc(Cl)c(F)cc1 Amb25699935 [0,2,0,0,0,0|2,0,0]=4 6251 B13R1.466 OCCC(=O)c1cc(F)c(F)cc1 Amb18564363 [0,2,0,0,0,0|2,0,0]=4 6252 B13R1.466 OCCC(=O)c1ccc(O)c(O)c1 Amb24584527 [0,2,0,0,0,0|2,0,0]=4 6253 B13R1.466 Oc1cc(ccc1Br)C(=O)CCBr Amb25068997 [0,2,0,0,0,0|2,0,0]=4 6254 B13R1.466 Oc1cc(ccc1Cl)C(=O)CCBr Amb25288974 [0,2,0,0,0,0|2,0,0]=4 6255 B13R1.466 Oc1cc(ccc1F)C(=O)CCBr Amb25155031 [0,2,0,0,0,0|2,0,0]=4 6256 B13R1.466 Oc1cc(ccc1F)C(=O)CCCl Amb24427748 [0,2,0,0,0,0|2,0,0]=4 6257 B13R1.466 Oc1cc(ccc1O)C(=O)CCBr Amb18136877 [0,2,0,0,0,0|2,0,0]=4 6258 B13R1.466 Oc1cc(ccc1O)C(=O)CCCl Amb18130749 [0,2,0,0,0,0|2,0,0]=4 6259 B13R1.466 Oc1ccc(cc1Br)C(=O)CCBr Amb25109553 [0,2,0,0,0,0|2,0,0]=4 6260 B13R1.466 Oc1ccc(cc1Br)C(=O)CCCl Amb24666835 [0,2,0,0,0,0|2,0,0]=4 6261 B13R1.466 Oc1ccc(cc1F)C(=O)CCCl Amb25328407 [0,2,0,0,0,0|2,0,0]=4 6262 B13R1.466 Oc1ccc(cc1I)C(=O)CCBr Amb24658731 [0,2,0,0,0,0|2,0,0]=4 6263 B13R1.466 SCCC(=O)c1ccc(c(c1)C)C Amb17401971 [0,2,0,0,0,0|2,0,0]=4 6264 B13R1.466 SCCC(=O)c1ccc(c(c1)C)F Amb17402256 [0,2,0,0,0,0|2,0,0]=4 6265 B13R1.466 [13CH3][13CH2]O[13C](=O)c1ccc(c(c1)O)O Amb17613775 [0,2,0,0,0,0|0,0,0]=2 6266 B13R1.1511 BrCCC(=O)c1ccc(cc1C)C Amb17437873 [0,2,0,0,0,0|2,0,0]=4 6267 B13R1.1511 BrCCC(=O)c1ccc(cc1Cl)Cl Amb17437869 [0,2,0,0,0,0|2,0,0]=4 6268 B13R1.1511 CC#CC(=O)c1ccc(F)cc1Cl Amb25127794 [0,2,0,0,0,0|1,0,1]=4 6269 B13R1.1511 CC1=CC=C(C(=O)N1)C(=O)OCC Amb20247956 [0,2,0,0,0,0|1,0,0]=3 6270 B13R1.1511 CC1=CC=C(C(=O)NCC)C(=O)N1 Amb24573884 [0,2,0,0,0,0|2,0,0]=4 6271 B13R1.1511 CC1=CC=C(C(=O)OCC)C(=O)O1 Amb24559532 [0,2,0,0,0,0|1,0,0]=3 6272 B13R1.1511 CC1=NC(=O)NC=C1C(=O)OCC Amb22435952 [0,2,0,0,0,0|2,0,0]=4 6273 B13R1.1511 CC=1NC(=O)C(=CN1)C(=O)OCC Amb17993355 [0,2,0,0,0,0|2,0,0]=4 6274 B13R1.1511 CC=1NC(=O)C=CC1C(=O)CCC Amb24434941 [0,2,0,0,0,0|2,0,0]=4 6275 B13R1.1511 CC=1NC(=O)C=CC1C(=O)OCC Amb19958715 [0,2,0,0,0,0|1,0,0]=3 6276 B13R1.1511 CC=1NC(=S)C(=CN1)C(=O)OCC Amb24490304 [0,2,0,0,0,0|2,0,0]=4 6277 B13R1.1511 CC=1NC(=S)N=CC1C(=O)OCC Amb22756914 [0,2,0,0,0,0|2,0,0]=4 6278 B13R1.1511 CCCC(=O)c1[n]cc(Br)cc1Br Amb24494231 [0,2,0,0,0,0|2,0,0]=4 6279 B13R1.1511 CCCC(=O)c1[n]cc(Cl)cc1Cl Amb25348620 [0,2,0,0,0,0|2,0,0]=4 6280 B13R1.1511 CCCC(=O)c1ccc(Br)cc1Cl Amb25251705 [0,2,0,0,0,0|1,0,0]=3 6281 B13R1.1511 CCCC(=O)c1ccc(Br)cc1F Amb20171340 [0,2,0,0,0,0|1,0,0]=3 6282 B13R1.1511 CCCC(=O)c1ccc(Br)cc1N Amb24460524 [0,2,0,0,0,0|1,0,0]=3 6283 B13R1.1511 CCCC(=O)c1ccc(Br)cc1O Amb24439413 [0,2,0,0,0,0|1,0,0]=3 6284 B13R1.1511 CCCC(=O)c1ccc(C)[n]c1C Amb24367543 [0,2,0,0,0,0|2,0,0]=4 6285 B13R1.1511 CCCC(=O)c1ccc(Cl)cc1F Amb19039640 [0,2,0,0,0,0|1,0,0]=3 6286 B13R1.1511 CCCC(=O)c1ccc(Cl)cc1O Amb18130566 [0,2,0,0,0,0|1,0,0]=3 6287 B13R1.1511 CCCC(=O)c1ccc(F)cc1Cl Amb18317157 [0,2,0,0,0,0|1,0,0]=3 6288 B13R1.1511 CCCC(=O)c1ccc(F)cc1I Amb25729705 [0,2,0,0,0,0|1,0,0]=3 6289 B13R1.1511 CCCC(=O)c1ccc(F)cc1N Amb25191852 [0,2,0,0,0,0|1,0,0]=3 6290 B13R1.1511 CCCC(=O)c1ccc(N)cc1Cl Amb24688539 [0,2,0,0,0,0|1,0,0]=3 6291 B13R1.1511 CCCC(=O)c1ccc(N)cc1O Amb24726258 [0,2,0,0,0,0|1,0,0]=3 6292 B13R1.1511 CCCC(=O)c1ccc(O)cc1Cl Amb18057543 [0,2,0,0,0,0|1,0,0]=3 6293 B13R1.1511 CCCC(=O)c1ccc(cc1Br)C Amb17348644 [0,2,0,0,0,0|1,0,0]=3 6294 B13R1.1511 CCCC(=O)c1ccc(cc1C)Br Amb17348645 [0,2,0,0,0,0|1,0,0]=3 6295 B13R1.1511 CCCC(=O)c1ccc(cc1C)Cl Amb17337142 [0,2,0,0,0,0|1,0,0]=3 6296 B13R1.1511 CCCS(=O)c1ccc(Br)cc1N Amb24428855 [0,2,0,0,0,0|2,0,0]=4 6297 B13R1.1511 CCCS(=O)c1ccc(Cl)cc1N Amb25836465 [0,2,0,0,0,0|2,0,0]=4 6298 B13R1.1511 CCCS(=O)c1ccc(F)cc1N Amb24604285 [0,2,0,0,0,0|2,0,0]=4 6299 B13R1.1511 CCCS(=O)c1ccc(N)cc1Br Amb25821981 [0,2,0,0,0,0|2,0,0]=4 6300 B13R1.1511 CCCS(=O)c1ccc(N)cc1Cl Amb25062674 [0,2,0,0,0,0|2,0,0]=4 6301 B13R1.1511 CCNC(=N)c1ccc(F)cc1Cl Amb25686399 [0,2,0,0,0,0|2,0,0]=4 6302 B13R1.1511 CCNC(=N)c1ccc(N)cc1O Amb25035457 [0,2,0,0,0,0|2,0,0]=4 6303 B13R1.1511 CCNC(=O)C1=CC=C(Cl)NC1=O Amb24397738 [0,2,0,0,0,0|2,0,0]=4 6304 B13R1.1511 CCNC(=O)N1C=CC(O)=CC1=O Amb25727761 [0,2,0,0,0,0|2,0,0]=4 6305 B13R1.1511 CCNC(=O)c1c[n]c(O)cc1O Amb24502599 [0,2,0,0,0,0|2,0,0]=4 6306 B13R1.1511 CCNC(=O)c1ccc(Br)cc1Cl Amb25052607 [0,2,0,0,0,0|1,0,0]=3 6307 B13R1.1511 CCNC(=O)c1ccc(Br)cc1I Amb24354067 [0,2,0,0,0,0|1,0,0]=3 6308 B13R1.1511 CCNC(=O)c1ccc(Br)cc1N Amb24465404 [0,2,0,0,0,0|1,0,0]=3 6309 B13R1.1511 CCNC(=O)c1ccc(Br)cc1S Amb24660713 [0,2,0,0,0,0|1,0,0]=3 6310 B13R1.1511 CCNC(=O)c1ccc(Cl)cc1F Amb19560278 [0,2,0,0,0,0|1,0,0]=3 6311 B13R1.1511 CCNC(=O)c1ccc(Cl)cc1I Amb25105644 [0,2,0,0,0,0|1,0,0]=3 6312 B13R1.1511 CCNC(=O)c1ccc(I)cc1O Amb25312155 [0,2,0,0,0,0|1,0,0]=3 6313 B13R1.1511 CCNC(=O)c1ccc(N)cc1F Amb18956449 [0,2,0,0,0,0|1,0,0]=3 6314 B13R1.1511 CCNC(=O)c1ccc(N)cc1N Amb18281737 [0,2,0,0,0,0|1,0,0]=3 6315 B13R1.1511 CCNC(=O)c1ccc(N)cc1O Amb25269366 [0,2,0,0,0,0|1,0,0]=3 6316 B13R1.1511 CCNC(=O)c1ccc(O)cc1Cl Amb24454719 [0,2,0,0,0,0|1,0,0]=3 6317 B13R1.1511 CCNC(=O)c1ccc(cc1Cl)N Amb1120144 [0,2,0,0,0,0|1,0,0]=3 6318 B13R1.1511 CCNC(=O)c1ccc(cc1Cl)N Amb13949225 [0,2,0,0,0,0|1,0,0]=3 6319 B13R1.1511 CCNC(=O)c1ccc(cc1I)F Amb11335177 [0,2,0,0,0,0|1,0,0]=3 6320 B13R1.1511 CCNC(=O)c1ccc(cc1N)Cl Amb1121355 [0,2,0,0,0,0|1,0,0]=3 6321 B13R1.1511 CCNC(=O)c1ccc(cc1O)Br Amb11584905 [0,2,0,0,0,0|1,0,0]=3 6322 B13R1.1511 CCN\C(\N)=C/1\C=CC(=N)C=C1O Amb25054499 [0,2,0,0,0,0|2,0,0]=4 6323 B13R1.1511 CCOC(=N)c1[n]cc(Br)cc1Br Amb25696683 [0,2,0,0,0,0|2,0,0]=4 6324 B13R1.1511 CCOC(=N)c1ccc(Cl)cc1Br Amb25096236 [0,2,0,0,0,0|1,0,0]=3 6325 B13R1.1511 CCOC(=N)c1ccc(Cl)cc1Cl Amb25081253 [0,2,0,0,0,0|1,0,0]=3 6326 B13R1.1511 CCOC(=N)c1ccc(Cl)cc1O Amb25102950 [0,2,0,0,0,0|1,0,0]=3 6327 B13R1.1511 CCOC(=N)c1ccc(N)cc1O Amb24542594 [0,2,0,0,0,0|1,0,0]=3 6328 B13R1.1511 CCOC(=N)c1ccc(O)cc1O Amb25799842 [0,2,0,0,0,0|1,0,0]=3 6329 B13R1.1511 CCOC(=O)C1=CN=C(N)NC1=O Amb18984540 [0,2,0,0,0,0|2,0,0]=4 6330 B13R1.1511 CCOC(=O)C1=CN=C(N)NC1=S Amb22449586 [0,2,0,0,0,0|2,0,0]=4 6331 B13R1.1511 CCOC(=O)C1=CN=C(S)NC1=O Amb20308298 [0,2,0,0,0,0|2,0,0]=4 6332 B13R1.1511 CCOC(=O)C1=CNC(=O)C=C1O Amb22411537 [0,2,0,0,0,0|1,0,0]=3 6333 B13R1.1511 CCOC(=O)C1=CNC(=O)N=C1N Amb18129197 [0,2,0,0,0,0|2,0,0]=4 6334 B13R1.1511 CCOC(=O)C1=CNC(=O)N=C1O Amb19958290 [0,2,0,0,0,0|2,0,0]=4 6335 B13R1.1511 CCOC(=O)C1=CNC(=O)NC1=O Amb20179331 [0,2,0,0,0,0|2,0,0]=4 6336 B13R1.1511 CCOC(=O)C1=CNC(=S)N=C1N Amb19816935 [0,2,0,0,0,0|2,0,0]=4 6337 B13R1.1511 CCOC(=O)C1=CNC(=S)NC1=O Amb20654027 [0,2,0,0,0,0|2,0,0]=4 6338 B13R1.1511 CCOC(=O)C1=CNC(O)=CC1=O Amb19330381 [0,2,0,0,0,0|1,0,0]=3 6339 B13R1.1511 CCOC(=O)C=1C=NC(=O)NC1N Amb19752969 [0,2,0,0,0,0|2,0,0]=4 6340 B13R1.1511 CCOC(=O)C=1C=NC(=S)NC1N Amb19812342 [0,2,0,0,0,0|2,0,0]=4 6341 B13R1.1511 CCOC(=O)C=1N=CC(=O)NC1N Amb18129198 [0,2,0,0,0,0|2,0,0]=4 6342 B13R1.1511 CCOC(=O)N1C=CC(=O)NC1=O Amb24636799 [0,2,0,0,0,0|2,0,0]=4 6343 B13R1.1511 CCOC(=O)N1C=CC(N)=NC1=O Amb25258360 [0,2,0,0,0,0|2,0,0]=4 6344 B13R1.1511 CCOC(=O)c1[n][n]c(Cl)cc1Cl Amb19516015 [0,2,0,0,0,0|2,0,0]=4 6345 B13R1.1511 CCOC(=O)c1[n][n]c(Cl)cc1N Amb24066510 [0,2,0,0,0,0|2,0,0]=4 6346 B13R1.1511 CCOC(=O)c1[n][n]c(O)cc1O Amb21963707 [0,2,0,0,0,0|2,0,0]=4 6347 B13R1.1511 CCOC(=O)c1[n]cc(Br)[n]c1Br Amb25113800 [0,2,0,0,0,0|2,0,0]=4 6348 B13R1.1511 CCOC(=O)c1[n]cc(Br)cc1Br Amb23440929 [0,2,0,0,0,0|1,0,0]=3 6349 B13R1.1511 CCOC(=O)c1[n]cc(Br)cc1Cl Amb22275973 [0,2,0,0,0,0|1,0,0]=3 6350 B13R1.1511 CCOC(=O)c1[n]cc(Br)cc1F Amb23399909 [0,2,0,0,0,0|1,0,0]=3 6351 B13R1.1511 CCOC(=O)c1[n]cc(Br)cc1N Amb19895092 [0,2,0,0,0,0|1,0,0]=3 6352 B13R1.1511 CCOC(=O)c1[n]cc(Br)cc1O Amb23399914 [0,2,0,0,0,0|1,0,0]=3 6353 B13R1.1511 CCOC(=O)c1[n]cc(Cl)[n]c1N Amb22276007 [0,2,0,0,0,0|2,0,0]=4 6354 B13R1.1511 CCOC(=O)c1[n]cc(Cl)cc1Br Amb22275972 [0,2,0,0,0,0|1,0,0]=3 6355 B13R1.1511 CCOC(=O)c1[n]cc(Cl)cc1Cl Amb21857453 [0,2,0,0,0,0|1,0,0]=3 6356 B13R1.1511 CCOC(=O)c1[n]cc(Cl)cc1F Amb22752616 [0,2,0,0,0,0|1,0,0]=3 6357 B13R1.1511 CCOC(=O)c1[n]cc(Cl)cc1N Amb21964719 [0,2,0,0,0,0|1,0,0]=3 6358 B13R1.1511 CCOC(=O)c1[n]cc(F)cc1Br Amb25742500 [0,2,0,0,0,0|1,0,0]=3 6359 B13R1.1511 CCOC(=O)c1[n]cc(F)cc1Cl Amb24383027 [0,2,0,0,0,0|1,0,0]=3 6360 B13R1.1511 CCOC(=O)c1[n]cc(F)cc1F Amb25715682 [0,2,0,0,0,0|1,0,0]=3 6361 B13R1.1511 CCOC(=O)c1[n]cc(I)cc1F Amb24596721 [0,2,0,0,0,0|1,0,0]=3 6362 B13R1.1511 CCOC(=O)c1[n]cc(N)cc1Cl Amb22495498 [0,2,0,0,0,0|1,0,0]=3 6363 B13R1.1511 CCOC(=O)c1[n]cc(N)cc1F Amb24608900 [0,2,0,0,0,0|1,0,0]=3 6364 B13R1.1511 CCOC(=O)c1[n]cc(N)cc1N Amb25713806 [0,2,0,0,0,0|1,0,0]=3 6365 B13R1.1511 CCOC(=O)c1c[n]c(Br)[n]c1Br Amb23437100 [0,2,0,0,0,0|2,0,0]=4 6366 B13R1.1511 CCOC(=O)c1c[n]c(Br)cc1Cl Amb24527981 [0,2,0,0,0,0|1,0,0]=3 6367 B13R1.1511 CCOC(=O)c1c[n]c(Br)cc1F Amb25755784 [0,2,0,0,0,0|1,0,0]=3 6368 B13R1.1511 CCOC(=O)c1c[n]c(Br)cc1N Amb25787056 [0,2,0,0,0,0|1,0,0]=3 6369 B13R1.1511 CCOC(=O)c1c[n]c(Cl)[n]c1N Amb19957984 [0,2,0,0,0,0|2,0,0]=4 6370 B13R1.1511 CCOC(=O)c1c[n]c(Cl)cc1O Amb25228191 [0,2,0,0,0,0|1,0,0]=3 6371 B13R1.1511 CCOC(=O)c1c[n]c(F)cc1Cl Amb24528493 [0,2,0,0,0,0|1,0,0]=3 6372 B13R1.1511 CCOC(=O)c1c[n]c(F)cc1F Amb22495153 [0,2,0,0,0,0|1,0,0]=3 6373 B13R1.1511 CCOC(=O)c1c[n]c(F)cc1I Amb24627269 [0,2,0,0,0,0|1,0,0]=3 6374 B13R1.1511 CCOC(=O)c1c[n]c(N)[n]c1Cl Amb23437066 [0,2,0,0,0,0|2,0,0]=4 6375 B13R1.1511 CCOC(=O)c1c[n]c(N)cc1Cl Amb25190187 [0,2,0,0,0,0|1,0,0]=3 6376 B13R1.1511 CCOC(=O)c1c[n]c(N)cc1N Amb22276072 [0,2,0,0,0,0|1,0,0]=3 6377 B13R1.1511 CCOC(=O)c1c[n]c(O)cc1Br Amb25780279 [0,2,0,0,0,0|1,0,0]=3 6378 B13R1.1511 CCOC(=O)c1c[n]c(O)cc1Cl Amb25058883 [0,2,0,0,0,0|1,0,0]=3 6379 B13R1.1511 CCOC(=O)c1ccc(Br)[n]c1Cl Amb21857508 [0,2,0,0,0,0|1,0,0]=3 6380 B13R1.1511 CCOC(=O)c1ccc(Br)[n]c1O Amb25287613 [0,2,0,0,0,0|1,0,0]=3 6381 B13R1.1511 CCOC(=O)c1ccc(Br)cc1N Amb18969849 [0,2,0,0,0,0|0,0,0]=2 6382 B13R1.1511 CCOC(=O)c1ccc(Br)cc1O Amb24182177 [0,2,0,0,0,0|0,0,0]=2 6383 B13R1.1511 CCOC(=O)c1ccc(Cl)[n]c1Br Amb21857514 [0,2,0,0,0,0|1,0,0]=3 6384 B13R1.1511 CCOC(=O)c1ccc(Cl)cc1Br Amb22001114 [0,2,0,0,0,0|0,0,0]=2 6385 B13R1.1511 CCOC(=O)c1ccc(F)[n]c1F Amb24424959 [0,2,0,0,0,0|1,0,0]=3 6386 B13R1.1511 CCOC(=O)c1ccc(F)[n]c1N Amb23438877 [0,2,0,0,0,0|1,0,0]=3 6387 B13R1.1511 CCOC(=O)c1ccc(F)cc1I Amb24443870 [0,2,0,0,0,0|0,0,0]=2 6388 B13R1.1511 CCOC(=O)c1ccc(F)cc1N Amb22234002 [0,2,0,0,0,0|0,0,0]=2 6389 B13R1.1511 CCOC(=O)c1ccc(F)cc1S Amb25312151 [0,2,0,0,0,0|0,0,0]=2 6390 B13R1.1511 CCOC(=O)c1ccc(I)cc1Cl Amb19944222 [0,2,0,0,0,0|0,0,0]=2 6391 B13R1.1511 CCOC(=O)c1ccc(I)cc1N Amb24685585 [0,2,0,0,0,0|0,0,0]=2 6392 B13R1.1511 CCOC(=O)c1ccc(N)[n]c1Br Amb24400298 [0,2,0,0,0,0|1,0,0]=3 6393 B13R1.1511 CCOC(=O)c1ccc(N)[n]c1N Amb24740688 [0,2,0,0,0,0|1,0,0]=3 6394 B13R1.1511 CCOC(=O)c1ccc(N)cc1Br Amb21980117 [0,2,0,0,0,0|0,0,0]=2 6395 B13R1.1511 CCOC(=O)c1ccc(N)cc1F Amb18982410 [0,2,0,0,0,0|0,0,0]=2 6396 B13R1.1511 CCOC(=O)c1ccc(N)cc1N Amb18291229 [0,2,0,0,0,0|0,0,0]=2 6397 B13R1.1511 CCOC(=O)c1ccc(N)cc1S Amb24103725 [0,2,0,0,0,0|0,0,0]=2 6398 B13R1.1511 CCOC(=O)c1ccc(O)[n]c1Br Amb24391800 [0,2,0,0,0,0|1,0,0]=3 6399 B13R1.1511 CCOC(=O)c1ccc(O)[n]c1Cl Amb24397183 [0,2,0,0,0,0|1,0,0]=3 6400 B13R1.1511 CCOC(=O)c1ccc(O)[n]c1O Amb20000932 [0,2,0,0,0,0|1,0,0]=3 6401 B13R1.1511 CCOC(=O)c1ccc(O)cc1Cl Amb22230640 [0,2,0,0,0,0|0,0,0]=2 6402 B13R1.1511 CCOC(=O)c1ccc(O)cc1F Amb23402004 [0,2,0,0,0,0|0,0,0]=2 6403 B13R1.1511 CCOC(=O)c1ccc(S)cc1O Amb24492397 [0,2,0,0,0,0|0,0,0]=2 6404 B13R1.1511 CCOC(=O)c1ccc(cc1F)I Amb16231914 [0,2,0,0,0,0|0,0,0]=2 6405 B13R1.1511 CCOC(=O)c1ccc(cc1O)F Amb16230832 [0,2,0,0,0,0|0,0,0]=2 6406 B13R1.1511 CCOC(=O)c1ccc(nc1N)Cl Amb10808728 [0,2,0,0,0,0|1,0,0]=3 6407 B13R1.1511 CCOC(=O)c1cnc([nH]c1=O)C Amb1397689 [0,2,0,0,0,0|2,0,0]=4 6408 B13R1.1511 CCOC(=O)c1cnc(cc1Cl)C Amb10604372 [0,2,0,0,0,0|1,0,0]=3 6409 B13R1.1511 CCOC(=O)c1cnc(nc1C)C Amb10067178 [0,2,0,0,0,0|2,0,0]=4 6410 B13R1.1511 CCOC(=O)c1cnc(nc1C)Cl Amb10842192 [0,2,0,0,0,0|2,0,0]=4 6411 B13R1.1511 CCOC(=O)c1cnc(nc1N)C Amb16230859 [0,2,0,0,0,0|2,0,0]=4 6412 B13R1.1511 CCOC(=O)c1cnc(nc1N)S Amb1912368 [0,2,0,0,0,0|2,0,0]=4 6413 B13R1.1511 CCOC(=O)c1cnc(nc1N)[S-] Amb2303454 [0,2,0,0,0,0|2,0,0]=4 6414 B13R1.1511 CCSC(=O)c1ccc(N)cc1O Amb25065299 [0,2,0,0,0,0|0,1,0]=3 6415 B13R1.1511 CN(OCC)c1ccc(Cl)cc1N Amb24714875 [0,2,0,0,0,0|2,0,0]=4 6416 B13R1.1511 CN(OCC)c1ccc(I)cc1N Amb24760738 [0,2,0,0,0,0|2,0,0]=4 6417 B13R1.1511 CN(OCC)c1ccc(N)cc1Br Amb24609696 [0,2,0,0,0,0|2,0,0]=4 6418 B13R1.1511 CN(OCC)c1ccc(N)cc1F Amb25261343 [0,2,0,0,0,0|2,0,0]=4 6419 B13R1.1511 CN(OCC)c1ccc(N)cc1I Amb24654922 [0,2,0,0,0,0|2,0,0]=4 6420 B13R1.1511 CNCC(=O)c1ccc(Br)cc1Cl Amb25066509 [0,2,0,0,0,0|2,0,0]=4 6421 B13R1.1511 CNCC(=O)c1ccc(Cl)cc1F Amb25327295 [0,2,0,0,0,0|2,0,0]=4 6422 B13R1.1511 CNCC(=O)c1ccc(F)cc1F Amb18564319 [0,2,0,0,0,0|2,0,0]=4 6423 B13R1.1511 CNCC(=O)c1ccc(O)cc1O Amb25180646 [0,2,0,0,0,0|2,0,0]=4 6424 B13R1.1511 CNCC(=O)c1ccc(cc1C)C Amb17233281 [0,2,0,0,0,0|2,0,0]=4 6425 B13R1.1511 CNCC(=O)c1ccc(cc1Cl)Cl Amb17314180 [0,2,0,0,0,0|2,0,0]=4 6426 B13R1.1511 CNNC(=O)c1ccc(I)cc1O Amb24613934 [0,2,0,0,0,0|2,0,0]=4 6427 B13R1.1511 CNOC(=O)c1ccc(Cl)cc1Cl Amb22441611 [0,2,0,0,0,0|1,0,0]=3 6428 B13R1.1511 COCC(=O)c1ccc(Br)cc1Br Amb24635403 [0,2,0,0,0,0|2,0,0]=4 6429 B13R1.1511 COCC(=O)c1ccc(Br)cc1F Amb25673834 [0,2,0,0,0,0|2,0,0]=4 6430 B13R1.1511 COCC(=O)c1ccc(Br)cc1N Amb25265180 [0,2,0,0,0,0|2,0,0]=4 6431 B13R1.1511 COCC(=O)c1ccc(Cl)cc1Br Amb25063936 [0,2,0,0,0,0|2,0,0]=4 6432 B13R1.1511 COCC(=O)c1ccc(Cl)cc1F Amb24436965 [0,2,0,0,0,0|2,0,0]=4 6433 B13R1.1511 COCC(=O)c1ccc(F)cc1Br Amb25158781 [0,2,0,0,0,0|2,0,0]=4 6434 B13R1.1511 COCC(=O)c1ccc(F)cc1Cl Amb24417510 [0,2,0,0,0,0|2,0,0]=4 6435 B13R1.1511 COCC(=O)c1ccc(F)cc1I Amb24688657 [0,2,0,0,0,0|2,0,0]=4 6436 B13R1.1511 COCC(=O)c1ccc(N)cc1Cl Amb24419632 [0,2,0,0,0,0|2,0,0]=4 6437 B13R1.1511 CONC(=O)c1ccc(Br)cc1I Amb24719164 [0,2,0,0,0,0|2,0,0]=4 6438 B13R1.1511 CONC(=O)c1ccc(Br)cc1N Amb24489400 [0,2,0,0,0,0|2,0,0]=4 6439 B13R1.1511 CONC(=O)c1ccc(Cl)cc1N Amb25310641 [0,2,0,0,0,0|2,0,0]=4 6440 B13R1.1511 CONC(=O)c1ccc(F)cc1N Amb25696827 [0,2,0,0,0,0|2,0,0]=4 6441 B13R1.1511 CONC(=O)c1ccc(F)cc1O Amb25356471 [0,2,0,0,0,0|2,0,0]=4 6442 B13R1.1511 CONC(=O)c1ccc(N)cc1F Amb25126204 [0,2,0,0,0,0|2,0,0]=4 6443 B13R1.1511 CONC(=O)c1ccc(cc1Br)F Amb16073193 [0,2,0,0,0,0|2,0,0]=4 6444 B13R1.1511 CONC(=O)c1ccc(cc1C)Br Amb11415618 [0,2,0,0,0,0|2,0,0]=4 6445 B13R1.1511 CONC(=O)c1ccc(cc1C)C Amb10704849 [0,2,0,0,0,0|2,0,0]=4 6446 B13R1.1511 CONC(=O)c1ccc(cc1Cl)Br Amb11415617 [0,2,0,0,0,0|2,0,0]=4 6447 B13R1.1511 CONC(=O)c1ccc(cc1F)Br Amb13980629 [0,2,0,0,0,0|2,0,0]=4 6448 B13R1.1511 CONC(=O)c1ccc(cc1F)Cl Amb16073227 [0,2,0,0,0,0|2,0,0]=4 6449 B13R1.1511 CONC(=O)c1ccc(cc1F)F Amb10704848 [0,2,0,0,0,0|2,0,0]=4 6450 B13R1.1511 CONC(=O)c1ccc(cc1I)F Amb11338471 [0,2,0,0,0,0|2,0,0]=4 6451 B13R1.1511 CONC(=O)c1ccc(cc1O)Br Amb11614901 [0,2,0,0,0,0|2,0,0]=4 6452 B13R1.1511 CSCC(=O)c1ccc(Br)cc1F Amb25121522 [0,2,0,0,0,0|2,0,0]=4 6453 B13R1.1511 CSCC(=O)c1ccc(Cl)cc1Br Amb25763152 [0,2,0,0,0,0|2,0,0]=4 6454 B13R1.1511 CSCC(=O)c1ccc(Cl)cc1Cl Amb24653210 [0,2,0,0,0,0|2,0,0]=4 6455 B13R1.1511 CSCC(=O)c1ccc(F)cc1Br Amb25244627 [0,2,0,0,0,0|2,0,0]=4 6456 B13R1.1511 CSCC(=O)c1ccc(F)cc1Cl Amb25716402 [0,2,0,0,0,0|2,0,0]=4 6457 B13R1.1511 CSCC(=O)c1ccc(O)cc1O Amb18321907 [0,2,0,0,0,0|2,0,0]=4 6458 B13R1.1511 C\C=C\C(=O)c1ccc(Cl)cc1Cl Amb25285692 [0,2,0,0,0,0|1,0,1]=4 6459 B13R1.1511 C\C=C\C(=O)c1ccc(F)cc1Cl Amb25740642 [0,2,0,0,0,0|1,0,1]=4 6460 B13R1.1511 C\C=C\C(=O)c1ccc(F)cc1F Amb25208918 [0,2,0,0,0,0|1,0,1]=4 6461 B13R1.1511 Cc1[n]c(Br)[n]cc1C(=O)OCC Amb24624581 [0,2,0,0,0,0|2,0,0]=4 6462 B13R1.1511 Cc1[n]c(Cl)ccc1C(=O)OCC Amb21856770 [0,2,0,0,0,0|1,0,0]=3 6463 B13R1.1511 Cc1[n]c(O)c[n]c1C(=O)OCC Amb24397186 [0,2,0,0,0,0|2,0,0]=4 6464 B13R1.1511 Cc1[n]c(O)ccc1C(=O)OCC Amb19889854 [0,2,0,0,0,0|1,0,0]=3 6465 B13R1.1511 Cc1[n]c(S)ccc1C(=O)OCC Amb24645850 [0,2,0,0,0,0|1,0,0]=3 6466 B13R1.1511 Cc1c[n]c(C(=O)NCC)c(C)c1 Amb25669000 [0,2,0,0,0,0|2,0,0]=4 6467 B13R1.1511 Cc1c[n]c(C(=O)OCC)c(C)[n]1 Amb25829425 [0,2,0,0,0,0|2,0,0]=4 6468 B13R1.1511 Cc1c[n]c(C(=O)OCC)c(Cl)c1 Amb22043821 [0,2,0,0,0,0|1,0,0]=3 6469 B13R1.1511 Cc1c[n]c(C(=O)OCC)c(F)c1 Amb25352179 [0,2,0,0,0,0|1,0,0]=3 6470 B13R1.1511 Cc1c[n]c(C(=O)OCC)c(N)[n]1 Amb24533465 [0,2,0,0,0,0|2,0,0]=4 6471 B13R1.1511 Cc1c[n]c(C(=O)OCC)c(O)[n]1 Amb22489778 [0,2,0,0,0,0|2,0,0]=4 6472 B13R1.1511 Cc1c[n]c(c(O)c1)C(=O)OCC Amb23403493 [0,2,0,0,0,0|1,0,0]=3 6473 B13R1.1511 Cc1cc(Br)[n]cc1C(=O)OCC Amb24596060 [0,2,0,0,0,0|1,0,0]=3 6474 B13R1.1511 Cc1cc(Br)c(c[n]1)C(=O)NCC Amb24502597 [0,2,0,0,0,0|2,0,0]=4 6475 B13R1.1511 Cc1cc(Br)c[n]c1C(=O)OCC Amb25076709 [0,2,0,0,0,0|1,0,0]=3 6476 B13R1.1511 Cc1cc(Br)ccc1C(=N)OCC Amb24065863 [0,2,0,0,0,0|1,0,0]=3 6477 B13R1.1511 Cc1cc(Br)ccc1C(=O)CCBr Amb24343927 [0,2,0,0,0,0|2,0,0]=4 6478 B13R1.1511 Cc1cc(Br)ccc1C(=O)CNC Amb18227884 [0,2,0,0,0,0|2,0,0]=4 6479 B13R1.1511 Cc1cc(Br)ccc1C(=O)CSC Amb25354551 [0,2,0,0,0,0|2,0,0]=4 6480 B13R1.1511 Cc1cc(Br)ccc1C(=O)\C=C\C Amb25769486 [0,2,0,0,0,0|1,0,1]=4 6481 B13R1.1511 Cc1cc(C)c(c[n]1)C(=N)OCC Amb24548083 [0,2,0,0,0,0|2,0,0]=4 6482 B13R1.1511 Cc1cc(Cl)[n]cc1C(=O)OCC Amb25347366 [0,2,0,0,0,0|1,0,0]=3 6483 B13R1.1511 Cc1cc(Cl)ccc1C(=O)CCCl Amb25328063 [0,2,0,0,0,0|2,0,0]=4 6484 B13R1.1511 Cc1cc(Cl)ccc1C(=O)CNC Amb18224988 [0,2,0,0,0,0|2,0,0]=4 6485 B13R1.1511 Cc1cc(Cl)ccc1C(=O)CSC Amb25038918 [0,2,0,0,0,0|2,0,0]=4 6486 B13R1.1511 Cc1cc(Cl)ccc1C(=O)OCC Amb22750095 [0,2,0,0,0,0|0,0,0]=2 6487 B13R1.1511 Cc1cc(Cl)ccc1C(=O)\C=C\C Amb25207091 [0,2,0,0,0,0|1,0,1]=4 6488 B13R1.1511 Cc1cc(F)[n]cc1C(=O)OCC Amb25187744 [0,2,0,0,0,0|1,0,0]=3 6489 B13R1.1511 Cc1cc(F)c(c[n]1)C(=O)OCC Amb25239519 [0,2,0,0,0,0|1,0,0]=3 6490 B13R1.1511 Cc1cc(F)ccc1C(=N)NCC Amb25788588 [0,2,0,0,0,0|2,0,0]=4 6491 B13R1.1511 Cc1cc(F)ccc1C(=N)OCC Amb25300090 [0,2,0,0,0,0|1,0,0]=3 6492 B13R1.1511 Cc1cc(F)ccc1C(=O)CCC Amb18184741 [0,2,0,0,0,0|1,0,0]=3 6493 B13R1.1511 Cc1cc(F)ccc1C(=O)CCCl Amb25856902 [0,2,0,0,0,0|2,0,0]=4 6494 B13R1.1511 Cc1cc(F)ccc1C(=O)COC Amb18185424 [0,2,0,0,0,0|2,0,0]=4 6495 B13R1.1511 Cc1cc(F)ccc1C(=O)CSC Amb18325534 [0,2,0,0,0,0|2,0,0]=4 6496 B13R1.1511 Cc1cc(F)ccc1C(=O)NCC Amb25755105 [0,2,0,0,0,0|1,0,0]=3 6497 B13R1.1511 Cc1cc(F)ccc1C(=O)OCC Amb23400332 [0,2,0,0,0,0|0,0,0]=2 6498 B13R1.1511 Cc1cc(I)c(cc1)C(=O)CCBr Amb24727317 [0,2,0,0,0,0|2,0,0]=4 6499 B13R1.1511 Cc1cc(I)ccc1C(=O)CCBr Amb25263837 [0,2,0,0,0,0|2,0,0]=4 6500 B13R1.1511 Cc1cc(I)ccc1C(=O)CCCl Amb25208334 [0,2,0,0,0,0|2,0,0]=4 6501 B13R1.1511 Cc1cc(I)ccc1C(=O)OCC Amb25154919 [0,2,0,0,0,0|0,0,0]=2 6502 B13R1.1511 Cc1cc(N)[n]cc1C(=O)OCC Amb25730996 [0,2,0,0,0,0|1,0,0]=3 6503 B13R1.1511 Cc1cc(N)c(c[n]1)C(=O)OCC Amb22499693 [0,2,0,0,0,0|1,0,0]=3 6504 B13R1.1511 Cc1cc(N)ccc1C(=O)CCC Amb18127946 [0,2,0,0,0,0|1,0,0]=3 6505 B13R1.1511 Cc1cc(N)ccc1C(=O)CCCl Amb24536768 [0,2,0,0,0,0|2,0,0]=4 6506 B13R1.1511 Cc1cc(N)ccc1C(=O)NCC Amb18957323 [0,2,0,0,0,0|1,0,0]=3 6507 B13R1.1511 Cc1cc(N)ccc1N(C)OCC Amb24714878 [0,2,0,0,0,0|2,0,0]=4 6508 B13R1.1511 Cc1cc(O)[n]cc1C(=O)NCC Amb22733824 [0,2,0,0,0,0|2,0,0]=4 6509 B13R1.1511 Cc1cc(O)[n]cc1C(=O)OCC Amb18128819 [0,2,0,0,0,0|1,0,0]=3 6510 B13R1.1511 Cc1cc(O)c(c[n]1)C(=O)OCC Amb18128827 [0,2,0,0,0,0|1,0,0]=3 6511 B13R1.1511 Cc1cc(O)c(cc1)C(=O)CCN Amb25047653 [0,2,0,0,0,0|2,0,0]=4 6512 B13R1.1511 Cc1cc(O)c(cc1)C(=O)\C=C\C Amb24633565 [0,2,0,0,0,0|1,0,1]=4 6513 B13R1.1511 Cc1cc(O)c[n]c1C(=O)OCC Amb23403489 [0,2,0,0,0,0|1,0,0]=3 6514 B13R1.1511 Cc1cc(O)ccc1C(=O)CCBr Amb25311744 [0,2,0,0,0,0|2,0,0]=4 6515 B13R1.1511 Cc1cc(O)ccc1C(=O)CCC Amb18554274 [0,2,0,0,0,0|1,0,0]=3 6516 B13R1.1511 Cc1cc(O)ccc1C(=O)CCCl Amb18055435 [0,2,0,0,0,0|2,0,0]=4 6517 B13R1.1511 Cc1cc(O)ccc1C(=O)CCN Amb24685242 [0,2,0,0,0,0|2,0,0]=4 6518 B13R1.1511 Cc1cc(O)ccc1C(=O)COC Amb25713570 [0,2,0,0,0,0|2,0,0]=4 6519 B13R1.1511 Cc1cc(O)ccc1C(=O)NOC Amb24440020 [0,2,0,0,0,0|2,0,0]=4 6520 B13R1.1511 Cc1cc(O)ccc1C(=O)OCC Amb18128611 [0,2,0,0,0,0|0,0,0]=2 6521 B13R1.1511 Cc1ccc(C(=C)OCC)c(C)c1 Amb25194926 [0,2,0,0,0,0|1,0,0]=3 6522 B13R1.1511 Cc1ccc(C(=N)OCC)c(C)c1 Amb18180668 [0,2,0,0,0,0|1,0,0]=3 6523 B13R1.1511 Cc1ccc(C(=O)CCBr)c(S)c1 Amb24539769 [0,2,0,0,0,0|2,0,0]=4 6524 B13R1.1511 Cc1ccc(C(=O)CCCl)c(F)c1 Amb25055665 [0,2,0,0,0,0|2,0,0]=4 6525 B13R1.1511 Cc1ccc(C(=O)CCO)c(C)c1 Amb18564080 [0,2,0,0,0,0|2,0,0]=4 6526 B13R1.1511 Cc1ccc(C(=O)CSC)c(C)c1 Amb19051957 [0,2,0,0,0,0|2,0,0]=4 6527 B13R1.1511 Cc1ccc(c(Br)c1)C(=O)CNC Amb24533505 [0,2,0,0,0,0|2,0,0]=4 6528 B13R1.1511 Cc1ccc(c(Br)c1)C(=O)OCC Amb22285063 [0,2,0,0,0,0|0,0,0]=2 6529 B13R1.1511 Cc1ccc(c(Cl)c1)C(=O)CCC Amb24685808 [0,2,0,0,0,0|1,0,0]=3 6530 B13R1.1511 Cc1ccc(c(Cl)c1)C(=O)COC Amb25277091 [0,2,0,0,0,0|2,0,0]=4 6531 B13R1.1511 Cc1ccc(c(Cl)c1)C(=O)NCC Amb19531816 [0,2,0,0,0,0|1,0,0]=3 6532 B13R1.1511 Cc1ccc(c(Cl)c1)C(=O)NOC Amb25293326 [0,2,0,0,0,0|2,0,0]=4 6533 B13R1.1511 Cc1ccc(c(Cl)c1)C(=O)OCC Amb22750097 [0,2,0,0,0,0|0,0,0]=2 6534 B13R1.1511 Cc1ccc(c(F)[n]1)C(=O)OCC Amb24390180 [0,2,0,0,0,0|1,0,0]=3 6535 B13R1.1511 Cc1ccc(c(F)c1)C(=O)CCC Amb25819908 [0,2,0,0,0,0|1,0,0]=3 6536 B13R1.1511 Cc1ccc(c(F)c1)C(=O)CNC Amb25157233 [0,2,0,0,0,0|2,0,0]=4 6537 B13R1.1511 Cc1ccc(c(F)c1)C(=O)NNC Amb24494269 [0,2,0,0,0,0|2,0,0]=4 6538 B13R1.1511 Cc1ccc(c(F)c1)C(=O)OCC Amb25083067 [0,2,0,0,0,0|0,0,0]=2 6539 B13R1.1511 Cc1ccc(c(I)c1)C(=O)NCC Amb23001185 [0,2,0,0,0,0|1,0,0]=3 6540 B13R1.1511 Cc1ccc(c(I)c1)C(=O)OCC Amb25353350 [0,2,0,0,0,0|0,0,0]=2 6541 B13R1.1511 Cc1ccc(c(N)[n]1)C(=O)OCC Amb18128680 [0,2,0,0,0,0|1,0,0]=3 6542 B13R1.1511 Cc1ccc(c(N)c1)C(=O)NCC Amb24390754 [0,2,0,0,0,0|1,0,0]=3 6543 B13R1.1511 Cc1ccc(c(N)c1)N(C)OCC Amb24567842 [0,2,0,0,0,0|2,0,0]=4 6544 B13R1.1511 Cc1ccc(c(N)c1)P(=O)OCC Amb25362256 [0,2,0,0,0,0|1,0,0]=3 6545 B13R1.1511 Cc1ccc(c(O)c1)C(=O)CCBr Amb25312287 [0,2,0,0,0,0|2,0,0]=4 6546 B13R1.1511 Cc1ccc(c(O)c1)C(=O)CCC Amb24492596 [0,2,0,0,0,0|1,0,0]=3 6547 B13R1.1511 Cc1ccc(c(O)c1)C(=O)CNC Amb25723071 [0,2,0,0,0,0|2,0,0]=4 6548 B13R1.1511 ClCCC(=O)c1ccc(cc1C)C Amb17194754 [0,2,0,0,0,0|2,0,0]=4 6549 B13R1.1511 ClCCC(=O)c1ccc(cc1Cl)Cl Amb17198856 [0,2,0,0,0,0|2,0,0]=4 6550 B13R1.1511 NCCC(=O)c1ccc(Cl)cc1Cl Amb18623683 [0,2,0,0,0,0|2,0,0]=4 6551 B13R1.1511 NCCC(=O)c1ccc(Cl)cc1O Amb24593495 [0,2,0,0,0,0|2,0,0]=4 6552 B13R1.1511 NCCC(=O)c1ccc(F)cc1F Amb18066157 [0,2,0,0,0,0|2,0,0]=4 6553 B13R1.1511 NCCC(=O)c1ccc(cc1C)C Amb17194511 [0,2,0,0,0,0|2,0,0]=4 6554 B13R1.1511 Nc1cc(Br)c(cc1)C(=O)CCBr Amb25268322 [0,2,0,0,0,0|2,0,0]=4 6555 B13R1.1511 Nc1cc(Br)ccc1C(=O)CCCl Amb22899321 [0,2,0,0,0,0|2,0,0]=4 6556 B13R1.1511 Nc1cc(Cl)c(cc1)C(=O)CCCl Amb24587209 [0,2,0,0,0,0|2,0,0]=4 6557 B13R1.1511 Nc1cc(Cl)ccc1C(=O)CCBr Amb24638309 [0,2,0,0,0,0|2,0,0]=4 6558 B13R1.1511 Nc1cc(Cl)ccc1C(=O)CCCl Amb25253625 [0,2,0,0,0,0|2,0,0]=4 6559 B13R1.1511 Nc1cc(F)ccc1C(=O)CCBr Amb24569469 [0,2,0,0,0,0|2,0,0]=4 6560 B13R1.1511 Nc1cc(F)ccc1C(=O)CCCl Amb24549383 [0,2,0,0,0,0|2,0,0]=4 6561 B13R1.1511 Nc1cc(O)ccc1C(=O)CCBr Amb24665967 [0,2,0,0,0,0|2,0,0]=4 6562 B13R1.1511 Nc1cc(O)ccc1C(=O)CCCl Amb25217411 [0,2,0,0,0,0|2,0,0]=4 6563 B13R1.1511 Nc1cc(S)ccc1C(=O)CCBr Amb25201770 [0,2,0,0,0,0|2,0,0]=4 6564 B13R1.1511 Nc1cc(S)ccc1C(=O)CCCl Amb25349640 [0,2,0,0,0,0|2,0,0]=4 6565 B13R1.1511 Nc1ccc(C(=O)CCBr)c(Cl)c1 Amb24651310 [0,2,0,0,0,0|2,0,0]=4 6566 B13R1.1511 Nc1ccc(C(=O)CCCl)c(N)c1 Amb24537164 [0,2,0,0,0,0|2,0,0]=4 6567 B13R1.1511 O=C(CCBr)c1ccc(Br)cc1Cl Amb25784596 [0,2,0,0,0,0|2,0,0]=4 6568 B13R1.1511 O=C(CCBr)c1ccc(Br)cc1S Amb24727552 [0,2,0,0,0,0|2,0,0]=4 6569 B13R1.1511 O=C(CCBr)c1ccc(Cl)cc1F Amb24444319 [0,2,0,0,0,0|2,0,0]=4 6570 B13R1.1511 O=C(CCBr)c1ccc(I)cc1Br Amb24727063 [0,2,0,0,0,0|2,0,0]=4 6571 B13R1.1511 O=C(CCBr)c1ccc(I)cc1Cl Amb25096327 [0,2,0,0,0,0|2,0,0]=4 6572 B13R1.1511 O=C(CCBr)c1ccc(S)cc1Br Amb24664595 [0,2,0,0,0,0|2,0,0]=4 6573 B13R1.1511 O=C(CCBr)c1ccc(S)cc1I Amb25268035 [0,2,0,0,0,0|2,0,0]=4 6574 B13R1.1511 O=C(CCCl)c1ccc(Br)cc1Br Amb24375665 [0,2,0,0,0,0|2,0,0]=4 6575 B13R1.1511 O=C(CCCl)c1ccc(Cl)cc1Br Amb25351647 [0,2,0,0,0,0|2,0,0]=4 6576 B13R1.1511 O=C(CCCl)c1ccc(Cl)cc1I Amb25729887 [0,2,0,0,0,0|2,0,0]=4 6577 B13R1.1511 O=C(CCCl)c1ccc(F)cc1S Amb24696773 [0,2,0,0,0,0|2,0,0]=4 6578 B13R1.1511 O=C(CCCl)c1ccc(I)cc1Cl Amb25154960 [0,2,0,0,0,0|2,0,0]=4 6579 B13R1.1511 O=C(CCCl)c1ccc(I)cc1F Amb25742472 [0,2,0,0,0,0|2,0,0]=4 6580 B13R1.1511 O=C(CCCl)c1ccc(S)cc1F Amb24628129 [0,2,0,0,0,0|2,0,0]=4 6581 B13R1.1511 O=C(OCCl)c1ccc(Cl)cc1Cl Amb24556077 [0,2,0,0,0,0|1,0,0]=3 6582 B13R1.1511 OCCC(=O)c1ccc(F)cc1F Amb18066168 [0,2,0,0,0,0|2,0,0]=4 6583 B13R1.1511 OCCC(=O)c1ccc(O)cc1O Amb24724065 [0,2,0,0,0,0|2,0,0]=4 6584 B13R1.1511 Oc1cc(Br)c(cc1)C(=O)CCBr Amb24392324 [0,2,0,0,0,0|2,0,0]=4 6585 B13R1.1511 Oc1cc(Br)ccc1C(=O)CCBr Amb25827053 [0,2,0,0,0,0|2,0,0]=4 6586 B13R1.1511 Oc1cc(Cl)c(cc1)C(=O)CCCl Amb18057545 [0,2,0,0,0,0|2,0,0]=4 6587 B13R1.1511 Oc1cc(Cl)ccc1C(=O)CCBr Amb24711176 [0,2,0,0,0,0|2,0,0]=4 6588 B13R1.1511 Oc1cc(F)ccc1C(=O)CCBr Amb24641390 [0,2,0,0,0,0|2,0,0]=4 6589 B13R1.1511 Oc1cc(F)ccc1C(=O)CCCl Amb24637964 [0,2,0,0,0,0|2,0,0]=4 6590 B13R1.1511 Oc1cc(I)c(cc1)C(=O)CCCl Amb25365009 [0,2,0,0,0,0|2,0,0]=4 6591 B13R1.1511 Oc1cc(I)ccc1C(=O)CCBr Amb24615697 [0,2,0,0,0,0|2,0,0]=4 6592 B13R1.1511 Oc1ccc(C(=O)CCBr)c(O)c1 Amb18136886 [0,2,0,0,0,0|2,0,0]=4 6593 B13R1.1511 Oc1ccc(C(=O)CCCl)c(F)c1 Amb24342241 [0,2,0,0,0,0|2,0,0]=4 6594 B13R1.1511 Oc1ccc(C(=O)CCCl)c(O)c1 Amb18553703 [0,2,0,0,0,0|2,0,0]=4 6595 B13R1.1511 SCCC(=O)c1ccc(cc1C)C Amb17401973 [0,2,0,0,0,0|2,0,0]=4 6596 B13R1.12 CC1=CNC=C(C1=O)C(=O)OCC Amb20671545 [0,2,0,0,0,0|1,0,0]=3 6597 B13R1.12 CC=1C(=O)NC=CC1C(=O)OCC Amb25050616 [0,2,0,0,0,0|1,0,0]=3 6598 B13R1.12 CCCC(=O)c1cccc(Br)c1Cl Amb25161229 [0,2,0,0,0,0|1,0,0]=3 6599 B13R1.12 CCCC(=O)c1cccc(Br)c1F Amb24740413 [0,2,0,0,0,0|1,0,0]=3 6600 B13R1.12 CCCC(=O)c1cccc(Cl)c1F Amb25300937 [0,2,0,0,0,0|1,0,0]=3 6601 B13R1.12 CCCC(=O)c1cccc(F)c1Br Amb25683045 [0,2,0,0,0,0|1,0,0]=3 6602 B13R1.12 CCCC(=O)c1cccc(F)c1Cl Amb25304754 [0,2,0,0,0,0|1,0,0]=3 6603 B13R1.12 CCCC(=O)c1cccc(F)c1F Amb25354410 [0,2,0,0,0,0|1,0,0]=3 6604 B13R1.12 CCCC(=O)c1cccc(F)c1N Amb24745420 [0,2,0,0,0,0|1,0,0]=3 6605 B13R1.12 CCCC(=O)c1cccc(N)c1F Amb25222342 [0,2,0,0,0,0|1,0,0]=3 6606 B13R1.12 CCCC(=O)c1cccc(O)c1O Amb24646659 [0,2,0,0,0,0|1,0,0]=3 6607 B13R1.12 CCCC(=O)c1cccc(c1C)C Amb17233221 [0,2,0,0,0,0|1,0,0]=3 6608 B13R1.12 CCCC(=O)c1cccc(c1Cl)Cl Amb17340709 [0,2,0,0,0,0|1,0,0]=3 6609 B13R1.12 CCCC(=O)c1cccc(c1O)C Amb17233421 [0,2,0,0,0,0|1,0,0]=3 6610 B13R1.12 CCCC(=O)c1cccc(c1O)Cl Amb17236840 [0,2,0,0,0,0|1,0,0]=3 6611 B13R1.12 CCCC(=O)c1cccc(c1O)F Amb17233891 [0,2,0,0,0,0|1,0,0]=3 6612 B13R1.12 CCNC(=O)C1=CC=CC(=O)N1C Amb24408041 [0,2,0,0,0,0|2,0,0]=4 6613 B13R1.12 CCNC(=O)C=1OC=CC(=O)C1O Amb25780067 [0,2,0,0,0,0|2,0,0]=4 6614 B13R1.12 CCNC(=O)c1[n]ccc(Cl)c1F Amb25855643 [0,2,0,0,0,0|2,0,0]=4 6615 B13R1.12 CCNC(=O)c1c[n]cc(Cl)c1O Amb25036151 [0,2,0,0,0,0|2,0,0]=4 6616 B13R1.12 CCNC(=O)c1c[n]cc(F)c1O Amb24594064 [0,2,0,0,0,0|2,0,0]=4 6617 B13R1.12 CCNC(=O)c1cc[n]c(Cl)c1I Amb25130162 [0,2,0,0,0,0|2,0,0]=4 6618 B13R1.12 CCNC(=O)c1cc[n]c(O)c1Br Amb24386591 [0,2,0,0,0,0|2,0,0]=4 6619 B13R1.12 CCNC(=O)c1cccc(Br)c1Cl Amb24432462 [0,2,0,0,0,0|1,0,0]=3 6620 B13R1.12 CCNC(=O)c1cccc(Br)c1I Amb24350127 [0,2,0,0,0,0|1,0,0]=3 6621 B13R1.12 CCNC(=O)c1cccc(Br)c1N Amb18273751 [0,2,0,0,0,0|1,0,0]=3 6622 B13R1.12 CCNC(=O)c1cccc(Cl)c1N Amb18938607 [0,2,0,0,0,0|1,0,0]=3 6623 B13R1.12 CCNC(=O)c1cccc(Cl)c1O Amb24502534 [0,2,0,0,0,0|1,0,0]=3 6624 B13R1.12 CCNC(=O)c1cccc(F)c1F Amb18326627 [0,2,0,0,0,0|1,0,0]=3 6625 B13R1.12 CCNC(=O)c1cccc(F)c1N Amb18286746 [0,2,0,0,0,0|1,0,0]=3 6626 B13R1.12 CCNC(=O)c1cccc(N)c1O Amb22229186 [0,2,0,0,0,0|1,0,0]=3 6627 B13R1.12 CCNC(=O)c1cccc(c1N)C Amb1114292 [0,2,0,0,0,0|1,0,0]=3 6628 B13R1.12 CCOB(O)c1cccc(Cl)c1Cl Amb25281899 [0,2,0,0,0,0|1,0,1]=4 6629 B13R1.12 CCOC(=N)c1cccc(F)c1F Amb24376282 [0,2,0,0,0,0|1,0,0]=3 6630 B13R1.12 CCOC(=N)c1cccc(O)c1O Amb24395894 [0,2,0,0,0,0|1,0,0]=3 6631 B13R1.12 CCOC(=O)C1=CC=CC(=O)N1C Amb22494718 [0,2,0,0,0,0|1,0,0]=3 6632 B13R1.12 CCOC(=O)C1=CC=CN(C)C1=O Amb22500755 [0,2,0,0,0,0|1,0,0]=3 6633 B13R1.12 CCOC(=O)C=1C=CNC(=O)C1Cl Amb24494403 [0,2,0,0,0,0|1,0,0]=3 6634 B13R1.12 CCOC(=O)C=1C=CNC(=O)C1O Amb23590702 [0,2,0,0,0,0|1,0,0]=3 6635 B13R1.12 CCOC(=O)C=1N=CNC(=O)C1Br Amb22011475 [0,2,0,0,0,0|2,0,0]=4 6636 B13R1.12 CCOC(=O)C=1NC=CC(=N)C1N Amb25669344 [0,2,0,0,0,0|1,0,0]=3 6637 B13R1.12 CCOC(=O)C=1NC=NC(=N)C1N Amb25152965 [0,2,0,0,0,0|2,0,0]=4 6638 B13R1.12 CCOC(=O)N1C=CN=C(Cl)C1=O Amb21960896 [0,2,0,0,0,0|2,0,0]=4 6639 B13R1.12 CCOC(=O)N1C=CNC(=O)C1=O Amb22728049 [0,2,0,0,0,0|2,0,0]=4 6640 B13R1.12 CCOC(=O)c1[n]c[n]c(Cl)c1Cl Amb22234814 [0,2,0,0,0,0|2,0,0]=4 6641 B13R1.12 CCOC(=O)c1[n]c[n]c(Cl)c1N Amb24395760 [0,2,0,0,0,0|2,0,0]=4 6642 B13R1.12 CCOC(=O)c1[n]c[n]c(N)c1Br Amb25710473 [0,2,0,0,0,0|2,0,0]=4 6643 B13R1.12 CCOC(=O)c1[n]c[n]c(N)c1Cl Amb22234813 [0,2,0,0,0,0|2,0,0]=4 6644 B13R1.12 CCOC(=O)c1[n]c[n]c(O)c1Cl Amb24367880 [0,2,0,0,0,0|2,0,0]=4 6645 B13R1.12 CCOC(=O)c1[n]ccc(Br)c1Cl Amb24558811 [0,2,0,0,0,0|1,0,0]=3 6646 B13R1.12 CCOC(=O)c1[n]ccc(Br)c1N Amb24745364 [0,2,0,0,0,0|1,0,0]=3 6647 B13R1.12 CCOC(=O)c1[n]ccc(Br)c1O Amb24374919 [0,2,0,0,0,0|1,0,0]=3 6648 B13R1.12 CCOC(=O)c1[n]ccc(Cl)c1F Amb25834712 [0,2,0,0,0,0|1,0,0]=3 6649 B13R1.12 CCOC(=O)c1[n]ccc(F)c1Br Amb24708177 [0,2,0,0,0,0|1,0,0]=3 6650 B13R1.12 CCOC(=O)c1[n]ccc(F)c1Cl Amb24528491 [0,2,0,0,0,0|1,0,0]=3 6651 B13R1.12 CCOC(=O)c1[n]ccc(F)c1N Amb24564803 [0,2,0,0,0,0|1,0,0]=3 6652 B13R1.12 CCOC(=O)c1[n]ccc(N)c1Br Amb24501509 [0,2,0,0,0,0|1,0,0]=3 6653 B13R1.12 CCOC(=O)c1[n]ccc(O)c1Br Amb25311366 [0,2,0,0,0,0|1,0,0]=3 6654 B13R1.12 CCOC(=O)c1[n]ccc(O)c1Cl Amb24528294 [0,2,0,0,0,0|1,0,0]=3 6655 B13R1.12 CCOC(=O)c1c[n]cc(Br)c1N Amb22498269 [0,2,0,0,0,0|1,0,0]=3 6656 B13R1.12 CCOC(=O)c1c[n]cc(Cl)c1Br Amb24527982 [0,2,0,0,0,0|1,0,0]=3 6657 B13R1.12 CCOC(=O)c1c[n]cc(F)c1Cl Amb25789440 [0,2,0,0,0,0|1,0,0]=3 6658 B13R1.12 CCOC(=O)c1c[n]cc(F)c1I Amb24628204 [0,2,0,0,0,0|1,0,0]=3 6659 B13R1.12 CCOC(=O)c1c[n]cc(F)c1N Amb22498566 [0,2,0,0,0,0|1,0,0]=3 6660 B13R1.12 CCOC(=O)c1c[n]cc(F)c1O Amb25855574 [0,2,0,0,0,0|1,0,0]=3 6661 B13R1.12 CCOC(=O)c1c[n]cc(I)c1N Amb22498561 [0,2,0,0,0,0|1,0,0]=3 6662 B13R1.12 CCOC(=O)c1c[n]cc(N)c1Br Amb25799718 [0,2,0,0,0,0|1,0,0]=3 6663 B13R1.12 CCOC(=O)c1c[n]cc(N)c1N Amb24183881 [0,2,0,0,0,0|1,0,0]=3 6664 B13R1.12 CCOC(=O)c1c[n]cc(O)c1Br Amb25275672 [0,2,0,0,0,0|1,0,0]=3 6665 B13R1.12 CCOC(=O)c1c[n]cc(O)c1Cl Amb25217186 [0,2,0,0,0,0|1,0,0]=3 6666 B13R1.12 CCOC(=O)c1cc[n]c(Br)c1N Amb25364876 [0,2,0,0,0,0|1,0,0]=3 6667 B13R1.12 CCOC(=O)c1cc[n]c(Br)c1O Amb24653941 [0,2,0,0,0,0|1,0,0]=3 6668 B13R1.12 CCOC(=O)c1cc[n]c(Cl)c1Cl Amb25351651 [0,2,0,0,0,0|1,0,0]=3 6669 B13R1.12 CCOC(=O)c1cc[n]c(Cl)c1F Amb25670295 [0,2,0,0,0,0|1,0,0]=3 6670 B13R1.12 CCOC(=O)c1cc[n]c(Cl)c1N Amb25751995 [0,2,0,0,0,0|1,0,0]=3 6671 B13R1.12 CCOC(=O)c1cc[n]c(F)c1Br Amb24696482 [0,2,0,0,0,0|1,0,0]=3 6672 B13R1.12 CCOC(=O)c1cc[n]c(F)c1I Amb25287479 [0,2,0,0,0,0|1,0,0]=3 6673 B13R1.12 CCOC(=O)c1cc[n]c(F)c1N Amb24548483 [0,2,0,0,0,0|1,0,0]=3 6674 B13R1.12 CCOC(=O)c1cc[n]c(I)c1N Amb25327506 [0,2,0,0,0,0|1,0,0]=3 6675 B13R1.12 CCOC(=O)c1cc[n]c(N)c1Br Amb24356810 [0,2,0,0,0,0|1,0,0]=3 6676 B13R1.12 CCOC(=O)c1cc[n]c(N)c1N Amb25751976 [0,2,0,0,0,0|1,0,0]=3 6677 B13R1.12 CCOC(=O)c1cc[n]c(O)c1F Amb25064624 [0,2,0,0,0,0|1,0,0]=3 6678 B13R1.12 CCOC(=O)c1cccc(Br)c1Cl Amb25731174 [0,2,0,0,0,0|0,0,0]=2 6679 B13R1.12 CCOC(=O)c1cccc(Br)c1F Amb21858199 [0,2,0,0,0,0|0,0,0]=2 6680 B13R1.12 CCOC(=O)c1cccc(Br)c1N Amb18968669 [0,2,0,0,0,0|0,0,0]=2 6681 B13R1.12 CCOC(=O)c1cccc(Br)c1O Amb22501163 [0,2,0,0,0,0|0,0,0]=2 6682 B13R1.12 CCOC(=O)c1cccc(Cl)c1Br Amb25827083 [0,2,0,0,0,0|0,0,0]=2 6683 B13R1.12 CCOC(=O)c1cccc(Cl)c1F Amb20671108 [0,2,0,0,0,0|0,0,0]=2 6684 B13R1.12 CCOC(=O)c1cccc(Cl)c1N Amb18968011 [0,2,0,0,0,0|0,0,0]=2 6685 B13R1.12 CCOC(=O)c1cccc(F)c1Cl Amb22499763 [0,2,0,0,0,0|0,0,0]=2 6686 B13R1.12 CCOC(=O)c1cccc(F)c1I Amb24534219 [0,2,0,0,0,0|0,0,0]=2 6687 B13R1.12 CCOC(=O)c1cccc(F)c1N Amb18968680 [0,2,0,0,0,0|0,0,0]=2 6688 B13R1.12 CCOC(=O)c1cccc(I)c1F Amb23402041 [0,2,0,0,0,0|0,0,0]=2 6689 B13R1.12 CCOC(=O)c1cccc(I)c1O Amb25329546 [0,2,0,0,0,0|0,0,0]=2 6690 B13R1.12 CCOC(=O)c1cccc(N)c1Br Amb22490440 [0,2,0,0,0,0|0,0,0]=2 6691 B13R1.12 CCOC(=O)c1cccc(N)c1F Amb22490329 [0,2,0,0,0,0|0,0,0]=2 6692 B13R1.12 CCOC(=O)c1cccc(N)c1N Amb18128674 [0,2,0,0,0,0|0,0,0]=2 6693 B13R1.12 CCOC(=O)c1cccc(O)c1Br Amb24400245 [0,2,0,0,0,0|0,0,0]=2 6694 B13R1.12 CCOC(=O)c1cccc(O)c1F Amb18648838 [0,2,0,0,0,0|0,0,0]=2 6695 B13R1.12 CCOC(=O)c1cccc(O)c1N Amb18128813 [0,2,0,0,0,0|0,0,0]=2 6696 B13R1.12 CCOC(=O)c1cccc(S)c1F Amb25201793 [0,2,0,0,0,0|0,0,0]=2 6697 B13R1.12 CCOC(=O)c1cccc(S)c1N Amb18273959 [0,2,0,0,0,0|0,0,0]=2 6698 B13R1.12 CNCC(=O)c1cccc(Br)c1Cl Amb25038829 [0,2,0,0,0,0|2,0,0]=4 6699 B13R1.12 CNCC(=O)c1cccc(Br)c1F Amb25158632 [0,2,0,0,0,0|2,0,0]=4 6700 B13R1.12 CNCC(=O)c1cccc(Cl)c1Cl Amb18866812 [0,2,0,0,0,0|2,0,0]=4 6701 B13R1.12 CNCC(=O)c1cccc(F)c1F Amb25795369 [0,2,0,0,0,0|2,0,0]=4 6702 B13R1.12 CNCC(=O)c1cccc(F)c1O Amb25320557 [0,2,0,0,0,0|2,0,0]=4 6703 B13R1.12 CNCC(=O)c1cccc(O)c1F Amb25755292 [0,2,0,0,0,0|2,0,0]=4 6704 B13R1.12 CNNC(=O)c1cccc(F)c1O Amb25834626 [0,2,0,0,0,0|2,0,0]=4 6705 B13R1.12 COCC(=O)c1cccc(Br)c1Cl Amb24405646 [0,2,0,0,0,0|2,0,0]=4 6706 B13R1.12 COCC(=O)c1cccc(Br)c1F Amb25708288 [0,2,0,0,0,0|2,0,0]=4 6707 B13R1.12 COCC(=O)c1cccc(Cl)c1F Amb24520727 [0,2,0,0,0,0|2,0,0]=4 6708 B13R1.12 COCC(=O)c1cccc(F)c1Br Amb25158780 [0,2,0,0,0,0|2,0,0]=4 6709 B13R1.12 COCC(=O)c1cccc(F)c1F Amb24700777 [0,2,0,0,0,0|2,0,0]=4 6710 B13R1.12 COCC(=O)c1cccc(N)c1F Amb25053756 [0,2,0,0,0,0|2,0,0]=4 6711 B13R1.12 CONC(=O)c1cccc(Cl)c1O Amb24706516 [0,2,0,0,0,0|2,0,0]=4 6712 B13R1.12 CONC(=O)c1cccc(F)c1Br Amb24458817 [0,2,0,0,0,0|2,0,0]=4 6713 B13R1.12 CONC(=O)c1cccc(F)c1Cl Amb25707101 [0,2,0,0,0,0|2,0,0]=4 6714 B13R1.12 CONC(=O)c1cccc(O)c1O Amb24716484 [0,2,0,0,0,0|2,0,0]=4 6715 B13R1.12 CONC(=O)c1cccc(c1Cl)Cl Amb16072978 [0,2,0,0,0,0|2,0,0]=4 6716 B13R1.12 CSCC(=O)c1cccc(Br)c1Cl Amb24648355 [0,2,0,0,0,0|2,0,0]=4 6717 B13R1.12 CSCC(=O)c1cccc(Cl)c1Cl Amb25060160 [0,2,0,0,0,0|2,0,0]=4 6718 B13R1.12 CSCC(=O)c1cccc(F)c1Cl Amb24489177 [0,2,0,0,0,0|2,0,0]=4 6719 B13R1.12 CSCC(=O)c1cccc(F)c1F Amb25341960 [0,2,0,0,0,0|2,0,0]=4 6720 B13R1.12 C\C=C\C(=O)c1cccc(Br)c1F Amb24496636 [0,2,0,0,0,0|1,0,1]=4 6721 B13R1.12 C\C=C\C(=O)c1cccc(C)c1C Amb24496417 [0,2,0,0,0,0|1,0,1]=4 6722 B13R1.12 C\C=C\C(=O)c1cccc(Cl)c1Cl Amb25235203 [0,2,0,0,0,0|1,0,1]=4 6723 B13R1.12 C\C=C\C(=O)c1cccc(Cl)c1O Amb24533962 [0,2,0,0,0,0|1,0,1]=4 6724 B13R1.12 C\C=C\C(=O)c1cccc(F)c1F Amb25180020 [0,2,0,0,0,0|1,0,1]=4 6725 B13R1.12 C\C=C\C(=O)c1cccc(O)c1O Amb25767895 [0,2,0,0,0,0|1,0,1]=4 6726 B13R1.12 Cc1[n]c[n]c(c1Br)C(=O)OCC Amb24492060 [0,2,0,0,0,0|2,0,0]=4 6727 B13R1.12 Cc1[n]ccc(C(=O)OCC)c1C Amb24066420 [0,2,0,0,0,0|1,0,0]=3 6728 B13R1.12 Cc1[n]ccc(c1Cl)C(=O)OCC Amb24496855 [0,2,0,0,0,0|1,0,0]=3 6729 B13R1.12 Cc1[n]ccc(c1F)C(=O)OCC Amb21857222 [0,2,0,0,0,0|1,0,0]=3 6730 B13R1.12 Cc1[n]ccc(c1N)C(=O)OCC Amb24364671 [0,2,0,0,0,0|1,0,0]=3 6731 B13R1.12 Cc1[n]ccc(c1O)C(=O)OCC Amb18128822 [0,2,0,0,0,0|1,0,0]=3 6732 B13R1.12 Cc1c(N)cccc1C(=O)CCCl Amb24536773 [0,2,0,0,0,0|2,0,0]=4 6733 B13R1.12 Cc1c(S)cccc1C(=O)CCBr Amb24669593 [0,2,0,0,0,0|2,0,0]=4 6734 B13R1.12 Cc1c([n]c[n]c1Cl)C(=O)OCC Amb24183397 [0,2,0,0,0,0|2,0,0]=4 6735 B13R1.12 Cc1c([n]ccc1Cl)C(=O)OCC Amb22235327 [0,2,0,0,0,0|1,0,0]=3 6736 B13R1.12 Cc1c([n]ccc1N)C(=O)OCC Amb22522204 [0,2,0,0,0,0|1,0,0]=3 6737 B13R1.12 Cc1c([n]ccc1O)C(=O)OCC Amb22522284 [0,2,0,0,0,0|1,0,0]=3 6738 B13R1.12 Cc1c(c[n]cc1Cl)C(=O)OCC Amb25793588 [0,2,0,0,0,0|1,0,0]=3 6739 B13R1.12 Cc1c(c[n]cc1N)C(=O)OCC Amb24353598 [0,2,0,0,0,0|1,0,0]=3 6740 B13R1.12 Cc1c(c[n]cc1O)C(=O)OCC Amb25045470 [0,2,0,0,0,0|1,0,0]=3 6741 B13R1.12 Cc1c(cc[n]c1Br)C(=O)OCC Amb25047238 [0,2,0,0,0,0|1,0,0]=3 6742 B13R1.12 Cc1c(cc[n]c1Cl)C(=O)OCC Amb20240833 [0,2,0,0,0,0|1,0,0]=3 6743 B13R1.12 Cc1c(cc[n]c1F)C(=O)OCC Amb25349369 [0,2,0,0,0,0|1,0,0]=3 6744 B13R1.12 Cc1c(cccc1Br)C(=O)CCC Amb25161227 [0,2,0,0,0,0|1,0,0]=3 6745 B13R1.12 Cc1c(cccc1Br)C(=O)COC Amb25688739 [0,2,0,0,0,0|2,0,0]=4 6746 B13R1.12 Cc1c(cccc1Br)C(=O)CSC Amb25231938 [0,2,0,0,0,0|2,0,0]=4 6747 B13R1.12 Cc1c(cccc1Br)C(=O)NOC Amb25155040 [0,2,0,0,0,0|2,0,0]=4 6748 B13R1.12 Cc1c(cccc1Cl)C(=N)OCC Amb25798350 [0,2,0,0,0,0|1,0,0]=3 6749 B13R1.12 Cc1c(cccc1Cl)C(=O)CCC Amb17337140 [0,2,0,0,0,0|1,0,0]=3 6750 B13R1.12 Cc1c(cccc1Cl)C(=O)CCCl Amb25300477 [0,2,0,0,0,0|2,0,0]=4 6751 B13R1.12 Cc1c(cccc1Cl)C(=O)CNC Amb18224962 [0,2,0,0,0,0|2,0,0]=4 6752 B13R1.12 Cc1c(cccc1Cl)C(=O)COC Amb25340427 [0,2,0,0,0,0|2,0,0]=4 6753 B13R1.12 Cc1c(cccc1Cl)C(=O)CSC Amb25829969 [0,2,0,0,0,0|2,0,0]=4 6754 B13R1.12 Cc1c(cccc1Cl)C(=O)NCC Amb25144484 [0,2,0,0,0,0|1,0,0]=3 6755 B13R1.12 Cc1c(cccc1Cl)C(=O)NOC Amb24625297 [0,2,0,0,0,0|2,0,0]=4 6756 B13R1.12 Cc1c(cccc1Cl)C(=O)OCC Amb24745578 [0,2,0,0,0,0|0,0,0]=2 6757 B13R1.12 Cc1c(cccc1F)C(=O)CNC Amb25158393 [0,2,0,0,0,0|2,0,0]=4 6758 B13R1.12 Cc1c(cccc1F)C(=O)CSC Amb25267225 [0,2,0,0,0,0|2,0,0]=4 6759 B13R1.12 Cc1c(cccc1F)C(=O)NCC Amb25243698 [0,2,0,0,0,0|1,0,0]=3 6760 B13R1.12 Cc1c(cccc1F)C(=O)NOC Amb25291568 [0,2,0,0,0,0|2,0,0]=4 6761 B13R1.12 Cc1c(cccc1F)C(=O)OCC Amb22001732 [0,2,0,0,0,0|0,0,0]=2 6762 B13R1.12 Cc1c(cccc1I)C(=O)CCCl Amb25055277 [0,2,0,0,0,0|2,0,0]=4 6763 B13R1.12 Cc1c(cccc1I)C(=O)NCC Amb24502535 [0,2,0,0,0,0|1,0,0]=3 6764 B13R1.12 Cc1c(cccc1I)C(=O)NOC Amb25344378 [0,2,0,0,0,0|2,0,0]=4 6765 B13R1.12 Cc1c(cccc1I)C(=O)OCC Amb22266259 [0,2,0,0,0,0|0,0,0]=2 6766 B13R1.12 Cc1c(cccc1N)C(=O)COC Amb25155666 [0,2,0,0,0,0|2,0,0]=4 6767 B13R1.12 Cc1c(cccc1N)C(=O)NCC Amb1116858 [0,2,0,0,0,0|1,0,0]=3 6768 B13R1.12 Cc1c(cccc1N)C(=O)NOC Amb25716363 [0,2,0,0,0,0|2,0,0]=4 6769 B13R1.12 Cc1c(cccc1O)C(=O)NOC Amb25212805 [0,2,0,0,0,0|2,0,0]=4 6770 B13R1.12 Cc1c[n]cc(c1Br)C(=O)OCC Amb25211986 [0,2,0,0,0,0|1,0,0]=3 6771 B13R1.12 Cc1c[n]cc(c1Cl)C(=O)OCC Amb20671591 [0,2,0,0,0,0|1,0,0]=3 6772 B13R1.12 Cc1c[n]cc(c1N)C(=O)OCC Amb20671592 [0,2,0,0,0,0|1,0,0]=3 6773 B13R1.12 Cc1c[n]cc(c1O)C(=O)OCC Amb20671594 [0,2,0,0,0,0|1,0,0]=3 6774 B13R1.12 Cc1cc[n]c(c1Br)C(=O)OCC Amb24564138 [0,2,0,0,0,0|1,0,0]=3 6775 B13R1.12 Cc1cc[n]c(c1Cl)C(=O)OCC Amb24365244 [0,2,0,0,0,0|1,0,0]=3 6776 B13R1.12 Cc1cc[n]c(c1F)C(=O)OCC Amb24651337 [0,2,0,0,0,0|1,0,0]=3 6777 B13R1.12 Cc1cc[n]c(c1N)C(=O)OCC Amb24420024 [0,2,0,0,0,0|1,0,0]=3 6778 B13R1.12 Cc1cccc(C(=N)OCC)c1C Amb18795919 [0,2,0,0,0,0|1,0,0]=3 6779 B13R1.12 Cc1cccc(C(=O)CCBr)c1C Amb25826566 [0,2,0,0,0,0|2,0,0]=4 6780 B13R1.12 Cc1cccc(C(=O)CCCl)c1Cl Amb24740115 [0,2,0,0,0,0|2,0,0]=4 6781 B13R1.12 Cc1cccc(C(=O)CCCl)c1F Amb25301313 [0,2,0,0,0,0|2,0,0]=4 6782 B13R1.12 Cc1cccc(C(=O)CCN)c1C Amb24453094 [0,2,0,0,0,0|2,0,0]=4 6783 B13R1.12 Cc1cccc(C(=O)CCN)c1F Amb24463887 [0,2,0,0,0,0|2,0,0]=4 6784 B13R1.12 Cc1cccc(C(=O)CNC)c1C Amb18224566 [0,2,0,0,0,0|2,0,0]=4 6785 B13R1.12 Cc1cccc(C(=O)COC)c1C Amb18804750 [0,2,0,0,0,0|2,0,0]=4 6786 B13R1.12 Cc1cccc(C(=O)CSC)c1C Amb19063161 [0,2,0,0,0,0|2,0,0]=4 6787 B13R1.12 Cc1cccc(C(=O)NOC)c1C Amb24390484 [0,2,0,0,0,0|2,0,0]=4 6788 B13R1.12 Cc1cccc(c1Br)C(=O)CNC Amb24463728 [0,2,0,0,0,0|2,0,0]=4 6789 B13R1.12 Cc1cccc(c1Br)C(=O)COC Amb25679866 [0,2,0,0,0,0|2,0,0]=4 6790 B13R1.12 Cc1cccc(c1Br)C(=O)CSC Amb24670922 [0,2,0,0,0,0|2,0,0]=4 6791 B13R1.12 Cc1cccc(c1Br)C(=O)OCC Amb24066447 [0,2,0,0,0,0|0,0,0]=2 6792 B13R1.12 Cc1cccc(c1Cl)C(=O)COC Amb25134925 [0,2,0,0,0,0|2,0,0]=4 6793 B13R1.12 Cc1cccc(c1Cl)C(=O)OCC Amb22750101 [0,2,0,0,0,0|0,0,0]=2 6794 B13R1.12 Cc1cccc(c1Cl)C(=O)\C=C\C Amb25077992 [0,2,0,0,0,0|1,0,1]=4 6795 B13R1.12 Cc1cccc(c1F)C(=O)CCC Amb25721640 [0,2,0,0,0,0|1,0,0]=3 6796 B13R1.12 Cc1cccc(c1F)C(=O)CNC Amb24685079 [0,2,0,0,0,0|2,0,0]=4 6797 B13R1.12 Cc1cccc(c1F)C(=O)NCC Amb25180663 [0,2,0,0,0,0|1,0,0]=3 6798 B13R1.12 Cc1cccc(c1I)C(=O)CCC Amb25856027 [0,2,0,0,0,0|1,0,0]=3 6799 B13R1.12 Cc1cccc(c1I)C(=O)NOC Amb24467914 [0,2,0,0,0,0|2,0,0]=4 6800 B13R1.12 Cc1cccc(c1N)S(=O)CCC Amb24489212 [0,2,0,0,0,0|2,0,0]=4 6801 B13R1.12 Cc1cccc(c1N)\C(\C)=C/CC Amb24553081 [0,2,0,0,0,0|2,0,0]=4 6802 B13R1.12 Cc1cccc(c1N)\C(\C)=C\CC Amb24400519 [0,2,0,0,0,0|2,0,0]=4 6803 B13R1.12 Cc1cccc(c1O)C(=O)CNC Amb25048342 [0,2,0,0,0,0|2,0,0]=4 6804 B13R1.12 Cc1cccc(c1O)C(=O)\C=C\C Amb25707511 [0,2,0,0,0,0|1,0,1]=4 6805 B13R1.12 NCCC(=O)c1cccc(F)c1F Amb25367082 [0,2,0,0,0,0|2,0,0]=4 6806 B13R1.12 NCCC(=O)c1cccc(F)c1O Amb25699189 [0,2,0,0,0,0|2,0,0]=4 6807 B13R1.12 Nc1c(Cl)cccc1C(=O)CCBr Amb24651309 [0,2,0,0,0,0|2,0,0]=4 6808 B13R1.12 Nc1c(F)cccc1C(=O)CCCl Amb25239564 [0,2,0,0,0,0|2,0,0]=4 6809 B13R1.12 Nc1c(O)cccc1C(=O)CCBr Amb24639208 [0,2,0,0,0,0|2,0,0]=4 6810 B13R1.12 Nc1cccc(C(=O)CCCl)c1I Amb25248647 [0,2,0,0,0,0|2,0,0]=4 6811 B13R1.12 Nc1cccc(C(=O)CCCl)c1N Amb24537162 [0,2,0,0,0,0|2,0,0]=4 6812 B13R1.12 Nc1cccc(C(=O)CCCl)c1S Amb25275608 [0,2,0,0,0,0|2,0,0]=4 6813 B13R1.12 Nc1cccc(c1O)C(=O)CCCl Amb24537045 [0,2,0,0,0,0|2,0,0]=4 6814 B13R1.12 O=C(CCBr)c1cccc(Br)c1Cl Amb24520869 [0,2,0,0,0,0|2,0,0]=4 6815 B13R1.12 O=C(CCBr)c1cccc(Br)c1F Amb25363999 [0,2,0,0,0,0|2,0,0]=4 6816 B13R1.12 O=C(CCBr)c1cccc(Cl)c1Br Amb24696454 [0,2,0,0,0,0|2,0,0]=4 6817 B13R1.12 O=C(CCBr)c1cccc(Cl)c1F Amb25040085 [0,2,0,0,0,0|2,0,0]=4 6818 B13R1.12 O=C(CCBr)c1cccc(Cl)c1S Amb24679450 [0,2,0,0,0,0|2,0,0]=4 6819 B13R1.12 O=C(CCBr)c1cccc(I)c1Br Amb24695418 [0,2,0,0,0,0|2,0,0]=4 6820 B13R1.12 O=C(CCBr)c1cccc(I)c1Cl Amb25192126 [0,2,0,0,0,0|2,0,0]=4 6821 B13R1.12 O=C(CCBr)c1cccc(I)c1F Amb24399422 [0,2,0,0,0,0|2,0,0]=4 6822 B13R1.12 O=C(CCBr)c1cccc(S)c1F Amb25249971 [0,2,0,0,0,0|2,0,0]=4 6823 B13R1.12 O=C(CCBr)c1cccc(S)c1I Amb24664645 [0,2,0,0,0,0|2,0,0]=4 6824 B13R1.12 O=C(CCCl)c1cccc(Br)c1Br Amb25046914 [0,2,0,0,0,0|2,0,0]=4 6825 B13R1.12 O=C(CCCl)c1cccc(Br)c1I Amb24743768 [0,2,0,0,0,0|2,0,0]=4 6826 B13R1.12 O=C(CCCl)c1cccc(Cl)c1Cl Amb25286793 [0,2,0,0,0,0|2,0,0]=4 6827 B13R1.12 O=C(CCCl)c1cccc(Cl)c1F Amb25123725 [0,2,0,0,0,0|2,0,0]=4 6828 B13R1.12 O=C(CCCl)c1cccc(F)c1F Amb22229246 [0,2,0,0,0,0|2,0,0]=4 6829 B13R1.12 O=C(CCCl)c1cccc(I)c1Br Amb25217945 [0,2,0,0,0,0|2,0,0]=4 6830 B13R1.12 O=C(CCCl)c1cccc(I)c1Cl Amb25377091 [0,2,0,0,0,0|2,0,0]=4 6831 B13R1.12 Oc1c(F)cccc1C(=O)CCBr Amb25155135 [0,2,0,0,0,0|2,0,0]=4 6832 B13R1.12 Oc1c(F)cccc1C(=O)CCCl Amb24435843 [0,2,0,0,0,0|2,0,0]=4 6833 B13R1.12 Oc1c(S)cccc1C(=O)CCCl Amb24611562 [0,2,0,0,0,0|2,0,0]=4 6834 B13R1.12 Oc1c(cccc1Br)C(=O)CCBr Amb24597052 [0,2,0,0,0,0|2,0,0]=4 6835 B13R1.12 Oc1c(cccc1Cl)C(=O)CCCl Amb25766603 [0,2,0,0,0,0|2,0,0]=4 6836 B13R1.12 Oc1c(cccc1I)C(=O)CCBr Amb25070925 [0,2,0,0,0,0|2,0,0]=4 6837 B13R1.12 Oc1c(cccc1I)C(=O)CCCl Amb25270100 [0,2,0,0,0,0|2,0,0]=4 6838 B13R1.12 Oc1cccc(C(=O)CCBr)c1O Amb24666001 [0,2,0,0,0,0|2,0,0]=4 6839 B13R1.12 Oc1cccc(C(=O)CCCl)c1Br Amb25216322 [0,2,0,0,0,0|2,0,0]=4 6840 B13R1.12 Oc1cccc(C(=O)CCCl)c1F Amb24741218 [0,2,0,0,0,0|2,0,0]=4 6841 B13R1.12 Oc1cccc(C(=O)CCCl)c1S Amb25250469 [0,2,0,0,0,0|2,0,0]=4 6842 B13R1.18 BrCC\C=C(\c1cccc(c1)C)/C Amb17254616 [0,2,0,0,0,0|2,0,0]=4 6843 B13R1.18 BrCC\C=C(\c1cccc(c1)Cl)/C Amb17267357 [0,2,0,0,0,0|2,0,0]=4 6844 B13R1.18 BrCC\C=C(\c1cccc(c1)F)/C Amb17256419 [0,2,0,0,0,0|2,0,0]=4 6845 B13R1.18 C#CCCC(=O)c1cccc(Cl)c1 Amb24346665 [0,2,0,0,0,0|1,0,1]=4 6846 B13R1.18 C#CCCC(=O)c1cccc(N)c1 Amb25048340 [0,2,0,0,0,0|1,0,1]=4 6847 B13R1.18 C#CCNC(=O)c1cccc(S)c1 Amb24495029 [0,2,0,0,0,0|1,0,1]=4 6848 B13R1.18 C#CCNC(=O)c1cccc(c1)I Amb15861091 [0,2,0,0,0,0|1,0,1]=4 6849 B13R1.18 C#CCOC(=O)c1c[n]cc(Br)c1 Amb24473838 [0,2,0,0,0,0|1,0,1]=4 6850 B13R1.18 C#CCOC(=O)c1c[n]cc(F)c1 Amb25802428 [0,2,0,0,0,0|1,0,1]=4 6851 B13R1.18 C#CCOC(=O)c1c[n]cc(I)c1 Amb24705115 [0,2,0,0,0,0|1,0,1]=4 6852 B13R1.18 C#CCOC(=O)c1c[n]cc(N)c1 Amb25163775 [0,2,0,0,0,0|1,0,1]=4 6853 B13R1.18 C#CCOC(=O)c1cc(Cl)cc[n]1 Amb25370202 [0,2,0,0,0,0|1,0,1]=4 6854 B13R1.18 C#CCOC(=O)c1cc[n]c(Br)c1 Amb25099211 [0,2,0,0,0,0|1,0,1]=4 6855 B13R1.18 C#CCOC(=O)c1cc[n]c(Cl)c1 Amb25358462 [0,2,0,0,0,0|1,0,1]=4 6856 B13R1.18 C#CCOC(=O)c1cccc(F)[n]1 Amb24577631 [0,2,0,0,0,0|1,0,1]=4 6857 B13R1.18 C#CCOC(=O)c1cccc(F)c1 Amb24421512 [0,2,0,0,0,0|0,0,1]=3 6858 B13R1.18 C#CCOC(=O)c1cccc(O)c1 Amb18929623 [0,2,0,0,0,0|0,0,1]=3 6859 B13R1.18 C=CCNC(=O)c1cccc(S)c1 Amb24495086 [0,2,0,0,0,0|1,0,1]=4 6860 B13R1.18 CC#CCC(=O)c1cccc(Br)c1 Amb24683409 [0,2,0,0,0,0|1,0,1]=4 6861 B13R1.18 CC#CCC(=O)c1cccc(Cl)c1 Amb19061628 [0,2,0,0,0,0|1,0,1]=4 6862 B13R1.18 CC#CCC(=O)c1cccc(F)c1 Amb18184040 [0,2,0,0,0,0|1,0,1]=4 6863 B13R1.18 CC#CCC(=O)c1cccc(I)c1 Amb24472091 [0,2,0,0,0,0|1,0,1]=4 6864 B13R1.18 CC#CCC(=O)c1cccc(N)c1 Amb25153573 [0,2,0,0,0,0|1,0,1]=4 6865 B13R1.18 CCCCC(=O)c1cccc(F)c1 Amb18184738 [0,2,0,0,0,0|1,0,0]=3 6866 B13R1.18 CCCCC(=O)c1cccc(c1)Br Amb17198774 [0,2,0,0,0,0|1,0,0]=3 6867 B13R1.18 CCCCC(=O)c1cccc(c1)Cl Amb17198754 [0,2,0,0,0,0|1,0,0]=3 6868 B13R1.18 CCCNC(=N)c1cc(F)ccc1 Amb25283653 [0,2,0,0,0,0|2,0,0]=4 6869 B13R1.18 CCCNC(=N)c1cc(O)ccc1 Amb25820055 [0,2,0,0,0,0|2,0,0]=4 6870 B13R1.18 CCCNC(=O)C1=CC(=O)NC=C1 Amb24614023 [0,2,0,0,0,0|2,0,0]=4 6871 B13R1.18 CCCNC(=O)C1=CC(=S)NC=C1 Amb24689164 [0,2,0,0,0,0|2,0,0]=4 6872 B13R1.18 CCCNC(=O)c1c[n]cc(Br)c1 Amb19959738 [0,2,0,0,0,0|2,0,0]=4 6873 B13R1.18 CCCNC(=O)c1cc(F)[n]cc1 Amb18179263 [0,2,0,0,0,0|2,0,0]=4 6874 B13R1.18 CCCNC(=O)c1cc(N)[n]cc1 Amb18986828 [0,2,0,0,0,0|2,0,0]=4 6875 B13R1.18 CCCNC(=O)c1cc(N)cc[n]1 Amb18986848 [0,2,0,0,0,0|2,0,0]=4 6876 B13R1.18 CCCNC(=O)c1cc(S)ccc1 Amb24495185 [0,2,0,0,0,0|1,0,0]=3 6877 B13R1.18 CCCNC(=O)c1cccc(Cl)[n]1 Amb18332184 [0,2,0,0,0,0|2,0,0]=4 6878 B13R1.18 CCCNC(=O)c1cccc(F)c1 Amb17775273 [0,2,0,0,0,0|1,0,0]=3 6879 B13R1.18 CCCNC(=O)c1cccc(N)[n]1 Amb18987778 [0,2,0,0,0,0|2,0,0]=4 6880 B13R1.18 CCCNC(=O)c1cccc(c1)N Amb1113441 [0,2,0,0,0,0|1,0,0]=3 6881 B13R1.18 CCNCC(=O)c1cc(N)ccc1 Amb18550939 [0,2,0,0,0,0|1,0,0]=3 6882 B13R1.18 CCNCC(=O)c1cccc(c1)Br Amb17315031 [0,2,0,0,0,0|1,0,0]=3 6883 B13R1.18 CCNCC(=O)c1cccc(c1)O Amb17594589 [0,2,0,0,0,0|1,0,0]=3 6884 B13R1.18 CCNNC(=O)c1cc(F)cc[n]1 Amb25227742 [0,2,0,0,0,0|2,0,0]=4 6885 B13R1.18 CCNNC(=O)c1cccc(Cl)[n]1 Amb25353762 [0,2,0,0,0,0|2,0,0]=4 6886 B13R1.18 CCONC(=O)c1c[n]cc(O)c1 Amb25760444 [0,2,0,0,0,0|1,0,0]=3 6887 B13R1.18 CCONC(=O)c1cc(Cl)cc[n]1 Amb25106967 [0,2,0,0,0,0|1,0,0]=3 6888 B13R1.18 CCONC(=O)c1cc[n]c(Br)c1 Amb24404149 [0,2,0,0,0,0|1,0,0]=3 6889 B13R1.18 CCONC(=O)c1cc[n]c(Cl)c1 Amb21645598 [0,2,0,0,0,0|1,0,0]=3 6890 B13R1.18 CCONC(=O)c1cccc(Br)c1 Amb20813604 [0,2,0,0,0,0|0,0,0]=2 6891 B13R1.18 CCONC(=O)c1cccc(Cl)[n]1 Amb25232434 [0,2,0,0,0,0|1,0,0]=3 6892 B13R1.18 CCONC(=O)c1cccc(Cl)c1 Amb24417621 [0,2,0,0,0,0|0,0,0]=2 6893 B13R1.18 CCONC(=O)c1cccc(F)c1 Amb24708983 [0,2,0,0,0,0|0,0,0]=2 6894 B13R1.18 CCONC(=O)c1cccc(O)c1 Amb25786725 [0,2,0,0,0,0|0,0,0]=2 6895 B13R1.18 CCO\N=C(/N)\c1cccc(Br)c1 Amb18227733 [0,2,0,0,0,0|1,0,0]=3 6896 B13R1.18 CCO\N=C(/N)\c1cccc(Cl)c1 Amb18225013 [0,2,0,0,0,0|1,0,0]=3 6897 B13R1.18 CCO\N=C(/N)\c1cccc(F)c1 Amb18224740 [0,2,0,0,0,0|1,0,0]=3 6898 B13R1.18 CCO\N=C(\C)/c1cc(C)c[n]c1 Amb24690042 [0,2,0,0,0,0|2,0,0]=4 6899 B13R1.18 CCO\N=C(\C)/c1cc(C)cc[n]1 Amb24525242 [0,2,0,0,0,0|2,0,0]=4 6900 B13R1.18 CCO\N=C(\C)/c1cc(C)ccc1 Amb24458436 [0,2,0,0,0,0|1,0,0]=3 6901 B13R1.18 CC\C=C\C(=O)c1cccc(Br)c1 Amb25211064 [0,2,0,0,0,0|1,0,0]=3 6902 B13R1.18 CC\C=C\C(=O)c1cccc(F)c1 Amb24386271 [0,2,0,0,0,0|1,0,0]=3 6903 B13R1.18 CC\C=C\C(=O)c1cccc(O)c1 Amb24367886 [0,2,0,0,0,0|1,0,0]=3 6904 B13R1.18 CNCCC(=O)c1cccc(N)c1 Amb18862931 [0,2,0,0,0,0|1,0,0]=3 6905 B13R1.18 COCCC(=O)c1cccc(c1)C Amb17233413 [0,2,0,0,0,0|1,0,0]=3 6906 B13R1.18 COCCC(=O)c1cccc(c1)Cl Amb17236837 [0,2,0,0,0,0|1,0,0]=3 6907 B13R1.18 COCCC(=O)c1cccc(c1)F Amb17233889 [0,2,0,0,0,0|1,0,0]=3 6908 B13R1.18 COCNC(=O)c1cccc(F)[n]1 Amb25315180 [0,2,0,0,0,0|2,0,0]=4 6909 B13R1.18 C\C(=C\CCBr)\c1cccc(Cl)c1 Amb25312765 [0,2,0,0,0,0|2,0,0]=4 6910 B13R1.18 C\C(=C\CCBr)\c1cccc(F)c1 Amb24668338 [0,2,0,0,0,0|2,0,0]=4 6911 B13R1.18 C\C(=C\CCN)\c1cc(Br)ccc1 Amb25212793 [0,2,0,0,0,0|2,0,0]=4 6912 B13R1.18 C\C(=C\CNC)\c1cc(Br)ccc1 Amb25776959 [0,2,0,0,0,0|2,0,0]=4 6913 B13R1.18 C\C(=N\OCC)\C1=CC(=O)NC=C1 Amb24459050 [0,2,0,0,0,0|2,0,0]=4 6914 B13R1.18 C\C(=N\OCC)\c1cc(O)ccc1 Amb25307143 [0,2,0,0,0,0|1,0,0]=3 6915 B13R1.18 C\C=C\OC(=O)c1cccc(O)c1 Amb25713019 [0,2,0,0,0,0|0,0,1]=3 6916 B13R1.18 Cc1[n]c(cc[n]1)C(=O)NOCC Amb24676178 [0,2,0,0,0,0|2,0,0]=4 6917 B13R1.18 Cc1c[n]cc(c1)C(=O)NCCC Amb24553774 [0,2,0,0,0,0|2,0,0]=4 6918 B13R1.18 Cc1cc([n]cc1)C(=O)CCCN Amb18195254 [0,2,0,0,0,0|2,0,0]=4 6919 B13R1.18 Cc1cc(c[n]c1)C(=O)NCCBr Amb25154985 [0,2,0,0,0,0|2,0,0]=4 6920 B13R1.18 Cc1cc(c[n]c1)C(=O)NCCCl Amb25114392 [0,2,0,0,0,0|2,0,0]=4 6921 B13R1.18 Cc1cc(c[n]c1)C(=O)NCCN Amb25073810 [0,2,0,0,0,0|2,0,0]=4 6922 B13R1.18 Cc1cc(c[n]c1)C(=O)NCCO Amb25719718 [0,2,0,0,0,0|2,0,0]=4 6923 B13R1.18 Cc1cc(c[n]c1)C(=O)OCC#C Amb24369874 [0,2,0,0,0,0|1,0,1]=4 6924 B13R1.18 Cc1cc(cc[n]1)C(=O)NCCCl Amb25242904 [0,2,0,0,0,0|2,0,0]=4 6925 B13R1.18 Cc1cc(cc[n]1)C(=O)NCCI Amb24723194 [0,2,0,0,0,0|2,0,0]=4 6926 B13R1.18 Cc1cc(cc[n]1)C(=O)NCCN Amb24753356 [0,2,0,0,0,0|2,0,0]=4 6927 B13R1.18 Cc1cc(cc[n]1)C(=O)NCCO Amb25333094 [0,2,0,0,0,0|2,0,0]=4 6928 B13R1.18 Cc1cc(ccc1)C(=N)NCCC Amb25220370 [0,2,0,0,0,0|2,0,0]=4 6929 B13R1.18 Cc1cc(ccc1)C(=O)CC#CC Amb18183694 [0,2,0,0,0,0|1,0,1]=4 6930 B13R1.18 Cc1cc(ccc1)C(=O)CCC#C Amb25321671 [0,2,0,0,0,0|1,0,1]=4 6931 B13R1.18 Cc1cc(ccc1)C(=O)CCCN Amb18195909 [0,2,0,0,0,0|1,0,0]=3 6932 B13R1.18 Cc1cc(ccc1)C(=O)OCC#C Amb25032966 [0,2,0,0,0,0|0,0,1]=3 6933 B13R1.18 Cc1cc(ccc1)C(=O)OCC#N Amb25370223 [0,2,0,0,0,0|0,0,1]=3 6934 B13R1.18 Cc1cc(ccc1)C(=O)\C=C\CC Amb24698971 [0,2,0,0,0,0|1,0,0]=3 6935 B13R1.18 Cc1cc(ccc1)\C(\N)=N\OCC Amb18224607 [0,2,0,0,0,0|1,0,0]=3 6936 B13R1.18 Cc1cccc([n]1)C(=O)NCCCl Amb19038151 [0,2,0,0,0,0|2,0,0]=4 6937 B13R1.18 Cc1cccc([n]1)C(=O)NCCI Amb25844700 [0,2,0,0,0,0|2,0,0]=4 6938 B13R1.18 Cc1cccc([n]1)C(=O)NCOC Amb24344038 [0,2,0,0,0,0|2,0,0]=4 6939 B13R1.18 Cc1cccc(c1)\C(\C)=C/CCBr Amb25180669 [0,2,0,0,0,0|2,0,0]=4 6940 B13R1.18 Cc1cccc(c1)\C(\C)=C/CCCl Amb25764678 [0,2,0,0,0,0|2,0,0]=4 6941 B13R1.18 Cc1cccc(n1)C(=O)NCCN Amb1129601 [0,2,0,0,0,0|2,0,0]=4 6942 B13R1.18 ClCCNC(=O)c1cccc(c1)Br Amb17103205 [0,2,0,0,0,0|1,0,0]=3 6943 B13R1.18 ClCCNC(=O)c1cccc(c1)C Amb17103200 [0,2,0,0,0,0|1,0,0]=3 6944 B13R1.18 ClCCNC(=O)c1cccc(c1)Cl Amb17103233 [0,2,0,0,0,0|1,0,0]=3 6945 B13R1.18 ClCCNC(=O)c1cccc(c1)F Amb17103202 [0,2,0,0,0,0|1,0,0]=3 6946 B13R1.18 ClCC\C=C(\c1cccc(c1)C)/C Amb17236143 [0,2,0,0,0,0|2,0,0]=4 6947 B13R1.18 ClCC\C=C(\c1cccc(c1)Cl)/C Amb17241876 [0,2,0,0,0,0|2,0,0]=4 6948 B13R1.18 ClCC\C=C(\c1cccc(c1)F)/C Amb17236850 [0,2,0,0,0,0|2,0,0]=4 6949 B13R1.18 N#CCCC(=O)c1cccc(c1)O Amb17133643 [0,2,0,0,0,0|1,0,1]=4 6950 B13R1.18 N#CCNC(=O)c1cccc(O)c1 Amb18180563 [0,2,0,0,0,0|1,0,1]=4 6951 B13R1.18 N#CCOC(=O)C1=CC=CC(=O)N1 Amb25283900 [0,2,0,0,0,0|1,0,1]=4 6952 B13R1.18 N#CCOC(=O)c1c[n+]([O-])ccc1 Amb24396869 [0,2,0,0,0,0|1,0,1]=4 6953 B13R1.18 N#CCOC(=O)c1c[n]cc(I)c1 Amb24429842 [0,2,0,0,0,0|1,0,1]=4 6954 B13R1.18 N#CCOC(=O)c1c[n]cc(O)c1 Amb25295569 [0,2,0,0,0,0|1,0,1]=4 6955 B13R1.18 N#CCOC(=O)c1cc(Cl)cc[n]1 Amb25163646 [0,2,0,0,0,0|1,0,1]=4 6956 B13R1.18 N#CCOC(=O)c1cc[n]c(F)c1 Amb24347588 [0,2,0,0,0,0|1,0,1]=4 6957 B13R1.18 N#CCOC(=O)c1cccc(F)c1 Amb25369279 [0,2,0,0,0,0|0,0,1]=3 6958 B13R1.18 N#CCOC(=O)c1cccc(O)c1 Amb25795239 [0,2,0,0,0,0|0,0,1]=3 6959 B13R1.18 NCCCC(=O)c1cccc(Cl)c1 Amb18188152 [0,2,0,0,0,0|1,0,0]=3 6960 B13R1.18 NCCNC(=O)c1cc(Br)[n]cc1 Amb24466164 [0,2,0,0,0,0|2,0,0]=4 6961 B13R1.18 NCCNC(=O)c1cc(Br)cc[n]1 Amb25219161 [0,2,0,0,0,0|2,0,0]=4 6962 B13R1.18 NCCNC(=O)c1cc(Cl)[n]cc1 Amb18290742 [0,2,0,0,0,0|2,0,0]=4 6963 B13R1.18 NCCNC(=O)c1cc(Cl)cc[n]1 Amb18973808 [0,2,0,0,0,0|2,0,0]=4 6964 B13R1.18 NCCNC(=O)c1cc(F)[n]cc1 Amb18975312 [0,2,0,0,0,0|2,0,0]=4 6965 B13R1.18 NCCNC(=O)c1cc(S)ccc1 Amb24495188 [0,2,0,0,0,0|1,0,0]=3 6966 B13R1.18 NCCNC(=O)c1cccc(Cl)[n]1 Amb18987800 [0,2,0,0,0,0|2,0,0]=4 6967 B13R1.18 NCCNC(=O)c1cccc(F)[n]1 Amb24616895 [0,2,0,0,0,0|2,0,0]=4 6968 B13R1.18 NCCNC(=O)c1cccc(c1)Br Amb13952146 [0,2,0,0,0,0|1,0,0]=3 6969 B13R1.18 NCCNC(=O)c1cccc(c1)C Amb1128047 [0,2,0,0,0,0|1,0,0]=3 6970 B13R1.18 NCCNC(=O)c1cccc(c1)Cl Amb1139275 [0,2,0,0,0,0|1,0,0]=3 6971 B13R1.18 NCCNC(=O)c1cccc(c1)F Amb1128710 [0,2,0,0,0,0|1,0,0]=3 6972 B13R1.18 NCCNC(=O)c1cccc(c1)O Amb1125097 [0,2,0,0,0,0|1,0,0]=3 6973 B13R1.18 NCCOC(c1cccc(c1)C)C Amb17079426 [0,2,0,0,0,0|1,0,1]=4 6974 B13R1.18 NCCOC(c1cccc(c1)Cl)C Amb17079509 [0,2,0,0,0,0|1,0,1]=4 6975 B13R1.18 NCCOC(c1cccc(c1)F)C Amb17079471 [0,2,0,0,0,0|1,0,1]=4 6976 B13R1.18 NCC\C=C(\c1cccc(c1)C)/C Amb17233143 [0,2,0,0,0,0|2,0,0]=4 6977 B13R1.18 NCC\C=C(\c1cccc(c1)Cl)/C Amb17236341 [0,2,0,0,0,0|2,0,0]=4 6978 B13R1.18 NCC\C=C(\c1cccc(c1)F)/C Amb17233552 [0,2,0,0,0,0|2,0,0]=4 6979 B13R1.18 Nc1cc([n]cc1)C(=O)NCCF Amb24650667 [0,2,0,0,0,0|2,0,0]=4 6980 B13R1.18 Nc1cc(c[n]c1)C(=O)NCCO Amb24412892 [0,2,0,0,0,0|2,0,0]=4 6981 B13R1.18 Nc1cc(cc[n]1)C(=O)NCCN Amb25679551 [0,2,0,0,0,0|2,0,0]=4 6982 B13R1.18 Nc1cc(ccc1)C(=O)NCC#N Amb18952114 [0,2,0,0,0,0|1,0,1]=4 6983 B13R1.18 Nc1cc(ccc1)C(=O)NCCN Amb18973825 [0,2,0,0,0,0|1,0,0]=3 6984 B13R1.18 Nc1cc(ccc1)C(=O)OCC#N Amb18291100 [0,2,0,0,0,0|0,0,1]=3 6985 B13R1.18 Nc1cccc([n]1)C(=O)NCCCl Amb25738840 [0,2,0,0,0,0|2,0,0]=4 6986 B13R1.18 Nc1cccc([n]1)C(=O)NCCF Amb24665257 [0,2,0,0,0,0|2,0,0]=4 6987 B13R1.18 Nc1cccc([n]1)C(=O)NCCO Amb25685423 [0,2,0,0,0,0|2,0,0]=4 6988 B13R1.18 O=C(NCCBr)C1=CC=CC(=O)N1 Amb24577507 [0,2,0,0,0,0|2,0,0]=4 6989 B13R1.18 O=C(NCCBr)C=1C=CNC(=O)C1 Amb25128489 [0,2,0,0,0,0|2,0,0]=4 6990 B13R1.18 O=C(NCCBr)c1c[n]cc(F)c1 Amb25274765 [0,2,0,0,0,0|2,0,0]=4 6991 B13R1.18 O=C(NCCCl)C1=CC=CC(=O)N1 Amb25839899 [0,2,0,0,0,0|2,0,0]=4 6992 B13R1.18 O=C(NCCCl)C=1C=CNC(=O)C1 Amb25730617 [0,2,0,0,0,0|2,0,0]=4 6993 B13R1.18 O=C(NCCCl)c1cc(Cl)c[n]c1 Amb25274202 [0,2,0,0,0,0|2,0,0]=4 6994 B13R1.18 O=C(NCCF)C=1C=CNC(=O)C1 Amb24684607 [0,2,0,0,0,0|2,0,0]=4 6995 B13R1.18 O=C(NCCF)c1c[n]cc(Br)c1 Amb25116294 [0,2,0,0,0,0|2,0,0]=4 6996 B13R1.18 O=C(NCCF)c1c[n]cc(I)c1 Amb24672038 [0,2,0,0,0,0|2,0,0]=4 6997 B13R1.18 O=C(NCCF)c1cc(Br)[n]cc1 Amb24393170 [0,2,0,0,0,0|2,0,0]=4 6998 B13R1.18 O=C(NCCF)c1cc(Cl)[n]cc1 Amb25131885 [0,2,0,0,0,0|2,0,0]=4 6999 B13R1.18 O=C(NCCF)c1cc(Cl)cc[n]1 Amb25753273 [0,2,0,0,0,0|2,0,0]=4 7000 B13R1.18 O=C(NCCF)c1cc(F)[n]cc1 Amb25779674 [0,2,0,0,0,0|2,0,0]=4 7001 B13R1.18 O=C(NCCF)c1cccc(Br)[n]1 Amb25238214 [0,2,0,0,0,0|2,0,0]=4 7002 B13R1.18 O=C(NCCF)c1cccc(F)[n]1 Amb25774860 [0,2,0,0,0,0|2,0,0]=4 7003 B13R1.18 O=C(NCCI)C1=CC=CC(=O)N1 Amb25115288 [0,2,0,0,0,0|2,0,0]=4 7004 B13R1.18 O=C(NCCI)C=1C=CNC(=O)C1 Amb24513563 [0,2,0,0,0,0|2,0,0]=4 7005 B13R1.18 O=C(NCCI)c1c[n]cc(Br)c1 Amb25677568 [0,2,0,0,0,0|2,0,0]=4 7006 B13R1.18 O=C(NCCI)c1cc(I)ccc1 Amb25063435 [0,2,0,0,0,0|1,0,0]=3 7007 B13R1.18 O=C(NCCI)c1cccc(Cl)c1 Amb25071750 [0,2,0,0,0,0|1,0,0]=3 7008 B13R1.18 O=C(NCCI)c1cccc(F)c1 Amb24490729 [0,2,0,0,0,0|1,0,0]=3 7009 B13R1.18 O=C(NCCS)c1cc(Cl)ccc1 Amb25144246 [0,2,0,0,0,0|1,0,0]=3 7010 B13R1.18 O=C(NCCS)c1cc(I)ccc1 Amb25818262 [0,2,0,0,0,0|1,0,0]=3 7011 B13R1.18 O=C(NCCS)c1cccc(F)c1 Amb25143692 [0,2,0,0,0,0|1,0,0]=3 7012 B13R1.18 O=CCNC(=O)c1cccc(c1)Br Amb17102073 [0,2,0,0,0,0|1,0,1]=4 7013 B13R1.18 O=CCNC(=O)c1cccc(c1)C Amb17102067 [0,2,0,0,0,0|1,0,1]=4 7014 B13R1.18 O=CCNC(=O)c1cccc(c1)Cl Amb17102104 [0,2,0,0,0,0|1,0,1]=4 7015 B13R1.18 O=CCNC(=O)c1cccc(c1)F Amb17102070 [0,2,0,0,0,0|1,0,1]=4 7016 B13R1.18 OCCNC(=O)C1=CC(=O)NC=C1 Amb25809683 [0,2,0,0,0,0|2,0,0]=4 7017 B13R1.18 OCCNC(=O)C1=CC=CC(=O)N1 Amb25180107 [0,2,0,0,0,0|2,0,0]=4 7018 B13R1.18 OCCNC(=O)c1c[n]cc(F)c1 Amb25281239 [0,2,0,0,0,0|2,0,0]=4 7019 B13R1.18 OCCNC(=O)c1c[n]cc(I)c1 Amb25283726 [0,2,0,0,0,0|2,0,0]=4 7020 B13R1.18 OCCNC(=O)c1cc(Br)[n]cc1 Amb25223000 [0,2,0,0,0,0|2,0,0]=4 7021 B13R1.18 OCCNC(=O)c1cc(Cl)[n]cc1 Amb19091272 [0,2,0,0,0,0|2,0,0]=4 7022 B13R1.18 OCCNC(=O)c1cc(Cl)cc[n]1 Amb19091271 [0,2,0,0,0,0|2,0,0]=4 7023 B13R1.18 OCCNC(=O)c1cc(F)[n]cc1 Amb19045361 [0,2,0,0,0,0|2,0,0]=4 7024 B13R1.18 OCCNC(=O)c1cccc(Cl)[n]1 Amb18333896 [0,2,0,0,0,0|2,0,0]=4 7025 B13R1.18 OCCNC(=O)c1cccc(c1)C Amb1211722 [0,2,0,0,0,0|1,0,0]=3 7026 B13R1.18 OCCNC(=O)c1cccc(c1)N Amb13952051 [0,2,0,0,0,0|1,0,0]=3 7027 B13R1.18 OC\C=C\C(=O)c1cccc(Cl)c1 Amb25129781 [0,2,0,0,0,0|1,0,1]=4 7028 B13R1.18 Oc1cc(ccc1)C(=O)NCCBr Amb24534653 [0,2,0,0,0,0|1,0,0]=3 7029 B13R1.18 Oc1cc(ccc1)C(=O)NCCI Amb24623569 [0,2,0,0,0,0|1,0,0]=3 7030 B13R1.22 CC(CC)C(=O)c1c[n]cc(Cl)c1 Amb24353574 [0,2,0,0,0,0|2,0,0]=4 7031 B13R1.22 CC(CN)C(=O)c1cccc(F)c1 Amb25155726 [0,2,0,0,0,0|2,0,0]=4 7032 B13R1.22 CC(CO)C(=O)c1cccc(Cl)c1 Amb24353155 [0,2,0,0,0,0|2,0,0]=4 7033 B13R1.22 CCC(=O)C(=O)c1cccc(Br)c1 Amb25244807 [0,2,0,0,0,0|1,0,0]=3 7034 B13R1.22 CCC(Br)C(=O)c1cc[n]c(Cl)c1 Amb24451196 [0,2,0,0,0,0|2,0,0]=4 7035 B13R1.22 CCC(Br)C(=O)c1cccc(Cl)c1 Amb25854355 [0,2,0,0,0,0|1,0,0]=3 7036 B13R1.22 CCC(C)C(=O)c1cccc(F)c1 Amb25244389 [0,2,0,0,0,0|1,0,0]=3 7037 B13R1.22 CCC(C)C(=O)c1cccc(N)[n]1 Amb24376737 [0,2,0,0,0,0|2,0,0]=4 7038 B13R1.22 CCC(Cl)C(=O)c1cccc(Br)c1 Amb18049338 [0,2,0,0,0,0|1,0,0]=3 7039 B13R1.22 CCC(Cl)C(=O)c1cccc(F)c1 Amb25194851 [0,2,0,0,0,0|1,0,0]=3 7040 B13R1.22 CCC(N)C(=O)c1cccc(Br)c1 Amb18156128 [0,2,0,0,0,0|1,0,0]=3 7041 B13R1.22 CCC(N)C(=O)c1cccc(Cl)c1 Amb18812031 [0,2,0,0,0,0|1,0,0]=3 7042 B13R1.22 CCC(N)C(=O)c1cccc(F)c1 Amb18824221 [0,2,0,0,0,0|1,0,0]=3 7043 B13R1.22 CCC(O)C(=O)c1cccc(Cl)c1 Amb25277021 [0,2,0,0,0,0|1,0,0]=3 7044 B13R1.22 CCN(O)C(=O)C1=CC=CC(=O)N1 Amb24606236 [0,2,0,0,0,0|2,0,0]=4 7045 B13R1.22 CCN(O)C(=O)c1c[n]cc(Br)c1 Amb24547972 [0,2,0,0,0,0|2,0,0]=4 7046 B13R1.22 CCN(O)C(=O)c1cc(Cl)cc[n]1 Amb24550000 [0,2,0,0,0,0|2,0,0]=4 7047 B13R1.22 CCN(O)C(=O)c1cccc(I)c1 Amb25266970 [0,2,0,0,0,0|1,0,0]=3 7048 B13R1.22 CN(CC)C(=O)c1c[n]cc(Br)c1 Amb24696005 [0,2,0,0,0,0|2,0,0]=4 7049 B13R1.22 CN(CC)C(=O)c1c[n]cc(F)c1 Amb25763608 [0,2,0,0,0,0|2,0,0]=4 7050 B13R1.22 CN(CC)C(=O)c1cc(N)cc[n]1 Amb18284841 [0,2,0,0,0,0|2,0,0]=4 7051 B13R1.22 CN(CC)C(=O)c1cc[n]c(Br)c1 Amb24576360 [0,2,0,0,0,0|2,0,0]=4 7052 B13R1.22 CN(CC)C(=O)c1cc[n]c(F)c1 Amb18791387 [0,2,0,0,0,0|2,0,0]=4 7053 B13R1.22 CN(CC)C(=O)c1cc[n]c(N)c1 Amb18284844 [0,2,0,0,0,0|2,0,0]=4 7054 B13R1.22 CN(CC)C(=O)c1cccc(Br)[n]1 Amb25160979 [0,2,0,0,0,0|2,0,0]=4 7055 B13R1.22 CN(CC)C(=O)c1cccc(Cl)[n]1 Amb18332185 [0,2,0,0,0,0|2,0,0]=4 7056 B13R1.22 CN(CC)C(=O)c1cccc(F)[n]1 Amb25328490 [0,2,0,0,0,0|2,0,0]=4 7057 B13R1.22 CN(CC)C(=O)c1cccc(F)c1 Amb24706421 [0,2,0,0,0,0|1,0,0]=3 7058 B13R1.22 CN(CC)C(=O)c1cccc(I)c1 Amb21796969 [0,2,0,0,0,0|1,0,0]=3 7059 B13R1.22 CN(CC)C(=O)c1cccc(N)[n]1 Amb18959763 [0,2,0,0,0,0|2,0,0]=4 7060 B13R1.22 CN(CC)C(=O)c1cccc(S)c1 Amb25285150 [0,2,0,0,0,0|1,0,0]=3 7061 B13R1.22 CN(OC)C(=O)c1cccc(I)c1 Amb20684745 [0,2,0,0,0,0|2,0,0]=4 7062 B13R1.22 CNC(C(=O)c1cccc(c1)C)C Amb17617552 [0,2,0,0,0,0|2,0,0]=4 7063 B13R1.22 CNC(C)C(=O)c1cccc(Cl)c1 Amb19889606 [0,2,0,0,0,0|2,0,0]=4 7064 B13R1.22 CNC(C)C(=O)c1cccc(F)c1 Amb22055294 [0,2,0,0,0,0|2,0,0]=4 7065 B13R1.22 COC(=O)C(=O)c1cccc(Br)c1 Amb22498288 [0,2,0,0,0,0|2,0,0]=4 7066 B13R1.22 COC(=O)C(=O)c1cccc(Cl)c1 Amb22755093 [0,2,0,0,0,0|2,0,0]=4 7067 B13R1.22 COC(=O)C(=O)c1cccc(F)c1 Amb25160749 [0,2,0,0,0,0|2,0,0]=4 7068 B13R1.22 COC(=O)C(=O)c1cccc(I)c1 Amb25738459 [0,2,0,0,0,0|2,0,0]=4 7069 B13R1.22 CSC(C)C(=O)c1cccc(Cl)c1 Amb25110469 [0,2,0,0,0,0|2,0,0]=4 7070 B13R1.22 C\C(=C/C)\C(=O)c1cccc(F)c1 Amb24676810 [0,2,0,0,0,0|1,0,1]=4 7071 B13R1.22 C\C(=C\C)\C(=O)c1cccc(F)c1 Amb24690503 [0,2,0,0,0,0|1,0,1]=4 7072 B13R1.22 C\C=C(/C)\C(=O)c1cc(C)ccc1 Amb25143367 [0,2,0,0,0,0|1,0,1]=4 7073 B13R1.22 Cc1c[n]cc(c1)C(=O)C(C)CC Amb25696901 [0,2,0,0,0,0|2,0,0]=4 7074 B13R1.22 Cc1c[n]cc(c1)C(=O)C(N)CC Amb24745429 [0,2,0,0,0,0|2,0,0]=4 7075 B13R1.22 Cc1c[n]cc(c1)C(=O)C(O)CC Amb24496139 [0,2,0,0,0,0|2,0,0]=4 7076 B13R1.22 Cc1c[n]cc(c1)C(=O)N(C)CC Amb25245035 [0,2,0,0,0,0|2,0,0]=4 7077 B13R1.22 Cc1cc(cc[n]1)C(=O)N(C)CC Amb25120639 [0,2,0,0,0,0|2,0,0]=4 7078 B13R1.22 Cc1cc(ccc1)C(=O)C(C)CO Amb24492512 [0,2,0,0,0,0|2,0,0]=4 7079 B13R1.22 Cc1cc(ccc1)C(=O)C(Cl)CC Amb25247360 [0,2,0,0,0,0|1,0,0]=3 7080 B13R1.22 Cc1cc(ccc1)C(=O)C(N)CC Amb18195907 [0,2,0,0,0,0|1,0,0]=3 7081 B13R1.22 Cc1cc(ccc1)C(=O)C(O)CC Amb24462699 [0,2,0,0,0,0|1,0,0]=3 7082 B13R1.22 Cc1cc(ccc1)C(=O)C(O)SC Amb25788129 [0,2,0,0,0,0|2,0,0]=4 7083 B13R1.22 Cc1cc(ccc1)C(=O)N(C)CC Amb24732786 [0,2,0,0,0,0|1,0,0]=3 7084 B13R1.22 Cc1cc[n]c(c1)C(=O)C(C)CC Amb24490009 [0,2,0,0,0,0|2,0,0]=4 7085 B13R1.22 Cc1cccc([n]1)C(=O)C(C)CC Amb25823835 [0,2,0,0,0,0|2,0,0]=4 7086 B13R1.22 Cc1cccc([n]1)C(=O)N(C)CC Amb25668996 [0,2,0,0,0,0|2,0,0]=4 7087 B13R1.22 Cc1cccc(c1)C(=O)C(=O)OC Amb22755054 [0,2,0,0,0,0|2,0,0]=4 7088 B13R1.22 ClCC(C(=O)c1cccc(c1)Br)Cl Amb17371797 [0,2,0,0,0,0|2,0,0]=4 7089 B13R1.30 CCCS(=O)(=O)c1cc(Br)ccc1 Amb18065211 [0,2,0,0,0,0|2,0,0]=4 7090 B13R1.30 CCCS(=O)(=O)c1cc(F)ccc1 Amb25204238 [0,2,0,0,0,0|2,0,0]=4 7091 B13R1.30 CCCS(=O)(=O)c1cc(N)ccc1 Amb18972069 [0,2,0,0,0,0|2,0,0]=4 7092 B13R1.30 CCCS(=O)(=O)c1cc(O)ccc1 Amb24455476 [0,2,0,0,0,0|2,0,0]=4 7093 B13R1.30 CCNS(=O)(=O)c1cccc(I)c1 Amb24344601 [0,2,0,0,0,0|2,0,0]=4 7094 B13R1.30 CCNS(=O)(=O)c1cccc(c1)Br Amb1570721 [0,2,0,0,0,0|2,0,0]=4 7095 B13R1.30 CCNS(=O)(=O)c1cccc(c1)N Amb1130466 [0,2,0,0,0,0|2,0,0]=4 7096 B13R1.30 CCOS(=O)(=O)c1cccc(Br)c1 Amb22044924 [0,2,0,0,0,0|1,0,0]=3 7097 B13R1.30 CCSS(=O)(=O)c1cccc(N)c1 Amb25857427 [0,2,0,0,0,0|1,1,0]=4 7098 B13R1.30 CP(=O)(OCC)c1cccc(O)c1 Amb25144606 [0,2,0,0,0,0|1,0,0]=3 7099 B13R1.147 CC(=C)CC(=O)c1cccc(Br)c1 Amb18071326 [0,2,0,0,0,0|1,0,1]=4 7100 B13R1.147 CC(=C)CC(=O)c1cccc(Cl)c1 Amb18066345 [0,2,0,0,0,0|1,0,1]=4 7101 B13R1.147 CC(=C)CC(=O)c1cccc(F)c1 Amb18065746 [0,2,0,0,0,0|1,0,1]=4 7102 B13R1.147 CC(=C)CC(=O)c1cccc(I)c1 Amb25303618 [0,2,0,0,0,0|1,0,1]=4 7103 B13R1.147 CC(=C)NC(=O)c1cccc(Cl)c1 Amb25110117 [0,2,0,0,0,0|1,0,1]=4 7104 B13R1.147 CC(=O)CC(=O)c1cc(C)ccc1 Amb18178269 [0,2,0,0,0,0|1,0,1]=4 7105 B13R1.147 CC(=O)CC(=O)c1cc(O)ccc1 Amb24351620 [0,2,0,0,0,0|1,0,1]=4 7106 B13R1.147 CC(=O)NC(=O)c1cc(Cl)ccc1 Amb25119296 [0,2,0,0,0,0|1,0,1]=4 7107 B13R1.147 CC(=O)NC(=O)c1cc(I)ccc1 Amb25690669 [0,2,0,0,0,0|1,0,1]=4 7108 B13R1.147 CC(C)=CC(=O)c1cccc(Cl)c1 Amb25715082 [0,2,0,0,0,0|1,0,1]=4 7109 B13R1.147 CC(C)=CC(=O)c1cccc(N)c1 Amb24453603 [0,2,0,0,0,0|1,0,1]=4 7110 B13R1.147 CC(C)CC(=O)c1c[n]cc(F)c1 Amb18181300 [0,2,0,0,0,0|2,0,0]=4 7111 B13R1.147 CC(C)CC(=O)c1cccc(N)[n]1 Amb24428273 [0,2,0,0,0,0|2,0,0]=4 7112 B13R1.147 CC(C)CS(=O)c1cccc(N)c1 Amb25104458 [0,2,0,0,0,0|2,0,0]=4 7113 B13R1.147 CC(C)NC(=N)c1cccc(Br)c1 Amb24346827 [0,2,0,0,0,0|2,0,0]=4 7114 B13R1.147 CC(C)NC(=N)c1cccc(F)c1 Amb25778531 [0,2,0,0,0,0|2,0,0]=4 7115 B13R1.147 CC(C)NC(=O)C1=CC=CC(=O)N1 Amb25180106 [0,2,0,0,0,0|2,0,0]=4 7116 B13R1.147 CC(C)NC(=O)c1c[n]cc(Cl)c1 Amb25088524 [0,2,0,0,0,0|2,0,0]=4 7117 B13R1.147 CC(C)NC(=O)c1c[n]cc(F)c1 Amb25819996 [0,2,0,0,0,0|2,0,0]=4 7118 B13R1.147 CC(C)NC(=O)c1c[n]cc(I)c1 Amb25236334 [0,2,0,0,0,0|2,0,0]=4 7119 B13R1.147 CC(C)NC(=O)c1cc(N)cc[n]1 Amb18284818 [0,2,0,0,0,0|2,0,0]=4 7120 B13R1.147 CC(C)NC(=O)c1cc[n]c(Br)c1 Amb24732993 [0,2,0,0,0,0|2,0,0]=4 7121 B13R1.147 CC(C)NC(=O)c1cc[n]c(F)c1 Amb18791386 [0,2,0,0,0,0|2,0,0]=4 7122 B13R1.147 CC(C)NC(=O)c1cc[n]c(N)c1 Amb18284820 [0,2,0,0,0,0|2,0,0]=4 7123 B13R1.147 CC(C)NC(=O)c1cccc(Br)[n]1 Amb24422567 [0,2,0,0,0,0|2,0,0]=4 7124 B13R1.147 CC(C)NC(=O)c1cccc(Cl)[n]1 Amb19088730 [0,2,0,0,0,0|2,0,0]=4 7125 B13R1.147 CC(C)NC(=O)c1cccc(N)[n]1 Amb18959757 [0,2,0,0,0,0|2,0,0]=4 7126 B13R1.147 CC(C)OC(=O)c1c[n]cc(Cl)[n]1 Amb25063693 [0,2,0,0,0,0|2,0,0]=4 7127 B13R1.147 CC(C)OC(=O)c1c[n]cc(Cl)c1 Amb25154821 [0,2,0,0,0,0|1,0,0]=3 7128 B13R1.147 CC(C)OC(=O)c1c[n]cc(N)c1 Amb25790098 [0,2,0,0,0,0|1,0,0]=3 7129 B13R1.147 CC(C)OC(=O)c1cc(Cl)cc[n]1 Amb24743118 [0,2,0,0,0,0|1,0,0]=3 7130 B13R1.147 CC(C)OC(=O)c1cc[n]c(Br)c1 Amb25089054 [0,2,0,0,0,0|1,0,0]=3 7131 B13R1.147 CC(C)OC(=O)c1cc[n]c(Cl)c1 Amb24743119 [0,2,0,0,0,0|1,0,0]=3 7132 B13R1.147 CC(C)OC(=O)c1cc[n]c(N)c1 Amb24731617 [0,2,0,0,0,0|1,0,0]=3 7133 B13R1.147 CC(C)OC(=O)c1cccc(Br)c1 Amb25081713 [0,2,0,0,0,0|0,0,0]=2 7134 B13R1.147 CC(C)OC(=O)c1cccc(Cl)[n]1 Amb25102955 [0,2,0,0,0,0|1,0,0]=3 7135 B13R1.147 CC(C)OC(=O)c1cccc(F)c1 Amb25674651 [0,2,0,0,0,0|0,0,0]=2 7136 B13R1.147 CC(C)OC(=O)c1cccc(N)[n]1 Amb24664926 [0,2,0,0,0,0|1,0,0]=3 7137 B13R1.147 CC(C)OC(=O)c1cccc(S)c1 Amb25760627 [0,2,0,0,0,0|0,0,0]=2 7138 B13R1.147 CC(C)OC(C)c1cccc(N)c1 Amb18292843 [0,2,0,0,0,0|1,0,1]=4 7139 B13R1.147 CC(CC(=O)c1cccc(c1)Br)C Amb17198775 [0,2,0,0,0,0|1,0,0]=3 7140 B13R1.147 CC(CC(=O)c1cccc(c1)C)C Amb17198737 [0,2,0,0,0,0|1,0,0]=3 7141 B13R1.147 CC(CC(=O)c1cccc(c1)Cl)C Amb17198755 [0,2,0,0,0,0|1,0,0]=3 7142 B13R1.147 CC(CC(=O)c1cccc(c1)F)C Amb17233681 [0,2,0,0,0,0|1,0,0]=3 7143 B13R1.147 CC(CC(=O)c1cccc(c1)N)C Amb17335171 [0,2,0,0,0,0|1,0,0]=3 7144 B13R1.147 CC(CC(=O)c1cccc(c1)O)C Amb17335231 [0,2,0,0,0,0|1,0,0]=3 7145 B13R1.147 CC(N)CC(=O)c1c[n]cc(F)c1 Amb25215148 [0,2,0,0,0,0|2,0,0]=4 7146 B13R1.147 CC(N)CC(=O)c1cccc(Br)c1 Amb24689823 [0,2,0,0,0,0|1,0,0]=3 7147 B13R1.147 CC(N)CC(=O)c1cccc(F)c1 Amb24520946 [0,2,0,0,0,0|1,0,0]=3 7148 B13R1.147 CC(N)CS(=O)c1cccc(Cl)c1 Amb25732626 [0,2,0,0,0,0|2,0,0]=4 7149 B13R1.147 CC(NC(=O)c1cccc(c1)N)C Amb1114824 [0,2,0,0,0,0|1,0,0]=3 7150 B13R1.147 CC(NC(=O)c1cncc(c1)Br)C Amb1081541 [0,2,0,0,0,0|2,0,0]=4 7151 B13R1.147 CC(O)CS(=O)c1cccc(N)c1 Amb25755198 [0,2,0,0,0,0|2,0,0]=4 7152 B13R1.147 CC(OC(=O)c1cccc(c1)C)C Amb17509325 [0,2,0,0,0,0|0,0,0]=2 7153 B13R1.147 CC(OC(=O)c1cccc(c1)O)C Amb2123403 [0,2,0,0,0,0|0,0,0]=2 7154 B13R1.147 CN(C)CC(=O)c1cccc(I)c1 Amb25155324 [0,2,0,0,0,0|2,0,0]=4 7155 B13R1.147 CN(C)CC(=O)c1cccc(O)c1 Amb25094482 [0,2,0,0,0,0|2,0,0]=4 7156 B13R1.147 CN(C)NC(=O)c1cccc(Br)c1 Amb24469764 [0,2,0,0,0,0|2,0,0]=4 7157 B13R1.147 CN(C)NC(=O)c1cccc(F)c1 Amb24335156 [0,2,0,0,0,0|2,0,0]=4 7158 B13R1.147 CN(CC(=O)c1cccc(c1)N)C Amb17090521 [0,2,0,0,0,0|2,0,0]=4 7159 B13R1.147 C\C(=C\C(C)O)\c1cc(Br)ccc1 Amb25838052 [0,2,0,0,0,0|2,0,0]=4 7160 B13R1.147 C\C(=C\C(C)O)\c1cc(F)ccc1 Amb25343978 [0,2,0,0,0,0|2,0,0]=4 7161 B13R1.147 C\C(\N)=N/C(=O)c1cc(N)ccc1 Amb18127913 [0,2,0,0,0,0|1,0,1]=4 7162 B13R1.147 Cc1[n]c(cc[n]1)C(=O)OC(C)C Amb24393688 [0,2,0,0,0,0|2,0,0]=4 7163 B13R1.147 Cc1c[n]cc(c1)C(=O)CC(C)N Amb24655619 [0,2,0,0,0,0|2,0,0]=4 7164 B13R1.147 Cc1c[n]cc(c1)C(=O)OC(C)C Amb24600681 [0,2,0,0,0,0|1,0,0]=3 7165 B13R1.147 Cc1cc([n]c[n]1)C(=O)OC(C)C Amb24412718 [0,2,0,0,0,0|2,0,0]=4 7166 B13R1.147 Cc1cc(cc[n]1)C(=O)NC(C)C Amb25822754 [0,2,0,0,0,0|2,0,0]=4 7167 B13R1.147 Cc1cc(cc[n]1)C(=O)OC(C)C Amb25034389 [0,2,0,0,0,0|1,0,0]=3 7168 B13R1.147 Cc1cc(ccc1)C(=N)NC(C)C Amb24421886 [0,2,0,0,0,0|2,0,0]=4 7169 B13R1.147 Cc1cc(ccc1)C(=O)CC(C)=C Amb18065523 [0,2,0,0,0,0|1,0,1]=4 7170 B13R1.147 Cc1cc(ccc1)C(=O)CC(C)N Amb24520947 [0,2,0,0,0,0|1,0,0]=3 7171 B13R1.147 Cc1cc(ccc1)C(=O)CC(F)F Amb25279350 [0,2,0,0,0,0|2,0,0]=4 7172 B13R1.147 Cc1cc(ccc1)C(=O)NN(C)C Amb25119756 [0,2,0,0,0,0|2,0,0]=4 7173 B13R1.147 Cc1cc(ccc1)\C(\C)=C/C(C)O Amb25098991 [0,2,0,0,0,0|2,0,0]=4 7174 B13R1.147 Cc1cc[n]c(c1)C(=O)NC(C)C Amb25243545 [0,2,0,0,0,0|2,0,0]=4 7175 B13R1.147 Cc1cccc(c1)C(=O)CS(C)=O Amb25826769 [0,2,0,0,0,0|2,0,0]=4 7176 B13R1.147 Nc1cc(ccc1)C(=O)OC(F)F Amb18975587 [0,2,0,0,0,0|1,0,0]=3 7177 B13R1.446 C=COC(=O)c1cc(O)ccc1Br Amb25159181 [0,2,0,0,0,0|0,0,2]=4 7178 B13R1.446 CC=1C=C(C(=O)NN1)C(=O)OCC Amb19930080 [0,2,0,0,0,0|2,0,0]=4 7179 B13R1.446 CC=1C=CC(=O)NC1C(=O)OCC Amb25785587 [0,2,0,0,0,0|1,0,0]=3 7180 B13R1.446 CCCC(=C)c1cc(C)ccc1C Amb25230186 [0,2,0,0,0,0|2,0,0]=4 7181 B13R1.446 CCCC(=O)c1cc(Br)ccc1Br Amb17198914 [0,2,0,0,0,0|1,0,0]=3 7182 B13R1.446 CCCC(=O)c1cc(Br)ccc1Cl Amb24437226 [0,2,0,0,0,0|1,0,0]=3 7183 B13R1.446 CCCC(=O)c1cc(Br)ccc1F Amb17198936 [0,2,0,0,0,0|1,0,0]=3 7184 B13R1.446 CCCC(=O)c1cc(C)ccc1Cl Amb17198876 [0,2,0,0,0,0|1,0,0]=3 7185 B13R1.446 CCCC(=O)c1cc(Cl)ccc1O Amb17236841 [0,2,0,0,0,0|1,0,0]=3 7186 B13R1.446 CCCC(=O)c1cc(F)ccc1O Amb17233892 [0,2,0,0,0,0|1,0,0]=3 7187 B13R1.446 CCCC(=O)c1cc(I)ccc1Br Amb24716506 [0,2,0,0,0,0|1,0,0]=3 7188 B13R1.446 CCCC(=O)c1cc(N)ccc1F Amb25767241 [0,2,0,0,0,0|1,0,0]=3 7189 B13R1.446 CCCC(=O)c1cc(O)ccc1F Amb24659471 [0,2,0,0,0,0|1,0,0]=3 7190 B13R1.446 CCCC(=O)c1cc(O)ccc1N Amb24356781 [0,2,0,0,0,0|1,0,0]=3 7191 B13R1.446 CCCS(=O)c1cc(Cl)ccc1N Amb24654478 [0,2,0,0,0,0|2,0,0]=4 7192 B13R1.446 CCCS(=O)c1cc(F)ccc1N Amb24760957 [0,2,0,0,0,0|2,0,0]=4 7193 B13R1.446 CCCS(=O)c1cc(N)ccc1Cl Amb24382873 [0,2,0,0,0,0|2,0,0]=4 7194 B13R1.446 CCNC(=N)c1cc(F)ccc1Br Amb24701995 [0,2,0,0,0,0|2,0,0]=4 7195 B13R1.446 CCNC(=O)c1[n]c(Br)ccc1Br Amb25135899 [0,2,0,0,0,0|2,0,0]=4 7196 B13R1.446 CCNC(=O)c1[n]c(Br)ccc1F Amb25043609 [0,2,0,0,0,0|2,0,0]=4 7197 B13R1.446 CCNC(=O)c1[n]c(Cl)ccc1F Amb25668999 [0,2,0,0,0,0|2,0,0]=4 7198 B13R1.446 CCNC(=O)c1[n]c(N)ccc1Cl Amb18284830 [0,2,0,0,0,0|2,0,0]=4 7199 B13R1.446 CCNC(=O)c1cc(Br)[n]cc1Cl Amb25120544 [0,2,0,0,0,0|2,0,0]=4 7200 B13R1.446 CCNC(=O)c1cc(Br)[n]cc1F Amb24588137 [0,2,0,0,0,0|2,0,0]=4 7201 B13R1.446 CCNC(=O)c1cc(Br)c[n]c1N Amb18284831 [0,2,0,0,0,0|2,0,0]=4 7202 B13R1.446 CCNC(=O)c1cc(Br)ccc1Br Amb24461513 [0,2,0,0,0,0|1,0,0]=3 7203 B13R1.446 CCNC(=O)c1cc(Br)ccc1I Amb11217880 [0,2,0,0,0,0|1,0,0]=3 7204 B13R1.446 CCNC(=O)c1cc(Br)ccc1N Amb18273760 [0,2,0,0,0,0|1,0,0]=3 7205 B13R1.446 CCNC(=O)c1cc(Br)ccc1O Amb15805574 [0,2,0,0,0,0|1,0,0]=3 7206 B13R1.446 CCNC(=O)c1cc(Cl)[n]cc1N Amb25096227 [0,2,0,0,0,0|2,0,0]=4 7207 B13R1.446 CCNC(=O)c1cc(Cl)ccc1I Amb24644617 [0,2,0,0,0,0|1,0,0]=3 7208 B13R1.446 CCNC(=O)c1cc(Cl)ccc1N Amb1118181 [0,2,0,0,0,0|1,0,0]=3 7209 B13R1.446 CCNC(=O)c1cc(F)c[n]c1Cl Amb25723473 [0,2,0,0,0,0|2,0,0]=4 7210 B13R1.446 CCNC(=O)c1cc(F)c[n]c1N Amb25755189 [0,2,0,0,0,0|2,0,0]=4 7211 B13R1.446 CCNC(=O)c1cc(F)ccc1I Amb20641873 [0,2,0,0,0,0|1,0,0]=3 7212 B13R1.446 CCNC(=O)c1cc(I)ccc1N Amb24352767 [0,2,0,0,0,0|1,0,0]=3 7213 B13R1.446 CCNC(=O)c1cc(I)ccc1O Amb25158528 [0,2,0,0,0,0|1,0,0]=3 7214 B13R1.446 CCNC(=O)c1cc(N)[n]cc1Br Amb24684193 [0,2,0,0,0,0|2,0,0]=4 7215 B13R1.446 CCNC(=O)c1cc(N)[n]cc1Cl Amb24757410 [0,2,0,0,0,0|2,0,0]=4 7216 B13R1.446 CCNC(=O)c1cc(N)ccc1Br Amb18284103 [0,2,0,0,0,0|1,0,0]=3 7217 B13R1.446 CCNC(=O)c1cc(N)ccc1Cl Amb1114508 [0,2,0,0,0,0|1,0,0]=3 7218 B13R1.446 CCNC(=O)c1cc(N)ccc1Cl Amb13949223 [0,2,0,0,0,0|1,0,0]=3 7219 B13R1.446 CCNC(=O)c1cc(N)ccc1O Amb18128675 [0,2,0,0,0,0|1,0,0]=3 7220 B13R1.446 CCNC(=O)c1cc(S)ccc1F Amb24495392 [0,2,0,0,0,0|1,0,0]=3 7221 B13R1.446 CCOC(=N)c1cc(Br)ccc1I Amb25305265 [0,2,0,0,0,0|1,0,0]=3 7222 B13R1.446 CCOC(=N)c1cc(Br)ccc1N Amb25081040 [0,2,0,0,0,0|1,0,0]=3 7223 B13R1.446 CCOC(=N)c1cc(Br)ccc1O Amb24669654 [0,2,0,0,0,0|1,0,0]=3 7224 B13R1.446 CCOC(=N)c1cc(Cl)ccc1Br Amb24734561 [0,2,0,0,0,0|1,0,0]=3 7225 B13R1.446 CCOC(=N)c1cc(Cl)ccc1O Amb25044284 [0,2,0,0,0,0|1,0,0]=3 7226 B13R1.446 CCOC(=N)c1cc(F)ccc1Br Amb25095948 [0,2,0,0,0,0|1,0,0]=3 7227 B13R1.446 CCOC(=O)C1=CC(Br)=CNC1=S Amb25105707 [0,2,0,0,0,0|1,0,0]=3 7228 B13R1.446 CCOC(=O)C1=CC(Cl)=CNC1=O Amb24601927 [0,2,0,0,0,0|1,0,0]=3 7229 B13R1.446 CCOC(=O)C1=CC(Cl)=NNC1=O Amb22523487 [0,2,0,0,0,0|2,0,0]=4 7230 B13R1.446 CCOC(=O)C=1NC(=O)C=CC1Cl Amb22751770 [0,2,0,0,0,0|1,0,0]=3 7231 B13R1.446 CCOC(=O)c1[n]c(Br)c[n]c1Cl Amb24603478 [0,2,0,0,0,0|2,0,0]=4 7232 B13R1.446 CCOC(=O)c1[n]c(Br)c[n]c1N Amb25364974 [0,2,0,0,0,0|2,0,0]=4 7233 B13R1.446 CCOC(=O)c1[n]c(Br)ccc1Br Amb19959824 [0,2,0,0,0,0|1,0,0]=3 7234 B13R1.446 CCOC(=O)c1[n]c(Br)ccc1F Amb25118828 [0,2,0,0,0,0|1,0,0]=3 7235 B13R1.446 CCOC(=O)c1[n]c(Br)ccc1N Amb19516200 [0,2,0,0,0,0|1,0,0]=3 7236 B13R1.446 CCOC(=O)c1[n]c(Br)ccc1O Amb23541703 [0,2,0,0,0,0|1,0,0]=3 7237 B13R1.446 CCOC(=O)c1[n]c(Cl)[n]cc1Br Amb22498355 [0,2,0,0,0,0|2,0,0]=4 7238 B13R1.446 CCOC(=O)c1[n]c(Cl)[n]cc1Cl Amb24733689 [0,2,0,0,0,0|2,0,0]=4 7239 B13R1.446 CCOC(=O)c1[n]c(Cl)[n]cc1N Amb18130813 [0,2,0,0,0,0|2,0,0]=4 7240 B13R1.446 CCOC(=O)c1[n]c(Cl)c[n]c1N Amb24468388 [0,2,0,0,0,0|2,0,0]=4 7241 B13R1.446 CCOC(=O)c1[n]c(Cl)c[n]c1O Amb25314720 [0,2,0,0,0,0|2,0,0]=4 7242 B13R1.446 CCOC(=O)c1[n]c(Cl)ccc1Br Amb19959855 [0,2,0,0,0,0|1,0,0]=3 7243 B13R1.446 CCOC(=O)c1[n]c(Cl)ccc1N Amb22755379 [0,2,0,0,0,0|1,0,0]=3 7244 B13R1.446 CCOC(=O)c1[n]c(F)ccc1Cl Amb25742988 [0,2,0,0,0,0|1,0,0]=3 7245 B13R1.446 CCOC(=O)c1[n]c(F)ccc1F Amb25065168 [0,2,0,0,0,0|1,0,0]=3 7246 B13R1.446 CCOC(=O)c1[n]c(I)c[n]c1N Amb25041003 [0,2,0,0,0,0|2,0,0]=4 7247 B13R1.446 CCOC(=O)c1[n]c(I)ccc1Cl Amb22752630 [0,2,0,0,0,0|1,0,0]=3 7248 B13R1.446 CCOC(=O)c1[n]c(N)[n]cc1Br Amb22497869 [0,2,0,0,0,0|2,0,0]=4 7249 B13R1.446 CCOC(=O)c1[n]c(N)[n]cc1F Amb24343845 [0,2,0,0,0,0|2,0,0]=4 7250 B13R1.446 CCOC(=O)c1[n]c(N)ccc1Br Amb19959836 [0,2,0,0,0,0|1,0,0]=3 7251 B13R1.446 CCOC(=O)c1[n]c(N)ccc1N Amb24455734 [0,2,0,0,0,0|1,0,0]=3 7252 B13R1.446 CCOC(=O)c1[n]c(O)ccc1Br Amb19959837 [0,2,0,0,0,0|1,0,0]=3 7253 B13R1.446 CCOC(=O)c1[n]c(O)ccc1F Amb25253427 [0,2,0,0,0,0|1,0,0]=3 7254 B13R1.446 CCOC(=O)c1cc(Br)[n]cc1Cl Amb24666576 [0,2,0,0,0,0|1,0,0]=3 7255 B13R1.446 CCOC(=O)c1cc(Br)[n]cc1N Amb22640980 [0,2,0,0,0,0|1,0,0]=3 7256 B13R1.446 CCOC(=O)c1cc(Br)c[n]c1Br Amb19959259 [0,2,0,0,0,0|1,0,0]=3 7257 B13R1.446 CCOC(=O)c1cc(Br)c[n]c1Cl Amb22752623 [0,2,0,0,0,0|1,0,0]=3 7258 B13R1.446 CCOC(=O)c1cc(Br)c[n]c1F Amb25055205 [0,2,0,0,0,0|1,0,0]=3 7259 B13R1.446 CCOC(=O)c1cc(Br)ccc1I Amb19888237 [0,2,0,0,0,0|0,0,0]=2 7260 B13R1.446 CCOC(=O)c1cc(Br)ccc1S Amb24597053 [0,2,0,0,0,0|0,0,0]=2 7261 B13R1.446 CCOC(=O)c1cc(C)ccc1I Amb10069354 [0,2,0,0,0,0|0,0,0]=2 7262 B13R1.446 CCOC(=O)c1cc(Cl)[n][n]c1Cl Amb19515923 [0,2,0,0,0,0|2,0,0]=4 7263 B13R1.446 CCOC(=O)c1cc(Cl)[n][n]c1N Amb24361604 [0,2,0,0,0,0|2,0,0]=4 7264 B13R1.446 CCOC(=O)c1cc(Cl)[n][n]c1O Amb18130871 [0,2,0,0,0,0|2,0,0]=4 7265 B13R1.446 CCOC(=O)c1cc(Cl)[n]cc1N Amb21926654 [0,2,0,0,0,0|1,0,0]=3 7266 B13R1.446 CCOC(=O)c1cc(Cl)c[n]c1Br Amb22495410 [0,2,0,0,0,0|1,0,0]=3 7267 B13R1.446 CCOC(=O)c1cc(Cl)c[n]c1F Amb22491901 [0,2,0,0,0,0|1,0,0]=3 7268 B13R1.446 CCOC(=O)c1cc(Cl)c[n]c1N Amb19958440 [0,2,0,0,0,0|1,0,0]=3 7269 B13R1.446 CCOC(=O)c1cc(Cl)cc[n+]1[O-] Amb24496244 [0,2,0,0,0,0|1,0,0]=3 7270 B13R1.446 CCOC(=O)c1cc(Cl)ccc1Br Amb24065402 [0,2,0,0,0,0|0,0,0]=2 7271 B13R1.446 CCOC(=O)c1cc(Cl)ccc1I Amb16185428 [0,2,0,0,0,0|0,0,0]=2 7272 B13R1.446 CCOC(=O)c1cc(Cl)ccc1S Amb24437995 [0,2,0,0,0,0|0,0,0]=2 7273 B13R1.446 CCOC(=O)c1cc(Cl)cnc1Cl Amb1090904 [0,2,0,0,0,0|1,0,0]=3 7274 B13R1.446 CCOC(=O)c1cc(Cl)ncc1Br Amb13882792 [0,2,0,0,0,0|1,0,0]=3 7275 B13R1.446 CCOC(=O)c1cc(F)[n]cc1Br Amb25155256 [0,2,0,0,0,0|1,0,0]=3 7276 B13R1.446 CCOC(=O)c1cc(F)[n]cc1F Amb25279376 [0,2,0,0,0,0|1,0,0]=3 7277 B13R1.446 CCOC(=O)c1cc(F)[n]cc1N Amb24496819 [0,2,0,0,0,0|1,0,0]=3 7278 B13R1.446 CCOC(=O)c1cc(F)c[n]c1Br Amb25301356 [0,2,0,0,0,0|1,0,0]=3 7279 B13R1.446 CCOC(=O)c1cc(F)c[n]c1F Amb25102751 [0,2,0,0,0,0|1,0,0]=3 7280 B13R1.446 CCOC(=O)c1cc(F)c[n]c1N Amb23438886 [0,2,0,0,0,0|1,0,0]=3 7281 B13R1.446 CCOC(=O)c1cc(F)ccc1O Amb10576342 [0,2,0,0,0,0|0,0,0]=2 7282 B13R1.446 CCOC(=O)c1cc(F)ccc1S Amb22337257 [0,2,0,0,0,0|0,0,0]=2 7283 B13R1.446 CCOC(=O)c1cc(I)c[n]c1F Amb24563986 [0,2,0,0,0,0|1,0,0]=3 7284 B13R1.446 CCOC(=O)c1cc(I)c[n]c1O Amb24384148 [0,2,0,0,0,0|1,0,0]=3 7285 B13R1.446 CCOC(=O)c1cc(I)ccc1Br Amb19888257 [0,2,0,0,0,0|0,0,0]=2 7286 B13R1.446 CCOC(=O)c1cc(I)ccc1Cl Amb19887819 [0,2,0,0,0,0|0,0,0]=2 7287 B13R1.446 CCOC(=O)c1cc(I)ccc1F Amb19887822 [0,2,0,0,0,0|0,0,0]=2 7288 B13R1.446 CCOC(=O)c1cc(I)ccc1I Amb24066424 [0,2,0,0,0,0|0,0,0]=2 7289 B13R1.446 CCOC(=O)c1cc(I)ccc1N Amb10068700 [0,2,0,0,0,0|0,0,0]=2 7290 B13R1.446 CCOC(=O)c1cc(I)ccc1O Amb16232638 [0,2,0,0,0,0|0,0,0]=2 7291 B13R1.446 CCOC(=O)c1cc(I)ccc1S Amb25699409 [0,2,0,0,0,0|0,0,0]=2 7292 B13R1.446 CCOC(=O)c1cc(N)[n]cc1Br Amb20620207 [0,2,0,0,0,0|1,0,0]=3 7293 B13R1.446 CCOC(=O)c1cc(N)[n]cc1F Amb24754366 [0,2,0,0,0,0|1,0,0]=3 7294 B13R1.446 CCOC(=O)c1cc(N)[n]cc1O Amb25251631 [0,2,0,0,0,0|1,0,0]=3 7295 B13R1.446 CCOC(=O)c1cc(N)c[n]c1N Amb25288142 [0,2,0,0,0,0|1,0,0]=3 7296 B13R1.446 CCOC(=O)c1cc(N)c[n]c1O Amb25083708 [0,2,0,0,0,0|1,0,0]=3 7297 B13R1.446 CCOC(=O)c1cc(N)ccc1Br Amb18294542 [0,2,0,0,0,0|0,0,0]=2 7298 B13R1.446 CCOC(=O)c1cc(N)ccc1F Amb18984956 [0,2,0,0,0,0|0,0,0]=2 7299 B13R1.446 CCOC(=O)c1cc(N)ccc1N Amb18975485 [0,2,0,0,0,0|0,0,0]=2 7300 B13R1.446 CCOC(=O)c1cc(O)[n][n]c1Cl Amb18130872 [0,2,0,0,0,0|2,0,0]=4 7301 B13R1.446 CCOC(=O)c1cc(O)[n]cc1Cl Amb25699491 [0,2,0,0,0,0|1,0,0]=3 7302 B13R1.446 CCOC(=O)c1cc(O)[n]cc1N Amb25674833 [0,2,0,0,0,0|1,0,0]=3 7303 B13R1.446 CCOC(=O)c1cc(O)c[n]c1Br Amb25350682 [0,2,0,0,0,0|1,0,0]=3 7304 B13R1.446 CCOC(=O)c1cc(O)c[n]c1Cl Amb24528293 [0,2,0,0,0,0|1,0,0]=3 7305 B13R1.446 CCOC(=O)c1cc(O)c[n]c1F Amb25223618 [0,2,0,0,0,0|1,0,0]=3 7306 B13R1.446 CCOC(=O)c1cc(O)ccc1Br Amb21964346 [0,2,0,0,0,0|0,0,0]=2 7307 B13R1.446 CCOC(=O)c1cc(O)ccc1Cl Amb22001181 [0,2,0,0,0,0|0,0,0]=2 7308 B13R1.446 CCOC(=O)c1cc(O)ccc1I Amb10553667 [0,2,0,0,0,0|0,0,0]=2 7309 B13R1.446 CCOC(=O)c1cc(O)ccc1N Amb18977547 [0,2,0,0,0,0|0,0,0]=2 7310 B13R1.446 CCOC(=O)c1cc(S)ccc1Br Amb25310858 [0,2,0,0,0,0|0,0,0]=2 7311 B13R1.446 CCOC(=O)c1cc(S)ccc1Cl Amb25760626 [0,2,0,0,0,0|0,0,0]=2 7312 B13R1.446 CCOC(=O)c1cc(S)ccc1F Amb25141521 [0,2,0,0,0,0|0,0,0]=2 7313 B13R1.446 CCOC(=O)c1nc(Cl)ccc1Cl Amb16185798 [0,2,0,0,0,0|1,0,0]=3 7314 B13R1.446 CNCC(=O)c1cc(Br)ccc1F Amb25153485 [0,2,0,0,0,0|2,0,0]=4 7315 B13R1.446 CNCC(=O)c1cc(C)ccc1C Amb17233279 [0,2,0,0,0,0|2,0,0]=4 7316 B13R1.446 CNCC(=O)c1cc(Cl)ccc1Cl Amb18225699 [0,2,0,0,0,0|2,0,0]=4 7317 B13R1.446 CNCC(=O)c1cc(Cl)ccc1F Amb18894775 [0,2,0,0,0,0|2,0,0]=4 7318 B13R1.446 CNCC(=O)c1cc(F)ccc1Br Amb25191402 [0,2,0,0,0,0|2,0,0]=4 7319 B13R1.446 CNCC(=O)c1cc(F)ccc1F Amb17335731 [0,2,0,0,0,0|2,0,0]=4 7320 B13R1.446 CNNC(=O)c1cc(Cl)ccc1N Amb25035281 [0,2,0,0,0,0|2,0,0]=4 7321 B13R1.446 COCC(=O)c1cc(Br)ccc1Br Amb17198915 [0,2,0,0,0,0|2,0,0]=4 7322 B13R1.446 COCC(=O)c1cc(Br)ccc1Cl Amb25161282 [0,2,0,0,0,0|2,0,0]=4 7323 B13R1.446 COCC(=O)c1cc(Br)ccc1F Amb17198937 [0,2,0,0,0,0|2,0,0]=4 7324 B13R1.446 COCC(=O)c1cc(Br)ccc1I Amb25734766 [0,2,0,0,0,0|2,0,0]=4 7325 B13R1.446 COCC(=O)c1cc(Br)ccc1N Amb25367965 [0,2,0,0,0,0|2,0,0]=4 7326 B13R1.446 COCC(=O)c1cc(C)ccc1Cl Amb17198877 [0,2,0,0,0,0|2,0,0]=4 7327 B13R1.446 COCC(=O)c1cc(Cl)ccc1I Amb24352442 [0,2,0,0,0,0|2,0,0]=4 7328 B13R1.446 COCC(=O)c1cc(Cl)ccc1O Amb22457028 [0,2,0,0,0,0|2,0,0]=4 7329 B13R1.446 COCC(=O)c1cc(F)ccc1Br Amb25819913 [0,2,0,0,0,0|2,0,0]=4 7330 B13R1.446 COCC(=O)c1cc(N)ccc1Br Amb25155864 [0,2,0,0,0,0|2,0,0]=4 7331 B13R1.446 COCC(=O)c1cc(N)ccc1F Amb25734792 [0,2,0,0,0,0|2,0,0]=4 7332 B13R1.446 CONC(=O)c1cc(Br)ccc1Br Amb24697328 [0,2,0,0,0,0|2,0,0]=4 7333 B13R1.446 CONC(=O)c1cc(Br)ccc1Cl Amb16072981 [0,2,0,0,0,0|2,0,0]=4 7334 B13R1.446 CONC(=O)c1cc(Br)ccc1F Amb20813826 [0,2,0,0,0,0|2,0,0]=4 7335 B13R1.446 CONC(=O)c1cc(Br)ccc1I Amb11261026 [0,2,0,0,0,0|2,0,0]=4 7336 B13R1.446 CONC(=O)c1cc(Br)ccc1O Amb21787782 [0,2,0,0,0,0|2,0,0]=4 7337 B13R1.446 CONC(=O)c1cc(Cl)ccc1F Amb16073230 [0,2,0,0,0,0|2,0,0]=4 7338 B13R1.446 CONC(=O)c1cc(Cl)ccc1I Amb11338467 [0,2,0,0,0,0|2,0,0]=4 7339 B13R1.446 CONC(=O)c1cc(Cl)ccc1N Amb24402189 [0,2,0,0,0,0|2,0,0]=4 7340 B13R1.446 CONC(=O)c1cc(Cl)ccc1O Amb20892796 [0,2,0,0,0,0|2,0,0]=4 7341 B13R1.446 CONC(=O)c1cc(F)ccc1Br Amb16073211 [0,2,0,0,0,0|2,0,0]=4 7342 B13R1.446 CONC(=O)c1cc(F)ccc1F Amb13980627 [0,2,0,0,0,0|2,0,0]=4 7343 B13R1.446 CONC(=O)c1cc(F)ccc1I Amb25344374 [0,2,0,0,0,0|2,0,0]=4 7344 B13R1.446 CONC(=O)c1cc(I)ccc1Br Amb25158647 [0,2,0,0,0,0|2,0,0]=4 7345 B13R1.446 CONC(=O)c1cc(I)ccc1Cl Amb24732659 [0,2,0,0,0,0|2,0,0]=4 7346 B13R1.446 CONC(=O)c1cc(I)ccc1F Amb24414725 [0,2,0,0,0,0|2,0,0]=4 7347 B13R1.446 CONC(=O)c1cc(I)ccc1I Amb25072368 [0,2,0,0,0,0|2,0,0]=4 7348 B13R1.446 CONC(=O)c1cc(N)ccc1F Amb24367236 [0,2,0,0,0,0|2,0,0]=4 7349 B13R1.446 CONC(=O)c1cc(N)ccc1O Amb24520913 [0,2,0,0,0,0|2,0,0]=4 7350 B13R1.446 CSCC(=O)c1cc(Br)ccc1Br Amb25731794 [0,2,0,0,0,0|2,0,0]=4 7351 B13R1.446 CSCC(=O)c1cc(Br)ccc1I Amb25735930 [0,2,0,0,0,0|2,0,0]=4 7352 B13R1.446 CSCC(=O)c1cc(Cl)ccc1Br Amb24660779 [0,2,0,0,0,0|2,0,0]=4 7353 B13R1.446 CSCC(=O)c1cc(Cl)ccc1F Amb24585615 [0,2,0,0,0,0|2,0,0]=4 7354 B13R1.446 CSCC(=O)c1cc(Cl)ccc1O Amb24343864 [0,2,0,0,0,0|2,0,0]=4 7355 B13R1.446 CSCC(=O)c1cc(F)ccc1Br Amb24368294 [0,2,0,0,0,0|2,0,0]=4 7356 B13R1.446 CSCC(=O)c1cc(F)ccc1F Amb25303096 [0,2,0,0,0,0|2,0,0]=4 7357 B13R1.446 CSCC(=O)c1cc(F)ccc1O Amb19047945 [0,2,0,0,0,0|2,0,0]=4 7358 B13R1.446 C\C=C\C(=O)c1cc(Br)ccc1F Amb25040884 [0,2,0,0,0,0|1,0,1]=4 7359 B13R1.446 C\C=C\C(=O)c1cc(C)ccc1C Amb25091438 [0,2,0,0,0,0|1,0,1]=4 7360 B13R1.446 C\C=C\C(=O)c1cc(F)ccc1Cl Amb25785362 [0,2,0,0,0,0|1,0,1]=4 7361 B13R1.446 C\C=C\C(=O)c1cc(F)ccc1F Amb24383795 [0,2,0,0,0,0|1,0,1]=4 7362 B13R1.446 C\C=C\C(=O)c1cc(F)ccc1O Amb24550101 [0,2,0,0,0,0|1,0,1]=4 7363 B13R1.446 Cc1[n]c(C(=O)OCC)c(Br)c[n]1 Amb21962896 [0,2,0,0,0,0|2,0,0]=4 7364 B13R1.446 Cc1[n]c(C(=O)OCC)c(C)c[n]1 Amb25331923 [0,2,0,0,0,0|2,0,0]=4 7365 B13R1.446 Cc1[n]c(c(N)c[n]1)C(=O)OCC Amb25704410 [0,2,0,0,0,0|2,0,0]=4 7366 B13R1.446 Cc1[n]cc(Br)cc1C(=O)OCC Amb19889836 [0,2,0,0,0,0|1,0,0]=3 7367 B13R1.446 Cc1[n]cc(Cl)cc1C(=O)OCC Amb19944704 [0,2,0,0,0,0|1,0,0]=3 7368 B13R1.446 Cc1[n]cc(I)cc1C(=O)OCC Amb23412146 [0,2,0,0,0,0|1,0,0]=3 7369 B13R1.446 Cc1[n]cc(N)cc1C(=O)NCC Amb18951120 [0,2,0,0,0,0|2,0,0]=4 7370 B13R1.446 Cc1[n]cc(N)cc1C(=O)OCC Amb18976369 [0,2,0,0,0,0|1,0,0]=3 7371 B13R1.446 Cc1[n]cc(O)cc1C(=O)OCC Amb22263373 [0,2,0,0,0,0|1,0,0]=3 7372 B13R1.446 Cc1c[n]c(C)c([n]1)C(=O)OCC Amb23401638 [0,2,0,0,0,0|2,0,0]=4 7373 B13R1.446 Cc1c[n]c(Cl)cc1C(=O)OCC Amb22263016 [0,2,0,0,0,0|1,0,0]=3 7374 B13R1.446 Cc1c[n]c(N)[n]c1C(=O)OCC Amb25673669 [0,2,0,0,0,0|2,0,0]=4 7375 B13R1.446 Cc1c[n]c(O)c([n]1)C(=O)OCC Amb24715548 [0,2,0,0,0,0|2,0,0]=4 7376 B13R1.446 Cc1cc(C(=N)OCC)c(C)cc1 Amb18180671 [0,2,0,0,0,0|1,0,0]=3 7377 B13R1.446 Cc1cc(C(=O)CCBr)c(I)cc1 Amb25192026 [0,2,0,0,0,0|2,0,0]=4 7378 B13R1.446 Cc1cc(C(=O)CCCl)c(F)cc1 Amb24392269 [0,2,0,0,0,0|2,0,0]=4 7379 B13R1.446 Cc1cc(C(=O)CCCl)c(S)cc1 Amb24572837 [0,2,0,0,0,0|2,0,0]=4 7380 B13R1.446 Cc1cc(C(=O)CCCl)c(cc1)Cl Amb17198880 [0,2,0,0,0,0|2,0,0]=4 7381 B13R1.446 Cc1cc(C(=O)CCN)c(Cl)cc1 Amb25114851 [0,2,0,0,0,0|2,0,0]=4 7382 B13R1.446 Cc1cc(C(=O)CCN)c(O)cc1 Amb25800893 [0,2,0,0,0,0|2,0,0]=4 7383 B13R1.446 Cc1cc(C(=O)CCO)c(C)cc1 Amb18065759 [0,2,0,0,0,0|2,0,0]=4 7384 B13R1.446 Cc1cc(C(=O)CSC)c(C)cc1 Amb18321259 [0,2,0,0,0,0|2,0,0]=4 7385 B13R1.446 Cc1cc(C(=O)NCCl)c(C)cc1 Amb24652325 [0,2,0,0,0,0|2,0,0]=4 7386 B13R1.446 Cc1cc(C(=O)OCC)c(Br)[n]c1 Amb21857315 [0,2,0,0,0,0|1,0,0]=3 7387 B13R1.446 Cc1cc(C(=O)OCC)c(C)[n][n]1 Amb19987163 [0,2,0,0,0,0|2,0,0]=4 7388 B13R1.446 Cc1cc(C(=O)OCC)c(C)[n]c1 Amb24496982 [0,2,0,0,0,0|1,0,0]=3 7389 B13R1.446 Cc1cc(C(=O)OCC)c(Cl)[n]c1 Amb21857313 [0,2,0,0,0,0|1,0,0]=3 7390 B13R1.446 Cc1cc(C(=O)OCC)c(F)[n]c1 Amb24573716 [0,2,0,0,0,0|1,0,0]=3 7391 B13R1.446 Cc1cc(C(=O)\C=C\C)c(Cl)cc1 Amb24733148 [0,2,0,0,0,0|1,0,1]=4 7392 B13R1.446 Cc1cc(C(=O)\C=C\C)c(F)cc1 Amb24667275 [0,2,0,0,0,0|1,0,1]=4 7393 B13R1.446 Cc1cc(c(Br)c[n]1)C(=O)OCC Amb25269790 [0,2,0,0,0,0|1,0,0]=3 7394 B13R1.446 Cc1cc(c(Cl)[n][n]1)C(=O)OCC Amb22498724 [0,2,0,0,0,0|2,0,0]=4 7395 B13R1.446 Cc1cc(c(N)[n]c1)C(=O)CCC Amb25160644 [0,2,0,0,0,0|2,0,0]=4 7396 B13R1.446 Cc1cc(c(N)[n]c1)C(=O)OCC Amb18128672 [0,2,0,0,0,0|1,0,0]=3 7397 B13R1.446 Cc1cc(c(N)cc1)C(=O)CCBr Amb24638070 [0,2,0,0,0,0|2,0,0]=4 7398 B13R1.446 Cc1cc(c(O)[n]c1)C(=O)OCC Amb18128820 [0,2,0,0,0,0|1,0,0]=3 7399 B13R1.446 Cc1cc(c(O)cc1)C(=O)CCCl Amb18054568 [0,2,0,0,0,0|2,0,0]=4 7400 B13R1.446 Cc1cc(c(O)cc1)C(=O)\C=C\C Amb18127686 [0,2,0,0,0,0|1,0,1]=4 7401 B13R1.446 Cc1ccc(Br)c(c1)C(=O)CCBr Amb24375698 [0,2,0,0,0,0|2,0,0]=4 7402 B13R1.446 Cc1ccc(Br)c(c1)C(=O)CCC Amb25711057 [0,2,0,0,0,0|1,0,0]=3 7403 B13R1.446 Cc1ccc(Br)c(c1)C(=O)NOC Amb25331161 [0,2,0,0,0,0|2,0,0]=4 7404 B13R1.446 Cc1ccc(Br)cc1C(=N)NCC Amb24705816 [0,2,0,0,0,0|2,0,0]=4 7405 B13R1.446 Cc1ccc(Br)cc1C(=N)OCC Amb25670873 [0,2,0,0,0,0|1,0,0]=3 7406 B13R1.446 Cc1ccc(Br)cc1C(=O)CCBr Amb24344101 [0,2,0,0,0,0|2,0,0]=4 7407 B13R1.446 Cc1ccc(Br)cc1C(=O)CCCl Amb25135181 [0,2,0,0,0,0|2,0,0]=4 7408 B13R1.446 Cc1ccc(Br)cc1C(=O)CCN Amb24555459 [0,2,0,0,0,0|2,0,0]=4 7409 B13R1.446 Cc1ccc(Br)cc1C(=O)COC Amb25117633 [0,2,0,0,0,0|2,0,0]=4 7410 B13R1.446 Cc1ccc(Br)cc1C(=O)NOC Amb24552790 [0,2,0,0,0,0|2,0,0]=4 7411 B13R1.446 Cc1ccc(C)c([n]1)C(=O)NCC Amb25190209 [0,2,0,0,0,0|2,0,0]=4 7412 B13R1.446 Cc1ccc(Cl)[n]c1C(=O)OCC Amb22235474 [0,2,0,0,0,0|1,0,0]=3 7413 B13R1.446 Cc1ccc(Cl)c(c1)C(=O)CSC Amb24339232 [0,2,0,0,0,0|2,0,0]=4 7414 B13R1.446 Cc1ccc(Cl)c(c1)C(=O)OCC Amb22750100 [0,2,0,0,0,0|0,0,0]=2 7415 B13R1.446 Cc1ccc(Cl)cc1C(=O)CCCl Amb25689613 [0,2,0,0,0,0|2,0,0]=4 7416 B13R1.446 Cc1ccc(Cl)cc1C(=O)CCN Amb18121503 [0,2,0,0,0,0|2,0,0]=4 7417 B13R1.446 Cc1ccc(Cl)cc1C(=O)CNC Amb18864129 [0,2,0,0,0,0|2,0,0]=4 7418 B13R1.446 Cc1ccc(Cl)cc1C(=O)COC Amb25817509 [0,2,0,0,0,0|2,0,0]=4 7419 B13R1.446 Cc1ccc(Cl)cc1C(=O)OCC Amb22750098 [0,2,0,0,0,0|0,0,0]=2 7420 B13R1.446 Cc1ccc(Cl)cc1C(=O)\C=C\C Amb25756635 [0,2,0,0,0,0|1,0,1]=4 7421 B13R1.446 Cc1ccc(F)c([n]1)C(=O)OCC Amb24638346 [0,2,0,0,0,0|1,0,0]=3 7422 B13R1.446 Cc1ccc(F)c(c1)C(=O)CCC Amb18805024 [0,2,0,0,0,0|1,0,0]=3 7423 B13R1.446 Cc1ccc(F)c(c1)C(=O)COC Amb18185425 [0,2,0,0,0,0|2,0,0]=4 7424 B13R1.446 Cc1ccc(F)c(c1)C(=O)CSC Amb18325536 [0,2,0,0,0,0|2,0,0]=4 7425 B13R1.446 Cc1ccc(F)c(c1)C(=O)NCC Amb18186809 [0,2,0,0,0,0|1,0,0]=3 7426 B13R1.446 Cc1ccc(F)c(c1)C(=O)OCC Amb18187070 [0,2,0,0,0,0|0,0,0]=2 7427 B13R1.446 Cc1ccc(F)cc1C(=N)OCC Amb18185004 [0,2,0,0,0,0|1,0,0]=3 7428 B13R1.446 Cc1ccc(F)cc1C(=O)CCBr Amb24426858 [0,2,0,0,0,0|2,0,0]=4 7429 B13R1.446 Cc1ccc(F)cc1C(=O)CCC Amb18184736 [0,2,0,0,0,0|1,0,0]=3 7430 B13R1.446 Cc1ccc(F)cc1C(=O)CNC Amb25820145 [0,2,0,0,0,0|2,0,0]=4 7431 B13R1.446 Cc1ccc(F)cc1C(=O)COC Amb18185423 [0,2,0,0,0,0|2,0,0]=4 7432 B13R1.446 Cc1ccc(F)cc1C(=O)CSC Amb18325533 [0,2,0,0,0,0|2,0,0]=4 7433 B13R1.446 Cc1ccc(F)cc1C(=O)NCC Amb25257327 [0,2,0,0,0,0|1,0,0]=3 7434 B13R1.446 Cc1ccc(F)cc1C(=O)NOC Amb24456019 [0,2,0,0,0,0|2,0,0]=4 7435 B13R1.446 Cc1ccc(F)cc1C(=O)OCC Amb18805490 [0,2,0,0,0,0|0,0,0]=2 7436 B13R1.446 Cc1ccc(F)cc1C(=O)\C=C\C Amb24617504 [0,2,0,0,0,0|1,0,1]=4 7437 B13R1.446 Cc1ccc(I)c(c1)C(=O)NOC Amb19460443 [0,2,0,0,0,0|2,0,0]=4 7438 B13R1.446 Cc1ccc(I)cc1C(=O)CCBr Amb25732923 [0,2,0,0,0,0|2,0,0]=4 7439 B13R1.446 Cc1ccc(I)cc1C(=O)CCCl Amb25180618 [0,2,0,0,0,0|2,0,0]=4 7440 B13R1.446 Cc1ccc(N)[n]c1C(=O)OCC Amb25742519 [0,2,0,0,0,0|1,0,0]=3 7441 B13R1.446 Cc1ccc(N)c([n]1)C(=O)OCC Amb23440297 [0,2,0,0,0,0|1,0,0]=3 7442 B13R1.446 Cc1ccc(N)c(c1)C(=O)CCC Amb24382101 [0,2,0,0,0,0|1,0,0]=3 7443 B13R1.446 Cc1ccc(N)c(c1)C(=O)COC Amb24670948 [0,2,0,0,0,0|2,0,0]=4 7444 B13R1.446 Cc1ccc(N)c(c1)C(=O)NCC Amb18286226 [0,2,0,0,0,0|1,0,0]=3 7445 B13R1.446 Cc1ccc(N)cc1C(=O)CCBr Amb24637195 [0,2,0,0,0,0|2,0,0]=4 7446 B13R1.446 Cc1ccc(N)cc1C(=O)CCC Amb25303615 [0,2,0,0,0,0|1,0,0]=3 7447 B13R1.446 Cc1ccc(N)cc1C(=O)NCC Amb18952834 [0,2,0,0,0,0|1,0,0]=3 7448 B13R1.446 Cc1ccc(N)cc1C(=O)OCC Amb18291232 [0,2,0,0,0,0|0,0,0]=2 7449 B13R1.446 Cc1ccc(O)c(c1)C(=O)C#CC Amb25833588 [0,2,0,0,0,0|1,0,1]=4 7450 B13R1.446 Cc1ccc(O)cc1C(=O)CCBr Amb25248658 [0,2,0,0,0,0|2,0,0]=4 7451 B13R1.446 Cc1ccc(O)cc1C(=O)NOC Amb25702294 [0,2,0,0,0,0|2,0,0]=4 7452 B13R1.446 Cc1ccc(S)cc1C(=O)CCBr Amb25278637 [0,2,0,0,0,0|2,0,0]=4 7453 B13R1.446 Cc1ccc(S)cc1C(=O)OCC Amb25724739 [0,2,0,0,0,0|0,0,0]=2 7454 B13R1.446 Cc1ccc(cc1C(=O)CCC)Cl Amb17337141 [0,2,0,0,0,0|1,0,0]=3 7455 B13R1.446 Cc1ccc(cc1C(=O)CCCl)C Amb17139623 [0,2,0,0,0,0|2,0,0]=4 7456 B13R1.446 Cc1ccc(cc1C(=O)CCN)C Amb17194510 [0,2,0,0,0,0|2,0,0]=4 7457 B13R1.446 Cc1ccc(cc1C(=O)CCS)C Amb17401972 [0,2,0,0,0,0|2,0,0]=4 7458 B13R1.446 Cc1ccc(cc1C(=O)OCC)Br Amb16232898 [0,2,0,0,0,0|0,0,0]=2 7459 B13R1.446 Cc1ccc(cc1C(=O)OCC)I Amb16232911 [0,2,0,0,0,0|0,0,0]=2 7460 B13R1.446 ClCCC(=O)c1cc(Br)ccc1Br Amb17198917 [0,2,0,0,0,0|2,0,0]=4 7461 B13R1.446 ClCCC(=O)c1cc(Cl)ccc1Cl Amb17198785 [0,2,0,0,0,0|2,0,0]=4 7462 B13R1.446 Fc1ccc(cc1C(=O)CCBr)F Amb17437922 [0,2,0,0,0,0|2,0,0]=4 7463 B13R1.446 Fc1ccc(cc1C(=O)CCCl)Br Amb17198940 [0,2,0,0,0,0|2,0,0]=4 7464 B13R1.446 Fc1ccc(cc1C(=O)CCCl)F Amb17194891 [0,2,0,0,0,0|2,0,0]=4 7465 B13R1.446 NCCC(=O)c1cc(Br)ccc1F Amb25791337 [0,2,0,0,0,0|2,0,0]=4 7466 B13R1.446 NCCC(=O)c1cc(Cl)ccc1Cl Amb24673767 [0,2,0,0,0,0|2,0,0]=4 7467 B13R1.446 NCCC(=O)c1cc(Cl)ccc1F Amb18244118 [0,2,0,0,0,0|2,0,0]=4 7468 B13R1.446 NCCC(=O)c1cc(Cl)ccc1O Amb18641512 [0,2,0,0,0,0|2,0,0]=4 7469 B13R1.446 NCCC(=O)c1cc(F)ccc1F Amb17194572 [0,2,0,0,0,0|2,0,0]=4 7470 B13R1.446 NCCC(=O)c1cc(F)ccc1O Amb25276121 [0,2,0,0,0,0|2,0,0]=4 7471 B13R1.446 Nc1cc(C(=O)CCBr)c(F)cc1 Amb24616046 [0,2,0,0,0,0|2,0,0]=4 7472 B13R1.446 Nc1cc(C(=O)CCBr)c(N)cc1 Amb25195432 [0,2,0,0,0,0|2,0,0]=4 7473 B13R1.446 Nc1cc(C(=O)CCCl)c(F)cc1 Amb24578914 [0,2,0,0,0,0|2,0,0]=4 7474 B13R1.446 Nc1cc(C(=O)CCCl)c(I)cc1 Amb25248648 [0,2,0,0,0,0|2,0,0]=4 7475 B13R1.446 Nc1cc(c(O)cc1)C(=O)CCCl Amb24541010 [0,2,0,0,0,0|2,0,0]=4 7476 B13R1.446 Nc1ccc(Cl)cc1C(=O)CCBr Amb24697079 [0,2,0,0,0,0|2,0,0]=4 7477 B13R1.446 Nc1ccc(F)cc1C(=O)CCBr Amb25208782 [0,2,0,0,0,0|2,0,0]=4 7478 B13R1.446 Nc1ccc(O)cc1C(=O)CCBr Amb24536888 [0,2,0,0,0,0|2,0,0]=4 7479 B13R1.446 Nc1ccc(S)cc1C(=O)CCCl Amb25241723 [0,2,0,0,0,0|2,0,0]=4 7480 B13R1.446 O=C(CCBr)c1cc(Br)ccc1F Amb25366050 [0,2,0,0,0,0|2,0,0]=4 7481 B13R1.446 O=C(CCBr)c1cc(Cl)ccc1Cl Amb24727284 [0,2,0,0,0,0|2,0,0]=4 7482 B13R1.446 O=C(CCBr)c1cc(Cl)ccc1F Amb24724108 [0,2,0,0,0,0|2,0,0]=4 7483 B13R1.446 O=C(CCBr)c1cc(Cl)ccc1S Amb25239073 [0,2,0,0,0,0|2,0,0]=4 7484 B13R1.446 O=C(CCBr)c1cc(F)ccc1Br Amb25326271 [0,2,0,0,0,0|2,0,0]=4 7485 B13R1.446 O=C(CCBr)c1cc(F)ccc1I Amb24544662 [0,2,0,0,0,0|2,0,0]=4 7486 B13R1.446 O=C(CCBr)c1cc(S)ccc1Br Amb25270365 [0,2,0,0,0,0|2,0,0]=4 7487 B13R1.446 O=C(CCCl)c1cc(Br)ccc1Cl Amb24343903 [0,2,0,0,0,0|2,0,0]=4 7488 B13R1.446 O=C(CCCl)c1cc(F)ccc1Cl Amb25784770 [0,2,0,0,0,0|2,0,0]=4 7489 B13R1.446 O=C(CCCl)c1cc(S)ccc1Br Amb24541176 [0,2,0,0,0,0|2,0,0]=4 7490 B13R1.446 O=C(CCCl)c1cc(S)ccc1S Amb24656749 [0,2,0,0,0,0|2,0,0]=4 7491 B13R1.446 OCCC(=O)c1cc(F)ccc1F Amb18564362 [0,2,0,0,0,0|2,0,0]=4 7492 B13R1.446 Oc1cc(C(=O)CCBr)c(Cl)cc1 Amb24695420 [0,2,0,0,0,0|2,0,0]=4 7493 B13R1.446 Oc1cc(C(=O)CCBr)c(F)cc1 Amb25751950 [0,2,0,0,0,0|2,0,0]=4 7494 B13R1.446 Oc1cc(C(=O)CCCl)c(Br)cc1 Amb24638373 [0,2,0,0,0,0|2,0,0]=4 7495 B13R1.446 Oc1cc(C(=O)CCCl)c(F)cc1 Amb25155063 [0,2,0,0,0,0|2,0,0]=4 7496 B13R1.446 Oc1ccc(Br)cc1C(=O)CCCl Amb24579298 [0,2,0,0,0,0|2,0,0]=4 7497 B13R1.446 Oc1ccc(Cl)c(c1)C(=O)CCCl Amb25155407 [0,2,0,0,0,0|2,0,0]=4 7498 B13R1.446 Oc1ccc(F)cc1C(=O)CCCl Amb18556461 [0,2,0,0,0,0|2,0,0]=4 7499 B13R1.446 Oc1ccc(I)cc1C(=O)CCBr Amb25791094 [0,2,0,0,0,0|2,0,0]=4 7500 B13R1.446 Oc1ccc(I)cc1C(=O)CCCl Amb24605626 [0,2,0,0,0,0|2,0,0]=4 7501 B13R1.450 CC=1NC(=O)C=C(N1)C(=O)OCC Amb22751687 [0,2,0,0,0,0|2,0,0]=4 7502 B13R1.450 CCCC(=O)c1cc(Br)cc(N)c1 Amb25062800 [0,2,0,0,0,0|1,0,0]=3 7503 B13R1.450 CCCC(=O)c1cc(C)cc(c1)C Amb17233218 [0,2,0,0,0,0|1,0,0]=3 7504 B13R1.450 CCCC(=O)c1cc(Cl)cc(F)c1 Amb24709112 [0,2,0,0,0,0|1,0,0]=3 7505 B13R1.450 CCCC(=O)c1cc(Cl)cc(N)c1 Amb25698026 [0,2,0,0,0,0|1,0,0]=3 7506 B13R1.450 CCCC(=O)c1cc(Cl)cc(c1)Cl Amb17340708 [0,2,0,0,0,0|1,0,0]=3 7507 B13R1.450 CCCC(=O)c1cc(F)cc(c1)F Amb17234061 [0,2,0,0,0,0|1,0,0]=3 7508 B13R1.450 CCCC(=O)c1cc(O)cc(O)c1 Amb24726186 [0,2,0,0,0,0|1,0,0]=3 7509 B13R1.450 CCCS(=O)c1cc(F)cc(N)c1 Amb25678082 [0,2,0,0,0,0|2,0,0]=4 7510 B13R1.450 CCNC(=N)c1cc(Cl)cc(Cl)c1 Amb25312719 [0,2,0,0,0,0|2,0,0]=4 7511 B13R1.450 CCNC(=N)c1cc(F)cc(F)c1 Amb25794988 [0,2,0,0,0,0|2,0,0]=4 7512 B13R1.450 CCNC(=O)C=1C=C(Cl)NC(=O)C1 Amb25741077 [0,2,0,0,0,0|2,0,0]=4 7513 B13R1.450 CCNC(=O)c1cc(Br)cc(I)c1 Amb25668988 [0,2,0,0,0,0|1,0,0]=3 7514 B13R1.450 CCNC(=O)c1cc(Cl)cc(Cl)[n]1 Amb25271798 [0,2,0,0,0,0|2,0,0]=4 7515 B13R1.450 CCNC(=O)c1cc(F)cc(Br)c1 Amb25114505 [0,2,0,0,0,0|1,0,0]=3 7516 B13R1.450 CCNC(=O)c1cc(F)cc(Cl)c1 Amb24380388 [0,2,0,0,0,0|1,0,0]=3 7517 B13R1.450 CCNC(=O)c1cc(N)[n]c(Cl)c1 Amb18959191 [0,2,0,0,0,0|2,0,0]=4 7518 B13R1.450 CCNC(=O)c1cc(N)cc(F)c1 Amb25101450 [0,2,0,0,0,0|1,0,0]=3 7519 B13R1.450 CCNC(=O)c1cc(N)cc(N)c1 Amb18281738 [0,2,0,0,0,0|1,0,0]=3 7520 B13R1.450 CCNC(=O)c1cc(O)cc(O)c1 Amb25190621 [0,2,0,0,0,0|1,0,0]=3 7521 B13R1.450 CCOC(=N)c1cc(C)[n]c(C)c1 Amb25291264 [0,2,0,0,0,0|2,0,0]=4 7522 B13R1.450 CCOC(=N)c1cc(C)cc(C)c1 Amb18804646 [0,2,0,0,0,0|1,0,0]=3 7523 B13R1.450 CCOC(=N)c1cc(F)cc(F)c1 Amb19069198 [0,2,0,0,0,0|1,0,0]=3 7524 B13R1.450 CCOC(=N)c1cc(O)cc(Cl)c1 Amb24564354 [0,2,0,0,0,0|1,0,0]=3 7525 B13R1.450 CCOC(=O)C1=CC(=O)N=C(N)S1 Amb24382478 [0,2,0,0,0,0|2,0,0]=4 7526 B13R1.450 CCOC(=O)C1=CC(=O)NC(=O)N1 Amb20000488 [0,2,0,0,0,0|2,0,0]=4 7527 B13R1.450 CCOC(=O)C1=CC(=O)OC(=O)N1 Amb25276250 [0,2,0,0,0,0|2,0,0]=4 7528 B13R1.450 CCOC(=O)C1=CC(=O)[N-]C(=S)[N-]1 Amb22360038 [0,2,0,0,0,0|2,0,0]=4 7529 B13R1.450 CCOC(=O)C1=CC(S)=NC(=O)N1 Amb20031211 [0,2,0,0,0,0|2,0,0]=4 7530 B13R1.450 CCOC(=O)C=1C=C(Cl)NC(=O)C1 Amb24491372 [0,2,0,0,0,0|1,0,0]=3 7531 B13R1.450 CCOC(=O)c1[n]c(C)cc(C)[n]1 Amb25755022 [0,2,0,0,0,0|2,0,0]=4 7532 B13R1.450 CCOC(=O)c1[n]c(Cl)cc(Cl)[n]1 Amb22490975 [0,2,0,0,0,0|2,0,0]=4 7533 B13R1.450 CCOC(=O)c1cc(Br)c[n+]([O-])c1 Amb21961775 [0,2,0,0,0,0|1,0,0]=3 7534 B13R1.450 CCOC(=O)c1cc(Br)cc(Br)[n]1 Amb23400806 [0,2,0,0,0,0|1,0,0]=3 7535 B13R1.450 CCOC(=O)c1cc(Br)cc(Br)c1 Amb19888238 [0,2,0,0,0,0|0,0,0]=2 7536 B13R1.450 CCOC(=O)c1cc(Br)cc(Cl)[n]1 Amb23400684 [0,2,0,0,0,0|1,0,0]=3 7537 B13R1.450 CCOC(=O)c1cc(Br)cc(F)[n]1 Amb25351865 [0,2,0,0,0,0|1,0,0]=3 7538 B13R1.450 CCOC(=O)c1cc(Br)cc(I)c1 Amb22285058 [0,2,0,0,0,0|0,0,0]=2 7539 B13R1.450 CCOC(=O)c1cc(Br)cc(N)[n]1 Amb24653842 [0,2,0,0,0,0|1,0,0]=3 7540 B13R1.450 CCOC(=O)c1cc(C)[n]c(C)c1 Amb22490764 [0,2,0,0,0,0|1,0,0]=3 7541 B13R1.450 CCOC(=O)c1cc(C)nc(c1)O Amb10807883 [0,2,0,0,0,0|1,0,0]=3 7542 B13R1.450 CCOC(=O)c1cc(Cl)[n]c(Cl)[n]1 Amb22170309 [0,2,0,0,0,0|2,0,0]=4 7543 B13R1.450 CCOC(=O)c1cc(Cl)[n]c(N)[n]1 Amb22498858 [0,2,0,0,0,0|2,0,0]=4 7544 B13R1.450 CCOC(=O)c1cc(Cl)cc(Br)[n]1 Amb23400805 [0,2,0,0,0,0|1,0,0]=3 7545 B13R1.450 CCOC(=O)c1cc(Cl)cc(Br)c1 Amb19944219 [0,2,0,0,0,0|0,0,0]=2 7546 B13R1.450 CCOC(=O)c1cc(Cl)cc(Cl)[n]1 Amb19958236 [0,2,0,0,0,0|1,0,0]=3 7547 B13R1.450 CCOC(=O)c1cc(Cl)cc(F)[n]1 Amb24528494 [0,2,0,0,0,0|1,0,0]=3 7548 B13R1.450 CCOC(=O)c1cc(Cl)cc(O)[n]1 Amb25270121 [0,2,0,0,0,0|1,0,0]=3 7549 B13R1.450 CCOC(=O)c1cc(Cl)nc(c1)Cl Amb17621583 [0,2,0,0,0,0|1,0,0]=3 7550 B13R1.450 CCOC(=O)c1cc(F)cc(I)[n]1 Amb25217828 [0,2,0,0,0,0|1,0,0]=3 7551 B13R1.450 CCOC(=O)c1cc(F)cc(I)c1 Amb20670533 [0,2,0,0,0,0|0,0,0]=2 7552 B13R1.450 CCOC(=O)c1cc(F)cc(O)[n]1 Amb25208606 [0,2,0,0,0,0|1,0,0]=3 7553 B13R1.450 CCOC(=O)c1cc(I)[n]c(Cl)[n]1 Amb25755136 [0,2,0,0,0,0|2,0,0]=4 7554 B13R1.450 CCOC(=O)c1cc(I)cc(I)c1 Amb19882293 [0,2,0,0,0,0|0,0,0]=2 7555 B13R1.450 CCOC(=O)c1cc(N)[n]c(Cl)[n]1 Amb23402900 [0,2,0,0,0,0|2,0,0]=4 7556 B13R1.450 CCOC(=O)c1cc(N)[n]c(F)c1 Amb24639561 [0,2,0,0,0,0|1,0,0]=3 7557 B13R1.450 CCOC(=O)c1cc(N)cc(Br)[n]1 Amb24501508 [0,2,0,0,0,0|1,0,0]=3 7558 B13R1.450 CCOC(=O)c1cc(N)cc(Br)c1 Amb19001986 [0,2,0,0,0,0|0,0,0]=2 7559 B13R1.450 CCOC(=O)c1cc(N)cc(Cl)c1 Amb18302896 [0,2,0,0,0,0|0,0,0]=2 7560 B13R1.450 CCOC(=O)c1cc(N)cc(F)[n]1 Amb25212616 [0,2,0,0,0,0|1,0,0]=3 7561 B13R1.450 CCOC(=O)c1cc(O)[nH+]c(O)c1 Amb22466119 [0,2,0,0,0,0|1,0,0]=3 7562 B13R1.450 CCOC(=O)c1cc(O)[n]c(Cl)[n]1 Amb24664146 [0,2,0,0,0,0|2,0,0]=4 7563 B13R1.450 CCOC(=O)c1cc(O)[n]c(O)[n]1 Amb21962478 [0,2,0,0,0,0|2,0,0]=4 7564 B13R1.450 CCOC(=O)c1cc(O)[n]c(O)c1 Amb24534189 [0,2,0,0,0,0|1,0,0]=3 7565 B13R1.450 CCOC(=O)c1cc(O)[n]c(S)[n]1 Amb18130665 [0,2,0,0,0,0|2,0,0]=4 7566 B13R1.450 CCOC(=O)c1cc(O)cc(Br)c1 Amb24587173 [0,2,0,0,0,0|0,0,0]=2 7567 B13R1.450 CCOC(=O)c1cc(O)cc(Cl)[n]1 Amb24528292 [0,2,0,0,0,0|1,0,0]=3 7568 B13R1.450 CCOC(=O)c1cc(O)cc(Cl)c1 Amb24469235 [0,2,0,0,0,0|0,0,0]=2 7569 B13R1.450 CCOC(=O)c1cc(O)cc(F)c1 Amb25352349 [0,2,0,0,0,0|0,0,0]=2 7570 B13R1.450 CCOC(=O)c1cc(S)cc(Br)c1 Amb24740287 [0,2,0,0,0,0|0,0,0]=2 7571 B13R1.450 CCOC(=O)c1cc(S)cc(Cl)c1 Amb25153669 [0,2,0,0,0,0|0,0,0]=2 7572 B13R1.450 CCOC(=O)c1cc(S)cc(I)c1 Amb25201414 [0,2,0,0,0,0|0,0,0]=2 7573 B13R1.450 CN(OCC)c1cc(N)cc(F)c1 Amb24642005 [0,2,0,0,0,0|2,0,0]=4 7574 B13R1.450 CNCC(=O)c1cc(C)cc(C)c1 Amb18862918 [0,2,0,0,0,0|2,0,0]=4 7575 B13R1.450 CNCC(=O)c1cc(Cl)cc(Br)c1 Amb24456871 [0,2,0,0,0,0|2,0,0]=4 7576 B13R1.450 CNCC(=O)c1cc(Cl)cc(Cl)c1 Amb18225701 [0,2,0,0,0,0|2,0,0]=4 7577 B13R1.450 CNCC(=O)c1cc(F)cc(Br)c1 Amb24472526 [0,2,0,0,0,0|2,0,0]=4 7578 B13R1.450 CNCC(=O)c1cc(F)cc(F)c1 Amb25698006 [0,2,0,0,0,0|2,0,0]=4 7579 B13R1.450 CNCC(=O)c1cc(O)cc(Cl)c1 Amb25180539 [0,2,0,0,0,0|2,0,0]=4 7580 B13R1.450 CNCC(=O)c1cc(O)cc(F)c1 Amb25094521 [0,2,0,0,0,0|2,0,0]=4 7581 B13R1.450 COCC(=O)c1cc(C)cc(C)c1 Amb18180779 [0,2,0,0,0,0|2,0,0]=4 7582 B13R1.450 COCC(=O)c1cc(Cl)cc(Br)c1 Amb25180104 [0,2,0,0,0,0|2,0,0]=4 7583 B13R1.450 COCC(=O)c1cc(F)cc(Br)c1 Amb25297489 [0,2,0,0,0,0|2,0,0]=4 7584 B13R1.450 COCC(=O)c1cc(F)cc(F)c1 Amb19069963 [0,2,0,0,0,0|2,0,0]=4 7585 B13R1.450 COCC(=O)c1cc(N)cc(Br)c1 Amb25155990 [0,2,0,0,0,0|2,0,0]=4 7586 B13R1.450 COCC(=O)c1cc(N)cc(Cl)c1 Amb24359725 [0,2,0,0,0,0|2,0,0]=4 7587 B13R1.450 CONC(=O)c1cc(Br)cc(Br)c1 Amb25180311 [0,2,0,0,0,0|2,0,0]=4 7588 B13R1.450 CONC(=O)c1cc(Br)cc(I)c1 Amb25079028 [0,2,0,0,0,0|2,0,0]=4 7589 B13R1.450 CONC(=O)c1cc(C)cc(C)c1 Amb25114485 [0,2,0,0,0,0|2,0,0]=4 7590 B13R1.450 CONC(=O)c1cc(Cl)cc(c1)Br Amb16989016 [0,2,0,0,0,0|2,0,0]=4 7591 B13R1.450 CONC(=O)c1cc(Cl)cc(c1)Cl Amb13980624 [0,2,0,0,0,0|2,0,0]=4 7592 B13R1.450 CONC(=O)c1cc(F)cc(Cl)c1 Amb25057298 [0,2,0,0,0,0|2,0,0]=4 7593 B13R1.450 CONC(=O)c1cc(F)cc(c1)Br Amb16989018 [0,2,0,0,0,0|2,0,0]=4 7594 B13R1.450 CONC(=O)c1cc(F)cc(c1)F Amb10704854 [0,2,0,0,0,0|2,0,0]=4 7595 B13R1.450 CONC(=O)c1cc(N)cc(I)c1 Amb25670665 [0,2,0,0,0,0|2,0,0]=4 7596 B13R1.450 CONC(=O)c1cc(O)cc(O)c1 Amb25687286 [0,2,0,0,0,0|2,0,0]=4 7597 B13R1.450 CSCC(=O)c1cc(Br)cc(Br)c1 Amb25328351 [0,2,0,0,0,0|2,0,0]=4 7598 B13R1.450 CSCC(=O)c1cc(C)cc(C)c1 Amb18324784 [0,2,0,0,0,0|2,0,0]=4 7599 B13R1.450 CSCC(=O)c1cc(Cl)cc(Br)c1 Amb25679865 [0,2,0,0,0,0|2,0,0]=4 7600 B13R1.450 CSCC(=O)c1cc(F)cc(Br)c1 Amb25698791 [0,2,0,0,0,0|2,0,0]=4 7601 B13R1.450 C\C=C\C(=O)c1cc(C)cc(C)c1 Amb25314263 [0,2,0,0,0,0|1,0,1]=4 7602 B13R1.450 C\C=C\C(=O)c1cc(F)cc(Cl)c1 Amb24529390 [0,2,0,0,0,0|1,0,1]=4 7603 B13R1.450 C\C=C\C(=O)c1cc(F)cc(F)c1 Amb24459713 [0,2,0,0,0,0|1,0,1]=4 7604 B13R1.450 Cc1[n]c(cc(Cl)[n]1)C(=O)OCC Amb22263784 [0,2,0,0,0,0|2,0,0]=4 7605 B13R1.450 Cc1[n]c(cc(O)[n]1)C(=O)OCC Amb20246747 [0,2,0,0,0,0|2,0,0]=4 7606 B13R1.450 Cc1cc(Br)cc([n]1)C(=O)OCC Amb24065881 [0,2,0,0,0,0|1,0,0]=3 7607 B13R1.450 Cc1cc(Br)cc(c1)C(=O)CCCl Amb24566579 [0,2,0,0,0,0|2,0,0]=4 7608 B13R1.450 Cc1cc(Br)cc(c1)C(=O)COC Amb24394841 [0,2,0,0,0,0|2,0,0]=4 7609 B13R1.450 Cc1cc(Br)cc(c1)C(=O)CSC Amb25041619 [0,2,0,0,0,0|2,0,0]=4 7610 B13R1.450 Cc1cc(Br)cc(c1)C(=O)OCC Amb22498272 [0,2,0,0,0,0|0,0,0]=2 7611 B13R1.450 Cc1cc(Cl)cc([n]1)C(=O)OCC Amb21926544 [0,2,0,0,0,0|1,0,0]=3 7612 B13R1.450 Cc1cc(Cl)cc(c1)C(=N)OCC Amb24726760 [0,2,0,0,0,0|1,0,0]=3 7613 B13R1.450 Cc1cc(Cl)cc(c1)C(=O)CCCl Amb25844087 [0,2,0,0,0,0|2,0,0]=4 7614 B13R1.450 Cc1cc(Cl)cc(c1)C(=O)COC Amb25077163 [0,2,0,0,0,0|2,0,0]=4 7615 B13R1.450 Cc1cc(Cl)cc(c1)C(=O)OCC Amb24761389 [0,2,0,0,0,0|0,0,0]=2 7616 B13R1.450 Cc1cc(F)cc([n]1)C(=O)OCC Amb24665997 [0,2,0,0,0,0|1,0,0]=3 7617 B13R1.450 Cc1cc(F)cc(c1)C(=N)OCC Amb24413374 [0,2,0,0,0,0|1,0,0]=3 7618 B13R1.450 Cc1cc(F)cc(c1)C(=O)CNC Amb25155763 [0,2,0,0,0,0|2,0,0]=4 7619 B13R1.450 Cc1cc(F)cc(c1)C(=O)NOC Amb25766275 [0,2,0,0,0,0|2,0,0]=4 7620 B13R1.450 Cc1cc(N)cc([n]1)C(=O)OCC Amb24398895 [0,2,0,0,0,0|1,0,0]=3 7621 B13R1.450 Cc1cc(N)cc(c1)C(=O)NCC Amb25153865 [0,2,0,0,0,0|1,0,0]=3 7622 B13R1.450 Cc1cc(N)cc(c1)C(=O)OCC Amb19002000 [0,2,0,0,0,0|0,0,0]=2 7623 B13R1.450 Cc1cc(N)cc(c1)N(C)OCC Amb24744640 [0,2,0,0,0,0|2,0,0]=4 7624 B13R1.450 Cc1cc(O)cc(c1)C(=O)CNC Amb24379656 [0,2,0,0,0,0|2,0,0]=4 7625 B13R1.450 Cc1cc(O)cc(c1)C(=O)NOC Amb25344592 [0,2,0,0,0,0|2,0,0]=4 7626 B13R1.450 Cc1cc(O)cc(c1)C(=O)OCC Amb23452662 [0,2,0,0,0,0|0,0,0]=2 7627 B13R1.450 Cc1cc(S)cc(c1)C(=O)OCC Amb24442721 [0,2,0,0,0,0|0,0,0]=2 7628 B13R1.450 Cc1cc([n]c(C)c1)C(=O)NCC Amb25858268 [0,2,0,0,0,0|2,0,0]=4 7629 B13R1.450 Cc1cc([n]c(Cl)c1)C(=O)OCC Amb19515772 [0,2,0,0,0,0|1,0,0]=3 7630 B13R1.450 Cc1cc([n]c(N)[n]1)C(=O)OCC Amb19844277 [0,2,0,0,0,0|2,0,0]=4 7631 B13R1.450 Cc1cc([n]c(N)c1)C(=O)OCC Amb25350847 [0,2,0,0,0,0|1,0,0]=3 7632 B13R1.450 Cc1cc([n]c(S)[n]1)C(=O)OCC Amb25110216 [0,2,0,0,0,0|2,0,0]=4 7633 B13R1.450 Cc1cc(cc(Cl)[n]1)C(=O)NCC Amb25820691 [0,2,0,0,0,0|2,0,0]=4 7634 B13R1.450 Cc1cc(cc(Cl)c1)C(=O)CCBr Amb25826636 [0,2,0,0,0,0|2,0,0]=4 7635 B13R1.450 Cc1cc(cc(F)c1)C(=O)CCCl Amb25155376 [0,2,0,0,0,0|2,0,0]=4 7636 B13R1.450 Cc1cc(cc(O)[n]1)C(=O)NCC Amb24748082 [0,2,0,0,0,0|2,0,0]=4 7637 B13R1.450 Cc1cc(cc(S)c1)C(=O)CCCl Amb25278638 [0,2,0,0,0,0|2,0,0]=4 7638 B13R1.450 Nc1cc(I)cc(c1)C(=O)CCCl Amb25247575 [0,2,0,0,0,0|2,0,0]=4 7639 B13R1.450 Nc1cc(cc(Cl)c1)C(=O)CCBr Amb24549293 [0,2,0,0,0,0|2,0,0]=4 7640 B13R1.450 Nc1cc(cc(S)c1)C(=O)CCBr Amb25350628 [0,2,0,0,0,0|2,0,0]=4 7641 B13R1.450 Nc1cc(cc(S)c1)C(=O)CCCl Amb24558462 [0,2,0,0,0,0|2,0,0]=4 7642 B13R1.450 O=C(CCBr)c1cc(Cl)cc(Cl)c1 Amb24383012 [0,2,0,0,0,0|2,0,0]=4 7643 B13R1.450 O=C(CCBr)c1cc(F)cc(Cl)c1 Amb24756491 [0,2,0,0,0,0|2,0,0]=4 7644 B13R1.450 O=C(CCBr)c1cc(F)cc(S)c1 Amb25247661 [0,2,0,0,0,0|2,0,0]=4 7645 B13R1.450 O=C(CCBr)c1cc(I)cc(I)c1 Amb25224014 [0,2,0,0,0,0|2,0,0]=4 7646 B13R1.450 O=C(CCBr)c1cc(I)cc(S)c1 Amb24664646 [0,2,0,0,0,0|2,0,0]=4 7647 B13R1.450 O=C(CCCl)c1cc(Br)cc(F)c1 Amb25248655 [0,2,0,0,0,0|2,0,0]=4 7648 B13R1.450 O=C(CCCl)c1cc(Cl)cc(Cl)c1 Amb24440439 [0,2,0,0,0,0|2,0,0]=4 7649 B13R1.450 O=C(CCCl)c1cc(Cl)cc(S)c1 Amb24656743 [0,2,0,0,0,0|2,0,0]=4 7650 B13R1.450 O=C(CCCl)c1cc(I)cc(F)c1 Amb25729942 [0,2,0,0,0,0|2,0,0]=4 7651 B13R1.450 O=C(CCCl)c1cc(S)cc(S)c1 Amb25253594 [0,2,0,0,0,0|2,0,0]=4 7652 B13R1.450 Oc1cc(cc(Cl)c1)C(=O)CCBr Amb24375715 [0,2,0,0,0,0|2,0,0]=4 7653 B13R1.450 Oc1cc(cc(O)c1)C(=O)CCBr Amb24566668 [0,2,0,0,0,0|2,0,0]=4 7654 B13R1.460 BrCCC(=O)c1cccc(c1)OC Amb17437882 [0,2,0,0,0,0|2,0,0]=4 7655 B13R1.460 CCCC(=O)c1cc(ccc1)C#N Amb24378967 [0,2,0,0,0,0|1,0,0]=3 7656 B13R1.460 CCCC(=O)c1cccc(c1)OC Amb17198739 [0,2,0,0,0,0|1,0,0]=3 7657 B13R1.460 CCNC(=O)c1c[n]cc(C=C)c1 Amb24490545 [0,2,0,0,0,0|2,0,0]=4 7658 B13R1.460 CCNC(=O)c1c[n]cc(c1)C#C Amb24360604 [0,2,0,0,0,0|2,0,0]=4 7659 B13R1.460 CCNC(=O)c1c[n]cc(c1)OC Amb20369553 [0,2,0,0,0,0|2,0,0]=4 7660 B13R1.460 CCNC(=O)c1cc(CO)cc[n]1 Amb25192252 [0,2,0,0,0,0|2,0,0]=4 7661 B13R1.460 CCNC(=O)c1cc(CO)ccc1 Amb24066804 [0,2,0,0,0,0|1,0,0]=3 7662 B13R1.460 CCNC(=O)c1cc(cc[n]1)C#N Amb25802686 [0,2,0,0,0,0|2,0,0]=4 7663 B13R1.460 CCNC(=O)c1cc(ccc1)C=O Amb24066803 [0,2,0,0,0,0|1,0,0]=3 7664 B13R1.460 CCNC(=O)c1cc[n]c(c1)NN Amb18186577 [0,2,0,0,0,0|2,0,0]=4 7665 B13R1.460 CCNC(=O)c1cccc(C#N)[n]1 Amb24430724 [0,2,0,0,0,0|2,0,0]=4 7666 B13R1.460 CCNC(=O)c1cccc(NN)[n]1 Amb18186578 [0,2,0,0,0,0|2,0,0]=4 7667 B13R1.460 CCNC(=O)c1cccc([n]1)OC Amb24404471 [0,2,0,0,0,0|2,0,0]=4 7668 B13R1.460 CCNC(=O)c1cccc(c1)CBr Amb17328942 [0,2,0,0,0,0|1,0,0]=3 7669 B13R1.460 CCNC(=O)c1cccc(c1)CN Amb10203503 [0,2,0,0,0,0|1,0,0]=3 7670 B13R1.460 CCNC(=O)c1cccc(c1)CN Amb1120583 [0,2,0,0,0,0|1,0,0]=3 7671 B13R1.460 CCOC(=O)N1C=CCC(=C1)C#N Amb18128138 [0,2,0,0,0,0|1,0,1]=4 7672 B13R1.460 CCOC(=O)N1CC(=CC=C1)C#N Amb18128137 [0,2,0,0,0,0|1,0,1]=4 7673 B13R1.460 CCOC(=O)N1CC=CC(=C1)C#N Amb18128139 [0,2,0,0,0,0|1,0,1]=4 7674 B13R1.460 CCOC(=O)c1c[n]cc(CBr)c1 Amb22276055 [0,2,0,0,0,0|1,0,0]=3 7675 B13R1.460 CCOC(=O)c1c[n]cc(CBr)c1 Amb22497680 [0,2,0,0,0,0|1,0,0]=3 7676 B13R1.460 CCOC(=O)c1c[n]cc(CCl)c1 Amb22276054 [0,2,0,0,0,0|1,0,0]=3 7677 B13R1.460 CCOC(=O)c1c[n]cc(CCl)c1 Amb22497679 [0,2,0,0,0,0|1,0,0]=3 7678 B13R1.460 CCOC(=O)c1c[n]cc(CO)c1 Amb22233966 [0,2,0,0,0,0|1,0,0]=3 7679 B13R1.460 CCOC(=O)c1c[n]cc(c1)NC Amb18267344 [0,2,0,0,0,0|1,0,0]=3 7680 B13R1.460 CCOC(=O)c1c[n]cc(c1)NN Amb23559893 [0,2,0,0,0,0|1,0,0]=3 7681 B13R1.460 CCOC(=O)c1c[n]cc(c1)[Zn]Br Amb22898079 [0,2,0,0,0,0|1,0,0]=3 7682 B13R1.460 CCOC(=O)c1cc(C#N)[n]c[n]1 Amb25172451 [0,2,0,0,0,0|2,0,0]=4 7683 B13R1.460 CCOC(=O)c1cc(C#N)[n]cc1 Amb18127622 [0,2,0,0,0,0|1,0,0]=3 7684 B13R1.460 CCOC(=O)c1cc(C=O)[n]cc1 Amb21857369 [0,2,0,0,0,0|1,0,0]=3 7685 B13R1.460 CCOC(=O)c1cc(CBr)cc[n]1 Amb23401269 [0,2,0,0,0,0|1,0,0]=3 7686 B13R1.460 CCOC(=O)c1cc(CBr)ccc1 Amb22002428 [0,2,0,0,0,0|0,0,0]=2 7687 B13R1.460 CCOC(=O)c1cc(CCl)cc[n]1 Amb23401270 [0,2,0,0,0,0|1,0,0]=3 7688 B13R1.460 CCOC(=O)c1cc(CF)[n]cc1 Amb24053069 [0,2,0,0,0,0|1,0,0]=3 7689 B13R1.460 CCOC(=O)c1cc(CN)[n]cc1 Amb22490759 [0,2,0,0,0,0|1,0,0]=3 7690 B13R1.460 CCOC(=O)c1cc(CN)ccc1 Amb22499039 [0,2,0,0,0,0|0,0,0]=2 7691 B13R1.460 CCOC(=O)c1cc(CO)[n]cc1 Amb22490843 [0,2,0,0,0,0|1,0,0]=3 7692 B13R1.460 CCOC(=O)c1cc(CO)cc[n]1 Amb21964018 [0,2,0,0,0,0|1,0,0]=3 7693 B13R1.460 CCOC(=O)c1cc(NN)[n]cc1 Amb22756856 [0,2,0,0,0,0|1,0,0]=3 7694 B13R1.460 CCOC(=O)c1cc(NN)[n]cc1 Amb22757167 [0,2,0,0,0,0|1,0,0]=3 7695 B13R1.460 CCOC(=O)c1cc(NN)[n]cc1 Amb23440316 [0,2,0,0,0,0|1,0,0]=3 7696 B13R1.460 CCOC(=O)c1cc(cc[n]1)C#C Amb25691183 [0,2,0,0,0,0|1,0,0]=3 7697 B13R1.460 CCOC(=O)c1cc(cc[n]1)C=O Amb22500675 [0,2,0,0,0,0|1,0,0]=3 7698 B13R1.460 CCOC(=O)c1cc(ccc1)C#C Amb23412172 [0,2,0,0,0,0|0,0,0]=2 7699 B13R1.460 CCOC(=O)c1cc(ccc1)NC Amb19037540 [0,2,0,0,0,0|0,0,0]=2 7700 B13R1.460 CCOC(=O)c1cc(ccc1)[Zn]I Amb22000407 [0,2,0,0,0,0|0,0,0]=2 7701 B13R1.460 CCOC(=O)c1cc[n]c(CCl)[n]1 Amb22276833 [0,2,0,0,0,0|2,0,0]=4 7702 B13R1.460 CCOC(=O)c1cc[n]c(CO)[n]1 Amb22304275 [0,2,0,0,0,0|2,0,0]=4 7703 B13R1.460 CCOC(=O)c1cccc(C#C)[n]1 Amb21857618 [0,2,0,0,0,0|1,0,0]=3 7704 B13R1.460 CCOC(=O)c1cccc(C#N)[n]1 Amb18127623 [0,2,0,0,0,0|1,0,0]=3 7705 B13R1.460 CCOC(=O)c1cccc(C=O)[n]1 Amb19889851 [0,2,0,0,0,0|1,0,0]=3 7706 B13R1.460 CCOC(=O)c1cccc(CBr)[n]1 Amb22491222 [0,2,0,0,0,0|1,0,0]=3 7707 B13R1.460 CCOC(=O)c1cccc(CC)[n]1 Amb21857616 [0,2,0,0,0,0|1,0,0]=3 7708 B13R1.460 CCOC(=O)c1cccc(CCl)[n]1 Amb21857623 [0,2,0,0,0,0|1,0,0]=3 7709 B13R1.460 CCOC(=O)c1cccc(CN)[n]1 Amb22727978 [0,2,0,0,0,0|1,0,0]=3 7710 B13R1.460 CCOC(=O)c1cccc([n]1)[Zn]Br Amb22898080 [0,2,0,0,0,0|1,0,0]=3 7711 B13R1.460 CCOC(=O)c1cccc(c1)C=C Amb16185424 [0,2,0,0,0,0|0,0,0]=2 7712 B13R1.460 CCOC(=O)c1cccc(c1)C=O Amb10807492 [0,2,0,0,0,0|0,0,0]=2 7713 B13R1.460 CCOC(=O)c1cccc(c1)CCl Amb10071038 [0,2,0,0,0,0|0,0,0]=2 7714 B13R1.460 CCOC(=O)c1cccc(c1)NN Amb10604175 [0,2,0,0,0,0|0,0,0]=2 7715 B13R1.460 CCOC(=O)c1cccc(n1)CCl Amb17205204 [0,2,0,0,0,0|1,0,0]=3 7716 B13R1.460 CCOC(=O)c1cccc(n1)CN Amb16233304 [0,2,0,0,0,0|1,0,0]=3 7717 B13R1.460 CCOC(=O)c1ccnc(c1)CN Amb10808510 [0,2,0,0,0,0|1,0,0]=3 7718 B13R1.460 CCOC(=O)c1ccnc(n1)SC Amb16233315 [0,2,0,0,0,0|2,0,0]=4 7719 B13R1.460 CNCC(=O)c1cccc(c1)OC Amb17233536 [0,2,0,0,0,0|2,0,0]=4 7720 B13R1.460 CNc1cc(cc[n]1)C(=O)NCC Amb18295774 [0,2,0,0,0,0|2,0,0]=4 7721 B13R1.460 CNc1cc(ccc1)C(=O)NCC Amb19002845 [0,2,0,0,0,0|1,0,0]=3 7722 B13R1.460 CNc1cccc([n]1)C(=O)NCC Amb18987766 [0,2,0,0,0,0|2,0,0]=4 7723 B13R1.460 CONC(=O)c1cc(ccc1)C=O Amb24461753 [0,2,0,0,0,0|2,0,0]=4 7724 B13R1.460 CONC(=O)c1cccc(CO)c1 Amb24412557 [0,2,0,0,0,0|2,0,0]=4 7725 B13R1.460 CONC(=O)c1cccc(c1)C#N Amb10704497 [0,2,0,0,0,0|2,0,0]=4 7726 B13R1.460 CONC(=O)c1cccc(c1)OC Amb10704495 [0,2,0,0,0,0|2,0,0]=4 7727 B13R1.460 COc1[n]c(cc[n]1)C(=O)OCC Amb22498603 [0,2,0,0,0,0|2,0,0]=4 7728 B13R1.460 COc1cc(c[n][n]1)C(=O)OCC Amb23400497 [0,2,0,0,0,0|2,0,0]=4 7729 B13R1.460 COc1cc(c[n]c1)C(=O)OCC Amb23401209 [0,2,0,0,0,0|1,0,0]=3 7730 B13R1.460 COc1cc(cc[n]1)C(=O)OCC Amb21962214 [0,2,0,0,0,0|1,0,0]=3 7731 B13R1.460 COc1cc(ccc1)C(=N)OCC Amb20673137 [0,2,0,0,0,0|1,0,0]=3 7732 B13R1.460 COc1cc(ccc1)C(=O)CCN Amb18065831 [0,2,0,0,0,0|2,0,0]=4 7733 B13R1.460 COc1cc(ccc1)C(=O)CCO Amb18065908 [0,2,0,0,0,0|2,0,0]=4 7734 B13R1.460 COc1cc(ccc1)C(=O)NCO Amb25375684 [0,2,0,0,0,0|2,0,0]=4 7735 B13R1.460 CSCC(=O)c1cc(ccc1)C#N Amb24414148 [0,2,0,0,0,0|2,0,0]=4 7736 B13R1.460 C\C=C\C(=O)c1cc(ccc1)C#N Amb24387735 [0,2,0,0,0,0|1,0,1]=4 7737 B13R1.460 C\C=C\C(=O)c1cc(ccc1)OC Amb25077626 [0,2,0,0,0,0|1,0,1]=4 7738 B13R1.460 N#Cc1cc(ccc1)C(=O)CCBr Amb25681385 [0,2,0,0,0,0|2,0,0]=4 7739 B13R1.460 N#Cc1cc(ccc1)C(=O)CCCl Amb24753362 [0,2,0,0,0,0|2,0,0]=4 7740 B13R1.460 SCCC(=O)c1cccc(c1)OC Amb17402131 [0,2,0,0,0,0|2,0,0]=4 7741 B13R1.11 C#C[C@@H](O)CC(=O)c1ccccc1 Amb25144598 [0,2,0,0,0,0|1,0,1]=4 7742 B13R1.11 C=C(CO)NC(=O)c1ccccc1 Amb24072199 [0,2,0,0,0,0|1,0,1]=4 7743 B13R1.11 CC(=C=O)NC(=O)c1ccccc1 Amb24427427 [0,2,0,0,0,0|1,0,1]=4 7744 B13R1.11 CC(C#C)NC(=O)c1cc[n]cc1 Amb25159042 [0,2,0,0,0,0|2,0,0]=4 7745 B13R1.11 CC(C#C)NC(=O)c1cccc[n]1 Amb25115062 [0,2,0,0,0,0|2,0,0]=4 7746 B13R1.11 CC(C#C)NC(=O)c1ccccc1 Amb25785569 [0,2,0,0,0,0|1,0,0]=3 7747 B13R1.11 CC(C#C)OC(=O)c1c[n]c[n]c1 Amb25036137 [0,2,0,0,0,0|2,0,0]=4 7748 B13R1.11 CC(C#C)OC(=O)c1cc[n][n]c1 Amb25741016 [0,2,0,0,0,0|2,0,0]=4 7749 B13R1.11 CC(C#C)OC(=O)c1cc[n]cc1 Amb24703896 [0,2,0,0,0,0|1,0,0]=3 7750 B13R1.11 CC(C#C)OC(=O)c1ccc[n]c1 Amb25078940 [0,2,0,0,0,0|1,0,0]=3 7751 B13R1.11 CC(C#C)OC(=O)c1ccccc1 Amb24719346 [0,2,0,0,0,0|0,0,0]=2 7752 B13R1.11 CC(C#N)NC(=O)c1cc[n]cc1 Amb18180478 [0,2,0,0,0,0|2,0,0]=4 7753 B13R1.11 CC(C#N)NC(=O)c1cccc[n]1 Amb18795579 [0,2,0,0,0,0|2,0,0]=4 7754 B13R1.11 CC(C#N)NS(=O)c1ccccc1 Amb24545550 [0,2,0,0,0,0|2,0,0]=4 7755 B13R1.11 CC(C#N)OC(=O)c1[n]ccc[n]1 Amb25167482 [0,2,0,0,0,0|2,0,0]=4 7756 B13R1.11 CC(C#N)OC(=O)c1c[n]cc[n]1 Amb25769155 [0,2,0,0,0,0|2,0,0]=4 7757 B13R1.11 CC(C#N)OC(=O)c1cccc[n]1 Amb25160805 [0,2,0,0,0,0|1,0,0]=3 7758 B13R1.11 CC(C#N)OC(=O)c1ccccc1 Amb20668158 [0,2,0,0,0,0|0,0,0]=2 7759 B13R1.11 CC(C=C)NC(=O)c1ccccc1 Amb25081064 [0,2,0,0,0,0|1,0,0]=3 7760 B13R1.11 CC(C=C)OC(=O)c1ccccc1 Amb20248367 [0,2,0,0,0,0|0,0,0]=2 7761 B13R1.11 CC(C=O)NC(=O)c1ccccc1 Amb18127903 [0,2,0,0,0,0|1,0,0]=3 7762 B13R1.11 CC(CBr)NC(=O)c1ccccc1 Amb24341257 [0,2,0,0,0,0|1,0,0]=3 7763 B13R1.11 CC(CC(=O)c1ccccc1)C#N Amb17334921 [0,2,0,0,0,0|1,0,0]=3 7764 B13R1.11 CC(CC(=O)c1ccncc1)C#N Amb17133614 [0,2,0,0,0,0|2,0,0]=4 7765 B13R1.11 CC(CCl)NC(=O)c1cc[n]cc1 Amb24751546 [0,2,0,0,0,0|2,0,0]=4 7766 B13R1.11 CC(CCl)\N=C(/Cl)\c1ccccc1 Amb24451984 [0,2,0,0,0,0|2,0,0]=4 7767 B13R1.11 CC(CF)NC(=O)c1ccc[n]c1 Amb25167393 [0,2,0,0,0,0|2,0,0]=4 7768 B13R1.11 CC(CN)NC(=O)c1cc[n]cc1 Amb18909096 [0,2,0,0,0,0|2,0,0]=4 7769 B13R1.11 CC(CN)NC(=O)c1ccc[n]c1 Amb18252469 [0,2,0,0,0,0|2,0,0]=4 7770 B13R1.11 CC(CN)NC(=O)c1cccc[n]1 Amb18909097 [0,2,0,0,0,0|2,0,0]=4 7771 B13R1.11 CC(CN)NC(=O)c1ccccc1 Amb18252418 [0,2,0,0,0,0|1,0,0]=3 7772 B13R1.11 CC(CO)NC(=S)c1ccccc1 Amb24342299 [0,2,0,0,0,0|1,1,0]=4 7773 B13R1.11 CC(CS(=O)c1ccccc1)C#N Amb25684421 [0,2,0,0,0,0|2,0,0]=4 7774 B13R1.11 CC(NC(=O)c1ccccc1)C#N Amb17400426 [0,2,0,0,0,0|1,0,0]=3 7775 B13R1.11 CCC(=O)NC(=N)c1ccccc1 Amb25855572 [0,2,0,0,0,0|2,0,0]=4 7776 B13R1.11 CCC(=O)OC(=O)c1ccccc1 Amb22500123 [0,2,0,0,0,0|0,0,0]=2 7777 B13R1.11 CCC(=S)NC(=O)c1ccccc1 Amb25034339 [0,2,0,0,0,0|1,0,0]=3 7778 B13R1.11 CCC(C)NC(=S)c1ccccc1 Amb24754036 [0,2,0,0,0,0|1,1,0]=4 7779 B13R1.11 CCC(O)NC(=O)c1ccccc1 Amb24096331 [0,2,0,0,0,0|1,0,0]=3 7780 B13R1.11 CCC(O)\C=C(\Cl)/c1ccccc1 Amb24475820 [0,2,0,0,0,0|2,0,0]=4 7781 B13R1.11 CC[C@H](C)NC(=O)c1ccccc1 Amb24461762 [0,2,0,0,0,0|1,0,0]=3 7782 B13R1.11 CN(CC)NC(=O)c1cc[n]cc1 Amb25043507 [0,2,0,0,0,0|2,0,0]=4 7783 B13R1.11 CN(CC)NC(=O)c1cccc[n]1 Amb25130166 [0,2,0,0,0,0|2,0,0]=4 7784 B13R1.11 CN(CC)NC(=O)c1ccccc1 Amb25057531 [0,2,0,0,0,0|1,0,0]=3 7785 B13R1.11 CN(NC(=O)c1ccccc1)N=O Amb24096790 [0,2,0,0,0,0|2,0,0]=4 7786 B13R1.11 CNC(=N)CC(=O)c1ccccc1 Amb25275499 [0,2,0,0,0,0|1,0,1]=4 7787 B13R1.11 CNC(=N)NC(=O)c1ccccc1 Amb25689630 [0,2,0,0,0,0|1,0,1]=4 7788 B13R1.11 CNC(=O)CC(=O)c1ccccc1 Amb24361603 [0,2,0,0,0,0|1,0,1]=4 7789 B13R1.11 CNC(=S)NC(=O)c1ccccc1 Amb1625173 [0,2,0,0,0,0|1,0,1]=4 7790 B13R1.11 COC(=N)CC(=O)c1ccccc1 Amb22433441 [0,2,0,0,0,0|1,0,1]=4 7791 B13R1.11 COC(=N)NC(=O)c1ccccc1 Amb25309498 [0,2,0,0,0,0|1,0,1]=4 7792 B13R1.11 COC(=O)CC(=O)c1ccccc1 Amb10553935 [0,2,0,0,0,0|1,0,1]=4 7793 B13R1.11 COC(=O)NC(=O)c1ccccc1 Amb25190157 [0,2,0,0,0,0|1,0,1]=4 7794 B13R1.11 COC(=S)NC(=O)c1ccccc1 Amb10553666 [0,2,0,0,0,0|1,0,1]=4 7795 B13R1.11 COC(C)NC(=O)c1cc[n]cc1 Amb25258455 [0,2,0,0,0,0|2,0,0]=4 7796 B13R1.11 COC(C)NC(=O)c1ccccc1 Amb24096334 [0,2,0,0,0,0|1,0,0]=3 7797 B13R1.11 CSC(=O)NC(=O)c1ccccc1 Amb25743426 [0,2,0,0,0,0|1,0,1]=4 7798 B13R1.11 C[C@@H](C#C)NC(=O)c1ccccc1 Amb25287160 [0,2,0,0,0,0|1,0,0]=3 7799 B13R1.11 C[C@@H](C#N)NC(=O)c1cc[n]cc1 Amb25334457 [0,2,0,0,0,0|2,0,0]=4 7800 B13R1.11 C[C@@H](C#N)NC(=O)c1ccc[n]c1 Amb25823552 [0,2,0,0,0,0|2,0,0]=4 7801 B13R1.11 C[C@@H](C#N)NC(=O)c1cccc[n]1 Amb24625261 [0,2,0,0,0,0|2,0,0]=4 7802 B13R1.11 C[C@@H](C#N)NC(=O)c1ccccc1 Amb24759074 [0,2,0,0,0,0|1,0,0]=3 7803 B13R1.11 C[C@@H](CN)NC(=O)c1ccc[n]c1 Amb24474611 [0,2,0,0,0,0|2,0,0]=4 7804 B13R1.11 C[C@@H](CN)NC(=O)c1ccccc1 Amb24421410 [0,2,0,0,0,0|1,0,0]=3 7805 B13R1.11 C[C@@H](CN)NC(=O)c1ccccc1 Amb25376964 [0,2,0,0,0,0|1,0,0]=3 7806 B13R1.11 C[C@@H](CO)NC(=O)c1cc[n]cc1 Amb25350029 [0,2,0,0,0,0|2,0,0]=4 7807 B13R1.11 C[C@@H](CO)NC(=O)c1ccc[n]c1 Amb25727732 [0,2,0,0,0,0|2,0,0]=4 7808 B13R1.11 C[C@@H](CO)NC(=O)c1cccc[n]1 Amb24562339 [0,2,0,0,0,0|2,0,0]=4 7809 B13R1.11 C[C@@H](CO)NC(=O)c1ccccc1 Amb24346934 [0,2,0,0,0,0|1,0,0]=3 7810 B13R1.11 C[C@H](C#N)NC(=O)c1ccc[n]c1 Amb25749461 [0,2,0,0,0,0|2,0,0]=4 7811 B13R1.11 C[C@H](C#N)NC(=O)c1ccccc1 Amb24676303 [0,2,0,0,0,0|1,0,0]=3 7812 B13R1.11 C[C@H](CC(=O)c1ccccc1)C#N Amb25315932 [0,2,0,0,0,0|1,0,0]=3 7813 B13R1.11 C[C@H](CN)NC(=O)c1cccc[n]1 Amb25134833 [0,2,0,0,0,0|2,0,0]=4 7814 B13R1.11 C[C@H](CN)NC(=O)c1ccccc1 Amb25155607 [0,2,0,0,0,0|1,0,0]=3 7815 B13R1.11 C[C@H](CO)NC(=O)c1ccc[n]c1 Amb24668371 [0,2,0,0,0,0|2,0,0]=4 7816 B13R1.11 C[C@H](CO)NC(=O)c1cccc[n]1 Amb25077380 [0,2,0,0,0,0|2,0,0]=4 7817 B13R1.11 C\C(=C/C(=O)c1ccccc1)\NC Amb24494958 [0,2,0,0,0,0|1,0,1]=4 7818 B13R1.11 C\C(=C/C(C)NC)\c1ccccc1 Amb23555670 [0,2,0,0,0,0|2,0,0]=4 7819 B13R1.11 C\C(=C\C(=O)CC)\c1ccccc1 Amb24553546 [0,2,0,0,0,0|2,0,0]=4 7820 B13R1.11 C\C(=C\C(=O)c1ccccc1)\C#N Amb25205867 [0,2,0,0,0,0|1,0,1]=4 7821 B13R1.11 C\C(=C\C(=O)c1ccccc1)\NC Amb24418806 [0,2,0,0,0,0|1,0,1]=4 7822 B13R1.11 C\C(=C\C(=O)c1ccccc1)\OC Amb25034479 [0,2,0,0,0,0|1,0,1]=4 7823 B13R1.11 C\C(=C\C(C)C=O)\c1ccccc1 Amb25328859 [0,2,0,0,0,0|2,0,0]=4 7824 B13R1.11 C\C(=C\C(O)CC)\c1ccccc1 Amb24719717 [0,2,0,0,0,0|2,0,0]=4 7825 B13R1.11 C\C(\C=C)=C/C(=O)c1ccccc1 Amb24492770 [0,2,0,0,0,0|1,0,1]=4 7826 B13R1.11 C\C(\CC(=O)c1ccccc1)=C/C Amb25768382 [0,2,0,0,0,0|1,0,1]=4 7827 B13R1.11 C\C(\CC(=O)c1ccccc1)=N/O Amb25334974 [0,2,0,0,0,0|1,0,1]=4 7828 B13R1.11 C\C(\CC)=C\C(=O)c1ccccc1 Amb24408334 [0,2,0,0,0,0|1,0,0]=3 7829 B13R1.11 C\C(\CO)=C/C(=O)c1ccccc1 Amb24495014 [0,2,0,0,0,0|1,0,1]=4 7830 B13R1.11 C\C(\CO)=C\C(=O)c1ccccc1 Amb24706804 [0,2,0,0,0,0|1,0,1]=4 7831 B13R1.11 C\C(\NC(=O)c1ccccc1)=N/C Amb24072852 [0,2,0,0,0,0|1,0,1]=4 7832 B13R1.11 N#CC(CC(=O)c1ccccn1)C Amb17133612 [0,2,0,0,0,0|2,0,0]=4 7833 B13R1.11 N#CC(CC(=O)c1cccnc1)C Amb17133613 [0,2,0,0,0,0|2,0,0]=4 7834 B13R1.11 N#CC(NC(=O)c1cccnc1)C Amb17400484 [0,2,0,0,0,0|2,0,0]=4 7835 B13R1.11 NCC(=O)NC(=O)c1ccccc1 Amb25782184 [0,2,0,0,0,0|1,0,1]=4 7836 B13R1.11 O=C(NC(=O)CF)c1ccccc1 Amb24743332 [0,2,0,0,0,0|1,0,1]=4 7837 B13R1.11 O=C(\C=C(/Cl)\CCl)c1ccccc1 Amb25780102 [0,2,0,0,0,0|1,0,1]=4 7838 B13R1.11 OCC(=O)NC(=O)c1ccccc1 Amb1109639 [0,2,0,0,0,0|1,0,1]=4 7839 B13R1.24 C#CCCNC(=O)c1cc[n]cc1 Amb25758083 [0,2,0,0,0,0|2,0,0]=4 7840 B13R1.24 C#CCCNC(=O)c1ccccc1 Amb21939996 [0,2,0,0,0,0|1,0,0]=3 7841 B13R1.24 C#CCONC(=O)c1cccc[n]1 Amb25232486 [0,2,0,0,0,0|1,0,1]=4 7842 B13R1.24 C([2H])(c1ccccc1)\C=C\OCC Amb10568510 [0,2,0,0,0,0|1,0,1]=4 7843 B13R1.24 C=C=CCNC(=O)c1ccccc1 Amb24341406 [0,2,0,0,0,0|1,0,1]=4 7844 B13R1.24 C=CCCNC(=O)c1ccccc1 Amb10562813 [0,2,0,0,0,0|1,0,0]=3 7845 B13R1.24 C=CCCOC(=O)c1ccccc1 Amb22499457 [0,2,0,0,0,0|0,0,0]=2 7846 B13R1.24 CC#CCCC(=O)c1ccc[n]c1 Amb24718747 [0,2,0,0,0,0|2,0,0]=4 7847 B13R1.24 CC#CCCC(=O)c1ccccc1 Amb18802901 [0,2,0,0,0,0|1,0,0]=3 7848 B13R1.24 CC#CCNC(=O)c1cc[n]cc1 Amb24613710 [0,2,0,0,0,0|2,0,0]=4 7849 B13R1.24 CC#CCOC(=O)c1c[n]ccc1 Amb24412802 [0,2,0,0,0,0|1,0,0]=3 7850 B13R1.24 CC#CCOC(=O)c1cc[n][n]c1 Amb25687765 [0,2,0,0,0,0|2,0,0]=4 7851 B13R1.24 CC#CCOC(=O)c1cc[n]cc1 Amb25077828 [0,2,0,0,0,0|1,0,0]=3 7852 B13R1.24 CC#CCOC(=O)c1cccc[n]1 Amb25099228 [0,2,0,0,0,0|1,0,0]=3 7853 B13R1.24 CC#C\C=C\C(=O)c1ccccc1 Amb24553543 [0,2,0,0,0,0|1,0,1]=4 7854 B13R1.24 CC=C=CCC(=O)c1ccccc1 Amb25143352 [0,2,0,0,0,0|1,0,1]=4 7855 B13R1.24 CCC=NNC(=O)c1cc[n]cc1 Amb24078146 [0,2,0,0,0,0|2,0,0]=4 7856 B13R1.24 CCCC#CC(=O)c1ccccc1 Amb24491405 [0,2,0,0,0,0|1,0,0]=3 7857 B13R1.24 CCCCCC(=O)c1cc[n]cc1 Amb18804653 [0,2,0,0,0,0|2,0,0]=4 7858 B13R1.24 CCCCCC(=O)c1ccc[n]c1 Amb18184182 [0,2,0,0,0,0|2,0,0]=4 7859 B13R1.24 CCCCNC(=O)c1ccncc1 Amb1954132 [0,2,0,0,0,0|2,0,0]=4 7860 B13R1.24 CCCCNC(=S)c1ccccc1 Amb10561699 [0,2,0,0,0,0|1,1,0]=4 7861 B13R1.24 CCCCOC(=O)c1cccnc1 Amb17509605 [0,2,0,0,0,0|1,0,0]=3 7862 B13R1.24 CCCCOC(=O)c1ccncc1 Amb10573708 [0,2,0,0,0,0|1,0,0]=3 7863 B13R1.24 CCCCSC(=O)c1ccccc1 Amb22231430 [0,2,0,0,0,0|0,1,0]=3 7864 B13R1.24 CCCOCC(O)c1ccccc1 Amb18809348 [0,2,0,0,0,0|0,0,2]=4 7865 B13R1.24 CCC\C=N\C(=O)c1ccccc1 Amb24072851 [0,2,0,0,0,0|1,0,0]=3 7866 B13R1.24 CCN=C=CC(=O)c1ccccc1 Amb25334925 [0,2,0,0,0,0|1,0,0]=3 7867 B13R1.24 CCOC#CC(O)c1ccccc1 Amb25280134 [0,2,0,0,0,0|0,0,2]=4 7868 B13R1.24 CCOCNC(=O)c1ccccc1 Amb24072678 [0,2,0,0,0,0|0,0,0]=2 7869 B13R1.24 CNCCCC(=O)c1ccc[n]c1 Amb21961433 [0,2,0,0,0,0|2,0,0]=4 7870 B13R1.24 CNCCCC(=O)c1cccnc1 Amb17617184 [0,2,0,0,0,0|2,0,0]=4 7871 B13R1.24 CNCCC[13C](=O)[13c]1[13cH][13cH][13cH]n[13cH]1 Amb17617156 [0,2,0,0,0,0|2,0,0]=4 7872 B13R1.24 CNCCNC(=O)c1ccccc1 Amb19028050 [0,2,0,0,0,0|1,0,0]=3 7873 B13R1.24 COCCNC(=N)c1ccccc1 Amb23447131 [0,2,0,0,0,0|2,0,0]=4 7874 B13R1.24 COCCOC(=N)c1ccccc1 Amb10553713 [0,2,0,0,0,0|1,0,0]=3 7875 B13R1.24 COCCOC(=O)c1cc[n]cc1 Amb24065717 [0,2,0,0,0,0|1,0,0]=3 7876 B13R1.24 COC\C=N\C(=O)c1ccccc1 Amb24072844 [0,2,0,0,0,0|1,0,0]=3 7877 B13R1.24 CO\C=C/NC(=O)c1ccccc1 Amb25233532 [0,2,0,0,0,0|1,0,1]=4 7878 B13R1.24 CO\C=C\NC(=O)c1ccccc1 Amb25236507 [0,2,0,0,0,0|1,0,1]=4 7879 B13R1.24 CSCCOC(=O)c1ccc[n]c1 Amb24081199 [0,2,0,0,0,0|1,0,0]=3 7880 B13R1.24 C[Se]CCNC(=O)c1ccccc1 Amb22347744 [0,2,0,0,0,0|1,0,0]=3 7881 B13R1.24 C\C(=C/CCCN)\c1ccccc1 Amb18065585 [0,2,0,0,0,0|2,0,0]=4 7882 B13R1.24 C\C(=N/OC=CC)\c1ccccc1 Amb20248436 [0,2,0,0,0,0|1,0,1]=4 7883 B13R1.24 C\C(=N\OCC#C)\c1ccccc1 Amb25234624 [0,2,0,0,0,0|1,0,1]=4 7884 B13R1.24 C\C=C\C#CC(=O)c1ccccc1 Amb24633521 [0,2,0,0,0,0|1,0,1]=4 7885 B13R1.24 C\C=C\C=CC(=O)c1ccccc1 Amb24646500 [0,2,0,0,0,0|1,0,1]=4 7886 B13R1.24 C\C=C\CNC(=O)c1ccccc1 Amb24072901 [0,2,0,0,0,0|1,0,0]=3 7887 B13R1.24 C\C=C\CNC(=S)c1ccccc1 Amb25294300 [0,2,0,0,0,0|1,1,0]=4 7888 B13R1.24 ClCCCCC(=O)c1cccnc1 Amb1981489 [0,2,0,0,0,0|2,0,0]=4 7889 B13R1.24 ClCCCNC(=O)c1cccnc1 Amb2125791 [0,2,0,0,0,0|2,0,0]=4 7890 B13R1.24 ClC\C=N\NC(=O)c1ccccc1 Amb1104998 [0,2,0,0,0,0|1,0,1]=4 7891 B13R1.24 N#CCCNC(=O)c1cccc[n]1 Amb18185874 [0,2,0,0,0,0|2,0,0]=4 7892 B13R1.24 N#CCCNC(=O)c1ccccc1 Amb17400429 [0,2,0,0,0,0|1,0,0]=3 7893 B13R1.24 N#CCCNC(=O)c1cccnc1 Amb17400486 [0,2,0,0,0,0|2,0,0]=4 7894 B13R1.24 N#CCCNC(=O)c1ccncc1 Amb10573746 [0,2,0,0,0,0|2,0,0]=4 7895 B13R1.24 N#CC\C=N\C(=O)c1ccccc1 Amb24072843 [0,2,0,0,0,0|1,0,1]=4 7896 B13R1.24 NCCCCC(=O)c1cccnc1 Amb1981488 [0,2,0,0,0,0|2,0,0]=4 7897 B13R1.24 NCCCNC(=O)c1cc[n]cc1 Amb18186372 [0,2,0,0,0,0|2,0,0]=4 7898 B13R1.24 NCCCNC(=O)c1ccccn1 Amb2153284 [0,2,0,0,0,0|2,0,0]=4 7899 B13R1.24 NCCCOC(c1ccccc1)C Amb1217768 [0,2,0,0,0,0|1,0,1]=4 7900 B13R1.24 NCCOCC(=O)c1ccccc1 Amb18111539 [0,2,0,0,0,0|0,0,0]=2 7901 B13R1.24 NCCONC(=O)c1ccccc1 Amb24096446 [0,2,0,0,0,0|0,0,0]=2 7902 B13R1.24 NCCSCC(=O)c1ccccc1 Amb21983634 [0,2,0,0,0,0|0,1,0]=3 7903 B13R1.24 NOCCNC(=O)c1ccccc1 Amb17138954 [0,2,0,0,0,0|1,0,0]=3 7904 B13R1.24 NOCCNC(=O)c1cccnc1 Amb17139001 [0,2,0,0,0,0|2,0,0]=4 7905 B13R1.24 N\C(=N\CCC#N)\c1ccccc1 Amb25815391 [0,2,0,0,0,0|2,0,0]=4 7906 B13R1.24 O=C(OCCCCl)c1ccccc1 Amb24099970 [0,2,0,0,0,0|0,0,0]=2 7907 B13R1.24 O=CCCNC(=O)c1ccccc1 Amb17102177 [0,2,0,0,0,0|1,0,0]=3 7908 B13R1.24 O=CCCNC(=O)c1cccnc1 Amb17102219 [0,2,0,0,0,0|2,0,0]=4 7909 B13R1.24 OCCCOC(=N)c1ccccn1 Amb10564569 [0,2,0,0,0,0|2,0,0]=4 7910 B13R1.24 OCCCOC(=O)c1ccccc1 Amb22387917 [0,2,0,0,0,0|0,0,0]=2 7911 B13R1.24 OCCNNC(=O)c1cc[n]cc1 Amb22487346 [0,2,0,0,0,0|2,0,0]=4 7912 B13R1.24 [C-]#[N+]CCNC(=O)c1ccccc1 Amb24072012 [0,2,0,0,0,0|1,0,0]=3 7913 B13R1.24 [N-]=[N+]=NCNC(=O)c1ccccc1 Amb24072661 [0,2,0,0,0,0|2,0,0]=4 7914 B13R1.45 C=C(Cl)CNC(=O)c1ccccc1 Amb25743401 [0,2,0,0,0,0|1,0,1]=4 7915 B13R1.45 CC(=C)C#CC(=O)c1ccccc1 Amb24380804 [0,2,0,0,0,0|1,0,1]=4 7916 B13R1.45 CC(=C)CNC(=O)c1ccc[n]c1 Amb25694651 [0,2,0,0,0,0|2,0,0]=4 7917 B13R1.45 CC(=C)CNC(=O)c1ccccc1 Amb24534621 [0,2,0,0,0,0|1,0,0]=3 7918 B13R1.45 CC(=CCC(C)=O)c1ccccc1 Amb24090254 [0,2,0,0,0,0|2,0,0]=4 7919 B13R1.45 CC(=N)NNC(=O)c1ccccc1 Amb24073590 [0,2,0,0,0,0|1,0,1]=4 7920 B13R1.45 CC(=O)C#CC(=O)c1ccccc1 Amb25134098 [0,2,0,0,0,0|1,0,1]=4 7921 B13R1.45 CC(=O)CNC(=O)c1c[n]ccc1 Amb25684073 [0,2,0,0,0,0|2,0,0]=4 7922 B13R1.45 CC(=O)CNC(=O)c1cc[n]cc1 Amb24439637 [0,2,0,0,0,0|2,0,0]=4 7923 B13R1.45 CC(=O)CNC(=O)c1cccc[n]1 Amb24650706 [0,2,0,0,0,0|2,0,0]=4 7924 B13R1.45 CC(=O)COC(=O)c1ccccc1 Amb22497327 [0,2,0,0,0,0|0,0,0]=2 7925 B13R1.45 CC(=O)NOC(=O)c1ccccc1 Amb24726089 [0,2,0,0,0,0|0,0,1]=3 7926 B13R1.45 CC(=O)O/C=C(\C)c1ccccc1 Amb17778975 [0,2,0,0,0,0|1,0,1]=4 7927 B13R1.45 CC(=O)OCC(=C)c1ccccc1 Amb17778927 [0,2,0,0,0,0|1,0,1]=4 7928 B13R1.45 CC(=O)ONC(=O)c1cc[n]cc1 Amb25160710 [0,2,0,0,0,0|1,0,1]=4 7929 B13R1.45 CC(=O)ONC(=O)c1cccc[n]1 Amb24745497 [0,2,0,0,0,0|1,0,1]=4 7930 B13R1.45 CC(=O)ONC(=O)c1ccccc1 Amb24106396 [0,2,0,0,0,0|0,0,1]=3 7931 B13R1.45 CC(=O)OOC(=O)c1ccccc1 Amb17672876 [0,2,0,0,0,0|0,0,1]=3 7932 B13R1.45 CC(=O)\C=C\C(=O)c1ccccc1 Amb25094370 [0,2,0,0,0,0|1,0,1]=4 7933 B13R1.45 CC(=S)SCC(=O)c1ccccc1 Amb24309338 [0,2,0,0,0,0|0,1,1]=4 7934 B13R1.45 CC(Br)CNC(=O)c1cc[n]cc1 Amb25058830 [0,2,0,0,0,0|2,0,0]=4 7935 B13R1.45 CC(C)=CNC(=O)c1ccccc1 Amb24104488 [0,2,0,0,0,0|1,0,1]=4 7936 B13R1.45 CC(C)=NOC(=O)c1ccccc1 Amb22733229 [0,2,0,0,0,0|0,0,1]=3 7937 B13R1.45 CC(C)C#CC(=O)c1ccccc1 Amb25720623 [0,2,0,0,0,0|1,0,0]=3 7938 B13R1.45 CC(C)CCC(=O)c1cc[n]cc1 Amb18804652 [0,2,0,0,0,0|2,0,0]=4 7939 B13R1.45 CC(C)CNC(=N)c1ccccc1 Amb23447122 [0,2,0,0,0,0|2,0,0]=4 7940 B13R1.45 CC(C)CNC(=O)c1ccncc1 Amb17861681 [0,2,0,0,0,0|2,0,0]=4 7941 B13R1.45 CC(C)NNC(=O)c1cc[n]cc1 Amb22728324 [0,2,0,0,0,0|2,0,0]=4 7942 B13R1.45 CC(C)N\N=C(\N)/c1ccccc1 Amb25288890 [0,2,0,0,0,0|2,0,0]=4 7943 B13R1.45 CC(C)ONC(=O)c1ccc[n]c1 Amb25371489 [0,2,0,0,0,0|1,0,0]=3 7944 B13R1.45 CC(C)ONC(=O)c1cccc[n]1 Amb25143290 [0,2,0,0,0,0|1,0,0]=3 7945 B13R1.45 CC(C)ONC(=O)c1ccccc1 Amb25279041 [0,2,0,0,0,0|0,0,0]=2 7946 B13R1.45 CC(C)O\N=C(/N)\c1c[n]ccc1 Amb18224639 [0,2,0,0,0,0|2,0,0]=4 7947 B13R1.45 CC(C)O\N=C(/N)\c1cc[n]cc1 Amb18224640 [0,2,0,0,0,0|2,0,0]=4 7948 B13R1.45 CC(C)O\N=C(/N)\c1cccc[n]1 Amb18224638 [0,2,0,0,0,0|2,0,0]=4 7949 B13R1.45 CC(C)O\N=C(/N)\c1ccccc1 Amb18862929 [0,2,0,0,0,0|1,0,0]=3 7950 B13R1.45 CC(C)\C=C\C(=O)c1cccc[n]1 Amb24689573 [0,2,0,0,0,0|2,0,0]=4 7951 B13R1.45 CC(C)\C=C\C(=O)c1ccccc1 Amb24559391 [0,2,0,0,0,0|1,0,0]=3 7952 B13R1.45 CC(C)\N=C\C(=O)c1ccccc1 Amb24434587 [0,2,0,0,0,0|1,0,0]=3 7953 B13R1.45 CC(CCC(=O)c1ccccc1)Cl Amb16231581 [0,2,0,0,0,0|1,0,0]=3 7954 B13R1.45 CC(CCC(=O)c1cccnc1)C Amb17233267 [0,2,0,0,0,0|2,0,0]=4 7955 B13R1.45 CC(CNC(=O)c1ccccc1)O Amb10788464 [0,2,0,0,0,0|1,0,0]=3 7956 B13R1.45 CC(CNC(=S)c1ccccc1)C Amb10553418 [0,2,0,0,0,0|1,1,0]=4 7957 B13R1.45 CC(COC(=O)c1ccncc1)C Amb17509537 [0,2,0,0,0,0|1,0,0]=3 7958 B13R1.45 CC(Cl)C#CC(=O)c1ccccc1 Amb25846415 [0,2,0,0,0,0|1,0,0]=3 7959 B13R1.45 CC(Cl)CNC(=O)c1ccc[n]c1 Amb24685389 [0,2,0,0,0,0|2,0,0]=4 7960 B13R1.45 CC(F)C#CC(=O)c1ccccc1 Amb24364142 [0,2,0,0,0,0|1,0,0]=3 7961 B13R1.45 CC(N)CNC(=O)c1cc[n]cc1 Amb18112243 [0,2,0,0,0,0|2,0,0]=4 7962 B13R1.45 CC(N)CNC(=O)c1ccc[n]c1 Amb18111152 [0,2,0,0,0,0|2,0,0]=4 7963 B13R1.45 CC(N)CNC(=O)c1ccccc1 Amb18110135 [0,2,0,0,0,0|1,0,0]=3 7964 B13R1.45 CC(O)CNC(=O)c1ccc[n]c1 Amb20624855 [0,2,0,0,0,0|2,0,0]=4 7965 B13R1.45 CC(O)\C=C/C(=O)c1ccccc1 Amb25190052 [0,2,0,0,0,0|1,0,0]=3 7966 B13R1.45 CC(O)\C=C\C(=O)c1ccccc1 Amb24378448 [0,2,0,0,0,0|1,0,0]=3 7967 B13R1.45 CN(C)C#CC(=O)c1ccccc1 Amb25714385 [0,2,0,0,0,0|1,0,1]=4 7968 B13R1.45 CN(C)CCC(=O)c1cc[n]cc1 Amb24119350 [0,2,0,0,0,0|2,0,0]=4 7969 B13R1.45 CN(C)CCC(=O)c1cccc[n]1 Amb24119362 [0,2,0,0,0,0|2,0,0]=4 7970 B13R1.45 CN(C)CNC(=O)c1cc[n]cc1 Amb25242982 [0,2,0,0,0,0|2,0,0]=4 7971 B13R1.45 CN(C)CNC(=O)c1cccc[n]1 Amb25300432 [0,2,0,0,0,0|2,0,0]=4 7972 B13R1.45 CN(C)CNC(=S)c1ccccc1 Amb24489129 [0,2,0,0,0,0|1,1,0]=4 7973 B13R1.45 CN(C)\N=C\C(=O)c1ccccc1 Amb24572835 [0,2,0,0,0,0|2,0,0]=4 7974 B13R1.45 CN(CCC(=C)c1ccccc1)C Amb10976100 [0,2,0,0,0,0|2,0,0]=4 7975 B13R1.45 CN(CCC(=O)c1ccccc1)C Amb1106335 [0,2,0,0,0,0|1,0,0]=3 7976 B13R1.45 CN(CCC(=O)c1ccccc1)C Amb1197569 [0,2,0,0,0,0|1,0,0]=3 7977 B13R1.45 CN(CNC(=O)c1ccccc1)C Amb10565604 [0,2,0,0,0,0|1,0,0]=3 7978 B13R1.45 CN(O)CCC(=O)c1ccccc1 Amb22228994 [0,2,0,0,0,0|1,0,0]=3 7979 B13R1.45 CN(\C=C\C(=O)c1ccccc1)C Amb2384234 [0,2,0,0,0,0|1,0,1]=4 7980 B13R1.45 CN(\C=N/C(=O)c1ccccc1)C Amb10553970 [0,2,0,0,0,0|1,0,1]=4 7981 B13R1.45 CN(\C=N\C(=O)c1ccccc1)C Amb16231122 [0,2,0,0,0,0|1,0,1]=4 7982 B13R1.45 C[C@@H](O)CNC(=O)c1cc[n]cc1 Amb24491052 [0,2,0,0,0,0|2,0,0]=4 7983 B13R1.45 C[C@H](O)CNC(=O)c1cccc[n]1 Amb25133456 [0,2,0,0,0,0|2,0,0]=4 7984 B13R1.45 C\C(=C\CC(C)=O)\c1ccccc1 Amb24392921 [0,2,0,0,0,0|2,0,0]=4 7985 B13R1.45 C\C(=C\OC(C)=O)\c1ccccc1 Amb25290986 [0,2,0,0,0,0|1,0,1]=4 7986 B13R1.45 C\C(=N\CC(C)O)\c1ccccc1 Amb25180193 [0,2,0,0,0,0|2,0,0]=4 7987 B13R1.45 C\C(=N\OC(=O)C)\c1ccccc1 Amb1014467 [0,2,0,0,0,0|1,0,1]=4 7988 B13R1.45 C\C(\N)=N\OC(=O)c1ccccc1 Amb24710149 [0,2,0,0,0,0|0,0,1]=3 7989 B13R1.45 N=C(NCC(F)F)c1ccccc1 Amb24374576 [0,2,0,0,0,0|2,0,0]=4 7990 B13R1.45 NC(=N)CNC(=O)c1ccccc1 Amb24563441 [0,2,0,0,0,0|1,0,1]=4 7991 B13R1.45 NC(=O)COC(=O)c1cccc[n]1 Amb20237415 [0,2,0,0,0,0|1,0,1]=4 7992 B13R1.45 NC(=O)COC(=O)c1cccnc1 Amb1961070 [0,2,0,0,0,0|1,0,1]=4 7993 B13R1.45 NC(=O)NOC(=O)c1ccccc1 Amb25806893 [0,2,0,0,0,0|1,0,1]=4 7994 B13R1.45 NC(=O)ONC(=O)c1ccccc1 Amb24635646 [0,2,0,0,0,0|1,0,1]=4 7995 B13R1.45 N[C@@H](c1ccccc1)COC(C)C Amb17061653 [0,2,0,0,0,0|1,0,1]=4 7996 B13R1.45 N\C(=N\OC(=O)C)\c1ccccc1 Amb2228036 [0,2,0,0,0,0|1,0,1]=4 7997 B13R1.45 O=C(NCC(=O)S)c1ccccc1 Amb24490432 [0,2,0,0,0,0|1,0,1]=4 7998 B13R1.45 O=C(NCC(Cl)Cl)c1cc[n]cc1 Amb24422196 [0,2,0,0,0,0|2,0,0]=4 7999 B13R1.45 O=C(NCC(Cl)Cl)c1ccccc1 Amb25137001 [0,2,0,0,0,0|1,0,0]=3 8000 B13R1.45 O=C(NCC(F)F)c1cc[n]cc1 Amb25683315 [0,2,0,0,0,0|2,0,0]=4 8001 B13R1.45 O=C(c1ccccc1)CCC(=C)Cl Amb17595128 [0,2,0,0,0,0|1,0,1]=4 8002 B13R1.45 O=C(c1ccccc1)CCC(=O)N Amb17233256 [0,2,0,0,0,0|1,0,1]=4 8003 B13R1.45 O=C(c1ccccc1)CCC(=O)O Amb1224638 [0,2,0,0,0,0|1,0,1]=4 8004 B13R1.45 O=C(c1ccccc1)CC[N+](=O)[O-] Amb16231607 [0,2,0,0,0,0|2,0,0]=4 8005 B13R1.45 O=C(c1ccccc1)CC[NH+](C)C Amb2430219 [0,2,0,0,0,0|1,0,0]=3 8006 B13R1.45 O=C(c1ccccc1)CNC(=O)C Amb17335159 [0,2,0,0,0,0|1,0,1]=4 8007 B13R1.45 O=C(c1ccccc1)NCC(=C)Br Amb14063723 [0,2,0,0,0,0|1,0,1]=4 8008 B13R1.45 O=C(c1ccccc1)NCC(=O)O Amb1006961 [0,2,0,0,0,0|1,0,1]=4 8009 B13R1.45 O=C(c1ccccc1)NCC(=O)O Amb17616813 [0,2,0,0,0,0|1,0,1]=4 8010 B13R1.45 O=C(c1ccccc1)NCC(=S)N Amb1678248 [0,2,0,0,0,0|1,0,1]=4 8011 B13R1.45 O=C(c1ccccc1)NN=C(C)C Amb1652225 [0,2,0,0,0,0|1,0,1]=4 8012 B13R1.45 O=C(c1ccccc1)OCC(=O)O Amb17594607 [0,2,0,0,0,0|0,0,1]=3 8013 B13R1.45 OC(=O)CCC(=O)[13c]1[13cH][13cH][13cH][13cH][13cH]1 Amb22054406 [0,2,0,0,0,0|1,0,1]=4 8014 B13R1.45 OC(=O)CNC(=O)c1ccccc1 Amb1197580 [0,2,0,0,0,0|1,0,1]=4 8015 B13R1.45 OC(=O)COC(=O)c1cccnc1 Amb1966283 [0,2,0,0,0,0|1,0,1]=4 8016 B13R1.122 C#CCOS(=O)(=O)c1ccccc1 Amb10807517 [0,2,0,0,0,0|1,0,1]=4 8017 B13R1.122 CC(Br)(OCCCl)c1ccccc1 Amb22755485 [0,2,0,0,0,0|1,0,1]=4 8018 B13R1.122 CCCOC(C)(C)c1ccccc1 Amb24079810 [0,2,0,0,0,0|1,0,1]=4 8019 B13R1.122 CCCOS(=O)(=O)c1ccccc1 Amb22056098 [0,2,0,0,0,0|1,0,0]=3 8020 B13R1.122 CS(=O)(=NCCN)c1ccccc1 Amb24548099 [0,2,0,0,0,0|2,0,0]=4 8021 B13R1.122 ClCCCS(=O)(=O)c1ccccc1 Amb1127097 [0,2,0,0,0,0|2,0,0]=4 8022 B13R1.122 N#CCOS(=O)(=O)c1ccccc1 Amb10807519 [0,2,0,0,0,0|1,0,1]=4 8023 B13R1.122 NCCCS(=O)(=O)c1ccccc1 Amb10068882 [0,2,0,0,0,0|2,0,0]=4 8024 B13R1.122 NCCOC(c1ccccc1)(C)C Amb10790060 [0,2,0,0,0,0|1,0,1]=4 8025 B13R1.122 NCCOS(=O)(=O)c1ccccc1 Amb18107652 [0,2,0,0,0,0|1,0,0]=3 8026 B13R1.122 O=S(=O)(OCCBr)c1ccccc1 Amb22347031 [0,2,0,0,0,0|1,0,0]=3 8027 B13R1.122 O=S(=O)(OCCCl)c1ccccc1 Amb24323425 [0,2,0,0,0,0|1,0,0]=3 8028 B13R1.122 OCCCS(=O)(=O)c1ccccc1 Amb17106257 [0,2,0,0,0,0|2,0,0]=4 8029 B13R1.122 OCCOS(=O)(=O)c1ccccc1 Amb24082570 [0,2,0,0,0,0|1,0,0]=3 8030 B13R1.674 BrCC\C=C(\c1ccccc1C)/C Amb17254615 [0,2,0,0,0,0|2,0,0]=4 8031 B13R1.674 BrCC\C=C(\c1ccccc1Cl)/C Amb17267356 [0,2,0,0,0,0|2,0,0]=4 8032 B13R1.674 BrCC\C=C(\c1ccccc1F)/C Amb17256418 [0,2,0,0,0,0|2,0,0]=4 8033 B13R1.674 C#CCCC(=O)c1ccccc1Cl Amb25189780 [0,2,0,0,0,0|1,0,1]=4 8034 B13R1.674 C#CCCC(=O)c1ccccc1F Amb24683348 [0,2,0,0,0,0|1,0,1]=4 8035 B13R1.674 C#CCNC(=O)c1ccccc1F Amb10672065 [0,2,0,0,0,0|1,0,1]=4 8036 B13R1.674 C#CCNC(=O)c1ccccc1N Amb10609189 [0,2,0,0,0,0|1,0,1]=4 8037 B13R1.674 C#CCNC(=O)c1ccccc1N Amb1216613 [0,2,0,0,0,0|1,0,1]=4 8038 B13R1.674 C#CCNC(=O)c1ccccc1S Amb24533347 [0,2,0,0,0,0|1,0,1]=4 8039 B13R1.674 C#CCOC(=O)c1[n]cccc1Br Amb24448536 [0,2,0,0,0,0|1,0,1]=4 8040 B13R1.674 C#CCOC(=O)c1[n]cccc1Cl Amb25690140 [0,2,0,0,0,0|1,0,1]=4 8041 B13R1.674 C#CCOC(=O)c1cc[n]cc1F Amb25163841 [0,2,0,0,0,0|1,0,1]=4 8042 B13R1.674 C#CCOC(=O)c1cc[n]cc1O Amb25119620 [0,2,0,0,0,0|1,0,1]=4 8043 B13R1.674 C#CCOC(=O)c1ccc[n]c1I Amb25781485 [0,2,0,0,0,0|1,0,1]=4 8044 B13R1.674 C#CCOC(=O)c1ccccc1Br Amb25285404 [0,2,0,0,0,0|0,0,1]=3 8045 B13R1.674 C#CCOC(=O)c1ccccc1I Amb25848309 [0,2,0,0,0,0|0,0,1]=3 8046 B13R1.674 C#CCOC(=O)c1ccccc1N Amb18266740 [0,2,0,0,0,0|0,0,1]=3 8047 B13R1.674 C#CCOC(=O)c1ccccc1O Amb18266739 [0,2,0,0,0,0|0,0,1]=3 8048 B13R1.674 C=CCNC(=O)c1ccccc1Br Amb2552442 [0,2,0,0,0,0|1,0,1]=4 8049 B13R1.674 C=CCNC(=O)c1ccccc1Cl Amb2434805 [0,2,0,0,0,0|1,0,1]=4 8050 B13R1.674 C=CCNC(=O)c1ccccc1N Amb1105964 [0,2,0,0,0,0|1,0,1]=4 8051 B13R1.674 C=CCNC(=O)c1ccccc1[NH3+] Amb10799562 [0,2,0,0,0,0|1,0,1]=4 8052 B13R1.674 C=CCOC(=O)c1ccccc1N Amb18127870 [0,2,0,0,0,0|0,0,1]=3 8053 B13R1.674 C=CCOC(=O)c1ccccc1O Amb17594533 [0,2,0,0,0,0|0,0,1]=3 8054 B13R1.674 CC#CCC(=O)c1ccccc1Cl Amb19061629 [0,2,0,0,0,0|1,0,1]=4 8055 B13R1.674 CC#CCC(=O)c1ccccc1F Amb18178251 [0,2,0,0,0,0|1,0,1]=4 8056 B13R1.674 CC#CCC(=O)c1ccccc1I Amb25698886 [0,2,0,0,0,0|1,0,1]=4 8057 B13R1.674 CC#CCC(=O)c1ccccc1N Amb24415659 [0,2,0,0,0,0|1,0,1]=4 8058 B13R1.674 CCCCC(=O)c1ccccc1Cl Amb17198752 [0,2,0,0,0,0|1,0,0]=3 8059 B13R1.674 CCCCC(=O)c1ccccc1F Amb17198741 [0,2,0,0,0,0|1,0,0]=3 8060 B13R1.674 CCCCC(=O)c1ccccc1O Amb17621754 [0,2,0,0,0,0|1,0,0]=3 8061 B13R1.674 CCCNC(=N)c1ccccc1Br Amb24583831 [0,2,0,0,0,0|2,0,0]=4 8062 B13R1.674 CCCNC(=O)C1=CC=CNC1=S Amb25317174 [0,2,0,0,0,0|2,0,0]=4 8063 B13R1.674 CCCNC(=O)c1[n]cccc1Cl Amb25787946 [0,2,0,0,0,0|2,0,0]=4 8064 B13R1.674 CCCNC(=O)c1c[n]ccc1Cl Amb24715316 [0,2,0,0,0,0|2,0,0]=4 8065 B13R1.674 CCCNC(=O)c1cc[n]cc1Br Amb25317175 [0,2,0,0,0,0|2,0,0]=4 8066 B13R1.674 CCCNC(=O)c1cc[n]cc1I Amb24719251 [0,2,0,0,0,0|2,0,0]=4 8067 B13R1.674 CCCNC(=O)c1cc[n]cc1O Amb25752082 [0,2,0,0,0,0|2,0,0]=4 8068 B13R1.674 CCCNC(=O)c1ccc[n]c1Br Amb24401268 [0,2,0,0,0,0|2,0,0]=4 8069 B13R1.674 CCCNC(=O)c1ccc[n]c1F Amb24378593 [0,2,0,0,0,0|2,0,0]=4 8070 B13R1.674 CCCNC(=O)c1ccc[n]c1I Amb25806305 [0,2,0,0,0,0|2,0,0]=4 8071 B13R1.674 CCCNC(=O)c1ccc[n]c1N Amb18986230 [0,2,0,0,0,0|2,0,0]=4 8072 B13R1.674 CCCNC(=O)c1cccc[n+]1[O-] Amb25740286 [0,2,0,0,0,0|2,0,0]=4 8073 B13R1.674 CCCNC(=O)c1ccccc1Cl Amb2221399 [0,2,0,0,0,0|1,0,0]=3 8074 B13R1.674 CCNNC(=O)c1ccccc1O Amb24443636 [0,2,0,0,0,0|1,0,0]=3 8075 B13R1.674 CCONC(=N)c1ccccc1O Amb24432205 [0,2,0,0,0,0|1,0,0]=3 8076 B13R1.674 CCONC(=O)C1=CNC=CC1=O Amb24456163 [0,2,0,0,0,0|1,0,0]=3 8077 B13R1.674 CCONC(=O)c1[n]cccc1N Amb25107986 [0,2,0,0,0,0|1,0,0]=3 8078 B13R1.674 CCONC(=O)c1[n]cccc1O Amb25304652 [0,2,0,0,0,0|1,0,0]=3 8079 B13R1.674 CCONC(=O)c1c[n]ccc1Cl Amb25226515 [0,2,0,0,0,0|1,0,0]=3 8080 B13R1.674 CCONC(=O)c1c[n]ccc1N Amb25673593 [0,2,0,0,0,0|1,0,0]=3 8081 B13R1.674 CCONC(=O)c1cc[n]cc1Br Amb25099307 [0,2,0,0,0,0|1,0,0]=3 8082 B13R1.674 CCONC(=O)c1ccc[n]c1Br Amb25158416 [0,2,0,0,0,0|1,0,0]=3 8083 B13R1.674 CCONC(=O)c1ccc[n]c1F Amb25773621 [0,2,0,0,0,0|1,0,0]=3 8084 B13R1.674 CCONC(=O)c1ccccc1C Amb10704492 [0,2,0,0,0,0|0,0,0]=2 8085 B13R1.674 CCONC(=O)c1ccccc1F Amb25675191 [0,2,0,0,0,0|0,0,0]=2 8086 B13R1.674 CCONC(=O)c1nccnc1N Amb10706855 [0,2,0,0,0,0|2,0,0]=4 8087 B13R1.674 CCO\N=C(/N)\c1ccccc1Br Amb18227820 [0,2,0,0,0,0|1,0,0]=3 8088 B13R1.674 CCO\N=C(/N)\c1ccccc1Cl Amb18864184 [0,2,0,0,0,0|1,0,0]=3 8089 B13R1.674 CCO\N=C(/N)\c1ccccc1F Amb18224738 [0,2,0,0,0,0|1,0,0]=3 8090 B13R1.674 CC\C=C\C(=O)c1c[n]ccc1N Amb25132063 [0,2,0,0,0,0|2,0,0]=4 8091 B13R1.674 CC\C=C\C(=O)c1ccccc1Br Amb25126921 [0,2,0,0,0,0|1,0,0]=3 8092 B13R1.674 CC\C=C\C(=O)c1ccccc1Cl Amb24681870 [0,2,0,0,0,0|1,0,0]=3 8093 B13R1.674 CC\C=C\C(=O)c1ccccc1F Amb25191517 [0,2,0,0,0,0|1,0,0]=3 8094 B13R1.674 CC\C=C\C(=O)c1ccccc1O Amb25318921 [0,2,0,0,0,0|1,0,0]=3 8095 B13R1.674 COCCC(=O)c1ccccc1C Amb17233410 [0,2,0,0,0,0|1,0,0]=3 8096 B13R1.674 COCCC(=O)c1ccccc1Cl Amb17236834 [0,2,0,0,0,0|1,0,0]=3 8097 B13R1.674 COCCC(=O)c1ccccc1F Amb17233887 [0,2,0,0,0,0|1,0,0]=3 8098 B13R1.674 COCOC(=O)c1ccccc1O Amb17594676 [0,2,0,0,0,0|0,0,0]=2 8099 B13R1.674 CO\C=N/C(=O)c1ccccc1O Amb25073282 [0,2,0,0,0,0|1,0,1]=4 8100 B13R1.674 CO\C=N\C(=O)c1ccccc1O Amb10070759 [0,2,0,0,0,0|1,0,1]=4 8101 B13R1.674 C\C(=C/OCC)\c1ccccc1N Amb18127957 [0,2,0,0,0,0|1,0,0]=3 8102 B13R1.674 C\C(=C\CCCl)\c1ccccc1F Amb25823764 [0,2,0,0,0,0|2,0,0]=4 8103 B13R1.674 C\C(=C\CCN)\c1ccccc1Cl Amb25695755 [0,2,0,0,0,0|2,0,0]=4 8104 B13R1.674 C\C(=C\CNC)\c1ccccc1F Amb25682650 [0,2,0,0,0,0|2,0,0]=4 8105 B13R1.674 C\C(=N/CCN)\c1ccccc1O Amb24647805 [0,2,0,0,0,0|2,0,0]=4 8106 B13R1.674 C\C(=N/CCS)\c1ccccc1O Amb25129003 [0,2,0,0,0,0|2,0,0]=4 8107 B13R1.674 C\C(=N\CCN)\c1ccccc1O Amb24410847 [0,2,0,0,0,0|2,0,0]=4 8108 B13R1.674 C\C(=N\CCO)\c1ccccc1N Amb25670321 [0,2,0,0,0,0|2,0,0]=4 8109 B13R1.674 C\C(=N\OCC)\c1cc[n]cc1F Amb25143801 [0,2,0,0,0,0|2,0,0]=4 8110 B13R1.674 C\C(=N\OCC)\c1ccccc1O Amb24632928 [0,2,0,0,0,0|1,0,0]=3 8111 B13R1.674 C\C=C\NC(=O)c1ccccc1N Amb18127743 [0,2,0,0,0,0|1,0,1]=4 8112 B13R1.674 C\C=N\NC(=O)c1ccccc1Br Amb2465864 [0,2,0,0,0,0|1,0,1]=4 8113 B13R1.674 C\C=N\NC(=O)c1ccccc1C Amb1419686 [0,2,0,0,0,0|1,0,1]=4 8114 B13R1.674 Cc1[n]cccc1C(=O)NCCC Amb25683557 [0,2,0,0,0,0|2,0,0]=4 8115 B13R1.674 Cc1[n]cccc1C(=O)NCCI Amb24529644 [0,2,0,0,0,0|2,0,0]=4 8116 B13R1.674 Cc1[n]cccc1C(=O)NCCN Amb25291449 [0,2,0,0,0,0|2,0,0]=4 8117 B13R1.674 Cc1[n]cccc1C(=O)OCC#C Amb25728872 [0,2,0,0,0,0|1,0,1]=4 8118 B13R1.674 Cc1c[n]ccc1C(=O)NCCCl Amb25134685 [0,2,0,0,0,0|2,0,0]=4 8119 B13R1.674 Cc1c[n]ccc1C(=O)NCCN Amb25753106 [0,2,0,0,0,0|2,0,0]=4 8120 B13R1.674 Cc1c[n]ccc1C(=O)OCC#C Amb24722271 [0,2,0,0,0,0|1,0,1]=4 8121 B13R1.674 Cc1cc[n]cc1C(=O)CCCN Amb18195255 [0,2,0,0,0,0|2,0,0]=4 8122 B13R1.674 Cc1cc[n]cc1C(=O)NOCC Amb25369270 [0,2,0,0,0,0|1,0,0]=3 8123 B13R1.674 Cc1cc[n]cc1C(=O)OCC#C Amb25032934 [0,2,0,0,0,0|1,0,1]=4 8124 B13R1.674 Cc1ccc[n]c1C(=O)NCCCl Amb18331162 [0,2,0,0,0,0|2,0,0]=4 8125 B13R1.674 Cc1ccc[n]c1C(=O)NCCI Amb25235371 [0,2,0,0,0,0|2,0,0]=4 8126 B13R1.674 Cc1ccc[n]c1C(=O)NCCN Amb18296381 [0,2,0,0,0,0|2,0,0]=4 8127 B13R1.674 Cc1ccc[n]c1C(=O)NCCO Amb18184701 [0,2,0,0,0,0|2,0,0]=4 8128 B13R1.674 Cc1ccc[n]c1C(=O)OCC#C Amb25358455 [0,2,0,0,0,0|1,0,1]=4 8129 B13R1.674 Cc1ccc[n]c1C(=O)OCC#N Amb25818218 [0,2,0,0,0,0|1,0,1]=4 8130 B13R1.674 Cc1ccccc1C(=O)CC#CC Amb18183693 [0,2,0,0,0,0|1,0,1]=4 8131 B13R1.674 Cc1ccccc1C(=O)CCC#C Amb24346823 [0,2,0,0,0,0|1,0,1]=4 8132 B13R1.674 Cc1ccccc1C(=O)CCCN Amb18824969 [0,2,0,0,0,0|1,0,0]=3 8133 B13R1.674 Cc1ccccc1C(=O)NCCS Amb25711980 [0,2,0,0,0,0|1,0,0]=3 8134 B13R1.674 Cc1ccccc1C(=O)OCCBr Amb24065426 [0,2,0,0,0,0|0,0,0]=2 8135 B13R1.674 Cc1ccccc1C(=O)\C=C\CO Amb24582580 [0,2,0,0,0,0|1,0,1]=4 8136 B13R1.674 Cc1ccccc1\C(\C)=C/CCBr Amb24637518 [0,2,0,0,0,0|2,0,0]=4 8137 B13R1.674 Cc1ccccc1\C(\C)=C/CCCl Amb24350333 [0,2,0,0,0,0|2,0,0]=4 8138 B13R1.674 Cc1ccccc1\C(\C)=C/CCN Amb25249045 [0,2,0,0,0,0|2,0,0]=4 8139 B13R1.674 Cc1ccccc1\C(\N)=N\OCC Amb18224606 [0,2,0,0,0,0|1,0,0]=3 8140 B13R1.674 ClCCNC(=O)c1ccccc1Br Amb17103204 [0,2,0,0,0,0|1,0,0]=3 8141 B13R1.674 ClCCNC(=O)c1ccccc1C Amb17103199 [0,2,0,0,0,0|1,0,0]=3 8142 B13R1.674 ClCCNC(=O)c1ccccc1Cl Amb17103232 [0,2,0,0,0,0|1,0,0]=3 8143 B13R1.674 ClCCNC(=O)c1ccccc1F Amb17103201 [0,2,0,0,0,0|1,0,0]=3 8144 B13R1.674 ClCC\C=C(\c1ccccc1C)/C Amb17236142 [0,2,0,0,0,0|2,0,0]=4 8145 B13R1.674 ClCC\C=C(\c1ccccc1Cl)/C Amb17241875 [0,2,0,0,0,0|2,0,0]=4 8146 B13R1.674 ClCC\C=C(\c1ccccc1F)/C Amb17236849 [0,2,0,0,0,0|2,0,0]=4 8147 B13R1.674 N#CCCC(=O)c1ccccc1O Amb17133642 [0,2,0,0,0,0|1,0,1]=4 8148 B13R1.674 N#CCNC(=O)c1ccccc1O Amb18180564 [0,2,0,0,0,0|1,0,1]=4 8149 B13R1.674 N#CCOC(=O)c1[n]cccc1Cl Amb25724748 [0,2,0,0,0,0|1,0,1]=4 8150 B13R1.674 N#CCOC(=O)c1c[n]ccc1Cl Amb24631952 [0,2,0,0,0,0|1,0,1]=4 8151 B13R1.674 N#CCOC(=O)c1cc[n]cc1Br Amb25136821 [0,2,0,0,0,0|1,0,1]=4 8152 B13R1.674 N#CCOC(=O)c1cc[n]cc1I Amb25295696 [0,2,0,0,0,0|1,0,1]=4 8153 B13R1.674 N#CCOC(=O)c1ccc[n]c1Br Amb24387443 [0,2,0,0,0,0|1,0,1]=4 8154 B13R1.674 N=C(NCCO)c1ccccc1O Amb18648357 [0,2,0,0,0,0|2,0,0]=4 8155 B13R1.674 NCCCC(=O)c1ccccc1Br Amb18727416 [0,2,0,0,0,0|1,0,0]=3 8156 B13R1.674 NCCNC(=O)C1=CC=CNC1=S Amb25056576 [0,2,0,0,0,0|2,0,0]=4 8157 B13R1.674 NCCNC(=O)c1[n]cccc1Cl Amb25307807 [0,2,0,0,0,0|2,0,0]=4 8158 B13R1.674 NCCNC(=O)c1[n]cccc1O Amb18970478 [0,2,0,0,0,0|2,0,0]=4 8159 B13R1.674 NCCNC(=O)c1[n]cccc1O Amb19515043 [0,2,0,0,0,0|2,0,0]=4 8160 B13R1.674 NCCNC(=O)c1c[n]ccc1Cl Amb25850838 [0,2,0,0,0,0|2,0,0]=4 8161 B13R1.674 NCCNC(=O)c1cc[n]cc1Br Amb24692189 [0,2,0,0,0,0|2,0,0]=4 8162 B13R1.674 NCCNC(=O)c1cc[n]cc1O Amb25716267 [0,2,0,0,0,0|2,0,0]=4 8163 B13R1.674 NCCNC(=O)c1ccc[n]c1Cl Amb18290741 [0,2,0,0,0,0|2,0,0]=4 8164 B13R1.674 NCCNC(=O)c1ccc[n]c1O Amb18970492 [0,2,0,0,0,0|2,0,0]=4 8165 B13R1.674 NCCNC(=O)c1cccc[n+]1[O-] Amb24429804 [0,2,0,0,0,0|2,0,0]=4 8166 B13R1.674 NCCNC(=O)c1ccccc1Br Amb1127696 [0,2,0,0,0,0|1,0,0]=3 8167 B13R1.674 NCCNC(=O)c1ccccc1C Amb1131147 [0,2,0,0,0,0|1,0,0]=3 8168 B13R1.674 NCCNC(=O)c1ccccc1Cl Amb1132937 [0,2,0,0,0,0|1,0,0]=3 8169 B13R1.674 NCCNC(=O)c1ccccc1F Amb1135711 [0,2,0,0,0,0|1,0,0]=3 8170 B13R1.674 NCCNC(=O)c1ccccc1F Amb20668348 [0,2,0,0,0,0|1,0,0]=3 8171 B13R1.674 NCCNC(=O)c1ccccc1I Amb1132647 [0,2,0,0,0,0|1,0,0]=3 8172 B13R1.674 NCCNC(=O)c1ccccc1O Amb1133042 [0,2,0,0,0,0|1,0,0]=3 8173 B13R1.674 NCCNC(=O)c1ccccc1S Amb24495187 [0,2,0,0,0,0|1,0,0]=3 8174 B13R1.674 NCC\C=C(\c1ccccc1C)/C Amb17233141 [0,2,0,0,0,0|2,0,0]=4 8175 B13R1.674 NCC\C=C(\c1ccccc1Cl)/C Amb17236339 [0,2,0,0,0,0|2,0,0]=4 8176 B13R1.674 NCC\C=C(\c1ccccc1F)/C Amb17233550 [0,2,0,0,0,0|2,0,0]=4 8177 B13R1.674 Nc1[n]cccc1C(=O)NCCF Amb25346764 [0,2,0,0,0,0|2,0,0]=4 8178 B13R1.674 Nc1[n]cccc1C(=O)NCCO Amb18271382 [0,2,0,0,0,0|2,0,0]=4 8179 B13R1.674 Nc1c[n]ccc1C(=O)NCCF Amb24608254 [0,2,0,0,0,0|2,0,0]=4 8180 B13R1.674 Nc1c[n]ccc1C(=O)OCC#N Amb25762586 [0,2,0,0,0,0|1,0,1]=4 8181 B13R1.674 Nc1cc[n]cc1C(=O)NCCN Amb25072161 [0,2,0,0,0,0|2,0,0]=4 8182 B13R1.674 Nc1ccc[n]c1C(=O)NCCN Amb24726361 [0,2,0,0,0,0|2,0,0]=4 8183 B13R1.674 Nc1ccccc1C(=O)NCC#N Amb18952089 [0,2,0,0,0,0|1,0,1]=4 8184 B13R1.674 Nc1ccccc1C(=O)NCCBr Amb24106214 [0,2,0,0,0,0|1,0,0]=3 8185 B13R1.674 Nc1ccccc1C(=O)NCCCl Amb24106215 [0,2,0,0,0,0|1,0,0]=3 8186 B13R1.674 Nc1ccccc1C(=O)NCCF Amb25083038 [0,2,0,0,0,0|1,0,0]=3 8187 B13R1.674 Nc1ccccc1C(=O)NCCN Amb18290739 [0,2,0,0,0,0|1,0,0]=3 8188 B13R1.674 Nc1ccccc1C(=O)NCCO Amb19373399 [0,2,0,0,0,0|1,0,0]=3 8189 B13R1.674 Nc1ccccc1C(=O)NCCS Amb24373214 [0,2,0,0,0,0|1,0,0]=3 8190 B13R1.674 O=C(NCCBr)C1=CNC=CC1=O Amb25047039 [0,2,0,0,0,0|2,0,0]=4 8191 B13R1.674 O=C(NCCBr)c1cc[n]cc1Br Amb24726772 [0,2,0,0,0,0|2,0,0]=4 8192 B13R1.674 O=C(NCCBr)c1cc[n]cc1Cl Amb25738964 [0,2,0,0,0,0|2,0,0]=4 8193 B13R1.674 O=C(NCCCl)C1=CNC=CC1=O Amb25732168 [0,2,0,0,0,0|2,0,0]=4 8194 B13R1.674 O=C(NCCCl)c1[n]cccc1Br Amb24424327 [0,2,0,0,0,0|2,0,0]=4 8195 B13R1.674 O=C(NCCCl)c1cc[n]cc1Br Amb24553007 [0,2,0,0,0,0|2,0,0]=4 8196 B13R1.674 O=C(NCCCl)c1ccccc1I Amb25738760 [0,2,0,0,0,0|1,0,0]=3 8197 B13R1.674 O=C(NCCF)C1=CNC=CC1=O Amb25304867 [0,2,0,0,0,0|2,0,0]=4 8198 B13R1.674 O=C(NCCF)c1[n]cccc1Cl Amb25131044 [0,2,0,0,0,0|2,0,0]=4 8199 B13R1.674 O=C(NCCF)c1c[n]ccc1Cl Amb25753274 [0,2,0,0,0,0|2,0,0]=4 8200 B13R1.674 O=C(NCCF)c1cc[n]cc1Cl Amb24530016 [0,2,0,0,0,0|2,0,0]=4 8201 B13R1.674 O=C(NCCF)c1ccccc1Cl Amb25663581 [0,2,0,0,0,0|1,0,0]=3 8202 B13R1.674 O=C(NCCF)c1ccccc1F Amb25111422 [0,2,0,0,0,0|1,0,0]=3 8203 B13R1.674 O=C(NCCI)c1cc[n]cc1Cl Amb25034384 [0,2,0,0,0,0|2,0,0]=4 8204 B13R1.674 O=C(NCCI)c1cc[n]cc1F Amb25280345 [0,2,0,0,0,0|2,0,0]=4 8205 B13R1.674 O=C(NCCI)c1ccccc1Br Amb25849849 [0,2,0,0,0,0|1,0,0]=3 8206 B13R1.674 O=C(NCCI)c1ccccc1F Amb25717223 [0,2,0,0,0,0|1,0,0]=3 8207 B13R1.674 O=C(NCCI)c1ccccc1I Amb24644527 [0,2,0,0,0,0|1,0,0]=3 8208 B13R1.674 O=C(NCCS)c1ccccc1Br Amb25712739 [0,2,0,0,0,0|1,0,0]=3 8209 B13R1.674 O=C(NCCS)c1ccccc1Cl Amb24352076 [0,2,0,0,0,0|1,0,0]=3 8210 B13R1.674 O=C(NCCS)c1ccccc1I Amb25728932 [0,2,0,0,0,0|1,0,0]=3 8211 B13R1.674 O=CCNC(=O)c1ccccc1Br Amb17102072 [0,2,0,0,0,0|1,0,1]=4 8212 B13R1.674 O=CCNC(=O)c1ccccc1C Amb17102066 [0,2,0,0,0,0|1,0,1]=4 8213 B13R1.674 O=CCNC(=O)c1ccccc1Cl Amb17102103 [0,2,0,0,0,0|1,0,1]=4 8214 B13R1.674 O=CCNC(=O)c1ccccc1F Amb17102069 [0,2,0,0,0,0|1,0,1]=4 8215 B13R1.674 OCCNC(=O)C1=CNC=CC1=O Amb24687716 [0,2,0,0,0,0|2,0,0]=4 8216 B13R1.674 OCCNC(=O)c1ccc[n]c1Cl Amb18333894 [0,2,0,0,0,0|2,0,0]=4 8217 B13R1.674 OCCNC(=O)c1ccc[n]c1F Amb25838919 [0,2,0,0,0,0|2,0,0]=4 8218 B13R1.674 OCCNC(=O)c1ccc[n]c1I Amb25722733 [0,2,0,0,0,0|2,0,0]=4 8219 B13R1.674 OCCNC(=O)c1ccccc1O Amb2445040 [0,2,0,0,0,0|1,0,0]=3 8220 B13R1.674 Oc1c[n]ccc1C(=O)NCCCl Amb25850775 [0,2,0,0,0,0|2,0,0]=4 8221 B13R1.674 Oc1c[n]ccc1C(=O)NCCF Amb25111423 [0,2,0,0,0,0|2,0,0]=4 8222 B13R1.674 Oc1c[n]ccc1C(=O)NCCI Amb25063433 [0,2,0,0,0,0|2,0,0]=4 8223 B13R1.674 Oc1c[n]ccc1C(=O)NCCO Amb25832816 [0,2,0,0,0,0|2,0,0]=4 8224 B13R1.674 Oc1ccc[n]c1C(=O)NCCO Amb18181544 [0,2,0,0,0,0|2,0,0]=4 8225 B13R1.674 Oc1ccccc1C(=O)NCCBr Amb25173673 [0,2,0,0,0,0|1,0,0]=3 8226 B13R1.86 CCC(=C=C)C(=O)c1ccccc1 Amb24492628 [0,2,0,0,0,0|1,0,0]=3 8227 B13R1.86 CCC(C(=O)c1ccccc1)NC Amb17621424 [0,2,0,0,0,0|1,0,0]=3 8228 B13R1.86 CCC(C=O)=C(Cl)c1ccccc1 Amb24065131 [0,2,0,0,0,0|2,0,0]=4 8229 B13R1.86 CC\C(=C\O)\C(=O)c1ccccc1 Amb24621310 [0,2,0,0,0,0|1,0,0]=3 8230 B13R1.86 CC\C(=N\O)\C(=O)c1cc[n]cc1 Amb25096715 [0,2,0,0,0,0|2,0,0]=4 8231 B13R1.86 CC\C(=N\O)\C(=O)c1cccc[n]1 Amb25103419 [0,2,0,0,0,0|2,0,0]=4 8232 B13R1.86 CC\C(=N\O)\C(=O)c1ccccc1 Amb25125706 [0,2,0,0,0,0|1,0,0]=3 8233 B13R1.86 CC\C(\C#N)=C(\Cl)/c1ccccc1 Amb24717582 [0,2,0,0,0,0|2,0,0]=4 8234 B13R1.86 CC\C(\C=O)=C(/Cl)\c1ccccc1 Amb25055867 [0,2,0,0,0,0|2,0,0]=4 8235 B13R1.86 CC\C(\C=O)=C(\N)/c1ccccc1 Amb25178990 [0,2,0,0,0,0|2,0,0]=4 8236 B13R1.86 COC(C(=O)c1ccccc1)OC Amb10559989 [0,2,0,0,0,0|2,0,0]=4 8237 B13R1.86 COP(OC)C(=O)c1ccccc1 Amb17778335 [0,2,0,0,0,0|2,0,0]=4 8238 B13R1.86 CSC(SC)C(=O)c1ccccc1 Amb22470038 [0,2,0,0,0,0|2,0,0]=4 8239 B13R1.86 C\C(\c1ccccc1)=C(\CC)/C=O Amb18127296 [0,2,0,0,0,0|2,0,0]=4 8240 B13R1.86 C\C=C(/CCl)\C(=O)c1ccccc1 Amb24627053 [0,2,0,0,0,0|1,0,1]=4 8241 B13R1.86 C\C=C(\C#N)/C(=O)c1ccccc1 Amb25179683 [0,2,0,0,0,0|1,0,1]=4 8242 B13R1.86 C\C=C(\CC)/C(=O)c1ccc[n]c1 Amb25302488 [0,2,0,0,0,0|2,0,0]=4 8243 B13R1.86 C\C=C(\CC)/C(=O)c1ccccc1 Amb25808039 [0,2,0,0,0,0|1,0,0]=3 8244 B13R1.86 C\N=C(/OC)\C(=O)c1ccccc1 Amb25231295 [0,2,0,0,0,0|2,0,0]=4 8245 B13R1.86 OC\C(=N/O)\C(=O)c1ccccc1 Amb24529693 [0,2,0,0,0,0|2,0,0]=4 8246 B13R1.86 OC\C(=N\O)\C(=O)c1ccccc1 Amb24580362 [0,2,0,0,0,0|2,0,0]=4 8247 B13R1.152 CC(=C)C(C)C(=O)c1ccccc1 Amb24492636 [0,2,0,0,0,0|1,0,1]=4 8248 B13R1.152 CC(=O)C(=O)C(=O)c1ccccc1 Amb25092958 [0,2,0,0,0,0|1,0,1]=4 8249 B13R1.152 CC(=O)C(Cl)C(=O)c1ccccc1 Amb25210855 [0,2,0,0,0,0|1,0,1]=4 8250 B13R1.152 CC(=O)C(F)C(=O)c1ccccc1 Amb25816142 [0,2,0,0,0,0|1,0,1]=4 8251 B13R1.152 CC(=O)C(O)C(=O)c1ccccc1 Amb24467013 [0,2,0,0,0,0|1,0,1]=4 8252 B13R1.152 CC(=O)N(O)C(=O)c1ccccc1 Amb24073570 [0,2,0,0,0,0|1,0,1]=4 8253 B13R1.152 CC(=O)[C@@H](C)C(=O)c1ccccc1 Amb25729157 [0,2,0,0,0,0|1,0,1]=4 8254 B13R1.152 CC(C(=O)C(=O)c1ccccc1)C Amb17400548 [0,2,0,0,0,0|1,0,0]=3 8255 B13R1.152 CC(C(=O)c1ccccc1)C(Cl)C Amb17595208 [0,2,0,0,0,0|1,0,0]=3 8256 B13R1.152 CC(C(=O)c1ccccc1)N(C)C Amb17613282 [0,2,0,0,0,0|2,0,0]=4 8257 B13R1.152 CC(C(=O)c1ccccc1)S(C)=O Amb24468966 [0,2,0,0,0,0|2,0,0]=4 8258 B13R1.152 CC(C(C)N)C(=O)c1ccccc1 Amb25155668 [0,2,0,0,0,0|1,0,0]=3 8259 B13R1.152 CC(C(C)O)C(=O)c1ccccc1 Amb24645443 [0,2,0,0,0,0|1,0,0]=3 8260 B13R1.152 CC(C(C)O)S(=O)c1ccccc1 Amb24672634 [0,2,0,0,0,0|2,0,0]=4 8261 B13R1.152 CC(C)=C(Br)C(=O)c1ccccc1 Amb25670796 [0,2,0,0,0,0|1,0,1]=4 8262 B13R1.152 CC(C)C(=O)C(=C)c1ccccc1 Amb24448985 [0,2,0,0,0,0|2,0,0]=4 8263 B13R1.152 CC(C)C(=O)C(=O)c1c[n]ccc1 Amb25689081 [0,2,0,0,0,0|2,0,0]=4 8264 B13R1.152 CC(C)C(=O)C(=O)c1cccc[n]1 Amb25099022 [0,2,0,0,0,0|2,0,0]=4 8265 B13R1.152 CC(C)C(C)C(=O)c1cc[n]cc1 Amb24504524 [0,2,0,0,0,0|2,0,0]=4 8266 B13R1.152 CC(C)C(C)C(=O)c1ccc[n]c1 Amb24368409 [0,2,0,0,0,0|2,0,0]=4 8267 B13R1.152 CC(C)C(C)C(=O)c1cccc[n]1 Amb24693295 [0,2,0,0,0,0|2,0,0]=4 8268 B13R1.152 CC(C)C(C)C(=O)c1ccccc1 Amb25100222 [0,2,0,0,0,0|1,0,0]=3 8269 B13R1.152 CC(C)C(Cl)C(=O)c1ccccc1 Amb18330794 [0,2,0,0,0,0|1,0,0]=3 8270 B13R1.152 CC(C)C(N)C(=C)c1ccccc1 Amb23536655 [0,2,0,0,0,0|2,0,0]=4 8271 B13R1.152 CC(C)C(N)C(=O)c1c[n]ccc1 Amb18065778 [0,2,0,0,0,0|2,0,0]=4 8272 B13R1.152 CC(C)C(N)C(=O)c1cc[n]cc1 Amb18065781 [0,2,0,0,0,0|2,0,0]=4 8273 B13R1.152 CC(C)C(N)C(=O)c1cccc[n]1 Amb18065775 [0,2,0,0,0,0|2,0,0]=4 8274 B13R1.152 CC(C)C(O)C(=O)c1ccccc1 Amb24395847 [0,2,0,0,0,0|1,0,0]=3 8275 B13R1.152 CC(C)[C@H](C)C(=O)c1ccccc1 Amb24492540 [0,2,0,0,0,0|1,0,0]=3 8276 B13R1.152 CC(C)[C@H](N)C(=C)c1ccccc1 Amb24699383 [0,2,0,0,0,0|2,0,0]=4 8277 B13R1.152 CC(C)[C@H](N)C(=O)c1ccccc1 Amb24710106 [0,2,0,0,0,0|1,0,0]=3 8278 B13R1.152 CC(C)[C@H](O)C(=C)c1ccccc1 Amb25792362 [0,2,0,0,0,0|2,0,0]=4 8279 B13R1.152 CC(C)[C@H](O)C(=O)c1ccccc1 Amb25322863 [0,2,0,0,0,0|1,0,0]=3 8280 B13R1.152 CC(O)C(N)C(=O)c1ccccc1 Amb24106078 [0,2,0,0,0,0|1,0,0]=3 8281 B13R1.152 CC([C@H](C)O)C(=O)c1ccccc1 Amb25767065 [0,2,0,0,0,0|1,0,0]=3 8282 B13R1.152 CN(C(=O)C(=O)c1ccccc1)C Amb17335166 [0,2,0,0,0,0|2,0,0]=4 8283 B13R1.152 CN(C(C)C)C(=O)c1ccc[n]c1 Amb25741215 [0,2,0,0,0,0|2,0,0]=4 8284 B13R1.152 CN(C(C)C)C(=O)c1cccc[n]1 Amb25668640 [0,2,0,0,0,0|2,0,0]=4 8285 B13R1.152 CN(C(C)C)C(=O)c1ccccc1 Amb25236698 [0,2,0,0,0,0|1,0,0]=3 8286 B13R1.152 CN(C(F)F)C(=O)c1ccccc1 Amb24072675 [0,2,0,0,0,0|2,0,0]=4 8287 B13R1.152 CN(C)[C@H](C)C(=O)c1ccccc1 Amb24690735 [0,2,0,0,0,0|2,0,0]=4 8288 B13R1.152 CS(=O)C(Cl)C(=O)c1ccccc1 Amb24104244 [0,2,0,0,0,0|2,0,0]=4 8289 B13R1.152 C[C@@H](O)C(=C)S(=O)c1ccccc1 Amb25670559 [0,2,0,0,0,0|2,0,0]=4 8290 B13R1.152 C[C@@H]([C@H](C)O)C(=O)c1ccccc1 Amb24686493 [0,2,0,0,0,0|1,0,0]=3 8291 B13R1.152 C[C@H](O)C(=C)S(=O)c1ccccc1 Amb24415015 [0,2,0,0,0,0|2,0,0]=4 8292 B13R1.152 C[C@H](O)\C(\C)=C(\C)/c1ccccc1 Amb24431853 [0,2,0,0,0,0|2,0,0]=4 8293 B13R1.152 C[C@H]([C@@H](C)O)S(=O)c1ccccc1 Amb24456968 [0,2,0,0,0,0|2,0,0]=4 8294 B13R1.152 C[C@H]([C@H](C)O)C(=O)c1ccccc1 Amb25050240 [0,2,0,0,0,0|1,0,0]=3 8295 B13R1.152 C[C@H]([C@H](C)O)S(=O)c1ccccc1 Amb25670538 [0,2,0,0,0,0|2,0,0]=4 8296 B13R1.152 C\C(\C(=O)c1ccccc1)=C(/C)\F Amb25768495 [0,2,0,0,0,0|1,0,1]=4 8297 B13R1.152 C\C(\C(=O)c1ccccc1)=C(/C)\N Amb25798281 [0,2,0,0,0,0|1,0,1]=4 8298 B13R1.152 C\C(\C(=O)c1ccccc1)=C(/C)\O Amb25128952 [0,2,0,0,0,0|1,0,1]=4 8299 B13R1.152 C\C(\C(=O)c1ccccc1)=C(\C)/F Amb25116521 [0,2,0,0,0,0|1,0,1]=4 8300 B13R1.152 C\C(\C(=O)c1ccccc1)=C(\C)/O Amb24378973 [0,2,0,0,0,0|1,0,1]=4 8301 B13R1.152 C\C(\N)=C(\Cl)/C(=O)c1ccccc1 Amb24557737 [0,2,0,0,0,0|1,0,1]=4 8302 B13R1.152 NC(C(=O)c1ccccc1)C(C)C Amb17138821 [0,2,0,0,0,0|1,0,0]=3 8303 B13R1.152 O=C(C(=C)C(=O)C)c1ccccc1 Amb17594383 [0,2,0,0,0,0|1,0,1]=4 8304 B13R1.263 CC(C)(CC)C(=O)c1cccc[n]1 Amb24526598 [0,2,0,0,0,0|2,0,0]=4 8305 B13R1.263 CC(C)(CCl)C(=O)c1ccccc1 Amb24684140 [0,2,0,0,0,0|2,0,0]=4 8306 B13R1.263 CC(C)(CN)C(=O)c1ccccc1 Amb25065180 [0,2,0,0,0,0|2,0,0]=4 8307 B13R1.263 CC(C)(SC)C(=O)c1ccccc1 Amb24465677 [0,2,0,0,0,0|2,0,0]=4 8308 B13R1.263 CC(N)(CC)C(=O)c1ccc[n]c1 Amb25809612 [0,2,0,0,0,0|2,0,0]=4 8309 B13R1.263 CC(N)(CC)C(=O)c1ccccc1 Amb25298608 [0,2,0,0,0,0|1,0,0]=3 8310 B13R1.263 CC(O)(CC)C(=O)c1ccccc1 Amb24577783 [0,2,0,0,0,0|1,0,0]=3 8311 B13R1.263 CCC(Cl)(Cl)C(=O)c1ccccc1 Amb22734940 [0,2,0,0,0,0|1,0,0]=3 8312 B13R1.263 CCC(O)(Cl)C(=O)c1ccccc1 Amb24104250 [0,2,0,0,0,0|1,0,0]=3 8313 B13R1.263 COP([O-])(=O)C(=O)c1ccccc1 Amb22489036 [0,2,0,0,0,0|2,0,0]=4 8314 B13R1.263 OCC(Cl)(Cl)C(=O)c1ccccc1 Amb24531904 [0,2,0,0,0,0|2,0,0]=4 8315 B13R1.696 C=C(CO)C(=O)c1ccccc1Cl Amb24448118 [0,2,0,0,0,0|2,0,0]=4 8316 B13R1.696 CC(CO)C(=O)c1ccccc1O Amb18128604 [0,2,0,0,0,0|2,0,0]=4 8317 B13R1.696 CCC(C)C(=O)c1[n]cccc1Br Amb25690022 [0,2,0,0,0,0|2,0,0]=4 8318 B13R1.696 CCC(C)C(=O)c1[n]cccc1Cl Amb24496479 [0,2,0,0,0,0|2,0,0]=4 8319 B13R1.696 CCC(C)C(=O)c1c[n]ccc1N Amb24469649 [0,2,0,0,0,0|2,0,0]=4 8320 B13R1.696 CCC(C)C(=O)c1cc[n]cc1Br Amb24595196 [0,2,0,0,0,0|2,0,0]=4 8321 B13R1.696 CCC(C)C(=O)c1ccccc1Cl Amb25315925 [0,2,0,0,0,0|1,0,0]=3 8322 B13R1.696 CCC(C)C(=O)c1ccccc1I Amb25354373 [0,2,0,0,0,0|1,0,0]=3 8323 B13R1.696 CCC(C)C(=O)c1ccccc1N Amb18127955 [0,2,0,0,0,0|1,0,0]=3 8324 B13R1.696 CCC(C)C(=O)c1ccccc1O Amb18128176 [0,2,0,0,0,0|1,0,0]=3 8325 B13R1.696 CCC(C)S(=O)c1ccccc1N Amb18977317 [0,2,0,0,0,0|2,0,0]=4 8326 B13R1.696 CCC(Cl)C(=O)c1ccccc1Cl Amb25052228 [0,2,0,0,0,0|1,0,0]=3 8327 B13R1.696 CCC(Cl)C(=O)c1ccccc1F Amb24520628 [0,2,0,0,0,0|1,0,0]=3 8328 B13R1.696 CCC(N)C(=O)c1c[n]ccc1N Amb25694477 [0,2,0,0,0,0|2,0,0]=4 8329 B13R1.696 CCC(N)C(=O)c1ccccc1Br Amb18156123 [0,2,0,0,0,0|1,0,0]=3 8330 B13R1.696 CCC(N)C(=O)c1ccccc1Cl Amb18188150 [0,2,0,0,0,0|1,0,0]=3 8331 B13R1.696 CCC(N)C(=O)c1ccccc1F Amb18193156 [0,2,0,0,0,0|1,0,0]=3 8332 B13R1.696 CCC(O)C(=O)c1ccccc1Cl Amb24496138 [0,2,0,0,0,0|1,0,0]=3 8333 B13R1.696 CCN(C)C(=O)C1=CNC=CC1=O Amb24408580 [0,2,0,0,0,0|2,0,0]=4 8334 B13R1.696 CCN(O)C(=O)c1[n]cccc1Br Amb25248127 [0,2,0,0,0,0|2,0,0]=4 8335 B13R1.696 CCN(O)C(=O)c1ccc[n]c1F Amb24617645 [0,2,0,0,0,0|2,0,0]=4 8336 B13R1.696 CN(CC)C(=O)c1[n]cccc1O Amb18181064 [0,2,0,0,0,0|2,0,0]=4 8337 B13R1.696 CN(CC)C(=O)c1c[n]ccc1Cl Amb25084644 [0,2,0,0,0,0|2,0,0]=4 8338 B13R1.696 CN(CC)C(=O)c1ccc[n]c1Br Amb24450535 [0,2,0,0,0,0|2,0,0]=4 8339 B13R1.696 CN(CC)C(=O)c1ccc[n]c1I Amb25130145 [0,2,0,0,0,0|2,0,0]=4 8340 B13R1.696 CN(CC)C(=O)c1ccc[n]c1N Amb18284836 [0,2,0,0,0,0|2,0,0]=4 8341 B13R1.696 CN(CC)C(=O)c1ccc[n]c1O Amb25725130 [0,2,0,0,0,0|2,0,0]=4 8342 B13R1.696 CN(CC)C(=O)c1ccccc1Cl Amb24557133 [0,2,0,0,0,0|1,0,0]=3 8343 B13R1.696 CN(CC)C(=O)c1ccccc1F Amb18179018 [0,2,0,0,0,0|1,0,0]=3 8344 B13R1.696 CN(CC)C(=O)c1ccccc1S Amb25740468 [0,2,0,0,0,0|1,0,0]=3 8345 B13R1.696 CN(OC)C(=O)c1ccccc1Br Amb20673759 [0,2,0,0,0,0|2,0,0]=4 8346 B13R1.696 CN(OC)C(=O)c1ccccc1I Amb20684718 [0,2,0,0,0,0|2,0,0]=4 8347 B13R1.696 CN(OC)C(=O)c1ccccc1S Amb25763742 [0,2,0,0,0,0|2,0,0]=4 8348 B13R1.696 CNC(=O)C(=O)c1ccccc1O Amb24410084 [0,2,0,0,0,0|2,0,0]=4 8349 B13R1.696 CNC(C(=O)c1ccccc1C)C Amb17617550 [0,2,0,0,0,0|2,0,0]=4 8350 B13R1.696 CNC(C)C(=O)c1ccccc1Cl Amb25731975 [0,2,0,0,0,0|2,0,0]=4 8351 B13R1.696 CNC(C)C(=O)c1ccccc1F Amb22055293 [0,2,0,0,0,0|2,0,0]=4 8352 B13R1.696 CNC(C)C(=O)c1ccccc1F Amb25228402 [0,2,0,0,0,0|2,0,0]=4 8353 B13R1.696 COC(=O)C(=O)c1ccccc1Br Amb22498290 [0,2,0,0,0,0|2,0,0]=4 8354 B13R1.696 COC(=O)C(=O)c1ccccc1C Amb10562342 [0,2,0,0,0,0|2,0,0]=4 8355 B13R1.696 COC(=O)C(=O)c1ccccc1Cl Amb24054285 [0,2,0,0,0,0|2,0,0]=4 8356 B13R1.696 COC(=O)C(=O)c1ccccc1N Amb23412038 [0,2,0,0,0,0|2,0,0]=4 8357 B13R1.696 COC(=O)C(=O)c1ccccc1O Amb18128546 [0,2,0,0,0,0|2,0,0]=4 8358 B13R1.696 COC(O)C(=O)c1ccccc1F Amb24412906 [0,2,0,0,0,0|2,0,0]=4 8359 B13R1.696 CON(C(=O)c1ccccc1O)C Amb13994033 [0,2,0,0,0,0|2,0,0]=4 8360 B13R1.696 Cc1c[n]ccc1C(=O)C(C)CC Amb25742761 [0,2,0,0,0,0|2,0,0]=4 8361 B13R1.696 Cc1cc[n]cc1C(=O)C(C)CC Amb25777247 [0,2,0,0,0,0|2,0,0]=4 8362 B13R1.696 Cc1ccccc1C(=O)C(=C)CC Amb24357189 [0,2,0,0,0,0|1,0,0]=3 8363 B13R1.696 Cc1ccccc1C(=O)C(=O)NC Amb19650933 [0,2,0,0,0,0|2,0,0]=4 8364 B13R1.696 Cc1ccccc1C(=O)C(C)NC Amb25836669 [0,2,0,0,0,0|2,0,0]=4 8365 B13R1.696 Cc1ccccc1C(=O)C(C)OC Amb25139867 [0,2,0,0,0,0|2,0,0]=4 8366 B13R1.696 Cc1ccccc1C(=O)C(Cl)CC Amb25311526 [0,2,0,0,0,0|1,0,0]=3 8367 B13R1.696 Cc1ccccc1C(=O)C(N)CC Amb18195821 [0,2,0,0,0,0|1,0,0]=3 8368 B13R1.696 Cc1ccccc1C(=O)N(C)CC Amb24473762 [0,2,0,0,0,0|1,0,0]=3 8369 B13R1.696 O=C(C(Br)CBr)c1ccccc1Cl Amb24474173 [0,2,0,0,0,0|2,0,0]=4 8370 B13R1.696 O=C(C(Br)CBr)c1ccccc1F Amb24420829 [0,2,0,0,0,0|2,0,0]=4 8371 B13R1.708 CCN(C)S(=O)(=O)c1ccccc1 Amb24715287 [0,2,0,0,0,0|2,0,0]=4 8372 B13R1.347 CC(C)CS(=O)(=O)c1ccccc1 Amb25099240 [0,2,0,0,0,0|2,0,0]=4 8373 B13R1.347 CC(N)CS(=O)(=O)c1ccccc1 Amb18302093 [0,2,0,0,0,0|2,0,0]=4 8374 B13R1.347 CC(O)CS(=N)(=O)c1ccccc1 Amb25753328 [0,2,0,0,0,0|2,0,0]=4 8375 B13R1.347 CC(O)CS(=O)(=O)c1ccccc1 Amb18316904 [0,2,0,0,0,0|2,0,0]=4 8376 B13R1.347 CC(OS(=O)(=O)c1ccccc1)C Amb17616224 [0,2,0,0,0,0|1,0,0]=3 8377 B13R1.347 C[C@@H](N)CS(=O)(=O)c1ccccc1 Amb25858097 [0,2,0,0,0,0|2,0,0]=4 8378 B13R1.2819 CCCS(=O)(=O)c1ccccc1Br Amb19375513 [0,2,0,0,0,0|2,0,0]=4 8379 B13R1.2819 CCCS(=O)(=O)c1ccccc1Cl Amb19149228 [0,2,0,0,0,0|2,0,0]=4 8380 B13R1.2819 CCCS(=O)(=O)c1ccccc1F Amb25764866 [0,2,0,0,0,0|2,0,0]=4 8381 B13R1.2819 CCNS(=O)(=O)c1ccccc1Br Amb142318 [0,2,0,0,0,0|2,0,0]=4 8382 B13R1.2819 CCNS(=O)(=O)c1ccccc1C Amb17614193 [0,2,0,0,0,0|2,0,0]=4 8383 B13R1.2819 CCNS(=O)(=O)c1ccccc1C Amb17942846 [0,2,0,0,0,0|2,0,0]=4 8384 B13R1.2819 CCNS(=O)(=O)c1ccccc1N Amb1129880 [0,2,0,0,0,0|2,0,0]=4 8385 B13R1.2819 CCNS(=O)(=O)c1ccccc1O Amb18566359 [0,2,0,0,0,0|2,0,0]=4 8386 B13R1.2819 CCOP(O)(=O)c1ccccc1N Amb25770532 [0,2,0,0,0,0|1,0,0]=3 8387 B13R1.2819 CCOS(=O)(=O)c1ccccc1Br Amb22044869 [0,2,0,0,0,0|1,0,0]=3 8388 B13R1.2819 CP(=O)(OCC)c1ccccc1O Amb24676850 [0,2,0,0,0,0|1,0,0]=3 8389 B13R1.2819 Cc1ccccc1S(=O)(=O)CCC Amb19375509 [0,2,0,0,0,0|2,0,0]=4 8390 B13R1.201 CC(=C)CC(=O)c1ccccc1Br Amb18071275 [0,2,0,0,0,0|1,0,1]=4 8391 B13R1.201 CC(=C)CC(=O)c1ccccc1Cl Amb18066344 [0,2,0,0,0,0|1,0,1]=4 8392 B13R1.201 CC(=C)CC(=O)c1ccccc1F Amb18065744 [0,2,0,0,0,0|1,0,1]=4 8393 B13R1.201 CC(=C)CC(=O)c1ccccc1I Amb24643489 [0,2,0,0,0,0|1,0,1]=4 8394 B13R1.201 CC(=C)CC(=O)c1ccccc1N Amb25722555 [0,2,0,0,0,0|1,0,1]=4 8395 B13R1.201 CC(=O)NC(=O)c1ccccc1Br Amb25291358 [0,2,0,0,0,0|1,0,1]=4 8396 B13R1.201 CC(=O)NC(=O)c1ccccc1C Amb24664090 [0,2,0,0,0,0|1,0,1]=4 8397 B13R1.201 CC(=O)NC(=O)c1ccccc1Cl Amb25758002 [0,2,0,0,0,0|1,0,1]=4 8398 B13R1.201 CC(=O)NC(=O)c1ccccc1F Amb18791209 [0,2,0,0,0,0|1,0,1]=4 8399 B13R1.201 CC(=O)NC(=O)c1ccccc1O Amb1983211 [0,2,0,0,0,0|1,0,1]=4 8400 B13R1.201 CC(=O)OC(=O)c1ccccc1O Amb25707001 [0,2,0,0,0,0|0,0,1]=3 8401 B13R1.201 CC(C)=CC(=O)c1ccccc1C Amb24402845 [0,2,0,0,0,0|1,0,1]=4 8402 B13R1.201 CC(C)=CC(=O)c1ccccc1Cl Amb25688716 [0,2,0,0,0,0|1,0,1]=4 8403 B13R1.201 CC(C)=CC(=O)c1ccccc1F Amb25363629 [0,2,0,0,0,0|1,0,1]=4 8404 B13R1.201 CC(C)=CC(=O)c1ccccc1I Amb25132577 [0,2,0,0,0,0|1,0,1]=4 8405 B13R1.201 CC(C)=CC(=O)c1ccccc1N Amb24698168 [0,2,0,0,0,0|1,0,1]=4 8406 B13R1.201 CC(C)=CC(=O)c1ccccc1O Amb25322829 [0,2,0,0,0,0|1,0,1]=4 8407 B13R1.201 CC(C)CC(=O)c1[n]cccc1Cl Amb25694500 [0,2,0,0,0,0|2,0,0]=4 8408 B13R1.201 CC(C)CC(=O)c1[n]cccc1F Amb25180853 [0,2,0,0,0,0|2,0,0]=4 8409 B13R1.201 CC(C)CC(=O)c1cc[n]cc1Cl Amb24078696 [0,2,0,0,0,0|2,0,0]=4 8410 B13R1.201 CC(C)CC(=O)c1ccccc1N Amb18127960 [0,2,0,0,0,0|1,0,0]=3 8411 B13R1.201 CC(C)CS(=O)c1ccccc1N Amb18987643 [0,2,0,0,0,0|2,0,0]=4 8412 B13R1.201 CC(C)NC(=O)c1[n]cccc1Br Amb25310799 [0,2,0,0,0,0|2,0,0]=4 8413 B13R1.201 CC(C)NC(=O)c1[n]cccc1Cl Amb24505724 [0,2,0,0,0,0|2,0,0]=4 8414 B13R1.201 CC(C)NC(=O)c1[n]cccc1N Amb24546969 [0,2,0,0,0,0|2,0,0]=4 8415 B13R1.201 CC(C)NC(=O)c1[n]cccc1O Amb18181063 [0,2,0,0,0,0|2,0,0]=4 8416 B13R1.201 CC(C)NC(=O)c1c[n]ccc1N Amb25107233 [0,2,0,0,0,0|2,0,0]=4 8417 B13R1.201 CC(C)NC(=O)c1cc[n]cc1Br Amb24505713 [0,2,0,0,0,0|2,0,0]=4 8418 B13R1.201 CC(C)NC(=O)c1cc[n]cc1Cl Amb25770454 [0,2,0,0,0,0|2,0,0]=4 8419 B13R1.201 CC(C)NC(=O)c1cc[n]cc1N Amb23571477 [0,2,0,0,0,0|2,0,0]=4 8420 B13R1.201 CC(C)NC(=O)c1ccc[n]c1I Amb24505605 [0,2,0,0,0,0|2,0,0]=4 8421 B13R1.201 CC(C)NC(=O)c1ccc[n]c1N Amb18965358 [0,2,0,0,0,0|2,0,0]=4 8422 B13R1.201 CC(C)NC(=O)c1ccc[n]c1O Amb24416219 [0,2,0,0,0,0|2,0,0]=4 8423 B13R1.201 CC(C)NC(=O)c1ccc[n]c1S Amb24673456 [0,2,0,0,0,0|2,0,0]=4 8424 B13R1.201 CC(C)NC(=O)c1cccc[n+]1[O-] Amb23470929 [0,2,0,0,0,0|2,0,0]=4 8425 B13R1.201 CC(C)NC(=O)c1ccccc1S Amb24490442 [0,2,0,0,0,0|1,0,0]=3 8426 B13R1.201 CC(C)NC(=S)c1ccccc1Cl Amb25054563 [0,2,0,0,0,0|1,1,0]=4 8427 B13R1.201 CC(C)NC(=S)c1ccccc1F Amb25685395 [0,2,0,0,0,0|1,1,0]=4 8428 B13R1.201 CC(C)NC(=S)c1ccccc1N Amb24488804 [0,2,0,0,0,0|1,1,0]=4 8429 B13R1.201 CC(C)OC(=O)c1[n]c[n]cc1Br Amb25848995 [0,2,0,0,0,0|2,0,0]=4 8430 B13R1.201 CC(C)OC(=O)c1[n]cc[n]c1N Amb25690564 [0,2,0,0,0,0|2,0,0]=4 8431 B13R1.201 CC(C)OC(=O)c1[n]cccc1Cl Amb25838467 [0,2,0,0,0,0|1,0,0]=3 8432 B13R1.201 CC(C)OC(=O)c1c[n]ccc1Cl Amb24401290 [0,2,0,0,0,0|1,0,0]=3 8433 B13R1.201 CC(C)OC(=O)c1cc[n]cc1F Amb25338785 [0,2,0,0,0,0|1,0,0]=3 8434 B13R1.201 CC(C)OC(=O)c1cc[n]cc1I Amb25822264 [0,2,0,0,0,0|1,0,0]=3 8435 B13R1.201 CC(C)OC(=O)c1cc[n]cc1O Amb24618948 [0,2,0,0,0,0|1,0,0]=3 8436 B13R1.201 CC(C)OC(=O)c1ccc[n]c1F Amb25038915 [0,2,0,0,0,0|1,0,0]=3 8437 B13R1.201 CC(C)OC(=O)c1ccc[n]c1I Amb24749212 [0,2,0,0,0,0|1,0,0]=3 8438 B13R1.201 CC(C)OC(=O)c1ccc[n]c1O Amb25078517 [0,2,0,0,0,0|1,0,0]=3 8439 B13R1.201 CC(C)OC(=O)c1ccccc1F Amb20236881 [0,2,0,0,0,0|0,0,0]=2 8440 B13R1.201 CC(C)OC(=O)c1ccccc1I Amb25733399 [0,2,0,0,0,0|0,0,0]=2 8441 B13R1.201 CC(C)SC(=O)c1ccccc1N Amb24415303 [0,2,0,0,0,0|0,1,0]=3 8442 B13R1.201 CC(CC(=O)c1ccccc1Br)C Amb17348647 [0,2,0,0,0,0|1,0,0]=3 8443 B13R1.201 CC(CC(=O)c1ccccc1C)C Amb17198736 [0,2,0,0,0,0|1,0,0]=3 8444 B13R1.201 CC(CC(=O)c1ccccc1Cl)C Amb17198753 [0,2,0,0,0,0|1,0,0]=3 8445 B13R1.201 CC(CC(=O)c1ccccc1F)C Amb17198742 [0,2,0,0,0,0|1,0,0]=3 8446 B13R1.201 CC(CC(=O)c1ccccc1O)C Amb17233429 [0,2,0,0,0,0|1,0,0]=3 8447 B13R1.201 CC(Cl)CC(=O)c1ccccc1O Amb24355946 [0,2,0,0,0,0|1,0,0]=3 8448 B13R1.201 CC(N)CC(=O)c1ccc[n]c1N Amb25789693 [0,2,0,0,0,0|2,0,0]=4 8449 B13R1.201 CC(N)CC(=O)c1ccccc1F Amb25093850 [0,2,0,0,0,0|1,0,0]=3 8450 B13R1.201 CC(N)CS(=O)c1ccccc1F Amb24400126 [0,2,0,0,0,0|2,0,0]=4 8451 B13R1.201 CC(NC(=O)c1ccccc1Cl)C Amb2222972 [0,2,0,0,0,0|1,0,0]=3 8452 B13R1.201 CC(O)CS(=O)c1ccccc1N Amb24698148 [0,2,0,0,0,0|2,0,0]=4 8453 B13R1.201 CN(C)CC(=O)c1ccccc1O Amb25160635 [0,2,0,0,0,0|2,0,0]=4 8454 B13R1.201 CN(C)NC(=O)c1ccccc1F Amb25290040 [0,2,0,0,0,0|2,0,0]=4 8455 B13R1.201 CN(C)NC(=O)c1ccccc1N Amb18128461 [0,2,0,0,0,0|2,0,0]=4 8456 B13R1.201 CN(C)NC(=O)c1ccccc1S Amb24386652 [0,2,0,0,0,0|2,0,0]=4 8457 B13R1.201 CS(=O)CC(=O)c1ccccc1Cl Amb25224293 [0,2,0,0,0,0|2,0,0]=4 8458 B13R1.201 CS(=O)CC(=O)c1ccccc1N Amb18130403 [0,2,0,0,0,0|2,0,0]=4 8459 B13R1.201 Cc1[n]c[n]cc1C(=O)OC(C)C Amb25136698 [0,2,0,0,0,0|2,0,0]=4 8460 B13R1.201 Cc1[n]cccc1C(=O)NC(C)C Amb24423835 [0,2,0,0,0,0|2,0,0]=4 8461 B13R1.201 Cc1[n]cccc1C(=O)OC(C)C Amb24441749 [0,2,0,0,0,0|1,0,0]=3 8462 B13R1.201 Cc1c[n]ccc1C(=O)CC(C)C Amb25800010 [0,2,0,0,0,0|2,0,0]=4 8463 B13R1.201 Cc1c[n]ccc1C(=O)NC(C)C Amb24732474 [0,2,0,0,0,0|2,0,0]=4 8464 B13R1.201 Cc1cc[n]cc1C(=O)CC(C)C Amb25776413 [0,2,0,0,0,0|2,0,0]=4 8465 B13R1.201 Cc1ccc[n]c1C(=O)CC(C)C Amb18184172 [0,2,0,0,0,0|2,0,0]=4 8466 B13R1.201 Cc1ccccc1C(=C)CC(C)O Amb24583798 [0,2,0,0,0,0|2,0,0]=4 8467 B13R1.201 Cc1ccccc1C(=N)NC(C)C Amb25854698 [0,2,0,0,0,0|2,0,0]=4 8468 B13R1.201 Cc1ccccc1C(=O)CC(C)=C Amb18065522 [0,2,0,0,0,0|1,0,1]=4 8469 B13R1.201 Cc1ccccc1C(=O)CS(C)=O Amb24697251 [0,2,0,0,0,0|2,0,0]=4 8470 B13R1.201 Cc1ccccc1C(=O)NN(C)C Amb24474654 [0,2,0,0,0,0|2,0,0]=4 8471 B13R1.201 Cc1ccccc1C(=O)OC(C)C Amb25293527 [0,2,0,0,0,0|0,0,0]=2 8472 B13R1.352 CC(C)(C)CC(=O)c1ccc[n]c1 Amb25189937 [0,2,0,0,0,0|2,0,0]=4 8473 B13R1.352 CC(C)(C)NC(=O)c1ccccc1 Amb17730892 [0,2,0,0,0,0|1,0,0]=3 8474 B13R1.352 CC(C)(C)OC(=O)N1C=CCC=C1 Amb24665810 [0,2,0,0,0,0|1,0,1]=4 8475 B13R1.352 CC(C)(C)OC(=O)N1C=COC=C1 Amb22411084 [0,2,0,0,0,0|2,0,0]=4 8476 B13R1.352 CC(C)(C)OC(=O)c1cc[n][n]c1 Amb23403524 [0,2,0,0,0,0|2,0,0]=4 8477 B13R1.352 CC(C)(C)OC(=O)c1cc[n]c[n]1 Amb24679178 [0,2,0,0,0,0|2,0,0]=4 8478 B13R1.352 CC(C)(C)OC(=O)c1ccccc1 Amb22735143 [0,2,0,0,0,0|0,0,0]=2 8479 B13R1.352 CC(C)(C)OC(O)c1ccccc1 Amb24495945 [0,2,0,0,0,0|0,0,2]=4 8480 B13R1.352 CC(C)(C)SC(=S)c1ccccc1 Amb25761214 [0,2,0,0,0,0|0,2,0]=4 8481 B13R1.352 CC(C)(N)CC(=O)c1ccc[n]c1 Amb18195269 [0,2,0,0,0,0|2,0,0]=4 8482 B13R1.352 CC(C)(N)CC(=O)c1ccccc1 Amb18195919 [0,2,0,0,0,0|1,0,0]=3 8483 B13R1.352 CC(F)(F)CC(=O)c1ccccc1 Amb25027745 [0,2,0,0,0,0|1,0,0]=3 8484 B13R1.352 CS(=O)(=O)[CH-]C(=O)c1ccccc1 Amb22462089 [0,2,0,0,0,0|2,0,0]=4 8485 B13R1.352 C[N+](C)(C)NC(=O)c1ccccc1 Amb22450235 [0,2,0,0,0,0|2,0,0]=4 8486 B13R1.352 C[N+](C)(C)[N-]C(=O)c1ccccc1 Amb20659748 [0,2,0,0,0,0|2,0,0]=4 8487 B13R1.352 C[Si](C)(C)OC(=C)c1ccccc1 Amb19894014 [0,2,0,0,0,0|1,1,0]=4 8488 B13R1.352 C[Si](C)(C)OC(=O)c1ccc[n]c1 Amb24102541 [0,2,0,0,0,0|1,1,0]=4 8489 B13R1.352 O=C(OC(F)(F)F)c1cccc[n]1 Amb25225790 [0,2,0,0,0,0|2,0,0]=4 8490 B13R1.352 O=C(OC(F)(F)F)c1ccccc1 Amb25163755 [0,2,0,0,0,0|1,0,0]=3 8491 B13R1.352 O=C([n+]1ccccc1)CC(C)(C)C Amb16203772 [0,2,0,0,0,0|2,0,0]=4 8492 B13R1.352 O=C(c1ccccc1)NS(=O)(=O)C Amb2568897 [0,2,0,0,0,0|2,0,0]=4 8493 B13R1.352 O=C(c1ccccc1)N[Si](C)(C)C Amb10562259 [0,2,0,0,0,0|1,1,0]=4 8494 B13R1.352 O=C(c1cccnc1)OC(C)(C)C Amb10573247 [0,2,0,0,0,0|1,0,0]=3 8495 B13R1.352 OS(=O)(=O)OC(=O)c1ccccc1 Amb25713485 [0,2,0,0,0,0|2,0,0]=4 8496 B13R1.464 CCCC(=O)c1ccccc1C#C Amb24491443 [0,2,0,0,0,0|1,0,0]=3 8497 B13R1.464 CCCC(=O)c1ccccc1C#N Amb25059670 [0,2,0,0,0,0|1,0,0]=3 8498 B13R1.464 CCCC(=O)c1ccccc1OC Amb17198738 [0,2,0,0,0,0|1,0,0]=3 8499 B13R1.464 CCNC(=O)c1[n]cccc1CC Amb24703817 [0,2,0,0,0,0|2,0,0]=4 8500 B13R1.464 CCNC(=O)c1[n]cccc1CO Amb25675291 [0,2,0,0,0,0|2,0,0]=4 8501 B13R1.464 CCNC(=O)c1c[n]ccc1CO Amb25345976 [0,2,0,0,0,0|2,0,0]=4 8502 B13R1.464 CCNC(=O)c1ccccc1C=O Amb25305984 [0,2,0,0,0,0|1,0,0]=3 8503 B13R1.464 CCNC(=O)c1ccccc1CBr Amb17326866 [0,2,0,0,0,0|1,0,0]=3 8504 B13R1.464 CCNC(=O)c1ccccc1CN Amb18909060 [0,2,0,0,0,0|1,0,0]=3 8505 B13R1.464 CCNC(=O)c1ccccc1NN Amb18186371 [0,2,0,0,0,0|1,0,0]=3 8506 B13R1.464 CCNC(=S)c1ccccc1SC Amb24419913 [0,2,0,0,0,0|1,1,0]=4 8507 B13R1.464 CCOC(=O)C1=CC=CNC1=NC Amb20626576 [0,2,0,0,0,0|1,0,0]=3 8508 B13R1.464 CCOC(=O)N1C=CC=CC1C#C Amb24060017 [0,2,0,0,0,0|1,0,1]=4 8509 B13R1.464 CCOC(=O)c1[n]c[n]cc1SC Amb22499289 [0,2,0,0,0,0|2,0,0]=4 8510 B13R1.464 CCOC(=O)c1[n]cc[n]c1C#N Amb18196430 [0,2,0,0,0,0|2,0,0]=4 8511 B13R1.464 CCOC(=O)c1[n]cccc1C#C Amb25135484 [0,2,0,0,0,0|1,0,0]=3 8512 B13R1.464 CCOC(=O)c1[n]cccc1CBr Amb22757334 [0,2,0,0,0,0|1,0,0]=3 8513 B13R1.464 CCOC(=O)c1[n]cccc1CCl Amb22490279 [0,2,0,0,0,0|1,0,0]=3 8514 B13R1.464 CCOC(=O)c1[n]cccc1CO Amb23559757 [0,2,0,0,0,0|1,0,0]=3 8515 B13R1.464 CCOC(=O)c1c[n]c[n]c1C#N Amb18127844 [0,2,0,0,0,0|2,0,0]=4 8516 B13R1.464 CCOC(=O)c1c[n]c[n]c1C=O Amb23454402 [0,2,0,0,0,0|2,0,0]=4 8517 B13R1.464 CCOC(=O)c1c[n]ccc1C#N Amb25285256 [0,2,0,0,0,0|1,0,0]=3 8518 B13R1.464 CCOC(=O)c1c[n]ccc1C=O Amb22500441 [0,2,0,0,0,0|1,0,0]=3 8519 B13R1.464 CCOC(=O)c1c[n]ccc1CBr Amb22276052 [0,2,0,0,0,0|1,0,0]=3 8520 B13R1.464 CCOC(=O)c1c[n]ccc1CBr Amb22497678 [0,2,0,0,0,0|1,0,0]=3 8521 B13R1.464 CCOC(=O)c1c[n]ccc1CCl Amb22751507 [0,2,0,0,0,0|1,0,0]=3 8522 B13R1.464 CCOC(=O)c1c[n]ccc1CO Amb23559758 [0,2,0,0,0,0|1,0,0]=3 8523 B13R1.464 CCOC(=O)c1cc[n]cc1C#N Amb18127619 [0,2,0,0,0,0|1,0,0]=3 8524 B13R1.464 CCOC(=O)c1cc[n]cc1C=O Amb23560771 [0,2,0,0,0,0|1,0,0]=3 8525 B13R1.464 CCOC(=O)c1cc[n]cc1CBr Amb22757345 [0,2,0,0,0,0|1,0,0]=3 8526 B13R1.464 CCOC(=O)c1cc[n]cc1CCl Amb22757353 [0,2,0,0,0,0|1,0,0]=3 8527 B13R1.464 CCOC(=O)c1ccc[n]c1C=O Amb22500674 [0,2,0,0,0,0|1,0,0]=3 8528 B13R1.464 CCOC(=O)c1ccc[n]c1CBr Amb22233963 [0,2,0,0,0,0|1,0,0]=3 8529 B13R1.464 CCOC(=O)c1ccc[n]c1CBr Amb22370833 [0,2,0,0,0,0|1,0,0]=3 8530 B13R1.464 CCOC(=O)c1ccc[n]c1CC Amb24102550 [0,2,0,0,0,0|1,0,0]=3 8531 B13R1.464 CCOC(=O)c1ccc[n]c1CCl Amb22496538 [0,2,0,0,0,0|1,0,0]=3 8532 B13R1.464 CCOC(=O)c1ccc[n]c1CN Amb22728821 [0,2,0,0,0,0|1,0,0]=3 8533 B13R1.464 CCOC(=O)c1ccc[n]c1NN Amb19651456 [0,2,0,0,0,0|1,0,0]=3 8534 B13R1.464 CCOC(=O)c1ccc[n]c1NO Amb24577388 [0,2,0,0,0,0|1,0,0]=3 8535 B13R1.464 CCOC(=O)c1ccccc1C#N Amb16230819 [0,2,0,0,0,0|0,0,0]=2 8536 B13R1.464 CCOC(=O)c1ccccc1CBr Amb10071455 [0,2,0,0,0,0|0,0,0]=2 8537 B13R1.464 CCOC(=O)c1ccccc1CC Amb20621222 [0,2,0,0,0,0|0,0,0]=2 8538 B13R1.464 CCOC(=O)c1ccccc1CI Amb24061261 [0,2,0,0,0,0|0,0,0]=2 8539 B13R1.464 CCOC(=O)c1ccccc1NN Amb24359843 [0,2,0,0,0,0|0,0,0]=2 8540 B13R1.464 CCOC(=O)c1ccccc1SC Amb22371251 [0,2,0,0,0,0|0,0,0]=2 8541 B13R1.464 CCOC(=O)c1ccccc1[N+]#N Amb25141527 [0,2,0,0,0,0|0,0,0]=2 8542 B13R1.464 CCOC(=O)c1cncnc1CC Amb10605042 [0,2,0,0,0,0|2,0,0]=4 8543 B13R1.464 CCOC(=O)c1ncccc1C=O Amb15695355 [0,2,0,0,0,0|1,0,0]=3 8544 B13R1.464 CCc1ccccc1C(=O)NOC Amb25232886 [0,2,0,0,0,0|2,0,0]=4 8545 B13R1.464 CNCC(=O)c1ccccc1OC Amb17233535 [0,2,0,0,0,0|2,0,0]=4 8546 B13R1.464 CNc1[n]cccc1C(=O)NCC Amb18986988 [0,2,0,0,0,0|2,0,0]=4 8547 B13R1.464 CNc1cc[n]cc1C(=O)NCC Amb25068183 [0,2,0,0,0,0|2,0,0]=4 8548 B13R1.464 CNc1ccccc1C(=O)NCC Amb18976972 [0,2,0,0,0,0|1,0,0]=3 8549 B13R1.464 CNc1ccccc1C(=O)NCO Amb24382164 [0,2,0,0,0,0|2,0,0]=4 8550 B13R1.464 CNc1ccccc1C(=O)NOC Amb25257782 [0,2,0,0,0,0|2,0,0]=4 8551 B13R1.464 CNc1ccccc1C(=S)NCC Amb25784601 [0,2,0,0,0,0|1,1,0]=4 8552 B13R1.464 CONC(=O)c1ccccc1OC Amb10704494 [0,2,0,0,0,0|2,0,0]=4 8553 B13R1.464 COc1c[n]ccc1C(=O)OCC Amb23412271 [0,2,0,0,0,0|1,0,0]=3 8554 B13R1.464 COc1cc[n]cc1C(=O)OCC Amb23401164 [0,2,0,0,0,0|1,0,0]=3 8555 B13R1.464 COc1ccc[n]c1C(=O)OCC Amb22490763 [0,2,0,0,0,0|1,0,0]=3 8556 B13R1.464 COc1ccccc1C(=O)CCN Amb18065830 [0,2,0,0,0,0|2,0,0]=4 8557 B13R1.464 COc1ccccc1C(=O)CCO Amb18564123 [0,2,0,0,0,0|2,0,0]=4 8558 B13R1.464 C\C=C\C(=O)c1ccccc1C=O Amb25208969 [0,2,0,0,0,0|1,0,1]=4 8559 B13R1.464 ClCCC(=O)c1ccccc1OC Amb17139722 [0,2,0,0,0,0|2,0,0]=4 8560 B13R1.464 N#Cc1ccccc1C(=O)CCBr Amb24698662 [0,2,0,0,0,0|2,0,0]=4 8561 B13R1.464 SCCC(=O)c1ccccc1OC Amb17402130 [0,2,0,0,0,0|2,0,0]=4 8562 B13R1.464 [C-]#[N+]c1ccccc1C(=O)CCC Amb25735756 [0,2,0,0,0,0|1,0,0]=3 8563 B13R1.464 [C-]#[N+]c1ccccc1C(=O)OCC Amb19928641 [0,2,0,0,0,0|0,0,0]=2 8564 B13R1.4453 CC=1N=CNC(=O)C1C(=O)OCC Amb24724527 [0,2,0,0,0,0|2,0,0]=4 8565 B13R1.4453 CC=1NC=CC(=O)C1C(=O)OCC Amb22736652 [0,2,0,0,0,0|1,0,0]=3 8566 B13R1.4453 CCCC(=O)c1c(C)cccc1C Amb24409436 [0,2,0,0,0,0|1,0,0]=3 8567 B13R1.4453 CCCC(=O)c1c(F)cccc1Cl Amb17198757 [0,2,0,0,0,0|1,0,0]=3 8568 B13R1.4453 CCCC(=O)c1c(N)cccc1F Amb24468803 [0,2,0,0,0,0|1,0,0]=3 8569 B13R1.4453 CCNC(=N)c1c(O)cccc1Cl Amb24372436 [0,2,0,0,0,0|2,0,0]=4 8570 B13R1.4453 CCNC(=O)c1c(Br)cccc1Br Amb25117858 [0,2,0,0,0,0|1,0,0]=3 8571 B13R1.4453 CCNC(=O)c1c(C)cccc1C Amb25039972 [0,2,0,0,0,0|1,0,0]=3 8572 B13R1.4453 CCNC(=O)c1c(C)cccc1N Amb1131711 [0,2,0,0,0,0|1,0,0]=3 8573 B13R1.4453 CCNC(=O)c1c(N)cccc1F Amb25345610 [0,2,0,0,0,0|1,0,0]=3 8574 B13R1.4453 CCNC(=O)c1c(O)cccc1F Amb25044043 [0,2,0,0,0,0|1,0,0]=3 8575 B13R1.4453 CCOC(=N)c1c(C)cccc1C Amb25822007 [0,2,0,0,0,0|1,0,0]=3 8576 B13R1.4453 CCOC(=N)c1c(F)cccc1F Amb24761324 [0,2,0,0,0,0|1,0,0]=3 8577 B13R1.4453 CCOC(=N)c1c(F)cccc1I Amb24750233 [0,2,0,0,0,0|1,0,0]=3 8578 B13R1.4453 CCOC(=N)c1c(O)cccc1Cl Amb25713205 [0,2,0,0,0,0|1,0,0]=3 8579 B13R1.4453 CCOC(=O)C=1C(C)=CCNC1C Amb24736891 [0,2,0,0,0,0|1,0,1]=4 8580 B13R1.4453 CCOC(=O)c1c(Br)[n]ccc1Br Amb23412239 [0,2,0,0,0,0|1,0,0]=3 8581 B13R1.4453 CCOC(=O)c1c(Br)c[n]cc1Br Amb21964000 [0,2,0,0,0,0|1,0,0]=3 8582 B13R1.4453 CCOC(=O)c1c(Br)cccc1Br Amb21857724 [0,2,0,0,0,0|0,0,0]=2 8583 B13R1.4453 CCOC(=O)c1c(C)ccnc1Br Amb17621485 [0,2,0,0,0,0|1,0,0]=3 8584 B13R1.4453 CCOC(=O)c1c(C)ccnc1Cl Amb10604399 [0,2,0,0,0,0|1,0,0]=3 8585 B13R1.4453 CCOC(=O)c1c(C)ncnc1C Amb10071081 [0,2,0,0,0,0|2,0,0]=4 8586 B13R1.4453 CCOC(=O)c1c(Cl)[n]c[n]c1Cl Amb19958012 [0,2,0,0,0,0|2,0,0]=4 8587 B13R1.4453 CCOC(=O)c1c(Cl)[n]ccc1Br Amb22752627 [0,2,0,0,0,0|1,0,0]=3 8588 B13R1.4453 CCOC(=O)c1c(Cl)c[n]cc1Br Amb22752626 [0,2,0,0,0,0|1,0,0]=3 8589 B13R1.4453 CCOC(=O)c1c(Cl)cc[n]c1Br Amb22752625 [0,2,0,0,0,0|1,0,0]=3 8590 B13R1.4453 CCOC(=O)c1c(Cl)cccc1Br Amb22491453 [0,2,0,0,0,0|0,0,0]=2 8591 B13R1.4453 CCOC(=O)c1c(Cl)cccc1I Amb22491455 [0,2,0,0,0,0|0,0,0]=2 8592 B13R1.4453 CCOC(=O)c1c(Cl)ccnc1Cl Amb10975538 [0,2,0,0,0,0|1,0,0]=3 8593 B13R1.4453 CCOC(=O)c1c(F)[n]ccc1Cl Amb24528492 [0,2,0,0,0,0|1,0,0]=3 8594 B13R1.4453 CCOC(=O)c1c(F)[n]ccc1F Amb22495160 [0,2,0,0,0,0|1,0,0]=3 8595 B13R1.4453 CCOC(=O)c1c(F)[n]ccc1I Amb25241680 [0,2,0,0,0,0|1,0,0]=3 8596 B13R1.4453 CCOC(=O)c1c(F)c[n]cc1Br Amb22233967 [0,2,0,0,0,0|1,0,0]=3 8597 B13R1.4453 CCOC(=O)c1c(F)c[n]cc1Cl Amb25764473 [0,2,0,0,0,0|1,0,0]=3 8598 B13R1.4453 CCOC(=O)c1c(F)cccc1Br Amb21964734 [0,2,0,0,0,0|0,0,0]=2 8599 B13R1.4453 CCOC(=O)c1c(N)[n]ccc1Br Amb24501504 [0,2,0,0,0,0|1,0,0]=3 8600 B13R1.4453 CCOC(=O)c1c(N)cc[n]c1Br Amb25686101 [0,2,0,0,0,0|1,0,0]=3 8601 B13R1.4453 CCOC(=O)c1c(N)cc[n]c1Cl Amb23401937 [0,2,0,0,0,0|1,0,0]=3 8602 B13R1.4453 CCOC(=O)c1c(N)cccc1Br Amb21857589 [0,2,0,0,0,0|0,0,0]=2 8603 B13R1.4453 CCOC(=O)c1c(N)cccc1Cl Amb22500214 [0,2,0,0,0,0|0,0,0]=2 8604 B13R1.4453 CCOC(=O)c1c(N)cccc1I Amb24670229 [0,2,0,0,0,0|0,0,0]=2 8605 B13R1.4453 CCOC(=O)c1c(N)cccc1O Amb21857045 [0,2,0,0,0,0|0,0,0]=2 8606 B13R1.4453 CCOC(=O)c1c(N)cncc1Br Amb16185775 [0,2,0,0,0,0|1,0,0]=3 8607 B13R1.4453 CCOC(=O)c1c(O)[n]c[n]c1O Amb22271305 [0,2,0,0,0,0|2,0,0]=4 8608 B13R1.4453 CCOC(=O)c1c(O)[n]ccc1Cl Amb25311489 [0,2,0,0,0,0|1,0,0]=3 8609 B13R1.4453 CCOC(=O)c1c(O)c[n]cc1Br Amb24399411 [0,2,0,0,0,0|1,0,0]=3 8610 B13R1.4453 CCOC(=O)c1c(O)cccc1Cl Amb18653408 [0,2,0,0,0,0|0,0,0]=2 8611 B13R1.4453 CCOC(=O)c1c(O)cccc1F Amb25039389 [0,2,0,0,0,0|0,0,0]=2 8612 B13R1.4453 CCOC(=O)c1c(O)cccc1I Amb24717069 [0,2,0,0,0,0|0,0,0]=2 8613 B13R1.4453 CCOC(=O)c1c(O)cccc1O Amb22351985 [0,2,0,0,0,0|0,0,0]=2 8614 B13R1.4453 CN(OCC)c1c(N)cccc1F Amb25314539 [0,2,0,0,0,0|2,0,0]=4 8615 B13R1.4453 CNCC(=O)c1c(Cl)cccc1Br Amb25845605 [0,2,0,0,0,0|2,0,0]=4 8616 B13R1.4453 CNCC(=O)c1c(F)cccc1Cl Amb25381392 [0,2,0,0,0,0|2,0,0]=4 8617 B13R1.4453 COCC(=O)c1c(Cl)cccc1Cl Amb25339137 [0,2,0,0,0,0|2,0,0]=4 8618 B13R1.4453 COCC(=O)c1c(F)cccc1Br Amb25126498 [0,2,0,0,0,0|2,0,0]=4 8619 B13R1.4453 CONC(=O)c1c(Br)cccc1Br Amb24335182 [0,2,0,0,0,0|2,0,0]=4 8620 B13R1.4453 CONC(=O)c1c(Cl)cccc1I Amb24687850 [0,2,0,0,0,0|2,0,0]=4 8621 B13R1.4453 CONC(=O)c1c(F)cccc1Cl Amb16969947 [0,2,0,0,0,0|2,0,0]=4 8622 B13R1.4453 CONC(=O)c1c(F)cccc1F Amb25336166 [0,2,0,0,0,0|2,0,0]=4 8623 B13R1.4453 CONC(=O)c1c(N)cccc1Cl Amb25740492 [0,2,0,0,0,0|2,0,0]=4 8624 B13R1.4453 CONC(=O)c1c(O)cccc1Cl Amb11561725 [0,2,0,0,0,0|2,0,0]=4 8625 B13R1.4453 CONC(=O)c1c(O)cccc1O Amb25696990 [0,2,0,0,0,0|2,0,0]=4 8626 B13R1.4453 CSCC(=O)c1c(C)cccc1C Amb25825727 [0,2,0,0,0,0|2,0,0]=4 8627 B13R1.4453 CSCC(=O)c1c(Cl)cccc1Br Amb24344491 [0,2,0,0,0,0|2,0,0]=4 8628 B13R1.4453 CSCC(=O)c1c(F)cccc1Cl Amb25688642 [0,2,0,0,0,0|2,0,0]=4 8629 B13R1.4453 C\C=C\C(=O)c1c(C)cccc1C Amb24707038 [0,2,0,0,0,0|1,0,1]=4 8630 B13R1.4453 C\C=C\C(=O)c1c(Cl)cccc1Br Amb25037535 [0,2,0,0,0,0|1,0,1]=4 8631 B13R1.4453 C\C=C\C(=O)c1c(Cl)cccc1Cl Amb24398075 [0,2,0,0,0,0|1,0,1]=4 8632 B13R1.4453 C\C=C\C(=O)c1c(F)cccc1F Amb24667276 [0,2,0,0,0,0|1,0,1]=4 8633 B13R1.4453 Cc1[n]c[n]c(Cl)c1C(=O)OCC Amb22899723 [0,2,0,0,0,0|2,0,0]=4 8634 B13R1.4453 Cc1[n]c[n]c(N)c1C(=O)OCC Amb25819965 [0,2,0,0,0,0|2,0,0]=4 8635 B13R1.4453 Cc1[n]ccc(Br)c1C(=O)OCC Amb22497499 [0,2,0,0,0,0|1,0,0]=3 8636 B13R1.4453 Cc1[n]ccc(Cl)c1C(=O)OCC Amb22728567 [0,2,0,0,0,0|1,0,0]=3 8637 B13R1.4453 Cc1[n]ccc(F)c1C(=O)OCC Amb24601314 [0,2,0,0,0,0|1,0,0]=3 8638 B13R1.4453 Cc1[n]ccc(O)c1C(=O)OCC Amb22491771 [0,2,0,0,0,0|1,0,0]=3 8639 B13R1.4453 Cc1c[n]cc(F)c1C(=O)OCC Amb24737884 [0,2,0,0,0,0|1,0,0]=3 8640 B13R1.4453 Cc1c[n]cc(N)c1C(=O)OCC Amb25122081 [0,2,0,0,0,0|1,0,0]=3 8641 B13R1.4453 Cc1cc[n]c(F)c1C(=O)OCC Amb24753198 [0,2,0,0,0,0|1,0,0]=3 8642 B13R1.4453 Cc1cc[n]c(N)c1C(=O)CCC Amb25063849 [0,2,0,0,0,0|2,0,0]=4 8643 B13R1.4453 Cc1cc[n]c(N)c1C(=O)OCC Amb23438885 [0,2,0,0,0,0|1,0,0]=3 8644 B13R1.4453 Cc1cc[n]c(O)c1C(=O)NCC Amb24343119 [0,2,0,0,0,0|2,0,0]=4 8645 B13R1.4453 Cc1cc[n]c(O)c1C(=O)OCC Amb20247540 [0,2,0,0,0,0|1,0,0]=3 8646 B13R1.4453 Cc1cccc(Br)c1C(=O)CCBr Amb25275376 [0,2,0,0,0,0|2,0,0]=4 8647 B13R1.4453 Cc1cccc(Br)c1C(=O)CCC Amb24746181 [0,2,0,0,0,0|1,0,0]=3 8648 B13R1.4453 Cc1cccc(Br)c1C(=O)COC Amb24459022 [0,2,0,0,0,0|2,0,0]=4 8649 B13R1.4453 Cc1cccc(Br)c1C(=O)OCC Amb23437315 [0,2,0,0,0,0|0,0,0]=2 8650 B13R1.4453 Cc1cccc(Cl)c1C(=O)CCC Amb25741469 [0,2,0,0,0,0|1,0,0]=3 8651 B13R1.4453 Cc1cccc(Cl)c1C(=O)CCCl Amb24741600 [0,2,0,0,0,0|2,0,0]=4 8652 B13R1.4453 Cc1cccc(Cl)c1C(=O)OCC Amb24743186 [0,2,0,0,0,0|0,0,0]=2 8653 B13R1.4453 Cc1cccc(Cl)c1C(=O)\C=C\C Amb24448093 [0,2,0,0,0,0|1,0,1]=4 8654 B13R1.4453 Cc1cccc(F)c1C(=O)CNC Amb24578587 [0,2,0,0,0,0|2,0,0]=4 8655 B13R1.4453 Cc1cccc(F)c1C(=O)NNC Amb25256031 [0,2,0,0,0,0|2,0,0]=4 8656 B13R1.4453 Cc1cccc(F)c1C(=O)OCC Amb22500699 [0,2,0,0,0,0|0,0,0]=2 8657 B13R1.4453 Cc1cccc(I)c1C(=O)CCCl Amb25347652 [0,2,0,0,0,0|2,0,0]=4 8658 B13R1.4453 Cc1cccc(I)c1C(=O)NCC Amb25769039 [0,2,0,0,0,0|1,0,0]=3 8659 B13R1.4453 Cc1cccc(I)c1C(=O)OCC Amb25364178 [0,2,0,0,0,0|0,0,0]=2 8660 B13R1.4453 Cc1cccc(N)c1C(=O)CCBr Amb24536766 [0,2,0,0,0,0|2,0,0]=4 8661 B13R1.4453 Cc1cccc(N)c1C(=O)OCC Amb18976379 [0,2,0,0,0,0|0,0,0]=2 8662 B13R1.4453 Cc1cccc(N)c1N(C)OCC Amb24714879 [0,2,0,0,0,0|2,0,0]=4 8663 B13R1.4453 Cc1cccc(O)c1C(=O)CCBr Amb24527965 [0,2,0,0,0,0|2,0,0]=4 8664 B13R1.4453 Cc1cccc(O)c1C(=O)CCC Amb25815803 [0,2,0,0,0,0|1,0,0]=3 8665 B13R1.4453 Cc1cccc(S)c1C(=O)CCBr Amb25238004 [0,2,0,0,0,0|2,0,0]=4 8666 B13R1.4453 NCCC(=O)c1c(F)cccc1F Amb24460455 [0,2,0,0,0,0|2,0,0]=4 8667 B13R1.4453 Nc1cccc(Cl)c1C(=O)CCCl Amb24639211 [0,2,0,0,0,0|2,0,0]=4 8668 B13R1.4453 Nc1cccc(I)c1C(=O)CCBr Amb25243479 [0,2,0,0,0,0|2,0,0]=4 8669 B13R1.4453 Nc1cccc(O)c1C(=O)CCBr Amb25364490 [0,2,0,0,0,0|2,0,0]=4 8670 B13R1.4453 Nc1cccc(S)c1C(=O)CCBr Amb25350627 [0,2,0,0,0,0|2,0,0]=4 8671 B13R1.4453 O=C(CCBr)c1c(Br)cccc1Br Amb25293951 [0,2,0,0,0,0|2,0,0]=4 8672 B13R1.4453 O=C(CCBr)c1c(Cl)cccc1Br Amb25290982 [0,2,0,0,0,0|2,0,0]=4 8673 B13R1.4453 O=C(CCBr)c1c(Cl)cccc1I Amb25212335 [0,2,0,0,0,0|2,0,0]=4 8674 B13R1.4453 O=C(CCBr)c1c(F)cccc1I Amb25081501 [0,2,0,0,0,0|2,0,0]=4 8675 B13R1.4453 O=C(CCBr)c1c(S)cccc1Cl Amb24697053 [0,2,0,0,0,0|2,0,0]=4 8676 B13R1.4453 O=C(CCCl)c1c(Br)cccc1Br Amb25771928 [0,2,0,0,0,0|2,0,0]=4 8677 B13R1.4453 O=C(CCCl)c1c(F)cccc1F Amb24378546 [0,2,0,0,0,0|2,0,0]=4 8678 B13R1.4453 O=C(CCCl)c1c(F)cccc1I Amb24435517 [0,2,0,0,0,0|2,0,0]=4 8679 B13R1.4453 O=C(CCCl)c1c(S)cccc1Cl Amb25218030 [0,2,0,0,0,0|2,0,0]=4 8680 B13R1.4453 O=C(CCCl)c1c(S)cccc1S Amb25377365 [0,2,0,0,0,0|2,0,0]=4 8681 B13R1.4453 OCNC(=O)c1c(F)cccc1F Amb25772866 [0,2,0,0,0,0|2,0,0]=4 8682 B13R1.4453 Oc1cccc(Cl)c1C(=O)CCCl Amb25696441 [0,2,0,0,0,0|2,0,0]=4 8683 B13R1.4453 Oc1cccc(I)c1C(=O)CCCl Amb25044997 [0,2,0,0,0,0|2,0,0]=4 8684 B13R1.4453 Oc1cccc(O)c1C(=O)CCBr Amb25268616 [0,2,0,0,0,0|2,0,0]=4 8685 B13R1.4453 Oc1cccc(O)c1C(=O)CCCl Amb24616000 [0,2,0,0,0,0|2,0,0]=4 8686 B13R1.4453 Oc1cccc(S)c1C(=O)CCCl Amb25207330 [0,2,0,0,0,0|2,0,0]=4 8687 B11R1.30 CCOC(=O)Cc1c[nH]cc1 Amb24764558 [0,0,1,1,0,0|1,0,1]=4 8688 B11R1.30 CCOC(=O)Cc1ccc[nH]1 Amb17938824 [0,0,1,1,0,0|1,0,1]=4 8689 B11R1.30 CCOC(=O)Cn1cccc1 Amb2236263 [0,0,1,1,0,0|1,0,1]=4 8690 B11R1.30 CCOC(=O)Nc1cc[s]c1 Amb24683773 [0,0,1,1,0,0|2,0,0]=4 8691 B11R1.30 CCOC(=O)Nc1ccc[nH]1 Amb19651842 [0,0,1,1,0,0|2,0,0]=4 8692 B11R1.30 CCOC(=O)Nc1ccco1 Amb24744539 [0,0,1,1,0,0|2,0,0]=4 8693 B11R1.30 CCOC(=O)Nc1cccs1 Amb17935663 [0,0,1,1,0,0|2,0,0]=4 8694 B11R1.30 CCOC(=O)Oc1ccco1 Amb25383238 [0,0,1,1,0,0|2,0,0]=4 8695 B11R1.189 CCCc1cccc(C=C)[n]1 Amb25151665 [0,0,1,1,0,0|2,0,0]=4 8696 B11R1.189 CCNc1cccc(C=C)c1 Amb24486040 [0,0,1,1,0,0|2,0,0]=4 8697 B11R1.189 CCOc1cc(C=C)cc[n]1 Amb25121853 [0,0,1,1,0,0|2,0,0]=4 8698 B11R1.189 CCOc1cc[n]c(C=C)c1 Amb24091484 [0,0,1,1,0,0|2,0,0]=4 8699 B11R1.189 CCOc1cccc(C=C)[n]1 Amb24487079 [0,0,1,1,0,0|1,0,0]=3 8700 B11R1.189 CCOc1cccc(C=C)c1 Amb25151360 [0,0,1,1,0,0|1,0,0]=3 8701 B11R1.189 CCOc1cccc(C=O)[n]1 Amb20669383 [0,0,1,1,0,0|2,0,0]=4 8702 B11R1.5 CCOC1=CC=CC=CC1=O Amb24646912 [0,0,1,1,0,0|2,0,0]=4 8703 B11R1.41 CCNc1[n]cccc1C=C Amb25676251 [0,0,1,1,0,0|2,0,0]=4 8704 B11R1.41 CCNc1ccccc1C=C Amb24745585 [0,0,1,1,0,0|2,0,0]=4 8705 B11R1.41 CCOc1[n]cc[n]c1C=C Amb24085953 [0,0,1,1,0,0|2,0,0]=4 8706 B11R1.41 CCOc1ccc[n]c1C=C Amb25341392 [0,0,1,1,0,0|2,0,0]=4 8707 B11R1.267 CCN1C=CC=C(C=O)C1=O Amb18201746 [0,0,1,1,0,0|2,0,0]=4 8708 B11R1.820 CCOC(=O)C1CC(=C)C1=C Amb24741031 [0,0,1,1,0,0|0,0,2]=4 8709 B11R2.1 BN1CCc2ccccc12 Amb25180693 [1,0,0,1,0,0|2,0,0]=4 8710 B11R2.1 C=C1CCc2ccccc21 Amb24458532 [1,0,0,1,0,0|1,0,0]=3 8711 B11R2.1 CC1=CCc2ccccc12 Amb17778909 [1,0,0,1,0,0|1,0,1]=4 8712 B11R2.1 CN1CCc2c1cccc2 Amb15691717 [1,0,0,1,0,0|2,0,0]=4 8713 B11R2.1 C[SiH]1CCc2ccccc12 Amb24065297 [1,0,0,1,0,0|1,1,0]=4 8714 B11R2.1 Clc1o[n]c2ccccc21 Amb25221266 [1,0,0,1,0,0|2,0,0]=4 8715 B11R2.1 FC1CCc2ccccc21 Amb25311534 [1,0,0,1,0,0|1,0,1]=4 8716 B11R2.1 NC1CCc2c1cccc2 Amb1158023 [1,0,0,1,0,0|1,0,1]=4 8717 B11R2.1 NC1CCc2c1cccc2 Amb16233857 [1,0,0,1,0,0|1,0,1]=4 8718 B11R2.1 NC1CCc2ccccc21 Amb24078253 [1,0,0,1,0,0|1,0,1]=4 8719 B11R2.1 N[C@@H]1CCc2c1cccc2 Amb16233854 [1,0,0,1,0,0|1,0,1]=4 8720 B11R2.1 N[C@H]1CCc2ccccc21 Amb20242239 [1,0,0,1,0,0|1,0,1]=4 8721 B11R2.1 Nc1o[n]c2ccccc21 Amb21857107 [1,0,0,1,0,0|2,0,0]=4 8722 B11R2.1 Nc1occ2ccccc21 Amb24463840 [1,0,0,1,0,0|1,0,1]=4 8723 B11R2.1 O=C1C=Cc2c1cccc2 Amb10603436 [1,0,0,1,0,0|0,0,2]=4 8724 B11R2.1 O=C1CCC=2OC=CCC21 Amb25112642 [1,0,0,1,0,0|1,0,1]=4 8725 B11R2.1 O=C1CCc2[n]c[n]cc21 Amb18832515 [1,0,0,1,0,0|2,0,0]=4 8726 B11R2.1 O=C1CCc2[n]cccc21 Amb22275948 [1,0,0,1,0,0|1,0,0]=3 8727 B11R2.1 O=C1CCc2c1nccc2 Amb10602809 [1,0,0,1,0,0|1,0,0]=3 8728 B11R2.1 O=C1CCc2c[n]ccc21 Amb22235532 [1,0,0,1,0,0|1,0,0]=3 8729 B11R2.1 O=C1CCc2cc[n]cc21 Amb22491415 [1,0,0,1,0,0|1,0,0]=3 8730 B11R2.1 O=C1CN=C2NC=CC=C21 Amb22491902 [1,0,0,1,0,0|2,0,0]=4 8731 B11R2.1 O=C1CNc2c1cccc2 Amb17593399 [1,0,0,1,0,0|1,0,0]=3 8732 B11R2.1 O=C1CNc2c[n]ccc21 Amb25307231 [1,0,0,1,0,0|2,0,0]=4 8733 B11R2.1 O=C1CNc2ccccc21 Amb22899450 [1,0,0,1,0,0|1,0,0]=3 8734 B11R2.1 O=C1COc2[n]cccc21 Amb20242022 [1,0,0,1,0,0|2,0,0]=4 8735 B11R2.1 O=C1COc2c1cccc2 Amb2383539 [1,0,0,1,0,0|1,0,0]=3 8736 B11R2.1 O=C1COc2c[n]ccc21 Amb20242099 [1,0,0,1,0,0|2,0,0]=4 8737 B11R2.1 O=C1COc2c[n]ccc21 Amb22728783 [1,0,0,1,0,0|2,0,0]=4 8738 B11R2.1 O=C1COc2cc[n]cc21 Amb20242098 [1,0,0,1,0,0|2,0,0]=4 8739 B11R2.1 O=C1COc2ccc[n]c21 Amb22372216 [1,0,0,1,0,0|2,0,0]=4 8740 B11R2.1 O=C1CSc2cc[n]cc21 Amb25807909 [1,0,0,1,0,0|2,0,0]=4 8741 B11R2.1 O=C1CSc2ccc[n]c21 Amb24480609 [1,0,0,1,0,0|2,0,0]=4 8742 B11R2.1 O=C1N=Cc2ccccc21 Amb25265062 [1,0,0,1,0,0|1,0,1]=4 8743 B11R2.1 O=C1N=Nc2ccccc21 Amb21928183 [1,0,0,1,0,0|2,0,0]=4 8744 B11R2.1 O=C1NCc2[n]cccc21 Amb21963093 [1,0,0,1,0,0|2,0,0]=4 8745 B11R2.1 O=C1NCc2c[n]ccc21 Amb23455305 [1,0,0,1,0,0|2,0,0]=4 8746 B11R2.1 O=C1NCc2cc[n]cc21 Amb22388464 [1,0,0,1,0,0|2,0,0]=4 8747 B11R2.1 O=C1NCc2ccc[n]c21 Amb22276754 [1,0,0,1,0,0|2,0,0]=4 8748 B11R2.1 O=C1NNc2ccccc21 Amb19514505 [1,0,0,1,0,0|2,0,0]=4 8749 B11R2.1 O=C1NS[13c]2[13cH][13cH][13cH][13cH]c21 Amb19130670 [1,0,0,1,0,0|2,0,0]=4 8750 B11R2.1 O=C1NSc2ccccc21 Amb17933279 [1,0,0,1,0,0|2,0,0]=4 8751 B11R2.1 O=C1OCc2c[n]c[n]c21 Amb24081823 [1,0,0,1,0,0|2,0,0]=4 8752 B11R2.1 O=C1OCc2c[n]ccc21 Amb22234952 [1,0,0,1,0,0|1,0,0]=3 8753 B11R2.1 O=C1OCc2cc[n]cc21 Amb22732365 [1,0,0,1,0,0|1,0,0]=3 8754 B11R2.1 O=C1OCc2ccc[n]c21 Amb24081817 [1,0,0,1,0,0|1,0,0]=3 8755 B11R2.1 O=C1O[Hg]c2ccccc21 Amb22369198 [1,0,0,1,0,0|1,0,0]=3 8756 B11R2.1 O=C1SCc2c1cccc2 Amb2421358 [1,0,0,1,0,0|0,1,0]=3 8757 B11R2.1 O=C1SNc2ccccc21 Amb19416440 [1,0,0,1,0,0|1,1,0]=4 8758 B11R2.1 O=C1SSc2ccccc21 Amb20660516 [1,0,0,1,0,0|1,1,0]=4 8759 B11R2.1 O=S1CNc2ccccc12 Amb24091032 [1,0,0,1,0,0|2,0,0]=4 8760 B11R2.1 O=c1s[nH]c2c1cccc2 Amb1071736 [1,0,0,1,0,0|1,1,0]=4 8761 B11R2.1 OB1OCc2c1cccc2 Amb1027843 [1,0,0,1,0,0|1,0,1]=4 8762 B11R2.1 OC1OCc2ccccc21 Amb21858794 [1,0,0,1,0,0|0,0,2]=4 8763 B11R2.1 O[C@@H]1CCc2c1cccc2 Amb13953023 [1,0,0,1,0,0|0,0,2]=4 8764 B11R2.1 O[C@H]1CCc2c1cccc2 Amb13953022 [1,0,0,1,0,0|0,0,2]=4 8765 B11R2.1 S=C1NCc2ccccc21 Amb24662530 [1,0,0,1,0,0|1,1,0]=4 8766 B11R2.1 Sc1o[n]c2ccccc21 Amb25363518 [1,0,0,1,0,0|1,1,0]=4 8767 B11R2.1 [NH3+]C1=NCc2c1cccc2 Amb2540026 [1,0,0,1,0,0|2,0,0]=4 8768 B11R2.4 CC1CC1c2ccccc2 Amb16236859 [1,0,0,1,0,0|1,0,1]=4 8769 B11R2.4 CC1NC1c2ccccc2 Amb24056775 [1,0,0,1,0,0|1,0,1]=4 8770 B11R2.4 CC1OC1c2ccccc2 Amb1129298 [1,0,0,1,0,0|0,0,2]=4 8771 B11R2.4 C[C@@H]1O[C@H]1c2ccccc2 Amb22367029 [1,0,0,1,0,0|0,0,2]=4 8772 B11R2.4 C[C@H]1O[C@@H]1c2ccccc2 Amb22224838 [1,0,0,1,0,0|0,0,2]=4 8773 B11R2.40 BrC1(CC1)c2ccccc2 Amb24743023 [1,0,0,1,0,0|1,0,1]=4 8774 B11R2.40 CC1(CC1)c2ccccc2 Amb24613075 [1,0,0,1,0,0|1,0,1]=4 8775 B11R2.40 ClC1(CC1)c2ccccc2 Amb17872674 [1,0,0,1,0,0|1,0,1]=4 8776 B11R2.40 NC1(CC1)c2ccccc2 Amb1095038 [1,0,0,1,0,0|1,0,1]=4 8777 B11R2.40 OC1(CC1)c2ccccc2 Amb19374887 [1,0,0,1,0,0|0,0,2]=4 8778 B11R2.54 CC1C(O)c2ccccc21 Amb25686146 [1,0,0,1,0,0|0,0,2]=4 8779 B11R2.54 C[C-]1C(=O)c2cccc[n+]21 Amb24422427 [1,0,0,1,0,0|1,0,1]=4 8780 B11R2.54 O=C1C(Cl)c2ccccc21 Amb21948336 [1,0,0,1,0,0|1,0,0]=3 8781 B11R2.54 O=C1c2ccccc2C1=O Amb18048412 [1,0,0,1,0,0|1,0,1]=4 8782 B11R2.239 C1CC(O1)c2ccccc2 Amb22298601 [1,0,0,1,0,0|0,0,2]=4 8783 B11R2.239 C1CC=C1c2cccc[n]2 Amb24069951 [1,0,0,1,0,0|2,0,0]=4 8784 B11R2.239 C1C[C@@H](O1)c2ccccc2 Amb24479262 [1,0,0,1,0,0|0,0,2]=4 8785 B11R2.239 C1C[C@H](O1)c2ccccc2 Amb25721124 [1,0,0,1,0,0|0,0,2]=4 8786 B11R2.988 CCC1Cc2ccccc21 Amb24647895 [1,0,0,1,0,0|1,0,1]=4 8787 B11R2.988 COC1Cc2ccccc21 Amb24455687 [1,0,0,1,0,0|1,0,1]=4 8788 B11R2.988 NCC1=Cc2ccccc21 Amb24596883 [1,0,0,1,0,0|2,0,0]=4 8789 B11R2.988 OCC1=Cc2c1cccc2 Amb15691967 [1,0,0,1,0,0|2,0,0]=4 8790 B11R2.20 C1=Cc2c(CC1)cccc2 Amb1162229 [1,0,0,1,0,0|1,0,0]=3 8791 B11R2.20 C1=Cc2c(NC1)cccc2 Amb17593383 [1,0,0,1,0,0|2,0,0]=4 8792 B11R2.20 C1CC=Cc2[n]cccc21 Amb25837322 [1,0,0,1,0,0|2,0,0]=4 8793 B11R2.20 C1CC=Cc2c[n]ccc21 Amb25064667 [1,0,0,1,0,0|2,0,0]=4 8794 B11R2.20 C1CCCc2ccccc21 Amb22351371 [1,0,0,1,0,0|1,0,1]=4 8795 B11R2.20 C1CCc2c(N1)cccc2 Amb10072811 [1,0,0,1,0,0|2,0,0]=4 8796 B11R2.20 C1CCc2c(N1)cccc2 Amb1869492 [1,0,0,1,0,0|2,0,0]=4 8797 B11R2.20 C1CCc2c(S1)cccc2 Amb2237019 [1,0,0,1,0,0|2,0,0]=4 8798 B11R2.20 C1CNNc2ccccc21 Amb24564127 [1,0,0,1,0,0|2,0,0]=4 8799 B11R2.20 C1C[NH+]=Cc2ccccc21 Amb23569648 [1,0,0,1,0,0|1,0,0]=3 8800 B11R2.20 C1N=C2C=CC=NC2=CO1 Amb24607302 [1,0,0,1,0,0|2,0,0]=4 8801 B11R2.20 C1N=C2C=CN=CC2=CO1 Amb25097053 [1,0,0,1,0,0|2,0,0]=4 8802 B11R2.20 C1Nc2ccccc2C=N1 Amb25147432 [1,0,0,1,0,0|2,0,0]=4 8803 B11R2.20 C1OCCc2ccc[n]c21 Amb24070918 [1,0,0,1,0,0|1,0,1]=4 8804 B11R2.20 C1OCOc2ccccc21 Amb24066080 [1,0,0,1,0,0|1,0,1]=4 8805 B11R2.20 C1ON=Cc2ccccc21 Amb25217160 [1,0,0,1,0,0|2,0,0]=4 8806 B11R2.20 C1Oc2ccccc2C=C1 Amb17844055 [1,0,0,1,0,0|2,0,0]=4 8807 B11R2.20 C1SC=Cc2ccccc21 Amb25231190 [1,0,0,1,0,0|2,0,0]=4 8808 B11R2.20 C1SCCc2ccccc21 Amb24085482 [1,0,0,1,0,0|0,1,1]=4 8809 B11R2.20 N1CCc2c(C1)cccc2 Amb2383348 [1,0,0,1,0,0|1,0,1]=4 8810 B11R2.20 c1ccc2c(c1)C=NCC2 Amb10603654 [1,0,0,1,0,0|1,0,0]=3 8811 B11R2.20 c1ccc2c(c1)C=[NH+]CC2 Amb10553686 [1,0,0,1,0,0|1,0,0]=3 8812 B11R2.238 C(C1CC1)c2ccccc2 Amb22490220 [1,0,0,1,0,0|1,0,1]=4 8813 B11R2.238 C1CC1=Cc2ccccc2 Amb19515480 [1,0,0,1,0,0|1,0,0]=3 8814 B11R2.238 C1CC1Nc2ccccc2 Amb18270529 [1,0,0,1,0,0|2,0,0]=4 8815 B11R2.2 C1COC(=N1)c2ccc[nH]2 Amb24621841 [0,0,0,1,1,0|2,0,0]=4 8816 B11R2.2 C1COC(=N1)c2ccc[s]2 Amb25085829 [0,0,0,1,1,0|2,0,0]=4 8817 B11R2.106 O=C1CCCC=2C=CCC21 Amb24422545 [0,0,0,1,1,0|1,0,1]=4 8818 B11R2.106 O=C1CCC[n]2cccc21 Amb22372247 [0,0,0,1,1,0|2,0,0]=4 8819 B11R2.106 O=C1CCCc2c1cco2 Amb2427525 [0,0,0,1,1,0|2,0,0]=4 8820 B11R2.106 O=C1CCCc2c[s]cc21 Amb18201211 [0,0,0,1,1,0|2,0,0]=4 8821 B11R2.106 O=C1CCCc2cc[s]c21 Amb18831190 [0,0,0,1,1,0|2,0,0]=4 8822 B11R2.106 O=C1CCCc2ccc[n]21 Amb24093722 [0,0,0,1,1,0|2,0,0]=4 8823 B11R2.106 O=C1CCCc2cocc21 Amb24627983 [0,0,0,1,1,0|2,0,0]=4 8824 B11R2.106 O=C1NCC[n]2cccc21 Amb19957767 [0,0,0,1,1,0|2,0,0]=4 8825 B11R2.106 O=C1NCCc2[nH]ccc21 Amb22490510 [0,0,0,1,1,0|2,0,0]=4 8826 B11R2.106 O=C1NCCc2[s]ccc21 Amb24410984 [0,0,0,1,1,0|2,0,0]=4 8827 B11R2.106 O=C1NCCc2c[nH]cc21 Amb24079555 [0,0,0,1,1,0|2,0,0]=4 8828 B11R2.106 O=C1NCCc2c[s]cc21 Amb18831115 [0,0,0,1,1,0|2,0,0]=4 8829 B11R2.106 O=C1NCCc2cc[nH]c21 Amb18832472 [0,0,0,1,1,0|2,0,0]=4 8830 B11R2.106 O=C1NCCc2cc[s]c21 Amb18831122 [0,0,0,1,1,0|2,0,0]=4 8831 B11R2.106 O=C1NCCc2ccoc21 Amb18832406 [0,0,0,1,1,0|2,0,0]=4 8832 B11R2.106 O=C1NCCc2occc21 Amb23585450 [0,0,0,1,1,0|2,0,0]=4 8833 B11R2.106 O=C1OCC[n]2cccc21 Amb25335418 [0,0,0,1,1,0|1,0,0]=3 8834 B11R2.106 O=C1OCCc2[s]c[n]c21 Amb24079481 [0,0,0,1,1,0|2,0,0]=4 8835 B11R2.202 CC1CC(=O)c2ccc[n]21 Amb25713030 [0,0,0,1,1,0|2,0,0]=4 8836 B11R2.202 CC1NC(=O)c2cc[nH]c21 Amb25249317 [0,0,0,1,1,0|2,0,0]=4 8837 B11R2.1031 O=C(C1CC1)c2cc[nH]c2 Amb18063374 [0,0,0,1,1,0|2,0,0]=4 8838 B11R2.1031 O=C(C1CC1)c2ccc[nH]2 Amb24643635 [0,0,0,1,1,0|2,0,0]=4 8839 B11R2.1031 O=C(C1CC1)c2ccoc2 Amb24502408 [0,0,0,1,1,0|2,0,0]=4 8840 B11R2.1031 O=C(c1cc[nH]c1)N2CC2 Amb24358533 [0,0,0,1,1,0|2,0,0]=4 8841 B11R2.1031 O=C(c1ccc[nH]1)N2CC2 Amb25235470 [0,0,0,1,1,0|2,0,0]=4 8842 B11R2.1031 O=C(c1ccc[s]1)N2CC2 Amb25043175 [0,0,0,1,1,0|2,0,0]=4 8843 B11R2.1031 O=C(c1ccco1)C2CC2 Amb17231892 [0,0,0,1,1,0|2,0,0]=4 8844 B13R2.15 C=C1CCCP1c2ccccc2 Amb25214600 [0,0,0,1,0,1|2,0,0]=4 8845 B13R2.15 FC=1CCCC1c2ccccc2 Amb24100453 [0,0,0,1,0,1|2,0,0]=4 8846 B13R2.15 N=C1OCCC1c2ccccc2 Amb25140934 [0,0,0,1,0,1|1,0,0]=3 8847 B13R2.15 NC1=NCCN1c2ccccc2 Amb1145690 [0,0,0,1,0,1|2,0,0]=4 8848 B13R2.15 O=C1C=CCC1c2ccccc2 Amb24520656 [0,0,0,1,0,1|1,0,1]=4 8849 B13R2.15 O=C1C=CCN1c2ccccc2 Amb25679742 [0,0,0,1,0,1|1,0,1]=4 8850 B13R2.15 O=C1CCC=C1c2ccccc2 Amb24099094 [0,0,0,1,0,1|1,0,1]=4 8851 B13R2.15 O=C1CCCC1c2ccc[n]c2 Amb18797977 [0,0,0,1,0,1|2,0,0]=4 8852 B13R2.15 O=C1CCCC1c2ccccc2 Amb17940271 [0,0,0,1,0,1|1,0,0]=3 8853 B13R2.15 O=C1CCNC1c2ccccc2 Amb18829957 [0,0,0,1,0,1|2,0,0]=4 8854 B13R2.15 O=C1CCNC1c2ccccc2 Amb22901061 [0,0,0,1,0,1|2,0,0]=4 8855 B13R2.15 O=C1CCNN1c2ccccc2 Amb24621860 [0,0,0,1,0,1|2,0,0]=4 8856 B13R2.15 O=C1CNCN1c2ccccc2 Amb24664160 [0,0,0,1,0,1|2,0,0]=4 8857 B13R2.15 O=C1COCC1c2ccccc2 Amb23590154 [0,0,0,1,0,1|2,0,0]=4 8858 B13R2.15 O=C1NCCC1c2cc[n]cc2 Amb25070544 [0,0,0,1,0,1|2,0,0]=4 8859 B13R2.15 O=C1NCCC1c2ccc[n]c2 Amb24393400 [0,0,0,1,0,1|2,0,0]=4 8860 B13R2.15 O=C1NCCC1c2ccccc2 Amb17400090 [0,0,0,1,0,1|1,0,0]=3 8861 B13R2.15 O=C1NCCN1c2ccncc2 Amb2446308 [0,0,0,1,0,1|2,0,0]=4 8862 B13R2.15 O=C1NCSC1c2ccccc2 Amb24600018 [0,0,0,1,0,1|2,0,0]=4 8863 B13R2.15 O=C1OC=NC1c2ccccc2 Amb24661677 [0,0,0,1,0,1|1,0,1]=4 8864 B13R2.15 O=C1OC=NN1c2ccccc2 Amb25688037 [0,0,0,1,0,1|1,0,1]=4 8865 B13R2.15 O=C1OCCC1c2cc[n]cc2 Amb22757401 [0,0,0,1,0,1|1,0,0]=3 8866 B13R2.15 O=C1OCCC1c2ccc[n]c2 Amb22757403 [0,0,0,1,0,1|1,0,0]=3 8867 B13R2.15 O=C1OCCC1c2cccc[n]2 Amb22757402 [0,0,0,1,0,1|1,0,0]=3 8868 B13R2.15 O=C1OCCC1c2ccccc2 Amb10606603 [0,0,0,1,0,1|0,0,0]=2 8869 B13R2.15 O=C1OCCN1c2cc[n]cc2 Amb24364749 [0,0,0,1,0,1|1,0,0]=3 8870 B13R2.15 O=C1OCOC1c2ccccc2 Amb24497607 [0,0,0,1,0,1|1,0,0]=3 8871 B13R2.15 O=C1ON=S=C1c2ccccc2 Amb17836463 [0,0,0,1,0,1|2,0,0]=4 8872 B13R2.15 O=C1SCCN1c2ccccc2 Amb1771171 [0,0,0,1,0,1|0,1,0]=3 8873 B13R2.15 OC1OCCC1c2ccccc2 Amb22752503 [0,0,0,1,0,1|0,0,2]=4 8874 B13R2.15 S=C1NCCC1c2ccccc2 Amb25194723 [0,0,0,1,0,1|1,1,0]=4 8875 B13R2.15 S=C1NCCN1c2ccccc2 Amb16192448 [0,0,0,1,0,1|1,1,0]=4 8876 B13R2.26 CCCC1=Cc2c(C1)cccc2 Amb15692407 [0,0,0,1,0,1|2,0,0]=4 8877 B13R2.26 CCCc1[n]c2ccccc2[s]1 Amb22495672 [0,0,0,1,0,1|1,1,0]=4 8878 B13R2.26 CCCc1cc2ccccc2[nH]1 Amb17939106 [0,0,0,1,0,1|2,0,0]=4 8879 B13R2.26 CCCc1nc2c(o1)cccc2 Amb17570040 [0,0,0,1,0,1|1,0,1]=4 8880 B13R2.26 CCNc1[n]c2ccccc2o1 Amb18281548 [0,0,0,1,0,1|1,0,1]=4 8881 B13R2.26 CCNc1cc2ccccc2o1 Amb24064466 [0,0,0,1,0,1|1,0,1]=4 8882 B13R2.26 CCNc1nc2c(s1)cccc2 Amb1106057 [0,0,0,1,0,1|1,1,0]=4 8883 B13R2.26 CCOC1Nc2ccccc2N1 Amb25700310 [0,0,0,1,0,1|1,0,1]=4 8884 B13R2.26 CCOC1Nc2ccccc2O1 Amb24104389 [0,0,0,1,0,1|0,0,2]=4 8885 B13R2.26 CCOC1Oc2c(O1)cccc2 Amb10562245 [0,0,0,1,0,1|0,0,2]=4 8886 B13R2.26 CCOC=1Cc2ccccc2N1 Amb24408882 [0,0,0,1,0,1|1,0,0]=3 8887 B13R2.26 CCOP1Oc2ccccc2O1 Amb25843794 [0,0,0,1,0,1|1,0,1]=4 8888 B13R2.26 CCOc1[nH]c2c[n]ccc2[n]1 Amb25373629 [0,0,0,1,0,1|2,0,0]=4 8889 B13R2.26 CCOc1[nH]c2ccc[n]c2[n]1 Amb24640316 [0,0,0,1,0,1|2,0,0]=4 8890 B13R2.26 CCOc1cc2ccccc2[nH]1 Amb22750429 [0,0,0,1,0,1|1,0,0]=3 8891 B13R2.26 CCOc1cc2ccccc2o1 Amb24104388 [0,0,0,1,0,1|0,0,1]=3 8892 B13R2.26 CCSc1[nH]c2ccccc2[n]1 Amb22032595 [0,0,0,1,0,1|1,1,0]=4 8893 B13R2.26 CCSc1[n]c2ccccc2o1 Amb25204488 [0,0,0,1,0,1|0,1,1]=4 8894 B13R2.26 CCSc1cc2ccccc2[nH]1 Amb25290226 [0,0,0,1,0,1|1,1,0]=4 8895 B13R2.26 CCSc1nc2c([nH]1)cccc2 Amb1263347 [0,0,0,1,0,1|1,1,0]=4 8896 B13R2.26 CCSc1nc2c([nH]1)cccc2 Amb16205362 [0,0,0,1,0,1|1,1,0]=4 8897 B13R2.26 CCSc1sc2c([nH+]1)cccc2 Amb2459349 [0,0,0,1,0,1|0,2,0]=4 8898 B13R2.26 NCOc1[n]c2ccccc2[s]1 Amb25039196 [0,0,0,1,0,1|1,1,0]=4 8899 B13R2.30 CC1CC(=O)C1c2ccccc2 Amb24449010 [0,0,0,1,0,1|1,0,0]=3 8900 B13R2.30 CC1NC(=O)[C@H]1c2ccccc2 Amb24381390 [0,0,0,1,0,1|1,0,0]=3 8901 B13R2.64 C(C1=CCCN1)c2ccccc2 Amb17938862 [0,0,0,1,0,1|2,0,0]=4 8902 B13R2.64 C(c1ccccc1)C=2CCCC2 Amb24059058 [0,0,0,1,0,1|2,0,0]=4 8903 B13R2.64 C(c1ccccc1)C=2CCCN2 Amb24053775 [0,0,0,1,0,1|2,0,0]=4 8904 B13R2.64 C1CCC(=Cc2ccccc2)C1 Amb10606582 [0,0,0,1,0,1|2,0,0]=4 8905 B13R2.64 C1CCC(Oc2ccccc2)O1 Amb22752483 [0,0,0,1,0,1|1,0,1]=4 8906 B13R2.64 C1CCC=C1Nc2ccccc2 Amb25805974 [0,0,0,1,0,1|2,0,0]=4 8907 B13R2.64 C1CNC(=Nc2ccccc2)N1 Amb1803476 [0,0,0,1,0,1|2,0,0]=4 8908 B13R2.64 C1COC(N1)Cc2ccccc2 Amb17506176 [0,0,0,1,0,1|1,0,1]=4 8909 B13R2.64 C1COC(Nc2ccc[n]c2)=N1 Amb24442387 [0,0,0,1,0,1|2,0,0]=4 8910 B13R2.64 c1ccc(cc1)CC2=NCCO2 Amb2429421 [0,0,0,1,0,1|1,0,0]=3 8911 B13R2.64 c1ccc(cc1)NC2=NCCC2 Amb1286041 [0,0,0,1,0,1|2,0,0]=4 8912 B13R2.135 CC=1Cc2ccccc2C1CC Amb25743495 [0,0,0,1,0,1|2,0,0]=4 8913 B13R2.135 CCC1C(=O)Nc2c[n]ccc21 Amb25060104 [0,0,0,1,0,1|2,0,0]=4 8914 B13R2.135 CCC1C(=O)Nc2ccc[n]c21 Amb24330955 [0,0,0,1,0,1|2,0,0]=4 8915 B13R2.135 CCC1C(=O)Nc2ccccc21 Amb23585468 [0,0,0,1,0,1|1,0,0]=3 8916 B13R2.135 CCC1C(=O)Oc2ccccc21 Amb24103815 [0,0,0,1,0,1|1,0,0]=3 8917 B13R2.135 CCC=1C(=O)CN2C=CC=CC21 Amb25128955 [0,0,0,1,0,1|2,0,0]=4 8918 B13R2.135 CCN1C(=C)Sc2ccccc12 Amb24609038 [0,0,0,1,0,1|2,0,0]=4 8919 B13R2.135 CCN1C(=N)Sc2ccccc12 Amb22655648 [0,0,0,1,0,1|2,0,0]=4 8920 B13R2.135 CCN1C(=O)Cc2c1cccc2 Amb2416954 [0,0,0,1,0,1|1,0,0]=3 8921 B13R2.135 CCN1C(=O)Nc2c[n]ccc12 Amb23454816 [0,0,0,1,0,1|2,0,0]=4 8922 B13R2.135 CCN1C(=O)Nc2cc[n]cc12 Amb21876632 [0,0,0,1,0,1|2,0,0]=4 8923 B13R2.135 CCN1C(=O)Nc2ccccc12 Amb18034265 [0,0,0,1,0,1|1,0,0]=3 8924 B13R2.135 CCN1C(=O)Oc2ccc[n]c12 Amb18407345 [0,0,0,1,0,1|2,0,0]=4 8925 B13R2.135 CCN1C(=O)Oc2ccccc12 Amb17992087 [0,0,0,1,0,1|1,0,0]=3 8926 B13R2.135 CCN1C(=S)Cc2ccccc12 Amb25047655 [0,0,0,1,0,1|1,1,0]=4 8927 B13R2.135 CCN1C(=S)Nc2ccccc12 Amb19866712 [0,0,0,1,0,1|1,1,0]=4 8928 B13R2.135 CC[NH+]1C(N)=Sc2ccccc12 Amb22369086 [0,0,0,1,0,1|2,0,0]=4 8929 B13R2.135 CC[n+]1c(C)sc2c1cccc2 Amb1144526 [0,0,0,1,0,1|2,0,0]=4 8930 B13R2.135 CC[n+]1c(Cl)oc2ccccc12 Amb22347782 [0,0,0,1,0,1|2,0,0]=4 8931 B13R2.135 CC[n+]1c2ccccc2[s]c1F Amb25811539 [0,0,0,1,0,1|2,0,0]=4 8932 B13R2.135 CC[n]1c(Br)[n]c2ccccc12 Amb23557023 [0,0,0,1,0,1|2,0,0]=4 8933 B13R2.135 CCc1c(Br)oc2ccccc21 Amb18754591 [0,0,0,1,0,1|2,0,0]=4 8934 B13R2.135 CCc1c(C)[nH]c2ccccc12 Amb17778659 [0,0,0,1,0,1|2,0,0]=4 8935 B13R2.135 CCc1c(Cl)[nH]c2ccccc21 Amb23441757 [0,0,0,1,0,1|2,0,0]=4 8936 B13R2.135 CCn1c(=S)sc2c1cccc2 Amb10553670 [0,0,0,1,0,1|1,1,0]=4 8937 B13R2.135 CCn1c(C)nc2c1cccc2 Amb2470237 [0,0,0,1,0,1|2,0,0]=4 8938 B13R2.135 CCn1c(I)nc2c1cccc2 Amb10563867 [0,0,0,1,0,1|2,0,0]=4 8939 B13R2.135 CCn1c(S)nc2c1cccc2 Amb1104433 [0,0,0,1,0,1|1,1,0]=4 8940 B13R2.135 CNC1C(=O)Nc2c1cccc2 Amb1113865 [0,0,0,1,0,1|2,0,0]=4 8941 B13R2.135 COC1C(=O)Nc2ccccc21 Amb24648884 [0,0,0,1,0,1|2,0,0]=4 8942 B13R2.135 CON1C(=O)Nc2ccccc12 Amb25368420 [0,0,0,1,0,1|2,0,0]=4 8943 B13R2.135 CSC1C(=O)Nc2ccccc21 Amb24435374 [0,0,0,1,0,1|2,0,0]=4 8944 B13R2.135 C\C=C/1\C(=O)Nc2ccccc21 Amb24487101 [0,0,0,1,0,1|1,0,1]=4 8945 B13R2.135 C\N=C\1/C(=O)Nc2c1cccc2 Amb1042382 [0,0,0,1,0,1|2,0,0]=4 8946 B13R2.135 Cc1[s]c2ccccc2[n+]1CC Amb25722871 [0,0,0,1,0,1|2,0,0]=4 8947 B13R2.135 Cc1oc2ccccc2c1CC Amb24102093 [0,0,0,1,0,1|2,0,0]=4 8948 B13R2.135 ClCn1c(=O)sc2c1cccc2 Amb16205273 [0,0,0,1,0,1|2,0,0]=4 8949 B13R2.135 ClCn1c(=O)sc2c1cccc2 Amb16205816 [0,0,0,1,0,1|2,0,0]=4 8950 B13R2.135 NCC1C(=O)Nc2ccccc21 Amb22001506 [0,0,0,1,0,1|2,0,0]=4 8951 B13R2.135 O=C1Oc2ccccc2N1CCl Amb19773104 [0,0,0,1,0,1|2,0,0]=4 8952 B13R2.135 O=C1Sc2ccccc2N1CCl Amb22337781 [0,0,0,1,0,1|2,0,0]=4 8953 B13R2.135 O=C1Sc2ccccc2N1CCl Amb22358029 [0,0,0,1,0,1|2,0,0]=4 8954 B13R2.135 OCC1C(=O)Nc2ccccc21 Amb24084324 [0,0,0,1,0,1|2,0,0]=4 8955 B13R2.135 OCN1C(=O)Nc2ccccc12 Amb25273874 [0,0,0,1,0,1|2,0,0]=4 8956 B13R2.135 OCN1C(=O)Oc2ccccc12 Amb19806606 [0,0,0,1,0,1|2,0,0]=4 8957 B13R2.135 OCN1C(=O)Sc2ccccc12 Amb21961868 [0,0,0,1,0,1|2,0,0]=4 8958 B13R2.135 OCN1C(=O)Sc2ccccc12 Amb22343799 [0,0,0,1,0,1|2,0,0]=4 8959 B13R2.135 OCn1c(=O)oc2c1cccc2 Amb1006641 [0,0,0,1,0,1|2,0,0]=4 8960 B13R2.135 OCn1c(=O)sc2c1cccc2 Amb16205274 [0,0,0,1,0,1|2,0,0]=4 8961 B13R2.163 BrC=1CCCc2ccccc2C1 Amb25244811 [0,0,0,1,0,1|2,0,0]=4 8962 B13R2.163 NC=1Cc2ccccc2CCN1 Amb22263623 [0,0,0,1,0,1|2,0,0]=4 8963 B13R2.163 O=C1C=CCc2ccccc2N1 Amb24399245 [0,0,0,1,0,1|1,0,1]=4 8964 B13R2.163 O=C1CCCc2c(N1)cccc2 Amb1077569 [0,0,0,1,0,1|1,0,0]=3 8965 B13R2.163 O=C1CCCc2ccc[n]c2N1 Amb21962431 [0,0,0,1,0,1|2,0,0]=4 8966 B13R2.163 O=C1CCCc2ccccc2O1 Amb22900954 [0,0,0,1,0,1|1,0,0]=3 8967 B13R2.163 O=C1CCNc2c(N1)cccc2 Amb1666975 [0,0,0,1,0,1|2,0,0]=4 8968 B13R2.163 O=C1CCNc2ccccc2N1 Amb21857722 [0,0,0,1,0,1|2,0,0]=4 8969 B13R2.163 O=C1CCOc2c(N1)cccc2 Amb10608982 [0,0,0,1,0,1|2,0,0]=4 8970 B13R2.163 O=C1CCSc2c(N1)cccc2 Amb1154582 [0,0,0,1,0,1|2,0,0]=4 8971 B13R2.163 O=C1CNCc2c(N1)cccc2 Amb17606145 [0,0,0,1,0,1|2,0,0]=4 8972 B13R2.163 O=C1COCc2ccccc2N1 Amb19516346 [0,0,0,1,0,1|2,0,0]=4 8973 B13R2.163 O=C1Cc2cc[n]cc2CCC1 Amb25730512 [0,0,0,1,0,1|2,0,0]=4 8974 B13R2.163 O=C1Cc2ccc[n]c2CCC1 Amb25097103 [0,0,0,1,0,1|2,0,0]=4 8975 B13R2.163 O=C1Cc2ccccc2NCC1 Amb18829955 [0,0,0,1,0,1|2,0,0]=4 8976 B13R2.163 O=C1Cc2ccccc2OCC1 Amb24352115 [0,0,0,1,0,1|2,0,0]=4 8977 B13R2.163 O=C1NCCc2c(C1)cccc2 Amb16203437 [0,0,0,1,0,1|1,0,0]=3 8978 B13R2.163 O=C1Nc2ccccc2CCO1 Amb24495939 [0,0,0,1,0,1|0,0,0]=2 8979 B13R2.163 O=C1Oc2ccccc2N=CO1 Amb24376626 [0,0,0,1,0,1|1,0,1]=4 8980 B13R2.163 S=C1Cc2ccccc2CCN1 Amb25826588 [0,0,0,1,0,1|1,1,0]=4 8981 B13R2.328 C=C1OC(=O)Nc2ccccc21 Amb24497158 [0,0,0,1,0,1|0,0,2]=4 8982 B13R2.328 CC1=CC(=O)Nc2ccccc21 Amb19654011 [0,0,0,1,0,1|1,0,1]=4 8983 B13R2.328 CC1=CC(=O)Oc2ccccc21 Amb20001467 [0,0,0,1,0,1|1,0,1]=4 8984 B13R2.328 CC1CC(=N)Nc2ccccc21 Amb24681069 [0,0,0,1,0,1|2,0,0]=4 8985 B13R2.328 CC1CC(=O)N=C2C=CC=CN21 Amb25080115 [0,0,0,1,0,1|2,0,0]=4 8986 B13R2.328 CC1CC(=O)Nc2ccccc12 Amb17836212 [0,0,0,1,0,1|1,0,0]=3 8987 B13R2.328 CC1NC(=O)Cc2cc[n]cc21 Amb25159362 [0,0,0,1,0,1|2,0,0]=4 8988 B13R2.328 CC1NC(=O)Cc2ccccc21 Amb23454628 [0,0,0,1,0,1|1,0,0]=3 8989 B13R2.328 CC1NC(=O)Nc2ccccc21 Amb22756019 [0,0,0,1,0,1|1,0,0]=3 8990 B13R2.328 CC1NC(=O)Oc2ccccc21 Amb25823463 [0,0,0,1,0,1|1,0,0]=3 8991 B13R2.328 CC1NC(=S)Nc2ccccc21 Amb25751539 [0,0,0,1,0,1|1,1,0]=4 8992 B13R2.328 CC1NC(N)=Nc2ccccc21 Amb25106087 [0,0,0,1,0,1|2,0,0]=4 8993 B13R2.328 CC1Nc2ccccc2C(C)O1 Amb25095786 [0,0,0,1,0,1|1,0,1]=4 8994 B13R2.328 CC1OC(=O)Nc2ccccc21 Amb25063171 [0,0,0,1,0,1|0,0,0]=2 8995 B13R2.328 CC1OC(C)c2ccccc2O1 Amb17940033 [0,0,0,1,0,1|1,0,1]=4 8996 B13R2.328 CC1OC(O)Cc2ccccc21 Amb24355171 [0,0,0,1,0,1|0,0,2]=4 8997 B13R2.328 CC=1NC(=O)C=C2C=CC=CC21 Amb22371049 [0,0,0,1,0,1|1,0,1]=4 8998 B13R2.328 CC=1NC(=O)N=C2C=CC=CC21 Amb22493795 [0,0,0,1,0,1|1,0,1]=4 8999 B13R2.328 CN1CC(=O)Nc2ccccc12 Amb21864918 [0,0,0,1,0,1|2,0,0]=4 9000 B13R2.328 CS1=NC(=O)Nc2ccccc12 Amb25372251 [0,0,0,1,0,1|2,0,0]=4 9001 B13R2.328 C[C@@H]1CC(=O)Nc2ccccc21 Amb24445921 [0,0,0,1,0,1|1,0,0]=3 9002 B13R2.328 C[C@H]1CC(=O)Nc2ccccc21 Amb25335663 [0,0,0,1,0,1|1,0,0]=3 9003 B13R2.328 C[C@H]1NC(=O)Cc2ccccc21 Amb25315064 [0,0,0,1,0,1|1,0,0]=3 9004 B13R2.328 NC1CC(=O)Nc2ccccc21 Amb22586933 [0,0,0,1,0,1|2,0,0]=4 9005 B13R2.328 NC1CC(=O)Oc2ccccc21 Amb25249264 [0,0,0,1,0,1|2,0,0]=4 9006 B13R2.328 N[C@@H]1CC(=O)Nc2ccccc21 Amb25766431 [0,0,0,1,0,1|2,0,0]=4 9007 B13R2.328 O=C1CC(C)c2c(C1)cccc2 Amb17594002 [0,0,0,1,0,1|1,0,0]=3 9008 B13R2.328 O=C1CC(N)c2c(N1)cccc2 Amb10607650 [0,0,0,1,0,1|2,0,0]=4 9009 B13R2.328 O=C1OC(=O)Nc2ccccc12 Amb18183505 [0,0,0,1,0,1|1,0,1]=4 9010 B13R2.328 O=C1OC(=O)c2c(C1)cccc2 Amb1157145 [0,0,0,1,0,1|1,0,1]=4 9011 B13R2.328 OC1CC(=O)Cc2ccccc21 Amb24707065 [0,0,0,1,0,1|2,0,0]=4 9012 B13R2.328 OC1NC(=O)Oc2ccccc21 Amb25278301 [0,0,0,1,0,1|2,0,0]=4 9013 B13R2.444 O=C(C1CC1)Nc2cccnc2 Amb2420240 [0,0,0,1,0,1|2,0,0]=4 9014 B13R2.444 O=C(C1CC1)Nc2ccncc2 Amb2420239 [0,0,0,1,0,1|2,0,0]=4 9015 B13R2.444 O=C(Cc1cc[n]cc1)C2CC2 Amb25783505 [0,0,0,1,0,1|2,0,0]=4 9016 B13R2.444 O=C(Cc1ccc[n]c1)C2CC2 Amb24717716 [0,0,0,1,0,1|2,0,0]=4 9017 B13R2.444 O=C(Cc1ccccc1)C2CC2 Amb18034012 [0,0,0,1,0,1|1,0,0]=3 9018 B13R2.444 O=C(Cc1ccccc1)C2CO2 Amb25238359 [0,0,0,1,0,1|2,0,0]=4 9019 B13R2.444 O=C(Nc1ccccc1)C2CO2 Amb24377141 [0,0,0,1,0,1|2,0,0]=4 9020 B13R2.444 O=C(Oc1ccccc1)N2CC2 Amb25801716 [0,0,0,1,0,1|1,0,0]=3 9021 B13R2.4820 O=C1CCCC2=CC=CC=CC21 Amb24736168 [0,0,0,1,0,1|1,0,1]=4 9022 B13R2.4820 O=C1CCCC2=CCC=CC=C21 Amb25751753 [0,0,0,1,0,1|1,0,0]=3 9023 B13R2.14791 CCOC(=O)c1cccc2Nc12 Amb25288580 [0,0,0,1,0,1|0,0,0]=2 9024 B13R2.1 CCCc1[n][nH]c2ccccc21 Amb25707815 [0,1,0,1,0,0|2,0,0]=4 9025 B13R2.1 CCCc1coc2ccccc21 Amb24102497 [0,1,0,1,0,0|1,0,1]=4 9026 B13R2.1 CCNc1[nH][n]c2ccccc21 Amb24398104 [0,1,0,1,0,0|2,0,0]=4 9027 B13R2.1 CCNc1[n][s]c2ccccc21 Amb24066790 [0,1,0,1,0,0|1,1,0]=4 9028 B13R2.1 CCNc1[n][s]c2ccccc21 Amb24488581 [0,1,0,1,0,0|1,1,0]=4 9029 B13R2.1 CCNc1[s][n]c2ccccc21 Amb24066797 [0,1,0,1,0,0|1,1,0]=4 9030 B13R2.1 CCNc1c[nH]c2ccccc12 Amb18553872 [0,1,0,1,0,0|2,0,0]=4 9031 B13R2.1 CCNc1c[s]c2ccccc21 Amb25820242 [0,1,0,1,0,0|1,1,0]=4 9032 B13R2.1 CCNc1coc2ccccc21 Amb25119969 [0,1,0,1,0,0|1,0,1]=4 9033 B13R2.1 CCOC1OCc2ccccc21 Amb25088972 [0,1,0,1,0,0|0,0,2]=4 9034 B13R2.1 CCO[n]1c[n]c2ccccc12 Amb25073171 [0,1,0,1,0,0|2,0,0]=4 9035 B13R2.1 CCO[n]1ccc2ccccc12 Amb25830466 [0,1,0,1,0,0|2,0,0]=4 9036 B13R2.1 CCOc1[n][nH]c2ccccc21 Amb21857446 [0,1,0,1,0,0|1,0,0]=3 9037 B13R2.1 CCOc1[n][n]c2cccc[n]21 Amb24351831 [0,1,0,1,0,0|2,0,0]=4 9038 B13R2.1 CCOc1[s][n]c2ccccc21 Amb25253716 [0,1,0,1,0,0|0,1,0]=3 9039 B13R2.1 CCOc1c[nH]c2ccccc12 Amb22750438 [0,1,0,1,0,0|1,0,0]=3 9040 B13R2.1 CCOc1coc2[n]cccc12 Amb25087829 [0,1,0,1,0,0|1,0,1]=4 9041 B13R2.1 CCOc1coc2ccccc12 Amb24085955 [0,1,0,1,0,0|0,0,1]=3 9042 B13R2.1 CCSc1c[nH]c2ccccc12 Amb25849843 [0,1,0,1,0,0|1,1,0]=4 9043 B13R2.3 C1C=C(CCO1)c2ccccc2 Amb21960770 [0,1,0,1,0,0|2,0,0]=4 9044 B13R2.3 C1C=C(NCN1)c2ccccc2 Amb24532691 [0,1,0,1,0,0|2,0,0]=4 9045 B13R2.3 C1CCC(OC1)c2ccccc2 Amb10558590 [0,1,0,1,0,0|1,0,1]=4 9046 B13R2.3 C1CCCN=C1c2ccccc2 Amb25835559 [0,1,0,1,0,0|2,0,0]=4 9047 B13R2.3 C1CCOC(=C1)c2cccc[n]2 Amb24371739 [0,1,0,1,0,0|2,0,0]=4 9048 B13R2.3 C1CCOC(N1)c2ccccc2 Amb22901047 [0,1,0,1,0,0|1,0,1]=4 9049 B13R2.3 C1CCOC=C1c2cc[n]cc2 Amb24669868 [0,1,0,1,0,0|2,0,0]=4 9050 B13R2.3 C1CCSC(=N1)c2ccccc2 Amb25246186 [0,1,0,1,0,0|1,1,0]=4 9051 B13R2.3 C1CNC(OC1)c2ccccc2 Amb17334580 [0,1,0,1,0,0|1,0,1]=4 9052 B13R2.3 C1CNN=C(N1)c2ccccc2 Amb25301491 [0,1,0,1,0,0|2,0,0]=4 9053 B13R2.3 C1CON=C(N1)c2ccccc2 Amb24424582 [0,1,0,1,0,0|1,0,0]=3 9054 B13R2.3 C1CSC=C(S1)c2ccccc2 Amb22483033 [0,1,0,1,0,0|0,2,0]=4 9055 B13R2.3 C1NCCC=C1c2ccccc2 Amb18645223 [0,1,0,1,0,0|2,0,0]=4 9056 B13R2.3 C1NCCO[C@@H]1c2ccccc2 Amb19889425 [0,1,0,1,0,0|1,0,1]=4 9057 B13R2.3 C1NCCO[C@@H]1c2ccccc2 Amb22899094 [0,1,0,1,0,0|1,0,1]=4 9058 B13R2.3 C1OCCNC1c2ccccc2 Amb18528726 [0,1,0,1,0,0|1,0,1]=4 9059 B13R2.3 C1OCCN[C@@H]1c2ccccc2 Amb20242902 [0,1,0,1,0,0|1,0,1]=4 9060 B13R2.3 C1OCCN[C@@H]1c2ccccc2 Amb22274558 [0,1,0,1,0,0|1,0,1]=4 9061 B13R2.3 C1OCCN[C@H]1c2ccccc2 Amb20242901 [0,1,0,1,0,0|1,0,1]=4 9062 B13R2.3 C1OCCN[C@H]1c2ccccc2 Amb24077482 [0,1,0,1,0,0|1,0,1]=4 9063 B13R2.3 C1OCCOC1c2ccccc2 Amb24487623 [0,1,0,1,0,0|0,0,2]=4 9064 B13R2.3 C1O[C@@H](CCO1)c2ccccc2 Amb22226715 [0,1,0,1,0,0|1,0,1]=4 9065 B13R2.3 N1CCC(=CC1)c2ccccc2 Amb1153094 [0,1,0,1,0,0|2,0,0]=4 9066 B13R2.3 N1CCOC(C1)c2ccccc2 Amb1782012 [0,1,0,1,0,0|1,0,1]=4 9067 B13R2.3 O1CCNC(C1)c2ccccc2 Amb10068848 [0,1,0,1,0,0|1,0,1]=4 9068 B13R2.10 CC1C=C(N=N1)c2ccccc2 Amb21952771 [0,1,0,1,0,0|2,0,0]=4 9069 B13R2.10 CC1CN=C(S1)c2ccccc2 Amb24090239 [0,1,0,1,0,0|1,1,0]=4 9070 B13R2.10 CC1CNC(O1)c2ccccc2 Amb18563573 [0,1,0,1,0,0|1,0,1]=4 9071 B13R2.10 CC1COC(N1)c2ccccc2 Amb18563574 [0,1,0,1,0,0|1,0,1]=4 9072 B13R2.10 CC1N[C@H](CO1)c2ccccc2 Amb25150915 [0,1,0,1,0,0|1,0,1]=4 9073 B13R2.10 CC=1CN=C(N1)c2ccccc2 Amb24079456 [0,1,0,1,0,0|2,0,0]=4 9074 B13R2.10 CC=1COC(C1)c2ccccc2 Amb25174191 [0,1,0,1,0,0|1,0,1]=4 9075 B13R2.10 CN1CC(=CC1)c2ccccc2 Amb22235338 [0,1,0,1,0,0|2,0,0]=4 9076 B13R2.10 CN1CC(=CC1)c2ccccc2 Amb25326815 [0,1,0,1,0,0|2,0,0]=4 9077 B13R2.10 CN1CCC(=N1)c2ccccc2 Amb25075711 [0,1,0,1,0,0|2,0,0]=4 9078 B13R2.10 C[C@@H]1CO[C@@H](N1)c2ccccc2 Amb24589650 [0,1,0,1,0,0|1,0,1]=4 9079 B13R2.10 Cc1ccc(o1)-c2ccccc2 Amb25743959 [0,1,0,1,0,0|1,0,1]=4 9080 B13R2.10 Cc1coc(c1)c2ccccc2 Amb10572487 [0,1,0,1,0,0|1,0,1]=4 9081 B13R2.10 Cc1nnc(o1)c2ccccc2 Amb16204058 [0,1,0,1,0,0|1,0,1]=4 9082 B13R2.10 Cc1noc(c1)c2ccccc2 Amb1893875 [0,1,0,1,0,0|1,0,1]=4 9083 B13R2.10 Cc1occ(n1)c2ccccc2 Amb17400054 [0,1,0,1,0,0|1,0,1]=4 9084 B13R2.10 Cc1onc(c1)c2ccccc2 Amb10553849 [0,1,0,1,0,0|1,0,1]=4 9085 B13R2.10 ClC1CC(=CC1)c2ccccc2 Amb24374584 [0,1,0,1,0,0|2,0,0]=4 9086 B13R2.10 ClC1COB(O1)c2ccccc2 Amb25798959 [0,1,0,1,0,0|1,0,1]=4 9087 B13R2.10 Cl[C@H]1CC(OC1)c2ccccc2 Amb24692710 [0,1,0,1,0,0|1,0,1]=4 9088 B13R2.10 NC1N=C(CO1)c2ccccc2 Amb24493499 [0,1,0,1,0,0|2,0,0]=4 9089 B13R2.10 NC1NN=C(O1)c2ccccc2 Amb25072770 [0,1,0,1,0,0|2,0,0]=4 9090 B13R2.10 O=C1CC=C(O1)c2ccccc2 Amb10570673 [0,1,0,1,0,0|1,0,1]=4 9091 B13R2.10 O=C1COC(=C1)c2ccccc2 Amb24090252 [0,1,0,1,0,0|1,0,1]=4 9092 B13R2.10 OC1CC(=CC1)c2ccccc2 Amb25057775 [0,1,0,1,0,0|2,0,0]=4 9093 B13R2.10 OC1CCC(=N1)c2ccccc2 Amb25204960 [0,1,0,1,0,0|2,0,0]=4 9094 B13R2.10 OC1CCC(O1)c2ccccc2 Amb22752551 [0,1,0,1,0,0|1,0,1]=4 9095 B13R2.10 OC1CC[C@@H](O1)c2ccccc2 Amb22752552 [0,1,0,1,0,0|1,0,1]=4 9096 B13R2.10 O[C@H]1C[C@H](OC1)c2ccccc2 Amb25176989 [0,1,0,1,0,0|1,0,1]=4 9097 B13R2.679 O=CC(c1ccccc1)C2CC2 Amb17232322 [0,1,0,1,0,0|1,0,1]=4 9098 B13R2.679 OCC(c1ccccc1)=C2CC2 Amb25037437 [0,1,0,1,0,0|1,0,1]=4 9099 B13R2.679 O\N=C(\c1ccccc1)/C2CC2 Amb10606515 [0,1,0,1,0,0|1,0,1]=4 9100 B13R2.679 [N-]=[N+]=C(C1CC1)c2ccccc2 Amb24069120 [0,1,0,1,0,0|2,0,0]=4 9101 B13R2.1613 BrCC1OCCc2ccccc21 Amb19373964 [0,1,0,1,0,0|1,0,1]=4 9102 B13R2.1613 CCC1=NCCc2ccccc21 Amb25035624 [0,1,0,1,0,0|2,0,0]=4 9103 B13R2.1613 COC1=NCCc2ccccc21 Amb24665738 [0,1,0,1,0,0|1,0,1]=4 9104 B13R2.1613 COC1OCCc2ccccc21 Amb22284603 [0,1,0,1,0,0|0,0,2]=4 9105 B13R2.1613 CSC1=NCCc2ccccc21 Amb25317689 [0,1,0,1,0,0|1,1,0]=4 9106 B13R2.1613 C\C=C/1\NCCc2ccccc21 Amb25124113 [0,1,0,1,0,0|2,0,0]=4 9107 B13R2.1613 ClCC1=NCCc2c1cccc2 Amb17506200 [0,1,0,1,0,0|2,0,0]=4 9108 B13R2.1613 ClCC1OCCc2ccccc21 Amb25238351 [0,1,0,1,0,0|1,0,1]=4 9109 B13R2.1613 Cl\C=C/1\CCCc2ccccc21 Amb24692679 [0,1,0,1,0,0|2,0,0]=4 9110 B13R2.1613 N#CC1=CCCc2c1cccc2 Amb17232153 [0,1,0,1,0,0|2,0,0]=4 9111 B13R2.1613 N#CC1=NCCc2ccccc21 Amb18644811 [0,1,0,1,0,0|2,0,0]=4 9112 B13R2.1613 NNC1=NCCc2ccccc21 Amb18126292 [0,1,0,1,0,0|2,0,0]=4 9113 B13R2.1613 O=CC1=CCCc2ccccc21 Amb18645053 [0,1,0,1,0,0|1,0,0]=3 9114 B13R2.1613 O=CC1=CCSc2ccccc21 Amb24631159 [0,1,0,1,0,0|2,0,0]=4 9115 B13R2.1613 O=CC1=CNCc2ccccc12 Amb24079640 [0,1,0,1,0,0|2,0,0]=4 9116 B13R2.1613 O=CC1CCCc2ccccc21 Amb18787961 [0,1,0,1,0,0|1,0,1]=4 9117 B13R2.1613 O=CC1OCCc2ccccc21 Amb18645642 [0,1,0,1,0,0|0,0,1]=3 9118 B13R2.1613 O=CC1SCCc2ccccc21 Amb18648147 [0,1,0,1,0,0|0,1,1]=4 9119 B13R2.1613 O=NC=1CCCC2=CC=CNC21 Amb25361899 [0,1,0,1,0,0|2,0,0]=4 9120 B13R2.1613 OCC1OCCc2c1cccc2 Amb1094003 [0,1,0,1,0,0|0,0,2]=4 9121 B13R2.1613 OC[C@H]1OCCc2ccccc21 Amb25271375 [0,1,0,1,0,0|0,0,2]=4 9122 B13R2.1613 O\N=C\1/CCCc2c1cccc2 Amb1948669 [0,1,0,1,0,0|1,0,1]=4 9123 B13R2.1613 O\N=C\1/CCCc2ccccc21 Amb18034226 [0,1,0,1,0,0|1,0,1]=4 9124 B13R2.1613 SCC1OCCc2ccccc21 Amb25152461 [0,1,0,1,0,0|0,1,1]=4 9125 B13R2.2532 CC1OC1(CO)c2ccccc2 Amb25296415 [0,1,0,1,0,0|0,0,2]=4 9126 B13R2.2532 C[C@H]1O[C@@]1(C=O)c2ccccc2 Amb25179873 [0,1,0,1,0,0|0,0,1]=3 9127 B13R2.2532 C[C@H]1O[C@@]1(CCl)c2ccccc2 Amb24739716 [0,1,0,1,0,0|1,0,1]=4 9128 B13R2.2539 N#CC1(CCO1)c2ccccc2 Amb22497350 [0,1,0,1,0,0|1,0,1]=4 9129 B13R2.2539 O=CC1(CCC1)c2ccccc2 Amb17594006 [0,1,0,1,0,0|1,0,1]=4 9130 B13R2.2931 C=CC1OC(=O)c2ccccc21 Amb24115296 [0,1,0,1,0,0|0,0,1]=3 9131 B13R2.2931 CC1CN(C=O)c2ccccc21 Amb25212167 [0,1,0,1,0,0|2,0,0]=4 9132 B13R2.2931 CC1C\C(=N\N)\c2ccccc21 Amb25817326 [0,1,0,1,0,0|2,0,0]=4 9133 B13R2.2931 CC1C\C(=N\O)\c2ccccc21 Amb25036333 [0,1,0,1,0,0|1,0,1]=4 9134 B13R2.2931 CCC1=CC(=O)c2ccccc21 Amb24647742 [0,1,0,1,0,0|1,0,0]=3 9135 B13R2.2931 CCC1CC(=O)c2c1cccc2 Amb17232326 [0,1,0,1,0,0|1,0,0]=3 9136 B13R2.2931 CCC1OC(=O)c2[n]cccc21 Amb25295257 [0,1,0,1,0,0|1,0,0]=3 9137 B13R2.2931 CCC1OC(=O)c2cc[n]cc21 Amb24341707 [0,1,0,1,0,0|1,0,0]=3 9138 B13R2.2931 CCC1OC(=O)c2ccccc21 Amb24115402 [0,1,0,1,0,0|0,0,0]=2 9139 B13R2.2931 CCC1OC(O)c2ccccc21 Amb25215873 [0,1,0,1,0,0|0,0,2]=4 9140 B13R2.2931 CC[C@@H]1NC(=O)c2ccccc21 Amb25733164 [0,1,0,1,0,0|1,0,0]=3 9141 B13R2.2931 CC[C@@H]1OC(O)c2ccccc21 Amb24404593 [0,1,0,1,0,0|0,0,2]=4 9142 B13R2.2931 CC[C@H]1CC(=O)c2ccccc21 Amb25370725 [0,1,0,1,0,0|1,0,0]=3 9143 B13R2.2931 CC[C@H]1O[C@@H](O)c2ccccc21 Amb24612138 [0,1,0,1,0,0|0,0,2]=4 9144 B13R2.2931 CC[n+]1oc(c2c1cccc2)C Amb16759187 [0,1,0,1,0,0|1,0,0]=3 9145 B13R2.2931 CC[n]1[n]c(Br)c2ccccc12 Amb22751457 [0,1,0,1,0,0|2,0,0]=4 9146 B13R2.2931 CC[n]1[n]c(I)c2ccccc12 Amb23558934 [0,1,0,1,0,0|2,0,0]=4 9147 B13R2.2931 CC[n]1cc(I)c2ccccc12 Amb24727509 [0,1,0,1,0,0|2,0,0]=4 9148 B13R2.2931 CCn1cc(C)c2ccccc12 Amb17672668 [0,1,0,1,0,0|2,0,0]=4 9149 B13R2.2931 CCn1nc(c2c1cccc2)N Amb10608066 [0,1,0,1,0,0|2,0,0]=4 9150 B13R2.2931 CNC1=NC(=O)c2ccccc21 Amb25295230 [0,1,0,1,0,0|1,0,1]=4 9151 B13R2.2931 CNC1NC(=O)c2ccccc21 Amb22372260 [0,1,0,1,0,0|1,0,0]=3 9152 B13R2.2931 CNC1OC(=C)c2ccccc21 Amb24739539 [0,1,0,1,0,0|1,0,0]=3 9153 B13R2.2931 CNC1OC(=O)c2ccccc21 Amb18266318 [0,1,0,1,0,0|0,0,0]=2 9154 B13R2.2931 COC1=CC(=O)c2ccccc12 Amb25262748 [0,1,0,1,0,0|1,0,1]=4 9155 B13R2.2931 COC1=CC(C)c2ccccc12 Amb17778898 [0,1,0,1,0,0|1,0,1]=4 9156 B13R2.2931 COC1=NC(C)c2ccccc21 Amb25719378 [0,1,0,1,0,0|1,0,1]=4 9157 B13R2.2931 COC1C=C(C)c2ccccc12 Amb17844048 [0,1,0,1,0,0|2,0,0]=4 9158 B13R2.2931 COC1NC(=O)c2ccccc21 Amb24560322 [0,1,0,1,0,0|1,0,0]=3 9159 B13R2.2931 COC1OC(=N)c2c[n]ccc21 Amb24422964 [0,1,0,1,0,0|2,0,0]=4 9160 B13R2.2931 COC1OC(O)c2ccccc21 Amb25156850 [0,1,0,1,0,0|0,0,2]=4 9161 B13R2.2931 C[C@@H]1C[C@@H](C=O)c2ccccc21 Amb24656170 [0,1,0,1,0,0|1,0,1]=4 9162 B13R2.2931 C\C=C/1\CC(=O)c2ccccc21 Amb24570409 [0,1,0,1,0,0|1,0,1]=4 9163 B13R2.2931 C\C=C\1/OC(=O)c2ccccc21 Amb19895689 [0,1,0,1,0,0|0,0,1]=3 9164 B13R2.2931 N#CC1=CC(c2c1cccc2)C Amb17232154 [0,1,0,1,0,0|2,0,0]=4 9165 B13R2.2931 N#CC1CC(=O)c2c1cccc2 Amb17400022 [0,1,0,1,0,0|1,0,1]=4 9166 B13R2.2931 N#CC1NC(=O)c2ccccc21 Amb24485599 [0,1,0,1,0,0|1,0,1]=4 9167 B13R2.2931 N#CC1OC(=O)c2ccccc21 Amb19889006 [0,1,0,1,0,0|0,0,1]=3 9168 B13R2.2931 N#C[I]1OC(=O)c2c1cccc2 Amb10071693 [0,1,0,1,0,0|1,0,1]=4 9169 B13R2.2931 NCC1CC(=O)c2c1cccc2 Amb17400089 [0,1,0,1,0,0|1,0,0]=3 9170 B13R2.2931 NCC1CC(=O)c2ccccc21 Amb22035182 [0,1,0,1,0,0|1,0,0]=3 9171 B13R2.2931 NCC1OC(=O)c2c1cccc2 Amb17608185 [0,1,0,1,0,0|0,0,0]=2 9172 B13R2.2931 NC[C@H]1OB(O)c2ccccc21 Amb25315113 [0,1,0,1,0,0|1,0,1]=4 9173 B13R2.2931 N\C=C/1\OC(=O)c2ccccc21 Amb25201645 [0,1,0,1,0,0|0,0,2]=4 9174 B13R2.2931 O=C1CC(CBr)c2ccccc21 Amb22489708 [0,1,0,1,0,0|1,0,0]=3 9175 B13R2.2931 O=C1CC(CCl)c2ccccc21 Amb24692943 [0,1,0,1,0,0|1,0,0]=3 9176 B13R2.2931 O=C1NC(C=O)c2ccccc12 Amb25073339 [0,1,0,1,0,0|1,0,1]=4 9177 B13R2.2931 O=C1OC(=CBr)c2ccccc21 Amb22482473 [0,1,0,1,0,0|0,0,2]=4 9178 B13R2.2931 O=C1OC(CCl)c2ccccc21 Amb25034744 [0,1,0,1,0,0|0,0,0]=2 9179 B13R2.2931 O=Cc1cn(c2c1cccc2)C Amb1147112 [0,1,0,1,0,0|2,0,0]=4 9180 B13R2.2931 OCC1=CC(=O)c2ccccc21 Amb24721734 [0,1,0,1,0,0|1,0,1]=4 9181 B13R2.2931 OCC1CC(=O)c2cc[n]cc21 Amb24726143 [0,1,0,1,0,0|2,0,0]=4 9182 B13R2.2931 OCC1OB(O)c2ccccc21 Amb25098635 [0,1,0,1,0,0|1,0,1]=4 9183 B13R2.2931 OC[C@@H]1CC(=O)c2ccccc21 Amb25086562 [0,1,0,1,0,0|1,0,0]=3 9184 B13R2.2931 OC[C@@H]1OC(=O)c2ccccc21 Amb25816368 [0,1,0,1,0,0|0,0,0]=2 9185 B13R2.2931 OC[C@H]1OC(=O)c2ccccc21 Amb25346281 [0,1,0,1,0,0|0,0,0]=2 9186 B13R2.2931 O\C=C/1\OC(=O)c2ccccc21 Amb24060110 [0,1,0,1,0,0|0,0,2]=4 9187 B13R2.2956 C=CCC1C(=O)c2ccccc21 Amb24456575 [0,1,0,1,0,0|1,0,1]=4 9188 B13R2.12 Brc1ccc(cc1)C2CCCO2 Amb17343724 [0,1,0,1,0,0|1,0,1]=4 9189 B13R2.12 Brc1ccc(cc1)C2NCCO2 Amb17344018 [0,1,0,1,0,0|1,0,1]=4 9190 B13R2.12 Brc1ccc(cc1)C=2CCCC2 Amb22227905 [0,1,0,1,0,0|2,0,0]=4 9191 B13R2.12 Cc1ccc(c[n]1)C2=CCCO2 Amb24531578 [0,1,0,1,0,0|2,0,0]=4 9192 B13R2.12 Cc1ccc(cc1)C2=NCCO2 Amb10553845 [0,1,0,1,0,0|1,0,0]=3 9193 B13R2.12 Cc1ccc(cc1)C2CCCO2 Amb17334569 [0,1,0,1,0,0|1,0,1]=4 9194 B13R2.12 Cc1ccc(cc1)C2NCCO2 Amb17334583 [0,1,0,1,0,0|1,0,1]=4 9195 B13R2.12 Cc1ccc(cc1)C2OCCO2 Amb17334608 [0,1,0,1,0,0|0,0,2]=4 9196 B13R2.12 Cc1ccc(cc1)C=2CCCN2 Amb24053769 [0,1,0,1,0,0|2,0,0]=4 9197 B13R2.12 Clc1ccc(cc1)C2=NCCO2 Amb10553673 [0,1,0,1,0,0|1,0,0]=3 9198 B13R2.12 Clc1ccc(cc1)C2CCCO2 Amb17335592 [0,1,0,1,0,0|1,0,1]=4 9199 B13R2.12 Clc1ccc(cc1)C2NCCO2 Amb17335657 [0,1,0,1,0,0|1,0,1]=4 9200 B13R2.12 Clc1ccc(cc1)C2OCCO2 Amb10569622 [0,1,0,1,0,0|0,0,2]=4 9201 B13R2.12 Fc1ccc(cc1)C2=NCCS2 Amb22356246 [0,1,0,1,0,0|1,1,0]=4 9202 B13R2.12 Fc1ccc(cc1)C2CCCO2 Amb17334671 [0,1,0,1,0,0|1,0,1]=4 9203 B13R2.12 Fc1ccc(cc1)C2NCCO2 Amb17334700 [0,1,0,1,0,0|1,0,1]=4 9204 B13R2.12 Fc1ccc(cc1)C=2CCCC2 Amb24484180 [0,1,0,1,0,0|2,0,0]=4 9205 B13R2.12 Fc1ccc(cc1)C=2CCCN2 Amb23578424 [0,1,0,1,0,0|2,0,0]=4 9206 B13R2.12 Fc1ccc(cc1)C=2NCCN2 Amb18563604 [0,1,0,1,0,0|2,0,0]=4 9207 B13R2.12 Ic1ccc(cc1)C=2CCCN2 Amb24727205 [0,1,0,1,0,0|2,0,0]=4 9208 B13R2.12 Nc1ccc(cc1)C2=CCCC2 Amb17107090 [0,1,0,1,0,0|2,0,0]=4 9209 B13R2.12 Nc1ccc(cc1)C2=NCCS2 Amb24626639 [0,1,0,1,0,0|1,1,0]=4 9210 B13R2.12 Nc1ccc(cc1)C2CCCO2 Amb17334584 [0,1,0,1,0,0|1,0,1]=4 9211 B13R2.12 Nc1ccc(cc1)C2OCCO2 Amb16230379 [0,1,0,1,0,0|0,0,2]=4 9212 B13R2.12 Nc1ccc(cc1)C=2CCCN2 Amb24543977 [0,1,0,1,0,0|2,0,0]=4 9213 B13R2.12 Oc1ccc(cc1)B2OCCO2 Amb24094218 [0,1,0,1,0,0|1,0,1]=4 9214 B13R2.12 Oc1ccc(cc1)C2=NCCN2 Amb10070817 [0,1,0,1,0,0|2,0,0]=4 9215 B13R2.12 Oc1ccc(cc1)C2=NCCO2 Amb18645792 [0,1,0,1,0,0|1,0,0]=3 9216 B13R2.12 Oc1ccc(cc1)C2=NCCS2 Amb18648260 [0,1,0,1,0,0|1,1,0]=4 9217 B13R2.12 Oc1ccc(cc1)C2OCCO2 Amb17334663 [0,1,0,1,0,0|0,0,2]=4 9218 B13R2.12 Oc1ccc(cc1)C2OCCS2 Amb24662333 [0,1,0,1,0,0|0,1,1]=4 9219 B13R2.12 Oc1ccc(cc1)C=2CCCC2 Amb18645357 [0,1,0,1,0,0|2,0,0]=4 9220 B13R2.12 Sc1ccc(cc1)C=2NCCN2 Amb24102828 [0,1,0,1,0,0|2,0,0]=4 9221 B13R2.520 C=C(C1CC1)c2ccc(Br)cc2 Amb22751350 [0,1,0,1,0,0|2,0,0]=4 9222 B13R2.520 C=C(C1CC1)c2ccc(F)cc2 Amb24484148 [0,1,0,1,0,0|2,0,0]=4 9223 B13R2.520 Cc1ccc([n]c1)C(=O)N2CC2 Amb25160181 [0,1,0,1,0,0|2,0,0]=4 9224 B13R2.520 Cc1ccc(c[n]1)C(=O)C2CC2 Amb24483485 [0,1,0,1,0,0|2,0,0]=4 9225 B13R2.520 Nc1ccc(cc1)C(=O)C2CC2 Amb22755982 [0,1,0,1,0,0|1,0,0]=3 9226 B13R2.520 O=C(C1CC1)c2ccc(Br)c[n]2 Amb23454994 [0,1,0,1,0,0|2,0,0]=4 9227 B13R2.520 O=C(C1CC1)c2ccc(Cl)c[n]2 Amb23454991 [0,1,0,1,0,0|2,0,0]=4 9228 B13R2.520 O=C(c1ccc(Br)c[n]1)N2CC2 Amb24673499 [0,1,0,1,0,0|2,0,0]=4 9229 B13R2.520 O=C(c1ccc(Cl)[n]c1)N2CC2 Amb25066173 [0,1,0,1,0,0|2,0,0]=4 9230 B13R2.520 O=C(c1ccc(Cl)c[n]1)N2CC2 Amb25717477 [0,1,0,1,0,0|2,0,0]=4 9231 B13R2.520 O=C(c1ccc(I)cc1)N2CC2 Amb25084002 [0,1,0,1,0,0|1,0,0]=3 9232 B13R2.520 O=C(c1ccc(cc1)Br)C2CC2 Amb2420176 [0,1,0,1,0,0|1,0,0]=3 9233 B13R2.520 O=C(c1ccc(cc1)C)C2CC2 Amb1660781 [0,1,0,1,0,0|1,0,0]=3 9234 B13R2.520 O=C(c1ccc(cc1)F)C2CC2 Amb2582736 [0,1,0,1,0,0|1,0,0]=3 9235 B13R2.520 O=C(c1ccc(cc1)N)C2CC2 Amb17138525 [0,1,0,1,0,0|1,0,0]=3 9236 B13R2.520 [O-][n+]1ccc(cc1)C(=O)N2CC2 Amb25206120 [0,1,0,1,0,0|2,0,0]=4 9237 B13R2.2986 CC1(CCO1)c2ccc(Br)cc2 Amb25292728 [0,1,0,1,0,0|1,0,1]=4 9238 B13R2.5102 O=C1C=CC2(CCOC2=O)C=C1 Amb25767813 [0,1,0,1,0,0|0,0,1]=3 9239 B13R2.5179 Brc1ccc2c(c1)CCCC2=O Amb10603037 [0,1,0,1,0,0|1,0,0]=3 9240 B13R2.5179 Brc1ccc2c(c1)CCNC2=O Amb10603016 [0,1,0,1,0,0|1,0,0]=3 9241 B13R2.5179 Brc1ccc2c(c1)NCCC2=O Amb16192033 [0,1,0,1,0,0|2,0,0]=4 9242 B13R2.5179 Brc1ccc2c(c1)OCCC2=O Amb10603907 [0,1,0,1,0,0|2,0,0]=4 9243 B13R2.5179 CC1=NCCc2cc(N)ccc21 Amb24406720 [0,1,0,1,0,0|2,0,0]=4 9244 B13R2.5179 CC=1NCCC2=CC(=N)C=CC21 Amb25817408 [0,1,0,1,0,0|2,0,0]=4 9245 B13R2.5179 Cc1cc2CCNC(=O)c2c[n]1 Amb24493118 [0,1,0,1,0,0|2,0,0]=4 9246 B13R2.5179 Cc1cc2CCNC(=O)c2cc1 Amb18065088 [0,1,0,1,0,0|1,0,0]=3 9247 B13R2.5179 Cc1cc2CCOC(=O)c2c[n]1 Amb25315050 [0,1,0,1,0,0|1,0,0]=3 9248 B13R2.5179 Cc1cc2NCCC(=O)c2cc1 Amb18560043 [0,1,0,1,0,0|2,0,0]=4 9249 B13R2.5179 Cc1cc2SCCC(=O)c2cc1 Amb18824839 [0,1,0,1,0,0|2,0,0]=4 9250 B13R2.5179 Cc1ccc2C(=O)CCCc2[n]1 Amb18829940 [0,1,0,1,0,0|2,0,0]=4 9251 B13R2.5179 Cc1ccc2C(=O)NCCc2[n]1 Amb24484253 [0,1,0,1,0,0|2,0,0]=4 9252 B13R2.5179 Clc1ccc2c(c1)OCCC2=O Amb10603919 [0,1,0,1,0,0|2,0,0]=4 9253 B13R2.5179 Fc1ccc2c(c1)OCCC2=O Amb16233074 [0,1,0,1,0,0|2,0,0]=4 9254 B13R2.5179 Ic1ccc2c(c1)CCCC2=O Amb16233083 [0,1,0,1,0,0|1,0,0]=3 9255 B13R2.5179 Nc1cc2CCNC(=O)c2cc1 Amb18064562 [0,1,0,1,0,0|1,0,0]=3 9256 B13R2.5179 Nc1cc2COCC(=O)c2cc1 Amb24467677 [0,1,0,1,0,0|2,0,0]=4 9257 B13R2.5179 Nc1cc2NCCC(=O)c2cc1 Amb22499568 [0,1,0,1,0,0|2,0,0]=4 9258 B13R2.5179 Nc1cc2SCCC(=O)c2cc1 Amb25760709 [0,1,0,1,0,0|2,0,0]=4 9259 B13R2.5179 Nc1ccc2C(=O)CCCc2[n]1 Amb23592276 [0,1,0,1,0,0|2,0,0]=4 9260 B13R2.5179 Nc1ccc2c(c1)OCCC2=O Amb17191612 [0,1,0,1,0,0|2,0,0]=4 9261 B13R2.5179 O=C1CCCC=2NC(=O)C=CC12 Amb17933811 [0,1,0,1,0,0|2,0,0]=4 9262 B13R2.5179 O=C1CCCC=2OC(=O)C=CC12 Amb19420099 [0,1,0,1,0,0|2,0,0]=4 9263 B13R2.5179 O=C1CCCc2cc(Br)[n]cc21 Amb25801126 [0,1,0,1,0,0|2,0,0]=4 9264 B13R2.5179 O=C1CCCc2cc(Br)c[n]c21 Amb24350538 [0,1,0,1,0,0|2,0,0]=4 9265 B13R2.5179 O=C1CCCc2cc(Cl)c[n]c21 Amb25100176 [0,1,0,1,0,0|2,0,0]=4 9266 B13R2.5179 O=C1CCNc2cc(F)ccc21 Amb18828470 [0,1,0,1,0,0|2,0,0]=4 9267 B13R2.5179 O=C1CCNc2cc(I)ccc21 Amb24493218 [0,1,0,1,0,0|2,0,0]=4 9268 B13R2.5179 O=C1CCOc2cc(I)ccc21 Amb24066323 [0,1,0,1,0,0|2,0,0]=4 9269 B13R2.5179 O=C1CCOc2cc(S)ccc21 Amb24674070 [0,1,0,1,0,0|2,0,0]=4 9270 B13R2.5179 O=C1CCSc2cc(Cl)ccc21 Amb18187822 [0,1,0,1,0,0|2,0,0]=4 9271 B13R2.5179 O=C1CNCc2cc(Cl)ccc21 Amb24542632 [0,1,0,1,0,0|2,0,0]=4 9272 B13R2.5179 O=C1CNCc2cc(F)ccc21 Amb25309740 [0,1,0,1,0,0|2,0,0]=4 9273 B13R2.5179 O=C1COCc2cc(Br)ccc21 Amb21963284 [0,1,0,1,0,0|2,0,0]=4 9274 B13R2.5179 O=C1COCc2cc(Cl)ccc21 Amb25348823 [0,1,0,1,0,0|2,0,0]=4 9275 B13R2.5179 O=C1COCc2cc(I)ccc21 Amb24066324 [0,1,0,1,0,0|2,0,0]=4 9276 B13R2.5179 O=C1CSCc2cc(I)ccc21 Amb25082449 [0,1,0,1,0,0|2,0,0]=4 9277 B13R2.5179 O=C1NCCc2[n]c(Br)ccc21 Amb24382488 [0,1,0,1,0,0|2,0,0]=4 9278 B13R2.5179 O=C1NCCc2[n]c(Cl)ccc21 Amb22584107 [0,1,0,1,0,0|2,0,0]=4 9279 B13R2.5179 O=C1NCCc2cc(Br)[n]cc21 Amb22754598 [0,1,0,1,0,0|2,0,0]=4 9280 B13R2.5179 O=C1NCCc2cc(Cl)[n]cc21 Amb22754595 [0,1,0,1,0,0|2,0,0]=4 9281 B13R2.5179 O=C1NCCc2cc(Cl)ccc21 Amb18065092 [0,1,0,1,0,0|1,0,0]=3 9282 B13R2.5179 O=C1NCCc2cc(F)ccc21 Amb18065091 [0,1,0,1,0,0|1,0,0]=3 9283 B13R2.5179 O=C1NCCc2cc(I)ccc21 Amb25340206 [0,1,0,1,0,0|1,0,0]=3 9284 B13R2.5179 O=C1OCCc2cc(Br)c[n]c21 Amb24497550 [0,1,0,1,0,0|1,0,0]=3 9285 B13R2.5179 O=C1OCCc2cc(Br)ccc21 Amb22284657 [0,1,0,1,0,0|0,0,0]=2 9286 B13R2.5179 O=C1OCCc2cc(Cl)ccc21 Amb25699047 [0,1,0,1,0,0|0,0,0]=2 9287 B13R2.5179 O=C1OCOc2cc(Br)ccc21 Amb24077634 [0,1,0,1,0,0|1,0,0]=3 9288 B13R2.5179 O=C1OCOc2cc(F)ccc21 Amb24077630 [0,1,0,1,0,0|1,0,0]=3 9289 B13R2.5179 O=c1ccc2c(o1)CCCC2=O Amb1148415 [0,1,0,1,0,0|2,0,0]=4 9290 B13R2.5179 Oc1cc2CCCC(=O)c2c[n]1 Amb18645807 [0,1,0,1,0,0|2,0,0]=4 9291 B13R2.5179 Oc1cc2CNCC(=O)c2cc1 Amb25250025 [0,1,0,1,0,0|2,0,0]=4 9292 B13R2.5179 Oc1cc2COCC(=O)c2cc1 Amb24405511 [0,1,0,1,0,0|2,0,0]=4 9293 B13R2.5179 Oc1cc2OCOC(=O)c2cc1 Amb24408242 [0,1,0,1,0,0|1,0,0]=3 9294 B13R2.5179 Oc1ccc2C(=O)CCCc2[n]1 Amb18645806 [0,1,0,1,0,0|2,0,0]=4 9295 B13R2.5179 Oc1ccc2C(=O)NCCc2[n]1 Amb22499176 [0,1,0,1,0,0|2,0,0]=4 9296 B13R2.5179 Oc1ccc2c(c1)CCCC2=O Amb2445422 [0,1,0,1,0,0|1,0,0]=3 9297 B13R2.5179 Oc1ccc2c(c1)OCCC2=O Amb10603782 [0,1,0,1,0,0|2,0,0]=4 9298 B13R2.5179 S=C1NCCc2cc(Br)ccc21 Amb25330691 [0,1,0,1,0,0|1,1,0]=4 9299 B13R2.5187 Brc1ccc2c(c1)C(=O)CC2N Amb17472099 [0,1,0,1,0,0|2,0,0]=4 9300 B13R2.5187 Brc1ccc2c(c1)C(N)CC2=O Amb17472097 [0,1,0,1,0,0|2,0,0]=4 9301 B13R2.5187 CC1CC(=O)c2[n]cc(O)cc21 Amb25143327 [0,1,0,1,0,0|2,0,0]=4 9302 B13R2.5187 CC1CC(=O)c2cc(O)ccc21 Amb25807644 [0,1,0,1,0,0|1,0,0]=3 9303 B13R2.5187 CC1CC(=O)c2ccc(Br)cc21 Amb25762965 [0,1,0,1,0,0|1,0,0]=3 9304 B13R2.5187 CC1CC(=O)c2ccc(Cl)cc21 Amb22753082 [0,1,0,1,0,0|1,0,0]=3 9305 B13R2.5187 CC1CC(=O)c2ccc(F)cc21 Amb25698030 [0,1,0,1,0,0|1,0,0]=3 9306 B13R2.5187 CC1NC(=O)c2ccc(O)cc21 Amb24652933 [0,1,0,1,0,0|1,0,0]=3 9307 B13R2.5187 CC1OB(O)c2ccc(N)cc21 Amb25762866 [0,1,0,1,0,0|1,0,1]=4 9308 B13R2.5187 CC1OB(O)c2ccc(O)cc21 Amb24732060 [0,1,0,1,0,0|1,0,1]=4 9309 B13R2.5187 CC1OC(=O)c2cc(Br)ccc21 Amb18159717 [0,1,0,1,0,0|0,0,0]=2 9310 B13R2.5187 CC1OC(=O)c2cc(N)ccc21 Amb25667060 [0,1,0,1,0,0|0,0,0]=2 9311 B13R2.5187 CC1OC(=O)c2ccc(O)cc21 Amb24415296 [0,1,0,1,0,0|0,0,0]=2 9312 B13R2.5187 CN1CC(=O)c2cc(Br)ccc12 Amb18160225 [0,1,0,1,0,0|2,0,0]=4 9313 B13R2.5187 CN1CC(=O)c2cc(N)ccc12 Amb18829714 [0,1,0,1,0,0|2,0,0]=4 9314 B13R2.5187 C[C@H]1CC(=O)c2cc(N)ccc21 Amb24341851 [0,1,0,1,0,0|1,0,0]=3 9315 B13R2.5187 C[n]1[nH]c(=O)c2ccc(Br)cc12 Amb24082848 [0,1,0,1,0,0|2,0,0]=4 9316 B13R2.5187 Cc1cc2C(=O)C[C@H](N)c2cc1 Amb24714685 [0,1,0,1,0,0|2,0,0]=4 9317 B13R2.5187 Cc1cc2C(=O)OC(O)c2cc1 Amb24060117 [0,1,0,1,0,0|1,0,0]=3 9318 B13R2.5187 Cc1cc2C(Br)CC(=O)c2cc1 Amb25042679 [0,1,0,1,0,0|2,0,0]=4 9319 B13R2.5187 Cc1cc2C(O)OC(=O)c2cc1 Amb18936180 [0,1,0,1,0,0|1,0,0]=3 9320 B13R2.5187 Cc1ccc2c(c1)C(=O)CC2N Amb17470419 [0,1,0,1,0,0|2,0,0]=4 9321 B13R2.5187 Cc1ccc2c(c1)C(N)CC2=O Amb17470421 [0,1,0,1,0,0|2,0,0]=4 9322 B13R2.5187 Clc1ccc2c(c1)C(=O)CC2N Amb17470645 [0,1,0,1,0,0|2,0,0]=4 9323 B13R2.5187 Fc1ccc2c(c1)C(=O)CC2N Amb17470454 [0,1,0,1,0,0|2,0,0]=4 9324 B13R2.5187 Fc1ccc2c(c1)C(=O)OC2=O Amb2236183 [0,1,0,1,0,0|1,0,1]=4 9325 B13R2.5187 Fc1ccc2c(c1)C(N)CC2=O Amb17470456 [0,1,0,1,0,0|2,0,0]=4 9326 B13R2.5187 NC1CC(=O)c2cc(O)ccc21 Amb25288411 [0,1,0,1,0,0|2,0,0]=4 9327 B13R2.5187 N[C@@H]1CC(=O)c2ccc(Br)cc21 Amb24603814 [0,1,0,1,0,0|2,0,0]=4 9328 B13R2.5187 N[C@@H]1CC(=O)c2ccc(I)cc21 Amb25062069 [0,1,0,1,0,0|2,0,0]=4 9329 B13R2.5187 N[C@@H]1CC(=O)c2ccc(O)cc21 Amb24714606 [0,1,0,1,0,0|2,0,0]=4 9330 B13R2.5187 N[C@H]1CC(=O)c2cc(Cl)ccc21 Amb25827669 [0,1,0,1,0,0|2,0,0]=4 9331 B13R2.5187 N[C@H]1CC(=O)c2cc(F)ccc21 Amb25082641 [0,1,0,1,0,0|2,0,0]=4 9332 B13R2.5187 N[C@H]1CC(=O)c2cc(O)ccc21 Amb24464332 [0,1,0,1,0,0|2,0,0]=4 9333 B13R2.5187 Nc1cc2C(=O)OC(Br)c2cc1 Amb23590103 [0,1,0,1,0,0|1,0,0]=3 9334 B13R2.5187 Nc1cc2c(cc1)C(=O)OC2=O Amb25256881 [0,1,0,1,0,0|1,0,1]=4 9335 B13R2.5187 Nc1ccc2C(N)CC(=O)c2c1 Amb24535465 [0,1,0,1,0,0|2,0,0]=4 9336 B13R2.5187 Nc1ccc2[C@H](N)CC(=O)c2c1 Amb25082590 [0,1,0,1,0,0|2,0,0]=4 9337 B13R2.5187 Nc1ccc2c(c1)C(N)CC2=O Amb25311128 [0,1,0,1,0,0|2,0,0]=4 9338 B13R2.5187 Nc1ccc2c(c1)[C@H](N)CC2=O Amb24605110 [0,1,0,1,0,0|2,0,0]=4 9339 B13R2.5187 O=C1CC(Br)c2cc(Br)ccc21 Amb22263581 [0,1,0,1,0,0|2,0,0]=4 9340 B13R2.5187 O=C1OC(Br)c2cc(Br)ccc21 Amb24056792 [0,1,0,1,0,0|1,0,0]=3 9341 B13R2.5187 O=C1OC(Br)c2cc(F)ccc21 Amb24056808 [0,1,0,1,0,0|1,0,0]=3 9342 B13R2.5187 O=C1OC(Br)c2ccc(Br)cc21 Amb23590102 [0,1,0,1,0,0|1,0,0]=3 9343 B13R2.5187 O=C1OC(Br)c2ccc(Cl)cc21 Amb25194543 [0,1,0,1,0,0|1,0,0]=3 9344 B13R2.5187 O=C1OC(Br)c2ccc(F)cc21 Amb24056817 [0,1,0,1,0,0|1,0,0]=3 9345 B13R2.5187 O=C1OC(Br)c2ccc(I)cc21 Amb25780718 [0,1,0,1,0,0|1,0,0]=3 9346 B13R2.5187 OC1CC(=O)c2cc(Cl)ccc21 Amb25681450 [0,1,0,1,0,0|2,0,0]=4 9347 B13R2.5187 OC1NC(=O)c2ccc(Br)cc21 Amb21963745 [0,1,0,1,0,0|2,0,0]=4 9348 B13R2.5187 OC1OC(=O)c2cc(Cl)ccc21 Amb25719526 [0,1,0,1,0,0|1,0,0]=3 9349 B13R2.5187 OC1OC(=O)c2ccc(Cl)cc21 Amb18936147 [0,1,0,1,0,0|1,0,0]=3 9350 B13R2.5187 OC1OC(=O)c2ccc(F)cc21 Amb18271892 [0,1,0,1,0,0|1,0,0]=3 9351 B13R2.5187 Oc1ccc2C(O)OC(=O)c2c1 Amb24450990 [0,1,0,1,0,0|1,0,0]=3 9352 B13R2.5187 Oc1ccc2c(c1)C(C)CC2=O Amb2518526 [0,1,0,1,0,0|1,0,0]=3 9353 B13R2.5187 Oc1ccc2c(c1)C(O)CC2=O Amb24690733 [0,1,0,1,0,0|2,0,0]=4 9354 B13R2.5187 Oc1ccc2c(c1)C(O)OC2=O Amb18272023 [0,1,0,1,0,0|1,0,0]=3 9355 B13R2.13 Brc1cc(ccc1)C2=NCCO2 Amb18561899 [0,1,0,1,0,0|1,0,0]=3 9356 B13R2.13 Brc1cc(ccc1)C2=NCCS2 Amb24089779 [0,1,0,1,0,0|1,1,0]=4 9357 B13R2.13 Brc1cc(ccc1)C=2CCCC2 Amb22227898 [0,1,0,1,0,0|2,0,0]=4 9358 B13R2.13 Brc1cc(ccc1)C=2NCCN2 Amb18068030 [0,1,0,1,0,0|2,0,0]=4 9359 B13R2.13 Brc1cccc(c1)C2NCCO2 Amb17344017 [0,1,0,1,0,0|1,0,1]=4 9360 B13R2.13 Cc1cc(ccc1)C=2CCCC2 Amb25716467 [0,1,0,1,0,0|2,0,0]=4 9361 B13R2.13 Cc1cc(ccc1)C=2CCCN2 Amb24053770 [0,1,0,1,0,0|2,0,0]=4 9362 B13R2.13 Cc1cccc([n]1)C2=CCCO2 Amb25370051 [0,1,0,1,0,0|2,0,0]=4 9363 B13R2.13 Cc1cccc(c1)C2NCCO2 Amb17334582 [0,1,0,1,0,0|1,0,1]=4 9364 B13R2.13 Cc1cccc(c1)C2OCCO2 Amb17334607 [0,1,0,1,0,0|0,0,2]=4 9365 B13R2.13 Clc1cc([n]cc1)C2=NCCO2 Amb25674410 [0,1,0,1,0,0|2,0,0]=4 9366 B13R2.13 Clc1cc(ccc1)C=2CCCN2 Amb22285357 [0,1,0,1,0,0|2,0,0]=4 9367 B13R2.13 Clc1cccc(c1)C2NCCO2 Amb17335656 [0,1,0,1,0,0|1,0,1]=4 9368 B13R2.13 Clc1cccc(c1)C2OCCO2 Amb17335723 [0,1,0,1,0,0|0,0,2]=4 9369 B13R2.13 Fc1cc(ccc1)C2NCCO2 Amb18563793 [0,1,0,1,0,0|1,0,1]=4 9370 B13R2.13 Fc1cc(ccc1)C=2CCCN2 Amb24053772 [0,1,0,1,0,0|2,0,0]=4 9371 B13R2.13 Fc1cccc(c1)C2=NCCN2 Amb17578184 [0,1,0,1,0,0|2,0,0]=4 9372 B13R2.13 Nc1cc(ccc1)C2=NCCO2 Amb18063924 [0,1,0,1,0,0|1,0,0]=3 9373 B13R2.13 Nc1cc(ccc1)C=2NCCN2 Amb22283370 [0,1,0,1,0,0|2,0,0]=4 9374 B13R2.13 Nc1cccc([n]1)C2=NCCO2 Amb24411946 [0,1,0,1,0,0|2,0,0]=4 9375 B13R2.13 Nc1cccc(c1)C2=CCCC2 Amb17107089 [0,1,0,1,0,0|2,0,0]=4 9376 B13R2.13 Nc1cccc(c1)C2=NCCN2 Amb10070819 [0,1,0,1,0,0|2,0,0]=4 9377 B13R2.13 Nc1cccc(c1)C2=NCCN2 Amb1051645 [0,1,0,1,0,0|2,0,0]=4 9378 B13R2.13 Nc1cccc(c1)C2CCCO2 Amb17334585 [0,1,0,1,0,0|1,0,1]=4 9379 B13R2.13 Oc1cc(ccc1)B2OCCO2 Amb24061454 [0,1,0,1,0,0|1,0,1]=4 9380 B13R2.13 Oc1cc(ccc1)C2=NCCO2 Amb24620105 [0,1,0,1,0,0|1,0,0]=3 9381 B13R2.13 Oc1cc(ccc1)C2=NCCS2 Amb18648261 [0,1,0,1,0,0|1,1,0]=4 9382 B13R2.13 Oc1cccc(c1)C2=NCCN2 Amb10070818 [0,1,0,1,0,0|2,0,0]=4 9383 B13R2.13 Oc1cccc(c1)C2NCCO2 Amb17334631 [0,1,0,1,0,0|1,0,1]=4 9384 B13R2.13 Oc1cccc(c1)C2OCCO2 Amb17334664 [0,1,0,1,0,0|0,0,2]=4 9385 B13R2.13 Sc1cc(ccc1)C=2NCCN2 Amb24085252 [0,1,0,1,0,0|2,0,0]=4 9386 B13R2.13 [NH3+]c1cccc(c1)C2=NCCN2 Amb10070016 [0,1,0,1,0,0|2,0,0]=4 9387 B13R2.162 Brc1ccc2c(c1)C(=O)CCC2 Amb2383551 [0,1,0,1,0,0|1,0,0]=3 9388 B13R2.162 Brc1ccc2c(c1)C(=O)CCO2 Amb1159443 [0,1,0,1,0,0|2,0,0]=4 9389 B13R2.162 Brc1ccc2c(c1)C(=O)COC2 Amb16233090 [0,1,0,1,0,0|2,0,0]=4 9390 B13R2.162 Brc1ccc2c(c1)C(=O)NCC2 Amb10603904 [0,1,0,1,0,0|1,0,0]=3 9391 B13R2.162 CC1=CCCc2ccc(Cl)cc21 Amb24382869 [0,1,0,1,0,0|2,0,0]=4 9392 B13R2.162 CC1=NCCc2ccc(F)cc21 Amb24092082 [0,1,0,1,0,0|2,0,0]=4 9393 B13R2.162 Cc1cc2C(=O)CCCc2c[n]1 Amb25036402 [0,1,0,1,0,0|2,0,0]=4 9394 B13R2.162 Cc1ccc2CCNC(=O)c2[n]1 Amb24554157 [0,1,0,1,0,0|2,0,0]=4 9395 B13R2.162 Cc1ccc2CCOC(=O)c2c1 Amb25325648 [0,1,0,1,0,0|0,0,0]=2 9396 B13R2.162 Cc1ccc2COCC(=O)c2c1 Amb25039284 [0,1,0,1,0,0|2,0,0]=4 9397 B13R2.162 Cc1ccc2CSCC(=O)c2c1 Amb25142724 [0,1,0,1,0,0|2,0,0]=4 9398 B13R2.162 Cc1ccc2c(c1)C(=O)CCN2 Amb10811774 [0,1,0,1,0,0|2,0,0]=4 9399 B13R2.162 Cc1ccc2c(c1)C(=O)CCS2 Amb2438157 [0,1,0,1,0,0|2,0,0]=4 9400 B13R2.162 Cc1ccc2c(c1)C(=O)CNC2 Amb17194297 [0,1,0,1,0,0|2,0,0]=4 9401 B13R2.162 Cc1ccc2c(c1)C(=O)NCC2 Amb17205807 [0,1,0,1,0,0|1,0,0]=3 9402 B13R2.162 Clc1ccc2c(c1)C(=O)CCC2 Amb2383549 [0,1,0,1,0,0|1,0,0]=3 9403 B13R2.162 Clc1ccc2c(c1)C(=O)CCN2 Amb16231038 [0,1,0,1,0,0|2,0,0]=4 9404 B13R2.162 Clc1ccc2c(c1)C(=O)CCS2 Amb1156672 [0,1,0,1,0,0|2,0,0]=4 9405 B13R2.162 Clc1ccc2c(c1)C(=O)CNC2 Amb17194299 [0,1,0,1,0,0|2,0,0]=4 9406 B13R2.162 Clc1ccc2c(c1)C(=O)NCC2 Amb17205801 [0,1,0,1,0,0|1,0,0]=3 9407 B13R2.162 Fc1ccc2c(c1)C(=O)CCC2 Amb2383550 [0,1,0,1,0,0|1,0,0]=3 9408 B13R2.162 Fc1ccc2c(c1)C(=O)CCS2 Amb1154161 [0,1,0,1,0,0|2,0,0]=4 9409 B13R2.162 Fc1ccc2c(c1)C(=O)CNC2 Amb17194298 [0,1,0,1,0,0|2,0,0]=4 9410 B13R2.162 Fc1ccc2c(c1)C(=O)NCC2 Amb17205808 [0,1,0,1,0,0|1,0,0]=3 9411 B13R2.162 Ic1ccc2c(c1)C(=O)CCC2 Amb16232420 [0,1,0,1,0,0|1,0,0]=3 9412 B13R2.162 Ic1ccc2c(c1)C(=O)CCO2 Amb2447108 [0,1,0,1,0,0|2,0,0]=4 9413 B13R2.162 Nc1c[n]c2CCCC(=O)c2c1 Amb18829717 [0,1,0,1,0,0|2,0,0]=4 9414 B13R2.162 Nc1cc2C(=O)CCNc2cc1 Amb19929523 [0,1,0,1,0,0|2,0,0]=4 9415 B13R2.162 Nc1cc2C(=O)CCSc2cc1 Amb18194419 [0,1,0,1,0,0|2,0,0]=4 9416 B13R2.162 Nc1cc2C(=O)NCNc2cc1 Amb24591807 [0,1,0,1,0,0|2,0,0]=4 9417 B13R2.162 Nc1ccc2CCNC(=O)c2c1 Amb19334962 [0,1,0,1,0,0|1,0,0]=3 9418 B13R2.162 Nc1ccc2CCOC(=O)c2c1 Amb18126361 [0,1,0,1,0,0|0,0,0]=2 9419 B13R2.162 Nc1ccc2c(c1)C(=O)CCO2 Amb17191578 [0,1,0,1,0,0|2,0,0]=4 9420 B13R2.162 Nc1ccc2c(c1)C(=O)NCC2 Amb17400107 [0,1,0,1,0,0|1,0,0]=3 9421 B13R2.162 O=C1C=C2C(=O)NCCN2C=C1 Amb20648791 [0,1,0,1,0,0|2,0,0]=4 9422 B13R2.162 O=C1CCCc2[n]cc(Br)cc21 Amb25857003 [0,1,0,1,0,0|2,0,0]=4 9423 B13R2.162 O=C1CCCc2[n]cc(Cl)cc21 Amb19959211 [0,1,0,1,0,0|2,0,0]=4 9424 B13R2.162 O=C1CCCc2c[n]c(Cl)cc21 Amb25759478 [0,1,0,1,0,0|2,0,0]=4 9425 B13R2.162 O=C1CCCc2ccc(Br)[n]c21 Amb24727125 [0,1,0,1,0,0|2,0,0]=4 9426 B13R2.162 O=C1CCCc2ccc(Cl)[n]c21 Amb23399670 [0,1,0,1,0,0|2,0,0]=4 9427 B13R2.162 O=C1CCNc2ccc(F)cc21 Amb18062524 [0,1,0,1,0,0|2,0,0]=4 9428 B13R2.162 O=C1CCNc2ccc(I)cc21 Amb24680680 [0,1,0,1,0,0|2,0,0]=4 9429 B13R2.162 O=C1CCOc2ccc(F)cc12 Amb22274866 [0,1,0,1,0,0|2,0,0]=4 9430 B13R2.162 O=C1CCOc2ccc(S)cc21 Amb24746687 [0,1,0,1,0,0|2,0,0]=4 9431 B13R2.162 O=C1CC[Se]c2ccc(Br)cc21 Amb22347343 [0,1,0,1,0,0|2,0,0]=4 9432 B13R2.162 O=C1COCc2ccc(Cl)cc21 Amb24081641 [0,1,0,1,0,0|2,0,0]=4 9433 B13R2.162 O=C1COCc2ccc(F)cc21 Amb24623435 [0,1,0,1,0,0|2,0,0]=4 9434 B13R2.162 O=C1COCc2ccc(I)cc21 Amb24081712 [0,1,0,1,0,0|2,0,0]=4 9435 B13R2.162 O=C1CSCc2ccc(Cl)cc21 Amb24475354 [0,1,0,1,0,0|2,0,0]=4 9436 B13R2.162 O=C1CSCc2ccc(F)cc21 Amb25306783 [0,1,0,1,0,0|2,0,0]=4 9437 B13R2.162 O=C1NCCc2[n]cc(Cl)cc21 Amb24726220 [0,1,0,1,0,0|2,0,0]=4 9438 B13R2.162 O=C1NCCc2c[n]c(Cl)cc21 Amb25291792 [0,1,0,1,0,0|2,0,0]=4 9439 B13R2.162 O=C1NCCc2ccc(Cl)[n]c21 Amb24080684 [0,1,0,1,0,0|2,0,0]=4 9440 B13R2.162 O=C1NCCc2ccc(Cl)[n]c21 Amb25063230 [0,1,0,1,0,0|2,0,0]=4 9441 B13R2.162 O=C1NCCc2ccc(I)cc21 Amb22233848 [0,1,0,1,0,0|1,0,0]=3 9442 B13R2.162 O=C1OC=Cc2ccc(Cl)cc21 Amb25251555 [0,1,0,1,0,0|0,0,2]=4 9443 B13R2.162 O=C1OC=Nc2ccc(Br)cc21 Amb19957642 [0,1,0,1,0,0|1,0,1]=4 9444 B13R2.162 O=C1OCCc2ccc(Br)cc21 Amb25316175 [0,1,0,1,0,0|0,0,0]=2 9445 B13R2.162 O=C1OCCc2ccc(I)cc21 Amb25723044 [0,1,0,1,0,0|0,0,0]=2 9446 B13R2.162 O=C1OCOc2ccc(Br)cc21 Amb24077633 [0,1,0,1,0,0|1,0,0]=3 9447 B13R2.162 O=C1OCOc2ccc(F)cc21 Amb24077629 [0,1,0,1,0,0|1,0,0]=3 9448 B13R2.162 O=c1oc[n]c2ccc(I)cc21 Amb24081715 [0,1,0,1,0,0|1,0,1]=4 9449 B13R2.162 Oc1cc2C(=O)CCNc2cc1 Amb25068896 [0,1,0,1,0,0|2,0,0]=4 9450 B13R2.162 Oc1cc2C(=O)OC=Cc2cc1 Amb25347575 [0,1,0,1,0,0|0,0,2]=4 9451 B13R2.162 Oc1ccc2CCNC(=O)c2c1 Amb18061676 [0,1,0,1,0,0|1,0,0]=3 9452 B13R2.162 Oc1ccc2CCOC(=O)c2c1 Amb18645961 [0,1,0,1,0,0|0,0,0]=2 9453 B13R2.162 Oc1ccc2COCC(=O)c2c1 Amb25338211 [0,1,0,1,0,0|2,0,0]=4 9454 B13R2.162 S=C1NCCc2ccc(Cl)cc21 Amb24341849 [0,1,0,1,0,0|1,1,0]=4 9455 B13R2.342 Cc1[n]ccc2C(=O)CCCc21 Amb24613103 [0,1,0,1,0,0|2,0,0]=4 9456 B13R2.342 Cc1cc[n]c2C(=O)CCCc21 Amb25793500 [0,1,0,1,0,0|2,0,0]=4 9457 B13R2.342 Cc1cccc2C(=O)CCNc21 Amb18062582 [0,1,0,1,0,0|2,0,0]=4 9458 B13R2.342 Cc1cccc2C(=O)CCSc21 Amb18180837 [0,1,0,1,0,0|2,0,0]=4 9459 B13R2.342 Cc1cccc2C(=O)CNCc21 Amb24511581 [0,1,0,1,0,0|2,0,0]=4 9460 B13R2.342 Cc1cccc2C(=O)CSCc21 Amb24456631 [0,1,0,1,0,0|2,0,0]=4 9461 B13R2.342 Cc1cccc2C(=O)OCCc21 Amb24497706 [0,1,0,1,0,0|0,0,0]=2 9462 B13R2.342 Cc1cccc2C(=S)NCCc21 Amb25361003 [0,1,0,1,0,0|1,1,0]=4 9463 B13R2.342 Nc1c[n]cc2C(=O)CCCc21 Amb24371165 [0,1,0,1,0,0|2,0,0]=4 9464 B13R2.342 Nc1cccc2C(=O)CCCc21 Amb18126290 [0,1,0,1,0,0|1,0,0]=3 9465 B13R2.342 Nc1cccc2C(=O)CCNc21 Amb18645668 [0,1,0,1,0,0|2,0,0]=4 9466 B13R2.342 Nc1cccc2C(=O)CCSc21 Amb18194418 [0,1,0,1,0,0|2,0,0]=4 9467 B13R2.342 Nc1cccc2C(=O)N=CCc21 Amb25740504 [0,1,0,1,0,0|1,0,1]=4 9468 B13R2.342 Nc1cccc2C(=O)NCCc21 Amb22496660 [0,1,0,1,0,0|1,0,0]=3 9469 B13R2.342 Nc1cccc2C(=O)OC=Cc21 Amb18645434 [0,1,0,1,0,0|0,0,2]=4 9470 B13R2.342 Nc1cccc2C(=O)OCCc21 Amb24089240 [0,1,0,1,0,0|0,0,0]=2 9471 B13R2.342 O=C1CCCc2c(Br)[n]ccc21 Amb25160034 [0,1,0,1,0,0|2,0,0]=4 9472 B13R2.342 O=C1CCCc2c(Cl)cc[n]c21 Amb22754632 [0,1,0,1,0,0|2,0,0]=4 9473 B13R2.342 O=C1CCCc2c(S)cccc21 Amb24360727 [0,1,0,1,0,0|1,0,0]=3 9474 B13R2.342 O=C1CCCc2c1cccc2C Amb17087874 [0,1,0,1,0,0|1,0,0]=3 9475 B13R2.342 O=C1CCCc2c1cccc2Cl Amb2383554 [0,1,0,1,0,0|1,0,0]=3 9476 B13R2.342 O=C1CCCc2c1cccc2F Amb2383555 [0,1,0,1,0,0|1,0,0]=3 9477 B13R2.342 O=C1CCCc2c1cccc2I Amb16233081 [0,1,0,1,0,0|1,0,0]=3 9478 B13R2.342 O=C1CCNc2c(Br)cccc21 Amb18753478 [0,1,0,1,0,0|2,0,0]=4 9479 B13R2.342 O=C1CCNc2c1cccc2Cl Amb1773286 [0,1,0,1,0,0|2,0,0]=4 9480 B13R2.342 O=C1CCOc2c(S)cccc21 Amb25367268 [0,1,0,1,0,0|2,0,0]=4 9481 B13R2.342 O=C1CCOc2c1cccc2N Amb17570075 [0,1,0,1,0,0|2,0,0]=4 9482 B13R2.342 O=C1CNCc2c(F)cccc21 Amb24638444 [0,1,0,1,0,0|2,0,0]=4 9483 B13R2.342 O=C1COCc2c(Br)cccc21 Amb24066341 [0,1,0,1,0,0|2,0,0]=4 9484 B13R2.342 O=C1COCc2c(Cl)cccc21 Amb24066345 [0,1,0,1,0,0|2,0,0]=4 9485 B13R2.342 O=C1COCc2c(F)cccc21 Amb21964895 [0,1,0,1,0,0|2,0,0]=4 9486 B13R2.342 O=C1COCc2c(I)cccc21 Amb24066354 [0,1,0,1,0,0|2,0,0]=4 9487 B13R2.342 O=C1CSCc2c(Cl)cccc21 Amb25098806 [0,1,0,1,0,0|2,0,0]=4 9488 B13R2.342 O=C1CSCc2c(F)cccc21 Amb22157287 [0,1,0,1,0,0|2,0,0]=4 9489 B13R2.342 O=C1NCCc2c(Br)c[n]cc21 Amb24058272 [0,1,0,1,0,0|2,0,0]=4 9490 B13R2.342 O=C1NCCc2c(Br)cccc21 Amb22002114 [0,1,0,1,0,0|1,0,0]=3 9491 B13R2.342 O=C1NCCc2c(I)cccc21 Amb24330771 [0,1,0,1,0,0|1,0,0]=3 9492 B13R2.342 O=C1NCCc2c1cccc2C Amb17400086 [0,1,0,1,0,0|1,0,0]=3 9493 B13R2.342 O=C1OC=Cc2c(Br)cccc21 Amb22500900 [0,1,0,1,0,0|0,0,2]=4 9494 B13R2.342 O=C1OCCc2c(Cl)cccc21 Amb25808071 [0,1,0,1,0,0|0,0,0]=2 9495 B13R2.342 O=C1OCNc2c(Cl)cccc21 Amb24424516 [0,1,0,1,0,0|1,0,0]=3 9496 B13R2.342 O=C1OCOc2c(Br)cccc21 Amb24077635 [0,1,0,1,0,0|1,0,0]=3 9497 B13R2.342 O=C1OCOc2c(F)cccc21 Amb24077631 [0,1,0,1,0,0|1,0,0]=3 9498 B13R2.342 Oc1cccc2C(=O)CCNc21 Amb22372295 [0,1,0,1,0,0|2,0,0]=4 9499 B13R2.342 Oc1cccc2C(=O)CCOc21 Amb24070316 [0,1,0,1,0,0|2,0,0]=4 9500 B13R2.342 Oc1cccc2C(=O)CNCc21 Amb25224095 [0,1,0,1,0,0|2,0,0]=4 9501 B13R2.342 Oc1cccc2C(=O)COCc21 Amb25314324 [0,1,0,1,0,0|2,0,0]=4 9502 B13R2.342 Oc1cccc2C(=O)OCCc21 Amb25084444 [0,1,0,1,0,0|0,0,0]=2 9503 B13R2.3018 Brc1cccc(c1)C2(C)CCO2 Amb10975946 [0,1,0,1,0,0|1,0,1]=4 9504 B13R2.4857 CC1=CC(=O)c2c1cccc2C Amb24691701 [0,1,0,1,0,0|1,0,1]=4 9505 B13R2.4857 CC1CC(=O)c2c(O)cccc21 Amb18645633 [0,1,0,1,0,0|1,0,0]=3 9506 B13R2.4857 CC1NC(=O)c2c(O)cccc21 Amb25246860 [0,1,0,1,0,0|1,0,0]=3 9507 B13R2.4857 CC1OB(O)c2c(N)cccc21 Amb25801048 [0,1,0,1,0,0|1,0,1]=4 9508 B13R2.4857 CC1OB(O)c2cccc(F)c21 Amb25739678 [0,1,0,1,0,0|1,0,1]=4 9509 B13R2.4857 CC1OC(=O)c2c(Cl)cccc21 Amb24564116 [0,1,0,1,0,0|0,0,0]=2 9510 B13R2.4857 CC1OC(=O)c2c(N)cccc21 Amb20620287 [0,1,0,1,0,0|0,0,0]=2 9511 B13R2.4857 CC1OC(=O)c2c(O)cccc21 Amb25135497 [0,1,0,1,0,0|0,0,0]=2 9512 B13R2.4857 CC1OC(=O)c2cccc(O)c21 Amb24497286 [0,1,0,1,0,0|0,0,0]=2 9513 B13R2.4857 CC1OC(=S)c2c(O)cccc21 Amb24662489 [0,1,0,1,0,0|0,1,0]=3 9514 B13R2.4857 CC1OC(C)c2cccc(N)c21 Amb25148769 [0,1,0,1,0,0|1,0,1]=4 9515 B13R2.4857 CN1CC(=O)c2cccc(Br)c12 Amb18160222 [0,1,0,1,0,0|2,0,0]=4 9516 B13R2.4857 CN1CC(=O)c2cccc(N)c12 Amb18829719 [0,1,0,1,0,0|2,0,0]=4 9517 B13R2.4857 CN1NC(=O)c2c(N)cccc12 Amb24564482 [0,1,0,1,0,0|2,0,0]=4 9518 B13R2.4857 Cc1c[n]cc2[C@@H](C)CC(=O)c12 Amb25773370 [0,1,0,1,0,0|2,0,0]=4 9519 B13R2.4857 Cc1cccc2C(=O)OC(O)c21 Amb24060115 [0,1,0,1,0,0|1,0,0]=3 9520 B13R2.4857 Cc1cccc2C(C)CC(=O)c12 Amb24646446 [0,1,0,1,0,0|1,0,0]=3 9521 B13R2.4857 Cc1cccc2C(O)OC(=O)c12 Amb17843912 [0,1,0,1,0,0|1,0,0]=3 9522 B13R2.4857 Cc1cccc2[C@@H](C)CC(=O)c12 Amb24570365 [0,1,0,1,0,0|1,0,0]=3 9523 B13R2.4857 Cc1cccc2[C@@H](N)CC(=O)c21 Amb25234956 [0,1,0,1,0,0|2,0,0]=4 9524 B13R2.4857 Cc1cccc2[C@H](N)CC(=O)c21 Amb24641578 [0,1,0,1,0,0|2,0,0]=4 9525 B13R2.4857 Cc1cccc2c1C(C)NC2=O Amb25311458 [0,1,0,1,0,0|1,0,0]=3 9526 B13R2.4857 NC1CC(=O)c2c(F)cccc21 Amb24419420 [0,1,0,1,0,0|2,0,0]=4 9527 B13R2.4857 NC1CC(=O)c2c(I)cccc21 Amb25124714 [0,1,0,1,0,0|2,0,0]=4 9528 B13R2.4857 NC1CC(=O)c2c1c(Br)ccc2 Amb17472098 [0,1,0,1,0,0|2,0,0]=4 9529 B13R2.4857 NC1CC(=O)c2c1c(C)ccc2 Amb17470420 [0,1,0,1,0,0|2,0,0]=4 9530 B13R2.4857 NC1CC(=O)c2c1c(Cl)ccc2 Amb17470646 [0,1,0,1,0,0|2,0,0]=4 9531 B13R2.4857 NC1CC(=O)c2c1c(F)ccc2 Amb17470455 [0,1,0,1,0,0|2,0,0]=4 9532 B13R2.4857 N[C@@H]1CC(=O)c2c(F)cccc21 Amb24674092 [0,1,0,1,0,0|2,0,0]=4 9533 B13R2.4857 N[C@@H]1CC(=O)c2cccc(Cl)c21 Amb25039304 [0,1,0,1,0,0|2,0,0]=4 9534 B13R2.4857 N[C@H]1CC(=O)c2c(Cl)cccc21 Amb25067990 [0,1,0,1,0,0|2,0,0]=4 9535 B13R2.4857 N[C@H]1CC(=O)c2cccc(I)c21 Amb25301699 [0,1,0,1,0,0|2,0,0]=4 9536 B13R2.4857 Nc1cccc2[C@@H](N)CC(=O)c12 Amb25733600 [0,1,0,1,0,0|2,0,0]=4 9537 B13R2.4857 Nc1cccc2c1C(=O)OC2=O Amb22233088 [0,1,0,1,0,0|1,0,1]=4 9538 B13R2.4857 Nc1cccc2c1C(N)CC2=O Amb25799529 [0,1,0,1,0,0|2,0,0]=4 9539 B13R2.4857 O=C1OC(=O)c2cccc(I)c12 Amb19886550 [0,1,0,1,0,0|1,0,1]=4 9540 B13R2.4857 O=C1OC(Br)c2c(Cl)cccc21 Amb25069416 [0,1,0,1,0,0|1,0,0]=3 9541 B13R2.4857 O=C1OC(Br)c2c(F)cccc21 Amb24056828 [0,1,0,1,0,0|1,0,0]=3 9542 B13R2.4857 O=C1OC(Br)c2cccc(Br)c21 Amb24056796 [0,1,0,1,0,0|1,0,0]=3 9543 B13R2.4857 O=C1OC(Br)c2cccc(F)c21 Amb24056819 [0,1,0,1,0,0|1,0,0]=3 9544 B13R2.4857 O=C1OC(Br)c2cccc(I)c21 Amb24593547 [0,1,0,1,0,0|1,0,0]=3 9545 B13R2.4857 OC1CC(=O)c2c1cccc2N Amb10975543 [0,1,0,1,0,0|2,0,0]=4 9546 B13R2.4857 OC1CC(=O)c2cccc(F)c21 Amb25674451 [0,1,0,1,0,0|2,0,0]=4 9547 B13R2.4857 OC1NC(=O)c2cccc(Br)c21 Amb25802010 [0,1,0,1,0,0|2,0,0]=4 9548 B13R2.4857 OC1NC(=O)c2cccc(F)c21 Amb25241612 [0,1,0,1,0,0|2,0,0]=4 9549 B13R2.4857 OC1OC(=O)c2c(Cl)cccc21 Amb18935869 [0,1,0,1,0,0|1,0,0]=3 9550 B13R2.4857 OC1OC(=O)c2c(F)cccc21 Amb18936162 [0,1,0,1,0,0|1,0,0]=3 9551 B13R2.4857 OC1OC(=O)c2c(I)cccc21 Amb25081689 [0,1,0,1,0,0|1,0,0]=3 9552 B13R2.4857 OC1OC(=O)c2cccc(Br)c21 Amb22170361 [0,1,0,1,0,0|1,0,0]=3 9553 B13R2.4857 OC1OC(=O)c2cccc(Cl)c21 Amb25751357 [0,1,0,1,0,0|1,0,0]=3 9554 B13R2.4857 Oc1cccc2C(O)OC(=O)c12 Amb18936166 [0,1,0,1,0,0|1,0,0]=3 9555 B13R2.5324 Cc1cc([n]cc1)C(=O)C2CC2 Amb25152660 [0,1,0,1,0,0|2,0,0]=4 9556 B13R2.5324 Cc1cc(cc[n]1)C(=O)C2CC2 Amb22730046 [0,1,0,1,0,0|2,0,0]=4 9557 B13R2.5324 Nc1cccc(c1)C(=O)C2CC2 Amb17138520 [0,1,0,1,0,0|1,0,0]=3 9558 B13R2.5324 O=C(C1CC1)c2c[n]cc(Br)c2 Amb23455627 [0,1,0,1,0,0|2,0,0]=4 9559 B13R2.5324 O=C(C1CC1)c2c[n]cc(Cl)c2 Amb23455119 [0,1,0,1,0,0|2,0,0]=4 9560 B13R2.5324 O=C(C1CC1)c2c[n]cc(F)c2 Amb18792620 [0,1,0,1,0,0|2,0,0]=4 9561 B13R2.5324 O=C(C1CC1)c2cc(Br)cc[n]2 Amb23455123 [0,1,0,1,0,0|2,0,0]=4 9562 B13R2.5324 O=C(C1CC1)c2cc(Cl)cc[n]2 Amb23455121 [0,1,0,1,0,0|2,0,0]=4 9563 B13R2.5324 O=C(C1CC1)c2cc[n]c(Br)c2 Amb23455125 [0,1,0,1,0,0|2,0,0]=4 9564 B13R2.5324 O=C(C1CC1)c2cccc(Br)[n]2 Amb19892364 [0,1,0,1,0,0|2,0,0]=4 9565 B13R2.5324 O=C(C1CC1)c2cccc(Cl)[n]2 Amb23455122 [0,1,0,1,0,0|2,0,0]=4 9566 B13R2.5324 O=C(C1CC1)c2cccc(I)c2 Amb25679299 [0,1,0,1,0,0|1,0,0]=3 9567 B13R2.5324 O=C(C1CO1)c2cccc(F)c2 Amb25793013 [0,1,0,1,0,0|2,0,0]=4 9568 B13R2.5324 O=C(c1c[n]cc(Br)c1)N2CC2 Amb24352954 [0,1,0,1,0,0|2,0,0]=4 9569 B13R2.5324 O=C(c1cc[n]c(Cl)c1)N2CC2 Amb24421581 [0,1,0,1,0,0|2,0,0]=4 9570 B13R2.5324 O=C(c1cc[n]c(F)c1)N2CC2 Amb25762680 [0,1,0,1,0,0|2,0,0]=4 9571 B13R2.5324 O=C(c1cccc(Br)c1)N2CC2 Amb24460687 [0,1,0,1,0,0|1,0,0]=3 9572 B13R2.5324 O=C(c1cccc(Cl)c1)N2CC2 Amb24106385 [0,1,0,1,0,0|1,0,0]=3 9573 B13R2.223 CC1(NCCO1)c2ccccc2 Amb24739762 [0,1,0,1,0,0|1,0,1]=4 9574 B13R2.223 CC1(OCCS1)c2ccccc2 Amb24604445 [0,1,0,1,0,0|0,1,1]=4 9575 B13R2.223 FC1(COCC1)c2ccccc2 Amb24636914 [0,1,0,1,0,0|1,0,1]=4 9576 B13R2.223 NC1(COCC1)c2ccccc2 Amb24120651 [0,1,0,1,0,0|1,0,1]=4 9577 B13R2.223 O=P1(CCCC1)c2ccccc2 Amb25833532 [0,1,0,1,0,0|2,0,0]=4 9578 B13R2.223 OC1(CCCO1)c2ccccc2 Amb22752498 [0,1,0,1,0,0|0,0,2]=4 9579 B13R2.371 C=C1CNC(=O)c2ccccc21 Amb25835782 [0,1,0,1,0,0|1,0,1]=4 9580 B13R2.371 C=C1COC(=O)c2ccccc21 Amb22549604 [0,1,0,1,0,0|0,0,1]=3 9581 B13R2.371 CC1=CCC(N)c2ccccc21 Amb18645218 [0,1,0,1,0,0|2,0,0]=4 9582 B13R2.371 CC1=NNC(=O)c2ccccc21 Amb19132657 [0,1,0,1,0,0|1,0,1]=4 9583 B13R2.371 CC1=NOC(=O)c2ccccc21 Amb21927595 [0,1,0,1,0,0|0,0,1]=3 9584 B13R2.371 CC1CCC(=O)c2[n]cccc21 Amb25713621 [0,1,0,1,0,0|2,0,0]=4 9585 B13R2.371 CC1CCC(=O)c2ccc[n]c21 Amb24648708 [0,1,0,1,0,0|2,0,0]=4 9586 B13R2.371 CC1CNC(=S)c2ccccc21 Amb25324007 [0,1,0,1,0,0|1,1,0]=4 9587 B13R2.371 CC1COC(=O)c2c[n]ccc21 Amb24487148 [0,1,0,1,0,0|1,0,0]=3 9588 B13R2.371 CN1C=CC(=O)c2ccccc12 Amb18048473 [0,1,0,1,0,0|1,0,1]=4 9589 B13R2.371 CN1C=NC(=O)c2ccccc12 Amb22752698 [0,1,0,1,0,0|1,0,1]=4 9590 B13R2.371 CN1CCC(=O)c2ccccc12 Amb18560299 [0,1,0,1,0,0|1,0,0]=3 9591 B13R2.371 C[C@H]1CCC(=O)c2ccccc21 Amb25830043 [0,1,0,1,0,0|1,0,0]=3 9592 B13R2.371 C[C@H]1CNC(=S)c2ccccc21 Amb24756583 [0,1,0,1,0,0|1,1,0]=4 9593 B13R2.371 C[N+]1=CNC(=O)c2ccccc12 Amb24447072 [0,1,0,1,0,0|1,0,1]=4 9594 B13R2.371 NC1CCC(=O)c2ccccc21 Amb20624438 [0,1,0,1,0,0|1,0,0]=3 9595 B13R2.371 NC1CCS(=O)c2ccccc21 Amb18943726 [0,1,0,1,0,0|2,0,0]=4 9596 B13R2.371 NC1CNC(=O)c2[n]cccc21 Amb18829367 [0,1,0,1,0,0|2,0,0]=4 9597 B13R2.371 NC1CNC(=O)c2ccccc21 Amb18645672 [0,1,0,1,0,0|1,0,0]=3 9598 B13R2.371 N[C@H]1CCC(=O)c2ccccc21 Amb25210687 [0,1,0,1,0,0|1,0,0]=3 9599 B13R2.371 O=C1CCC(=O)c2ccccc12 Amb24054332 [0,1,0,1,0,0|1,0,1]=4 9600 B13R2.371 O=C1CCC(Br)c2ccccc21 Amb25262943 [0,1,0,1,0,0|1,0,0]=3 9601 B13R2.371 O=C1CCC(F)c2ccccc21 Amb24059980 [0,1,0,1,0,0|1,0,0]=3 9602 B13R2.371 O=C1CCS(=O)c2ccccc12 Amb18178842 [0,1,0,1,0,0|2,0,0]=4 9603 B13R2.371 O=C1CSC(Cl)c2ccccc21 Amb18636498 [0,1,0,1,0,0|1,1,0]=4 9604 B13R2.371 O=C1NCC(=O)c2ccccc12 Amb22372293 [0,1,0,1,0,0|1,0,1]=4 9605 B13R2.371 O=C1NCC(c2c1cccc2)C Amb17400088 [0,1,0,1,0,0|1,0,0]=3 9606 B13R2.371 O=C1NCC(c2c1cccc2)O Amb17615447 [0,1,0,1,0,0|1,0,0]=3 9607 B13R2.371 O=C1NCS(=O)c2ccccc12 Amb25667389 [0,1,0,1,0,0|2,0,0]=4 9608 B13R2.371 O=C1OCC(=O)c2ccccc12 Amb24078409 [0,1,0,1,0,0|0,0,1]=3 9609 B13R2.371 OC1C=CC(=O)c2ccccc21 Amb25706969 [0,1,0,1,0,0|1,0,1]=4 9610 B13R2.371 OC1CCC(=O)c2ccccc21 Amb22170418 [0,1,0,1,0,0|1,0,0]=3 9611 B13R2.371 O[C@@H]1CCC(=O)c2ccccc21 Amb25718269 [0,1,0,1,0,0|1,0,0]=3 9612 B13R2.371 O[C@H]1CCC(=O)c2ccccc21 Amb24690507 [0,1,0,1,0,0|1,0,0]=3 9613 B13R2.382 CC1=NC1C(=O)c2ccccc2 Amb25093643 [0,1,0,1,0,0|1,0,1]=4 9614 B13R2.382 C[C@@H]1C[C@H]1C(=O)c2ccccc2 Amb25273102 [0,1,0,1,0,0|1,0,0]=3 9615 B13R2.382 C[C@@H]1O[C@@H]1C(=O)c2ccccc2 Amb24608586 [0,1,0,1,0,0|0,0,0]=2 9616 B13R2.382 C[C@@H]1O[C@H]1C(=O)c2ccccc2 Amb25179812 [0,1,0,1,0,0|0,0,0]=2 9617 B13R2.382 C[C@H]1O[C@@H]1[C@H](O)c2ccccc2 Amb24580699 [0,1,0,1,0,0|0,0,2]=4 9618 B13R2.382 C[C@H]1O[C@H]1C(=O)c2ccccc2 Amb24583082 [0,1,0,1,0,0|0,0,0]=2 9619 B13R2.382 O=C(C1CC1Cl)c2ccccc2 Amb24105352 [0,1,0,1,0,0|1,0,0]=3 9620 B13R2.382 O=C([C@@H]1C[C@H]1Cl)c2ccccc2 Amb24552920 [0,1,0,1,0,0|1,0,0]=3 9621 B13R2.633 CC1(OC1CN)c2ccccc2 Amb25148602 [0,1,0,1,0,0|1,0,1]=4 9622 B13R2.690 C=C(OC1CC1)c2ccccc2 Amb24623165 [0,1,0,1,0,0|1,0,0]=3 9623 B13R2.690 Cl\C(=N\C1CC1)\c2ccccc2 Amb22086100 [0,1,0,1,0,0|2,0,0]=4 9624 B13R2.690 N=C(NC1CC1)c2ccccc2 Amb25148469 [0,1,0,1,0,0|2,0,0]=4 9625 B13R2.690 O=C(C=C1CC1)c2ccccc2 Amb24378392 [0,1,0,1,0,0|1,0,0]=3 9626 B13R2.690 O=C(CC1CC1)c2cc[n]cc2 Amb23455022 [0,1,0,1,0,0|2,0,0]=4 9627 B13R2.690 O=C(CC1CC1)c2ccc[n]c2 Amb24484100 [0,1,0,1,0,0|2,0,0]=4 9628 B13R2.690 O=C(CC1CC1)c2ccccc2 Amb18792232 [0,1,0,1,0,0|1,0,0]=3 9629 B13R2.690 O=C(OC1CC1)c2cc[n][n]c2 Amb25187726 [0,1,0,1,0,0|2,0,0]=4 9630 B13R2.690 O=C(OC1CC1)c2ccc[n]c2 Amb25762582 [0,1,0,1,0,0|1,0,0]=3 9631 B13R2.690 O=C(OC1CC1)c2cccc[n]2 Amb25801682 [0,1,0,1,0,0|1,0,0]=3 9632 B13R2.690 O=C(c1ccccc1)CN2CC2 Amb17400091 [0,1,0,1,0,0|1,0,0]=3 9633 B13R2.690 O=C(c1cccnc1)NC2CC2 Amb16191817 [0,1,0,1,0,0|2,0,0]=4 9634 B13R2.690 O=S(C[C@@H]1CO1)c2ccccc2 Amb25794361 [0,1,0,1,0,0|2,0,0]=4 9635 B13R2.690 O=S(C[C@H]1CO1)c2ccccc2 Amb25268882 [0,1,0,1,0,0|2,0,0]=4 9636 B13R2.5252 C=C1CCCCc2ccccc21 Amb23400875 [0,1,0,1,0,0|2,0,0]=4 9637 B13R2.5252 C=C1CCCOc2ccccc21 Amb19316319 [0,1,0,1,0,0|2,0,0]=4 9638 B13R2.5252 C=C1CNCCc2ccccc21 Amb25096241 [0,1,0,1,0,0|2,0,0]=4 9639 B13R2.5252 CC1=NCCSc2ccccc21 Amb25241838 [0,1,0,1,0,0|2,0,0]=4 9640 B13R2.5252 NC1=NCCCc2ccccc21 Amb24382490 [0,1,0,1,0,0|2,0,0]=4 9641 B13R2.5252 O=C1C=CCSc2ccccc21 Amb24730346 [0,1,0,1,0,0|1,0,1]=4 9642 B13R2.5252 O=C1CCCCc2[n]cccc21 Amb25756978 [0,1,0,1,0,0|2,0,0]=4 9643 B13R2.5252 O=C1CCCCc2c1cccc2 Amb1208402 [0,1,0,1,0,0|1,0,0]=3 9644 B13R2.5252 O=C1CCCCc2c[n]ccc21 Amb24738433 [0,1,0,1,0,0|2,0,0]=4 9645 B13R2.5252 O=C1CCCNc2[n]cccc21 Amb24664337 [0,1,0,1,0,0|2,0,0]=4 9646 B13R2.5252 O=C1CCCNc2c1cccc2 Amb17621762 [0,1,0,1,0,0|1,0,0]=3 9647 B13R2.5252 O=C1CCCNc2c[n]ccc21 Amb25159693 [0,1,0,1,0,0|2,0,0]=4 9648 B13R2.5252 O=C1CCCNc2cc[n]cc21 Amb24346451 [0,1,0,1,0,0|2,0,0]=4 9649 B13R2.5252 O=C1CCCSc2c1cccc2 Amb2413576 [0,1,0,1,0,0|1,0,0]=3 9650 B13R2.5252 O=C1CCNCc2ccccc21 Amb22499160 [0,1,0,1,0,0|1,0,0]=3 9651 B13R2.5252 O=C1CCOCc2ccccc21 Amb24381288 [0,1,0,1,0,0|1,0,0]=3 9652 B13R2.5252 O=C1CNCCc2[n]cccc21 Amb24424611 [0,1,0,1,0,0|2,0,0]=4 9653 B13R2.5252 O=C1CSCCc2ccccc21 Amb20668935 [0,1,0,1,0,0|0,1,0]=3 9654 B13R2.5252 O=C1NCC=Cc2ccccc21 Amb24386486 [0,1,0,1,0,0|1,0,1]=4 9655 B13R2.5252 O=C1NCC=Nc2ccccc21 Amb23592207 [0,1,0,1,0,0|1,0,1]=4 9656 B13R2.5252 O=C1NCCCc2c1cccc2 Amb17470422 [0,1,0,1,0,0|1,0,0]=3 9657 B13R2.5252 O=C1NCCCc2cc[n]cc21 Amb24497162 [0,1,0,1,0,0|2,0,0]=4 9658 B13R2.5252 O=C1NCCCc2ccc[n]c21 Amb25060164 [0,1,0,1,0,0|2,0,0]=4 9659 B13R2.5252 O=C1NCCNc2[n]cccc21 Amb25152379 [0,1,0,1,0,0|2,0,0]=4 9660 B13R2.5252 O=C1NCCNc2cc[n]cc21 Amb24728517 [0,1,0,1,0,0|2,0,0]=4 9661 B13R2.5252 O=C1NCCNc2ccccc21 Amb19958708 [0,1,0,1,0,0|1,0,0]=3 9662 B13R2.5252 O=C1NCCOc2c1cccc2 Amb2445337 [0,1,0,1,0,0|1,0,0]=3 9663 B13R2.5252 O=C1OCCCc2ccccc21 Amb24415736 [0,1,0,1,0,0|0,0,0]=2 9664 B13R2.5252 O=C1ONCNc2ccccc21 Amb23313783 [0,1,0,1,0,0|1,0,0]=3 9665 B13R2.5252 O=C1ONCNc2ccccc21 Amb23313784 [0,1,0,1,0,0|1,0,0]=3 9666 B13R2.5252 O=S1CCCCc2ccccc12 Amb25300750 [0,1,0,1,0,0|2,0,0]=4 9667 B13R2.5252 O=S1CCCNc2ccccc12 Amb19337771 [0,1,0,1,0,0|2,0,0]=4 9668 B13R2.5252 O=S1CCNCc2ccccc12 Amb25217617 [0,1,0,1,0,0|2,0,0]=4 9669 B13R2.5252 OC1OCCCc2ccccc21 Amb24488564 [0,1,0,1,0,0|0,0,2]=4 9670 B13R2.5252 S=C1NCCSc2ccccc21 Amb25804707 [0,1,0,1,0,0|1,1,0]=4 9671 B13R2.8137 O=C(C1CCC1)c2cc[n]cc2 Amb23455037 [0,1,0,1,0,0|2,0,0]=4 9672 B13R2.8137 O=C(C1CCC1)c2ccc[n]c2 Amb23455035 [0,1,0,1,0,0|2,0,0]=4 9673 B13R2.8137 O=C(C1CNC1)c2cc[n]cc2 Amb23598774 [0,1,0,1,0,0|2,0,0]=4 9674 B13R2.8137 O=C(C1CNC1)c2ccc[n]c2 Amb23598775 [0,1,0,1,0,0|2,0,0]=4 9675 B13R2.8137 O=C(C1CNC1)c2cccc[n]2 Amb23598776 [0,1,0,1,0,0|2,0,0]=4 9676 B13R2.8137 O=C(C1CNC1)c2ccccc2 Amb22230239 [0,1,0,1,0,0|1,0,0]=3 9677 B13R2.8137 O=C(c1ccccc1)N2CCC2 Amb25155315 [0,1,0,1,0,0|1,0,0]=3 9678 B13R2.8137 O=S(C1CNC1)c2ccccc2 Amb25676084 [0,1,0,1,0,0|2,0,0]=4 9679 B13R2.32 BrC1CCc2c(C1=O)cccc2 Amb16232578 [0,1,0,1,0,0|1,0,0]=3 9680 B13R2.32 C=C1C(O)CCc2ccccc21 Amb24403889 [0,1,0,1,0,0|2,0,0]=4 9681 B13R2.32 C=C1CCc2ccccc2C1=O Amb18561613 [0,1,0,1,0,0|1,0,0]=3 9682 B13R2.32 C=C1COc2ccccc2C1=O Amb18063792 [0,1,0,1,0,0|2,0,0]=4 9683 B13R2.32 C=C1CSc2ccccc2C1=O Amb25143389 [0,1,0,1,0,0|2,0,0]=4 9684 B13R2.32 CC1CC[13c]2[13cH][13cH][13cH][13cH][13c]2C1=O Amb22055858 [0,1,0,1,0,0|1,0,0]=3 9685 B13R2.32 CC1CNc2ccccc2C1=O Amb18062583 [0,1,0,1,0,0|2,0,0]=4 9686 B13R2.32 CC1OCc2ccccc2C1=O Amb25713025 [0,1,0,1,0,0|2,0,0]=4 9687 B13R2.32 CC1SCc2ccccc2C1=O Amb25767812 [0,1,0,1,0,0|2,0,0]=4 9688 B13R2.32 CN1CCc2ccccc2C1=C Amb25111593 [0,1,0,1,0,0|2,0,0]=4 9689 B13R2.32 CN1CNc2ccccc2C1=O Amb25252919 [0,1,0,1,0,0|2,0,0]=4 9690 B13R2.32 CN1NCc2ccccc2C1=O Amb24556524 [0,1,0,1,0,0|2,0,0]=4 9691 B13R2.32 C[C@@H]1CCc2ccccc2C1=O Amb25320131 [0,1,0,1,0,0|1,0,0]=3 9692 B13R2.32 C[C@H]1CCc2ccccc2C1=O Amb24378466 [0,1,0,1,0,0|1,0,0]=3 9693 B13R2.32 C[C@H]1COc2ccccc2C1=O Amb25807608 [0,1,0,1,0,0|2,0,0]=4 9694 B13R2.32 C[N+]1=C(C)c2c(CC1)cccc2 Amb10553501 [0,1,0,1,0,0|2,0,0]=4 9695 B13R2.32 NC1CCc2[n]cccc2C1=O Amb24754454 [0,1,0,1,0,0|2,0,0]=4 9696 B13R2.32 NC1CCc2c[n]ccc2C1=O Amb24093723 [0,1,0,1,0,0|2,0,0]=4 9697 B13R2.32 NC1CCc2ccccc2C1=O Amb19514850 [0,1,0,1,0,0|1,0,0]=3 9698 B13R2.32 NC1COc2ccccc2C1=O Amb22049784 [0,1,0,1,0,0|2,0,0]=4 9699 B13R2.32 NC1CSc2ccccc2C1=O Amb18194436 [0,1,0,1,0,0|2,0,0]=4 9700 B13R2.32 NN1CCc2ccccc2C1=O Amb18118349 [0,1,0,1,0,0|1,0,0]=3 9701 B13R2.32 NN1CNc2ccccc2C1=O Amb22524841 [0,1,0,1,0,0|2,0,0]=4 9702 B13R2.32 O=C1C(Br)CNc2ccccc21 Amb25806779 [0,1,0,1,0,0|2,0,0]=4 9703 B13R2.32 O=C1C(Br)COc2ccccc21 Amb22549365 [0,1,0,1,0,0|2,0,0]=4 9704 B13R2.32 O=C1C(Cl)CCc2ccccc21 Amb18805198 [0,1,0,1,0,0|1,0,0]=3 9705 B13R2.32 O=C1C(Cl)CSc2ccccc21 Amb24711377 [0,1,0,1,0,0|2,0,0]=4 9706 B13R2.32 O=C1C(F)CCc2ccccc21 Amb21965076 [0,1,0,1,0,0|1,0,0]=3 9707 B13R2.32 O=C1C(F)COc2ccccc21 Amb21965068 [0,1,0,1,0,0|2,0,0]=4 9708 B13R2.32 O=C1OCc2ccccc2C1=O Amb24633619 [0,1,0,1,0,0|2,0,0]=4 9709 B13R2.32 O=C1[C@@H](Cl)CCc2ccccc21 Amb24710065 [0,1,0,1,0,0|1,0,0]=3 9710 B13R2.32 O=C1[C@@H](F)CCc2ccccc21 Amb24342029 [0,1,0,1,0,0|1,0,0]=3 9711 B13R2.32 O=C1c2ccccc2OCC1=O Amb24662280 [0,1,0,1,0,0|2,0,0]=4 9712 B13R2.32 O=C1c2ccccc2SCC1=O Amb24467680 [0,1,0,1,0,0|2,0,0]=4 9713 B13R2.32 OC1CCc2ccccc2C1=O Amb24455195 [0,1,0,1,0,0|1,0,0]=3 9714 B13R2.32 OC1CSc2ccccc2C1=O Amb24575610 [0,1,0,1,0,0|2,0,0]=4 9715 B13R2.32 ON1CNc2ccccc2C1=O Amb25691533 [0,1,0,1,0,0|2,0,0]=4 9716 B13R2.32 O[C@H]1CCc2ccccc2C1=O Amb25373107 [0,1,0,1,0,0|1,0,0]=3 9717 B13R2.32 O[C@H]1COc2ccccc2C1=O Amb24691679 [0,1,0,1,0,0|2,0,0]=4 9718 B13R2.32 S=C1C(Br)CCc2ccccc21 Amb25771211 [0,1,0,1,0,0|1,1,0]=4 9719 B13R2.45 CCC1=Nc2ccccc2C1=O Amb24753327 [0,1,0,1,0,0|1,0,0]=3 9720 B13R2.45 CCC1Cc2ccc[n]c2C1=O Amb22750354 [0,1,0,1,0,0|2,0,0]=4 9721 B13R2.45 CCC1Nc2c(C1=O)cccc2 Amb17594018 [0,1,0,1,0,0|1,0,0]=3 9722 B13R2.45 CCC1Oc2ccccc2C1=O Amb24061517 [0,1,0,1,0,0|1,0,0]=3 9723 B13R2.45 CCN1Cc2ccc[n]c2C1=O Amb22372198 [0,1,0,1,0,0|2,0,0]=4 9724 B13R2.45 CCN1N=C2C=CC=CN2C1=O Amb25154158 [0,1,0,1,0,0|2,0,0]=4 9725 B13R2.45 CCN1Oc2ccccc2C1=O Amb24457538 [0,1,0,1,0,0|1,0,0]=3 9726 B13R2.45 CC[C@H]1Cc2c(C1=O)cccc2 Amb16232572 [0,1,0,1,0,0|1,0,0]=3 9727 B13R2.45 CCc1[nH]c2ccccc2c1N Amb18830146 [0,1,0,1,0,0|2,0,0]=4 9728 B13R2.45 CCc1[s]c2ccccc2c1Br Amb24518699 [0,1,0,1,0,0|2,0,0]=4 9729 B13R2.45 CCc1[s]c2ccccc2c1O Amb24727753 [0,1,0,1,0,0|1,0,1]=4 9730 B13R2.45 CCc1oc2c(c1Br)cccc2 Amb10569511 [0,1,0,1,0,0|2,0,0]=4 9731 B13R2.45 COC1Cc2ccccc2C1=O Amb24532698 [0,1,0,1,0,0|2,0,0]=4 9732 B13R2.45 COC1Oc2ccccc2C1=O Amb24061519 [0,1,0,1,0,0|2,0,0]=4 9733 B13R2.45 CSC1=Nc2ccccc2C1=O Amb25136885 [0,1,0,1,0,0|2,0,0]=4 9734 B13R2.45 CSC1Sc2ccccc2C1=O Amb24656662 [0,1,0,1,0,0|2,0,0]=4 9735 B13R2.45 C\C=C/1\Cc2ccccc2C1=O Amb24602951 [0,1,0,1,0,0|1,0,1]=4 9736 B13R2.45 C\C=C\1/Oc2ccccc2C1=O Amb24408418 [0,1,0,1,0,0|1,0,1]=4 9737 B13R2.45 C\C=C\1/Sc2ccccc2C1=O Amb25773427 [0,1,0,1,0,0|1,0,1]=4 9738 B13R2.45 C\N=C\1/Nc2ccccc2C1=O Amb25130630 [0,1,0,1,0,0|2,0,0]=4 9739 B13R2.45 Cc1c2ccccc2oc1CC Amb22233704 [0,1,0,1,0,0|2,0,0]=4 9740 B13R2.45 OCC1Cc2ccccc2C1=O Amb25205765 [0,1,0,1,0,0|2,0,0]=4 9741 B13R2.45 OCC1Oc2ccccc2C1=O Amb24061515 [0,1,0,1,0,0|2,0,0]=4 9742 B13R2.45 OCN1Sc2ccccc2C1=O Amb24554829 [0,1,0,1,0,0|2,0,0]=4 9743 B13R2.3085 CC1C(Cl)C(=O)c2ccccc21 Amb24390287 [0,1,0,1,0,0|1,0,0]=3 9744 B13R2.3085 CC=1c2ccccc2C(C)C1Br Amb25849928 [0,1,0,1,0,0|2,0,0]=4 9745 B13R2.3085 CN1C(N)C(=O)c2ccccc12 Amb24078928 [0,1,0,1,0,0|2,0,0]=4 9746 B13R2.3085 C[C@@H]1[C@@H](C)c2ccccc2C1=O Amb24736164 [0,1,0,1,0,0|1,0,0]=3 9747 B13R2.3085 C[C@@H]1[C@@H](O)c2ccccc2C1=O Amb25179777 [0,1,0,1,0,0|2,0,0]=4 9748 B13R2.3085 C[C@H]1[C@@H](O)c2ccccc2C1=O Amb25285739 [0,1,0,1,0,0|2,0,0]=4 9749 B13R2.3085 NC1C(O)c2ccccc2C1=O Amb25700423 [0,1,0,1,0,0|2,0,0]=4 9750 B13R2.3085 N[C@@H]1[C@@H](Cl)C(=O)c2ccccc21 Amb24617789 [0,1,0,1,0,0|2,0,0]=4 9751 B13R2.3085 N[C@@H]1[C@@H](O)C(=O)c2ccccc21 Amb24670508 [0,1,0,1,0,0|2,0,0]=4 9752 B13R2.3085 O=C1[C@@H](Cl)[C@@H](Cl)c2ccccc21 Amb25216206 [0,1,0,1,0,0|2,0,0]=4 9753 B13R2.3085 O=C1[C@H](Cl)[C@@H](Cl)c2ccccc21 Amb25176642 [0,1,0,1,0,0|2,0,0]=4 9754 B13R2.3085 O=C1c2ccccc2C(N1C)O Amb1155091 [0,1,0,1,0,0|2,0,0]=4 9755 B13R2.3085 OC1C(Cl)C(=O)c2ccccc21 Amb25101579 [0,1,0,1,0,0|2,0,0]=4 9756 B13R2.3085 OC1C(O)c2ccccc2C1=O Amb24625369 [0,1,0,1,0,0|2,0,0]=4 9757 B13R2.8138 CC1(CC1)C(=O)c2ccc[n]c2 Amb25857765 [0,1,0,1,0,0|2,0,0]=4 9758 B13R2.8138 CC1(CC1)C(=O)c2ccccc2 Amb18563491 [0,1,0,1,0,0|1,0,0]=3 9759 B13R2.8138 O=S(c1ccccc1)C2(Cl)CC2 Amb24183980 [0,1,0,1,0,0|2,0,0]=4 9760 B13R2.3063 O=S(=O)(C1CC1)c2ccccc2 Amb24497599 [0,1,0,1,0,0|2,0,0]=4 9761 B13R2.12159 C=C1OC(c2c1cccc2)(C)C Amb13893490 [0,1,0,1,0,0|1,0,0]=3 9762 B13R2.12159 CC1(C)NC(=N)c2ccccc12 Amb25770495 [0,1,0,1,0,0|2,0,0]=4 9763 B13R2.12159 CC1(C)NC(=O)c2ccccc12 Amb22899742 [0,1,0,1,0,0|1,0,0]=3 9764 B13R2.12159 CC1(C)OC(=O)c2ccc[n]c12 Amb25151000 [0,1,0,1,0,0|1,0,0]=3 9765 B13R2.12159 CC1(C)OC(=O)c2ccccc12 Amb17778630 [0,1,0,1,0,0|0,0,0]=2 9766 B13R2.12159 CC1(C)OI(Cl)c2ccccc12 Amb21961271 [0,1,0,1,0,0|2,0,0]=4 9767 B13R2.12159 CC1(C)OI(F)c2ccccc12 Amb24324964 [0,1,0,1,0,0|2,0,0]=4 9768 B13R2.12159 CC1(O)CC(=O)c2[n]cccc12 Amb22750340 [0,1,0,1,0,0|2,0,0]=4 9769 B13R2.12159 CC1(O)NC(=O)c2ccccc12 Amb25041083 [0,1,0,1,0,0|1,0,0]=3 9770 B13R2.12159 CC1(O)OC(=O)c2ccccc12 Amb24060114 [0,1,0,1,0,0|0,0,0]=2 9771 B13R2.12159 CC1=CC(C)(C)c2ccccc12 Amb22002270 [0,1,0,1,0,0|2,0,0]=4 9772 B13R2.12159 CC1=CC(C)(O)c2ccccc12 Amb17778887 [0,1,0,1,0,0|2,0,0]=4 9773 B13R2.12159 CC1NS(=O)(=O)c2ccccc21 Amb22497137 [0,1,0,1,0,0|2,0,0]=4 9774 B13R2.12159 NC1(N)OC(=O)c2ccccc12 Amb24692757 [0,1,0,1,0,0|1,0,0]=3 9775 B13R2.12159 O=C1OC(c2c1cccc2)(Cl)Cl Amb16233588 [0,1,0,1,0,0|1,0,0]=3 9776 B13R2.12159 OB1OC(c2c1cccc2)(C)C Amb16233581 [0,1,0,1,0,0|1,0,1]=4 9777 B13R2.244 CC(C)N1C(=O)c2ccccc12 Amb25291024 [0,1,0,1,0,0|1,0,0]=3 9778 B13R2.18 Brc1ccccc1C2=NCCO2 Amb18063906 [0,1,0,1,0,0|1,0,0]=3 9779 B13R2.18 Brc1ccccc1C2NCCO2 Amb18571581 [0,1,0,1,0,0|1,0,1]=4 9780 B13R2.18 Brc1ccccc1C=2CCCN2 Amb24381998 [0,1,0,1,0,0|2,0,0]=4 9781 B13R2.18 Brc1ccccc1C=2NCCN2 Amb18069920 [0,1,0,1,0,0|2,0,0]=4 9782 B13R2.18 Cc1ccccc1C2NCCO2 Amb17334581 [0,1,0,1,0,0|1,0,1]=4 9783 B13R2.18 Cc1ccccc1C2OCCO2 Amb17334606 [0,1,0,1,0,0|0,0,2]=4 9784 B13R2.18 Cc1ccccc1C=2CCCC2 Amb25252698 [0,1,0,1,0,0|2,0,0]=4 9785 B13R2.18 Cc1ccccc1C=2NCCN2 Amb18563497 [0,1,0,1,0,0|2,0,0]=4 9786 B13R2.18 Clc1ccccc1B2OCCO2 Amb24742724 [0,1,0,1,0,0|1,0,1]=4 9787 B13R2.18 Clc1ccccc1C2=CCCN2 Amb25765810 [0,1,0,1,0,0|2,0,0]=4 9788 B13R2.18 Clc1ccccc1C2=NCCS2 Amb10573095 [0,1,0,1,0,0|1,1,0]=4 9789 B13R2.18 Clc1ccccc1C2NCCO2 Amb17335655 [0,1,0,1,0,0|1,0,1]=4 9790 B13R2.18 Clc1ccccc1C=2CCCC2 Amb24658577 [0,1,0,1,0,0|2,0,0]=4 9791 B13R2.18 Clc1ccccc1C=2CCCN2 Amb22285378 [0,1,0,1,0,0|2,0,0]=4 9792 B13R2.18 Fc1ccccc1C2=NCCN2 Amb17578183 [0,1,0,1,0,0|2,0,0]=4 9793 B13R2.18 Fc1ccccc1C2NCCO2 Amb17334699 [0,1,0,1,0,0|1,0,1]=4 9794 B13R2.18 Fc1ccccc1C2OCCO2 Amb17334709 [0,1,0,1,0,0|0,0,2]=4 9795 B13R2.18 Ic1ccccc1C2OCCO2 Amb25669556 [0,1,0,1,0,0|0,0,2]=4 9796 B13R2.18 Nc1ccccc1C2=CCCC2 Amb17107088 [0,1,0,1,0,0|2,0,0]=4 9797 B13R2.18 Nc1ccccc1C2=NCCO2 Amb18063926 [0,1,0,1,0,0|1,0,0]=3 9798 B13R2.18 Nc1ccccc1C2CCCO2 Amb25756209 [0,1,0,1,0,0|1,0,1]=4 9799 B13R2.18 Nc1ccccc1C2OCCO2 Amb17334637 [0,1,0,1,0,0|0,0,2]=4 9800 B13R2.18 Oc1ccccc1C2=NCCO2 Amb18645804 [0,1,0,1,0,0|1,0,0]=3 9801 B13R2.18 Oc1ccccc1C2CCCO2 Amb18646054 [0,1,0,1,0,0|1,0,1]=4 9802 B13R2.18 Oc1ccccc1C2OCCO2 Amb24094012 [0,1,0,1,0,0|0,0,2]=4 9803 B13R2.18 Oc1ccccc1C=2CCCC2 Amb18645356 [0,1,0,1,0,0|2,0,0]=4 9804 B13R2.18 Sc1ccccc1C2=CCCN2 Amb22363566 [0,1,0,1,0,0|2,0,0]=4 9805 B13R2.18 Sc1ccccc1C2=NCCN2 Amb2425856 [0,1,0,1,0,0|2,0,0]=4 9806 B13R2.3097 Cc1c[n]ccc1C(=O)C2CC2 Amb25140663 [0,1,0,1,0,0|2,0,0]=4 9807 B13R2.3097 Cc1cc[n]cc1C(=O)C2CC2 Amb25359433 [0,1,0,1,0,0|2,0,0]=4 9808 B13R2.3097 Cc1cc[n]cc1C(=O)N2CC2 Amb24422126 [0,1,0,1,0,0|2,0,0]=4 9809 B13R2.3097 Cc1ccccc1C(=O)C2CO2 Amb25320130 [0,1,0,1,0,0|2,0,0]=4 9810 B13R2.3097 Nc1[n]cccc1C(=O)C2CC2 Amb23455061 [0,1,0,1,0,0|2,0,0]=4 9811 B13R2.3097 Nc1c[n]ccc1C(=O)C2CC2 Amb23455058 [0,1,0,1,0,0|2,0,0]=4 9812 B13R2.3097 Nc1cc[n]cc1C(=O)C2CC2 Amb23455059 [0,1,0,1,0,0|2,0,0]=4 9813 B13R2.3097 Nc1ccc[n]c1C(=O)C2CC2 Amb23455060 [0,1,0,1,0,0|2,0,0]=4 9814 B13R2.3097 Nc1ccccc1C(=O)C2CC2 Amb22754628 [0,1,0,1,0,0|1,0,0]=3 9815 B13R2.3097 O=C(C1CC1)c2[n]cccc2Br Amb23454995 [0,1,0,1,0,0|2,0,0]=4 9816 B13R2.3097 O=C(C1CC1)c2[n]cccc2Cl Amb23455120 [0,1,0,1,0,0|2,0,0]=4 9817 B13R2.3097 O=C(C1CC1)c2c[n]ccc2Cl Amb23455118 [0,1,0,1,0,0|2,0,0]=4 9818 B13R2.3097 O=C(C1CC1)c2cc[n]cc2Br Amb23455124 [0,1,0,1,0,0|2,0,0]=4 9819 B13R2.3097 O=C(C1CC1)c2cc[n]cc2Cl Amb24403039 [0,1,0,1,0,0|2,0,0]=4 9820 B13R2.3097 O=C(C1CC1)c2cc[n]cc2F Amb23455230 [0,1,0,1,0,0|2,0,0]=4 9821 B13R2.3097 O=C(C1CC1)c2ccc[n]c2Cl Amb23454979 [0,1,0,1,0,0|2,0,0]=4 9822 B13R2.3097 O=C(c1cc[n]cc1Cl)N2CC2 Amb25833411 [0,1,0,1,0,0|2,0,0]=4 9823 B13R2.3097 O=C(c1ccc[n]c1S)N2CC2 Amb25119715 [0,1,0,1,0,0|2,0,0]=4 9824 B13R2.3097 O=C(c1ccccc1Br)C2CC2 Amb17343204 [0,1,0,1,0,0|1,0,0]=3 9825 B13R2.3097 O=C(c1ccccc1F)N2CC2 Amb25669737 [0,1,0,1,0,0|1,0,0]=3 9826 B13R2.4818 Cc1cc[n]c2CCCC(=O)c21 Amb18829937 [0,1,0,1,0,0|2,0,0]=4 9827 B13R2.4818 Cc1cccc2CCCC(=O)c21 Amb22230186 [0,1,0,1,0,0|1,0,0]=3 9828 B13R2.4818 Cc1cccc2CCNC(=O)c21 Amb18563086 [0,1,0,1,0,0|1,0,0]=3 9829 B13R2.4818 Cc1cccc2CCOC(=O)c21 Amb24424945 [0,1,0,1,0,0|0,0,0]=2 9830 B13R2.4818 Cc1cccc2COCC(=O)c21 Amb25743509 [0,1,0,1,0,0|2,0,0]=4 9831 B13R2.4818 Cc1cccc2N=COC(=O)c21 Amb24556056 [0,1,0,1,0,0|1,0,1]=4 9832 B13R2.4818 Cc1cccc2NCCC(=O)c21 Amb18829956 [0,1,0,1,0,0|2,0,0]=4 9833 B13R2.4818 Cc1cccc2OCCC(=O)c21 Amb18829762 [0,1,0,1,0,0|2,0,0]=4 9834 B13R2.4818 Cc1cccc2SCCC(=O)c21 Amb18824838 [0,1,0,1,0,0|2,0,0]=4 9835 B13R2.4818 Nc1cc[n]c2CCCC(=O)c21 Amb25102505 [0,1,0,1,0,0|2,0,0]=4 9836 B13R2.4818 Nc1cccc2CCCC(=O)c21 Amb22491494 [0,1,0,1,0,0|1,0,0]=3 9837 B13R2.4818 Nc1cccc2CCNC(=O)c21 Amb18064242 [0,1,0,1,0,0|1,0,0]=3 9838 B13R2.4818 Nc1cccc2OCCC(=O)c21 Amb24409752 [0,1,0,1,0,0|2,0,0]=4 9839 B13R2.4818 O=C1CCCC=2NC=CC(=O)C12 Amb24513619 [0,1,0,1,0,0|2,0,0]=4 9840 B13R2.4818 O=C1CCCc2[n]ccc(Cl)c21 Amb22491881 [0,1,0,1,0,0|2,0,0]=4 9841 B13R2.4818 O=C1CCCc2c1c(Cl)ccc2 Amb13883634 [0,1,0,1,0,0|1,0,0]=3 9842 B13R2.4818 O=C1CCCc2c1c(F)ccc2 Amb10603941 [0,1,0,1,0,0|1,0,0]=3 9843 B13R2.4818 O=C1CCCc2c1c(I)ccc2 Amb16233089 [0,1,0,1,0,0|1,0,0]=3 9844 B13R2.4818 O=C1CCNc2cccc(Br)c21 Amb18753485 [0,1,0,1,0,0|2,0,0]=4 9845 B13R2.4818 O=C1CCNc2cccc(Cl)c21 Amb18823866 [0,1,0,1,0,0|2,0,0]=4 9846 B13R2.4818 O=C1CCNc2cccc(I)c21 Amb25716066 [0,1,0,1,0,0|2,0,0]=4 9847 B13R2.4818 O=C1CCOc2c1c(Br)ccc2 Amb16233097 [0,1,0,1,0,0|2,0,0]=4 9848 B13R2.4818 O=C1CCOc2c1c(Cl)ccc2 Amb16233096 [0,1,0,1,0,0|2,0,0]=4 9849 B13R2.4818 O=C1CCOc2c1c(F)ccc2 Amb16233077 [0,1,0,1,0,0|2,0,0]=4 9850 B13R2.4818 O=C1CCOc2c1c(I)ccc2 Amb16233103 [0,1,0,1,0,0|2,0,0]=4 9851 B13R2.4818 O=C1CCSc2cccc(Br)c21 Amb25121325 [0,1,0,1,0,0|2,0,0]=4 9852 B13R2.4818 O=C1CCSc2cccc(Cl)c21 Amb18811413 [0,1,0,1,0,0|2,0,0]=4 9853 B13R2.4818 O=C1CCSc2cccc(F)c21 Amb24183291 [0,1,0,1,0,0|2,0,0]=4 9854 B13R2.4818 O=C1CCSc2cccc(I)c21 Amb25315433 [0,1,0,1,0,0|2,0,0]=4 9855 B13R2.4818 O=C1COCc2cccc(Br)c21 Amb24081421 [0,1,0,1,0,0|2,0,0]=4 9856 B13R2.4818 O=C1COCc2cccc(Cl)c21 Amb24081478 [0,1,0,1,0,0|2,0,0]=4 9857 B13R2.4818 O=C1COCc2cccc(F)c21 Amb24081508 [0,1,0,1,0,0|2,0,0]=4 9858 B13R2.4818 O=C1COCc2cccc(I)c21 Amb25096376 [0,1,0,1,0,0|2,0,0]=4 9859 B13R2.4818 O=C1NCCc2cc[n]c(Br)c21 Amb25709785 [0,1,0,1,0,0|2,0,0]=4 9860 B13R2.4818 O=C1NCCc2cc[n]c(Cl)c21 Amb18823459 [0,1,0,1,0,0|2,0,0]=4 9861 B13R2.4818 O=C1NCCc2cccc(Br)c21 Amb18065023 [0,1,0,1,0,0|1,0,0]=3 9862 B13R2.4818 O=C1NCCc2cccc(Cl)c21 Amb18563088 [0,1,0,1,0,0|1,0,0]=3 9863 B13R2.4818 O=C1NCCc2cccc(F)c21 Amb18563087 [0,1,0,1,0,0|1,0,0]=3 9864 B13R2.4818 O=C1OCCc2c1c(O)ccc2 Amb10604225 [0,1,0,1,0,0|0,0,0]=2 9865 B13R2.4818 O=C1OCCc2cccc(Cl)c21 Amb24691810 [0,1,0,1,0,0|0,0,0]=2 9866 B13R2.4818 O=C1OCCc2cccc(F)c21 Amb25762991 [0,1,0,1,0,0|0,0,0]=2 9867 B13R2.4818 O=C1OCOc2cccc(Br)c21 Amb24077632 [0,1,0,1,0,0|1,0,0]=3 9868 B13R2.4818 O=C1OCOc2cccc(F)c21 Amb24077628 [0,1,0,1,0,0|1,0,0]=3 9869 B13R2.4818 Oc1cccc2C=COC(=O)c21 Amb18645570 [0,1,0,1,0,0|0,0,2]=4 9870 B13R2.4818 Oc1cccc2CCCC(=O)c21 Amb18645630 [0,1,0,1,0,0|1,0,0]=3 9871 B13R2.4818 Oc1cccc2CCNC(=O)c21 Amb22754565 [0,1,0,1,0,0|1,0,0]=3 9872 B13R2.4818 Oc1cccc2CCSC(=O)c21 Amb25821416 [0,1,0,1,0,0|0,1,0]=3 9873 B13R2.4818 Oc1cccc2NCCC(=O)c21 Amb18645810 [0,1,0,1,0,0|2,0,0]=4 9874 B13R2.4818 Oc1cccc2SCCC(=O)c21 Amb25782944 [0,1,0,1,0,0|2,0,0]=4 9875 B13R3.1962 C1C[C@H]2O[C@@H]1c3ccccc32 Amb25679044 [0,0,0,2,0,0|1,0,1]=4 9876 B13R3.274 O=C1C2CC2c3ccccc31 Amb24533047 [0,0,0,2,0,0|1,0,0]=3 9877 B13R3.274 O=C1[C@H]2C[C@H]2c3ccccc31 Amb24512663 [0,0,0,2,0,0|1,0,0]=3 9878 B9R1.11 CC(CCl)=C1C=CC=C1 Amb25705321 [1,0,0,0,1,0|2,0,0]=4 9879 B9R1.11 CCC(=C)c1cc[s]c1 Amb25279221 [1,0,0,0,1,0|2,0,0]=4 9880 B9R1.11 CCC(=O)c1c[nH][n]c1 Amb22298643 [1,0,0,0,1,0|2,0,0]=4 9881 B9R1.11 CCC(=O)c1c[nH]c[n]1 Amb23402204 [1,0,0,0,1,0|2,0,0]=4 9882 B9R1.11 CCC(=O)c1c[n]c[s]1 Amb25308975 [1,0,0,0,1,0|2,0,0]=4 9883 B9R1.11 CCC(=O)c1c[s]c[n]1 Amb24384180 [1,0,0,0,1,0|2,0,0]=4 9884 B9R1.11 CCC(=O)c1cc[nH][n]1 Amb25842047 [1,0,0,0,1,0|2,0,0]=4 9885 B9R1.11 CCC(=O)c1cc[nH]c1 Amb18062764 [1,0,0,0,1,0|1,0,0]=3 9886 B9R1.11 CCC(=O)c1cc[s][n]1 Amb24593642 [1,0,0,0,1,0|2,0,0]=4 9887 B9R1.11 CCC(=O)n1cccc1 Amb17938694 [1,0,0,0,1,0|1,0,0]=3 9888 B9R1.11 CNC(=O)c1c[nH]cc1 Amb24612395 [1,0,0,0,1,0|2,0,0]=4 9889 B9R1.11 CNC(=O)c1ccc[nH]1 Amb21859009 [1,0,0,0,1,0|2,0,0]=4 9890 B9R1.11 CNC(=O)c1ccoc1 Amb24531887 [1,0,0,0,1,0|2,0,0]=4 9891 B9R1.11 COC(=N)c1cc[nH]c1 Amb25846197 [1,0,0,0,1,0|2,0,0]=4 9892 B9R1.11 COC(=N)c1ccc[nH]1 Amb24669587 [1,0,0,0,1,0|2,0,0]=4 9893 B9R1.11 COC(=N)c1ccco1 Amb22263727 [1,0,0,0,1,0|2,0,0]=4 9894 B9R1.11 COC(=N)c1cccs1 Amb17621680 [1,0,0,0,1,0|2,0,0]=4 9895 B9R1.11 COC(=O)C=1C=CCC1 Amb25145939 [1,0,0,0,1,0|0,0,1]=3 9896 B9R1.11 COC(=O)[n]1c[n]cc1 Amb24078489 [1,0,0,0,1,0|2,0,0]=4 9897 B9R1.11 COC(=O)c1[n]cco1 Amb22001762 [1,0,0,0,1,0|2,0,0]=4 9898 B9R1.11 COC(=O)c1c[nH][n]c1 Amb19515848 [1,0,0,0,1,0|2,0,0]=4 9899 B9R1.11 COC(=O)c1c[nH]c[n]1 Amb20621624 [1,0,0,0,1,0|2,0,0]=4 9900 B9R1.11 COC(=O)c1c[nH]nc1 Amb10070554 [1,0,0,0,1,0|2,0,0]=4 9901 B9R1.11 COC(=O)c1c[n][s]c1 Amb25705771 [1,0,0,0,1,0|2,0,0]=4 9902 B9R1.11 COC(=O)c1c[n]co1 Amb21520455 [1,0,0,0,1,0|2,0,0]=4 9903 B9R1.11 COC(=O)c1cc[nH]n1 Amb1000875 [1,0,0,0,1,0|2,0,0]=4 9904 B9R1.11 COC(=O)c1cc[s][n]1 Amb22896459 [1,0,0,0,1,0|2,0,0]=4 9905 B9R1.11 COC(=O)c1ccc[nH]1 Amb1088973 [1,0,0,0,1,0|1,0,0]=3 9906 B9R1.11 COC(=O)c1cccs1 Amb1911537 [1,0,0,0,1,0|1,0,0]=3 9907 B9R1.11 COC(=O)c1ccns1 Amb13883507 [1,0,0,0,1,0|2,0,0]=4 9908 B9R1.11 COC(=O)c1cco[n]1 Amb23412333 [1,0,0,0,1,0|2,0,0]=4 9909 B9R1.11 COC(=O)c1cncs1 Amb2455728 [1,0,0,0,1,0|2,0,0]=4 9910 B9R1.11 COC(=O)c1co[n]c1 Amb22754239 [1,0,0,0,1,0|2,0,0]=4 9911 B9R1.11 COC(=O)c1coc[n]1 Amb21857674 [1,0,0,0,1,0|2,0,0]=4 9912 B9R1.11 COC(=O)c1cscn1 Amb10067320 [1,0,0,0,1,0|2,0,0]=4 9913 B9R1.11 COC(=O)c1nccs1 Amb10807389 [1,0,0,0,1,0|2,0,0]=4 9914 B9R1.11 COC(=S)c1ccco1 Amb22232675 [1,0,0,0,1,0|1,1,0]=4 9915 B9R1.11 COS(=O)c1ccc[s]1 Amb25254375 [1,0,0,0,1,0|2,0,0]=4 9916 B9R1.11 CSC(=O)c1ccc[s]1 Amb24520558 [1,0,0,0,1,0|1,1,0]=4 9917 B9R1.11 ClCC(=O)c1ccco1 Amb17138398 [1,0,0,0,1,0|2,0,0]=4 9918 B9R1.11 NCC(=O)c1cc[nH]c1 Amb18560375 [1,0,0,0,1,0|2,0,0]=4 9919 B9R1.11 NCC(=O)c1cc[s]c1 Amb18643742 [1,0,0,0,1,0|2,0,0]=4 9920 B9R1.11 NCC(=O)c1ccc[nH]1 Amb17593270 [1,0,0,0,1,0|2,0,0]=4 9921 B9R1.11 NCC(=O)c1ccco1 Amb18642269 [1,0,0,0,1,0|2,0,0]=4 9922 B9R1.11 NCC(=O)c1ccco1 Amb19373982 [1,0,0,0,1,0|2,0,0]=4 9923 B9R1.11 NCC(=O)c1cccs1 Amb1286169 [1,0,0,0,1,0|2,0,0]=4 9924 B9R1.11 NCC(=O)c1ccoc1 Amb18642270 [1,0,0,0,1,0|2,0,0]=4 9925 B9R1.11 NOC(=O)c1ccc[s]1 Amb25268305 [1,0,0,0,1,0|2,0,0]=4 9926 B9R1.11 O([2H])C(=O)c1cccs1 Amb10573503 [1,0,0,0,1,0|2,0,0]=4 9927 B9R1.11 O=C(CBr)c1cc[nH]c1 Amb18224795 [1,0,0,0,1,0|2,0,0]=4 9928 B9R1.11 O=C(CBr)c1ccc[s]1 Amb22491221 [1,0,0,0,1,0|2,0,0]=4 9929 B9R1.11 O=C(CBr)c1ccoc1 Amb25772759 [1,0,0,0,1,0|2,0,0]=4 9930 B9R1.11 O=C(CCl)c1cc[nH]c1 Amb18063662 [1,0,0,0,1,0|2,0,0]=4 9931 B9R1.11 O=C(CCl)c1cc[s]c1 Amb25727715 [1,0,0,0,1,0|2,0,0]=4 9932 B9R1.11 O=C(CCl)c1ccoc1 Amb22395346 [1,0,0,0,1,0|2,0,0]=4 9933 B9R1.11 O=C(CF)c1cc[s]c1 Amb24084132 [1,0,0,0,1,0|2,0,0]=4 9934 B9R1.11 O=C(CF)c1ccc[s]1 Amb21964939 [1,0,0,0,1,0|2,0,0]=4 9935 B9R1.11 O=C(CI)c1ccco1 Amb25365425 [1,0,0,0,1,0|2,0,0]=4 9936 B9R1.11 O=C(OCl)c1ccc[nH]1 Amb24518091 [1,0,0,0,1,0|2,0,0]=4 9937 B9R1.11 OCC(=O)[n]1cccc1 Amb25107623 [1,0,0,0,1,0|2,0,0]=4 9938 B9R1.11 OCC(=O)c1cc[nH]c1 Amb18560595 [1,0,0,0,1,0|2,0,0]=4 9939 B9R1.11 OCC(=O)c1cc[s]c1 Amb25348480 [1,0,0,0,1,0|2,0,0]=4 9940 B9R1.11 OCC(=O)c1ccc[s]1 Amb25742219 [1,0,0,0,1,0|2,0,0]=4 9941 B9R1.11 OCC(=O)c1ccco1 Amb17689139 [1,0,0,0,1,0|2,0,0]=4 9942 B9R1.11 SCC(=O)c1cccs1 Amb17400035 [1,0,0,0,1,0|2,0,0]=4 9943 B9R1.11 [Cu]OC(=O)c1cccs1 Amb13890298 [1,0,0,0,1,0|2,0,0]=4 9944 B9R1.11 [Li]OC(=O)n1cccc1 Amb10552456 [1,0,0,0,1,0|2,0,0]=4 9945 B9R1.11 [NH3+]CC(=O)c1cccs1 Amb17848802 [1,0,0,0,1,0|2,0,0]=4 9946 B9R1.12 CCOCc1c[s]cc1 Amb24708417 [1,0,0,0,1,0|1,0,1]=4 9947 B9R1.12 CCOCc1ccc[nH]1 Amb25190159 [1,0,0,0,1,0|1,0,1]=4 9948 B9R1.12 CCOCc1ccc[s]1 Amb25217999 [1,0,0,0,1,0|1,0,1]=4 9949 B9R1.12 CCOCc1ccco1 Amb22234292 [1,0,0,0,1,0|1,0,1]=4 9950 B9R1.12 CC\N=C\c1ccc[s]1 Amb24518706 [1,0,0,0,1,0|2,0,0]=4 9951 B9R1.73 CCOC(=O)C=1CCC1 Amb25317027 [0,0,0,0,2,0|0,0,2]=4 9952 B11R1.852 CNC(=O)C1C=CC=CC=C1 Amb24381921 [1,0,0,0,0,1|1,0,1]=4 9953 B11R1.852 COC(=O)C1C=CCCC=C1 Amb25336455 [1,0,0,0,0,1|0,0,2]=4 9954 B11R1.852 COC(=O)C=1C=CC=C=CC1 Amb24060625 [1,0,0,0,0,1|0,0,0]=2 9955 B11R1.852 COC(=O)C=1C=CC=CN=C1 Amb24736682 [1,0,0,0,0,1|0,0,1]=3 9956 B11R1.852 COC(=O)C=1C=CCC=CC1 Amb24450110 [1,0,0,0,0,1|0,0,0]=2 9957 B11R1.852 COC(=O)C=1C=CNC=CC1 Amb24078438 [1,0,0,0,0,1|0,0,0]=2 9958 B11R1.852 COC(=O)N1C=CC=CC=C1 Amb22364783 [1,0,0,0,0,1|1,0,0]=3 9959 B11R1.852 COC(=O)N1C=CC=CC=C1 Amb24078431 [1,0,0,0,0,1|1,0,0]=3 9960 B11R1.852 COC(=O)N1C=CC=CC=N1 Amb24422879 [1,0,0,0,0,1|1,0,0]=3 9961 B11R1.852 COC(=O)N1CC=CCC=C1 Amb25169471 [1,0,0,0,0,1|1,0,1]=4 9962 B11R1.852 O=C(CCl)C1C=CC=CC=C1 Amb24104139 [1,0,0,0,0,1|1,0,1]=4 9963 B11R1.852 O=C(CCl)N1C=CC=CC=N1 Amb24711374 [1,0,0,0,0,1|2,0,0]=4 9964 B11R1.852 ONC(=O)C=1CC=CC=CC1 Amb25225570 [1,0,0,0,0,1|2,0,0]=4 9965 B13R1.42 BrCCC(=O)NCc1ccccc1 Amb17084003 [0,0,0,0,0,2|2,0,0]=4 9966 B13R1.42 C/C=C/C(=O)NNc1ccccc1 Amb17777823 [0,0,0,0,0,2|1,0,1]=4 9967 B13R1.42 C=COC(=O)CCc1ccccc1 Amb21858909 [0,0,0,0,0,2|0,0,2]=4 9968 B13R1.42 C=COC(=O)\C=C\c1ccccc1 Amb10807746 [0,0,0,0,0,2|0,0,2]=4 9969 B13R1.42 CC#CC(=O)CCc1ccccc1 Amb17619342 [0,0,0,0,0,2|1,0,1]=4 9970 B13R1.42 CC#CC(=O)\C=C\c1ccccc1 Amb24580491 [0,0,0,0,0,2|1,0,1]=4 9971 B13R1.42 CCCC(=O)C#Cc1ccccc1 Amb17594320 [0,0,0,0,0,2|1,0,0]=3 9972 B13R1.42 CCCC(=O)NNc1c[n]ccc1 Amb25098278 [0,0,0,0,0,2|2,0,0]=4 9973 B13R1.42 CCCC(=O)NNc1cccc[n]1 Amb24705336 [0,0,0,0,0,2|2,0,0]=4 9974 B13R1.42 CCCC(=S)NCc1ccccc1 Amb25835568 [0,0,0,0,0,2|1,1,0]=4 9975 B13R1.42 CCNC(=N)NCc1ccccc1 Amb18804667 [0,0,0,0,0,2|2,0,0]=4 9976 B13R1.42 CCNC(=O)NCc1c[n]ccc1 Amb25208970 [0,0,0,0,0,2|2,0,0]=4 9977 B13R1.42 CCNC(=O)NCc1cc[n]cc1 Amb24383174 [0,0,0,0,0,2|2,0,0]=4 9978 B13R1.42 CCNC(=O)NCc1cccc[n]1 Amb25240069 [0,0,0,0,0,2|2,0,0]=4 9979 B13R1.42 CCNC(=O)NCc1ccccc1 Amb2236980 [0,0,0,0,0,2|1,0,0]=3 9980 B13R1.42 CCNC(=O)NNc1ccccc1 Amb24710661 [0,0,0,0,0,2|1,0,0]=3 9981 B13R1.42 CCNC(=O)OCc1ccccc1 Amb24375743 [0,0,0,0,0,2|1,0,0]=3 9982 B13R1.42 CCNC(=O)\C=C\c1ccc[n]c1 Amb25821659 [0,0,0,0,0,2|2,0,0]=4 9983 B13R1.42 CCNC(=S)\C=C\c1ccccc1 Amb24606964 [0,0,0,0,0,2|1,1,0]=4 9984 B13R1.42 CCOC(=N)CCc1cc[n]cc1 Amb24094201 [0,0,0,0,0,2|2,0,0]=4 9985 B13R1.42 CCOC(=N)CCc1ccc[n]c1 Amb24094202 [0,0,0,0,0,2|2,0,0]=4 9986 B13R1.42 CCOC(=N)CCc1cccc[n]1 Amb24094195 [0,0,0,0,0,2|2,0,0]=4 9987 B13R1.42 CCOC(=O)C#Cc1c[n]c[n]c1 Amb24668597 [0,0,0,0,0,2|2,0,0]=4 9988 B13R1.42 CCOC(=O)C#Cc1cccc[n]1 Amb24494363 [0,0,0,0,0,2|1,0,0]=3 9989 B13R1.42 CCOC(=O)CCc1[n]ccc[n]1 Amb24061350 [0,0,0,0,0,2|2,0,0]=4 9990 B13R1.42 CCOC(=O)CCc1c[n]c[n]c1 Amb23571325 [0,0,0,0,0,2|2,0,0]=4 9991 B13R1.42 CCOC(=O)CNc1ccc[n]c1 Amb24180824 [0,0,0,0,0,2|1,0,0]=3 9992 B13R1.42 CCOC(=O)CNc1cccc[n]1 Amb18181060 [0,0,0,0,0,2|1,0,0]=3 9993 B13R1.42 CCOC(=O)CNc1ccccc1 Amb1025527 [0,0,0,0,0,2|0,0,0]=2 9994 B13R1.42 CCOC(=O)CNc1ccccc1 Amb21961619 [0,0,0,0,0,2|0,0,0]=2 9995 B13R1.42 CCOC(=O)COc1cccc[n]1 Amb22493952 [0,0,0,0,0,2|1,0,0]=3 9996 B13R1.42 CCOC(=O)CSc1cc[n]cc1 Amb24103490 [0,0,0,0,0,2|1,0,0]=3 9997 B13R1.42 CCOC(=O)CSc1ccc[n]c1 Amb24103483 [0,0,0,0,0,2|1,0,0]=3 9998 B13R1.42 CCOC(=O)CSc1ccccc1 Amb2408276 [0,0,0,0,0,2|0,0,0]=2 9999 B13R1.42 CCOC(=O)NCc1c[n]cc[n]1 Amb24103463 [0,0,0,0,0,2|2,0,0]=4 10000 B13R1.42 CCOC(=O)NCc1ccccn1 Amb10553732 [0,0,0,0,0,2|1,0,0]=3 10001 B13R1.42 CCOC(=O)NNc1c[n]cc[n]1 Amb24673279 [0,0,0,0,0,2|2,0,0]=4 10002 B13R1.42 CCOC(=O)NNc1cc[n]cc1 Amb24530140 [0,0,0,0,0,2|1,0,0]=3 10003 B13R1.42 CCOC(=O)NNc1cccc[n]1 Amb25681252 [0,0,0,0,0,2|1,0,0]=3 10004 B13R1.42 CCOC(=O)NSc1cccc[n]1 Amb24103464 [0,0,0,0,0,2|1,0,0]=3 10005 B13R1.42 CCOC(=O)\C=C/c1ccccc1 Amb17613997 [0,0,0,0,0,2|0,0,0]=2 10006 B13R1.42 CCOC(=O)\C=C\c1c[n]c[n]c1 Amb23571324 [0,0,0,0,0,2|2,0,0]=4 10007 B13R1.42 CCOC(=O)\C=C\c1ccccn1 Amb15695131 [0,0,0,0,0,2|1,0,0]=3 10008 B13R1.42 CCOC(=O)\C=C\c1cccnc1 Amb15695192 [0,0,0,0,0,2|1,0,0]=3 10009 B13R1.42 CCOC(=S)NCc1ccccc1 Amb25313123 [0,0,0,0,0,2|0,1,0]=3 10010 B13R1.42 CCOC(=S)SCc1ccccc1 Amb10560707 [0,0,0,0,0,2|0,1,0]=3 10011 B13R1.42 CCO\C(\N)=N\Cc1ccccc1 Amb25138606 [0,0,0,0,0,2|1,0,0]=3 10012 B13R1.42 CCSC(=N)NCc1ccccc1 Amb24399348 [0,0,0,0,0,2|1,1,0]=4 10013 B13R1.42 CCSC(=S)NCc1ccccc1 Amb24490280 [0,0,0,0,0,2|0,2,0]=4 10014 B13R1.42 CCSC(=S)NNc1ccccc1 Amb25218192 [0,0,0,0,0,2|0,2,0]=4 10015 B13R1.42 CNCC(=O)C#Cc1ccccc1 Amb24383348 [0,0,0,0,0,2|2,0,0]=4 10016 B13R1.42 CNCC(=O)NCc1ccccc1 Amb21959039 [0,0,0,0,0,2|2,0,0]=4 10017 B13R1.42 CNCC(=O)NNc1ccccc1 Amb24735727 [0,0,0,0,0,2|2,0,0]=4 10018 B13R1.42 CNCC(=O)OCc1ccccc1 Amb18809175 [0,0,0,0,0,2|2,0,0]=4 10019 B13R1.42 CNCC(=O)OCc1ccccc1 Amb21929370 [0,0,0,0,0,2|2,0,0]=4 10020 B13R1.42 CNCC(=O)OCc1ccccc1 Amb22002169 [0,0,0,0,0,2|2,0,0]=4 10021 B13R1.42 COCC(=O)CCc1ccccc1 Amb10563175 [0,0,0,0,0,2|2,0,0]=4 10022 B13R1.42 COCC(=O)NNc1ccccc1 Amb25052871 [0,0,0,0,0,2|2,0,0]=4 10023 B13R1.42 CONC(=O)CCc1ccccc1 Amb10705059 [0,0,0,0,0,2|2,0,0]=4 10024 B13R1.42 CONC(=O)NCc1ccccc1 Amb16969954 [0,0,0,0,0,2|2,0,0]=4 10025 B13R1.42 CONC(=O)OCc1ccccc1 Amb16969956 [0,0,0,0,0,2|2,0,0]=4 10026 B13R1.42 CSCC(=O)C#Cc1ccccc1 Amb24440307 [0,0,0,0,0,2|2,0,0]=4 10027 B13R1.42 CSCC(=O)NCc1ccccc1 Amb19382179 [0,0,0,0,0,2|2,0,0]=4 10028 B13R1.42 CSCC(=O)NNc1ccccc1 Amb25145264 [0,0,0,0,0,2|2,0,0]=4 10029 B13R1.42 C\C=C/C(=O)NCc1ccccc1 Amb24432668 [0,0,0,0,0,2|1,0,1]=4 10030 B13R1.42 C\C=C/C(=O)\C=C\c1ccccc1 Amb25093685 [0,0,0,0,0,2|1,0,1]=4 10031 B13R1.42 C\C=C\C(=O)NCc1ccccc1 Amb1196143 [0,0,0,0,0,2|1,0,1]=4 10032 B13R1.42 C\C=C\C(=O)OCc1ccccc1 Amb10572342 [0,0,0,0,0,2|1,0,1]=4 10033 B13R1.42 ClCCC(=O)NCc1ccccc1 Amb1931859 [0,0,0,0,0,2|2,0,0]=4 10034 B13R1.42 NCCC(=O)NCc1ccccc1 Amb15740949 [0,0,0,0,0,2|2,0,0]=4 10035 B13R1.42 NCCC(=O)OCc1ccccc1 Amb15690782 [0,0,0,0,0,2|2,0,0]=4 10036 B13R1.42 NCCC(=O)OCc1ccccc1 Amb20626398 [0,0,0,0,0,2|2,0,0]=4 10037 B13R1.42 NCNC(=O)OCc1ccccc1 Amb10558226 [0,0,0,0,0,2|2,0,0]=4 10038 B13R1.42 O=C(CCBr)C#Cc1ccccc1 Amb24379645 [0,0,0,0,0,2|2,0,0]=4 10039 B13R1.42 O=C(CCBr)OCc1ccccc1 Amb22232000 [0,0,0,0,0,2|2,0,0]=4 10040 B13R1.42 O=C(CCCl)C#Cc1ccccc1 Amb24431018 [0,0,0,0,0,2|2,0,0]=4 10041 B13R1.42 O=C(CCF)OCc1ccccc1 Amb22497154 [0,0,0,0,0,2|2,0,0]=4 10042 B13R1.42 O=C(CCS)OCc1ccccc1 Amb24495479 [0,0,0,0,0,2|2,0,0]=4 10043 B13R1.42 O=C(NCCl)OCc1ccccc1 Amb25783886 [0,0,0,0,0,2|2,0,0]=4 10044 B13R1.42 O=C(NCc1ccccc1)OCCl Amb24635651 [0,0,0,0,0,2|1,0,0]=3 10045 B13R1.42 O=C(NCc1ccccc1)OCF Amb25090863 [0,0,0,0,0,2|1,0,0]=3 10046 B13R1.42 OCCC(=O)NCc1ccccc1 Amb17335299 [0,0,0,0,0,2|2,0,0]=4 10047 B13R1.42 OCCC(=O)OCc1ccccc1 Amb17609079 [0,0,0,0,0,2|2,0,0]=4 10048 B13R1.42 OCNC(=O)OCc1ccccc1 Amb10066979 [0,0,0,0,0,2|2,0,0]=4 10049 B13R1.1575 CCOC(=O)NC1=CCC=CC=C1 Amb25034337 [0,0,0,0,0,2|0,0,0]=2 10050 B13R1.1464 CCCC(=O)C=1C=CC=CC=CC1 Amb25059693 [0,0,0,0,0,2|1,0,0]=3