0 B8R1.7 C=C(Br)c1ccco1 Amb28075689 [0,0,0,0,0,0|2,1,1]=4 1 B8R1.7 C=C(C)C1=NCCO1 Amb17772215 [0,0,0,0,0,0|1,1,2]=4 2 B8R1.7 C=C(C)c1ccco1 Amb24532306 [0,0,0,0,0,0|2,1,0]=3 3 B8R1.7 C=C(C)c1cccs1 Amb28141914 [0,0,0,0,0,0|2,0,0]=2 4 B8R1.7 C=C(C)c1ccoc1 Amb27627290 [0,0,0,0,0,0|4,0,0]=4 5 B8R1.7 CB(Br)c1cccs1 Amb27636578 [0,0,0,0,0,0|3,0,0]=3 6 B8R1.7 CC(=O)C1=CCCC1 Amb22338190 [0,0,0,0,0,0|2,0,2]=4 7 B8R1.7 CC(=O)C1=CCCN1 Amb27880337 [0,0,0,0,0,0|1,0,3]=4 8 B8R1.7 CC(=O)C1=CCCO1 Amb25759909 [0,0,0,0,0,0|1,1,2]=4 9 B8R1.7 CC(=O)C1=CNCC1 Amb27455189 [0,0,0,0,0,0|3,0,1]=4 10 B8R1.7 CC(=O)C1=C[CH-]C=C1 Amb2227554 [0,0,0,0,0,0|2,0,1]=3 11 B8R1.7 CC(=O)C1=NCCO1 Amb24481446 [0,0,0,0,0,0|0,1,2]=3 12 B8R1.7 CC(=O)C1=NCCS1 Amb8384455 [0,0,0,0,0,0|0,0,2]=2 13 B8R1.7 CC(=O)C1=NCSC1 Amb27985534 [0,0,0,0,0,0|2,0,1]=3 14 B8R1.7 CC(=O)C1CC=CN1 Amb26979687 [0,0,0,0,0,0|1,0,2]=3 15 B8R1.7 CC(=O)C1CC=NO1 Amb27481847 [0,0,0,0,0,0|2,1,1]=4 16 B8R1.7 CC(=O)C1CCC=N1 Amb22496787 [0,0,0,0,0,0|1,0,2]=3 17 B8R1.7 CC(=O)C1CCCS1 Amb27838322 [0,0,0,0,0,0|1,0,3]=4 18 B8R1.7 CC(=O)C1NCCS1 Amb22757393 [0,0,0,0,0,0|0,0,4]=4 19 B8R1.7 CC(=O)C1OCCS1 Amb27262730 [0,0,0,0,0,0|1,0,3]=4 20 B8R1.7 CC(=O)[c-]1cccc1 Amb34916050 [0,0,0,0,0,0|2,0,1]=3 21 B8R1.7 CC(=O)c1cc[se]c1 Amb2611517 [0,0,0,0,0,0|3,0,0]=3 22 B8R1.7 CC(=O)c1ccc[se]1 Amb17673999 [0,0,0,0,0,0|1,1,0]=2 23 B8R1.7 CC(=O)c1ccco1 Amb2782007 [0,0,0,0,0,0|1,1,0]=2 24 B8R1.7 CC(=O)c1cccs1 Amb2684284 [0,0,0,0,0,0|1,0,0]=1 25 B8R1.7 CC(=O)c1ccno1 Amb20242198 [0,0,0,0,0,0|2,1,0]=3 26 B8R1.7 CC(=O)c1ccns1 Amb13883508 [0,0,0,0,0,0|2,0,0]=2 27 B8R1.7 CC(=O)c1ccoc1 Amb2440799 [0,0,0,0,0,0|3,0,0]=3 28 B8R1.7 CC(=O)c1ccon1 Amb20242197 [0,0,0,0,0,0|2,0,0]=2 29 B8R1.7 CC(=O)c1ccsc1 Amb535812 [0,0,0,0,0,0|3,0,0]=3 30 B8R1.7 CC(=O)c1ccsn1 Amb25044341 [0,0,0,0,0,0|2,0,0]=2 31 B8R1.7 CC(=O)c1cnco1 Amb24737064 [0,0,0,0,0,0|2,1,0]=3 32 B8R1.7 CC(=O)c1cncs1 Amb33531201 [0,0,0,0,0,0|2,0,0]=2 33 B8R1.7 CC(=O)c1cnns1 Amb17772366 [0,0,0,0,0,0|3,0,0]=3 34 B8R1.7 CC(=O)c1cnon1 Amb18833096 [0,0,0,0,0,0|3,0,0]=3 35 B8R1.7 CC(=O)c1cnsc1 Amb26359853 [0,0,0,0,0,0|4,0,0]=4 36 B8R1.7 CC(=O)c1cocn1 Amb18833111 [0,0,0,0,0,0|2,0,0]=2 37 B8R1.7 CC(=O)c1cscn1 Amb33543399 [0,0,0,0,0,0|2,0,0]=2 38 B8R1.7 CC(=O)c1csnn1 Amb18203245 [0,0,0,0,0,0|3,0,0]=3 39 B8R1.7 CC(=O)c1ncco1 Amb19958429 [0,0,0,0,0,0|0,1,0]=1 40 B8R1.7 CC(=O)c1nccs1 Amb2684283 [0,0,0,0,0,0|0,0,0]=0 41 B8R1.7 CC(=O)c1ncno1 Amb25119390 [0,0,0,0,0,0|1,1,0]=2 42 B8R1.7 CC(=O)c1ncsn1 Amb26887703 [0,0,0,0,0,0|2,0,0]=2 43 B8R1.7 CC(=O)c1nnco1 Amb28322871 [0,0,0,0,0,0|1,1,0]=2 44 B8R1.7 CC(=O)c1nnno1 Amb25798453 [0,0,0,0,0,0|2,1,0]=3 45 B8R1.7 CC(=O)n1cccn1 Amb3372586 [0,0,0,0,0,0|2,0,0]=2 46 B8R1.7 CC(=O)n1ccnc1 Amb2684250 [0,0,0,0,0,0|4,0,0]=4 47 B8R1.7 CC(=O)n1cncn1 Amb22584191 [0,0,0,0,0,0|3,0,0]=3 48 B8R1.7 CC(=O)n1nccn1 Amb28344017 [0,0,0,0,0,0|2,0,0]=2 49 B8R1.7 CC(Br)c1cccs1 Amb17447081 [0,0,0,0,0,0|2,0,1]=3 50 B8R1.7 CC(Br)c1nccs1 Amb32941904 [0,0,0,0,0,0|1,0,1]=2 51 B8R1.7 CC(Br)c1nccs1 Amb33547779 [0,0,0,0,0,0|1,0,1]=2 52 B8R1.7 CC(C)=C1C=CC=C1 Amb2720978 [0,0,0,0,0,0|3,0,0]=3 53 B8R1.7 CC(C)=C1C=CSC1 Amb28188823 [0,0,0,0,0,0|4,0,0]=4 54 B8R1.7 CC(C)C1=CC=CC1 Amb22227970 [0,0,0,0,0,0|3,0,1]=4 55 B8R1.7 CC(C)C1=NCCS1 Amb22364351 [0,0,0,0,0,0|1,0,3]=4 56 B8R1.7 CC(C)C1N=CCS1 Amb27660836 [0,0,0,0,0,0|1,0,3]=4 57 B8R1.7 CC(C)c1ccco1 Amb22168231 [0,0,0,0,0,0|2,1,1]=4 58 B8R1.7 CC(C)c1cccs1 Amb17689449 [0,0,0,0,0,0|2,0,1]=3 59 B8R1.7 CC(C)c1cncs1 Amb22001688 [0,0,0,0,0,0|3,0,1]=4 60 B8R1.7 CC(C)c1cocn1 Amb27755493 [0,0,0,0,0,0|3,0,1]=4 61 B8R1.7 CC(C)c1cscn1 Amb13884092 [0,0,0,0,0,0|3,0,1]=4 62 B8R1.7 CC(C)c1ncco1 Amb17399790 [0,0,0,0,0,0|1,1,1]=3 63 B8R1.7 CC(C)c1nccs1 Amb10601014 [0,0,0,0,0,0|1,0,1]=2 64 B8R1.7 CC(C)n1cccn1 Amb2582754 [0,0,0,0,0,0|3,0,1]=4 65 B8R1.7 CC(Cl)c1ccco1 Amb17138373 [0,0,0,0,0,0|2,1,1]=4 66 B8R1.7 CC(Cl)c1cccs1 Amb17138413 [0,0,0,0,0,0|2,0,1]=3 67 B8R1.7 CC(Cl)c1ccns1 Amb26965614 [0,0,0,0,0,0|3,0,1]=4 68 B8R1.7 CC(Cl)c1nccs1 Amb20618291 [0,0,0,0,0,0|1,0,1]=2 69 B8R1.7 CC(Cl)c1ncno1 Amb19375376 [0,0,0,0,0,0|2,1,1]=4 70 B8R1.7 CC(Cl)c1nnco1 Amb28207552 [0,0,0,0,0,0|2,1,1]=4 71 B8R1.7 CC(Cl)n1cccn1 Amb27881847 [0,0,0,0,0,0|3,0,1]=4 72 B8R1.7 CC(N)=C1C=CC=C1 Amb27245689 [0,0,0,0,0,0|3,0,0]=3 73 B8R1.7 CC(N)C1=NCCS1 Amb28323473 [0,0,0,0,0,0|1,0,3]=4 74 B8R1.7 CC(N)c1ccco1 Amb6893074 [0,0,0,0,0,0|2,1,1]=4 75 B8R1.7 CC(N)c1ccco1 Amb9745704 [0,0,0,0,0,0|2,1,1]=4 76 B8R1.7 CC(N)c1cccs1 Amb1790688 [0,0,0,0,0,0|2,0,1]=3 77 B8R1.7 CC(N)c1cccs1 Amb6487447 [0,0,0,0,0,0|2,0,1]=3 78 B8R1.7 CC(N)c1ccns1 Amb18202953 [0,0,0,0,0,0|3,0,1]=4 79 B8R1.7 CC(N)c1ccns1 Amb28934887 [0,0,0,0,0,0|3,0,1]=4 80 B8R1.7 CC(N)c1ccns1 Amb32670745 [0,0,0,0,0,0|3,0,1]=4 81 B8R1.7 CC(N)c1ccon1 Amb8009386 [0,0,0,0,0,0|3,0,1]=4 82 B8R1.7 CC(N)c1cncs1 Amb32666049 [0,0,0,0,0,0|3,0,1]=4 83 B8R1.7 CC(N)c1cncs1 Amb32687458 [0,0,0,0,0,0|3,0,1]=4 84 B8R1.7 CC(N)c1cncs1 Amb5758538 [0,0,0,0,0,0|3,0,1]=4 85 B8R1.7 CC(N)c1cocn1 Amb35752619 [0,0,0,0,0,0|3,0,1]=4 86 B8R1.7 CC(N)c1cocn1 Amb8009706 [0,0,0,0,0,0|3,0,1]=4 87 B8R1.7 CC(N)c1cscn1 Amb21956129 [0,0,0,0,0,0|3,0,1]=4 88 B8R1.7 CC(N)c1cscn1 Amb33542524 [0,0,0,0,0,0|3,0,1]=4 89 B8R1.7 CC(N)c1ncco1 Amb28934825 [0,0,0,0,0,0|1,1,1]=3 90 B8R1.7 CC(N)c1ncco1 Amb8009702 [0,0,0,0,0,0|1,1,1]=3 91 B8R1.7 CC(N)c1nccs1 Amb21857830 [0,0,0,0,0,0|1,0,1]=2 92 B8R1.7 CC(N)c1nccs1 Amb21928079 [0,0,0,0,0,0|1,0,1]=2 93 B8R1.7 CC(N)c1nccs1 Amb5740489 [0,0,0,0,0,0|1,0,1]=2 94 B8R1.7 CC(N)c1ncno1 Amb33330110 [0,0,0,0,0,0|2,1,1]=4 95 B8R1.7 CC(N)c1ncno1 Amb8009699 [0,0,0,0,0,0|2,1,1]=4 96 B8R1.7 CC(N)c1ncon1 Amb28990941 [0,0,0,0,0,0|3,0,1]=4 97 B8R1.7 CC(N)c1ncon1 Amb9421927 [0,0,0,0,0,0|3,0,1]=4 98 B8R1.7 CC(N)c1nnco1 Amb17079553 [0,0,0,0,0,0|2,1,1]=4 99 B8R1.7 CC(O)C1=NCCS1 Amb28453499 [0,0,0,0,0,0|0,0,4]=4 100 B8R1.7 CC(O)c1ccco1 Amb2725588 [0,0,0,0,0,0|1,1,2]=4 101 B8R1.7 CC(O)c1cccs1 Amb5722410 [0,0,0,0,0,0|1,0,2]=3 102 B8R1.7 CC(O)c1ccns1 Amb27474829 [0,0,0,0,0,0|2,0,2]=4 103 B8R1.7 CC(O)c1cncs1 Amb19515392 [0,0,0,0,0,0|2,0,2]=4 104 B8R1.7 CC(O)c1cncs1 Amb32666046 [0,0,0,0,0,0|2,0,2]=4 105 B8R1.7 CC(O)c1cocn1 Amb24412519 [0,0,0,0,0,0|2,0,2]=4 106 B8R1.7 CC(O)c1cscn1 Amb26858695 [0,0,0,0,0,0|2,0,2]=4 107 B8R1.7 CC(O)c1nccs1 Amb19649204 [0,0,0,0,0,0|0,0,2]=2 108 B8R1.7 CC(O)c1ncon1 Amb27219491 [0,0,0,0,0,0|2,0,2]=4 109 B8R1.7 CC(S)c1ccco1 Amb9208025 [0,0,0,0,0,0|1,2,1]=4 110 B8R1.7 CC(S)c1cccs1 Amb9204475 [0,0,0,0,0,0|1,1,1]=3 111 B8R1.7 CC(S)c1ccns1 Amb32788286 [0,0,0,0,0,0|2,1,1]=4 112 B8R1.7 CC(S)c1cncs1 Amb27800439 [0,0,0,0,0,0|2,1,1]=4 113 B8R1.7 CC(S)c1cscn1 Amb25103852 [0,0,0,0,0,0|2,1,1]=4 114 B8R1.7 CC(S)c1nccs1 Amb27244796 [0,0,0,0,0,0|0,1,1]=2 115 B8R1.7 CC([NH3+])c1ccon1 Amb4303247 [0,0,0,0,0,0|3,0,1]=4 116 B8R1.7 CN(C)c1nccs1 Amb18268629 [0,0,0,0,0,0|2,0,0]=2 117 B8R1.7 CN(C)c1ncns1 Amb27449624 [0,0,0,0,0,0|3,0,0]=3 118 B8R1.7 CN(C)c1nncs1 Amb28056741 [0,0,0,0,0,0|3,0,0]=3 119 B8R1.7 CN(O)c1nccs1 Amb27186197 [0,0,0,0,0,0|1,0,1]=2 120 B8R1.7 C[C@@H](N)c1ccco1 Amb13952986 [0,0,0,0,0,0|2,1,1]=4 121 B8R1.7 C[C@@H](N)c1ccco1 Amb30526698 [0,0,0,0,0,0|2,1,1]=4 122 B8R1.7 C[C@@H](N)c1cccs1 Amb13952998 [0,0,0,0,0,0|2,0,1]=3 123 B8R1.7 C[C@@H](N)c1cncs1 Amb19374315 [0,0,0,0,0,0|3,0,1]=4 124 B8R1.7 C[C@@H](N)c1cncs1 Amb32941942 [0,0,0,0,0,0|3,0,1]=4 125 B8R1.7 C[C@@H](N)c1cscn1 Amb26968250 [0,0,0,0,0,0|3,0,1]=4 126 B8R1.7 C[C@@H](N)c1ncco1 Amb19374517 [0,0,0,0,0,0|1,1,1]=3 127 B8R1.7 C[C@@H](N)c1nccs1 Amb19115342 [0,0,0,0,0,0|1,0,1]=2 128 B8R1.7 C[C@@H](N)c1nccs1 Amb22754035 [0,0,0,0,0,0|1,0,1]=2 129 B8R1.7 C[C@@H](O)C1=CC=CC1 Amb27763807 [0,0,0,0,0,0|2,0,2]=4 130 B8R1.7 C[C@@H](O)c1ccco1 Amb8515979 [0,0,0,0,0,0|1,1,2]=4 131 B8R1.7 C[C@@H](O)c1ccns1 Amb33483071 [0,0,0,0,0,0|2,0,2]=4 132 B8R1.7 C[C@@H](O)c1ccon1 Amb33226152 [0,0,0,0,0,0|2,0,2]=4 133 B8R1.7 C[C@@H](O)c1cncs1 Amb19515388 [0,0,0,0,0,0|2,0,2]=4 134 B8R1.7 C[C@@H](O)c1nccs1 Amb19338124 [0,0,0,0,0,0|0,0,2]=2 135 B8R1.7 C[C@H](N)c1ccco1 Amb13952985 [0,0,0,0,0,0|2,1,1]=4 136 B8R1.7 C[C@H](N)c1ccco1 Amb28934820 [0,0,0,0,0,0|2,1,1]=4 137 B8R1.7 C[C@H](N)c1cccs1 Amb13952997 [0,0,0,0,0,0|2,0,1]=3 138 B8R1.7 C[C@H](N)c1cccs1 Amb33872484 [0,0,0,0,0,0|2,0,1]=3 139 B8R1.7 C[C@H](N)c1ccon1 Amb32954569 [0,0,0,0,0,0|3,0,1]=4 140 B8R1.7 C[C@H](N)c1cncs1 Amb24481398 [0,0,0,0,0,0|3,0,1]=4 141 B8R1.7 C[C@H](N)c1cncs1 Amb33109887 [0,0,0,0,0,0|3,0,1]=4 142 B8R1.7 C[C@H](N)c1cscn1 Amb26983763 [0,0,0,0,0,0|3,0,1]=4 143 B8R1.7 C[C@H](N)c1nccs1 Amb17602653 [0,0,0,0,0,0|1,0,1]=2 144 B8R1.7 C[C@H](N)c1nccs1 Amb23385338 [0,0,0,0,0,0|1,0,1]=2 145 B8R1.7 C[C@H](O)C1=CC=CC1 Amb28079112 [0,0,0,0,0,0|2,0,2]=4 146 B8R1.7 C[C@H](O)c1ccco1 Amb8515981 [0,0,0,0,0,0|1,1,2]=4 147 B8R1.7 C[C@H](O)c1cccs1 Amb13952996 [0,0,0,0,0,0|1,0,2]=3 148 B8R1.7 C[C@H](O)c1ccns1 Amb33483067 [0,0,0,0,0,0|2,0,2]=4 149 B8R1.7 C[C@H](O)c1ccon1 Amb33198776 [0,0,0,0,0,0|2,0,2]=4 150 B8R1.7 C[C@H](O)c1cncs1 Amb25697062 [0,0,0,0,0,0|2,0,2]=4 151 B8R1.7 C[C@H](O)c1cncs1 Amb32941861 [0,0,0,0,0,0|2,0,2]=4 152 B8R1.7 C[C@H](O)c1cscn1 Amb24568211 [0,0,0,0,0,0|2,0,2]=4 153 B8R1.7 C[C@H](O)c1nccs1 Amb28280646 [0,0,0,0,0,0|0,0,2]=2 154 B8R1.7 C[SiH](C)c1ccco1 Amb27624813 [0,0,0,0,0,0|2,2,0]=4 155 B8R1.7 ClP(Cl)c1cccs1 Amb4297331 [0,0,0,0,0,0|4,0,0]=4 156 B8R1.7 Cl[SiH](Cl)c1cccs1 Amb27847661 [0,0,0,0,0,0|3,1,0]=4 157 B8R1.7 FC(F)c1cccs1 Amb26966095 [0,0,0,0,0,0|3,0,1]=4 158 B8R1.7 FC(F)c1nccs1 Amb31377735 [0,0,0,0,0,0|2,0,1]=3 159 B8R1.7 N=C(N)c1ccco1 Amb13952844 [0,0,0,0,0,0|3,1,0]=4 160 B8R1.7 N=C(N)c1ccco1 Amb2695169 [0,0,0,0,0,0|3,1,0]=4 161 B8R1.7 N=C(N)c1ccco1 Amb9210508 [0,0,0,0,0,0|3,1,0]=4 162 B8R1.7 N=C(N)c1cccs1 Amb2684312 [0,0,0,0,0,0|3,0,0]=3 163 B8R1.7 N=C(N)c1ccns1 Amb29852545 [0,0,0,0,0,0|4,0,0]=4 164 B8R1.7 N=C(N)c1ccon1 Amb33199047 [0,0,0,0,0,0|4,0,0]=4 165 B8R1.7 N=C(N)c1cncs1 Amb18255775 [0,0,0,0,0,0|4,0,0]=4 166 B8R1.7 N=C(N)c1cncs1 Amb28934906 [0,0,0,0,0,0|4,0,0]=4 167 B8R1.7 N=C(N)c1cscn1 Amb28468141 [0,0,0,0,0,0|4,0,0]=4 168 B8R1.7 N=C(N)c1nccs1 Amb17934257 [0,0,0,0,0,0|2,0,0]=2 169 B8R1.7 N=C(N)c1nccs1 Amb33544287 [0,0,0,0,0,0|2,0,0]=2 170 B8R1.7 N=C(N)n1cccn1 Amb10604060 [0,0,0,0,0,0|4,0,0]=4 171 B8R1.7 N=C(N)n1cccn1 Amb2720290 [0,0,0,0,0,0|4,0,0]=4 172 B8R1.7 N=C(O)c1cocn1 Amb21928044 [0,0,0,0,0,0|3,0,1]=4 173 B8R1.7 NC(=O)C1=NCCN1 Amb1068371 [0,0,0,0,0,0|2,0,2]=4 174 B8R1.7 NC(=O)C1CC=CC1 Amb10068010 [0,0,0,0,0,0|3,0,1]=4 175 B8R1.7 NC(=O)N1C=CNS1 Amb27968648 [0,0,0,0,0,0|4,0,0]=4 176 B8R1.7 NC(=O)N1CC=CC1 Amb27837546 [0,0,0,0,0,0|4,0,0]=4 177 B8R1.7 NC(=O)N1CCC=N1 Amb27839165 [0,0,0,0,0,0|3,0,1]=4 178 B8R1.7 NC(=O)c1ccco1 Amb6373632 [0,0,0,0,0,0|2,1,0]=3 179 B8R1.7 NC(=O)c1cccs1 Amb2722696 [0,0,0,0,0,0|2,0,0]=2 180 B8R1.7 NC(=O)c1ccno1 Amb4477414 [0,0,0,0,0,0|3,1,0]=4 181 B8R1.7 NC(=O)c1ccns1 Amb24409499 [0,0,0,0,0,0|3,0,0]=3 182 B8R1.7 NC(=O)c1ccoc1 Amb8998597 [0,0,0,0,0,0|4,0,0]=4 183 B8R1.7 NC(=O)c1ccon1 Amb20630182 [0,0,0,0,0,0|3,0,0]=3 184 B8R1.7 NC(=O)c1ccsc1 Amb8998201 [0,0,0,0,0,0|4,0,0]=4 185 B8R1.7 NC(=O)c1ccsn1 Amb25224962 [0,0,0,0,0,0|3,0,0]=3 186 B8R1.7 NC(=O)c1cnco1 Amb22000976 [0,0,0,0,0,0|3,1,0]=4 187 B8R1.7 NC(=O)c1cncs1 Amb19514920 [0,0,0,0,0,0|3,0,0]=3 188 B8R1.7 NC(=O)c1cnns1 Amb9383988 [0,0,0,0,0,0|4,0,0]=4 189 B8R1.7 NC(=O)c1cocn1 Amb21857139 [0,0,0,0,0,0|3,0,0]=3 190 B8R1.7 NC(=O)c1cscn1 Amb8631050 [0,0,0,0,0,0|3,0,0]=3 191 B8R1.7 NC(=O)c1csnn1 Amb2725701 [0,0,0,0,0,0|4,0,0]=4 192 B8R1.7 NC(=O)c1ncco1 Amb21963562 [0,0,0,0,0,0|1,1,0]=2 193 B8R1.7 NC(=O)c1nccs1 Amb5494087 [0,0,0,0,0,0|1,0,0]=1 194 B8R1.7 NC(=O)c1ncon1 Amb25169588 [0,0,0,0,0,0|3,0,0]=3 195 B8R1.7 NC(=O)c1nncs1 Amb23437055 [0,0,0,0,0,0|2,0,0]=2 196 B8R1.7 NC(=O)n1cccc1 Amb17938700 [0,0,0,0,0,0|4,0,0]=4 197 B8R1.7 NC(=O)n1ccnn1 Amb27877905 [0,0,0,0,0,0|4,0,0]=4 198 B8R1.7 NC(=O)n1cncn1 Amb24621879 [0,0,0,0,0,0|4,0,0]=4 199 B8R1.7 NC(=S)C1=NCCS1 Amb28073445 [0,0,0,0,0,0|1,1,2]=4 200 B8R1.7 NC(=S)c1ccco1 Amb2099744 [0,0,0,0,0,0|2,2,0]=4 201 B8R1.7 NC(=S)c1cccs1 Amb1152349 [0,0,0,0,0,0|2,1,0]=3 202 B8R1.7 NC(=S)c1ccns1 Amb35720413 [0,0,0,0,0,0|3,1,0]=4 203 B8R1.7 NC(=S)c1ccon1 Amb25378762 [0,0,0,0,0,0|3,1,0]=4 204 B8R1.7 NC(=S)c1ccsn1 Amb33496181 [0,0,0,0,0,0|3,1,0]=4 205 B8R1.7 NC(=S)c1cncs1 Amb18255776 [0,0,0,0,0,0|3,1,0]=4 206 B8R1.7 NC(=S)c1cocn1 Amb13890530 [0,0,0,0,0,0|3,1,0]=4 207 B8R1.7 NC(=S)c1cscn1 Amb10068447 [0,0,0,0,0,0|3,1,0]=4 208 B8R1.7 NC(=S)c1nccs1 Amb8630334 [0,0,0,0,0,0|1,1,0]=2 209 B8R1.7 NC(=S)c1ncon1 Amb1102327 [0,0,0,0,0,0|3,1,0]=4 210 B8R1.7 NC(=S)n1cccn1 Amb2429874 [0,0,0,0,0,0|3,1,0]=4 211 B8R1.7 NC(N)=C1C=CC=N1 Amb25711339 [0,0,0,0,0,0|3,0,0]=3 212 B8R1.7 NC(N)=C1C=CN=N1 Amb27808459 [0,0,0,0,0,0|4,0,0]=4 213 B8R1.7 NC(O)c1cccs1 Amb27186320 [0,0,0,0,0,0|2,0,2]=4 214 B8R1.7 O=C(Br)c1cccs1 Amb27239935 [0,0,0,0,0,0|2,0,0]=2 215 B8R1.7 O=C(Cl)C1CC=CC1 Amb24371090 [0,0,0,0,0,0|3,0,1]=4 216 B8R1.7 O=C(Cl)c1ccco1 Amb2716231 [0,0,0,0,0,0|2,1,0]=3 217 B8R1.7 O=C(Cl)c1cccs1 Amb1157175 [0,0,0,0,0,0|2,0,0]=2 218 B8R1.7 O=C(Cl)c1ccno1 Amb2689052 [0,0,0,0,0,0|3,1,0]=4 219 B8R1.7 O=C(Cl)c1ccns1 Amb26413872 [0,0,0,0,0,0|3,0,0]=3 220 B8R1.7 O=C(Cl)c1ccoc1 Amb33528390 [0,0,0,0,0,0|4,0,0]=4 221 B8R1.7 O=C(Cl)c1ccsc1 Amb33527269 [0,0,0,0,0,0|4,0,0]=4 222 B8R1.7 O=C(Cl)c1cnco1 Amb26915176 [0,0,0,0,0,0|3,1,0]=4 223 B8R1.7 O=C(Cl)c1cncs1 Amb33329448 [0,0,0,0,0,0|3,0,0]=3 224 B8R1.7 O=C(Cl)c1cnon1 Amb27799957 [0,0,0,0,0,0|4,0,0]=4 225 B8R1.7 O=C(Cl)c1cocn1 Amb23440854 [0,0,0,0,0,0|3,0,0]=3 226 B8R1.7 O=C(Cl)c1cscn1 Amb8631052 [0,0,0,0,0,0|3,0,0]=3 227 B8R1.7 O=C(Cl)c1csnn1 Amb535502 [0,0,0,0,0,0|4,0,0]=4 228 B8R1.7 O=C(Cl)c1nccs1 Amb2723139 [0,0,0,0,0,0|1,0,0]=1 229 B8R1.7 O=C(Cl)c1ncon1 Amb16230808 [0,0,0,0,0,0|3,0,0]=3 230 B8R1.7 O=C(Cl)n1cccn1 Amb22886609 [0,0,0,0,0,0|3,0,0]=3 231 B8R1.7 O=C(O)C1=CCCS1 Amb18642795 [0,0,0,0,0,0|2,0,2]=4 232 B8R1.7 O=C(O)C1=CN=S=N1 Amb17798585 [0,0,0,0,0,0|4,0,0]=4 233 B8R1.7 O=C(O)C1=CSCS1 Amb25330178 [0,0,0,0,0,0|3,0,1]=4 234 B8R1.7 O=C(O)C1=NCCN1 Amb27787520 [0,0,0,0,0,0|2,0,2]=4 235 B8R1.7 O=C(O)C1=NOCC1 Amb24353499 [0,0,0,0,0,0|3,0,1]=4 236 B8R1.7 O=C(O)C1CC=CC1 Amb2694750 [0,0,0,0,0,0|3,0,1]=4 237 B8R1.7 O=C(O)C1CCC=N1 Amb27849168 [0,0,0,0,0,0|2,0,2]=4 238 B8R1.7 O=C(O)C1COC=N1 Amb28291372 [0,0,0,0,0,0|3,0,1]=4 239 B8R1.7 O=C(O)C1OC=CS1 Amb27489874 [0,0,0,0,0,0|2,0,1]=3 240 B8R1.7 O=C(O)[C@@H]1CSC=N1 Amb35648199 [0,0,0,0,0,0|3,0,1]=4 241 B8R1.7 O=C(O)[C@H]1CCC=N1 Amb28128325 [0,0,0,0,0,0|2,0,2]=4 242 B8R1.7 O=C(O)[C@H]1CSC=N1 Amb35641724 [0,0,0,0,0,0|3,0,1]=4 243 B8R1.7 O=C(O)[c-]1cccc1 Amb33801890 [0,0,0,0,0,0|3,0,1]=4 244 B8R1.7 O=C(O)[c-]1cccc1 Amb34916034 [0,0,0,0,0,0|3,0,1]=4 245 B8R1.7 O=C(O)c1ccc[se]1 Amb2611630 [0,0,0,0,0,0|2,1,0]=3 246 B8R1.7 O=C(O)c1ccco1 Amb6335264 [0,0,0,0,0,0|2,1,0]=3 247 B8R1.7 O=C(O)c1cccs1 Amb2690602 [0,0,0,0,0,0|2,0,0]=2 248 B8R1.7 O=C(O)c1ccno1 Amb1152220 [0,0,0,0,0,0|3,1,0]=4 249 B8R1.7 O=C(O)c1ccns1 Amb1091955 [0,0,0,0,0,0|3,0,0]=3 250 B8R1.7 O=C(O)c1ccoc1 Amb2720344 [0,0,0,0,0,0|4,0,0]=4 251 B8R1.7 O=C(O)c1ccon1 Amb8386353 [0,0,0,0,0,0|3,0,0]=3 252 B8R1.7 O=C(O)c1ccsc1 Amb1156673 [0,0,0,0,0,0|4,0,0]=4 253 B8R1.7 O=C(O)c1ccsn1 Amb19894963 [0,0,0,0,0,0|3,0,0]=3 254 B8R1.7 O=C(O)c1cnco1 Amb1158212 [0,0,0,0,0,0|3,1,0]=4 255 B8R1.7 O=C(O)c1cncs1 Amb1158214 [0,0,0,0,0,0|3,0,0]=3 256 B8R1.7 O=C(O)c1cnns1 Amb3319162 [0,0,0,0,0,0|4,0,0]=4 257 B8R1.7 O=C(O)c1cnon1 Amb6316077 [0,0,0,0,0,0|4,0,0]=4 258 B8R1.7 O=C(O)c1cnsn1 Amb1091970 [0,0,0,0,0,0|4,0,0]=4 259 B8R1.7 O=C(O)c1cocn1 Amb10071584 [0,0,0,0,0,0|3,0,0]=3 260 B8R1.7 O=C(O)c1conn1 Amb28286788 [0,0,0,0,0,0|4,0,0]=4 261 B8R1.7 O=C(O)c1cscn1 Amb17039667 [0,0,0,0,0,0|3,0,0]=3 262 B8R1.7 O=C(O)c1cscn1 Amb2455731 [0,0,0,0,0,0|3,0,0]=3 263 B8R1.7 O=C(O)c1csnn1 Amb535501 [0,0,0,0,0,0|4,0,0]=4 264 B8R1.7 O=C(O)c1ncco1 Amb8009395 [0,0,0,0,0,0|1,1,0]=2 265 B8R1.7 O=C(O)c1nccs1 Amb6572012 [0,0,0,0,0,0|1,0,0]=1 266 B8R1.7 O=C(O)c1ncno1 Amb8009397 [0,0,0,0,0,0|2,1,0]=3 267 B8R1.7 O=C(O)c1ncns1 Amb18203206 [0,0,0,0,0,0|2,0,0]=2 268 B8R1.7 O=C(O)c1ncon1 Amb8009396 [0,0,0,0,0,0|3,0,0]=3 269 B8R1.7 O=C(O)c1nnco1 Amb21964326 [0,0,0,0,0,0|2,1,0]=3 270 B8R1.7 O=C(O)c1nncs1 Amb20241053 [0,0,0,0,0,0|2,0,0]=2 271 B8R1.7 O=C(O)n1cccc1 Amb17938698 [0,0,0,0,0,0|4,0,0]=4 272 B8R1.7 O=C([O-])C1CCC=N1 Amb33624430 [0,0,0,0,0,0|2,0,2]=4 273 B8R1.7 O=C([O-])c1cccs1 Amb10067272 [0,0,0,0,0,0|2,0,0]=2 274 B8R1.7 O=C([O-])c1cncs1 Amb13951709 [0,0,0,0,0,0|3,0,0]=3 275 B8R1.7 O=C([O-])c1cscn1 Amb13951445 [0,0,0,0,0,0|3,0,0]=3 276 B8R1.7 O=C([O-])c1ncco1 Amb33547593 [0,0,0,0,0,0|1,1,0]=2 277 B8R1.7 O=C([O-])c1ncco1 Amb33733801 [0,0,0,0,0,0|1,1,0]=2 278 B8R1.7 O=C([O-])c1nccs1 Amb1102733 [0,0,0,0,0,0|1,0,0]=1 279 B8R1.7 O=C([O-])c1nccs1 Amb6540690 [0,0,0,0,0,0|1,0,0]=1 280 B8R1.7 O=C([O-])c1nncs1 Amb32992088 [0,0,0,0,0,0|2,0,0]=2 281 B8R1.7 O=N(=O)c1cccs1 Amb20621934 [0,0,0,0,0,0|3,0,0]=3 282 B8R1.7 O=N(=O)n1cccn1 Amb20621869 [0,0,0,0,0,0|4,0,0]=4 283 B8R1.7 O=S(Cl)c1cccs1 Amb18563780 [0,0,0,0,0,0|3,0,0]=3 284 B8R1.7 O=S(O)c1cccs1 Amb18063457 [0,0,0,0,0,0|3,0,0]=3 285 B8R1.7 O=S([O-])c1ccco1 Amb32754730 [0,0,0,0,0,0|3,1,0]=4 286 B8R1.7 O=S([O-])c1cccs1 Amb19944454 [0,0,0,0,0,0|3,0,0]=3 287 B8R1.7 O=S([O-])c1ccns1 Amb32755692 [0,0,0,0,0,0|4,0,0]=4 288 B8R1.7 O=S([O-])c1cncs1 Amb32755180 [0,0,0,0,0,0|4,0,0]=4 289 B8R1.7 O=S([O-])c1cscn1 Amb32754966 [0,0,0,0,0,0|4,0,0]=4 290 B8R1.7 O=S([O-])c1nccs1 Amb32755078 [0,0,0,0,0,0|2,0,0]=2 291 B8R1.7 O=[N+]([O-])c1ccco1 Amb10573954 [0,0,0,0,0,0|3,1,0]=4 292 B8R1.7 O=[N+]([O-])c1cccs1 Amb1208024 [0,0,0,0,0,0|3,0,0]=3 293 B8R1.7 O=[N+]([O-])c1cncs1 Amb10070705 [0,0,0,0,0,0|4,0,0]=4 294 B8R1.7 O=[N+]([O-])c1cocn1 Amb27798946 [0,0,0,0,0,0|4,0,0]=4 295 B8R1.7 O=[N+]([O-])c1cscn1 Amb28190783 [0,0,0,0,0,0|4,0,0]=4 296 B8R1.7 O=[N+]([O-])c1ncco1 Amb27438667 [0,0,0,0,0,0|2,1,0]=3 297 B8R1.7 O=[N+]([O-])c1nccs1 Amb10573893 [0,0,0,0,0,0|2,0,0]=2 298 B8R1.7 O=[N+]([O-])c1nnco1 Amb22551856 [0,0,0,0,0,0|3,1,0]=4 299 B8R1.7 O=[N+]([O-])n1cccn1 Amb2610536 [0,0,0,0,0,0|4,0,0]=4 300 B8R1.7 OB(O)c1cccs1 Amb2720322 [0,0,0,0,0,0|3,0,1]=4 301 B8R1.7 OB(O)c1nccs1 Amb8010553 [0,0,0,0,0,0|2,0,1]=3 302 B8R1.7 OB(O)c1nncs1 Amb24396453 [0,0,0,0,0,0|3,0,1]=4 303 B7R1.1 BrC=C1C=CC=C1 Amb28118986 [1,0,0,0,0,0|3,0,0]=4 304 B7R1.1 BrCc1cccs1 Amb10602501 [1,0,0,0,0,0|2,0,1]=4 305 B7R1.1 BrCc1nccs1 Amb10602038 [1,0,0,0,0,0|1,0,1]=3 306 B7R1.1 BrCc1nccs1 Amb21857626 [1,0,0,0,0,0|1,0,1]=3 307 B7R1.1 BrCc1nncs1 Amb24065108 [1,0,0,0,0,0|2,0,1]=4 308 B7R1.1 Br[Zn]c1cccs1 Amb6300113 [1,0,0,0,0,0|3,0,0]=4 309 B7R1.1 Br[Zn]c1nccs1 Amb22000385 [1,0,0,0,0,0|2,0,0]=3 310 B7R1.1 C#Cc1cccs1 Amb2721505 [1,0,0,0,0,0|1,0,2]=4 311 B7R1.1 C#Cc1nccs1 Amb22170067 [1,0,0,0,0,0|0,0,2]=3 312 B7R1.1 C#Cc1nncs1 Amb33168940 [1,0,0,0,0,0|1,0,2]=4 313 B7R1.1 C=Cc1ccco1 Amb22295842 [1,0,0,0,0,0|1,1,1]=4 314 B7R1.1 C=Cc1cccs1 Amb33542804 [1,0,0,0,0,0|1,0,1]=3 315 B7R1.1 C=Cc1ccns1 Amb26936370 [1,0,0,0,0,0|2,0,1]=4 316 B7R1.1 C=Cc1ccon1 Amb33197567 [1,0,0,0,0,0|2,0,1]=4 317 B7R1.1 C=Cc1cncs1 Amb24395972 [1,0,0,0,0,0|2,0,1]=4 318 B7R1.1 C=Cc1nccs1 Amb24056329 [1,0,0,0,0,0|0,0,1]=2 319 B7R1.1 C=Cc1nncs1 Amb27806194 [1,0,0,0,0,0|1,0,1]=3 320 B7R1.1 C=Cn1cccn1 Amb24583489 [1,0,0,0,0,0|2,0,1]=4 321 B7R1.1 CCC1=NCCS1 Amb28141823 [1,0,0,0,0,0|0,0,3]=4 322 B7R1.1 CCC1NC=CS1 Amb27167609 [1,0,0,0,0,0|0,0,3]=4 323 B7R1.1 CCc1ccco1 Amb8393153 [1,0,0,0,0,0|1,1,1]=4 324 B7R1.1 CCc1cccs1 Amb2687955 [1,0,0,0,0,0|1,0,1]=3 325 B7R1.1 CCc1cncs1 Amb25663104 [1,0,0,0,0,0|2,0,1]=4 326 B7R1.1 CCc1cocn1 Amb25073231 [1,0,0,0,0,0|2,0,1]=4 327 B7R1.1 CCc1cscn1 Amb13884091 [1,0,0,0,0,0|2,0,1]=4 328 B7R1.1 CCc1ncco1 Amb17399786 [1,0,0,0,0,0|0,1,1]=3 329 B7R1.1 CCc1nccs1 Amb10601013 [1,0,0,0,0,0|0,0,1]=2 330 B7R1.1 CCc1nnco1 Amb2208686 [1,0,0,0,0,0|1,1,1]=4 331 B7R1.1 CCn1cccn1 Amb1934294 [1,0,0,0,0,0|2,0,1]=4 332 B7R1.1 CNC1=NCCS1 Amb10609697 [1,0,0,0,0,0|1,0,2]=4 333 B7R1.1 CNC1=NCCS1 Amb7762036 [1,0,0,0,0,0|1,0,2]=4 334 B7R1.1 CNc1ccon1 Amb18281002 [1,0,0,0,0,0|3,0,0]=4 335 B7R1.1 CNc1ccon1 Amb30584677 [1,0,0,0,0,0|3,0,0]=4 336 B7R1.1 CNc1ccsn1 Amb25063572 [1,0,0,0,0,0|3,0,0]=4 337 B7R1.1 CNc1cncs1 Amb22492450 [1,0,0,0,0,0|3,0,0]=4 338 B7R1.1 CNc1ncco1 Amb21856873 [1,0,0,0,0,0|1,1,0]=3 339 B7R1.1 CNc1nccs1 Amb6620126 [1,0,0,0,0,0|1,0,0]=2 340 B7R1.1 CNc1ncns1 Amb23412319 [1,0,0,0,0,0|2,0,0]=3 341 B7R1.1 CNc1nnco1 Amb24117942 [1,0,0,0,0,0|2,1,0]=4 342 B7R1.1 CNc1nncs1 Amb18276942 [1,0,0,0,0,0|2,0,0]=3 343 B7R1.1 CNc1nnns1 Amb2384440 [1,0,0,0,0,0|3,0,0]=4 344 B7R1.1 COC1=NCC=C1 Amb27877548 [1,0,0,0,0,0|2,0,1]=4 345 B7R1.1 COc1ccco1 Amb8513561 [1,0,0,0,0,0|2,1,0]=4 346 B7R1.1 COc1cccs1 Amb2689282 [1,0,0,0,0,0|2,0,0]=3 347 B7R1.1 COc1ccsn1 Amb23592267 [1,0,0,0,0,0|3,0,0]=4 348 B7R1.1 COc1cncs1 Amb28050388 [1,0,0,0,0,0|3,0,0]=4 349 B7R1.1 COc1cocn1 Amb27445542 [1,0,0,0,0,0|3,0,0]=4 350 B7R1.1 COc1nccs1 Amb2447656 [1,0,0,0,0,0|1,0,0]=2 351 B7R1.1 COc1nncs1 Amb19651018 [1,0,0,0,0,0|2,0,0]=3 352 B7R1.1 CSC1=NCCS1 Amb4037058 [1,0,0,0,0,0|1,0,2]=4 353 B7R1.1 CSC1=NCCS1 Amb6861322 [1,0,0,0,0,0|1,0,2]=4 354 B7R1.1 CSc1ccco1 Amb21961438 [1,0,0,0,0,0|2,1,0]=4 355 B7R1.1 CSc1cccs1 Amb2724421 [1,0,0,0,0,0|2,0,0]=3 356 B7R1.1 CSc1cncs1 Amb26647426 [1,0,0,0,0,0|3,0,0]=4 357 B7R1.1 CSc1ncco1 Amb21961333 [1,0,0,0,0,0|1,1,0]=3 358 B7R1.1 CSc1nccs1 Amb2689744 [1,0,0,0,0,0|1,0,0]=2 359 B7R1.1 C[SiH2]c1ccco1 Amb28368539 [1,0,0,0,0,0|1,2,0]=4 360 B7R1.1 ClCc1cccs1 Amb6717230 [1,0,0,0,0,0|2,0,1]=4 361 B7R1.1 ClCc1ncco1 Amb10602092 [1,0,0,0,0,0|1,1,1]=4 362 B7R1.1 ClCc1nccs1 Amb10603583 [1,0,0,0,0,0|1,0,1]=3 363 B7R1.1 ClCc1nccs1 Amb21857625 [1,0,0,0,0,0|1,0,1]=3 364 B7R1.1 ClCc1nncs1 Amb27452934 [1,0,0,0,0,0|2,0,1]=4 365 B7R1.1 ClSc1nccs1 Amb27962460 [1,0,0,0,0,0|2,0,0]=3 366 B7R1.1 Cl[SiH2]c1nccs1 Amb27482094 [1,0,0,0,0,0|1,1,0]=3 367 B7R1.1 FCc1cccs1 Amb26568225 [1,0,0,0,0,0|2,0,1]=4 368 B7R1.1 ICc1nccs1 Amb24641632 [1,0,0,0,0,0|1,0,1]=3 369 B7R1.1 N#Cc1cccs1 Amb1154392 [1,0,0,0,0,0|2,0,1]=4 370 B7R1.1 N#Cc1ncco1 Amb19889630 [1,0,0,0,0,0|1,1,1]=4 371 B7R1.1 N#Cc1nccs1 Amb19957521 [1,0,0,0,0,0|1,0,1]=3 372 B7R1.1 N#Cc1nncs1 Amb20620883 [1,0,0,0,0,0|2,0,1]=4 373 B7R1.1 NCc1cccs1 Amb20622043 [1,0,0,0,0,0|2,0,1]=4 374 B7R1.1 NCc1cccs1 Amb2720340 [1,0,0,0,0,0|2,0,1]=4 375 B7R1.1 NCc1ncco1 Amb19929809 [1,0,0,0,0,0|1,1,1]=4 376 B7R1.1 NCc1ncco1 Amb8009700 [1,0,0,0,0,0|1,1,1]=4 377 B7R1.1 NCc1nccs1 Amb17935776 [1,0,0,0,0,0|1,0,1]=3 378 B7R1.1 NCc1nccs1 Amb2684480 [1,0,0,0,0,0|1,0,1]=3 379 B7R1.1 NCc1nccs1 Amb5740479 [1,0,0,0,0,0|1,0,1]=3 380 B7R1.1 NCc1nncs1 Amb23439704 [1,0,0,0,0,0|2,0,1]=4 381 B7R1.1 NCc1nncs1 Amb30584679 [1,0,0,0,0,0|2,0,1]=4 382 B7R1.1 NNc1cccs1 Amb18203361 [1,0,0,0,0,0|3,0,0]=4 383 B7R1.1 NNc1ncco1 Amb18120860 [1,0,0,0,0,0|2,1,0]=4 384 B7R1.1 NNc1nccs1 Amb1120140 [1,0,0,0,0,0|2,0,0]=3 385 B7R1.1 NNc1nccs1 Amb22757179 [1,0,0,0,0,0|2,0,0]=3 386 B7R1.1 NNc1ncns1 Amb25354457 [1,0,0,0,0,0|3,0,0]=4 387 B7R1.1 NNc1ncns1 Amb33483290 [1,0,0,0,0,0|3,0,0]=4 388 B7R1.1 NNc1nncs1 Amb24116971 [1,0,0,0,0,0|3,0,0]=4 389 B7R1.1 NNc1nncs1 Amb32662718 [1,0,0,0,0,0|3,0,0]=4 390 B7R1.1 NNc1nncs1 Amb33483392 [1,0,0,0,0,0|3,0,0]=4 391 B7R1.1 N\C=C1\C=CC=N1 Amb27623643 [1,0,0,0,0,0|2,0,0]=3 392 B7R1.1 O=C=C1CC=CN1 Amb27851531 [1,0,0,0,0,0|1,0,2]=4 393 B7R1.1 O=C=C1NC=CN1 Amb27209383 [1,0,0,0,0,0|1,0,2]=4 394 B7R1.1 O=CC1=CC=CC1 Amb25799627 [1,0,0,0,0,0|2,0,0]=3 395 B7R1.1 O=CC1=NCCS1 Amb27799744 [1,0,0,0,0,0|0,0,2]=3 396 B7R1.1 O=CC1=NOCC1 Amb35788708 [1,0,0,0,0,0|2,0,1]=4 397 B7R1.1 O=CC1C=CC=C1 Amb27408563 [1,0,0,0,0,0|2,0,1]=4 398 B7R1.1 O=CC1CC=CC1 Amb18638871 [1,0,0,0,0,0|2,0,1]=4 399 B7R1.1 O=CN1CC=CC1 Amb27978047 [1,0,0,0,0,0|3,0,0]=4 400 B7R1.1 O=C[c-]1cccc1 Amb22168256 [1,0,0,0,0,0|2,0,1]=4 401 B7R1.1 O=C[c-]1cccc1 Amb33801815 [1,0,0,0,0,0|2,0,1]=4 402 B7R1.1 O=Cc1ccco1 Amb2720358 [1,0,0,0,0,0|1,1,0]=3 403 B7R1.1 O=Cc1cccs1 Amb2690601 [1,0,0,0,0,0|1,0,0]=2 404 B7R1.1 O=Cc1ccno1 Amb33546951 [1,0,0,0,0,0|2,1,0]=4 405 B7R1.1 O=Cc1ccns1 Amb8010934 [1,0,0,0,0,0|2,0,0]=3 406 B7R1.1 O=Cc1ccoc1 Amb2720357 [1,0,0,0,0,0|3,0,0]=4 407 B7R1.1 O=Cc1ccon1 Amb8009575 [1,0,0,0,0,0|2,0,0]=3 408 B7R1.1 O=Cc1ccsc1 Amb2720343 [1,0,0,0,0,0|3,0,0]=4 409 B7R1.1 O=Cc1ccsn1 Amb8010932 [1,0,0,0,0,0|2,0,0]=3 410 B7R1.1 O=Cc1cnco1 Amb8010823 [1,0,0,0,0,0|2,1,0]=4 411 B7R1.1 O=Cc1cncs1 Amb2455730 [1,0,0,0,0,0|2,0,0]=3 412 B7R1.1 O=Cc1cnns1 Amb8010940 [1,0,0,0,0,0|3,0,0]=4 413 B7R1.1 O=Cc1cnon1 Amb18199365 [1,0,0,0,0,0|3,0,0]=4 414 B7R1.1 O=Cc1cnsn1 Amb18641770 [1,0,0,0,0,0|3,0,0]=4 415 B7R1.1 O=Cc1cocn1 Amb8010935 [1,0,0,0,0,0|2,0,0]=3 416 B7R1.1 O=Cc1conn1 Amb8010942 [1,0,0,0,0,0|3,0,0]=4 417 B7R1.1 O=Cc1cscn1 Amb2455729 [1,0,0,0,0,0|2,0,0]=3 418 B7R1.1 O=Cc1csnn1 Amb2725899 [1,0,0,0,0,0|3,0,0]=4 419 B7R1.1 O=Cc1ncco1 Amb33544448 [1,0,0,0,0,0|0,1,0]=2 420 B7R1.1 O=Cc1nccs1 Amb2723140 [1,0,0,0,0,0|0,0,0]=1 421 B7R1.1 O=Cc1ncns1 Amb8010944 [1,0,0,0,0,0|1,0,0]=2 422 B7R1.1 O=Cc1ncon1 Amb8010947 [1,0,0,0,0,0|2,0,0]=3 423 B7R1.1 O=Cc1ncsn1 Amb8010945 [1,0,0,0,0,0|2,0,0]=3 424 B7R1.1 O=Cc1nnco1 Amb21856468 [1,0,0,0,0,0|1,1,0]=3 425 B7R1.1 O=Cc1nncs1 Amb8010937 [1,0,0,0,0,0|1,0,0]=2 426 B7R1.1 O=Cn1ccnn1 Amb27790038 [1,0,0,0,0,0|3,0,0]=4 427 B7R1.1 OCc1cccs1 Amb837506 [1,0,0,0,0,0|1,0,2]=4 428 B7R1.1 OCc1ncco1 Amb10071191 [1,0,0,0,0,0|0,1,2]=4 429 B7R1.1 OCc1nccs1 Amb2723142 [1,0,0,0,0,0|0,0,2]=3 430 B7R1.1 OCc1ncns1 Amb28071735 [1,0,0,0,0,0|1,0,2]=4 431 B7R1.1 OCc1nncs1 Amb23437041 [1,0,0,0,0,0|1,0,2]=4 432 B7R1.1 S=Cc1ccco1 Amb28368735 [1,0,0,0,0,0|1,2,0]=4 433 B7R1.1 S=Nc1nccs1 Amb27438253 [1,0,0,0,0,0|1,1,0]=3 434 B7R1.1 SCc1cccs1 Amb3428574 [1,0,0,0,0,0|1,1,1]=4 435 B7R1.1 SCc1nccs1 Amb25241320 [1,0,0,0,0,0|0,1,1]=3 436 B7R1.1 [C-]#[N+]c1ncco1 Amb33735207 [1,0,0,0,0,0|1,1,1]=4 437 B7R1.1 [C-]#[N+]c1nccs1 Amb25352023 [1,0,0,0,0,0|1,0,1]=3 438 B7R1.1 [C-]#[N+]c1nncs1 Amb33747253 [1,0,0,0,0,0|2,0,1]=4 439 B7R1.1 [N-]=[N+]=C1C=CC=N1 Amb27613195 [1,0,0,0,0,0|3,0,0]=4 440 B7R1.1 [N-]=[N+]=C1NC=CS1 Amb27613199 [1,0,0,0,0,0|2,0,1]=4 441 B9R1.11 C#CC(=O)c1ccco1 Amb27465291 [0,1,0,0,0,0|1,1,1]=4 442 B9R1.11 C#CC(=O)c1nccs1 Amb27600237 [0,1,0,0,0,0|0,0,1]=2 443 B9R1.11 C#CC(C)c1cccs1 Amb33169147 [0,1,0,0,0,0|2,0,1]=4 444 B9R1.11 C#CC(C)c1nccs1 Amb33310362 [0,1,0,0,0,0|1,0,1]=3 445 B9R1.11 C=C(C#N)c1cccs1 Amb17231891 [0,1,0,0,0,0|2,0,1]=4 446 B9R1.11 C=C(CBr)c1ccco1 Amb33451440 [0,1,0,0,0,0|2,1,0]=4 447 B9R1.11 C=C(CBr)c1cccs1 Amb26024920 [0,1,0,0,0,0|2,0,0]=3 448 B9R1.11 C=C(CBr)c1ccon1 Amb33335572 [0,1,0,0,0,0|3,0,0]=4 449 B9R1.11 C=C(CBr)c1cncs1 Amb33006596 [0,1,0,0,0,0|3,0,0]=4 450 B9R1.11 C=C(CBr)c1cscn1 Amb33334791 [0,1,0,0,0,0|3,0,0]=4 451 B9R1.11 C=C(CBr)c1nccs1 Amb33386779 [0,1,0,0,0,0|1,0,0]=2 452 B9R1.11 C=C(CC)c1ccco1 Amb28119044 [0,1,0,0,0,0|2,1,0]=4 453 B9R1.11 C=C(CC)c1cccs1 Amb27494295 [0,1,0,0,0,0|2,0,0]=3 454 B9R1.11 C=C(CCl)c1ccco1 Amb28249972 [0,1,0,0,0,0|2,1,0]=4 455 B9R1.11 C=C(CCl)c1cccs1 Amb25349350 [0,1,0,0,0,0|2,0,0]=3 456 B9R1.11 C=C(CCl)c1ccon1 Amb33413486 [0,1,0,0,0,0|3,0,0]=4 457 B9R1.11 C=C(CCl)c1cncs1 Amb33057311 [0,1,0,0,0,0|3,0,0]=4 458 B9R1.11 C=C(CCl)c1nccs1 Amb33259197 [0,1,0,0,0,0|1,0,0]=2 459 B9R1.11 C=C(CN)c1ccco1 Amb26971270 [0,1,0,0,0,0|2,1,0]=4 460 B9R1.11 C=C(CN)c1cccs1 Amb18908327 [0,1,0,0,0,0|2,0,0]=3 461 B9R1.11 C=C(CN)c1ccon1 Amb33197560 [0,1,0,0,0,0|3,0,0]=4 462 B9R1.11 C=C(CN)c1cncs1 Amb33269111 [0,1,0,0,0,0|3,0,0]=4 463 B9R1.11 C=C(CN)c1cscn1 Amb33417852 [0,1,0,0,0,0|3,0,0]=4 464 B9R1.11 C=C(CN)c1nccs1 Amb33310377 [0,1,0,0,0,0|1,0,0]=2 465 B9R1.11 C=C(CO)c1cccs1 Amb27395559 [0,1,0,0,0,0|2,0,0]=3 466 B9R1.11 C=CC(=O)c1ccco1 Amb16232452 [0,1,0,0,0,0|1,1,1]=4 467 B9R1.11 C=CC(=O)c1cccs1 Amb18562033 [0,1,0,0,0,0|1,0,1]=3 468 B9R1.11 C=CC(=O)c1ccns1 Amb27449528 [0,1,0,0,0,0|2,0,1]=4 469 B9R1.11 C=CC(=O)c1ccon1 Amb26516072 [0,1,0,0,0,0|2,0,1]=4 470 B9R1.11 C=CC(=O)c1cncs1 Amb26641774 [0,1,0,0,0,0|2,0,1]=4 471 B9R1.11 C=CC(=O)c1cscn1 Amb25888952 [0,1,0,0,0,0|2,0,1]=4 472 B9R1.11 C=CC(=O)c1nccs1 Amb33313059 [0,1,0,0,0,0|0,0,1]=2 473 B9R1.11 C=CC(O)c1nccs1 Amb24481644 [0,1,0,0,0,0|0,0,3]=4 474 B9R1.11 CC(=[N+]=[N-])c1ccco1 Amb28368730 [0,1,0,0,0,0|2,1,0]=4 475 B9R1.11 CC(=[N+]=[N-])c1cccs1 Amb27246823 [0,1,0,0,0,0|2,0,0]=3 476 B9R1.11 CC(C#N)c1cccs1 Amb17089237 [0,1,0,0,0,0|2,0,1]=4 477 B9R1.11 CC(C#N)c1ncco1 Amb27792557 [0,1,0,0,0,0|1,1,1]=4 478 B9R1.11 CC(C#N)c1nccs1 Amb17506060 [0,1,0,0,0,0|1,0,1]=3 479 B9R1.11 CC(C=O)c1ccco1 Amb18642174 [0,1,0,0,0,0|1,1,1]=4 480 B9R1.11 CC(C=O)c1cccs1 Amb17138391 [0,1,0,0,0,0|1,0,1]=3 481 B9R1.11 CC(C=O)c1ccon1 Amb33197568 [0,1,0,0,0,0|2,0,1]=4 482 B9R1.11 CC(C=O)c1cncs1 Amb33269136 [0,1,0,0,0,0|2,0,1]=4 483 B9R1.11 CC(C=O)c1cscn1 Amb33417819 [0,1,0,0,0,0|2,0,1]=4 484 B9R1.11 CC(C=O)c1nccs1 Amb33474029 [0,1,0,0,0,0|0,0,1]=2 485 B9R1.11 CC(CBr)c1cccs1 Amb17238292 [0,1,0,0,0,0|2,0,1]=4 486 B9R1.11 CC(CBr)c1nccs1 Amb33386808 [0,1,0,0,0,0|1,0,1]=3 487 B9R1.11 CC(CCl)c1cccs1 Amb17232346 [0,1,0,0,0,0|2,0,1]=4 488 B9R1.11 CC(CN)c1cccs1 Amb4056911 [0,1,0,0,0,0|2,0,1]=4 489 B9R1.11 CC(CN)c1nccs1 Amb5740844 [0,1,0,0,0,0|1,0,1]=3 490 B9R1.11 CC(CO)=C1C=CC=C1 Amb27981717 [0,1,0,0,0,0|2,0,1]=4 491 B9R1.11 CC(CO)c1cccs1 Amb17231948 [0,1,0,0,0,0|1,0,2]=4 492 B9R1.11 CC(NO)c1cccs1 Amb10606933 [0,1,0,0,0,0|1,0,2]=4 493 B9R1.11 CC(NO)c1nccs1 Amb27606913 [0,1,0,0,0,0|0,0,2]=3 494 B9R1.11 CC(ON)c1cccs1 Amb17089184 [0,1,0,0,0,0|1,0,2]=4 495 B9R1.11 CC(ON)c1nccs1 Amb33311516 [0,1,0,0,0,0|0,0,2]=3 496 B9R1.11 CCC(=O)C1=NCCS1 Amb22227614 [0,1,0,0,0,0|0,0,2]=3 497 B9R1.11 CCC(=O)N1CC=CC1 Amb24340134 [0,1,0,0,0,0|3,0,0]=4 498 B9R1.11 CCC(=O)c1ccco1 Amb844124 [0,1,0,0,0,0|1,1,0]=3 499 B9R1.11 CCC(=O)c1cccs1 Amb2690591 [0,1,0,0,0,0|1,0,0]=2 500 B9R1.11 CCC(=O)c1ccoc1 Amb27196907 [0,1,0,0,0,0|3,0,0]=4 501 B9R1.11 CCC(=O)c1ccsc1 Amb6298062 [0,1,0,0,0,0|3,0,0]=4 502 B9R1.11 CCC(=O)c1cnco1 Amb33328540 [0,1,0,0,0,0|2,1,0]=4 503 B9R1.11 CCC(=O)c1cnns1 Amb28457829 [0,1,0,0,0,0|3,0,0]=4 504 B9R1.11 CCC(=O)c1cscn1 Amb24384180 [0,1,0,0,0,0|2,0,0]=3 505 B9R1.11 CCC(=O)c1nccs1 Amb2592102 [0,1,0,0,0,0|0,0,0]=1 506 B9R1.11 CCC(Br)c1nccs1 Amb27450759 [0,1,0,0,0,0|1,0,1]=3 507 B9R1.11 CCC(Cl)c1cccs1 Amb17138515 [0,1,0,0,0,0|2,0,1]=4 508 B9R1.11 CCC(N)c1cccs1 Amb10609665 [0,1,0,0,0,0|2,0,1]=4 509 B9R1.11 CCC(N)c1cccs1 Amb9703567 [0,1,0,0,0,0|2,0,1]=4 510 B9R1.11 CCC(N)c1nccs1 Amb21959387 [0,1,0,0,0,0|1,0,1]=3 511 B9R1.11 CCC(N)c1nccs1 Amb2592279 [0,1,0,0,0,0|1,0,1]=3 512 B9R1.11 CCC(O)c1cccs1 Amb9358389 [0,1,0,0,0,0|1,0,2]=4 513 B9R1.11 CCC(O)c1nccs1 Amb19649356 [0,1,0,0,0,0|0,0,2]=3 514 B9R1.11 CCC(S)c1cccs1 Amb18787791 [0,1,0,0,0,0|1,1,1]=4 515 B9R1.11 CCS(=O)c1cccs1 Amb27590898 [0,1,0,0,0,0|2,0,0]=3 516 B9R1.11 CCS(=O)c1nccs1 Amb28454974 [0,1,0,0,0,0|1,0,0]=2 517 B9R1.11 CC[C@@H](N)c1cccs1 Amb24666373 [0,1,0,0,0,0|2,0,1]=4 518 B9R1.11 CC[C@@H](N)c1cccs1 Amb33204429 [0,1,0,0,0,0|2,0,1]=4 519 B9R1.11 CC[C@@H](N)c1nccs1 Amb27444790 [0,1,0,0,0,0|1,0,1]=3 520 B9R1.11 CC[C@H](N)c1cccs1 Amb26407222 [0,1,0,0,0,0|2,0,1]=4 521 B9R1.11 CC[C@H](N)c1cccs1 Amb33313563 [0,1,0,0,0,0|2,0,1]=4 522 B9R1.11 CC[C@H](O)c1cccs1 Amb27837491 [0,1,0,0,0,0|1,0,2]=4 523 B9R1.11 CN(C#N)c1nccs1 Amb27623385 [0,1,0,0,0,0|2,0,0]=3 524 B9R1.11 CNC(=O)C1=NCCN1 Amb28122247 [0,1,0,0,0,0|1,0,2]=4 525 B9R1.11 CNC(=O)C1CC=CC1 Amb28292101 [0,1,0,0,0,0|2,0,1]=4 526 B9R1.11 CNC(=O)c1ccco1 Amb2612183 [0,1,0,0,0,0|1,1,0]=3 527 B9R1.11 CNC(=O)c1cccs1 Amb2612184 [0,1,0,0,0,0|1,0,0]=2 528 B9R1.11 CNC(=O)c1ccsc1 Amb2612185 [0,1,0,0,0,0|3,0,0]=4 529 B9R1.11 CNC(=O)c1cnns1 Amb27259378 [0,1,0,0,0,0|3,0,0]=4 530 B9R1.11 CNC(=O)c1cocn1 Amb27661402 [0,1,0,0,0,0|2,0,0]=3 531 B9R1.11 CNC(C)c1cccs1 Amb1799863 [0,1,0,0,0,0|2,0,1]=4 532 B9R1.11 CNC(C)c1cccs1 Amb6344854 [0,1,0,0,0,0|2,0,1]=4 533 B9R1.11 CNC(C)c1nccs1 Amb18282541 [0,1,0,0,0,0|1,0,1]=3 534 B9R1.11 CNC(O)c1cccs1 Amb27637082 [0,1,0,0,0,0|1,0,2]=4 535 B9R1.11 CN[C@@H](C)c1nccs1 Amb28428458 [0,1,0,0,0,0|1,0,1]=3 536 B9R1.11 COC(=N)c1cccs1 Amb17621680 [0,1,0,0,0,0|2,0,0]=3 537 B9R1.11 COC(=N)c1ccns1 Amb35719608 [0,1,0,0,0,0|3,0,0]=4 538 B9R1.11 COC(=N)c1cscn1 Amb25888953 [0,1,0,0,0,0|3,0,0]=4 539 B9R1.11 COC(=N)c1nccs1 Amb28252493 [0,1,0,0,0,0|1,0,0]=2 540 B9R1.11 COC(=O)C1=NCCC1 Amb21964254 [0,1,0,0,0,0|1,0,2]=4 541 B9R1.11 COC(=O)C1=NOCC1 Amb25831584 [0,1,0,0,0,0|2,0,1]=4 542 B9R1.11 COC(=O)C1CC=CC1 Amb2695401 [0,1,0,0,0,0|2,0,1]=4 543 B9R1.11 COC(=O)C1CCC=N1 Amb25106874 [0,1,0,0,0,0|1,0,2]=4 544 B9R1.11 COC(=O)C1CNC=N1 Amb20668156 [0,1,0,0,0,0|2,0,1]=4 545 B9R1.11 COC(=O)N1CC=CC1 Amb2612456 [0,1,0,0,0,0|3,0,0]=4 546 B9R1.11 COC(=O)[C@@H]1CCC=N1 Amb27249637 [0,1,0,0,0,0|1,0,2]=4 547 B9R1.11 COC(=O)[C@@H]1CSC=N1 Amb28286149 [0,1,0,0,0,0|2,0,1]=4 548 B9R1.11 COC(=O)[SH]1CC=CC1 Amb26566886 [0,1,0,0,0,0|3,0,0]=4 549 B9R1.11 COC(=O)c1ccco1 Amb4302709 [0,1,0,0,0,0|1,1,0]=3 550 B9R1.11 COC(=O)c1cccs1 Amb1911537 [0,1,0,0,0,0|1,0,0]=2 551 B9R1.11 COC(=O)c1ccno1 Amb4450531 [0,1,0,0,0,0|2,1,0]=4 552 B9R1.11 COC(=O)c1ccns1 Amb13883507 [0,1,0,0,0,0|2,0,0]=3 553 B9R1.11 COC(=O)c1ccoc1 Amb33531546 [0,1,0,0,0,0|3,0,0]=4 554 B9R1.11 COC(=O)c1ccsc1 Amb9245220 [0,1,0,0,0,0|3,0,0]=4 555 B9R1.11 COC(=O)c1cnco1 Amb21520455 [0,1,0,0,0,0|2,1,0]=4 556 B9R1.11 COC(=O)c1cncs1 Amb2455728 [0,1,0,0,0,0|2,0,0]=3 557 B9R1.11 COC(=O)c1cnns1 Amb26848874 [0,1,0,0,0,0|3,0,0]=4 558 B9R1.11 COC(=O)c1cnsn1 Amb25338228 [0,1,0,0,0,0|3,0,0]=4 559 B9R1.11 COC(=O)c1cocn1 Amb21857674 [0,1,0,0,0,0|2,0,0]=3 560 B9R1.11 COC(=O)c1cscn1 Amb10067320 [0,1,0,0,0,0|2,0,0]=3 561 B9R1.11 COC(=O)c1csnn1 Amb2384311 [0,1,0,0,0,0|3,0,0]=4 562 B9R1.11 COC(=O)c1ncco1 Amb22001762 [0,1,0,0,0,0|0,1,0]=2 563 B9R1.11 COC(=O)c1nccs1 Amb10807389 [0,1,0,0,0,0|0,0,0]=1 564 B9R1.11 COC(=O)c1ncon1 Amb22741278 [0,1,0,0,0,0|2,0,0]=3 565 B9R1.11 COC(=O)c1nnco1 Amb24425959 [0,1,0,0,0,0|1,1,0]=3 566 B9R1.11 COC(=O)c1nncs1 Amb23437054 [0,1,0,0,0,0|1,0,0]=2 567 B9R1.11 COC(=O)n1cccc1 Amb4477192 [0,1,0,0,0,0|3,0,0]=4 568 B9R1.11 COC(=O)n1cccn1 Amb3373376 [0,1,0,0,0,0|2,0,0]=3 569 B9R1.11 COC(=O)n1ccnn1 Amb27974622 [0,1,0,0,0,0|3,0,0]=4 570 B9R1.11 COC(=O)n1nccn1 Amb24553832 [0,1,0,0,0,0|2,0,0]=3 571 B9R1.11 COC(=S)c1cccs1 Amb27782424 [0,1,0,0,0,0|1,1,0]=3 572 B9R1.11 CSC(=O)c1cscn1 Amb10070320 [0,1,0,0,0,0|2,0,0]=3 573 B9R1.11 C\C(=N/N)c1cccs1 Amb1152010 [0,1,0,0,0,0|2,0,0]=3 574 B9R1.11 C\C(=N/O)c1ccco1 Amb6739803 [0,1,0,0,0,0|1,1,1]=4 575 B9R1.11 C\C(=N/O)c1cccs1 Amb6355845 [0,1,0,0,0,0|1,0,1]=3 576 B9R1.11 C\C(=N/O)c1nccs1 Amb2433008 [0,1,0,0,0,0|0,0,1]=2 577 B9R1.11 C\C(=N\O)c1ccco1 Amb4018078 [0,1,0,0,0,0|1,1,1]=4 578 B9R1.11 C\C(=N\O)c1cccs1 Amb4020390 [0,1,0,0,0,0|1,0,1]=3 579 B9R1.11 C\C(=N\O)c1cscn1 Amb16186593 [0,1,0,0,0,0|2,0,1]=4 580 B9R1.11 C\C(=N\O)c1nccs1 Amb27854702 [0,1,0,0,0,0|0,0,1]=2 581 B9R1.11 C\N=C(/Cl)c1ccco1 Amb30585147 [0,1,0,0,0,0|2,1,0]=4 582 B9R1.11 C\N=C(\Cl)c1ccco1 Amb2371268 [0,1,0,0,0,0|2,1,0]=4 583 B9R1.11 C\N=C(\Cl)c1cccs1 Amb2371267 [0,1,0,0,0,0|2,0,0]=3 584 B9R1.11 Cl\C=C(\Cl)c1cccs1 Amb27965884 [0,1,0,0,0,0|2,0,1]=4 585 B9R1.11 N#CC(=O)c1ccco1 Amb17231835 [0,1,0,0,0,0|1,1,1]=4 586 B9R1.11 N#CC(=O)c1cccs1 Amb2779505 [0,1,0,0,0,0|1,0,1]=3 587 B9R1.11 N#C[C@@H](O)c1nccs1 Amb28315479 [0,1,0,0,0,0|0,0,3]=4 588 B9R1.11 N#C[C@H](O)c1nccs1 Amb28325025 [0,1,0,0,0,0|0,0,3]=4 589 B9R1.11 N=C(NN)c1nccs1 Amb17593593 [0,1,0,0,0,0|2,0,0]=3 590 B9R1.11 N=C(NO)c1ncco1 Amb28051590 [0,1,0,0,0,0|1,1,1]=4 591 B9R1.11 N=C(NO)c1nccs1 Amb22372195 [0,1,0,0,0,0|1,0,1]=3 592 B9R1.11 NC(=S=O)c1cscn1 Amb27758659 [0,1,0,0,0,0|3,0,0]=4 593 B9R1.11 NC(CF)c1cccs1 Amb27832587 [0,1,0,0,0,0|2,0,1]=4 594 B9R1.11 NC(CO)c1cccs1 Amb17231970 [0,1,0,0,0,0|2,0,1]=4 595 B9R1.11 NC(CO)c1cccs1 Amb31028985 [0,1,0,0,0,0|2,0,1]=4 596 B9R1.11 NC(CO)c1ncco1 Amb32796178 [0,1,0,0,0,0|1,1,1]=4 597 B9R1.11 NC(CO)c1nccs1 Amb25188940 [0,1,0,0,0,0|1,0,1]=3 598 B9R1.11 NCC(=O)N1CC=CC1 Amb24629143 [0,1,0,0,0,0|3,0,0]=4 599 B9R1.11 NCC(=O)N1CC=CC1 Amb33328907 [0,1,0,0,0,0|3,0,0]=4 600 B9R1.11 NCC(=O)c1ccco1 Amb18642269 [0,1,0,0,0,0|1,1,0]=3 601 B9R1.11 NCC(=O)c1ccco1 Amb19373982 [0,1,0,0,0,0|1,1,0]=3 602 B9R1.11 NCC(=O)c1cccs1 Amb1286169 [0,1,0,0,0,0|1,0,0]=2 603 B9R1.11 NCC(=O)c1cccs1 Amb5739529 [0,1,0,0,0,0|1,0,0]=2 604 B9R1.11 NCC(=O)c1ccns1 Amb25957124 [0,1,0,0,0,0|2,0,0]=3 605 B9R1.11 NCC(=O)c1ccoc1 Amb18642270 [0,1,0,0,0,0|3,0,0]=4 606 B9R1.11 NCC(=O)c1ccon1 Amb18832769 [0,1,0,0,0,0|2,0,0]=3 607 B9R1.11 NCC(=O)c1ccsc1 Amb18643742 [0,1,0,0,0,0|3,0,0]=4 608 B9R1.11 NCC(=O)c1ccsn1 Amb24471992 [0,1,0,0,0,0|2,0,0]=3 609 B9R1.11 NCC(=O)c1cnco1 Amb18832770 [0,1,0,0,0,0|2,1,0]=4 610 B9R1.11 NCC(=O)c1cncs1 Amb18831640 [0,1,0,0,0,0|2,0,0]=3 611 B9R1.11 NCC(=O)c1cncs1 Amb30585216 [0,1,0,0,0,0|2,0,0]=3 612 B9R1.11 NCC(=O)c1cncs1 Amb32683464 [0,1,0,0,0,0|2,0,0]=3 613 B9R1.11 NCC(=O)c1cscn1 Amb18831641 [0,1,0,0,0,0|2,0,0]=3 614 B9R1.11 NCC(=O)c1csnn1 Amb33321966 [0,1,0,0,0,0|3,0,0]=4 615 B9R1.11 NCC(=O)c1nccs1 Amb18831642 [0,1,0,0,0,0|0,0,0]=1 616 B9R1.11 NCC(F)c1cccs1 Amb25842892 [0,1,0,0,0,0|2,0,1]=4 617 B9R1.11 NCC(F)c1nccs1 Amb33313062 [0,1,0,0,0,0|1,0,1]=3 618 B9R1.11 NCC(O)c1cccs1 Amb9703659 [0,1,0,0,0,0|1,0,2]=4 619 B9R1.11 NCC(O)c1nccs1 Amb8009869 [0,1,0,0,0,0|0,0,2]=3 620 B9R1.11 NC[C@@H](O)c1cccs1 Amb25804883 [0,1,0,0,0,0|1,0,2]=4 621 B9R1.11 NC[C@@H](O)c1nccs1 Amb25889803 [0,1,0,0,0,0|0,0,2]=3 622 B9R1.11 NC[C@H](N)c1cccs1 Amb27800048 [0,1,0,0,0,0|2,0,1]=4 623 B9R1.11 NC[C@H](O)c1cccs1 Amb26419255 [0,1,0,0,0,0|1,0,2]=4 624 B9R1.11 NC[C@H](O)c1nccs1 Amb26875706 [0,1,0,0,0,0|0,0,2]=3 625 B9R1.11 NNC(=O)c1ccco1 Amb6364758 [0,1,0,0,0,0|2,1,0]=4 626 B9R1.11 NNC(=O)c1cccs1 Amb33038267 [0,1,0,0,0,0|2,0,0]=3 627 B9R1.11 NNC(=O)c1cccs1 Amb6355875 [0,1,0,0,0,0|2,0,0]=3 628 B9R1.11 NNC(=O)c1ccns1 Amb27852001 [0,1,0,0,0,0|3,0,0]=4 629 B9R1.11 NNC(=O)c1ccon1 Amb20622665 [0,1,0,0,0,0|3,0,0]=4 630 B9R1.11 NNC(=O)c1cncs1 Amb4413256 [0,1,0,0,0,0|3,0,0]=4 631 B9R1.11 NNC(=O)c1cocn1 Amb13890531 [0,1,0,0,0,0|3,0,0]=4 632 B9R1.11 NNC(=O)c1cscn1 Amb1786304 [0,1,0,0,0,0|3,0,0]=4 633 B9R1.11 NNC(=O)c1nccs1 Amb22490247 [0,1,0,0,0,0|1,0,0]=2 634 B9R1.11 NNC(=O)c1ncns1 Amb27598621 [0,1,0,0,0,0|2,0,0]=3 635 B9R1.11 NNC(=O)c1ncon1 Amb16231306 [0,1,0,0,0,0|3,0,0]=4 636 B9R1.11 NNC(=O)c1nncs1 Amb23535960 [0,1,0,0,0,0|2,0,0]=3 637 B9R1.11 N[C@@H](CO)c1cccs1 Amb26057259 [0,1,0,0,0,0|2,0,1]=4 638 B9R1.11 N[C@@H](CO)c1nccs1 Amb25224968 [0,1,0,0,0,0|1,0,1]=3 639 B9R1.11 N[C@H](CO)C1=NC=CC1 Amb27624411 [0,1,0,0,0,0|2,0,1]=4 640 B9R1.11 N[C@H](CO)c1cccs1 Amb25959092 [0,1,0,0,0,0|2,0,1]=4 641 B9R1.11 N[C@H](CO)c1nccs1 Amb24727007 [0,1,0,0,0,0|1,0,1]=3 642 B9R1.11 N\C(=N/O)c1cccs1 Amb6384078 [0,1,0,0,0,0|2,0,1]=4 643 B9R1.11 N\C(=N\O)c1cccs1 Amb1106021 [0,1,0,0,0,0|2,0,1]=4 644 B9R1.11 N\N=C(\N)c1cccs1 Amb25250535 [0,1,0,0,0,0|3,0,0]=4 645 B9R1.11 O=C(CBr)c1ccco1 Amb2721798 [0,1,0,0,0,0|1,1,0]=3 646 B9R1.11 O=C(CBr)c1cccs1 Amb2720497 [0,1,0,0,0,0|1,0,0]=2 647 B9R1.11 O=C(CBr)c1ccon1 Amb23412312 [0,1,0,0,0,0|2,0,0]=3 648 B9R1.11 O=C(CBr)c1ccsc1 Amb2723197 [0,1,0,0,0,0|3,0,0]=4 649 B9R1.11 O=C(CBr)c1cncs1 Amb33870854 [0,1,0,0,0,0|2,0,0]=3 650 B9R1.11 O=C(CBr)c1cscn1 Amb22899135 [0,1,0,0,0,0|2,0,0]=3 651 B9R1.11 O=C(CBr)c1nccs1 Amb2723141 [0,1,0,0,0,0|0,0,0]=1 652 B9R1.11 O=C(CBr)c1nccs1 Amb6384160 [0,1,0,0,0,0|0,0,0]=1 653 B9R1.11 O=C(CBr)n1cccc1 Amb27244789 [0,1,0,0,0,0|3,0,0]=4 654 B9R1.11 O=C(CCl)N1CC=CC1 Amb28046772 [0,1,0,0,0,0|3,0,0]=4 655 B9R1.11 O=C(CCl)c1ccco1 Amb17138398 [0,1,0,0,0,0|1,1,0]=3 656 B9R1.11 O=C(CCl)c1cccs1 Amb2686490 [0,1,0,0,0,0|1,0,0]=2 657 B9R1.11 O=C(CCl)c1ccns1 Amb32664376 [0,1,0,0,0,0|2,0,0]=3 658 B9R1.11 O=C(CCl)c1ccoc1 Amb22395346 [0,1,0,0,0,0|3,0,0]=4 659 B9R1.11 O=C(CCl)c1ccon1 Amb24104110 [0,1,0,0,0,0|2,0,0]=3 660 B9R1.11 O=C(CCl)c1ccsc1 Amb25727715 [0,1,0,0,0,0|3,0,0]=4 661 B9R1.11 O=C(CCl)c1cnco1 Amb22011645 [0,1,0,0,0,0|2,1,0]=4 662 B9R1.11 O=C(CCl)c1cncs1 Amb24104081 [0,1,0,0,0,0|2,0,0]=3 663 B9R1.11 O=C(CCl)c1cnon1 Amb25244957 [0,1,0,0,0,0|3,0,0]=4 664 B9R1.11 O=C(CCl)c1cocn1 Amb22011648 [0,1,0,0,0,0|2,0,0]=3 665 B9R1.11 O=C(CCl)c1cscn1 Amb17506261 [0,1,0,0,0,0|2,0,0]=3 666 B9R1.11 O=C(CCl)c1csnn1 Amb26349240 [0,1,0,0,0,0|3,0,0]=4 667 B9R1.11 O=C(CCl)c1ncco1 Amb22904306 [0,1,0,0,0,0|0,1,0]=2 668 B9R1.11 O=C(CCl)c1nccs1 Amb24104111 [0,1,0,0,0,0|0,0,0]=1 669 B9R1.11 O=C(CF)c1cccs1 Amb21964939 [0,1,0,0,0,0|1,0,0]=2 670 B9R1.11 O=C(CI)c1cccs1 Amb28368856 [0,1,0,0,0,0|1,0,0]=2 671 B9R1.11 O=C(CI)c1ccoc1 Amb27647081 [0,1,0,0,0,0|3,0,0]=4 672 B9R1.11 O=C(CO)c1ccco1 Amb17689139 [0,1,0,0,0,0|1,1,0]=3 673 B9R1.11 O=C(CO)c1cccs1 Amb25742219 [0,1,0,0,0,0|1,0,0]=2 674 B9R1.11 O=C(CS)c1cccs1 Amb17400035 [0,1,0,0,0,0|1,0,0]=2 675 B9R1.11 O=C(NO)c1ccco1 Amb6270335 [0,1,0,0,0,0|2,1,0]=4 676 B9R1.11 O=C(NO)c1cccs1 Amb1151586 [0,1,0,0,0,0|2,0,0]=3 677 B9R1.11 O=C(NO)c1ccon1 Amb27856744 [0,1,0,0,0,0|3,0,0]=4 678 B9R1.11 O=C(NO)c1cncs1 Amb27494447 [0,1,0,0,0,0|3,0,0]=4 679 B9R1.11 O=C(NO)c1cocn1 Amb28318358 [0,1,0,0,0,0|3,0,0]=4 680 B9R1.11 O=C(NO)c1nccs1 Amb27837648 [0,1,0,0,0,0|1,0,0]=2 681 B9R1.11 O=C(N[O-])c1cccs1 Amb471648 [0,1,0,0,0,0|2,0,0]=3 682 B9R1.11 O=C(O[Cu])c1cccs1 Amb13890298 [0,1,0,0,0,0|2,0,0]=3 683 B9R1.11 O=C(O[Na])c1cccs1 Amb3150403 [0,1,0,0,0,0|2,0,0]=3 684 B9R1.11 O=CC(=O)c1ccco1 Amb17593264 [0,1,0,0,0,0|1,1,1]=4 685 B9R1.11 O=CC(=O)c1cccs1 Amb10067937 [0,1,0,0,0,0|1,0,1]=3 686 B9R1.11 O=CC(=O)c1cccs1 Amb10607111 [0,1,0,0,0,0|1,0,1]=3 687 B9R1.11 O=CC(Cl)c1cccs1 Amb27246769 [0,1,0,0,0,0|2,0,1]=4 688 B9R1.11 OC(CBr)c1cccs1 Amb17206127 [0,1,0,0,0,0|1,0,2]=4 689 B9R1.11 OC(CBr)c1nccs1 Amb26341820 [0,1,0,0,0,0|0,0,2]=3 690 B9R1.11 OC(CCl)c1cccs1 Amb17194470 [0,1,0,0,0,0|1,0,2]=4 691 B9R1.11 OC(CCl)c1nccs1 Amb24415239 [0,1,0,0,0,0|0,0,2]=3 692 B9R1.11 OC(CF)c1cccs1 Amb33360698 [0,1,0,0,0,0|1,0,2]=4 693 B9R1.11 OC(CF)c1nccs1 Amb33310380 [0,1,0,0,0,0|0,0,2]=3 694 B9R1.11 OCC(F)c1cccs1 Amb27441548 [0,1,0,0,0,0|2,0,1]=4 695 B9R1.11 OCC(O)c1cccs1 Amb18063817 [0,1,0,0,0,0|1,0,2]=4 696 B9R1.11 OCC(O)c1ncco1 Amb32796171 [0,1,0,0,0,0|0,1,2]=4 697 B9R1.11 OCC(O)c1nccs1 Amb27412511 [0,1,0,0,0,0|0,0,2]=3 698 B9R1.11 OC[C@H](O)c1cccs1 Amb27396199 [0,1,0,0,0,0|1,0,2]=4 699 B9R1.11 O[C@@H](CBr)c1cccs1 Amb27392821 [0,1,0,0,0,0|1,0,2]=4 700 B9R1.11 O[C@H](CBr)c1cccs1 Amb27875659 [0,1,0,0,0,0|1,0,2]=4 701 B9R1.11 O[C@H](CCl)c1cccs1 Amb27811547 [0,1,0,0,0,0|1,0,2]=4 702 B9R1.11 O[C@H](CCl)c1nccs1 Amb27403016 [0,1,0,0,0,0|0,0,2]=3 703 B9R1.11 O\N=C(\Cl)c1cccs1 Amb27864158 [0,1,0,0,0,0|2,0,1]=4 704 B9R1.11 [C-]#[N+]C(C)c1cccs1 Amb3973285 [0,1,0,0,0,0|2,0,1]=4 705 B9R1.11 [NH3+]CC(=O)c1cccs1 Amb17848802 [0,1,0,0,0,0|1,0,0]=2 706 B9R1.19 CC(C)(Br)c1ncco1 Amb27633445 [0,1,0,0,0,0|1,1,1]=4 707 B9R1.19 CC(C)(C)c1cccs1 Amb2793098 [0,1,0,0,0,0|2,0,1]=4 708 B9R1.19 CC(C)(C)c1ncco1 Amb17399802 [0,1,0,0,0,0|1,1,1]=4 709 B9R1.19 CC(C)(C)c1nccs1 Amb10601011 [0,1,0,0,0,0|1,0,1]=3 710 B9R1.19 CC(C)(C)c1nncs1 Amb26316077 [0,1,0,0,0,0|2,0,1]=4 711 B9R1.19 CC(C)(Cl)c1cccs1 Amb27193541 [0,1,0,0,0,0|2,0,1]=4 712 B9R1.19 CC(C)(N)c1cccs1 Amb17078777 [0,1,0,0,0,0|2,0,1]=4 713 B9R1.19 CC(C)(N)c1ncco1 Amb18832749 [0,1,0,0,0,0|1,1,1]=4 714 B9R1.19 CC(C)(N)c1nccs1 Amb17084615 [0,1,0,0,0,0|1,0,1]=3 715 B9R1.19 CC(C)(O)c1cccs1 Amb4314259 [0,1,0,0,0,0|1,0,2]=4 716 B9R1.19 CC(C)(O)c1nccs1 Amb4314261 [0,1,0,0,0,0|0,0,2]=3 717 B9R1.19 CS(=N)(=O)c1ccco1 Amb33338887 [0,1,0,0,0,0|2,1,0]=4 718 B9R1.19 CS(=O)(=O)c1ccco1 Amb27400164 [0,1,0,0,0,0|2,1,0]=4 719 B9R1.19 CS(=O)(=O)c1cccs1 Amb2611485 [0,1,0,0,0,0|2,0,0]=3 720 B9R1.19 CS(=O)(=O)c1nccs1 Amb27423788 [0,1,0,0,0,0|1,0,0]=2 721 B9R1.19 C[Si](C)(C)c1cccs1 Amb2690592 [0,1,0,0,0,0|2,1,0]=4 722 B9R1.19 C[Si](C)(C)c1ncco1 Amb25698102 [0,1,0,0,0,0|1,2,0]=4 723 B9R1.19 C[Si](C)(C)c1nccs1 Amb2447463 [0,1,0,0,0,0|1,1,0]=3 724 B9R1.19 C[Si](C)(Cl)c1cccs1 Amb20671358 [0,1,0,0,0,0|2,1,0]=4 725 B9R1.19 C[Si](C)(Cl)c1nccs1 Amb27770357 [0,1,0,0,0,0|1,1,0]=3 726 B9R1.19 C[Si](C)(F)c1cccs1 Amb27229179 [0,1,0,0,0,0|2,1,0]=4 727 B9R1.19 C[Si](C)(O)c1cccs1 Amb22167028 [0,1,0,0,0,0|1,1,1]=4 728 B9R1.19 C[Si](C)([O-])c1cccs1 Amb22167051 [0,1,0,0,0,0|1,1,1]=4 729 B9R1.19 C[Si](Cl)(Cl)c1cccs1 Amb27463504 [0,1,0,0,0,0|2,1,0]=4 730 B9R1.19 FC(F)(F)c1nccs1 Amb27159065 [0,1,0,0,0,0|2,0,1]=4 731 B9R1.19 F[B-](F)(F)c1nccs1 Amb26940257 [0,1,0,0,0,0|3,0,0]=4 732 B9R1.19 F[Si](F)(F)c1nccs1 Amb28248525 [0,1,0,0,0,0|2,1,0]=4 733 B9R1.19 NS(=O)(=O)c1cccs1 Amb1103388 [0,1,0,0,0,0|3,0,0]=4 734 B9R1.19 NS(=O)(=O)c1nccs1 Amb18183512 [0,1,0,0,0,0|2,0,0]=3 735 B9R1.19 O=S(=O)(Br)c1cccs1 Amb27208825 [0,1,0,0,0,0|3,0,0]=4 736 B9R1.19 O=S(=O)(Cl)c1cccs1 Amb1216878 [0,1,0,0,0,0|3,0,0]=4 737 B9R1.19 O=S(=O)(Cl)c1ncco1 Amb24117208 [0,1,0,0,0,0|2,1,0]=4 738 B9R1.19 O=S(=O)(Cl)c1nccs1 Amb17193910 [0,1,0,0,0,0|2,0,0]=3 739 B9R1.19 O=S(=O)(Cl)c1nncs1 Amb6628879 [0,1,0,0,0,0|3,0,0]=4 740 B9R1.19 O=S(=O)(F)c1cccs1 Amb18520967 [0,1,0,0,0,0|3,0,0]=4 741 B9R1.19 O=S(=O)(F)c1ncco1 Amb28252096 [0,1,0,0,0,0|2,1,0]=4 742 B9R1.19 O=S(=O)(F)c1nccs1 Amb2455977 [0,1,0,0,0,0|2,0,0]=3 743 B9R1.19 O=S(=O)(O)c1cccs1 Amb17672954 [0,1,0,0,0,0|3,0,0]=4 744 B9R1.35 C=C(C)C1=NCC(=O)O1 Amb27770419 [0,1,0,0,0,0|1,1,1]=4 745 B9R1.35 C=C(C)c1cc(Br)cs1 Amb28207792 [0,1,0,0,0,0|2,0,0]=3 746 B9R1.35 C=C(C)c1cc(C)cs1 Amb28436270 [0,1,0,0,0,0|2,0,0]=3 747 B9R1.35 C=C(C)c1cc(N)on1 Amb33199163 [0,1,0,0,0,0|3,0,0]=4 748 B9R1.35 C=C(C)c1csc(N)n1 Amb27655096 [0,1,0,0,0,0|3,0,0]=4 749 B9R1.35 C=C(C)c1nc(Br)cs1 Amb20617324 [0,1,0,0,0,0|1,0,0]=2 750 B9R1.35 C=C(C)c1ncc(Br)s1 Amb20617325 [0,1,0,0,0,0|1,0,0]=2 751 B9R1.35 C=C(C)c1nnc(N)s1 Amb28249782 [0,1,0,0,0,0|2,0,0]=3 752 B9R1.35 C=C(C)n1ccc(N)n1 Amb28184989 [0,1,0,0,0,0|3,0,0]=4 753 B9R1.35 CC(=O)C1=CC(=O)NO1 Amb27636423 [0,1,0,0,0,0|2,1,0]=4 754 B9R1.35 CC(=O)C1=CCC(=S)O1 Amb27261937 [0,1,0,0,0,0|1,1,1]=4 755 B9R1.35 CC(=O)C1=CSC(=S)N1 Amb25227392 [0,1,0,0,0,0|2,0,1]=4 756 B9R1.35 CC(=O)C1=NC(=O)CS1 Amb29850784 [0,1,0,0,0,0|0,0,1]=2 757 B9R1.35 CC(=O)C1CC=C(C)C1 Amb26910073 [0,1,0,0,0,0|2,0,1]=4 758 B9R1.35 CC(=O)N1C=CC(=O)N1 Amb24481715 [0,1,0,0,0,0|2,0,1]=4 759 B9R1.35 CC(=O)N1CSC(N)=N1 Amb25790048 [0,1,0,0,0,0|3,0,0]=4 760 B9R1.35 CC(=O)c1cc(Br)cs1 Amb1946493 [0,1,0,0,0,0|1,0,0]=2 761 B9R1.35 CC(=O)c1cc(Br)no1 Amb18190978 [0,1,0,0,0,0|2,1,0]=4 762 B9R1.35 CC(=O)c1cc(C)cs1 Amb3941162 [0,1,0,0,0,0|1,0,0]=2 763 B9R1.35 CC(=O)c1cc(C)no1 Amb18672024 [0,1,0,0,0,0|2,1,0]=4 764 B9R1.35 CC(=O)c1cc(C)ns1 Amb18831719 [0,1,0,0,0,0|2,0,0]=3 765 B9R1.35 CC(=O)c1cc(C)on1 Amb21964495 [0,1,0,0,0,0|2,0,0]=3 766 B9R1.35 CC(=O)c1cc(C)sn1 Amb18831706 [0,1,0,0,0,0|2,0,0]=3 767 B9R1.35 CC(=O)c1cc(Cl)cs1 Amb8396574 [0,1,0,0,0,0|1,0,0]=2 768 B9R1.35 CC(=O)c1cc(Cl)on1 Amb27777474 [0,1,0,0,0,0|2,0,0]=3 769 B9R1.35 CC(=O)c1cc(F)cs1 Amb18831508 [0,1,0,0,0,0|1,0,0]=2 770 B9R1.35 CC(=O)c1cc(I)cs1 Amb22751276 [0,1,0,0,0,0|1,0,0]=2 771 B9R1.35 CC(=O)c1cc(N)cs1 Amb18678229 [0,1,0,0,0,0|1,0,0]=2 772 B9R1.35 CC(=O)c1cc(N)no1 Amb18832777 [0,1,0,0,0,0|2,1,0]=4 773 B9R1.35 CC(=O)c1cc(N)on1 Amb27970954 [0,1,0,0,0,0|2,0,0]=3 774 B9R1.35 CC(=O)c1ccc(Br)[se]1 Amb2611508 [0,1,0,0,0,0|1,1,0]=3 775 B9R1.35 CC(=O)c1ccc(Br)o1 Amb18678443 [0,1,0,0,0,0|1,1,0]=3 776 B9R1.35 CC(=O)c1ccc(Br)s1 Amb1151096 [0,1,0,0,0,0|1,0,0]=2 777 B9R1.35 CC(=O)c1ccc(C)o1 Amb1154368 [0,1,0,0,0,0|1,1,0]=3 778 B9R1.35 CC(=O)c1ccc(C)s1 Amb1153736 [0,1,0,0,0,0|1,0,0]=2 779 B9R1.35 CC(=O)c1ccc(Cl)s1 Amb1148733 [0,1,0,0,0,0|1,0,0]=2 780 B9R1.35 CC(=O)c1ccc(F)s1 Amb18831509 [0,1,0,0,0,0|1,0,0]=2 781 B9R1.35 CC(=O)c1ccc(I)s1 Amb19886673 [0,1,0,0,0,0|1,0,0]=2 782 B9R1.35 CC(=O)c1ccc(N)o1 Amb18642262 [0,1,0,0,0,0|1,1,0]=3 783 B9R1.35 CC(=O)c1ccc(N)s1 Amb17477841 [0,1,0,0,0,0|1,0,0]=2 784 B9R1.35 CC(=O)c1ccc(O)s1 Amb34135974 [0,1,0,0,0,0|1,0,0]=2 785 B9R1.35 CC(=O)c1ccc(S)s1 Amb25706073 [0,1,0,0,0,0|1,0,0]=2 786 B9R1.35 CC(=O)c1ccn(C)c1 Amb3940523 [0,1,0,0,0,0|3,0,0]=4 787 B9R1.35 CC(=O)c1ccn(C)n1 Amb33544400 [0,1,0,0,0,0|2,0,0]=3 788 B9R1.35 CC(=O)c1cn(C)cn1 Amb23399836 [0,1,0,0,0,0|2,0,0]=3 789 B9R1.35 CC(=O)c1cn(C)nn1 Amb24529113 [0,1,0,0,0,0|3,0,0]=4 790 B9R1.35 CC(=O)c1cn(N)cn1 Amb27768777 [0,1,0,0,0,0|2,0,0]=3 791 B9R1.35 CC(=O)c1cnc(Br)o1 Amb26391439 [0,1,0,0,0,0|2,1,0]=4 792 B9R1.35 CC(=O)c1cnc(Br)s1 Amb18176255 [0,1,0,0,0,0|2,0,0]=3 793 B9R1.35 CC(=O)c1cnc(C)o1 Amb23437343 [0,1,0,0,0,0|2,1,0]=4 794 B9R1.35 CC(=O)c1cnc(C)s1 Amb19882144 [0,1,0,0,0,0|2,0,0]=3 795 B9R1.35 CC(=O)c1cnc(Cl)o1 Amb27246755 [0,1,0,0,0,0|2,1,0]=4 796 B9R1.35 CC(=O)c1cnc(Cl)s1 Amb25202568 [0,1,0,0,0,0|2,0,0]=3 797 B9R1.35 CC(=O)c1cnc(N)o1 Amb17231842 [0,1,0,0,0,0|2,1,0]=4 798 B9R1.35 CC(=O)c1cnc(N)s1 Amb10605732 [0,1,0,0,0,0|2,0,0]=3 799 B9R1.35 CC(=O)c1cnc(N)s1 Amb19515342 [0,1,0,0,0,0|2,0,0]=3 800 B9R1.35 CC(=O)c1cnc(N)s1 Amb33465501 [0,1,0,0,0,0|2,0,0]=3 801 B9R1.35 CC(=O)c1cnc(O)s1 Amb27838546 [0,1,0,0,0,0|2,0,0]=3 802 B9R1.35 CC(=O)c1cnc(S)s1 Amb19882270 [0,1,0,0,0,0|2,0,0]=3 803 B9R1.35 CC(=O)c1cnn(C)n1 Amb27187215 [0,1,0,0,0,0|3,0,0]=4 804 B9R1.35 CC(=O)c1coc(Br)c1 Amb27648127 [0,1,0,0,0,0|3,0,0]=4 805 B9R1.35 CC(=O)c1coc(C)n1 Amb18832850 [0,1,0,0,0,0|2,0,0]=3 806 B9R1.35 CC(=O)c1coc(Cl)c1 Amb26391385 [0,1,0,0,0,0|3,0,0]=4 807 B9R1.35 CC(=O)c1coc(Cl)n1 Amb25070464 [0,1,0,0,0,0|2,0,0]=3 808 B9R1.35 CC(=O)c1csc(Br)c1 Amb10603337 [0,1,0,0,0,0|3,0,0]=4 809 B9R1.35 CC(=O)c1csc(Br)n1 Amb25103826 [0,1,0,0,0,0|2,0,0]=3 810 B9R1.35 CC(=O)c1csc(C)c1 Amb22494674 [0,1,0,0,0,0|3,0,0]=4 811 B9R1.35 CC(=O)c1csc(C)n1 Amb20622917 [0,1,0,0,0,0|2,0,0]=3 812 B9R1.35 CC(=O)c1csc(C)n1 Amb493870 [0,1,0,0,0,0|2,0,0]=3 813 B9R1.35 CC(=O)c1csc(Cl)c1 Amb5719933 [0,1,0,0,0,0|3,0,0]=4 814 B9R1.35 CC(=O)c1csc(Cl)n1 Amb19944607 [0,1,0,0,0,0|2,0,0]=3 815 B9R1.35 CC(=O)c1csc(F)c1 Amb18202409 [0,1,0,0,0,0|3,0,0]=4 816 B9R1.35 CC(=O)c1csc(N)n1 Amb6355913 [0,1,0,0,0,0|2,0,0]=3 817 B9R1.35 CC(=O)c1nc(Br)cs1 Amb24321383 [0,1,0,0,0,0|0,0,0]=1 818 B9R1.35 CC(=O)c1nc(Br)no1 Amb18819017 [0,1,0,0,0,0|1,1,0]=3 819 B9R1.35 CC(=O)c1nc(C)co1 Amb21963773 [0,1,0,0,0,0|0,1,0]=2 820 B9R1.35 CC(=O)c1nc(C)cs1 Amb22347859 [0,1,0,0,0,0|0,0,0]=1 821 B9R1.35 CC(=O)c1nc(C)no1 Amb18138552 [0,1,0,0,0,0|1,1,0]=3 822 B9R1.35 CC(=O)c1nc(C)ns1 Amb18202587 [0,1,0,0,0,0|1,0,0]=2 823 B9R1.35 CC(=O)c1nc(Cl)ns1 Amb27795127 [0,1,0,0,0,0|1,0,0]=2 824 B9R1.35 CC(=O)c1nc(N)no1 Amb18203288 [0,1,0,0,0,0|1,1,0]=3 825 B9R1.35 CC(=O)c1ncc(Br)s1 Amb8394578 [0,1,0,0,0,0|0,0,0]=1 826 B9R1.35 CC(=O)c1ncc(C)o1 Amb18832862 [0,1,0,0,0,0|0,1,0]=2 827 B9R1.35 CC(=O)c1ncc(C)s1 Amb18831720 [0,1,0,0,0,0|0,0,0]=1 828 B9R1.35 CC(=O)c1ncc(Cl)s1 Amb8383444 [0,1,0,0,0,0|0,0,0]=1 829 B9R1.35 CC(=O)c1nnc(Br)o1 Amb18819022 [0,1,0,0,0,0|1,1,0]=3 830 B9R1.35 CC(=O)c1nnc(C)o1 Amb22898820 [0,1,0,0,0,0|1,1,0]=3 831 B9R1.35 CC(=O)c1nnc(Cl)o1 Amb27843721 [0,1,0,0,0,0|1,1,0]=3 832 B9R1.35 CC(=O)c1nnn(C)n1 Amb18832763 [0,1,0,0,0,0|3,0,0]=4 833 B9R1.35 CC(=O)c1noc(C)n1 Amb22756380 [0,1,0,0,0,0|2,0,0]=3 834 B9R1.35 CC(=O)c1noc(N)n1 Amb25887270 [0,1,0,0,0,0|2,0,0]=3 835 B9R1.35 CC(=O)c1nsc(N)n1 Amb28054655 [0,1,0,0,0,0|2,0,0]=3 836 B9R1.35 CC(=O)n1cc(F)cn1 Amb23400558 [0,1,0,0,0,0|2,0,0]=3 837 B9R1.35 CC(=O)n1cc(I)cn1 Amb15693384 [0,1,0,0,0,0|2,0,0]=3 838 B9R1.35 CC(=O)n1ccc(N)c1 Amb24482008 [0,1,0,0,0,0|3,0,0]=4 839 B9R1.35 CC(=O)n1cnc(C)n1 Amb20248268 [0,1,0,0,0,0|3,0,0]=4 840 B9R1.35 CC(=O)n1cnc(Cl)n1 Amb27185703 [0,1,0,0,0,0|3,0,0]=4 841 B9R1.35 CC(=O)n1nc(C)cp1 Amb27810842 [0,1,0,0,0,0|2,0,0]=3 842 B9R1.35 CC(=S)c1ccc(Cl)s1 Amb27847567 [0,1,0,0,0,0|1,1,0]=3 843 B9R1.35 CC(Br)c1ccc(Br)s1 Amb27837453 [0,1,0,0,0,0|2,0,1]=4 844 B9R1.35 CC(Br)c1nnc(N)s1 Amb17208881 [0,1,0,0,0,0|2,0,1]=4 845 B9R1.35 CC(C)=C1N=CC(=O)O1 Amb27843713 [0,1,0,0,0,0|1,1,0]=3 846 B9R1.35 CC(C)c1cc(Br)cs1 Amb18783656 [0,1,0,0,0,0|2,0,1]=4 847 B9R1.35 CC(C)c1ccc(Br)s1 Amb10600620 [0,1,0,0,0,0|2,0,1]=4 848 B9R1.35 CC(C)c1ccc(I)s1 Amb27445990 [0,1,0,0,0,0|2,0,1]=4 849 B9R1.35 CC(C)c1ccc(N)s1 Amb10600621 [0,1,0,0,0,0|2,0,1]=4 850 B9R1.35 CC(C)c1ccc(O)s1 Amb20617566 [0,1,0,0,0,0|2,0,1]=4 851 B9R1.35 CC(C)c1nc(Br)cs1 Amb2455675 [0,1,0,0,0,0|1,0,1]=3 852 B9R1.35 CC(C)c1nc(Br)ns1 Amb27466192 [0,1,0,0,0,0|2,0,1]=4 853 B9R1.35 CC(C)c1nc(Cl)ns1 Amb25259518 [0,1,0,0,0,0|2,0,1]=4 854 B9R1.35 CC(C)c1nc(N)cs1 Amb10599935 [0,1,0,0,0,0|1,0,1]=3 855 B9R1.35 CC(C)c1nc(N)ns1 Amb18831563 [0,1,0,0,0,0|2,0,1]=4 856 B9R1.35 CC(C)c1nc(O)cs1 Amb10599936 [0,1,0,0,0,0|1,0,1]=3 857 B9R1.35 CC(C)c1ncc(Br)o1 Amb24368755 [0,1,0,0,0,0|1,1,1]=4 858 B9R1.35 CC(C)c1ncc(Br)s1 Amb10600218 [0,1,0,0,0,0|1,0,1]=3 859 B9R1.35 CC(C)c1ncc(I)s1 Amb27475885 [0,1,0,0,0,0|1,0,1]=3 860 B9R1.35 CC(C)c1ncc(N)o1 Amb18062956 [0,1,0,0,0,0|1,1,1]=4 861 B9R1.35 CC(C)c1ncc(N)s1 Amb10600220 [0,1,0,0,0,0|1,0,1]=3 862 B9R1.35 CC(C)c1ncc(O)s1 Amb10600221 [0,1,0,0,0,0|1,0,1]=3 863 B9R1.35 CC(C)c1ncc(S)s1 Amb33344649 [0,1,0,0,0,0|1,0,1]=3 864 B9R1.35 CC(C)c1nnc(Br)s1 Amb7173219 [0,1,0,0,0,0|2,0,1]=4 865 B9R1.35 CC(C)c1nnc(Cl)s1 Amb19516940 [0,1,0,0,0,0|2,0,1]=4 866 B9R1.35 CC(C)c1nnc(I)s1 Amb20668440 [0,1,0,0,0,0|2,0,1]=4 867 B9R1.35 CC(C)c1nnc(N)s1 Amb1008319 [0,1,0,0,0,0|2,0,1]=4 868 B9R1.35 CC(C)c1nnc(O)s1 Amb19516959 [0,1,0,0,0,0|2,0,1]=4 869 B9R1.35 CC(C)c1nnc(S)s1 Amb9786962 [0,1,0,0,0,0|2,0,1]=4 870 B9R1.35 CC(Cl)c1ccc(Br)s1 Amb27837455 [0,1,0,0,0,0|2,0,1]=4 871 B9R1.35 CC(Cl)c1ccc(Cl)s1 Amb18181045 [0,1,0,0,0,0|2,0,1]=4 872 B9R1.35 CC(Cl)c1nnc(N)s1 Amb17205128 [0,1,0,0,0,0|2,0,1]=4 873 B9R1.35 CC(N)C1=NC(=O)CS1 Amb30008470 [0,1,0,0,0,0|1,0,2]=4 874 B9R1.35 CC(N)c1cc(Br)cs1 Amb18244132 [0,1,0,0,0,0|2,0,1]=4 875 B9R1.35 CC(N)c1cc(Cl)cs1 Amb25185371 [0,1,0,0,0,0|2,0,1]=4 876 B9R1.35 CC(N)c1ccc(Br)s1 Amb32666088 [0,1,0,0,0,0|2,0,1]=4 877 B9R1.35 CC(N)c1ccc(Br)s1 Amb3788871 [0,1,0,0,0,0|2,0,1]=4 878 B9R1.35 CC(N)c1ccc(Cl)s1 Amb1107924 [0,1,0,0,0,0|2,0,1]=4 879 B9R1.35 CC(N)c1ccc(Cl)s1 Amb32666018 [0,1,0,0,0,0|2,0,1]=4 880 B9R1.35 CC(N)c1ccc(F)s1 Amb24054157 [0,1,0,0,0,0|2,0,1]=4 881 B9R1.35 CC(N)c1ccc(F)s1 Amb27659311 [0,1,0,0,0,0|2,0,1]=4 882 B9R1.35 CC(N)c1ccc(I)s1 Amb28456386 [0,1,0,0,0,0|2,0,1]=4 883 B9R1.35 CC(N)c1ccc(O)s1 Amb27860172 [0,1,0,0,0,0|2,0,1]=4 884 B9R1.35 CC(N)c1nc(O)cs1 Amb28411040 [0,1,0,0,0,0|1,0,1]=3 885 B9R1.35 CC(N)c1ncc(Br)s1 Amb26991144 [0,1,0,0,0,0|1,0,1]=3 886 B9R1.35 CC(N)c1ncc(Cl)s1 Amb24478789 [0,1,0,0,0,0|1,0,1]=3 887 B9R1.35 CC(N)c1nnc(N)s1 Amb15701596 [0,1,0,0,0,0|2,0,1]=4 888 B9R1.35 CC(N)c1nnc(N)s1 Amb19889158 [0,1,0,0,0,0|2,0,1]=4 889 B9R1.35 CC(O)C1=NC(=O)CS1 Amb35679378 [0,1,0,0,0,0|0,0,3]=4 890 B9R1.35 CC(O)c1cc(Br)cs1 Amb26600035 [0,1,0,0,0,0|1,0,2]=4 891 B9R1.35 CC(O)c1ccc(Br)s1 Amb17194985 [0,1,0,0,0,0|1,0,2]=4 892 B9R1.35 CC(O)c1ccc(Cl)s1 Amb9704465 [0,1,0,0,0,0|1,0,2]=4 893 B9R1.35 CC(O)c1ccc(F)s1 Amb19892826 [0,1,0,0,0,0|1,0,2]=4 894 B9R1.35 CC(O)c1nc(O)cs1 Amb35710099 [0,1,0,0,0,0|0,0,2]=3 895 B9R1.35 CC(O)c1ncc(Br)s1 Amb27811828 [0,1,0,0,0,0|0,0,2]=3 896 B9R1.35 CC(O)c1ncc(Cl)s1 Amb28061412 [0,1,0,0,0,0|0,0,2]=3 897 B9R1.35 CC(O)c1ncc(I)s1 Amb27763322 [0,1,0,0,0,0|0,0,2]=3 898 B9R1.35 CC(O)c1nnc(Cl)s1 Amb27454734 [0,1,0,0,0,0|1,0,2]=4 899 B9R1.35 CC(S)c1cc(Br)cs1 Amb24387948 [0,1,0,0,0,0|1,1,1]=4 900 B9R1.35 CC(S)c1ccc(Br)s1 Amb27837425 [0,1,0,0,0,0|1,1,1]=4 901 B9R1.35 CC(S)c1ccc(Cl)s1 Amb9297783 [0,1,0,0,0,0|1,1,1]=4 902 B9R1.35 CC1=CC(=C(C)C)C=C1 Amb24399879 [0,1,0,0,0,0|3,0,0]=4 903 B9R1.35 CN(C)C1=NC(=O)CS1 Amb27212694 [0,1,0,0,0,0|2,0,1]=4 904 B9R1.35 CN(C)C1=NC(=S)SS1 Amb19668870 [0,1,0,0,0,0|3,0,0]=4 905 B9R1.35 CN(C)C1=NNC(=S)S1 Amb19514956 [0,1,0,0,0,0|3,0,0]=4 906 B9R1.35 CN(C)c1ccc(Br)s1 Amb24317616 [0,1,0,0,0,0|3,0,0]=4 907 B9R1.35 CN(C)c1nc(Br)cs1 Amb10599584 [0,1,0,0,0,0|2,0,0]=3 908 B9R1.35 CN(C)c1nc(Br)ns1 Amb25076133 [0,1,0,0,0,0|3,0,0]=4 909 B9R1.35 CN(C)c1nc(N)[s+]s1 Amb27977309 [0,1,0,0,0,0|3,0,0]=4 910 B9R1.35 CN(C)c1nc(N)cs1 Amb20617473 [0,1,0,0,0,0|2,0,0]=3 911 B9R1.35 CN(C)c1nc(N)cs1 Amb22051626 [0,1,0,0,0,0|2,0,0]=3 912 B9R1.35 CN(C)c1ncc(Br)s1 Amb10599640 [0,1,0,0,0,0|2,0,0]=3 913 B9R1.35 CN(C)c1ncc(Cl)s1 Amb27634163 [0,1,0,0,0,0|2,0,0]=3 914 B9R1.35 CN(C)c1ncc(N)s1 Amb18831558 [0,1,0,0,0,0|2,0,0]=3 915 B9R1.35 CN(C)c1ncc(S)s1 Amb32875477 [0,1,0,0,0,0|2,0,0]=3 916 B9R1.35 CN(C)c1nnc(Cl)s1 Amb23400703 [0,1,0,0,0,0|3,0,0]=4 917 B9R1.35 CN(C)c1nnc(N)s1 Amb18124680 [0,1,0,0,0,0|3,0,0]=4 918 B9R1.35 CN(N)C1=NC(=O)CS1 Amb27201816 [0,1,0,0,0,0|2,0,1]=4 919 B9R1.35 CS(=O)c1nc(Br)cs1 Amb20617250 [0,1,0,0,0,0|1,0,0]=2 920 B9R1.35 CS(=O)c1ncc(Br)s1 Amb20615914 [0,1,0,0,0,0|1,0,0]=2 921 B9R1.35 CS(=O)c1nnc(N)s1 Amb28282797 [0,1,0,0,0,0|2,0,0]=3 922 B9R1.35 CS(=O)c1noc(N)n1 Amb18644316 [0,1,0,0,0,0|3,0,0]=4 923 B9R1.35 CS(=O)n1cc(N)cn1 Amb27473551 [0,1,0,0,0,0|3,0,0]=4 924 B9R1.35 C[C@@H](N)C1=NC(=O)CS1 Amb35721223 [0,1,0,0,0,0|1,0,2]=4 925 B9R1.35 C[C@@H](N)c1cc(Br)cs1 Amb27487446 [0,1,0,0,0,0|2,0,1]=4 926 B9R1.35 C[C@@H](N)c1cc(Br)cs1 Amb35789839 [0,1,0,0,0,0|2,0,1]=4 927 B9R1.35 C[C@@H](N)c1cc(Cl)cs1 Amb24436871 [0,1,0,0,0,0|2,0,1]=4 928 B9R1.35 C[C@@H](N)c1cc(N)cs1 Amb27838433 [0,1,0,0,0,0|2,0,1]=4 929 B9R1.35 C[C@@H](N)c1ccc(Br)s1 Amb33506250 [0,1,0,0,0,0|2,0,1]=4 930 B9R1.35 C[C@@H](N)c1ccc(Cl)s1 Amb13953002 [0,1,0,0,0,0|2,0,1]=4 931 B9R1.35 C[C@@H](N)c1ccc(Cl)s1 Amb28934975 [0,1,0,0,0,0|2,0,1]=4 932 B9R1.35 C[C@@H](N)c1ccc(I)s1 Amb27423837 [0,1,0,0,0,0|2,0,1]=4 933 B9R1.35 C[C@@H](N)c1nc(O)cs1 Amb29863411 [0,1,0,0,0,0|1,0,1]=3 934 B9R1.35 C[C@@H](N)c1ncc(Br)s1 Amb33434391 [0,1,0,0,0,0|1,0,1]=3 935 B9R1.35 C[C@@H](N)c1ncc(Cl)s1 Amb35671486 [0,1,0,0,0,0|1,0,1]=3 936 B9R1.35 C[C@@H](N)c1ncc(I)s1 Amb35671488 [0,1,0,0,0,0|1,0,1]=3 937 B9R1.35 C[C@@H](O)c1cc(Br)cs1 Amb23439873 [0,1,0,0,0,0|1,0,2]=4 938 B9R1.35 C[C@@H](O)c1cc(Cl)cs1 Amb33057548 [0,1,0,0,0,0|1,0,2]=4 939 B9R1.35 C[C@@H](O)c1ccc(Br)s1 Amb13953003 [0,1,0,0,0,0|1,0,2]=4 940 B9R1.35 C[C@@H](O)c1ccc(Cl)s1 Amb13952999 [0,1,0,0,0,0|1,0,2]=4 941 B9R1.35 C[C@@H](O)c1ncc(Br)s1 Amb33434347 [0,1,0,0,0,0|0,0,2]=3 942 B9R1.35 C[C@H](N)C1=NC(=O)CS1 Amb35671483 [0,1,0,0,0,0|1,0,2]=4 943 B9R1.35 C[C@H](N)c1cc(Br)cs1 Amb25075759 [0,1,0,0,0,0|2,0,1]=4 944 B9R1.35 C[C@H](N)c1cc(Cl)cs1 Amb27838463 [0,1,0,0,0,0|2,0,1]=4 945 B9R1.35 C[C@H](N)c1cc(F)cs1 Amb27644516 [0,1,0,0,0,0|2,0,1]=4 946 B9R1.35 C[C@H](N)c1ccc(Br)s1 Amb13953006 [0,1,0,0,0,0|2,0,1]=4 947 B9R1.35 C[C@H](N)c1ccc(Br)s1 Amb28895927 [0,1,0,0,0,0|2,0,1]=4 948 B9R1.35 C[C@H](N)c1ccc(Cl)s1 Amb13953001 [0,1,0,0,0,0|2,0,1]=4 949 B9R1.35 C[C@H](N)c1ccc(Cl)s1 Amb28934974 [0,1,0,0,0,0|2,0,1]=4 950 B9R1.35 C[C@H](N)c1nc(O)cs1 Amb35671484 [0,1,0,0,0,0|1,0,1]=3 951 B9R1.35 C[C@H](N)c1ncc(Br)s1 Amb29849705 [0,1,0,0,0,0|1,0,1]=3 952 B9R1.35 C[C@H](N)c1ncc(Cl)s1 Amb29849696 [0,1,0,0,0,0|1,0,1]=3 953 B9R1.35 C[C@H](N)c1ncc(I)s1 Amb35671649 [0,1,0,0,0,0|1,0,1]=3 954 B9R1.35 C[C@H](O)c1cc(Br)cs1 Amb26857270 [0,1,0,0,0,0|1,0,2]=4 955 B9R1.35 C[C@H](O)c1cc(Cl)cs1 Amb33057552 [0,1,0,0,0,0|1,0,2]=4 956 B9R1.35 C[C@H](O)c1ccc(Br)s1 Amb13953004 [0,1,0,0,0,0|1,0,2]=4 957 B9R1.35 C[C@H](O)c1ccc(Cl)s1 Amb13953000 [0,1,0,0,0,0|1,0,2]=4 958 B9R1.35 C[C@H](O)c1ncc(Br)s1 Amb33434350 [0,1,0,0,0,0|0,0,2]=3 959 B9R1.35 C[SiH](C)c1ccc(Cl)s1 Amb27796587 [0,1,0,0,0,0|2,1,0]=4 960 B9R1.35 Cc1cc(C(=O)Cl)no1 Amb2689504 [0,1,0,0,0,0|3,0,0]=4 961 B9R1.35 Cc1cc(C(=O)O)no1 Amb6335305 [0,1,0,0,0,0|3,0,0]=4 962 B9R1.35 Cc1cc(C(=O)O)ns1 Amb18202486 [0,1,0,0,0,0|3,0,0]=4 963 B9R1.35 Cc1cc(C(=O)O)sn1 Amb33544153 [0,1,0,0,0,0|3,0,0]=4 964 B9R1.35 Cc1cc(C(N)=O)no1 Amb4009604 [0,1,0,0,0,0|3,0,0]=4 965 B9R1.35 Cc1ccc(C(=N)N)s1 Amb17601556 [0,1,0,0,0,0|3,0,0]=4 966 B9R1.35 Cc1ccc(C(=N)N)s1 Amb8834132 [0,1,0,0,0,0|3,0,0]=4 967 B9R1.35 Cc1ccc(C(=O)Cl)o1 Amb2689440 [0,1,0,0,0,0|2,1,0]=4 968 B9R1.35 Cc1ccc(C(=O)Cl)s1 Amb33528399 [0,1,0,0,0,0|2,0,0]=3 969 B9R1.35 Cc1ccc(C(=O)O)o1 Amb6318544 [0,1,0,0,0,0|2,1,0]=4 970 B9R1.35 Cc1ccc(C(=O)O)s1 Amb1157149 [0,1,0,0,0,0|2,0,0]=3 971 B9R1.35 Cc1ccc(C(C)C)s1 Amb27185525 [0,1,0,0,0,0|2,0,1]=4 972 B9R1.35 Cc1ccc(C(C)N)s1 Amb10610116 [0,1,0,0,0,0|2,0,1]=4 973 B9R1.35 Cc1ccc(C(C)N)s1 Amb9703786 [0,1,0,0,0,0|2,0,1]=4 974 B9R1.35 Cc1ccc(C(C)O)s1 Amb2237071 [0,1,0,0,0,0|1,0,2]=4 975 B9R1.35 Cc1ccc(C(C)S)s1 Amb9208034 [0,1,0,0,0,0|1,1,1]=4 976 B9R1.35 Cc1ccc(C(N)=O)o1 Amb3359879 [0,1,0,0,0,0|2,1,0]=4 977 B9R1.35 Cc1ccc(C(N)=O)s1 Amb8997732 [0,1,0,0,0,0|2,0,0]=3 978 B9R1.35 Cc1ccc(C(N)=S)s1 Amb8834046 [0,1,0,0,0,0|2,1,0]=4 979 B9R1.35 Cc1ccc(S(=O)[O-])s1 Amb24753008 [0,1,0,0,0,0|3,0,0]=4 980 B9R1.35 Cc1ccc(S(C)=O)o1 Amb27230252 [0,1,0,0,0,0|2,1,0]=4 981 B9R1.35 Cc1ccc([C@@H](C)N)s1 Amb27494851 [0,1,0,0,0,0|2,0,1]=4 982 B9R1.35 Cc1ccc([C@@H](C)O)s1 Amb24625882 [0,1,0,0,0,0|1,0,2]=4 983 B9R1.35 Cc1ccc([C@H](C)N)s1 Amb24555329 [0,1,0,0,0,0|2,0,1]=4 984 B9R1.35 Cc1ccc([C@H](C)O)s1 Amb27249678 [0,1,0,0,0,0|1,0,2]=4 985 B9R1.35 Cc1ccc([N+](=O)[O-])s1 Amb10574813 [0,1,0,0,0,0|3,0,0]=4 986 B9R1.35 Cc1ccn(C(N)=O)n1 Amb2720537 [0,1,0,0,0,0|3,0,0]=4 987 B9R1.35 Cc1cnc(C(=N)N)s1 Amb27205401 [0,1,0,0,0,0|2,0,0]=3 988 B9R1.35 Cc1cnc(C(=O)Cl)s1 Amb26455598 [0,1,0,0,0,0|1,0,0]=2 989 B9R1.35 Cc1cnc(C(=O)O)o1 Amb18832708 [0,1,0,0,0,0|1,1,0]=3 990 B9R1.35 Cc1cnc(C(=O)O)s1 Amb8010646 [0,1,0,0,0,0|1,0,0]=2 991 B9R1.35 Cc1cnc(C(=O)[O-])o1 Amb24183598 [0,1,0,0,0,0|1,1,0]=3 992 B9R1.35 Cc1cnc(C(=O)[O-])o1 Amb32653595 [0,1,0,0,0,0|1,1,0]=3 993 B9R1.35 Cc1cnc(C(=O)[O-])o1 Amb33713544 [0,1,0,0,0,0|1,1,0]=3 994 B9R1.35 Cc1cnc(C(=O)[O-])s1 Amb16187163 [0,1,0,0,0,0|1,0,0]=2 995 B9R1.35 Cc1cnc(C(C)C)o1 Amb23456251 [0,1,0,0,0,0|1,1,1]=4 996 B9R1.35 Cc1cnc(C(C)C)s1 Amb27595399 [0,1,0,0,0,0|1,0,1]=3 997 B9R1.35 Cc1cnc(C(C)Cl)o1 Amb22059657 [0,1,0,0,0,0|1,1,1]=4 998 B9R1.35 Cc1cnc(C(C)N)o1 Amb5733072 [0,1,0,0,0,0|1,1,1]=4 999 B9R1.35 Cc1cnc(C(C)N)s1 Amb5754156 [0,1,0,0,0,0|1,0,1]=3 1000 B9R1.35 Cc1cnc(C(C)O)s1 Amb19649411 [0,1,0,0,0,0|0,0,2]=3 1001 B9R1.35 Cc1cnc(C(O)=S)s1 Amb27670233 [0,1,0,0,0,0|1,0,1]=3 1002 B9R1.35 Cc1cnc([C@@H](C)N)o1 Amb19373386 [0,1,0,0,0,0|1,1,1]=4 1003 B9R1.35 Cc1cnc([C@@H](C)N)s1 Amb35671485 [0,1,0,0,0,0|1,0,1]=3 1004 B9R1.35 Cc1cnc([C@H](C)N)s1 Amb29849695 [0,1,0,0,0,0|1,0,1]=3 1005 B9R1.35 Cc1cnc([N+](=O)[O-])s1 Amb10574577 [0,1,0,0,0,0|2,0,0]=3 1006 B9R1.35 Cc1coc(C(=O)O)c1 Amb18642368 [0,1,0,0,0,0|2,1,0]=4 1007 B9R1.35 Cc1coc(C(=O)O)n1 Amb18832706 [0,1,0,0,0,0|1,1,0]=3 1008 B9R1.35 Cc1coc(C(=O)[O-])n1 Amb30585199 [0,1,0,0,0,0|1,1,0]=3 1009 B9R1.35 Cc1coc(C(C)Cl)n1 Amb32671974 [0,1,0,0,0,0|1,1,1]=4 1010 B9R1.35 Cc1coc(C(C)N)n1 Amb25786164 [0,1,0,0,0,0|1,1,1]=4 1011 B9R1.35 Cc1coc([C@@H](C)N)n1 Amb18832748 [0,1,0,0,0,0|1,1,1]=4 1012 B9R1.35 Cc1coc([C@@H](C)N)n1 Amb33457637 [0,1,0,0,0,0|1,1,1]=4 1013 B9R1.35 Cc1csc(C(=N)N)c1 Amb28120709 [0,1,0,0,0,0|3,0,0]=4 1014 B9R1.35 Cc1csc(C(=N)N)n1 Amb28555350 [0,1,0,0,0,0|2,0,0]=3 1015 B9R1.35 Cc1csc(C(=O)Cl)c1 Amb2691601 [0,1,0,0,0,0|2,0,0]=3 1016 B9R1.35 Cc1csc(C(=O)O)c1 Amb2691600 [0,1,0,0,0,0|2,0,0]=3 1017 B9R1.35 Cc1csc(C(=O)O)n1 Amb5759010 [0,1,0,0,0,0|1,0,0]=2 1018 B9R1.35 Cc1csc(C(=O)[O-])n1 Amb9902127 [0,1,0,0,0,0|1,0,0]=2 1019 B9R1.35 Cc1csc(C(C)Br)n1 Amb26362971 [0,1,0,0,0,0|1,0,1]=3 1020 B9R1.35 Cc1csc(C(C)C)n1 Amb2689023 [0,1,0,0,0,0|1,0,1]=3 1021 B9R1.35 Cc1csc(C(C)N)c1 Amb24505034 [0,1,0,0,0,0|2,0,1]=4 1022 B9R1.35 Cc1csc(C(C)N)n1 Amb21959886 [0,1,0,0,0,0|1,0,1]=3 1023 B9R1.35 Cc1csc(C(C)N)n1 Amb3788123 [0,1,0,0,0,0|1,0,1]=3 1024 B9R1.35 Cc1csc(C(C)O)n1 Amb19649410 [0,1,0,0,0,0|0,0,2]=3 1025 B9R1.35 Cc1csc(C(C)S)n1 Amb32788115 [0,1,0,0,0,0|0,1,1]=3 1026 B9R1.35 Cc1csc(C(Cl)Cl)n1 Amb27223461 [0,1,0,0,0,0|2,0,1]=4 1027 B9R1.35 Cc1csc(C(N)=O)c1 Amb2691602 [0,1,0,0,0,0|2,0,0]=3 1028 B9R1.35 Cc1csc(C(N)=S)c1 Amb33312047 [0,1,0,0,0,0|2,1,0]=4 1029 B9R1.35 Cc1csc(C(N)=S)n1 Amb24571404 [0,1,0,0,0,0|1,1,0]=3 1030 B9R1.35 Cc1csc(N(C)C)n1 Amb22234955 [0,1,0,0,0,0|2,0,0]=3 1031 B9R1.35 Cc1csc(N(C)N)n1 Amb27448161 [0,1,0,0,0,0|2,0,0]=3 1032 B9R1.35 Cc1csc(S(=O)[O-])c1 Amb32755389 [0,1,0,0,0,0|3,0,0]=4 1033 B9R1.35 Cc1csc([C@@H](C)N)c1 Amb28423529 [0,1,0,0,0,0|2,0,1]=4 1034 B9R1.35 Cc1csc([C@@H](C)O)c1 Amb33427968 [0,1,0,0,0,0|1,0,2]=4 1035 B9R1.35 Cc1csc([C@H](C)N)c1 Amb26498785 [0,1,0,0,0,0|2,0,1]=4 1036 B9R1.35 Cc1csc([C@H](C)O)c1 Amb33427600 [0,1,0,0,0,0|1,0,2]=4 1037 B9R1.35 Cc1csc([N+](=O)[O-])c1 Amb24524204 [0,1,0,0,0,0|3,0,0]=4 1038 B9R1.35 Cc1csc([N+](=O)[O-])n1 Amb26969782 [0,1,0,0,0,0|2,0,0]=3 1039 B9R1.35 Cc1csc([SiH](C)C)c1 Amb27965893 [0,1,0,0,0,0|2,1,0]=4 1040 B9R1.35 Cc1nc(C(=O)Cl)co1 Amb22736505 [0,1,0,0,0,0|3,0,0]=4 1041 B9R1.35 Cc1nc(C(=O)Cl)cs1 Amb6572009 [0,1,0,0,0,0|3,0,0]=4 1042 B9R1.35 Cc1nc(C(=O)Cl)cs1 Amb8630401 [0,1,0,0,0,0|3,0,0]=4 1043 B9R1.35 Cc1nc(C(=O)Cl)no1 Amb25241966 [0,1,0,0,0,0|3,0,0]=4 1044 B9R1.35 Cc1nc(C(=O)O)co1 Amb6307241 [0,1,0,0,0,0|3,0,0]=4 1045 B9R1.35 Cc1nc(C(=O)O)cs1 Amb22587710 [0,1,0,0,0,0|3,0,0]=4 1046 B9R1.35 Cc1nc(C(=O)O)cs1 Amb2723085 [0,1,0,0,0,0|3,0,0]=4 1047 B9R1.35 Cc1nc(C(=O)O)cs1 Amb33446967 [0,1,0,0,0,0|3,0,0]=4 1048 B9R1.35 Cc1nc(C(=O)O)no1 Amb8010643 [0,1,0,0,0,0|3,0,0]=4 1049 B9R1.35 Cc1nc(C(=O)[O-])no1 Amb21963020 [0,1,0,0,0,0|3,0,0]=4 1050 B9R1.35 Cc1nc(C(=O)[O-])no1 Amb32653555 [0,1,0,0,0,0|3,0,0]=4 1051 B9R1.35 Cc1nc(C(=O)[O-])no1 Amb32680311 [0,1,0,0,0,0|3,0,0]=4 1052 B9R1.35 Cc1nc(C(N)=O)co1 Amb8483752 [0,1,0,0,0,0|3,0,0]=4 1053 B9R1.35 Cc1nc(C(N)=O)cs1 Amb4477412 [0,1,0,0,0,0|3,0,0]=4 1054 B9R1.35 Cc1nc(C(N)=O)no1 Amb27167521 [0,1,0,0,0,0|3,0,0]=4 1055 B9R1.35 Cc1ncc(C(=O)O)s1 Amb8630402 [0,1,0,0,0,0|3,0,0]=4 1056 B9R1.35 Cc1ncc(C(N)=O)s1 Amb13952295 [0,1,0,0,0,0|3,0,0]=4 1057 B9R1.35 Cc1nnc(C(=O)Cl)o1 Amb22169651 [0,1,0,0,0,0|2,1,0]=4 1058 B9R1.35 Cc1nnc(C(=O)O)o1 Amb3941251 [0,1,0,0,0,0|2,1,0]=4 1059 B9R1.35 Cc1nnc(C(=O)O)s1 Amb22234842 [0,1,0,0,0,0|2,0,0]=3 1060 B9R1.35 Cc1nnc(C(=O)[O-])o1 Amb17617582 [0,1,0,0,0,0|2,1,0]=4 1061 B9R1.35 Cc1nnc(C(=O)[O-])o1 Amb21937025 [0,1,0,0,0,0|2,1,0]=4 1062 B9R1.35 Cc1nnc(C(=O)[O-])s1 Amb23439055 [0,1,0,0,0,0|2,0,0]=3 1063 B9R1.35 Cc1nnc(C(=O)[O-])s1 Amb28934955 [0,1,0,0,0,0|2,0,0]=3 1064 B9R1.35 Cc1nnc(C(C)C)s1 Amb27481512 [0,1,0,0,0,0|2,0,1]=4 1065 B9R1.35 Cc1nnc(C(C)Cl)s1 Amb24744064 [0,1,0,0,0,0|2,0,1]=4 1066 B9R1.35 Cc1nnc(C(C)N)s1 Amb18862272 [0,1,0,0,0,0|2,0,1]=4 1067 B9R1.35 Cc1nnc(C(N)=O)o1 Amb27193971 [0,1,0,0,0,0|2,1,0]=4 1068 B9R1.35 Cc1nnc(S(=O)[O-])s1 Amb32755368 [0,1,0,0,0,0|3,0,0]=4 1069 B9R1.35 Cc1noc(C(=O)O)n1 Amb18687563 [0,1,0,0,0,0|2,1,0]=4 1070 B9R1.35 Cc1noc(C(=O)[O-])n1 Amb21963031 [0,1,0,0,0,0|2,1,0]=4 1071 B9R1.35 Cc1noc(C(=O)[O-])n1 Amb33334619 [0,1,0,0,0,0|2,1,0]=4 1072 B9R1.35 Cc1nsc(C(=O)O)n1 Amb18831516 [0,1,0,0,0,0|2,0,0]=3 1073 B9R1.35 Cc1nsc(C(=O)[O-])n1 Amb32757544 [0,1,0,0,0,0|2,0,0]=3 1074 B9R1.35 Cc1nsc(C(=O)[O-])n1 Amb34913028 [0,1,0,0,0,0|2,0,0]=3 1075 B9R1.35 Cc1nsc(C(N)=O)n1 Amb22702907 [0,1,0,0,0,0|2,0,0]=3 1076 B9R1.35 Cn1ccc(C(=O)Cl)n1 Amb2723918 [0,1,0,0,0,0|3,0,0]=4 1077 B9R1.35 Cn1ccc(C(=O)O)n1 Amb33544330 [0,1,0,0,0,0|3,0,0]=4 1078 B9R1.35 Cn1ccc(C(N)=O)n1 Amb6572626 [0,1,0,0,0,0|3,0,0]=4 1079 B9R1.35 Cn1cnc(C(=O)O)c1 Amb33545050 [0,1,0,0,0,0|3,0,0]=4 1080 B9R1.35 Cn1cnc(C(=O)O)n1 Amb33545103 [0,1,0,0,0,0|3,0,0]=4 1081 B9R1.35 Cn1cnc(C(N)=O)c1 Amb9677665 [0,1,0,0,0,0|3,0,0]=4 1082 B9R1.35 Cn1cnc(C(N)=O)n1 Amb27968919 [0,1,0,0,0,0|3,0,0]=4 1083 B9R1.35 FC(F)c1nc(Br)cs1 Amb26547539 [0,1,0,0,0,0|2,0,1]=4 1084 B9R1.35 FC(F)c1ncc(Br)s1 Amb23439249 [0,1,0,0,0,0|2,0,1]=4 1085 B9R1.35 N=C(N)c1cc(Br)cs1 Amb8834133 [0,1,0,0,0,0|3,0,0]=4 1086 B9R1.35 N=C(N)c1cc(Cl)cs1 Amb23447090 [0,1,0,0,0,0|3,0,0]=4 1087 B9R1.35 N=C(N)c1ccc(Br)s1 Amb17601641 [0,1,0,0,0,0|3,0,0]=4 1088 B9R1.35 N=C(N)c1ccc(Cl)s1 Amb10609838 [0,1,0,0,0,0|3,0,0]=4 1089 B9R1.35 N=C(N)c1ccc(Cl)s1 Amb8834135 [0,1,0,0,0,0|3,0,0]=4 1090 B9R1.35 N=C(N)c1ncc(Br)s1 Amb33435144 [0,1,0,0,0,0|2,0,0]=3 1091 B9R1.35 NC(=O)C1=CC(=S)SS1 Amb27862499 [0,1,0,0,0,0|3,0,0]=4 1092 B9R1.35 NC(=O)C1=CSC(=S)S1 Amb28246404 [0,1,0,0,0,0|3,0,0]=4 1093 B9R1.35 NC(=O)C1=NC(=O)ON1 Amb25056607 [0,1,0,0,0,0|3,0,0]=4 1094 B9R1.35 NC(=O)C1=NNC(=S)S1 Amb22496139 [0,1,0,0,0,0|2,0,0]=3 1095 B9R1.35 NC(=O)c1cc(Br)co1 Amb22044254 [0,1,0,0,0,0|2,1,0]=4 1096 B9R1.35 NC(=O)c1cc(Br)cs1 Amb8089669 [0,1,0,0,0,0|2,0,0]=3 1097 B9R1.35 NC(=O)c1cc(N)cs1 Amb26967551 [0,1,0,0,0,0|2,0,0]=3 1098 B9R1.35 NC(=O)c1cc(N)on1 Amb25858665 [0,1,0,0,0,0|3,0,0]=4 1099 B9R1.35 NC(=O)c1cc(O)cs1 Amb26512603 [0,1,0,0,0,0|2,0,0]=3 1100 B9R1.35 NC(=O)c1ccc(Br)o1 Amb8335806 [0,1,0,0,0,0|2,1,0]=4 1101 B9R1.35 NC(=O)c1ccc(Br)s1 Amb6491031 [0,1,0,0,0,0|2,0,0]=3 1102 B9R1.35 NC(=O)c1ccc(Cl)o1 Amb27203205 [0,1,0,0,0,0|2,1,0]=4 1103 B9R1.35 NC(=O)c1ccc(Cl)s1 Amb1948780 [0,1,0,0,0,0|2,0,0]=3 1104 B9R1.35 NC(=O)c1ccc(F)s1 Amb23449713 [0,1,0,0,0,0|2,0,0]=3 1105 B9R1.35 NC(=O)c1ccc(I)o1 Amb780127 [0,1,0,0,0,0|2,1,0]=4 1106 B9R1.35 NC(=O)c1ccc(I)s1 Amb27792049 [0,1,0,0,0,0|2,0,0]=3 1107 B9R1.35 NC(=O)c1ccc(N)s1 Amb18831646 [0,1,0,0,0,0|2,0,0]=3 1108 B9R1.35 NC(=O)c1cn(N)cn1 Amb27393138 [0,1,0,0,0,0|3,0,0]=4 1109 B9R1.35 NC(=O)c1cnc(Br)s1 Amb19958304 [0,1,0,0,0,0|3,0,0]=4 1110 B9R1.35 NC(=O)c1cnc(N)s1 Amb477913 [0,1,0,0,0,0|3,0,0]=4 1111 B9R1.35 NC(=O)c1coc(Br)n1 Amb22490827 [0,1,0,0,0,0|3,0,0]=4 1112 B9R1.35 NC(=O)c1coc(N)n1 Amb24383446 [0,1,0,0,0,0|3,0,0]=4 1113 B9R1.35 NC(=O)c1csc(Br)n1 Amb10602040 [0,1,0,0,0,0|3,0,0]=4 1114 B9R1.35 NC(=O)c1csc(Cl)n1 Amb10608523 [0,1,0,0,0,0|3,0,0]=4 1115 B9R1.35 NC(=O)c1csc(F)n1 Amb27860181 [0,1,0,0,0,0|3,0,0]=4 1116 B9R1.35 NC(=O)c1csc(I)n1 Amb25237542 [0,1,0,0,0,0|3,0,0]=4 1117 B9R1.35 NC(=O)c1csc(N)n1 Amb7173178 [0,1,0,0,0,0|3,0,0]=4 1118 B9R1.35 NC(=O)c1nc(Br)cs1 Amb26973893 [0,1,0,0,0,0|1,0,0]=2 1119 B9R1.35 NC(=O)c1nc(Cl)cs1 Amb28256557 [0,1,0,0,0,0|1,0,0]=2 1120 B9R1.35 NC(=O)c1nc(S)cs1 Amb28292300 [0,1,0,0,0,0|1,0,0]=2 1121 B9R1.35 NC(=O)c1ncc(Cl)s1 Amb22753105 [0,1,0,0,0,0|1,0,0]=2 1122 B9R1.35 NC(=O)c1ncc(I)s1 Amb22753109 [0,1,0,0,0,0|1,0,0]=2 1123 B9R1.35 NC(=O)c1ncc(N)s1 Amb22489884 [0,1,0,0,0,0|1,0,0]=2 1124 B9R1.35 NC(=O)c1nnc(Br)s1 Amb23437052 [0,1,0,0,0,0|2,0,0]=3 1125 B9R1.35 NC(=O)c1nnc(Cl)s1 Amb22498923 [0,1,0,0,0,0|2,0,0]=3 1126 B9R1.35 NC(=O)c1nnc(N)o1 Amb1063100 [0,1,0,0,0,0|2,1,0]=4 1127 B9R1.35 NC(=O)c1nnc(N)s1 Amb22490508 [0,1,0,0,0,0|2,0,0]=3 1128 B9R1.35 NC(=O)n1cc(Br)cn1 Amb24053200 [0,1,0,0,0,0|3,0,0]=4 1129 B9R1.35 NC(=S)c1cc(Br)cs1 Amb9210491 [0,1,0,0,0,0|2,1,0]=4 1130 B9R1.35 NC(=S)c1cc(Cl)cs1 Amb27161924 [0,1,0,0,0,0|2,1,0]=4 1131 B9R1.35 NC(=S)c1ccc(Br)s1 Amb8834044 [0,1,0,0,0,0|2,1,0]=4 1132 B9R1.35 NC(=S)c1ccc(Cl)s1 Amb8834049 [0,1,0,0,0,0|2,1,0]=4 1133 B9R1.35 NC(=S)c1ccc(F)s1 Amb26362282 [0,1,0,0,0,0|2,1,0]=4 1134 B9R1.35 NC(=S)c1nc(N)cs1 Amb28385569 [0,1,0,0,0,0|1,1,0]=3 1135 B9R1.35 NC(=S)c1ncc(Br)s1 Amb33435991 [0,1,0,0,0,0|1,1,0]=3 1136 B9R1.35 NC(=S)c1ncc(Cl)s1 Amb27755758 [0,1,0,0,0,0|1,1,0]=3 1137 B9R1.35 NC(=S)c1ncc(N)s1 Amb22059454 [0,1,0,0,0,0|1,1,0]=3 1138 B9R1.35 NC(=S)c1nnc(S)s1 Amb33743537 [0,1,0,0,0,0|2,1,0]=4 1139 B9R1.35 Nc1cc(C(=O)O)no1 Amb18832652 [0,1,0,0,0,0|3,0,0]=4 1140 B9R1.35 Nc1cc(C(=O)O)ns1 Amb27398352 [0,1,0,0,0,0|3,0,0]=4 1141 B9R1.35 Nc1ccc(C(=O)O)o1 Amb18946756 [0,1,0,0,0,0|2,1,0]=4 1142 B9R1.35 Nc1ccc(C(=O)O)s1 Amb18831593 [0,1,0,0,0,0|2,0,0]=3 1143 B9R1.35 Nc1ccc([N+](=O)[O-])s1 Amb18202412 [0,1,0,0,0,0|3,0,0]=4 1144 B9R1.35 Nc1cnc(C(=O)O)s1 Amb22235290 [0,1,0,0,0,0|1,0,0]=2 1145 B9R1.35 Nc1cnc(C(=O)O)s1 Amb22899439 [0,1,0,0,0,0|1,0,0]=2 1146 B9R1.35 Nc1csc(C(=O)O)c1 Amb10602581 [0,1,0,0,0,0|2,0,0]=3 1147 B9R1.35 Nc1csc(C(=O)O)c1 Amb18124637 [0,1,0,0,0,0|2,0,0]=3 1148 B9R1.35 Nc1csc(C(=O)O)n1 Amb25978066 [0,1,0,0,0,0|1,0,0]=2 1149 B9R1.35 Nc1csc(C(=O)[O-])n1 Amb35789848 [0,1,0,0,0,0|1,0,0]=2 1150 B9R1.35 Nc1nc(C(=O)O)co1 Amb10879778 [0,1,0,0,0,0|3,0,0]=4 1151 B9R1.35 Nc1nc(C(=O)O)cs1 Amb10067797 [0,1,0,0,0,0|3,0,0]=4 1152 B9R1.35 Nc1nc(C(=O)O)cs1 Amb33528356 [0,1,0,0,0,0|3,0,0]=4 1153 B9R1.35 Nc1nc(C(=O)O)ns1 Amb27590427 [0,1,0,0,0,0|3,0,0]=4 1154 B9R1.35 Nc1nc(C(=O)[O-])cs1 Amb33512918 [0,1,0,0,0,0|3,0,0]=4 1155 B9R1.35 Nc1ncc(C(=O)O)s1 Amb7172637 [0,1,0,0,0,0|3,0,0]=4 1156 B9R1.35 Nc1nnc(C(=O)O)o1 Amb18832581 [0,1,0,0,0,0|2,1,0]=4 1157 B9R1.35 Nc1nnc(C(=O)O)s1 Amb22275932 [0,1,0,0,0,0|2,0,0]=3 1158 B9R1.35 Nc1nnc(C(=O)[O-])o1 Amb33457266 [0,1,0,0,0,0|2,1,0]=4 1159 B9R1.35 Nc1nnc(C(=O)[O-])s1 Amb30585197 [0,1,0,0,0,0|2,0,0]=3 1160 B9R1.35 Nc1nnc([N+](=O)[O-])s1 Amb22499641 [0,1,0,0,0,0|3,0,0]=4 1161 B9R1.35 Nc1noc(C(=O)O)n1 Amb25911736 [0,1,0,0,0,0|2,1,0]=4 1162 B9R1.35 Nn1ccc(C(=O)O)n1 Amb18642484 [0,1,0,0,0,0|3,0,0]=4 1163 B9R1.35 Nn1cnc(C(=O)O)n1 Amb25077216 [0,1,0,0,0,0|3,0,0]=4 1164 B9R1.35 O=C(Br)c1ccc(Br)o1 Amb17939056 [0,1,0,0,0,0|2,1,0]=4 1165 B9R1.35 O=C(Br)c1ccc(Br)s1 Amb27438585 [0,1,0,0,0,0|2,0,0]=3 1166 B9R1.35 O=C(Br)c1ccc(Cl)s1 Amb28286939 [0,1,0,0,0,0|2,0,0]=3 1167 B9R1.35 O=C(Cl)c1cc(Br)cs1 Amb2723433 [0,1,0,0,0,0|2,0,0]=3 1168 B9R1.35 O=C(Cl)c1cc(Cl)cs1 Amb28254474 [0,1,0,0,0,0|2,0,0]=3 1169 B9R1.35 O=C(Cl)c1ccc(Br)o1 Amb2685261 [0,1,0,0,0,0|2,1,0]=4 1170 B9R1.35 O=C(Cl)c1ccc(Br)s1 Amb6743401 [0,1,0,0,0,0|2,0,0]=3 1171 B9R1.35 O=C(Cl)c1ccc(Cl)o1 Amb27953619 [0,1,0,0,0,0|2,1,0]=4 1172 B9R1.35 O=C(Cl)c1ccc(Cl)s1 Amb7173092 [0,1,0,0,0,0|2,0,0]=3 1173 B9R1.35 O=C(Cl)c1ccc(F)o1 Amb28196417 [0,1,0,0,0,0|2,1,0]=4 1174 B9R1.35 O=C(Cl)c1ccc(F)s1 Amb23449712 [0,1,0,0,0,0|2,0,0]=3 1175 B9R1.35 O=C(Cl)c1ccc(I)o1 Amb27438212 [0,1,0,0,0,0|2,1,0]=4 1176 B9R1.35 O=C(Cl)c1cnc(Br)s1 Amb25208694 [0,1,0,0,0,0|3,0,0]=4 1177 B9R1.35 O=C(Cl)c1cnc(Cl)s1 Amb6572318 [0,1,0,0,0,0|3,0,0]=4 1178 B9R1.35 O=C(Cl)c1csc(Br)n1 Amb24478753 [0,1,0,0,0,0|3,0,0]=4 1179 B9R1.35 O=C(Cl)c1csc(Cl)n1 Amb22551861 [0,1,0,0,0,0|3,0,0]=4 1180 B9R1.35 O=C(F)c1ccc(Br)o1 Amb28254044 [0,1,0,0,0,0|2,1,0]=4 1181 B9R1.35 O=C(O)c1cc(Br)co1 Amb18129829 [0,1,0,0,0,0|2,1,0]=4 1182 B9R1.35 O=C(O)c1cc(Br)cs1 Amb1935172 [0,1,0,0,0,0|2,0,0]=3 1183 B9R1.35 O=C(O)c1cc(Br)ns1 Amb28204289 [0,1,0,0,0,0|3,0,0]=4 1184 B9R1.35 O=C(O)c1cc(Br)on1 Amb28388186 [0,1,0,0,0,0|3,0,0]=4 1185 B9R1.35 O=C(O)c1cc(Cl)co1 Amb18644297 [0,1,0,0,0,0|2,1,0]=4 1186 B9R1.35 O=C(O)c1cc(Cl)cs1 Amb16185757 [0,1,0,0,0,0|2,0,0]=3 1187 B9R1.35 O=C(O)c1cc(Cl)ns1 Amb18189241 [0,1,0,0,0,0|3,0,0]=4 1188 B9R1.35 O=C(O)c1cc(Cl)on1 Amb26438976 [0,1,0,0,0,0|3,0,0]=4 1189 B9R1.35 O=C(O)c1cc(F)co1 Amb28141604 [0,1,0,0,0,0|2,1,0]=4 1190 B9R1.35 O=C(O)c1cc(F)cs1 Amb10602731 [0,1,0,0,0,0|2,0,0]=3 1191 B9R1.35 O=C(O)c1cc(I)on1 Amb24578190 [0,1,0,0,0,0|3,0,0]=4 1192 B9R1.35 O=C(O)c1cc(O)co1 Amb27494194 [0,1,0,0,0,0|2,1,0]=4 1193 B9R1.35 O=C(O)c1cc(O)cs1 Amb5720296 [0,1,0,0,0,0|2,0,0]=3 1194 B9R1.35 O=C(O)c1cc(O)ns1 Amb24579600 [0,1,0,0,0,0|3,0,0]=4 1195 B9R1.35 O=C(O)c1ccc(Br)o1 Amb6335213 [0,1,0,0,0,0|2,1,0]=4 1196 B9R1.35 O=C(O)c1ccc(Br)s1 Amb6341887 [0,1,0,0,0,0|2,0,0]=3 1197 B9R1.35 O=C(O)c1ccc(Cl)o1 Amb1107530 [0,1,0,0,0,0|2,1,0]=4 1198 B9R1.35 O=C(O)c1ccc(Cl)s1 Amb1152956 [0,1,0,0,0,0|2,0,0]=3 1199 B9R1.35 O=C(O)c1ccc(F)o1 Amb23538033 [0,1,0,0,0,0|2,1,0]=4 1200 B9R1.35 O=C(O)c1ccc(F)s1 Amb33542618 [0,1,0,0,0,0|2,0,0]=3 1201 B9R1.35 O=C(O)c1ccc(I)o1 Amb2459665 [0,1,0,0,0,0|2,1,0]=4 1202 B9R1.35 O=C(O)c1ccc(I)s1 Amb22002319 [0,1,0,0,0,0|2,0,0]=3 1203 B9R1.35 O=C(O)c1cnc(Br)s1 Amb6600495 [0,1,0,0,0,0|3,0,0]=4 1204 B9R1.35 O=C(O)c1cnc(Cl)s1 Amb2432444 [0,1,0,0,0,0|3,0,0]=4 1205 B9R1.35 O=C(O)c1cnc(F)s1 Amb24329329 [0,1,0,0,0,0|3,0,0]=4 1206 B9R1.35 O=C(O)c1cnc(S)s1 Amb27401807 [0,1,0,0,0,0|3,0,0]=4 1207 B9R1.35 O=C(O)c1coc(Br)n1 Amb21857043 [0,1,0,0,0,0|3,0,0]=4 1208 B9R1.35 O=C(O)c1coc(Cl)n1 Amb16232458 [0,1,0,0,0,0|3,0,0]=4 1209 B9R1.35 O=C(O)c1coc(F)n1 Amb22756381 [0,1,0,0,0,0|3,0,0]=4 1210 B9R1.35 O=C(O)c1coc(I)n1 Amb22000930 [0,1,0,0,0,0|3,0,0]=4 1211 B9R1.35 O=C(O)c1coc(O)n1 Amb24481698 [0,1,0,0,0,0|3,0,0]=4 1212 B9R1.35 O=C(O)c1coc(S)n1 Amb27212072 [0,1,0,0,0,0|3,0,0]=4 1213 B9R1.35 O=C(O)c1csc(Br)n1 Amb2455706 [0,1,0,0,0,0|3,0,0]=4 1214 B9R1.35 O=C(O)c1csc(Br)n1 Amb32665794 [0,1,0,0,0,0|3,0,0]=4 1215 B9R1.35 O=C(O)c1csc(Cl)n1 Amb8630269 [0,1,0,0,0,0|3,0,0]=4 1216 B9R1.35 O=C(O)c1csc(F)n1 Amb25147077 [0,1,0,0,0,0|3,0,0]=4 1217 B9R1.35 O=C(O)c1csc(I)n1 Amb8630396 [0,1,0,0,0,0|3,0,0]=4 1218 B9R1.35 O=C(O)c1csc(O)n1 Amb27142660 [0,1,0,0,0,0|3,0,0]=4 1219 B9R1.35 O=C(O)c1csc(S)n1 Amb24480164 [0,1,0,0,0,0|3,0,0]=4 1220 B9R1.35 O=C(O)c1nc(Br)co1 Amb22754333 [0,1,0,0,0,0|1,1,0]=3 1221 B9R1.35 O=C(O)c1nc(Br)cs1 Amb13883510 [0,1,0,0,0,0|1,0,0]=2 1222 B9R1.35 O=C(O)c1nc(Cl)cs1 Amb26941525 [0,1,0,0,0,0|1,0,0]=2 1223 B9R1.35 O=C(O)c1nc(Cl)ns1 Amb28196534 [0,1,0,0,0,0|2,0,0]=3 1224 B9R1.35 O=C(O)c1nc(F)cs1 Amb27629831 [0,1,0,0,0,0|1,0,0]=2 1225 B9R1.35 O=C(O)c1nc(O)cs1 Amb35710163 [0,1,0,0,0,0|1,0,0]=2 1226 B9R1.35 O=C(O)c1ncc(Br)s1 Amb10606388 [0,1,0,0,0,0|1,0,0]=2 1227 B9R1.35 O=C(O)c1ncc(Cl)s1 Amb33543981 [0,1,0,0,0,0|1,0,0]=2 1228 B9R1.35 O=C(O)c1ncc(I)s1 Amb27866039 [0,1,0,0,0,0|1,0,0]=2 1229 B9R1.35 O=C(O)c1nnc(Br)o1 Amb18190404 [0,1,0,0,0,0|2,1,0]=4 1230 B9R1.35 O=C(O)c1nnc(Br)s1 Amb23437048 [0,1,0,0,0,0|2,0,0]=3 1231 B9R1.35 O=C(O)c1nnc(Cl)s1 Amb23402885 [0,1,0,0,0,0|2,0,0]=3 1232 B9R1.35 O=C(O)c1nnc(I)s1 Amb26929267 [0,1,0,0,0,0|2,0,0]=3 1233 B9R1.35 O=C(O)c1noc(Cl)n1 Amb27877582 [0,1,0,0,0,0|3,0,0]=4 1234 B9R1.35 O=C(O)c1noc(O)n1 Amb26962564 [0,1,0,0,0,0|3,0,0]=4 1235 B9R1.35 O=C(O)c1nsc(Cl)n1 Amb24681982 [0,1,0,0,0,0|3,0,0]=4 1236 B9R1.35 O=C([O-])c1cc([O-])on1 Amb33309471 [0,1,0,0,0,0|3,0,0]=4 1237 B9R1.35 O=C([O-])c1nc(Br)cs1 Amb33456257 [0,1,0,0,0,0|1,0,0]=2 1238 B9R1.35 O=C([O-])c1ncc(Br)s1 Amb32653175 [0,1,0,0,0,0|1,0,0]=2 1239 B9R1.35 O=C([O-])c1nnc(Br)s1 Amb33620604 [0,1,0,0,0,0|2,0,0]=3 1240 B9R1.35 O=C1CC(C(=O)O)=NN1 Amb18278720 [0,1,0,0,0,0|3,0,0]=4 1241 B9R1.35 O=C1CN=C(C(=O)O)N1 Amb24387402 [0,1,0,0,0,0|2,0,1]=4 1242 B9R1.35 O=C1CSC(C(=O)O)=N1 Amb27211941 [0,1,0,0,0,0|1,0,1]=3 1243 B9R1.35 O=C1N=C(C(=O)Cl)CN1 Amb26587208 [0,1,0,0,0,0|3,0,0]=4 1244 B9R1.35 O=C1N=C(C(=O)O)NN1 Amb18944041 [0,1,0,0,0,0|3,0,0]=4 1245 B9R1.35 O=C1N=C(C(=O)[O-])NO1 Amb33292492 [0,1,0,0,0,0|3,0,0]=4 1246 B9R1.35 O=C1NC=C(C(=O)O)S1 Amb33531086 [0,1,0,0,0,0|3,0,0]=4 1247 B9R1.35 O=C1NN=C(C(=O)O)N1 Amb19205315 [0,1,0,0,0,0|3,0,0]=4 1248 B9R1.35 O=C1NN=C(C(=O)O)N1 Amb21955579 [0,1,0,0,0,0|3,0,0]=4 1249 B9R1.35 O=C1NN=C(C(=O)[O-])N1 Amb22408706 [0,1,0,0,0,0|3,0,0]=4 1250 B9R1.35 O=C1NN=C(C(=O)[O-])N1 Amb22757735 [0,1,0,0,0,0|3,0,0]=4 1251 B9R1.35 O=S(Cl)c1ccc(Br)s1 Amb18577477 [0,1,0,0,0,0|3,0,0]=4 1252 B9R1.35 O=S(Cl)c1ccc(Cl)s1 Amb18066388 [0,1,0,0,0,0|3,0,0]=4 1253 B9R1.35 O=S(O)c1cc(Br)cs1 Amb18867802 [0,1,0,0,0,0|3,0,0]=4 1254 B9R1.35 O=S(O)c1ccc(Br)s1 Amb18571234 [0,1,0,0,0,0|3,0,0]=4 1255 B9R1.35 O=S(O)c1ccc(Cl)s1 Amb18560136 [0,1,0,0,0,0|3,0,0]=4 1256 B9R1.35 O=S([O-])c1cc(Br)cs1 Amb26014675 [0,1,0,0,0,0|3,0,0]=4 1257 B9R1.35 O=S([O-])c1ccc(Br)s1 Amb19929132 [0,1,0,0,0,0|3,0,0]=4 1258 B9R1.35 O=S([O-])c1ccc(Cl)s1 Amb24654148 [0,1,0,0,0,0|3,0,0]=4 1259 B9R1.35 O=[N+]([O-])c1cc(Br)cs1 Amb10574144 [0,1,0,0,0,0|3,0,0]=4 1260 B9R1.35 O=[N+]([O-])c1cc(Cl)cs1 Amb27162108 [0,1,0,0,0,0|3,0,0]=4 1261 B9R1.35 O=[N+]([O-])c1cc(F)cs1 Amb27455104 [0,1,0,0,0,0|3,0,0]=4 1262 B9R1.35 O=[N+]([O-])c1ccc(Br)s1 Amb2707740 [0,1,0,0,0,0|3,0,0]=4 1263 B9R1.35 O=[N+]([O-])c1ccc(Cl)s1 Amb10609919 [0,1,0,0,0,0|3,0,0]=4 1264 B9R1.35 O=[N+]([O-])c1ccc(F)s1 Amb19892814 [0,1,0,0,0,0|3,0,0]=4 1265 B9R1.35 O=[N+]([O-])c1ccc(I)s1 Amb6843922 [0,1,0,0,0,0|3,0,0]=4 1266 B9R1.35 O=[N+]([O-])c1ccc(O)s1 Amb21964257 [0,1,0,0,0,0|3,0,0]=4 1267 B9R1.35 O=[N+]([O-])c1ccc(S)s1 Amb33374248 [0,1,0,0,0,0|3,0,0]=4 1268 B9R1.35 O=[N+]([O-])c1ncc(Br)s1 Amb25720219 [0,1,0,0,0,0|2,0,0]=3 1269 B9R1.35 O=[N+]([O-])c1ncc(Cl)s1 Amb28323504 [0,1,0,0,0,0|2,0,0]=3 1270 B9R1.35 O=[N+]([O-])c1nnc(Br)s1 Amb19958185 [0,1,0,0,0,0|3,0,0]=4 1271 B9R1.35 [NH3+]c1nc(C(=O)O)cs1 Amb2694742 [0,1,0,0,0,0|3,0,0]=4 1272 B9R1.41 C=C(C)c1sccc1C Amb27235420 [0,1,0,0,0,0|2,0,0]=3 1273 B9R1.41 C=C(C)c1sccc1I Amb27225040 [0,1,0,0,0,0|2,0,0]=3 1274 B9R1.41 C=C1C=CC=C1C(C)=O Amb25861278 [0,1,0,0,0,0|2,0,0]=3 1275 B9R1.41 CC(=O)C1=C([Na])CC=C1 Amb28321995 [0,1,0,0,0,0|2,0,1]=4 1276 B9R1.41 CC(=O)C1=NNNC1=O Amb28054001 [0,1,0,0,0,0|3,0,0]=4 1277 B9R1.41 CC(=O)N1CC=CC1=O Amb22494822 [0,1,0,0,0,0|3,0,0]=4 1278 B9R1.41 CC(=O)N1SN=CC1=O Amb27826963 [0,1,0,0,0,0|3,0,0]=4 1279 B9R1.41 CC(=O)c1cccn1C Amb3940343 [0,1,0,0,0,0|1,0,1]=3 1280 B9R1.41 CC(=O)c1cccn1N Amb25188906 [0,1,0,0,0,0|1,0,1]=3 1281 B9R1.41 CC(=O)c1ccnn1C Amb1995284 [0,1,0,0,0,0|2,0,1]=4 1282 B9R1.41 CC(=O)c1ccoc1Br Amb26393759 [0,1,0,0,0,0|3,0,0]=4 1283 B9R1.41 CC(=O)c1ccoc1C Amb28054842 [0,1,0,0,0,0|3,0,0]=4 1284 B9R1.41 CC(=O)c1ccoc1Cl Amb26081241 [0,1,0,0,0,0|3,0,0]=4 1285 B9R1.41 CC(=O)c1ccoc1O Amb27607192 [0,1,0,0,0,0|3,0,0]=4 1286 B9R1.41 CC(=O)c1ccsc1Br Amb22498154 [0,1,0,0,0,0|3,0,0]=4 1287 B9R1.41 CC(=O)c1ccsc1Cl Amb25147022 [0,1,0,0,0,0|3,0,0]=4 1288 B9R1.41 CC(=O)c1ccsc1N Amb16231458 [0,1,0,0,0,0|3,0,0]=4 1289 B9R1.41 CC(=O)c1ccsc1O Amb27964081 [0,1,0,0,0,0|3,0,0]=4 1290 B9R1.41 CC(=O)c1ccsc1S Amb25185349 [0,1,0,0,0,0|3,0,0]=4 1291 B9R1.41 CC(=O)c1cncn1C Amb18145080 [0,1,0,0,0,0|2,0,1]=4 1292 B9R1.41 CC(=O)c1cncn1C Amb33141030 [0,1,0,0,0,0|2,0,1]=4 1293 B9R1.41 CC(=O)c1cncn1N Amb27786915 [0,1,0,0,0,0|2,0,1]=4 1294 B9R1.41 CC(=O)c1cocc1Br Amb27636721 [0,1,0,0,0,0|3,0,0]=4 1295 B9R1.41 CC(=O)c1cscc1Br Amb22500733 [0,1,0,0,0,0|3,0,0]=4 1296 B9R1.41 CC(=O)c1cscc1Cl Amb22899017 [0,1,0,0,0,0|3,0,0]=4 1297 B9R1.41 CC(=O)c1cscc1F Amb18202408 [0,1,0,0,0,0|3,0,0]=4 1298 B9R1.41 CC(=O)c1nccn1C Amb16230260 [0,1,0,0,0,0|1,0,0]=2 1299 B9R1.41 CC(=O)c1nccn1N Amb25887197 [0,1,0,0,0,0|1,0,0]=2 1300 B9R1.41 CC(=O)c1ncnn1C Amb10669475 [0,1,0,0,0,0|2,0,0]=3 1301 B9R1.41 CC(=O)c1ncoc1C Amb25245183 [0,1,0,0,0,0|2,0,0]=3 1302 B9R1.41 CC(=O)c1ncsc1Br Amb29892935 [0,1,0,0,0,0|2,0,0]=3 1303 B9R1.41 CC(=O)c1ncsc1C Amb18831707 [0,1,0,0,0,0|2,0,0]=3 1304 B9R1.41 CC(=O)c1ncsc1I Amb27652947 [0,1,0,0,0,0|2,0,0]=3 1305 B9R1.41 CC(=O)c1ncsc1N Amb27881679 [0,1,0,0,0,0|2,0,0]=3 1306 B9R1.41 CC(=O)c1ncsc1S Amb25945736 [0,1,0,0,0,0|2,0,0]=3 1307 B9R1.41 CC(=O)c1nncn1C Amb22900909 [0,1,0,0,0,0|2,0,0]=3 1308 B9R1.41 CC(=O)c1nnnn1C Amb18203298 [0,1,0,0,0,0|3,0,0]=4 1309 B9R1.41 CC(=O)c1nnsc1Cl Amb28129638 [0,1,0,0,0,0|3,0,0]=4 1310 B9R1.41 CC(=O)c1nnsc1N Amb18202484 [0,1,0,0,0,0|3,0,0]=4 1311 B9R1.41 CC(=O)c1nonc1C Amb1088876 [0,1,0,0,0,0|3,0,0]=4 1312 B9R1.41 CC(=O)c1nonc1N Amb18203287 [0,1,0,0,0,0|3,0,0]=4 1313 B9R1.41 CC(=O)c1nonc1N Amb33329424 [0,1,0,0,0,0|3,0,0]=4 1314 B9R1.41 CC(=O)c1nonc1O Amb18832653 [0,1,0,0,0,0|3,0,0]=4 1315 B9R1.41 CC(=O)c1nscc1Br Amb29864146 [0,1,0,0,0,0|2,0,0]=3 1316 B9R1.41 CC(=O)c1nsnc1C Amb27482939 [0,1,0,0,0,0|3,0,0]=4 1317 B9R1.41 CC(=O)c1occc1Br Amb19374756 [0,1,0,0,0,0|1,1,0]=3 1318 B9R1.41 CC(=O)c1occc1C Amb20668258 [0,1,0,0,0,0|1,1,0]=3 1319 B9R1.41 CC(=O)c1occc1Cl Amb27167140 [0,1,0,0,0,0|1,1,0]=3 1320 B9R1.41 CC(=O)c1occc1N Amb18832859 [0,1,0,0,0,0|1,1,0]=3 1321 B9R1.41 CC(=O)c1occc1O Amb28351437 [0,1,0,0,0,0|1,1,0]=3 1322 B9R1.41 CC(=O)c1oncc1C Amb18832846 [0,1,0,0,0,0|2,1,0]=4 1323 B9R1.41 CC(=O)c1sccc1Br Amb2440289 [0,1,0,0,0,0|1,0,0]=2 1324 B9R1.41 CC(=O)c1sccc1C Amb3940405 [0,1,0,0,0,0|1,0,0]=2 1325 B9R1.41 CC(=O)c1sccc1Cl Amb2415188 [0,1,0,0,0,0|1,0,0]=2 1326 B9R1.41 CC(=O)c1sccc1F Amb18831514 [0,1,0,0,0,0|1,0,0]=2 1327 B9R1.41 CC(=O)c1sccc1I Amb2611510 [0,1,0,0,0,0|1,0,0]=2 1328 B9R1.41 CC(=O)c1sccc1N Amb2724281 [0,1,0,0,0,0|1,0,0]=2 1329 B9R1.41 CC(=O)c1sccc1O Amb18202590 [0,1,0,0,0,0|1,0,0]=2 1330 B9R1.41 CC(=O)c1sccc1S Amb28195316 [0,1,0,0,0,0|1,0,0]=2 1331 B9R1.41 CC(=O)c1scnc1Br Amb18176253 [0,1,0,0,0,0|2,0,0]=3 1332 B9R1.41 CC(=O)c1scnc1C Amb7969579 [0,1,0,0,0,0|2,0,0]=3 1333 B9R1.41 CC(=O)c1scnc1N Amb18831647 [0,1,0,0,0,0|2,0,0]=3 1334 B9R1.41 CC(=O)c1sncc1Cl Amb28132861 [0,1,0,0,0,0|2,0,0]=3 1335 B9R1.41 CC(=O)c1sncc1N Amb18202585 [0,1,0,0,0,0|2,0,0]=3 1336 B9R1.41 CC(=O)c1snnc1C Amb18202588 [0,1,0,0,0,0|3,0,0]=4 1337 B9R1.41 CC(=O)n1cccc1Br Amb27488240 [0,1,0,0,0,0|3,0,0]=4 1338 B9R1.41 CC(=O)n1cccc1C Amb28285118 [0,1,0,0,0,0|3,0,0]=4 1339 B9R1.41 CC(Br)c1nccn1C Amb22270470 [0,1,0,0,0,0|2,0,1]=4 1340 B9R1.41 CC(C)=C1N=COC1=O Amb28135727 [0,1,0,0,0,0|3,0,0]=4 1341 B9R1.41 CC(C)=C1N=CSC1=O Amb27985280 [0,1,0,0,0,0|3,0,0]=4 1342 B9R1.41 CC(C)=C1NC=CC1=O Amb27844541 [0,1,0,0,0,0|2,0,1]=4 1343 B9R1.41 CC(C)c1nccn1C Amb33545330 [0,1,0,0,0,0|2,0,1]=4 1344 B9R1.41 CC(C)c1nccn1N Amb27228800 [0,1,0,0,0,0|2,0,1]=4 1345 B9R1.41 CC(Cl)c1nccn1C Amb22267315 [0,1,0,0,0,0|2,0,1]=4 1346 B9R1.41 CC(I)c1nccn1C Amb22267324 [0,1,0,0,0,0|2,0,1]=4 1347 B9R1.41 CC(N)c1nccn1C Amb28934931 [0,1,0,0,0,0|2,0,1]=4 1348 B9R1.41 CC(N)c1nccn1C Amb5722661 [0,1,0,0,0,0|2,0,1]=4 1349 B9R1.41 CC(N)c1sccc1Br Amb9620855 [0,1,0,0,0,0|2,0,1]=4 1350 B9R1.41 CC(N)c1sccc1Cl Amb26907233 [0,1,0,0,0,0|2,0,1]=4 1351 B9R1.41 CC(N)c1sccc1N Amb27828072 [0,1,0,0,0,0|2,0,1]=4 1352 B9R1.41 CC(O)c1nccn1C Amb22267722 [0,1,0,0,0,0|1,0,2]=4 1353 B9R1.41 CC(O)c1sccc1Cl Amb27838427 [0,1,0,0,0,0|1,0,2]=4 1354 B9R1.41 CC(S)c1nccn1C Amb22267832 [0,1,0,0,0,0|1,1,1]=4 1355 B9R1.41 CC(S)c1sccc1Br Amb32788826 [0,1,0,0,0,0|1,1,1]=4 1356 B9R1.41 CN(C)c1nccn1C Amb23437094 [0,1,0,0,0,0|3,0,0]=4 1357 B9R1.41 CN(C)c1scc[n+]1C Amb2609411 [0,1,0,0,0,0|2,0,1]=4 1358 B9R1.41 C[C@@H](N)c1nccn1C Amb24117440 [0,1,0,0,0,0|2,0,1]=4 1359 B9R1.41 C[C@@H](N)c1sccc1Br Amb24429631 [0,1,0,0,0,0|2,0,1]=4 1360 B9R1.41 C[C@@H](N)c1sccc1Cl Amb27975481 [0,1,0,0,0,0|2,0,1]=4 1361 B9R1.41 C[C@@H](N)c1sccc1N Amb27620285 [0,1,0,0,0,0|2,0,1]=4 1362 B9R1.41 C[C@@H](N)c1sccc1O Amb27779882 [0,1,0,0,0,0|2,0,1]=4 1363 B9R1.41 C[C@@H](O)c1nccn1C Amb25923996 [0,1,0,0,0,0|1,0,2]=4 1364 B9R1.41 C[C@@H](O)c1sccc1Br Amb27834430 [0,1,0,0,0,0|1,0,2]=4 1365 B9R1.41 C[C@@H](O)c1sccc1Cl Amb27978899 [0,1,0,0,0,0|1,0,2]=4 1366 B9R1.41 C[C@H](N)c1nccn1C Amb24436520 [0,1,0,0,0,0|2,0,1]=4 1367 B9R1.41 C[C@H](N)c1sccc1Br Amb26557953 [0,1,0,0,0,0|2,0,1]=4 1368 B9R1.41 C[C@H](N)c1sccc1Cl Amb26354987 [0,1,0,0,0,0|2,0,1]=4 1369 B9R1.41 C[C@H](N)c1sccc1I Amb27962883 [0,1,0,0,0,0|2,0,1]=4 1370 B9R1.41 C[C@H](O)c1nccn1C Amb26340398 [0,1,0,0,0,0|1,0,2]=4 1371 B9R1.41 C[C@H](O)c1sccc1Br Amb26038653 [0,1,0,0,0,0|1,0,2]=4 1372 B9R1.41 C[C@H](O)c1sccc1Cl Amb24363179 [0,1,0,0,0,0|1,0,2]=4 1373 B9R1.41 C\C(O)=C1\OC=CC1=O Amb25686104 [0,1,0,0,0,0|1,1,1]=4 1374 B9R1.41 Cc1ccnn1C(N)=O Amb17778918 [0,1,0,0,0,0|3,0,0]=4 1375 B9R1.41 Cc1ccoc1C(=O)Cl Amb2725685 [0,1,0,0,0,0|2,1,0]=4 1376 B9R1.41 Cc1ccoc1C(=O)O Amb1156943 [0,1,0,0,0,0|2,1,0]=4 1377 B9R1.41 Cc1ccoc1C(N)=O Amb8998946 [0,1,0,0,0,0|2,1,0]=4 1378 B9R1.41 Cc1ccsc1C(=N)N Amb8834124 [0,1,0,0,0,0|3,0,0]=4 1379 B9R1.41 Cc1ccsc1C(=O)Cl Amb2689730 [0,1,0,0,0,0|2,0,0]=3 1380 B9R1.41 Cc1ccsc1C(=O)O Amb2695360 [0,1,0,0,0,0|2,0,0]=3 1381 B9R1.41 Cc1ccsc1C(=O)[O-] Amb15691659 [0,1,0,0,0,0|2,0,0]=3 1382 B9R1.41 Cc1ccsc1C(C)Cl Amb28049255 [0,1,0,0,0,0|2,0,1]=4 1383 B9R1.41 Cc1ccsc1C(C)N Amb18279251 [0,1,0,0,0,0|2,0,1]=4 1384 B9R1.41 Cc1ccsc1C(C)O Amb24556518 [0,1,0,0,0,0|1,0,2]=4 1385 B9R1.41 Cc1ccsc1C(C)S Amb24505030 [0,1,0,0,0,0|1,1,1]=4 1386 B9R1.41 Cc1ccsc1C(N)=O Amb8997731 [0,1,0,0,0,0|2,0,0]=3 1387 B9R1.41 Cc1ccsc1C(N)=S Amb1116860 [0,1,0,0,0,0|2,1,0]=4 1388 B9R1.41 Cc1ccsc1N(C)C Amb27441901 [0,1,0,0,0,0|3,0,0]=4 1389 B9R1.41 Cc1ccsc1S(=O)[O-] Amb32754089 [0,1,0,0,0,0|3,0,0]=4 1390 B9R1.41 Cc1ccsc1[C@@H](C)N Amb27235595 [0,1,0,0,0,0|2,0,1]=4 1391 B9R1.41 Cc1ccsc1[C@@H](C)O Amb25842069 [0,1,0,0,0,0|1,0,2]=4 1392 B9R1.41 Cc1ccsc1[C@H](C)N Amb25710219 [0,1,0,0,0,0|2,0,1]=4 1393 B9R1.41 Cc1ccsc1[C@H](C)O Amb25088944 [0,1,0,0,0,0|1,0,2]=4 1394 B9R1.41 Cc1ccsc1[N+](=O)[O-] Amb27862325 [0,1,0,0,0,0|3,0,0]=4 1395 B9R1.41 Cc1cnsc1C(=O)O Amb8439091 [0,1,0,0,0,0|3,0,0]=4 1396 B9R1.41 Cc1conc1C(=O)O Amb33545063 [0,1,0,0,0,0|3,0,0]=4 1397 B9R1.41 Cc1ncsc1C(=O)Cl Amb6743387 [0,1,0,0,0,0|3,0,0]=4 1398 B9R1.41 Cc1ncsc1C(=O)O Amb6336150 [0,1,0,0,0,0|3,0,0]=4 1399 B9R1.41 Cc1ocnc1C(=O)Cl Amb10071436 [0,1,0,0,0,0|3,0,0]=4 1400 B9R1.41 Cc1ocnc1C(=O)O Amb10067408 [0,1,0,0,0,0|3,0,0]=4 1401 B9R1.41 Cc1ocnc1C(N)=O Amb25141600 [0,1,0,0,0,0|3,0,0]=4 1402 B9R1.41 Cc1scnc1C(=O)O Amb10067521 [0,1,0,0,0,0|3,0,0]=4 1403 B9R1.41 Cc1scnc1C(N)=O Amb22498462 [0,1,0,0,0,0|3,0,0]=4 1404 B9R1.41 Cn1cccc1C(=O)O Amb1151288 [0,1,0,0,0,0|2,0,1]=4 1405 B9R1.41 Cn1cccc1C(N)=O Amb2604322 [0,1,0,0,0,0|2,0,1]=4 1406 B9R1.41 Cn1ccnc1C(=N)N Amb21960774 [0,1,0,0,0,0|3,0,0]=4 1407 B9R1.41 Cn1ccnc1C(=N)N Amb24477878 [0,1,0,0,0,0|3,0,0]=4 1408 B9R1.41 Cn1ccnc1C(=O)Cl Amb10844843 [0,1,0,0,0,0|2,0,0]=3 1409 B9R1.41 Cn1ccnc1C(=O)Cl Amb33496155 [0,1,0,0,0,0|2,0,0]=3 1410 B9R1.41 Cn1ccnc1C(=O)O Amb1107172 [0,1,0,0,0,0|2,0,0]=3 1411 B9R1.41 Cn1ccnc1C(=O)[O-] Amb13951582 [0,1,0,0,0,0|2,0,0]=3 1412 B9R1.41 Cn1ccnc1C(=O)[O-] Amb33512890 [0,1,0,0,0,0|2,0,0]=3 1413 B9R1.41 Cn1ccnc1C(=O)[O-] Amb33542621 [0,1,0,0,0,0|2,0,0]=3 1414 B9R1.41 Cn1ccnc1C(N)=O Amb2415054 [0,1,0,0,0,0|2,0,0]=3 1415 B9R1.41 Cn1ccnc1C(N)=S Amb22059424 [0,1,0,0,0,0|2,1,0]=4 1416 B9R1.41 Cn1ccnc1S(=O)[O-] Amb32754077 [0,1,0,0,0,0|3,0,0]=4 1417 B9R1.41 Cn1ccnc1S(C)=O Amb26031872 [0,1,0,0,0,0|2,0,0]=3 1418 B9R1.41 Cn1ccnc1[N+](=O)[O-] Amb10573953 [0,1,0,0,0,0|3,0,0]=4 1419 B9R1.41 Cn1cnnc1C(=O)O Amb25368216 [0,1,0,0,0,0|3,0,0]=4 1420 B9R1.41 Cn1cnnc1C(=O)[O-] Amb22504627 [0,1,0,0,0,0|3,0,0]=4 1421 B9R1.41 Cn1cnnc1C(=O)[O-] Amb33457379 [0,1,0,0,0,0|3,0,0]=4 1422 B9R1.41 Cn1ncnc1C(=O)O Amb16230756 [0,1,0,0,0,0|3,0,0]=4 1423 B9R1.41 Cn1ncnc1C(=O)[O-] Amb28934989 [0,1,0,0,0,0|3,0,0]=4 1424 B9R1.41 N=C(N)c1sccc1Br Amb24478707 [0,1,0,0,0,0|3,0,0]=4 1425 B9R1.41 N=C(N)c1sccc1Cl Amb24532417 [0,1,0,0,0,0|3,0,0]=4 1426 B9R1.41 NC(=O)c1cccn1N Amb10067897 [0,1,0,0,0,0|2,0,1]=4 1427 B9R1.41 NC(=O)c1cccn1N Amb23440206 [0,1,0,0,0,0|2,0,1]=4 1428 B9R1.41 NC(=O)c1cccn1O Amb28136084 [0,1,0,0,0,0|2,0,1]=4 1429 B9R1.41 NC(=O)c1ncsc1Br Amb22753107 [0,1,0,0,0,0|3,0,0]=4 1430 B9R1.41 NC(=O)c1ncsc1Cl Amb23402176 [0,1,0,0,0,0|3,0,0]=4 1431 B9R1.41 NC(=O)c1ncsc1N Amb18643989 [0,1,0,0,0,0|3,0,0]=4 1432 B9R1.41 NC(=O)c1ncsc1S Amb26872701 [0,1,0,0,0,0|3,0,0]=4 1433 B9R1.41 NC(=O)c1nscc1N Amb1089974 [0,1,0,0,0,0|3,0,0]=4 1434 B9R1.41 NC(=O)c1occc1N Amb27882622 [0,1,0,0,0,0|2,1,0]=4 1435 B9R1.41 NC(=O)c1occc1N Amb33624323 [0,1,0,0,0,0|2,1,0]=4 1436 B9R1.41 NC(=O)c1sccc1Br Amb2782198 [0,1,0,0,0,0|2,0,0]=3 1437 B9R1.41 NC(=O)c1sccc1Cl Amb2433270 [0,1,0,0,0,0|2,0,0]=3 1438 B9R1.41 NC(=O)c1sccc1F Amb24681772 [0,1,0,0,0,0|2,0,0]=3 1439 B9R1.41 NC(=O)c1sccc1I Amb27667540 [0,1,0,0,0,0|2,0,0]=3 1440 B9R1.41 NC(=O)c1sccc1N Amb2684537 [0,1,0,0,0,0|2,0,0]=3 1441 B9R1.41 NC(=O)c1sccc1O Amb1398894 [0,1,0,0,0,0|2,0,0]=3 1442 B9R1.41 NC(=O)c1sccc1S Amb24594973 [0,1,0,0,0,0|2,0,0]=3 1443 B9R1.41 NC(=O)c1scnc1Cl Amb25714788 [0,1,0,0,0,0|3,0,0]=4 1444 B9R1.41 NC(=S)c1sccc1Br Amb2725775 [0,1,0,0,0,0|2,1,0]=4 1445 B9R1.41 NC(=S)c1sccc1Cl Amb27785656 [0,1,0,0,0,0|2,1,0]=4 1446 B9R1.41 Nc1ccoc1C(=O)O Amb18832709 [0,1,0,0,0,0|2,1,0]=4 1447 B9R1.41 Nc1ccsc1C(=O)O Amb19888389 [0,1,0,0,0,0|2,0,0]=3 1448 B9R1.41 Nc1ccsc1C(=O)O Amb2695071 [0,1,0,0,0,0|2,0,0]=3 1449 B9R1.41 Nc1ccsc1C(=O)[O-] Amb35782038 [0,1,0,0,0,0|2,0,0]=3 1450 B9R1.41 Nc1ccsc1[N+](=O)[O-] Amb22263237 [0,1,0,0,0,0|3,0,0]=4 1451 B9R1.41 Nc1cnsc1C(=O)O Amb18831515 [0,1,0,0,0,0|3,0,0]=4 1452 B9R1.41 Nc1csnc1C(=O)O Amb10068068 [0,1,0,0,0,0|3,0,0]=4 1453 B9R1.41 Nc1csnc1C(=O)O Amb1068363 [0,1,0,0,0,0|3,0,0]=4 1454 B9R1.41 Nc1csnc1C(=O)O Amb20669014 [0,1,0,0,0,0|3,0,0]=4 1455 B9R1.41 Nc1ncsc1C(=O)O Amb24481890 [0,1,0,0,0,0|3,0,0]=4 1456 B9R1.41 Nc1scnc1C(=O)O Amb25302896 [0,1,0,0,0,0|3,0,0]=4 1457 B9R1.41 Nn1cccc1C(=O)O Amb28143308 [0,1,0,0,0,0|2,0,1]=4 1458 B9R1.41 Nn1ccnc1C(=O)O Amb24470695 [0,1,0,0,0,0|2,0,0]=3 1459 B9R1.41 O=C(Cl)c1nscc1Br Amb30013699 [0,1,0,0,0,0|3,0,0]=4 1460 B9R1.41 O=C(Cl)c1occc1Br Amb7990095 [0,1,0,0,0,0|2,1,0]=4 1461 B9R1.41 O=C(Cl)c1occc1Cl Amb25147033 [0,1,0,0,0,0|2,1,0]=4 1462 B9R1.41 O=C(Cl)c1occc1I Amb28196414 [0,1,0,0,0,0|2,1,0]=4 1463 B9R1.41 O=C(Cl)c1sccc1Br Amb2725784 [0,1,0,0,0,0|2,0,0]=3 1464 B9R1.41 O=C(Cl)c1sccc1Cl Amb2686484 [0,1,0,0,0,0|2,0,0]=3 1465 B9R1.41 O=C(Cl)c1scnc1Cl Amb27964265 [0,1,0,0,0,0|3,0,0]=4 1466 B9R1.41 O=C(O)C1=CC=CC1Cl Amb27780445 [0,1,0,0,0,0|3,0,0]=4 1467 B9R1.41 O=C(O)c1ncsc1Br Amb10067425 [0,1,0,0,0,0|3,0,0]=4 1468 B9R1.41 O=C(O)c1ncsc1S Amb26964290 [0,1,0,0,0,0|3,0,0]=4 1469 B9R1.41 O=C(O)c1nocc1Br Amb27813383 [0,1,0,0,0,0|3,0,0]=4 1470 B9R1.41 O=C(O)c1nocc1Cl Amb33496115 [0,1,0,0,0,0|3,0,0]=4 1471 B9R1.41 O=C(O)c1nocc1O Amb22055438 [0,1,0,0,0,0|3,0,0]=4 1472 B9R1.41 O=C(O)c1nscc1Br Amb25827572 [0,1,0,0,0,0|3,0,0]=4 1473 B9R1.41 O=C(O)c1nscc1I Amb25161872 [0,1,0,0,0,0|3,0,0]=4 1474 B9R1.41 O=C(O)c1occc1Br Amb7990094 [0,1,0,0,0,0|2,1,0]=4 1475 B9R1.41 O=C(O)c1occc1Cl Amb18202245 [0,1,0,0,0,0|2,1,0]=4 1476 B9R1.41 O=C(O)c1occc1F Amb26497027 [0,1,0,0,0,0|2,1,0]=4 1477 B9R1.41 O=C(O)c1sccc1Br Amb2685506 [0,1,0,0,0,0|2,0,0]=3 1478 B9R1.41 O=C(O)c1sccc1Cl Amb2686485 [0,1,0,0,0,0|2,0,0]=3 1479 B9R1.41 O=C(O)c1sccc1F Amb33542984 [0,1,0,0,0,0|2,0,0]=3 1480 B9R1.41 O=C(O)c1sccc1I Amb2688890 [0,1,0,0,0,0|2,0,0]=3 1481 B9R1.41 O=C(O)c1sccc1O Amb10069920 [0,1,0,0,0,0|2,0,0]=3 1482 B9R1.41 O=C(O)c1scnc1Br Amb18778174 [0,1,0,0,0,0|3,0,0]=4 1483 B9R1.41 O=C(O)c1scnc1Cl Amb6479171 [0,1,0,0,0,0|3,0,0]=4 1484 B9R1.41 O=C(O)c1scnc1S Amb27490987 [0,1,0,0,0,0|3,0,0]=4 1485 B9R1.41 O=C(O)c1sncc1Br Amb17595558 [0,1,0,0,0,0|3,0,0]=4 1486 B9R1.41 O=C(O)c1sncc1Cl Amb17594060 [0,1,0,0,0,0|3,0,0]=4 1487 B9R1.41 O=C([O-])c1sccc1Cl Amb15691661 [0,1,0,0,0,0|2,0,0]=3 1488 B9R1.41 O=N(=O)c1sccc1Br Amb20620585 [0,1,0,0,0,0|3,0,0]=4 1489 B9R1.41 O=S([O-])c1sccc1Br Amb28049362 [0,1,0,0,0,0|3,0,0]=4 1490 B9R1.41 O=S([O-])c1sccc1Cl Amb32755324 [0,1,0,0,0,0|3,0,0]=4 1491 B9R1.41 O=S([O-])c1sccc1F Amb32755170 [0,1,0,0,0,0|3,0,0]=4 1492 B9R1.41 O=[N+]([O-])c1sccc1Br Amb2611394 [0,1,0,0,0,0|3,0,0]=4 1493 B9R1.41 O=[N+]([O-])c1sccc1Cl Amb33542894 [0,1,0,0,0,0|3,0,0]=4 1494 B9R1.41 O=[N+]([O-])c1sccc1F Amb27170997 [0,1,0,0,0,0|3,0,0]=4 1495 B9R1.41 O=[N+]([O-])c1sccc1O Amb5720115 [0,1,0,0,0,0|3,0,0]=4 1496 B7R0.4 CC(=O)C=C=CCO Amb28284681 [0,0,1,0,0,0|1,1,1]=4 1497 B7R0.4 CC(=O)CS\C=N\O Amb27973055 [0,0,1,0,0,0|2,0,1]=4 1498 B7R0.4 CC(=O)C\C=C\C=O Amb27165276 [0,0,1,0,0,0|1,1,1]=4 1499 B7R0.4 CC(=O)OC\C=C/Br Amb26652075 [0,0,1,0,0,0|3,0,0]=4 1500 B7R0.4 CC(=O)OC\C=C/Cl Amb27843145 [0,0,1,0,0,0|3,0,0]=4 1501 B7R0.4 CC(=O)OC\C=C\Br Amb27467221 [0,0,1,0,0,0|3,0,0]=4 1502 B7R0.4 CC(=O)\C=C/C=C\Br Amb27858614 [0,0,1,0,0,0|2,0,0]=3 1503 B7R0.4 CC(=O)\C=C\C=C\Cl Amb27233379 [0,0,1,0,0,0|2,0,0]=3 1504 B7R0.4 CC(=O)\C=N\NC#N Amb27828848 [0,0,1,0,0,0|2,0,1]=4 1505 B7R0.4 CC(C)=CCNC=N Amb28057742 [0,0,1,0,0,0|3,0,0]=4 1506 B7R0.4 CC(C)=C\C=C/C=O Amb27169113 [0,0,1,0,0,0|2,1,0]=4 1507 B7R0.4 CCC=C=CC(C)=O Amb25830543 [0,0,1,0,0,0|2,0,1]=4 1508 B7R0.4 C\C=C/C=C/C(C)=O Amb28129038 [0,0,1,0,0,0|2,0,0]=3 1509 B7R0.4 C\C=C\C=C\C(=O)Cl Amb32664141 [0,0,1,0,0,0|3,0,0]=4 1510 B7R0.4 C\C=C\C=C\C(=O)O Amb17784698 [0,0,1,0,0,0|3,0,0]=4 1511 B7R0.4 C\C=C\C=C\C(=O)[O-] Amb33512746 [0,0,1,0,0,0|3,0,0]=4 1512 B7R0.4 C\C=C\C=C\C(=O)[O-] Amb33723188 [0,0,1,0,0,0|3,0,0]=4 1513 B7R0.4 C\C=C\C=C\C(C)=O Amb17593137 [0,0,1,0,0,0|2,0,0]=3 1514 B7R0.4 C\C=C\C=C\C(N)=O Amb28400805 [0,0,1,0,0,0|3,0,0]=4 1515 B7R0.4 C\C=C\CCC(C)=O Amb9031579 [0,0,1,0,0,0|2,0,1]=4 1516 B7R0.4 C\C=C\COC(C)=O Amb6366590 [0,0,1,0,0,0|3,0,0]=4 1517 B7R0.4 O=C(O)\C=C\C=C\Cl Amb28189602 [0,0,1,0,0,0|3,0,0]=4 1518 B7R0.5 C=C(\C=C\C)C(C)=O Amb25712751 [0,0,1,0,0,0|2,0,1]=4 1519 B7R0.5 C=CCC(=C)C(=O)O Amb18641687 [0,0,1,0,0,0|3,0,0]=4 1520 B7R0.5 C=CCC(=C)C(N)=O Amb27845092 [0,0,1,0,0,0|3,0,0]=4 1521 B7R0.5 C=CCC(=O)C(=C)C Amb17593136 [0,0,1,0,0,0|2,1,0]=4 1522 B7R0.5 C=CCC(=O)C(=O)O Amb25890017 [0,0,1,0,0,0|2,1,0]=4 1523 B7R0.5 C=CCC(Br)C(C)=O Amb27760403 [0,0,1,0,0,0|2,0,1]=4 1524 B7R0.5 C=CCC(C)C(C)=O Amb19373098 [0,0,1,0,0,0|2,0,1]=4 1525 B7R0.5 C=CCC(F)C(C)=O Amb19889753 [0,0,1,0,0,0|2,0,1]=4 1526 B7R0.5 C=CCC(N)C(C)=O Amb27194092 [0,0,1,0,0,0|1,0,2]=4 1527 B7R0.5 C=CCC(O)C(C)=O Amb26451431 [0,0,1,0,0,0|1,1,1]=4 1528 B7R0.5 C=CCN(Br)C(C)=O Amb28316145 [0,0,1,0,0,0|3,0,0]=4 1529 B7R0.5 C=CCN(C)C(C)=O Amb4318131 [0,0,1,0,0,0|3,0,0]=4 1530 B7R0.5 C=CCN(S)C(N)=O Amb27596029 [0,0,1,0,0,0|3,0,0]=4 1531 B7R0.5 C=CC[C@H](C)C(C)=O Amb26641913 [0,0,1,0,0,0|2,0,1]=4 1532 B7R0.5 C=COC(=O)C(=C)C Amb22045212 [0,0,1,0,0,0|2,1,0]=4 1533 B7R0.5 C=C\C=C(/Cl)C(=O)O Amb18642910 [0,0,1,0,0,0|3,0,0]=4 1534 B7R0.5 C=C\C=C(\C)C(=O)O Amb27221069 [0,0,1,0,0,0|3,0,0]=4 1535 B7R0.5 CC(=O)C(=O)CC=O Amb24524264 [0,0,1,0,0,0|2,1,0]=4 1536 B7R0.5 CC(=O)\C(C)=C\C=O Amb28208341 [0,0,1,0,0,0|3,0,0]=4 1537 B7R0.5 CC(=O)\C(C)=N\C=O Amb28316244 [0,0,1,0,0,0|2,0,0]=3 1538 B7R0.5 CCSC(=O)C(C)=O Amb27972957 [0,0,1,0,0,0|1,0,2]=4 1539 B7R0.5 CO\N=C(/Cl)C(C)=O Amb28322041 [0,0,1,0,0,0|2,0,1]=4 1540 B7R0.15 CC(=O)\C(C#N)=N\N Amb27796830 [0,0,1,0,0,0|3,0,0]=4 1541 B7R0.15 CC(=O)\C(C#N)=N\O Amb27191777 [0,0,1,0,0,0|3,0,0]=4 1542 B7R0.15 CC(=O)\C(C=O)=N\N Amb26943899 [0,0,1,0,0,0|3,0,0]=4 1543 B7R0.15 CC(=O)\C(C=O)=N\O Amb27848201 [0,0,1,0,0,0|3,0,0]=4 1544 B7R0.15 CC(=O)\C(CCl)=N/O Amb28315687 [0,0,1,0,0,0|3,0,0]=4 1545 B7R0.15 CC(=O)\C(CCl)=N\O Amb26041025 [0,0,1,0,0,0|3,0,0]=4 1546 B7R0.15 CC\C(=N\O)C(C)=O Amb28198610 [0,0,1,0,0,0|2,0,1]=4 1547 B7R0.15 CS\C(=C\O)C(C)=O Amb27974462 [0,0,1,0,0,0|2,0,1]=4 1548 B7R0.15 CS\C(=N/O)C(C)=O Amb27854932 [0,0,1,0,0,0|1,0,1]=3 1549 B9R2.2 c1coc(C2CC2)n1 Amb17399789 [0,0,0,1,0,0|1,1,1]=4 1550 B9R2.2 c1csc(C2CC2)c1 Amb24323171 [0,0,0,1,0,0|2,0,1]=4 1551 B9R2.2 c1csc(C2CC2)n1 Amb10601012 [0,0,0,1,0,0|1,0,1]=3 1552 B9R2.2 c1csc(C2CN2)c1 Amb18222208 [0,0,0,1,0,0|2,0,1]=4 1553 B9R2.2 c1csc(C2CO2)c1 Amb1140287 [0,0,0,1,0,0|1,0,2]=4 1554 B9R2.2 c1csc(C2CO2)n1 Amb26850759 [0,0,0,1,0,0|0,0,2]=3 1555 B9R2.2 c1csc([C@@H]2CO2)c1 Amb24384733 [0,0,0,1,0,0|1,0,2]=4 1556 B9R2.2 c1csc([C@@H]2CO2)n1 Amb27952634 [0,0,0,1,0,0|0,0,2]=3 1557 B9R2.2 c1csc([C@H]2CO2)c1 Amb27395531 [0,0,0,1,0,0|1,0,2]=4 1558 B9R2.2 c1csc([C@H]2CO2)n1 Amb25126543 [0,0,0,1,0,0|0,0,2]=3 1559 B9R2.7 O=C1CC2C=CCC12 Amb8631505 [0,0,0,1,0,0|2,0,1]=4 1560 B9R2.7 O=C1C[C@@H]2C=CC[C@H]12 Amb22735988 [0,0,0,1,0,0|2,0,1]=4 1561 B9R2.7 O=C1C[C@H]2C=CC[C@H]12 Amb25962489 [0,0,0,1,0,0|2,0,1]=4 1562 B7R1.18 CC(=O)C1=CCC1 Amb23453500 [0,0,0,0,1,0|1,0,1]=3 1563 B7R1.18 CC(=O)N1C=CC1 Amb22001815 [0,0,0,0,1,0|2,0,0]=3 1564 B7R1.18 O=C(O)C1=CCC1 Amb17593068 [0,0,0,0,1,0|2,0,1]=4 1565 B7R1.18 O=C([O-])C1=CCC1 Amb34165365 [0,0,0,0,1,0|2,0,1]=4 1566 B9R1.6 C=C(Br)c1ccccn1 Amb2447497 [0,0,0,0,0,1|2,0,1]=4 1567 B9R1.6 C=C(C)c1ccccc1 Amb8394996 [0,0,0,0,0,1|3,0,0]=4 1568 B9R1.6 C=C(C)c1ccccn1 Amb25077592 [0,0,0,0,0,1|2,0,0]=3 1569 B9R1.6 C=C(C)c1cccnc1 Amb26389581 [0,0,0,0,0,1|2,0,0]=3 1570 B9R1.6 C=C(C)c1cccnn1 Amb32641600 [0,0,0,0,0,1|2,0,0]=3 1571 B9R1.6 C=C(C)c1ccncc1 Amb25126374 [0,0,0,0,0,1|3,0,0]=4 1572 B9R1.6 C=C(C)c1cnccn1 Amb26942610 [0,0,0,0,0,1|2,0,0]=3 1573 B9R1.6 C=C(F)c1ccccn1 Amb20248373 [0,0,0,0,0,1|2,0,1]=4 1574 B9R1.6 CC(=N)c1cccnc1 Amb22170296 [0,0,0,0,0,1|2,0,0]=3 1575 B9R1.6 CC(=N)c1ccnnc1 Amb28323587 [0,0,0,0,0,1|3,0,0]=4 1576 B9R1.6 CC(=N)c1cncnc1 Amb27847217 [0,0,0,0,0,1|3,0,0]=4 1577 B9R1.6 CC(=O)C1=CNCCS1 Amb25691015 [0,0,0,0,0,1|0,0,3]=4 1578 B9R1.6 CC(=O)C1=CSCCC1 Amb27803691 [0,0,0,0,0,1|1,0,2]=4 1579 B9R1.6 CC(=O)C1=NCCSC1 Amb24620482 [0,0,0,0,0,1|0,0,2]=3 1580 B9R1.6 CC(=O)C1C=CC=CN1 Amb27849933 [0,0,0,0,0,1|1,0,2]=4 1581 B9R1.6 CC(=O)C1CC=CCC1 Amb27643727 [0,0,0,0,0,1|2,0,1]=4 1582 B9R1.6 CC(=O)C1CCC=CN1 Amb25094747 [0,0,0,0,0,1|1,0,2]=4 1583 B9R1.6 CC(=O)C1CCC=CO1 Amb24650635 [0,0,0,0,0,1|1,1,1]=4 1584 B9R1.6 CC(=O)C1CCC=NC1 Amb25073951 [0,0,0,0,0,1|1,0,2]=4 1585 B9R1.6 CC(=O)[C@@H]1CC=CCC1 Amb26643097 [0,0,0,0,0,1|2,0,1]=4 1586 B9R1.6 CC(=O)[C@H]1CCC=CO1 Amb25349063 [0,0,0,0,0,1|1,1,1]=4 1587 B9R1.6 CC(=O)c1ccccc1 Amb2792761 [0,0,0,0,0,1|2,0,0]=3 1588 B9R1.6 CC(=O)c1ccccn1 Amb932786 [0,0,0,0,0,1|1,0,0]=2 1589 B9R1.6 CC(=O)c1cccnc1 Amb2610530 [0,0,0,0,0,1|1,0,0]=2 1590 B9R1.6 CC(=O)c1cccnn1 Amb20242017 [0,0,0,0,0,1|1,0,0]=2 1591 B9R1.6 CC(=O)c1ccncc1 Amb2792762 [0,0,0,0,0,1|2,0,0]=3 1592 B9R1.6 CC(=O)c1ccncn1 Amb19959228 [0,0,0,0,0,1|1,0,0]=2 1593 B9R1.6 CC(=O)c1ccnnc1 Amb19958070 [0,0,0,0,0,1|2,0,0]=3 1594 B9R1.6 CC(=O)c1cnccn1 Amb2684281 [0,0,0,0,0,1|1,0,0]=2 1595 B9R1.6 CC(=O)c1cncnc1 Amb8631038 [0,0,0,0,0,1|2,0,0]=3 1596 B9R1.6 CC(=O)c1cncnn1 Amb18832971 [0,0,0,0,0,1|2,0,0]=3 1597 B9R1.6 CC(=O)c1cnncn1 Amb18203342 [0,0,0,0,0,1|2,0,0]=3 1598 B9R1.6 CC(=O)c1ncccn1 Amb33534997 [0,0,0,0,0,1|1,0,0]=2 1599 B9R1.6 CC(=O)c1nccnn1 Amb26029644 [0,0,0,0,0,1|1,0,0]=2 1600 B9R1.6 CC(Br)c1ccccn1 Amb6770323 [0,0,0,0,0,1|2,0,1]=4 1601 B9R1.6 CC(Br)c1ccccn1 Amb8835436 [0,0,0,0,0,1|2,0,1]=4 1602 B9R1.6 CC(Br)c1cccnc1 Amb33552368 [0,0,0,0,0,1|2,0,1]=4 1603 B9R1.6 CC(Br)c1cccnc1 Amb8835401 [0,0,0,0,0,1|2,0,1]=4 1604 B9R1.6 CC(Br)c1cnccn1 Amb21862010 [0,0,0,0,0,1|2,0,1]=4 1605 B9R1.6 CC(C)c1ccccn1 Amb8438962 [0,0,0,0,0,1|2,0,1]=4 1606 B9R1.6 CC(C)c1cccnc1 Amb24320774 [0,0,0,0,0,1|2,0,1]=4 1607 B9R1.6 CC(C)c1cccnn1 Amb26572070 [0,0,0,0,0,1|2,0,1]=4 1608 B9R1.6 CC(C)c1ccncn1 Amb24070425 [0,0,0,0,0,1|2,0,1]=4 1609 B9R1.6 CC(Cl)c1ccccn1 Amb10610197 [0,0,0,0,0,1|2,0,1]=4 1610 B9R1.6 CC(Cl)c1ccccn1 Amb9205056 [0,0,0,0,0,1|2,0,1]=4 1611 B9R1.6 CC(Cl)c1cccnc1 Amb13952205 [0,0,0,0,0,1|2,0,1]=4 1612 B9R1.6 CC(Cl)c1cccnc1 Amb9205037 [0,0,0,0,0,1|2,0,1]=4 1613 B9R1.6 CC(Cl)c1ccncn1 Amb27245210 [0,0,0,0,0,1|2,0,1]=4 1614 B9R1.6 CC(Cl)c1cnccn1 Amb20618636 [0,0,0,0,0,1|2,0,1]=4 1615 B9R1.6 CC(Cl)c1ncccn1 Amb26326722 [0,0,0,0,0,1|2,0,1]=4 1616 B9R1.6 CC(Cl)c1ncccn1 Amb32668192 [0,0,0,0,0,1|2,0,1]=4 1617 B9R1.6 CC(N)c1ccccn1 Amb1102610 [0,0,0,0,0,1|2,0,1]=4 1618 B9R1.6 CC(N)c1ccccn1 Amb22265614 [0,0,0,0,0,1|2,0,1]=4 1619 B9R1.6 CC(N)c1ccccn1 Amb24064899 [0,0,0,0,0,1|2,0,1]=4 1620 B9R1.6 CC(N)c1ccccn1 Amb31206895 [0,0,0,0,0,1|2,0,1]=4 1621 B9R1.6 CC(N)c1cccnc1 Amb1214297 [0,0,0,0,0,1|2,0,1]=4 1622 B9R1.6 CC(N)c1cccnc1 Amb22754521 [0,0,0,0,0,1|2,0,1]=4 1623 B9R1.6 CC(N)c1ccncn1 Amb10608543 [0,0,0,0,0,1|2,0,1]=4 1624 B9R1.6 CC(N)c1ccncn1 Amb22587681 [0,0,0,0,0,1|2,0,1]=4 1625 B9R1.6 CC(N)c1cnccn1 Amb18278310 [0,0,0,0,0,1|2,0,1]=4 1626 B9R1.6 CC(N)c1cnccn1 Amb32752562 [0,0,0,0,0,1|2,0,1]=4 1627 B9R1.6 CC(N)c1ncccn1 Amb22757229 [0,0,0,0,0,1|2,0,1]=4 1628 B9R1.6 CC(N)c1ncccn1 Amb30585152 [0,0,0,0,0,1|2,0,1]=4 1629 B9R1.6 CC(N)c1ncccn1 Amb8010520 [0,0,0,0,0,1|2,0,1]=4 1630 B9R1.6 CC(N)c1nccnn1 Amb18203325 [0,0,0,0,0,1|2,0,1]=4 1631 B9R1.6 CC(N)c1ncncn1 Amb18221621 [0,0,0,0,0,1|2,0,1]=4 1632 B9R1.6 CC(O)c1ccccn1 Amb32666055 [0,0,0,0,0,1|1,0,2]=4 1633 B9R1.6 CC(O)c1ccccn1 Amb9748230 [0,0,0,0,0,1|1,0,2]=4 1634 B9R1.6 CC(O)c1cccnc1 Amb9748268 [0,0,0,0,0,1|1,0,2]=4 1635 B9R1.6 CC(O)c1cccnn1 Amb26346035 [0,0,0,0,0,1|1,0,2]=4 1636 B9R1.6 CC(O)c1ccncn1 Amb24477841 [0,0,0,0,0,1|1,0,2]=4 1637 B9R1.6 CC(O)c1cnccn1 Amb13952214 [0,0,0,0,0,1|1,0,2]=4 1638 B9R1.6 CC(O)c1ncccn1 Amb22284841 [0,0,0,0,0,1|1,0,2]=4 1639 B9R1.6 CC(S)c1ccccn1 Amb9208044 [0,0,0,0,0,1|1,1,1]=4 1640 B9R1.6 CC(S)c1cccnc1 Amb9208030 [0,0,0,0,0,1|1,1,1]=4 1641 B9R1.6 CC(S)c1ccncn1 Amb25917576 [0,0,0,0,0,1|1,1,1]=4 1642 B9R1.6 CC(S)c1cnccn1 Amb22267831 [0,0,0,0,0,1|1,1,1]=4 1643 B9R1.6 CN(C)c1ccccn1 Amb9825822 [0,0,0,0,0,1|3,0,0]=4 1644 B9R1.6 CN(C)c1cccnc1 Amb2622130 [0,0,0,0,0,1|3,0,0]=4 1645 B9R1.6 CN(C)c1ccncn1 Amb22233623 [0,0,0,0,0,1|3,0,0]=4 1646 B9R1.6 CN(C)c1ncccn1 Amb17939007 [0,0,0,0,0,1|3,0,0]=4 1647 B9R1.6 CN(N)c1ccccn1 Amb18642128 [0,0,0,0,0,1|3,0,0]=4 1648 B9R1.6 CN(N)c1cccnc1 Amb24085137 [0,0,0,0,0,1|3,0,0]=4 1649 B9R1.6 CN(N)c1cnccn1 Amb2408250 [0,0,0,0,0,1|3,0,0]=4 1650 B9R1.6 CN(N)c1ncccn1 Amb24070015 [0,0,0,0,0,1|3,0,0]=4 1651 B9R1.6 CS(=O)c1ccccc1 Amb8516154 [0,0,0,0,0,1|3,0,0]=4 1652 B9R1.6 CS(=O)c1ccccn1 Amb24562247 [0,0,0,0,0,1|2,0,0]=3 1653 B9R1.6 CS(=O)c1cccnn1 Amb27877101 [0,0,0,0,0,1|2,0,0]=3 1654 B9R1.6 CS(=O)c1ccnnc1 Amb27239017 [0,0,0,0,0,1|3,0,0]=4 1655 B9R1.6 CS(=O)c1cnccn1 Amb27248820 [0,0,0,0,0,1|2,0,0]=3 1656 B9R1.6 CS(=O)c1ncccn1 Amb26603199 [0,0,0,0,0,1|2,0,0]=3 1657 B9R1.6 C[C@@H](N)c1ccccn1 Amb19514583 [0,0,0,0,0,1|2,0,1]=4 1658 B9R1.6 C[C@@H](N)c1ccccn1 Amb2695967 [0,0,0,0,0,1|2,0,1]=4 1659 B9R1.6 C[C@@H](N)c1ccccn1 Amb30526699 [0,0,0,0,0,1|2,0,1]=4 1660 B9R1.6 C[C@@H](N)c1cccnc1 Amb13951181 [0,0,0,0,0,1|2,0,1]=4 1661 B9R1.6 C[C@@H](N)c1cccnc1 Amb6893473 [0,0,0,0,0,1|2,0,1]=4 1662 B9R1.6 C[C@@H](N)c1ccncn1 Amb18832953 [0,0,0,0,0,1|2,0,1]=4 1663 B9R1.6 C[C@@H](N)c1cnccn1 Amb22747093 [0,0,0,0,0,1|2,0,1]=4 1664 B9R1.6 C[C@@H](N)c1cnccn1 Amb32664964 [0,0,0,0,0,1|2,0,1]=4 1665 B9R1.6 C[C@@H](N)c1ncccn1 Amb27264293 [0,0,0,0,0,1|2,0,1]=4 1666 B9R1.6 C[C@@H](O)c1ccccn1 Amb24087444 [0,0,0,0,0,1|1,0,2]=4 1667 B9R1.6 C[C@@H](O)c1ccccn1 Amb4166327 [0,0,0,0,0,1|1,0,2]=4 1668 B9R1.6 C[C@@H](O)c1cccnc1 Amb6893471 [0,0,0,0,0,1|1,0,2]=4 1669 B9R1.6 C[C@@H](O)c1ccncn1 Amb27235358 [0,0,0,0,0,1|1,0,2]=4 1670 B9R1.6 C[C@@H](O)c1cnccn1 Amb19514758 [0,0,0,0,0,1|1,0,2]=4 1671 B9R1.6 C[C@@H](O)c1ncccn1 Amb25313724 [0,0,0,0,0,1|1,0,2]=4 1672 B9R1.6 C[C@H](Br)c1ccccn1 Amb28123940 [0,0,0,0,0,1|2,0,1]=4 1673 B9R1.6 C[C@H](Cl)c1ccccn1 Amb33068907 [0,0,0,0,0,1|2,0,1]=4 1674 B9R1.6 C[C@H](N)c1ccccn1 Amb13951343 [0,0,0,0,0,1|2,0,1]=4 1675 B9R1.6 C[C@H](N)c1ccccn1 Amb33871554 [0,0,0,0,0,1|2,0,1]=4 1676 B9R1.6 C[C@H](N)c1ccccn1 Amb6893465 [0,0,0,0,0,1|2,0,1]=4 1677 B9R1.6 C[C@H](N)c1cccnc1 Amb30647445 [0,0,0,0,0,1|2,0,1]=4 1678 B9R1.6 C[C@H](N)c1cccnc1 Amb6893472 [0,0,0,0,0,1|2,0,1]=4 1679 B9R1.6 C[C@H](N)c1ccncn1 Amb24099656 [0,0,0,0,0,1|2,0,1]=4 1680 B9R1.6 C[C@H](N)c1cnccn1 Amb25980810 [0,0,0,0,0,1|2,0,1]=4 1681 B9R1.6 C[C@H](N)c1cnccn1 Amb32665356 [0,0,0,0,0,1|2,0,1]=4 1682 B9R1.6 C[C@H](N)c1ncccn1 Amb27437960 [0,0,0,0,0,1|2,0,1]=4 1683 B9R1.6 C[C@H](O)c1ccccn1 Amb30526838 [0,0,0,0,0,1|1,0,2]=4 1684 B9R1.6 C[C@H](O)c1cccnc1 Amb6893470 [0,0,0,0,0,1|1,0,2]=4 1685 B9R1.6 C[C@H](O)c1ccncn1 Amb26019235 [0,0,0,0,0,1|1,0,2]=4 1686 B9R1.6 C[C@H](O)c1cnccn1 Amb26977321 [0,0,0,0,0,1|1,0,2]=4 1687 B9R1.6 C[C@H](O)c1ncccn1 Amb24428544 [0,0,0,0,0,1|1,0,2]=4 1688 B9R1.6 C[SiH](C)c1ccccn1 Amb22336977 [0,0,0,0,0,1|2,1,0]=4 1689 B9R1.6 N=C(N)c1ccccn1 Amb2696370 [0,0,0,0,0,1|3,0,0]=4 1690 B9R1.6 N=C(N)c1ccccn1 Amb2725149 [0,0,0,0,0,1|3,0,0]=4 1691 B9R1.6 N=C(N)c1cccnc1 Amb2695043 [0,0,0,0,0,1|3,0,0]=4 1692 B9R1.6 N=C(N)c1cccnc1 Amb2782187 [0,0,0,0,0,1|3,0,0]=4 1693 B9R1.6 N=C(N)c1cccnn1 Amb27474386 [0,0,0,0,0,1|3,0,0]=4 1694 B9R1.6 N=C(N)c1ccncn1 Amb24099639 [0,0,0,0,0,1|3,0,0]=4 1695 B9R1.6 N=C(N)c1ccncn1 Amb28934979 [0,0,0,0,0,1|3,0,0]=4 1696 B9R1.6 N=C(N)c1cnccn1 Amb22489518 [0,0,0,0,0,1|3,0,0]=4 1697 B9R1.6 N=C(N)c1cnccn1 Amb2696373 [0,0,0,0,0,1|3,0,0]=4 1698 B9R1.6 N=C(N)c1cnccn1 Amb6298866 [0,0,0,0,0,1|3,0,0]=4 1699 B9R1.6 N=C(N)c1ncccn1 Amb13951992 [0,0,0,0,0,1|3,0,0]=4 1700 B9R1.6 N=C(N)c1ncccn1 Amb22899134 [0,0,0,0,0,1|3,0,0]=4 1701 B9R1.6 N=C(N)c1ncccn1 Amb8397265 [0,0,0,0,0,1|3,0,0]=4 1702 B9R1.6 N=C(O)c1cnccn1 Amb22166847 [0,0,0,0,0,1|2,0,1]=4 1703 B9R1.6 NC(=O)C1=CC=CNC1 Amb28397885 [0,0,0,0,0,1|2,0,1]=4 1704 B9R1.6 NC(=O)C1=CNC=CC1 Amb24574438 [0,0,0,0,0,1|2,0,1]=4 1705 B9R1.6 NC(=O)c1ccc[nH+]c1 Amb8465811 [0,0,0,0,0,1|2,0,1]=4 1706 B9R1.6 NC(=O)c1ccccc1 Amb6399766 [0,0,0,0,0,1|3,0,0]=4 1707 B9R1.6 NC(=O)c1ccccn1 Amb1219876 [0,0,0,0,0,1|2,0,0]=3 1708 B9R1.6 NC(=O)c1cccnc1 Amb2609940 [0,0,0,0,0,1|2,0,0]=3 1709 B9R1.6 NC(=O)c1cccnn1 Amb22499430 [0,0,0,0,0,1|2,0,0]=3 1710 B9R1.6 NC(=O)c1ccncc1 Amb5721989 [0,0,0,0,0,1|3,0,0]=4 1711 B9R1.6 NC(=O)c1ccncn1 Amb24074283 [0,0,0,0,0,1|2,0,0]=3 1712 B9R1.6 NC(=O)c1ccnnc1 Amb22235791 [0,0,0,0,0,1|3,0,0]=4 1713 B9R1.6 NC(=O)c1cnccn1 Amb534509 [0,0,0,0,0,1|2,0,0]=3 1714 B9R1.6 NC(=O)c1cncnc1 Amb5492750 [0,0,0,0,0,1|3,0,0]=4 1715 B9R1.6 NC(=O)c1ncccn1 Amb8631041 [0,0,0,0,0,1|2,0,0]=3 1716 B9R1.6 NC(=O)c1ncncn1 Amb27392150 [0,0,0,0,0,1|2,0,0]=3 1717 B9R1.6 NC(=S)c1ccccn1 Amb6316123 [0,0,0,0,0,1|2,1,0]=4 1718 B9R1.6 NC(=S)c1cccnc1 Amb1152408 [0,0,0,0,0,1|2,1,0]=4 1719 B9R1.6 NC(=S)c1cccnn1 Amb10070425 [0,0,0,0,0,1|2,1,0]=4 1720 B9R1.6 NC(=S)c1ccncn1 Amb21933379 [0,0,0,0,0,1|2,1,0]=4 1721 B9R1.6 NC(=S)c1cnccn1 Amb2725773 [0,0,0,0,0,1|2,1,0]=4 1722 B9R1.6 NC(=S)c1ncccn1 Amb9486566 [0,0,0,0,0,1|2,1,0]=4 1723 B9R1.6 NC(=[NH2+])c1ccccn1 Amb16233715 [0,0,0,0,0,1|3,0,0]=4 1724 B9R1.6 O=C(Br)c1ccccc1 Amb8513573 [0,0,0,0,0,1|3,0,0]=4 1725 B9R1.6 O=C(Cl)c1cc[nH+]cc1 Amb21952993 [0,0,0,0,0,1|3,0,0]=4 1726 B9R1.6 O=C(Cl)c1ccccc1 Amb3939302 [0,0,0,0,0,1|3,0,0]=4 1727 B9R1.6 O=C(Cl)c1ccccn1 Amb22492448 [0,0,0,0,0,1|2,0,0]=3 1728 B9R1.6 O=C(Cl)c1ccccn1 Amb2690341 [0,0,0,0,0,1|2,0,0]=3 1729 B9R1.6 O=C(Cl)c1ccccn1 Amb3939534 [0,0,0,0,0,1|2,0,0]=3 1730 B9R1.6 O=C(Cl)c1cccnc1 Amb33531191 [0,0,0,0,0,1|2,0,0]=3 1731 B9R1.6 O=C(Cl)c1cccnc1 Amb839669 [0,0,0,0,0,1|2,0,0]=3 1732 B9R1.6 O=C(Cl)c1ccncc1 Amb2707217 [0,0,0,0,0,1|3,0,0]=4 1733 B9R1.6 O=C(Cl)c1ccncc1 Amb2720189 [0,0,0,0,0,1|3,0,0]=4 1734 B9R1.6 O=C(Cl)c1cnccn1 Amb2455965 [0,0,0,0,0,1|2,0,0]=3 1735 B9R1.6 O=C(Cl)c1cncnc1 Amb8009551 [0,0,0,0,0,1|3,0,0]=4 1736 B9R1.6 O=C(F)c1ccccc1 Amb10607152 [0,0,0,0,0,1|3,0,0]=4 1737 B9R1.6 O=C(O)C1=NC=CCC1 Amb26865460 [0,0,0,0,0,1|2,0,0]=3 1738 B9R1.6 O=C(O)C1=NCC=CC1 Amb27945577 [0,0,0,0,0,1|2,0,0]=3 1739 B9R1.6 O=C(O)C1=NN=CNN1 Amb27945576 [0,0,0,0,0,1|3,0,0]=4 1740 B9R1.6 O=C(O)C1CSCC=N1 Amb25887246 [0,0,0,0,0,1|1,0,2]=4 1741 B9R1.6 O=C(O)[C@@H]1CC=CC=N1 Amb25968999 [0,0,0,0,0,1|2,0,1]=4 1742 B9R1.6 O=C(O)c1ccccc1 Amb1935196 [0,0,0,0,0,1|3,0,0]=4 1743 B9R1.6 O=C(O)c1ccccc1 Amb22002523 [0,0,0,0,0,1|3,0,0]=4 1744 B9R1.6 O=C(O)c1ccccc1 Amb22336602 [0,0,0,0,0,1|3,0,0]=4 1745 B9R1.6 O=C(O)c1ccccc1 Amb22351742 [0,0,0,0,0,1|3,0,0]=4 1746 B9R1.6 O=C(O)c1ccccn1 Amb1227737 [0,0,0,0,0,1|2,0,0]=3 1747 B9R1.6 O=C(O)c1ccccn1 Amb4035065 [0,0,0,0,0,1|2,0,0]=3 1748 B9R1.6 O=C(O)c1cccnc1 Amb1195995 [0,0,0,0,0,1|2,0,0]=3 1749 B9R1.6 O=C(O)c1cccnn1 Amb33544461 [0,0,0,0,0,1|2,0,0]=3 1750 B9R1.6 O=C(O)c1ccncc1 Amb2609990 [0,0,0,0,0,1|3,0,0]=4 1751 B9R1.6 O=C(O)c1ccncn1 Amb1102414 [0,0,0,0,0,1|2,0,0]=3 1752 B9R1.6 O=C(O)c1ccnnc1 Amb2691390 [0,0,0,0,0,1|3,0,0]=4 1753 B9R1.6 O=C(O)c1cnccn1 Amb2455963 [0,0,0,0,0,1|2,0,0]=3 1754 B9R1.6 O=C(O)c1cncnc1 Amb24099331 [0,0,0,0,0,1|3,0,0]=4 1755 B9R1.6 O=C(O)c1cncnc1 Amb33527289 [0,0,0,0,0,1|3,0,0]=4 1756 B9R1.6 O=C(O)c1cncnn1 Amb18832864 [0,0,0,0,0,1|3,0,0]=4 1757 B9R1.6 O=C(O)c1cnncn1 Amb26419787 [0,0,0,0,0,1|3,0,0]=4 1758 B9R1.6 O=C(O)c1ncccn1 Amb19330380 [0,0,0,0,0,1|2,0,0]=3 1759 B9R1.6 O=C(O)c1ncccn1 Amb2720395 [0,0,0,0,0,1|2,0,0]=3 1760 B9R1.6 O=C(O)c1nccnn1 Amb33719343 [0,0,0,0,0,1|2,0,0]=3 1761 B9R1.6 O=C(O)c1nccnn1 Amb8010270 [0,0,0,0,0,1|2,0,0]=3 1762 B9R1.6 O=C(O)c1ncncn1 Amb27760009 [0,0,0,0,0,1|2,0,0]=3 1763 B9R1.6 O=C(S)c1ccccc1 Amb8513358 [0,0,0,0,0,1|3,0,0]=4 1764 B9R1.6 O=C([O-])c1ccccc1 Amb22053472 [0,0,0,0,0,1|3,0,0]=4 1765 B9R1.6 O=C([O-])c1ccccc1 Amb22168438 [0,0,0,0,0,1|3,0,0]=4 1766 B9R1.6 O=C([O-])c1ccccc1 Amb8387740 [0,0,0,0,0,1|3,0,0]=4 1767 B9R1.6 O=C([O-])c1ccccc1 Amb8513916 [0,0,0,0,0,1|3,0,0]=4 1768 B9R1.6 O=C([O-])c1ccccc1 Amb8517378 [0,0,0,0,0,1|3,0,0]=4 1769 B9R1.6 O=C([O-])c1ccccn1 Amb22058087 [0,0,0,0,0,1|2,0,0]=3 1770 B9R1.6 O=C([O-])c1ccccn1 Amb22734923 [0,0,0,0,0,1|2,0,0]=3 1771 B9R1.6 O=C([O-])c1ccccn1 Amb8393579 [0,0,0,0,0,1|2,0,0]=3 1772 B9R1.6 O=C([O-])c1ccccn1 Amb8393582 [0,0,0,0,0,1|2,0,0]=3 1773 B9R1.6 O=C([O-])c1ccncc1 Amb22730239 [0,0,0,0,0,1|3,0,0]=4 1774 B9R1.6 O=C([O-])c1cnccn1 Amb594440 [0,0,0,0,0,1|2,0,0]=3 1775 B9R1.6 O=C([O-])c1ncccn1 Amb22643200 [0,0,0,0,0,1|2,0,0]=3 1776 B9R1.6 O=C([O-])c1ncccn1 Amb32411832 [0,0,0,0,0,1|2,0,0]=3 1777 B9R1.6 O=S(O)c1cccnc1 Amb24062548 [0,0,0,0,0,1|3,0,0]=4 1778 B9R1.6 O=S(O)c1cccnc1 Amb32674890 [0,0,0,0,0,1|3,0,0]=4 1779 B9R1.6 O=S([O-])c1ccccn1 Amb22751253 [0,0,0,0,0,1|3,0,0]=4 1780 B9R1.6 O=S([O-])c1ccccn1 Amb33212385 [0,0,0,0,0,1|3,0,0]=4 1781 B9R1.6 O=S([O-])c1cccnc1 Amb27872709 [0,0,0,0,0,1|3,0,0]=4 1782 B9R1.6 O=[N+]([O-])c1ccccn1 Amb7774175 [0,0,0,0,0,1|3,0,0]=4 1783 B9R1.6 O=[N+]([O-])c1cccnc1 Amb8516101 [0,0,0,0,0,1|3,0,0]=4 1784 B9R1.6 O=[N+]([O-])c1cccnn1 Amb20669697 [0,0,0,0,0,1|3,0,0]=4 1785 B9R1.6 OC(=S)c1cccnc1 Amb22731908 [0,0,0,0,0,1|2,0,1]=4 1786 B9R1.6 [CH2-]C(=O)c1ncccn1 Amb27227006 [0,0,0,0,0,1|1,0,1]=3 1787 B9R1.13 BrC(Br)=Cc1cccs1 Amb26079369 [0,0,0,0,0,1|3,0,0]=4 1788 B9R1.13 C=C(Br)Cc1cccs1 Amb25185096 [0,0,0,0,0,1|2,0,1]=4 1789 B9R1.13 C=C(C)Cc1ccco1 Amb24673621 [0,0,0,0,0,1|2,1,0]=4 1790 B9R1.13 C=C(C)Cc1cccs1 Amb27413817 [0,0,0,0,0,1|2,0,0]=3 1791 B9R1.13 C=C(Cl)Cc1cccs1 Amb24674094 [0,0,0,0,0,1|2,0,1]=4 1792 B9R1.13 C=C(Cl)Sc1cccs1 Amb27462347 [0,0,0,0,0,1|2,0,1]=4 1793 B9R1.13 CC(=O)C=C1SCCS1 Amb28054000 [0,0,0,0,0,1|1,0,2]=4 1794 B9R1.13 CC(=O)Cc1ccco1 Amb5751052 [0,0,0,0,0,1|1,1,0]=3 1795 B9R1.13 CC(=O)Cc1cccs1 Amb3429447 [0,0,0,0,0,1|1,0,0]=2 1796 B9R1.13 CC(=O)Cc1ccno1 Amb24425365 [0,0,0,0,0,1|2,1,0]=4 1797 B9R1.13 CC(=O)Cc1ccns1 Amb35651562 [0,0,0,0,0,1|2,0,0]=3 1798 B9R1.13 CC(=O)Cc1ccoc1 Amb25713513 [0,0,0,0,0,1|3,0,0]=4 1799 B9R1.13 CC(=O)Cc1ccon1 Amb33080144 [0,0,0,0,0,1|2,0,0]=3 1800 B9R1.13 CC(=O)Cc1ccsc1 Amb6744886 [0,0,0,0,0,1|3,0,0]=4 1801 B9R1.13 CC(=O)Cc1cnco1 Amb33416893 [0,0,0,0,0,1|2,1,0]=4 1802 B9R1.13 CC(=O)Cc1cncs1 Amb25887376 [0,0,0,0,0,1|2,0,0]=3 1803 B9R1.13 CC(=O)Cc1cnsn1 Amb27475330 [0,0,0,0,0,1|3,0,0]=4 1804 B9R1.13 CC(=O)Cc1conn1 Amb27267147 [0,0,0,0,0,1|3,0,0]=4 1805 B9R1.13 CC(=O)Cc1cscn1 Amb26967074 [0,0,0,0,0,1|2,0,0]=3 1806 B9R1.13 CC(=O)Cc1csnn1 Amb28120384 [0,0,0,0,0,1|3,0,0]=4 1807 B9R1.13 CC(=O)Cc1nccs1 Amb6297701 [0,0,0,0,0,1|0,0,0]=1 1808 B9R1.13 CC(=O)Cc1ncon1 Amb25758852 [0,0,0,0,0,1|2,0,0]=3 1809 B9R1.13 CC(=O)Cc1ncsn1 Amb18202586 [0,0,0,0,0,1|2,0,0]=3 1810 B9R1.13 CC(=O)Cc1nnco1 Amb27838736 [0,0,0,0,0,1|1,1,0]=3 1811 B9R1.13 CC(=O)Cn1cccn1 Amb1092543 [0,0,0,0,0,1|2,0,0]=3 1812 B9R1.13 CC(=O)Cn1cccn1 Amb21988437 [0,0,0,0,0,1|2,0,0]=3 1813 B9R1.13 CC(=O)Cn1cncn1 Amb22284176 [0,0,0,0,0,1|3,0,0]=4 1814 B9R1.13 CC(=O)Cn1cncn1 Amb33534624 [0,0,0,0,0,1|3,0,0]=4 1815 B9R1.13 CC(=O)Cn1ncnn1 Amb1093251 [0,0,0,0,0,1|3,0,0]=4 1816 B9R1.13 CC(=O)NC1=NCCS1 Amb3365295 [0,0,0,0,0,1|0,0,2]=3 1817 B9R1.13 CC(=O)NC1=NOCC1 Amb27209678 [0,0,0,0,0,1|2,0,1]=4 1818 B9R1.13 CC(=O)NC1CC=CC1 Amb27983434 [0,0,0,0,0,1|2,0,1]=4 1819 B9R1.13 CC(=O)Nc1ccco1 Amb2611741 [0,0,0,0,0,1|1,1,0]=3 1820 B9R1.13 CC(=O)Nc1cccs1 Amb2228309 [0,0,0,0,0,1|1,0,0]=2 1821 B9R1.13 CC(=O)Nc1ccon1 Amb25868303 [0,0,0,0,0,1|2,0,0]=3 1822 B9R1.13 CC(=O)Nc1ccsc1 Amb4036279 [0,0,0,0,0,1|3,0,0]=4 1823 B9R1.13 CC(=O)Nc1cnns1 Amb25732486 [0,0,0,0,0,1|3,0,0]=4 1824 B9R1.13 CC(=O)Nc1cscn1 Amb6298641 [0,0,0,0,0,1|2,0,0]=3 1825 B9R1.13 CC(=O)Nc1ncco1 Amb27614332 [0,0,0,0,0,1|0,1,0]=2 1826 B9R1.13 CC(=O)Nc1nccs1 Amb6336321 [0,0,0,0,0,1|0,0,0]=1 1827 B9R1.13 CC(=O)Nc1ncns1 Amb23412318 [0,0,0,0,0,1|1,0,0]=2 1828 B9R1.13 CC(=O)Nc1ncon1 Amb28122006 [0,0,0,0,0,1|2,0,0]=3 1829 B9R1.13 CC(=O)Nc1nncs1 Amb1150326 [0,0,0,0,0,1|1,0,0]=2 1830 B9R1.13 CC(=O)Nc1nnns1 Amb35605299 [0,0,0,0,0,1|2,0,0]=3 1831 B9R1.13 CC(=O)Oc1ccco1 Amb27614492 [0,0,0,0,0,1|1,1,0]=3 1832 B9R1.13 CC(=O)Oc1ccsc1 Amb28138065 [0,0,0,0,0,1|3,0,0]=4 1833 B9R1.13 CC(=O)On1cccc1 Amb28366433 [0,0,0,0,0,1|3,0,0]=4 1834 B9R1.13 CC(=O)Sc1ccsc1 Amb24727644 [0,0,0,0,0,1|3,0,0]=4 1835 B9R1.13 CC(=O)\C=C1/C=CCO1 Amb27186200 [0,0,0,0,0,1|1,1,1]=4 1836 B9R1.13 CC(=O)\C=C1/NCCS1 Amb26905115 [0,0,0,0,0,1|0,0,3]=4 1837 B9R1.13 CC(=O)\C=C1\CC=CO1 Amb28326023 [0,0,0,0,0,1|1,1,0]=3 1838 B9R1.13 CC(=O)\C=C1\NCCS1 Amb24518464 [0,0,0,0,0,1|0,0,3]=4 1839 B9R1.13 CC(=S)Nc1cscn1 Amb27659463 [0,0,0,0,0,1|2,1,0]=4 1840 B9R1.13 CC(=S)Nc1nccs1 Amb26564795 [0,0,0,0,0,1|0,1,0]=2 1841 B9R1.13 CC(Br)Cc1cccs1 Amb26653704 [0,0,0,0,0,1|2,0,1]=4 1842 B9R1.13 CC(Br)Cc1nccs1 Amb28990263 [0,0,0,0,0,1|1,0,1]=3 1843 B9R1.13 CC(C)Cc1cccs1 Amb24061264 [0,0,0,0,0,1|2,0,1]=4 1844 B9R1.13 CC(C)Cc1ncco1 Amb17399801 [0,0,0,0,0,1|1,1,1]=4 1845 B9R1.13 CC(C)Cc1nccs1 Amb2688916 [0,0,0,0,0,1|1,0,1]=3 1846 B9R1.13 CC(C)Sc1cccs1 Amb28205791 [0,0,0,0,0,1|2,0,1]=4 1847 B9R1.13 CC(C)Sc1nccs1 Amb27158755 [0,0,0,0,0,1|1,0,1]=3 1848 B9R1.13 CC(Cl)Cc1cccs1 Amb17477833 [0,0,0,0,0,1|2,0,1]=4 1849 B9R1.13 CC(N)Cc1cccs1 Amb19514742 [0,0,0,0,0,1|2,0,1]=4 1850 B9R1.13 CC(N)Cc1cccs1 Amb9714775 [0,0,0,0,0,1|2,0,1]=4 1851 B9R1.13 CC(N)Cc1nccs1 Amb5740874 [0,0,0,0,0,1|1,0,1]=3 1852 B9R1.13 CC(O)Cc1cccs1 Amb4016400 [0,0,0,0,0,1|1,0,2]=4 1853 B9R1.13 CC(O)Cc1nccs1 Amb27817410 [0,0,0,0,0,1|0,0,2]=3 1854 B9R1.13 CC(S)Cc1cccs1 Amb29859712 [0,0,0,0,0,1|1,1,1]=4 1855 B9R1.13 CN(C)Cc1cccs1 Amb21864815 [0,0,0,0,0,1|3,0,0]=4 1856 B9R1.13 CN(C)Nc1nccs1 Amb28077465 [0,0,0,0,0,1|2,0,0]=3 1857 B9R1.13 CN(C)Nc1ncns1 Amb28143262 [0,0,0,0,0,1|3,0,0]=4 1858 B9R1.13 CN(N)Cc1cccs1 Amb27185999 [0,0,0,0,0,1|3,0,0]=4 1859 B9R1.13 CN(O)Cc1cccs1 Amb33360066 [0,0,0,0,0,1|2,0,1]=4 1860 B9R1.13 CN(O)Cc1nccs1 Amb33311577 [0,0,0,0,0,1|1,0,1]=3 1861 B9R1.13 CS(C)=Nc1nccs1 Amb27621860 [0,0,0,0,0,1|2,0,0]=3 1862 B9R1.13 C[C@@H](N)Cc1cccs1 Amb24680998 [0,0,0,0,0,1|2,0,1]=4 1863 B9R1.13 C[C@@H](N)Cc1nccs1 Amb33311510 [0,0,0,0,0,1|1,0,1]=3 1864 B9R1.13 C[C@@H](O)Cc1cccs1 Amb22896924 [0,0,0,0,0,1|1,0,2]=4 1865 B9R1.13 C[C@@H](O)Cc1nccs1 Amb33311484 [0,0,0,0,0,1|0,0,2]=3 1866 B9R1.13 C[C@H](N)Cc1cccs1 Amb27655600 [0,0,0,0,0,1|2,0,1]=4 1867 B9R1.13 C[C@H](N)Cc1nccs1 Amb33311497 [0,0,0,0,0,1|1,0,1]=3 1868 B9R1.13 C[C@H](O)Cc1cccs1 Amb25354706 [0,0,0,0,0,1|1,0,2]=4 1869 B9R1.13 C[C@H](O)Cc1nccs1 Amb33311491 [0,0,0,0,0,1|0,0,2]=3 1870 B9R1.13 C\C(N)=C/c1cscn1 Amb27246331 [0,0,0,0,0,1|3,0,0]=4 1871 B9R1.13 C\[N+]([O-])=C\c1cccs1 Amb2613451 [0,0,0,0,0,1|2,0,1]=4 1872 B9R1.13 F\C(Br)=C\c1cccs1 Amb28428694 [0,0,0,0,0,1|3,0,0]=4 1873 B9R1.13 N=C(N)Cc1cccs1 Amb2696408 [0,0,0,0,0,1|3,0,0]=4 1874 B9R1.13 N=C(N)Cc1cccs1 Amb8630204 [0,0,0,0,0,1|3,0,0]=4 1875 B9R1.13 N=C(N)Cc1nccs1 Amb26022713 [0,0,0,0,0,1|2,0,0]=3 1876 B9R1.13 N=C(N)Sc1cccs1 Amb27794018 [0,0,0,0,0,1|3,0,0]=4 1877 B9R1.13 NC(=O)Cc1cccs1 Amb3620365 [0,0,0,0,0,1|2,0,0]=3 1878 B9R1.13 NC(=O)Cc1ccsn1 Amb27460712 [0,0,0,0,0,1|3,0,0]=4 1879 B9R1.13 NC(=O)Cc1cncs1 Amb22372056 [0,0,0,0,0,1|3,0,0]=4 1880 B9R1.13 NC(=O)Cc1cscn1 Amb2610764 [0,0,0,0,0,1|3,0,0]=4 1881 B9R1.13 NC(=O)Cn1cccn1 Amb10609663 [0,0,0,0,0,1|3,0,0]=4 1882 B9R1.13 NC(=O)Cn1nccn1 Amb27837651 [0,0,0,0,0,1|3,0,0]=4 1883 B9R1.13 NC(=O)NC1=NCCS1 Amb24700141 [0,0,0,0,0,1|1,0,2]=4 1884 B9R1.13 NC(=O)Nc1ccco1 Amb27804619 [0,0,0,0,0,1|2,1,0]=4 1885 B9R1.13 NC(=O)Nc1cccs1 Amb28248962 [0,0,0,0,0,1|2,0,0]=3 1886 B9R1.13 NC(=O)Nc1ncco1 Amb27201421 [0,0,0,0,0,1|1,1,0]=3 1887 B9R1.13 NC(=O)Nc1nncs1 Amb25368376 [0,0,0,0,0,1|2,0,0]=3 1888 B9R1.13 NC(=O)Nc1nnns1 Amb35707099 [0,0,0,0,0,1|3,0,0]=4 1889 B9R1.13 NC(=S)Cc1cccs1 Amb1092031 [0,0,0,0,0,1|2,1,0]=4 1890 B9R1.13 NC(=S)Cc1nccs1 Amb6740594 [0,0,0,0,0,1|1,1,0]=3 1891 B9R1.13 NC(=S)Nc1cccs1 Amb27444130 [0,0,0,0,0,1|2,1,0]=4 1892 B9R1.13 NC(N)=Nc1nccs1 Amb25328377 [0,0,0,0,0,1|2,0,0]=3 1893 B9R1.13 O=C(Cl)Cc1ccco1 Amb25124003 [0,0,0,0,0,1|2,1,0]=4 1894 B9R1.13 O=C(Cl)Cc1cccs1 Amb535730 [0,0,0,0,0,1|2,0,0]=3 1895 B9R1.13 O=C(O)CC1=CC=CC1 Amb28370362 [0,0,0,0,0,1|3,0,0]=4 1896 B9R1.13 O=C(O)CC1=NCCS1 Amb8009921 [0,0,0,0,0,1|1,0,2]=4 1897 B9R1.13 O=C(O)Cc1ccco1 Amb2792725 [0,0,0,0,0,1|2,1,0]=4 1898 B9R1.13 O=C(O)Cc1cccs1 Amb6335251 [0,0,0,0,0,1|2,0,0]=3 1899 B9R1.13 O=C(O)Cc1ccns1 Amb18831590 [0,0,0,0,0,1|3,0,0]=4 1900 B9R1.13 O=C(O)Cc1ccon1 Amb8009412 [0,0,0,0,0,1|3,0,0]=4 1901 B9R1.13 O=C(O)Cc1ccsn1 Amb18831591 [0,0,0,0,0,1|3,0,0]=4 1902 B9R1.13 O=C(O)Cc1cncs1 Amb3319218 [0,0,0,0,0,1|3,0,0]=4 1903 B9R1.13 O=C(O)Cc1cocn1 Amb8009408 [0,0,0,0,0,1|3,0,0]=4 1904 B9R1.13 O=C(O)Cc1cscn1 Amb17039671 [0,0,0,0,0,1|3,0,0]=4 1905 B9R1.13 O=C(O)Cc1cscn1 Amb33537693 [0,0,0,0,0,1|3,0,0]=4 1906 B9R1.13 O=C(O)Cc1ncco1 Amb8009407 [0,0,0,0,0,1|1,1,0]=3 1907 B9R1.13 O=C(O)Cc1nccs1 Amb9533133 [0,0,0,0,0,1|1,0,0]=2 1908 B9R1.13 O=C(O)Cc1ncns1 Amb18831517 [0,0,0,0,0,1|2,0,0]=3 1909 B9R1.13 O=C(O)Cc1ncsn1 Amb18202411 [0,0,0,0,0,1|3,0,0]=4 1910 B9R1.13 O=C(O)Cc1nnco1 Amb22753920 [0,0,0,0,0,1|2,1,0]=4 1911 B9R1.13 O=C(O)Cc1nncs1 Amb27162471 [0,0,0,0,0,1|2,0,0]=3 1912 B9R1.13 O=C(O)Cn1cccn1 Amb1157167 [0,0,0,0,0,1|3,0,0]=4 1913 B9R1.13 O=C(O)Cn1nccn1 Amb8010901 [0,0,0,0,0,1|3,0,0]=4 1914 B9R1.13 O=C([O-])Cc1nccs1 Amb32648040 [0,0,0,0,0,1|1,0,0]=2 1915 B9R1.13 O=C([O-])Cc1nnco1 Amb20667981 [0,0,0,0,0,1|2,1,0]=4 1916 B9R1.13 O=C([O-])Cc1nncs1 Amb32655950 [0,0,0,0,0,1|2,0,0]=3 1917 B9R1.13 O=C([O-])Cc1nncs1 Amb33299307 [0,0,0,0,0,1|2,0,0]=3 1918 B9R1.13 O=C([OH2+])Cn1cccn1 Amb10552495 [0,0,0,0,0,1|3,0,0]=4 1919 B9R1.13 O=S(O)Nc1nccs1 Amb27967994 [0,0,0,0,0,1|2,0,0]=3 1920 B9R1.13 O=[N+]([O-])Cc1cccs1 Amb26527648 [0,0,0,0,0,1|3,0,0]=4 1921 B9R1.13 O=[N+]([O-])Cc1nccs1 Amb33310376 [0,0,0,0,0,1|2,0,0]=3 1922 B9R1.13 OB(O)Cc1nccs1 Amb28187318 [0,0,0,0,0,1|2,0,1]=4 1923 B9R1.13 OC(=S)Cc1cccs1 Amb2611516 [0,0,0,0,0,1|2,0,1]=4 1924 B9R1.13 S=C(S)Nc1nccs1 Amb27798334 [0,0,0,0,0,1|1,1,0]=3 1925 B9R1.13 S=C(S)Nc1nncs1 Amb27777208 [0,0,0,0,0,1|2,1,0]=4 1926 B6R0.4 C=C(C)\C=C\C=O Amb18120435 [1,0,1,0,0,0|1,1,0]=4 1927 B6R0.4 C=C=C=CC(C)=O Amb28201583 [1,0,1,0,0,0|1,0,1]=4 1928 B6R0.4 C=CCCC(C)=O Amb2721704 [1,0,1,0,0,0|1,0,1]=4 1929 B6R0.4 C=CCNC(C)=O Amb5797445 [1,0,1,0,0,0|2,0,0]=4 1930 B6R0.4 C=COCC(C)=O Amb27838258 [1,0,1,0,0,0|0,1,1]=4 1931 B6R0.4 C=C\C=C/C(C)=O Amb27165543 [1,0,1,0,0,0|1,0,0]=3 1932 B6R0.4 C=C\C=C\C(=O)Cl Amb26530329 [1,0,1,0,0,0|2,0,0]=4 1933 B6R0.4 CC(=O)N\C=C/S Amb27246451 [1,0,1,0,0,0|0,0,1]=3 1934 B6R0.4 CC(=O)N\C=C\Cl Amb28132682 [1,0,1,0,0,0|1,0,1]=4 1935 B6R0.4 CC(=O)O\C=C/Br Amb27484017 [1,0,1,0,0,0|1,1,0]=4 1936 B6R0.4 CC(=O)SCC=O Amb27873378 [1,0,1,0,0,0|1,0,1]=4 1937 B6R0.4 CC(=O)\C=C/C#N Amb28050527 [1,0,1,0,0,0|0,0,2]=4 1938 B6R0.4 CC(=O)\C=C/C=O Amb27424884 [1,0,1,0,0,0|0,1,0]=3 1939 B6R0.4 CC(=O)\C=C\CCl Amb25378305 [1,0,1,0,0,0|1,0,1]=4 1940 B6R0.4 CC(=O)\C=C\CF Amb33379250 [1,0,1,0,0,0|1,0,1]=4 1941 B6R0.4 CC(C)=C\C=C\Br Amb28244792 [1,0,1,0,0,0|2,0,0]=4 1942 B6R0.4 CC(C)=C\C=C\Cl Amb27760419 [1,0,1,0,0,0|2,0,0]=4 1943 B6R0.4 CC\C=C/C(C)=O Amb27835645 [1,0,1,0,0,0|1,0,1]=4 1944 B6R0.4 CC\C=C\C(C)=O Amb26022886 [1,0,1,0,0,0|1,0,1]=4 1945 B6R0.4 CC\N=C\C(C)=O Amb27854982 [1,0,1,0,0,0|0,0,2]=4 1946 B6R0.4 CN\C=C\C(C)=O Amb17593076 [1,0,1,0,0,0|2,0,0]=4 1947 B6R0.4 CO\C=C/C(C)=O Amb27264758 [1,0,1,0,0,0|2,0,0]=4 1948 B6R0.4 CO\C=C\C(C)=O Amb8385700 [1,0,1,0,0,0|2,0,0]=4 1949 B6R0.4 CS\C=C/C(C)=O Amb27471812 [1,0,1,0,0,0|2,0,0]=4 1950 B6R0.4 O=C\C=C/C(=O)O Amb26023446 [1,0,1,0,0,0|1,1,0]=4 1951 B6R0.6 C=C\C=C\C=C\C Amb27627431 [1,0,1,0,0,0|2,0,0]=4 1952 B6R0.6 C\C=C\C=C\C=O Amb33986154 [1,0,1,0,0,0|1,1,0]=4 1953 B6R0.6 C\C=C\S\C=C\C Amb27210562 [1,0,1,0,0,0|1,0,0]=3 1954 B6R0.6 Cl\C=C\S\C=C\Cl Amb28343062 [1,0,1,0,0,0|2,0,0]=4 1955 B6R0.6 N\C=C/C=C/C=O Amb27838284 [1,0,1,0,0,0|1,0,1]=4 1956 B6R0.6 N\C=C\C=C\C=O Amb27873733 [1,0,1,0,0,0|1,0,1]=4 1957 B6R0.6 O=C\C=C/C=C\S Amb27166146 [1,0,1,0,0,0|1,0,0]=3 1958 B6R0.6 O=C\C=C\C=C\Br Amb16233577 [1,0,1,0,0,0|2,0,0]=4 1959 B6R0.6 O=C\C=C\C=C\Cl Amb27760447 [1,0,1,0,0,0|2,0,0]=4 1960 B6R0.6 O=C\C=C\C=C\O Amb27646525 [1,0,1,0,0,0|1,1,0]=4 1961 B6R0.6 O=C\C=C\C=C\S Amb28051864 [1,0,1,0,0,0|1,0,0]=3 1962 B6R0.1 C=CCC(=C)C=O Amb18120415 [1,0,1,0,0,0|2,0,0]=4 1963 B6R0.1 C=CC\C(C)=C\C Amb24479822 [1,0,1,0,0,0|2,0,0]=4 1964 B6R0.1 C=CNC(=N)SC Amb27244029 [1,0,1,0,0,0|2,0,0]=4 1965 B6R0.1 C=CSC(=O)NC Amb27969936 [1,0,1,0,0,0|2,0,0]=4 1966 B6R0.1 C=C\C=C(/Cl)C=O Amb27797386 [1,0,1,0,0,0|2,0,0]=4 1967 B6R0.1 C=C\C=C(\Br)C=O Amb18126250 [1,0,1,0,0,0|2,0,0]=4 1968 B6R0.3 C=C(CO)C(C)=O Amb24571845 [1,0,1,0,0,0|2,0,0]=4 1969 B6R0.3 C=C(OC)C(C)=O Amb28126662 [1,0,1,0,0,0|0,1,1]=4 1970 B6R0.3 C=C(SC)C(=O)O Amb27882690 [1,0,1,0,0,0|1,0,1]=4 1971 B6R0.3 C=C(SS)C(=O)O Amb27593809 [1,0,1,0,0,0|2,0,0]=4 1972 B6R0.3 C=CC(=C)C(=O)O Amb24394371 [1,0,1,0,0,0|2,0,0]=4 1973 B6R0.3 C=CC(=O)C(=C)C Amb26842538 [1,0,1,0,0,0|1,1,0]=4 1974 B6R0.3 C=CC(C)=C(C)C Amb28457266 [1,0,1,0,0,0|2,0,0]=4 1975 B6R0.3 C=CC(O)C(C)=O Amb27838239 [1,0,1,0,0,0|0,1,1]=4 1976 B6R0.3 C=CC(S)C(=O)O Amb28069741 [1,0,1,0,0,0|1,0,1]=4 1977 B6R0.3 C=CN(C)C(C)=O Amb8513334 [1,0,1,0,0,0|2,0,0]=4 1978 B6R0.3 CC(=O)C(=N)NO Amb27433735 [1,0,1,0,0,0|2,0,0]=4 1979 B6R0.3 CC(=O)\C(Br)=C/Cl Amb27400332 [1,0,1,0,0,0|2,0,0]=4 1980 B6R0.3 CC(=O)\C(Br)=C\N Amb27878489 [1,0,1,0,0,0|2,0,0]=4 1981 B6R0.3 CC(=O)\C(Br)=C\O Amb17232510 [1,0,1,0,0,0|2,0,0]=4 1982 B6R0.3 CC(=O)\C(C)=N/O Amb9787796 [1,0,1,0,0,0|1,0,1]=4 1983 B6R0.3 CC(=O)\C(C)=N\N Amb27830523 [1,0,1,0,0,0|1,0,1]=4 1984 B6R0.3 CC(=O)\C(C)=N\O Amb8389366 [1,0,1,0,0,0|1,0,1]=4 1985 B6R0.3 CC(=O)\C(Cl)=C/Cl Amb28050173 [1,0,1,0,0,0|2,0,0]=4 1986 B6R0.3 CC(=O)\C(Cl)=C\Cl Amb8393393 [1,0,1,0,0,0|2,0,0]=4 1987 B6R0.3 CC(=O)\C(Cl)=C\O Amb27854622 [1,0,1,0,0,0|2,0,0]=4 1988 B6R0.3 CC(=O)\C(F)=C\Cl Amb27838259 [1,0,1,0,0,0|2,0,0]=4 1989 B6R0.3 CSC(=O)C(C)=O Amb27861244 [1,0,1,0,0,0|1,0,1]=4 1990 B6R0.3 C\C=C(/C)C(C)=O Amb2725616 [1,0,1,0,0,0|1,0,1]=4 1991 B6R0.3 C\N=C(/C)C(C)=O Amb27838250 [1,0,1,0,0,0|0,0,2]=4 1992 B6R1.2 Brc1cccs1 Amb2685504 [2,0,0,0,0,0|2,0,0]=4 1993 B6R1.2 Brc1ncco1 Amb10071482 [2,0,0,0,0,0|1,1,0]=4 1994 B6R1.2 Brc1ncco1 Amb19514894 [2,0,0,0,0,0|1,1,0]=4 1995 B6R1.2 Brc1nccs1 Amb535721 [2,0,0,0,0,0|1,0,0]=3 1996 B6R1.2 Brc1ncns1 Amb33547755 [2,0,0,0,0,0|2,0,0]=4 1997 B6R1.2 Brc1nncs1 Amb2723120 [2,0,0,0,0,0|2,0,0]=4 1998 B6R1.2 C=C1N=CCS1 Amb27796505 [2,0,0,0,0,0|0,0,1]=3 1999 B6R1.2 CC1=CC=CC1 Amb26338978 [2,0,0,0,0,0|2,0,0]=4 2000 B6R1.2 CC1=NCCS1 Amb6608778 [2,0,0,0,0,0|0,0,2]=4 2001 B6R1.2 CC1N=CCS1 Amb8392841 [2,0,0,0,0,0|0,0,2]=4 2002 B6R1.2 Cc1ccco1 Amb2447070 [2,0,0,0,0,0|1,1,0]=4 2003 B6R1.2 Cc1cccs1 Amb2447069 [2,0,0,0,0,0|1,0,0]=3 2004 B6R1.2 Cc1ccns1 Amb22734260 [2,0,0,0,0,0|2,0,0]=4 2005 B6R1.2 Cc1ccon1 Amb4005631 [2,0,0,0,0,0|2,0,0]=4 2006 B6R1.2 Cc1ccsn1 Amb20621563 [2,0,0,0,0,0|2,0,0]=4 2007 B6R1.2 Cc1cncs1 Amb8396856 [2,0,0,0,0,0|2,0,0]=4 2008 B6R1.2 Cc1cocn1 Amb33544147 [2,0,0,0,0,0|2,0,0]=4 2009 B6R1.2 Cc1cscn1 Amb1163532 [2,0,0,0,0,0|2,0,0]=4 2010 B6R1.2 Cc1ncco1 Amb17399783 [2,0,0,0,0,0|0,1,0]=3 2011 B6R1.2 Cc1ncco1 Amb22757206 [2,0,0,0,0,0|0,1,0]=3 2012 B6R1.2 Cc1nccs1 Amb2455765 [2,0,0,0,0,0|0,0,0]=2 2013 B6R1.2 Cc1nnco1 Amb20171395 [2,0,0,0,0,0|1,1,0]=4 2014 B6R1.2 Clc1cccs1 Amb2686481 [2,0,0,0,0,0|2,0,0]=4 2015 B6R1.2 Clc1ncco1 Amb22054705 [2,0,0,0,0,0|1,1,0]=4 2016 B6R1.2 Clc1ncco1 Amb32655821 [2,0,0,0,0,0|1,1,0]=4 2017 B6R1.2 Clc1nccs1 Amb2455949 [2,0,0,0,0,0|1,0,0]=3 2018 B6R1.2 Clc1ncns1 Amb10602887 [2,0,0,0,0,0|2,0,0]=4 2019 B6R1.2 Clc1nncs1 Amb19514765 [2,0,0,0,0,0|2,0,0]=4 2020 B6R1.2 Cn1cccn1 Amb1088902 [2,0,0,0,0,0|2,0,0]=4 2021 B6R1.2 Cn1nccn1 Amb22491223 [2,0,0,0,0,0|2,0,0]=4 2022 B6R1.2 Fc1cccs1 Amb8388025 [2,0,0,0,0,0|2,0,0]=4 2023 B6R1.2 Fc1nccs1 Amb20621379 [2,0,0,0,0,0|1,0,0]=3 2024 B6R1.2 Fc1ncns1 Amb35719506 [2,0,0,0,0,0|2,0,0]=4 2025 B6R1.2 Ic1cccs1 Amb2688889 [2,0,0,0,0,0|2,0,0]=4 2026 B6R1.2 Ic1ncco1 Amb33547666 [2,0,0,0,0,0|1,1,0]=4 2027 B6R1.2 Ic1nccs1 Amb6296420 [2,0,0,0,0,0|1,0,0]=3 2028 B6R1.2 Ic1ncns1 Amb27424451 [2,0,0,0,0,0|2,0,0]=4 2029 B6R1.2 Ic1nncs1 Amb19375226 [2,0,0,0,0,0|2,0,0]=4 2030 B6R1.2 N=C1NC=CS1 Amb22166858 [2,0,0,0,0,0|1,0,1]=4 2031 B6R1.2 Nc1ncco1 Amb6751913 [2,0,0,0,0,0|1,1,0]=4 2032 B6R1.2 Nc1nccs1 Amb2609403 [2,0,0,0,0,0|1,0,0]=3 2033 B6R1.2 Nc1nccs1 Amb2707210 [2,0,0,0,0,0|1,0,0]=3 2034 B6R1.2 Nc1ncns1 Amb22436769 [2,0,0,0,0,0|2,0,0]=4 2035 B6R1.2 Nc1ncns1 Amb33528436 [2,0,0,0,0,0|2,0,0]=4 2036 B6R1.2 Nc1ncns1 Amb33529613 [2,0,0,0,0,0|2,0,0]=4 2037 B6R1.2 Nc1nncs1 Amb1644490 [2,0,0,0,0,0|2,0,0]=4 2038 B6R1.2 O=C1C=CCS1 Amb22336458 [2,0,0,0,0,0|1,0,1]=4 2039 B6R1.2 O=C1C=CN=N1 Amb22230022 [2,0,0,0,0,0|2,0,0]=4 2040 B6R1.2 O=C1C=CSS1 Amb27421370 [2,0,0,0,0,0|2,0,0]=4 2041 B6R1.2 O=C1CC=CC1 Amb2686649 [2,0,0,0,0,0|2,0,0]=4 2042 B6R1.2 O=C1CC=CN1 Amb22235167 [2,0,0,0,0,0|1,0,1]=4 2043 B6R1.2 O=C1CN=CS1 Amb27963219 [2,0,0,0,0,0|2,0,0]=4 2044 B6R1.2 O=C1N=CC=N1 Amb25138138 [2,0,0,0,0,0|1,0,0]=3 2045 B6R1.2 O=C1N=CN=N1 Amb3614275 [2,0,0,0,0,0|2,0,0]=4 2046 B6R1.2 O=C1NC=CN1 Amb19516737 [2,0,0,0,0,0|1,0,1]=4 2047 B6R1.2 O=C1NC=CO1 Amb20671008 [2,0,0,0,0,0|0,1,1]=4 2048 B6R1.2 O=C1NC=CS1 Amb19271596 [2,0,0,0,0,0|0,0,1]=3 2049 B6R1.2 O=C1NN=CS1 Amb22491285 [2,0,0,0,0,0|1,0,1]=4 2050 B6R1.2 O=C1OC=CO1 Amb20239430 [2,0,0,0,0,0|1,1,0]=4 2051 B6R1.2 Oc1cccs1 Amb17201836 [2,0,0,0,0,0|1,0,1]=4 2052 B6R1.2 Oc1nncs1 Amb19516957 [2,0,0,0,0,0|1,0,1]=4 2053 B6R1.2 S=C1NC=CS1 Amb22492748 [2,0,0,0,0,0|0,1,1]=4 2054 B6R1.2 S=C1SC=CS1 Amb20001458 [2,0,0,0,0,0|1,1,0]=4 2055 B6R1.2 Sc1cccs1 Amb2689075 [2,0,0,0,0,0|1,1,0]=4 2056 B6R1.2 Sc1nccs1 Amb1137208 [2,0,0,0,0,0|0,1,0]=3 2057 B6R1.2 Sc1ncns1 Amb25745842 [2,0,0,0,0,0|1,1,0]=4 2058 B6R1.2 Sc1nncs1 Amb5395443 [2,0,0,0,0,0|1,1,0]=4 2059 B8R0.6 COC(=O)\C=C\C=C\Br Amb28283385 [0,1,1,0,0,0|2,0,0]=4 2060 B8R0.6 C\C(C=O)=C/C=C/C=O Amb28325792 [0,1,1,0,0,0|1,1,0]=4 2061 B8R0.6 C\C=C\C=C\C(=O)OC Amb22230900 [0,1,1,0,0,0|2,0,0]=4 2062 B8R0.7 C#C\C=C\C=C\C(C)=O Amb27789857 [0,1,1,0,0,0|2,0,0]=4 2063 B8R0.7 CC(=O)\C=C\C=C\CCl Amb27254525 [0,1,1,0,0,0|2,0,0]=4 2064 B8R0.7 CC\C=C/C=C/C(C)=O Amb27164670 [0,1,1,0,0,0|2,0,0]=4 2065 B8R0.7 CC\C=C/SCC(C)=O Amb24615236 [0,1,1,0,0,0|1,0,1]=4 2066 B8R0.7 CC\C=C\C=C\C(C)=O Amb24667251 [0,1,1,0,0,0|2,0,0]=4 2067 B8R0.7 CC\C=C\SCC(C)=O Amb28245395 [0,1,1,0,0,0|1,0,1]=4 2068 B8R0.7 CO\C=C\C=C\C(C)=O Amb27875381 [0,1,1,0,0,0|1,1,0]=4 2069 B8R0.7 C\C=C\C=C\CC(C)=O Amb27248237 [0,1,1,0,0,0|2,0,0]=4 2070 B8R0.8 C=CC\N=C(/C)C(C)=O Amb27875405 [0,1,1,0,0,0|1,0,1]=4 2071 B8R0.8 C\C=C\C=C(/C)C(C)=O Amb27802596 [0,1,1,0,0,0|2,0,0]=4 2072 B8R0.9 C=CC(=O)\C=C\C(C)=O Amb24061722 [0,1,1,0,0,0|2,0,0]=4 2073 B8R0.9 C\C=C(C)/C=C/C(C)=O Amb27428251 [0,1,1,0,0,0|2,0,0]=4 2074 B8R0.9 C\C=C(C)\C=C/C(C)=O Amb28199822 [0,1,1,0,0,0|2,0,0]=4 2075 B8R0.28 CC(=O)O\N=C/C(=O)O Amb27593741 [0,1,1,0,0,0|1,1,0]=4 2076 B8R0.28 CC(=O)\C=C/C=C(C)C Amb28198620 [0,1,1,0,0,0|2,0,0]=4 2077 B8R0.28 CC(=O)\C=C\C=C(C)C Amb26890921 [0,1,1,0,0,0|2,0,0]=4 2078 B8R0.28 CC(=O)\C=N\C=[N+](/C)[O-] Amb27199464 [0,1,1,0,0,0|1,1,0]=4 2079 B8R0.28 CC(=O)\C=N\OC(C)=O Amb27788385 [0,1,1,0,0,0|1,1,0]=4 2080 B8R0.28 N\C(S)=N\N=C\C(=O)O Amb27467785 [0,1,1,0,0,0|2,0,0]=4 2081 B8R0.3 C=CCC(=O)C(=O)OC Amb27838686 [0,1,1,0,0,0|1,1,0]=4 2082 B8R0.15 C=CC\C(=C/C)C(C)=O Amb28141546 [0,1,1,0,0,0|2,0,0]=4 2083 B8R0.15 C=CC\C(=N/O)C(C)=O Amb25976237 [0,1,1,0,0,0|1,0,0]=3 2084 B8R0.15 C=CC\C(=N\O)C(C)=O Amb27424745 [0,1,1,0,0,0|1,0,0]=3 2085 B8R0.23 C=C(C)CC(=C)C(C)=O Amb27215898 [0,1,1,0,0,0|2,0,0]=4 2086 B8R0.23 CC(=O)\N=C(/C)C(C)=O Amb26476592 [0,1,1,0,0,0|1,0,1]=4 2087 B8R0.18 C=C(C)\C(=N/O)C(C)=O Amb27187180 [0,1,1,0,0,0|2,0,0]=4 2088 B8R0.20 CNC(=O)\C(=N\O)SC Amb27810783 [0,1,1,0,0,0|1,0,1]=4 2089 B8R0.20 COC(=O)\C(=N\O)SC Amb24540911 [0,1,1,0,0,0|1,0,1]=4 2090 B8R1.1 BrCc1nc(Br)cs1 Amb22886695 [1,1,0,0,0,0|1,0,1]=4 2091 B8R1.1 BrCc1ncc(Br)s1 Amb28204021 [1,1,0,0,0,0|1,0,1]=4 2092 B8R1.1 BrCc1ncc(I)s1 Amb27866703 [1,1,0,0,0,0|1,0,1]=4 2093 B8R1.1 C#Cc1nc(C)cs1 Amb22750724 [1,1,0,0,0,0|0,0,2]=4 2094 B8R1.1 C#Cc1ncc(Br)s1 Amb33451022 [1,1,0,0,0,0|0,0,2]=4 2095 B8R1.1 C#Cc1ncc(I)s1 Amb28065242 [1,1,0,0,0,0|0,0,2]=4 2096 B8R1.1 C=Cc1cc(Br)cs1 Amb25742529 [1,1,0,0,0,0|1,0,1]=4 2097 B8R1.1 C=Cc1cc(C)cs1 Amb27390688 [1,1,0,0,0,0|1,0,1]=4 2098 B8R1.1 C=Cc1cc(Cl)cs1 Amb26887814 [1,1,0,0,0,0|1,0,1]=4 2099 B8R1.1 C=Cc1ccc(Br)s1 Amb17594904 [1,1,0,0,0,0|1,0,1]=4 2100 B8R1.1 C=Cc1ccc(C)s1 Amb26496095 [1,1,0,0,0,0|1,0,1]=4 2101 B8R1.1 C=Cc1ccc(Cl)s1 Amb17672604 [1,1,0,0,0,0|1,0,1]=4 2102 B8R1.1 C=Cc1nc(Br)cs1 Amb22748648 [1,1,0,0,0,0|0,0,1]=3 2103 B8R1.1 C=Cc1nc(C)cs1 Amb27974607 [1,1,0,0,0,0|0,0,1]=3 2104 B8R1.1 C=Cc1ncc(Br)s1 Amb33435978 [1,1,0,0,0,0|0,0,1]=3 2105 B8R1.1 C=Cc1ncc(C)s1 Amb27816672 [1,1,0,0,0,0|0,0,1]=3 2106 B8R1.1 C=Cc1nnc(N)s1 Amb27482519 [1,1,0,0,0,0|1,0,1]=4 2107 B8R1.1 CCc1cc(Br)cs1 Amb20619491 [1,1,0,0,0,0|1,0,1]=4 2108 B8R1.1 CCc1cc(N)cs1 Amb18143965 [1,1,0,0,0,0|1,0,1]=4 2109 B8R1.1 CCc1ccc(Br)s1 Amb10600651 [1,1,0,0,0,0|1,0,1]=4 2110 B8R1.1 CCc1ccc(C)s1 Amb15691670 [1,1,0,0,0,0|1,0,1]=4 2111 B8R1.1 CCc1ccc(Cl)s1 Amb25811685 [1,1,0,0,0,0|1,0,1]=4 2112 B8R1.1 CCc1ccc(F)s1 Amb27200756 [1,1,0,0,0,0|1,0,1]=4 2113 B8R1.1 CCc1ccc(I)s1 Amb24332471 [1,1,0,0,0,0|1,0,1]=4 2114 B8R1.1 CCc1ccc(N)s1 Amb10600652 [1,1,0,0,0,0|1,0,1]=4 2115 B8R1.1 CCc1ccc(O)s1 Amb20617898 [1,1,0,0,0,0|1,0,1]=4 2116 B8R1.1 CCc1ccc(S)s1 Amb17939214 [1,1,0,0,0,0|1,0,1]=4 2117 B8R1.1 CCc1nc(Br)cs1 Amb10599930 [1,1,0,0,0,0|0,0,1]=3 2118 B8R1.1 CCc1nc(C)cs1 Amb8515388 [1,1,0,0,0,0|0,0,1]=3 2119 B8R1.1 CCc1nc(Cl)cs1 Amb25807436 [1,1,0,0,0,0|0,0,1]=3 2120 B8R1.1 CCc1nc(F)cs1 Amb28203665 [1,1,0,0,0,0|0,0,1]=3 2121 B8R1.1 CCc1nc(I)cs1 Amb26420268 [1,1,0,0,0,0|0,0,1]=3 2122 B8R1.1 CCc1nc(N)cs1 Amb10599932 [1,1,0,0,0,0|0,0,1]=3 2123 B8R1.1 CCc1nc(N)ns1 Amb18203232 [1,1,0,0,0,0|1,0,1]=4 2124 B8R1.1 CCc1nc(O)cs1 Amb10599933 [1,1,0,0,0,0|0,0,1]=3 2125 B8R1.1 CCc1ncc(Br)o1 Amb25709768 [1,1,0,0,0,0|0,1,1]=4 2126 B8R1.1 CCc1ncc(Br)s1 Amb10600222 [1,1,0,0,0,0|0,0,1]=3 2127 B8R1.1 CCc1ncc(Br)s1 Amb22587370 [1,1,0,0,0,0|0,0,1]=3 2128 B8R1.1 CCc1ncc(C)s1 Amb28060646 [1,1,0,0,0,0|0,0,1]=3 2129 B8R1.1 CCc1ncc(F)s1 Amb28315697 [1,1,0,0,0,0|0,0,1]=3 2130 B8R1.1 CCc1ncc(N)o1 Amb18559669 [1,1,0,0,0,0|0,1,1]=4 2131 B8R1.1 CCc1ncc(N)s1 Amb10600224 [1,1,0,0,0,0|0,0,1]=3 2132 B8R1.1 CCc1ncc(O)s1 Amb10600225 [1,1,0,0,0,0|0,0,1]=3 2133 B8R1.1 CCc1nnc(Br)s1 Amb7173218 [1,1,0,0,0,0|1,0,1]=4 2134 B8R1.1 CCc1nnc(Cl)s1 Amb16231561 [1,1,0,0,0,0|1,0,1]=4 2135 B8R1.1 CCc1nnc(I)s1 Amb27829132 [1,1,0,0,0,0|1,0,1]=4 2136 B8R1.1 CCc1nnc(N)s1 Amb1010861 [1,1,0,0,0,0|1,0,1]=4 2137 B8R1.1 CCc1nnc(O)s1 Amb19516951 [1,1,0,0,0,0|1,0,1]=4 2138 B8R1.1 CCc1nnc(S)s1 Amb9855140 [1,1,0,0,0,0|1,0,1]=4 2139 B8R1.1 CNC1=NC(=O)CS1 Amb27838288 [1,1,0,0,0,0|1,0,1]=4 2140 B8R1.1 CNC1=NC(=O)NS1 Amb27839489 [1,1,0,0,0,0|2,0,0]=4 2141 B8R1.1 CNC1=NNC(=S)S1 Amb19781257 [1,1,0,0,0,0|2,0,0]=4 2142 B8R1.1 CNc1cc(Br)cs1 Amb18565046 [1,1,0,0,0,0|2,0,0]=4 2143 B8R1.1 CNc1ccc(Br)s1 Amb18055073 [1,1,0,0,0,0|2,0,0]=4 2144 B8R1.1 CNc1nc(Br)cs1 Amb25226769 [1,1,0,0,0,0|1,0,0]=3 2145 B8R1.1 CNc1nc(Br)ns1 Amb24435978 [1,1,0,0,0,0|2,0,0]=4 2146 B8R1.1 CNc1nc(C)cs1 Amb2609408 [1,1,0,0,0,0|1,0,0]=3 2147 B8R1.1 CNc1nc(C)ns1 Amb22886476 [1,1,0,0,0,0|2,0,0]=4 2148 B8R1.1 CNc1nc(Cl)ns1 Amb27838989 [1,1,0,0,0,0|2,0,0]=4 2149 B8R1.1 CNc1nc(N)cs1 Amb22728559 [1,1,0,0,0,0|1,0,0]=3 2150 B8R1.1 CNc1ncc(Br)s1 Amb15701423 [1,1,0,0,0,0|1,0,0]=3 2151 B8R1.1 CNc1ncc(Br)s1 Amb32664609 [1,1,0,0,0,0|1,0,0]=3 2152 B8R1.1 CNc1ncc(C)s1 Amb33484248 [1,1,0,0,0,0|1,0,0]=3 2153 B8R1.1 CNc1ncc(C)s1 Amb9681372 [1,1,0,0,0,0|1,0,0]=3 2154 B8R1.1 CNc1ncc(Cl)s1 Amb24426819 [1,1,0,0,0,0|1,0,0]=3 2155 B8R1.1 CNc1nnc(Br)s1 Amb23401912 [1,1,0,0,0,0|2,0,0]=4 2156 B8R1.1 CNc1nnc(C)s1 Amb5248350 [1,1,0,0,0,0|2,0,0]=4 2157 B8R1.1 CNc1nnc(Cl)s1 Amb23401909 [1,1,0,0,0,0|2,0,0]=4 2158 B8R1.1 COC1=NNC(=O)S1 Amb20247060 [1,1,0,0,0,0|2,0,0]=4 2159 B8R1.1 COc1cc(Br)cs1 Amb25827956 [1,1,0,0,0,0|2,0,0]=4 2160 B8R1.1 COc1cc(C)cs1 Amb28291371 [1,1,0,0,0,0|2,0,0]=4 2161 B8R1.1 COc1ccc(Br)s1 Amb18190248 [1,1,0,0,0,0|2,0,0]=4 2162 B8R1.1 COc1ccc(C)s1 Amb25108498 [1,1,0,0,0,0|2,0,0]=4 2163 B8R1.1 COc1ccc(I)s1 Amb25929678 [1,1,0,0,0,0|2,0,0]=4 2164 B8R1.1 COc1nc(Br)cs1 Amb2455771 [1,1,0,0,0,0|1,0,0]=3 2165 B8R1.1 COc1nc(C)cs1 Amb24312654 [1,1,0,0,0,0|1,0,0]=3 2166 B8R1.1 COc1nc(Cl)cs1 Amb28316136 [1,1,0,0,0,0|1,0,0]=3 2167 B8R1.1 COc1nc(I)cs1 Amb25364349 [1,1,0,0,0,0|1,0,0]=3 2168 B8R1.1 COc1ncc(Br)s1 Amb2455899 [1,1,0,0,0,0|1,0,0]=3 2169 B8R1.1 COc1ncc(Cl)s1 Amb27658756 [1,1,0,0,0,0|1,0,0]=3 2170 B8R1.1 COc1ncc(I)s1 Amb32685618 [1,1,0,0,0,0|1,0,0]=3 2171 B8R1.1 COc1ncc(N)s1 Amb20617371 [1,1,0,0,0,0|1,0,0]=3 2172 B8R1.1 COc1ncc(O)s1 Amb25782839 [1,1,0,0,0,0|1,0,0]=3 2173 B8R1.1 COc1ncc(S)s1 Amb32881063 [1,1,0,0,0,0|1,0,0]=3 2174 B8R1.1 COc1nnc(Br)s1 Amb28323044 [1,1,0,0,0,0|2,0,0]=4 2175 B8R1.1 COc1nnc(C)s1 Amb20527633 [1,1,0,0,0,0|2,0,0]=4 2176 B8R1.1 COc1nnc(Cl)s1 Amb28066708 [1,1,0,0,0,0|2,0,0]=4 2177 B8R1.1 COc1nnc(N)s1 Amb18642838 [1,1,0,0,0,0|2,0,0]=4 2178 B8R1.1 COc1nnc(O)s1 Amb19516937 [1,1,0,0,0,0|2,0,0]=4 2179 B8R1.1 COc1nnc(S)s1 Amb22551843 [1,1,0,0,0,0|2,0,0]=4 2180 B8R1.1 CSC1=NC(=O)CS1 Amb2089015 [1,1,0,0,0,0|1,0,1]=4 2181 B8R1.1 CSC1=NNC(=S)S1 Amb21867583 [1,1,0,0,0,0|2,0,0]=4 2182 B8R1.1 CSc1cc(Br)cs1 Amb25844408 [1,1,0,0,0,0|2,0,0]=4 2183 B8R1.1 CSc1cc(C)cs1 Amb26016095 [1,1,0,0,0,0|2,0,0]=4 2184 B8R1.1 CSc1cc(F)cs1 Amb27851629 [1,1,0,0,0,0|2,0,0]=4 2185 B8R1.1 CSc1ccc(Br)s1 Amb26013080 [1,1,0,0,0,0|2,0,0]=4 2186 B8R1.1 CSc1ccc(C)s1 Amb17672797 [1,1,0,0,0,0|2,0,0]=4 2187 B8R1.1 CSc1ccc(Cl)s1 Amb25980290 [1,1,0,0,0,0|2,0,0]=4 2188 B8R1.1 CSc1nc(Br)cs1 Amb2455773 [1,1,0,0,0,0|1,0,0]=3 2189 B8R1.1 CSc1nc(Br)ns1 Amb2691719 [1,1,0,0,0,0|2,0,0]=4 2190 B8R1.1 CSc1nc(C)cs1 Amb24334238 [1,1,0,0,0,0|1,0,0]=3 2191 B8R1.1 CSc1nc(Cl)ns1 Amb2691718 [1,1,0,0,0,0|2,0,0]=4 2192 B8R1.1 CSc1nc(N)cs1 Amb20617459 [1,1,0,0,0,0|1,0,0]=3 2193 B8R1.1 CSc1nc(O)ns1 Amb2688766 [1,1,0,0,0,0|2,0,0]=4 2194 B8R1.1 CSc1ncc(Br)s1 Amb20617253 [1,1,0,0,0,0|1,0,0]=3 2195 B8R1.1 CSc1ncc(C)o1 Amb27963268 [1,1,0,0,0,0|1,1,0]=4 2196 B8R1.1 CSc1ncc(Cl)s1 Amb28049352 [1,1,0,0,0,0|1,0,0]=3 2197 B8R1.1 CSc1ncc(I)s1 Amb27660837 [1,1,0,0,0,0|1,0,0]=3 2198 B8R1.1 CSc1ncc(N)s1 Amb16233781 [1,1,0,0,0,0|1,0,0]=3 2199 B8R1.1 CSc1nnc(C)s1 Amb25992692 [1,1,0,0,0,0|2,0,0]=4 2200 B8R1.1 CSc1nnc(Cl)s1 Amb25997781 [1,1,0,0,0,0|2,0,0]=4 2201 B8R1.1 CSc1nnc(F)s1 Amb26052824 [1,1,0,0,0,0|2,0,0]=4 2202 B8R1.1 CSc1nnc(N)s1 Amb6355783 [1,1,0,0,0,0|2,0,0]=4 2203 B8R1.1 CSc1nnc(S)s1 Amb1647539 [1,1,0,0,0,0|2,0,0]=4 2204 B8R1.1 C\C=C1/C=CC(=O)S1 Amb27638992 [1,1,0,0,0,0|1,0,0]=3 2205 B8R1.1 Cc1cc(C=O)no1 Amb33546829 [1,1,0,0,0,0|2,0,0]=4 2206 B8R1.1 Cc1cc(C=O)ns1 Amb8010955 [1,1,0,0,0,0|2,0,0]=4 2207 B8R1.1 Cc1cc(C=O)sn1 Amb8010957 [1,1,0,0,0,0|2,0,0]=4 2208 B8R1.1 Cc1ccc(C=O)o1 Amb1151338 [1,1,0,0,0,0|1,1,0]=4 2209 B8R1.1 Cc1ccc(C=O)s1 Amb2447398 [1,1,0,0,0,0|1,0,0]=3 2210 B8R1.1 Cc1cnc(C#N)s1 Amb10602098 [1,1,0,0,0,0|1,0,1]=4 2211 B8R1.1 Cc1cnc(C=O)o1 Amb8010965 [1,1,0,0,0,0|0,1,0]=3 2212 B8R1.1 Cc1cnc(C=O)s1 Amb8010590 [1,1,0,0,0,0|0,0,0]=2 2213 B8R1.1 Cc1cnc(CBr)s1 Amb26887833 [1,1,0,0,0,0|1,0,1]=4 2214 B8R1.1 Cc1cnc(CCl)s1 Amb16187170 [1,1,0,0,0,0|1,0,1]=4 2215 B8R1.1 Cc1cnc(CN)s1 Amb21959892 [1,1,0,0,0,0|1,0,1]=4 2216 B8R1.1 Cc1cnc(CN)s1 Amb5754155 [1,1,0,0,0,0|1,0,1]=4 2217 B8R1.1 Cc1cnc(CO)s1 Amb8388249 [1,1,0,0,0,0|0,0,2]=4 2218 B8R1.1 Cc1cnc(CS)s1 Amb32650892 [1,1,0,0,0,0|0,1,1]=4 2219 B8R1.1 Cc1coc(C=O)c1 Amb18124164 [1,1,0,0,0,0|1,1,0]=4 2220 B8R1.1 Cc1coc(C=O)n1 Amb8010964 [1,1,0,0,0,0|0,1,0]=3 2221 B8R1.1 Cc1csc(C#N)n1 Amb20672091 [1,1,0,0,0,0|1,0,1]=4 2222 B8R1.1 Cc1csc(C=O)c1 Amb2447336 [1,1,0,0,0,0|1,0,0]=3 2223 B8R1.1 Cc1csc(C=O)n1 Amb5494084 [1,1,0,0,0,0|0,0,0]=2 2224 B8R1.1 Cc1csc(CBr)n1 Amb23571389 [1,1,0,0,0,0|1,0,1]=4 2225 B8R1.1 Cc1csc(CCl)n1 Amb10607778 [1,1,0,0,0,0|1,0,1]=4 2226 B8R1.1 Cc1csc(CCl)n1 Amb5759012 [1,1,0,0,0,0|1,0,1]=4 2227 B8R1.1 Cc1csc(CN)n1 Amb22899001 [1,1,0,0,0,0|1,0,1]=4 2228 B8R1.1 Cc1csc(CN)n1 Amb2693614 [1,1,0,0,0,0|1,0,1]=4 2229 B8R1.1 Cc1csc(CN)n1 Amb488372 [1,1,0,0,0,0|1,0,1]=4 2230 B8R1.1 Cc1csc(CO)n1 Amb21959671 [1,1,0,0,0,0|0,0,2]=4 2231 B8R1.1 Cc1csc(CO)n1 Amb5494083 [1,1,0,0,0,0|0,0,2]=4 2232 B8R1.1 Cc1csc(CS)n1 Amb26906405 [1,1,0,0,0,0|0,1,1]=4 2233 B8R1.1 Cc1csc(NN)n1 Amb2606112 [1,1,0,0,0,0|2,0,0]=4 2234 B8R1.1 Cc1csc(NN)n1 Amb439639 [1,1,0,0,0,0|2,0,0]=4 2235 B8R1.1 Cc1csc(N[NH3+])n1 Amb4000218 [1,1,0,0,0,0|2,0,0]=4 2236 B8R1.1 Cc1nc(C=O)co1 Amb8010966 [1,1,0,0,0,0|2,0,0]=4 2237 B8R1.1 Cc1nc(C=O)cs1 Amb444935 [1,1,0,0,0,0|2,0,0]=4 2238 B8R1.1 Cc1nc(C=O)no1 Amb8010176 [1,1,0,0,0,0|2,0,0]=4 2239 B8R1.1 Cc1nc(C=O)ns1 Amb8010993 [1,1,0,0,0,0|2,0,0]=4 2240 B8R1.1 Cc1ncc(C=O)s1 Amb6316125 [1,1,0,0,0,0|2,0,0]=4 2241 B8R1.1 Cc1nnc(C=O)o1 Amb22011678 [1,1,0,0,0,0|1,1,0]=4 2242 B8R1.1 Cc1nnc(C=O)s1 Amb8010984 [1,1,0,0,0,0|1,0,0]=3 2243 B8R1.1 Cc1noc(C=O)n1 Amb8010177 [1,1,0,0,0,0|1,1,0]=4 2244 B8R1.1 Cc1nsc(C=O)n1 Amb8010992 [1,1,0,0,0,0|1,0,0]=3 2245 B8R1.1 ClCc1nc(Cl)cs1 Amb27879066 [1,1,0,0,0,0|1,0,1]=4 2246 B8R1.1 ClCc1ncc(Br)s1 Amb22235032 [1,1,0,0,0,0|1,0,1]=4 2247 B8R1.1 ClCc1ncc(Cl)s1 Amb33547289 [1,1,0,0,0,0|1,0,1]=4 2248 B8R1.1 Cn1ccc(C=O)n1 Amb1945611 [1,1,0,0,0,0|2,0,0]=4 2249 B8R1.1 Cn1cnc(C=O)c1 Amb2723067 [1,1,0,0,0,0|2,0,0]=4 2250 B8R1.1 Cn1cnc(C=O)n1 Amb8010943 [1,1,0,0,0,0|2,0,0]=4 2251 B8R1.1 Fc1cnc(CCl)s1 Amb28196585 [1,1,0,0,0,0|1,0,1]=4 2252 B8R1.1 N#Cc1nc(Br)cs1 Amb10599280 [1,1,0,0,0,0|1,0,1]=4 2253 B8R1.1 N#Cc1nc(Cl)cs1 Amb23439094 [1,1,0,0,0,0|1,0,1]=4 2254 B8R1.1 N#Cc1nc(F)cs1 Amb27656553 [1,1,0,0,0,0|1,0,1]=4 2255 B8R1.1 N#Cc1nc(I)cs1 Amb26423970 [1,1,0,0,0,0|1,0,1]=4 2256 B8R1.1 N#Cc1nc(N)cs1 Amb13884086 [1,1,0,0,0,0|1,0,1]=4 2257 B8R1.1 N#Cc1ncc(Br)s1 Amb13884063 [1,1,0,0,0,0|1,0,1]=4 2258 B8R1.1 N#Cc1ncc(Cl)s1 Amb26563260 [1,1,0,0,0,0|1,0,1]=4 2259 B8R1.1 N#Cc1ncc(F)s1 Amb26921485 [1,1,0,0,0,0|1,0,1]=4 2260 B8R1.1 N#Cc1ncc(I)s1 Amb24481542 [1,1,0,0,0,0|1,0,1]=4 2261 B8R1.1 N#Cc1ncc(N)s1 Amb22386929 [1,1,0,0,0,0|1,0,1]=4 2262 B8R1.1 NCc1nc(Br)cs1 Amb22491035 [1,1,0,0,0,0|1,0,1]=4 2263 B8R1.1 NCc1nc(Cl)cs1 Amb28323999 [1,1,0,0,0,0|1,0,1]=4 2264 B8R1.1 NCc1nc(N)cs1 Amb18203229 [1,1,0,0,0,0|1,0,1]=4 2265 B8R1.1 NCc1ncc(Br)s1 Amb22491236 [1,1,0,0,0,0|1,0,1]=4 2266 B8R1.1 NCc1ncc(Br)s1 Amb24078539 [1,1,0,0,0,0|1,0,1]=4 2267 B8R1.1 NCc1ncc(Cl)s1 Amb22756252 [1,1,0,0,0,0|1,0,1]=4 2268 B8R1.1 NCc1ncc(Cl)s1 Amb24723328 [1,1,0,0,0,0|1,0,1]=4 2269 B8R1.1 NNc1nc(Br)cs1 Amb28077656 [1,1,0,0,0,0|2,0,0]=4 2270 B8R1.1 NNc1nc(O)cs1 Amb35679359 [1,1,0,0,0,0|2,0,0]=4 2271 B8R1.1 NNc1ncc(Br)s1 Amb27460783 [1,1,0,0,0,0|2,0,0]=4 2272 B8R1.1 Nc1ccc(C=O)o1 Amb18833112 [1,1,0,0,0,0|1,1,0]=4 2273 B8R1.1 Nc1ccc(C=O)s1 Amb18202442 [1,1,0,0,0,0|1,0,0]=3 2274 B8R1.1 Nc1coc(C=O)c1 Amb18833113 [1,1,0,0,0,0|1,1,0]=4 2275 B8R1.1 Nc1csc(C=O)c1 Amb18679453 [1,1,0,0,0,0|1,0,0]=3 2276 B8R1.1 Nc1csc(CCl)n1 Amb28076074 [1,1,0,0,0,0|1,0,1]=4 2277 B8R1.1 Nc1nc(C=O)co1 Amb27482554 [1,1,0,0,0,0|2,0,0]=4 2278 B8R1.1 Nc1nc(C=O)cs1 Amb21964509 [1,1,0,0,0,0|2,0,0]=4 2279 B8R1.1 Nc1ncc(C=O)s1 Amb535864 [1,1,0,0,0,0|2,0,0]=4 2280 B8R1.1 Nc1ncc(C=O)s1 Amb8631369 [1,1,0,0,0,0|2,0,0]=4 2281 B8R1.1 Nc1nnc(C=O)o1 Amb18833085 [1,1,0,0,0,0|1,1,0]=4 2282 B8R1.1 Nc1nnc(C=O)s1 Amb19515511 [1,1,0,0,0,0|1,0,0]=3 2283 B8R1.1 O=CC1=CSC(=O)S1 Amb25984894 [1,1,0,0,0,0|2,0,0]=4 2284 B8R1.1 O=CC1=CSC(=S)S1 Amb27464107 [1,1,0,0,0,0|2,0,0]=4 2285 B8R1.1 O=CC1=NC(=O)CS1 Amb35679379 [1,1,0,0,0,0|0,0,1]=3 2286 B8R1.1 O=CC1=NNC(=O)C1 Amb18203380 [1,1,0,0,0,0|2,0,0]=4 2287 B8R1.1 O=CC1=NOC(=O)C1 Amb27209562 [1,1,0,0,0,0|2,0,0]=4 2288 B8R1.1 O=Cc1cc(Br)co1 Amb2685260 [1,1,0,0,0,0|1,1,0]=4 2289 B8R1.1 O=Cc1cc(Br)cs1 Amb1806177 [1,1,0,0,0,0|1,0,0]=3 2290 B8R1.1 O=Cc1cc(Cl)co1 Amb18642825 [1,1,0,0,0,0|1,1,0]=4 2291 B8R1.1 O=Cc1cc(Cl)cs1 Amb33544156 [1,1,0,0,0,0|1,0,0]=3 2292 B8R1.1 O=Cc1cc(F)co1 Amb18833044 [1,1,0,0,0,0|1,1,0]=4 2293 B8R1.1 O=Cc1cc(F)cs1 Amb18832536 [1,1,0,0,0,0|1,0,0]=3 2294 B8R1.1 O=Cc1cc(I)cs1 Amb21962048 [1,1,0,0,0,0|1,0,0]=3 2295 B8R1.1 O=Cc1cc(O)co1 Amb28049029 [1,1,0,0,0,0|1,1,0]=4 2296 B8R1.1 O=Cc1cc(O)cs1 Amb28138899 [1,1,0,0,0,0|1,0,0]=3 2297 B8R1.1 O=Cc1ccc(Br)o1 Amb1153092 [1,1,0,0,0,0|1,1,0]=4 2298 B8R1.1 O=Cc1ccc(Br)s1 Amb1161542 [1,1,0,0,0,0|1,0,0]=3 2299 B8R1.1 O=Cc1ccc(Cl)o1 Amb1157854 [1,1,0,0,0,0|1,1,0]=4 2300 B8R1.1 O=Cc1ccc(Cl)s1 Amb1159320 [1,1,0,0,0,0|1,0,0]=3 2301 B8R1.1 O=Cc1ccc(F)o1 Amb18203364 [1,1,0,0,0,0|1,1,0]=4 2302 B8R1.1 O=Cc1ccc(F)s1 Amb10249047 [1,1,0,0,0,0|1,0,0]=3 2303 B8R1.1 O=Cc1ccc(I)o1 Amb1669363 [1,1,0,0,0,0|1,1,0]=4 2304 B8R1.1 O=Cc1ccc(I)s1 Amb20621479 [1,1,0,0,0,0|1,0,0]=3 2305 B8R1.1 O=Cc1ccc(O)o1 Amb26370088 [1,1,0,0,0,0|1,1,0]=4 2306 B8R1.1 O=Cc1ccc(O)s1 Amb24741796 [1,1,0,0,0,0|1,0,0]=3 2307 B8R1.1 O=Cc1ccc(S)s1 Amb26641991 [1,1,0,0,0,0|1,0,0]=3 2308 B8R1.1 O=Cc1cn(Br)cn1 Amb20248185 [1,1,0,0,0,0|2,0,0]=4 2309 B8R1.1 O=Cc1cnc(Br)s1 Amb2455702 [1,1,0,0,0,0|2,0,0]=4 2310 B8R1.1 O=Cc1cnc(Cl)s1 Amb2407120 [1,1,0,0,0,0|2,0,0]=4 2311 B8R1.1 O=Cc1cnc(O)s1 Amb18832574 [1,1,0,0,0,0|2,0,0]=4 2312 B8R1.1 O=Cc1coc(Br)n1 Amb10067556 [1,1,0,0,0,0|2,0,0]=4 2313 B8R1.1 O=Cc1coc(Cl)n1 Amb27228792 [1,1,0,0,0,0|2,0,0]=4 2314 B8R1.1 O=Cc1csc(Br)n1 Amb10067250 [1,1,0,0,0,0|2,0,0]=4 2315 B8R1.1 O=Cc1csc(Cl)n1 Amb10067275 [1,1,0,0,0,0|2,0,0]=4 2316 B8R1.1 O=Cc1nc(Br)cs1 Amb2447476 [1,1,0,0,0,0|0,0,0]=2 2317 B8R1.1 O=Cc1nc(Br)no1 Amb25269884 [1,1,0,0,0,0|1,1,0]=4 2318 B8R1.1 O=Cc1nc(Cl)cs1 Amb26625051 [1,1,0,0,0,0|0,0,0]=2 2319 B8R1.1 O=Cc1nc(O)cs1 Amb35710100 [1,1,0,0,0,0|0,0,0]=2 2320 B8R1.1 O=Cc1ncc(Br)s1 Amb10606154 [1,1,0,0,0,0|0,0,0]=2 2321 B8R1.1 O=Cc1ncc(Cl)s1 Amb10071211 [1,1,0,0,0,0|0,0,0]=2 2322 B8R1.1 O=Cc1ncc(I)s1 Amb27459548 [1,1,0,0,0,0|0,0,0]=2 2323 B8R1.1 O=Cc1nnc(Br)s1 Amb23402889 [1,1,0,0,0,0|1,0,0]=3 2324 B8R1.1 O=Cc1nnc(Cl)s1 Amb23402888 [1,1,0,0,0,0|1,0,0]=3 2325 B8R1.1 O=Cc1noc(Cl)n1 Amb27976003 [1,1,0,0,0,0|2,0,0]=4 2326 B8R1.1 OCc1nc(Br)cs1 Amb22002368 [1,1,0,0,0,0|0,0,2]=4 2327 B8R1.1 OCc1nc(Cl)cs1 Amb27946426 [1,1,0,0,0,0|0,0,2]=4 2328 B8R1.1 OCc1ncc(Br)s1 Amb33530470 [1,1,0,0,0,0|0,0,2]=4 2329 B8R1.1 OCc1ncc(Cl)s1 Amb23439248 [1,1,0,0,0,0|0,0,2]=4 2330 B8R1.1 ONc1nc(Cl)cs1 Amb27481094 [1,1,0,0,0,0|1,0,1]=4 2331 B8R1.1 Oc1csc(CCl)n1 Amb35710101 [1,1,0,0,0,0|1,0,1]=4 2332 B8R1.1 SCc1ncc(Br)s1 Amb32650893 [1,1,0,0,0,0|0,1,1]=4 2333 B8R1.1 SCc1ncc(Cl)s1 Amb32788322 [1,1,0,0,0,0|0,1,1]=4 2334 B8R1.1 SCc1ncc(I)s1 Amb32788569 [1,1,0,0,0,0|0,1,1]=4 2335 B8R1.1 [C-]#[N+]c1nc(C)cs1 Amb33747259 [1,1,0,0,0,0|1,0,1]=4 2336 B8R1.1 [C-]#[N+]c1ncc(Br)s1 Amb33434433 [1,1,0,0,0,0|1,0,1]=4 2337 B8R1.1 [C-]#[N+]c1ncc(C)s1 Amb33733581 [1,1,0,0,0,0|1,0,1]=4 2338 B8R1.8 BrCCc1cccs1 Amb16234134 [1,1,0,0,0,0|1,0,1]=4 2339 B8R1.8 BrCCc1nccs1 Amb25189038 [1,1,0,0,0,0|0,0,1]=3 2340 B8R1.8 Br\C=C\c1cccs1 Amb33134763 [1,1,0,0,0,0|1,0,1]=4 2341 B8R1.8 Br\C=C\c1nccs1 Amb33135037 [1,1,0,0,0,0|0,0,1]=3 2342 B8R1.8 C#CCc1nccs1 Amb27227632 [1,1,0,0,0,0|0,0,2]=4 2343 B8R1.8 C=CCc1cccs1 Amb27882648 [1,1,0,0,0,0|1,0,1]=4 2344 B8R1.8 C=NCc1nccs1 Amb24517142 [1,1,0,0,0,0|0,0,2]=4 2345 B8R1.8 CC#Cc1cccs1 Amb27878886 [1,1,0,0,0,0|1,0,1]=4 2346 B8R1.8 CCCc1cccs1 Amb2690417 [1,1,0,0,0,0|1,0,1]=4 2347 B8R1.8 CCCc1nccs1 Amb2725496 [1,1,0,0,0,0|0,0,1]=3 2348 B8R1.8 CCNc1ncco1 Amb25744100 [1,1,0,0,0,0|0,1,1]=4 2349 B8R1.8 CCNc1nccs1 Amb6626337 [1,1,0,0,0,0|0,0,1]=3 2350 B8R1.8 CCOc1ncco1 Amb28196629 [1,1,0,0,0,0|0,1,1]=4 2351 B8R1.8 CCOc1nccs1 Amb2455931 [1,1,0,0,0,0|0,0,1]=3 2352 B8R1.8 CCSc1cccs1 Amb17845323 [1,1,0,0,0,0|1,0,1]=4 2353 B8R1.8 CCSc1ncco1 Amb28365973 [1,1,0,0,0,0|0,1,1]=4 2354 B8R1.8 CCSc1nccs1 Amb27230033 [1,1,0,0,0,0|0,0,1]=3 2355 B8R1.8 CCSc1nncs1 Amb24532191 [1,1,0,0,0,0|1,0,1]=4 2356 B8R1.8 CNCc1cccs1 Amb1152299 [1,1,0,0,0,0|1,0,1]=4 2357 B8R1.8 CNCc1cccs1 Amb6344856 [1,1,0,0,0,0|1,0,1]=4 2358 B8R1.8 CNCc1ncco1 Amb8009701 [1,1,0,0,0,0|0,1,1]=4 2359 B8R1.8 CNCc1nccs1 Amb21959839 [1,1,0,0,0,0|0,0,1]=3 2360 B8R1.8 CNCc1nccs1 Amb7543836 [1,1,0,0,0,0|0,0,1]=3 2361 B8R1.8 CNCc1nncs1 Amb27857633 [1,1,0,0,0,0|1,0,1]=4 2362 B8R1.8 CNSc1nncs1 Amb1827694 [1,1,0,0,0,0|2,0,0]=4 2363 B8R1.8 COCc1cccs1 Amb25169518 [1,1,0,0,0,0|1,0,1]=4 2364 B8R1.8 CONc1nccs1 Amb27880087 [1,1,0,0,0,0|1,0,0]=3 2365 B8R1.8 C\N=C\c1cccs1 Amb27849144 [1,1,0,0,0,0|1,0,0]=3 2366 B8R1.8 ClCCc1cccs1 Amb9004334 [1,1,0,0,0,0|1,0,1]=4 2367 B8R1.8 ClCSc1cccs1 Amb28347488 [1,1,0,0,0,0|2,0,0]=4 2368 B8R1.8 ClCSc1nccs1 Amb28247887 [1,1,0,0,0,0|1,0,0]=3 2369 B8R1.8 Cl\N=N\c1nccs1 Amb28133026 [1,1,0,0,0,0|2,0,0]=4 2370 B8R1.8 N#CCc1nccs1 Amb2796073 [1,1,0,0,0,0|0,0,2]=4 2371 B8R1.8 N#CNc1nccs1 Amb1981495 [1,1,0,0,0,0|1,0,1]=4 2372 B8R1.8 NCCc1cccs1 Amb1073690 [1,1,0,0,0,0|1,0,1]=4 2373 B8R1.8 NCCc1cccs1 Amb6858256 [1,1,0,0,0,0|1,0,1]=4 2374 B8R1.8 NCCc1ncco1 Amb8009425 [1,1,0,0,0,0|0,1,1]=4 2375 B8R1.8 NCCc1nccs1 Amb10072657 [1,1,0,0,0,0|0,0,1]=3 2376 B8R1.8 NCCc1nccs1 Amb15741139 [1,1,0,0,0,0|0,0,1]=3 2377 B8R1.8 NCCc1nccs1 Amb5754073 [1,1,0,0,0,0|0,0,1]=3 2378 B8R1.8 NCCc1ncns1 Amb18203234 [1,1,0,0,0,0|1,0,1]=4 2379 B8R1.8 NCCc1nncs1 Amb23439703 [1,1,0,0,0,0|1,0,1]=4 2380 B8R1.8 NCCc1nncs1 Amb24700378 [1,1,0,0,0,0|1,0,1]=4 2381 B8R1.8 NNCc1nccs1 Amb28347466 [1,1,0,0,0,0|1,0,1]=4 2382 B8R1.8 NOCc1nccs1 Amb26959264 [1,1,0,0,0,0|0,0,2]=4 2383 B8R1.8 N\N=C\c1nccs1 Amb27768186 [1,1,0,0,0,0|1,0,0]=3 2384 B8R1.8 O=C=Cc1cccs1 Amb27632892 [1,1,0,0,0,0|1,0,0]=3 2385 B8R1.8 O=C=Nc1cccs1 Amb2723194 [1,1,0,0,0,0|1,0,1]=4 2386 B8R1.8 O=CCc1ccco1 Amb17089526 [1,1,0,0,0,0|1,1,0]=4 2387 B8R1.8 O=CCc1cccs1 Amb17089527 [1,1,0,0,0,0|1,0,0]=3 2388 B8R1.8 O=CCc1ccon1 Amb26390824 [1,1,0,0,0,0|2,0,0]=4 2389 B8R1.8 O=CCc1ccsn1 Amb27190366 [1,1,0,0,0,0|2,0,0]=4 2390 B8R1.8 O=CCc1cncs1 Amb28316235 [1,1,0,0,0,0|2,0,0]=4 2391 B8R1.8 O=CCc1cscn1 Amb24469342 [1,1,0,0,0,0|2,0,0]=4 2392 B8R1.8 O=CCc1ncco1 Amb26946687 [1,1,0,0,0,0|0,1,0]=3 2393 B8R1.8 O=CCc1nccs1 Amb26856976 [1,1,0,0,0,0|0,0,0]=2 2394 B8R1.8 O=CCn1cccn1 Amb32411521 [1,1,0,0,0,0|2,0,0]=4 2395 B8R1.8 O=CNc1ccco1 Amb28135036 [1,1,0,0,0,0|1,1,0]=4 2396 B8R1.8 O=CNc1cccs1 Amb28282647 [1,1,0,0,0,0|1,0,0]=3 2397 B8R1.8 O=CNc1nccs1 Amb10561672 [1,1,0,0,0,0|0,0,0]=2 2398 B8R1.8 O=CNc1ncon1 Amb27838423 [1,1,0,0,0,0|2,0,0]=4 2399 B8R1.8 O=CNc1nnns1 Amb35605298 [1,1,0,0,0,0|2,0,0]=4 2400 B8R1.8 O=COc1ccco1 Amb27591421 [1,1,0,0,0,0|1,1,0]=4 2401 B8R1.8 O=COc1cccs1 Amb27798954 [1,1,0,0,0,0|1,0,0]=3 2402 B8R1.8 O=NNc1nccs1 Amb27862928 [1,1,0,0,0,0|1,0,0]=3 2403 B8R1.8 OCC=C1C=CC=C1 Amb27662404 [1,1,0,0,0,0|2,0,0]=4 2404 B8R1.8 OCCc1cccs1 Amb2099445 [1,1,0,0,0,0|1,0,1]=4 2405 B8R1.8 OCCc1ncco1 Amb27495611 [1,1,0,0,0,0|0,1,1]=4 2406 B8R1.8 OCCc1nccs1 Amb33547163 [1,1,0,0,0,0|0,0,1]=3 2407 B8R1.8 OCCc1nncs1 Amb33213126 [1,1,0,0,0,0|1,0,1]=4 2408 B8R1.8 OCNc1ncns1 Amb22497924 [1,1,0,0,0,0|2,0,0]=4 2409 B8R1.8 ONCc1nccs1 Amb26025896 [1,1,0,0,0,0|0,0,2]=4 2410 B8R1.8 O\N=C/c1cccs1 Amb27801792 [1,1,0,0,0,0|1,0,1]=4 2411 B8R1.8 O\N=C\c1cccs1 Amb6384738 [1,1,0,0,0,0|1,0,1]=4 2412 B8R1.8 O\N=C\c1nccs1 Amb22736216 [1,1,0,0,0,0|0,0,1]=3 2413 B8R1.8 S=C=Nc1nccs1 Amb6477792 [1,1,0,0,0,0|0,1,1]=4 2414 B8R1.8 SCCc1cccs1 Amb17399886 [1,1,0,0,0,0|1,0,1]=4 2415 B8R1.8 SCCc1nccs1 Amb20621112 [1,1,0,0,0,0|0,0,1]=3 2416 B8R1.8 [N-]=[N+]=Nc1nccs1 Amb26548754 [1,1,0,0,0,0|2,0,0]=4 2417 B8R1.11 C=Cc1nccn1C Amb27668024 [1,1,0,0,0,0|1,0,1]=4 2418 B8R1.11 C=Cc1sccc1Br Amb26342630 [1,1,0,0,0,0|1,0,1]=4 2419 B8R1.11 C=Cc1sccc1C Amb24532317 [1,1,0,0,0,0|1,0,1]=4 2420 B8R1.11 C=Cc1sccc1Cl Amb28244906 [1,1,0,0,0,0|1,0,1]=4 2421 B8R1.11 CCc1nccn1N Amb25053354 [1,1,0,0,0,0|1,0,1]=4 2422 B8R1.11 CCc1sccc1F Amb27631779 [1,1,0,0,0,0|1,0,1]=4 2423 B8R1.11 CCc1sccc1S Amb27193410 [1,1,0,0,0,0|1,0,1]=4 2424 B8R1.11 CNc1nccn1C Amb23437095 [1,1,0,0,0,0|2,0,0]=4 2425 B8R1.11 CNc1nccn1C Amb8011071 [1,1,0,0,0,0|2,0,0]=4 2426 B8R1.11 COc1nccn1C Amb27631760 [1,1,0,0,0,0|2,0,0]=4 2427 B8R1.11 COc1sccc1Br Amb24082781 [1,1,0,0,0,0|2,0,0]=4 2428 B8R1.11 COc1sccc1C Amb25064766 [1,1,0,0,0,0|2,0,0]=4 2429 B8R1.11 COc1sccc1N Amb19895576 [1,1,0,0,0,0|2,0,0]=4 2430 B8R1.11 CSc1nccn1C Amb27217595 [1,1,0,0,0,0|2,0,0]=4 2431 B8R1.11 CSc1nccn1C Amb32664666 [1,1,0,0,0,0|2,0,0]=4 2432 B8R1.11 CSc1sccc1Br Amb26864440 [1,1,0,0,0,0|2,0,0]=4 2433 B8R1.11 Cc1ccoc1C=O Amb6572128 [1,1,0,0,0,0|1,1,0]=4 2434 B8R1.11 Cc1ccsc1C=O Amb534988 [1,1,0,0,0,0|1,0,0]=3 2435 B8R1.11 Cc1cnsc1C=O Amb8010958 [1,1,0,0,0,0|2,0,0]=4 2436 B8R1.11 Cc1conc1C=O Amb8010950 [1,1,0,0,0,0|2,0,0]=4 2437 B8R1.11 Cc1csnc1C=O Amb8010954 [1,1,0,0,0,0|2,0,0]=4 2438 B8R1.11 Cc1ncsc1C=O Amb3319371 [1,1,0,0,0,0|2,0,0]=4 2439 B8R1.11 Cc1ocnc1C=O Amb8010967 [1,1,0,0,0,0|2,0,0]=4 2440 B8R1.11 Cc1scnc1C=O Amb8010963 [1,1,0,0,0,0|2,0,0]=4 2441 B8R1.11 Cn1cccc1C=O Amb2723053 [1,1,0,0,0,0|1,0,1]=4 2442 B8R1.11 Cn1ccnc1C=O Amb1107787 [1,1,0,0,0,0|1,0,0]=3 2443 B8R1.11 Cn1ccnc1N=O Amb28456474 [1,1,0,0,0,0|2,0,0]=4 2444 B8R1.11 Cn1cnnc1C=O Amb8010936 [1,1,0,0,0,0|2,0,0]=4 2445 B8R1.11 Cn1ncnc1C=O Amb18124223 [1,1,0,0,0,0|2,0,0]=4 2446 B8R1.11 Nc1ccoc1C=O Amb18203397 [1,1,0,0,0,0|1,1,0]=4 2447 B8R1.11 Nc1ccsc1C=O Amb18202433 [1,1,0,0,0,0|1,0,0]=3 2448 B8R1.11 Nc1ocnc1C=O Amb28461068 [1,1,0,0,0,0|2,0,0]=4 2449 B8R1.11 Nc1scnc1C=O Amb24527710 [1,1,0,0,0,0|2,0,0]=4 2450 B8R1.11 Nn1cccc1C=O Amb22496148 [1,1,0,0,0,0|1,0,1]=4 2451 B8R1.11 O=C1C=CS\C1=C\O Amb27401611 [1,1,0,0,0,0|1,0,1]=4 2452 B8R1.11 O=CC1=CC=CC1[Na] Amb24646434 [1,1,0,0,0,0|2,0,0]=4 2453 B8R1.11 O=CC1=NN=CC1Br Amb18191587 [1,1,0,0,0,0|2,0,0]=4 2454 B8R1.11 O=Cc1ncoc1Br Amb27858826 [1,1,0,0,0,0|2,0,0]=4 2455 B8R1.11 O=Cc1ncoc1O Amb27421558 [1,1,0,0,0,0|2,0,0]=4 2456 B8R1.11 O=Cc1ncsc1Br Amb23402177 [1,1,0,0,0,0|2,0,0]=4 2457 B8R1.11 O=Cc1ncsc1Cl Amb23402182 [1,1,0,0,0,0|2,0,0]=4 2458 B8R1.11 O=Cc1nocc1Cl Amb18199353 [1,1,0,0,0,0|2,0,0]=4 2459 B8R1.11 O=Cc1nscc1Br Amb24682820 [1,1,0,0,0,0|2,0,0]=4 2460 B8R1.11 O=Cc1occc1Br Amb2447448 [1,1,0,0,0,0|1,1,0]=4 2461 B8R1.11 O=Cc1occc1Cl Amb18202965 [1,1,0,0,0,0|1,1,0]=4 2462 B8R1.11 O=Cc1occc1F Amb18203365 [1,1,0,0,0,0|1,1,0]=4 2463 B8R1.11 O=Cc1occc1I Amb25089234 [1,1,0,0,0,0|1,1,0]=4 2464 B8R1.11 O=Cc1occc1O Amb28186907 [1,1,0,0,0,0|1,1,0]=4 2465 B8R1.11 O=Cc1sccc1Br Amb2725736 [1,1,0,0,0,0|1,0,0]=3 2466 B8R1.11 O=Cc1sccc1Cl Amb2725857 [1,1,0,0,0,0|1,0,0]=3 2467 B8R1.11 O=Cc1sccc1F Amb18832537 [1,1,0,0,0,0|1,0,0]=3 2468 B8R1.11 O=Cc1sccc1I Amb2611693 [1,1,0,0,0,0|1,0,0]=3 2469 B8R1.11 O=Cc1sccc1O Amb5719791 [1,1,0,0,0,0|1,0,0]=3 2470 B8R1.11 O=Cc1scnc1Br Amb22304735 [1,1,0,0,0,0|2,0,0]=4 2471 B8R1.11 O=Cc1scnc1Cl Amb6479172 [1,1,0,0,0,0|2,0,0]=4 2472 B8R1.11 O=Cc1sncc1Br Amb25350452 [1,1,0,0,0,0|2,0,0]=4 2473 B8R1.11 O=Cc1sncc1Cl Amb27985262 [1,1,0,0,0,0|2,0,0]=4 2474 B8R1.52 NC1(C=O)NC=CS1 Amb27491750 [1,1,0,0,0,0|0,0,2]=4 2475 B8R1.23 CC(=O)C1=CC(C)C1 Amb27802162 [0,1,0,0,1,0|1,0,1]=4 2476 B8R1.23 CC(=O)C1C=C(C)C1 Amb24676939 [0,1,0,0,1,0|1,0,1]=4 2477 B8R1.31 CC(=O)C1=C(C)CC1 Amb28316170 [0,1,0,0,1,0|1,0,1]=4 2478 B8R1.31 CC(=O)C1=C(Cl)CC1 Amb28048920 [0,1,0,0,1,0|1,0,1]=4 2479 B8R1.31 CC(C)=C1SCC1=O Amb27485319 [0,1,0,0,1,0|1,0,1]=4 2480 B8R1.38 CNC(=O)C1=CCC1 Amb27838027 [0,1,0,0,1,0|1,0,1]=4 2481 B8R1.38 COC(=O)C1=CCC1 Amb24689222 [0,1,0,0,1,0|1,0,1]=4 2482 B8R1.38 COC(=O)C1C=CC1 Amb33715996 [0,1,0,0,1,0|1,0,1]=4 2483 B10R1.13 C=C(C)c1ccc(Br)cn1 Amb20617316 [0,1,0,0,0,1|2,0,0]=4 2484 B10R1.13 C=C(C)c1ccc(Br)nc1 Amb26381805 [0,1,0,0,0,1|2,0,0]=4 2485 B10R1.13 C=C(C)c1ccc(Br)nn1 Amb20617328 [0,1,0,0,0,1|2,0,0]=4 2486 B10R1.13 C=C(C)c1ccc(C)cn1 Amb24084447 [0,1,0,0,0,1|2,0,0]=4 2487 B10R1.13 C=C(C)c1ccc(C)nc1 Amb25889903 [0,1,0,0,0,1|2,0,0]=4 2488 B10R1.13 C=C(C)c1ccc(Cl)cn1 Amb30036939 [0,1,0,0,0,1|2,0,0]=4 2489 B10R1.13 C=C(C)c1ccc(Cl)nc1 Amb20620746 [0,1,0,0,0,1|2,0,0]=4 2490 B10R1.13 C=C(C)c1ccc(Cl)nn1 Amb20617329 [0,1,0,0,0,1|2,0,0]=4 2491 B10R1.13 C=C(C)c1ccc(F)nc1 Amb24655160 [0,1,0,0,0,1|2,0,0]=4 2492 B10R1.13 C=C(C)c1ccc(N)cn1 Amb20617317 [0,1,0,0,0,1|2,0,0]=4 2493 B10R1.13 C=C(C)c1ccc(N)nc1 Amb25077205 [0,1,0,0,0,1|2,0,0]=4 2494 B10R1.13 C=C(C)c1ccc(N)nn1 Amb20617330 [0,1,0,0,0,1|2,0,0]=4 2495 B10R1.13 C=C(C)c1cnc(Br)cn1 Amb20617315 [0,1,0,0,0,1|2,0,0]=4 2496 B10R1.13 C=C(C)c1ncc(Br)cn1 Amb20617326 [0,1,0,0,0,1|2,0,0]=4 2497 B10R1.13 C=C(C)c1ncc(N)cn1 Amb20617327 [0,1,0,0,0,1|2,0,0]=4 2498 B10R1.13 C=C1C=CC(C(C)=O)=CC1 Amb24758694 [0,1,0,0,0,1|2,0,0]=4 2499 B10R1.13 CC(=O)C1=CC=C(C)CC1 Amb33803393 [0,1,0,0,0,1|2,0,0]=4 2500 B10R1.13 CC(=O)C1=CNC(=N)C=N1 Amb26398886 [0,1,0,0,0,1|1,0,0]=3 2501 B10R1.13 CC(=O)C1=CNC(=O)C=C1 Amb22744839 [0,1,0,0,0,1|1,0,1]=4 2502 B10R1.13 CC(=O)C1=CNC(=O)SC1 Amb27424829 [0,1,0,0,0,1|2,0,0]=4 2503 B10R1.13 CC(=O)C1=COC(=O)C=C1 Amb27660313 [0,1,0,0,0,1|1,1,0]=4 2504 B10R1.13 CC(=O)C1=NNC(=O)C=C1 Amb18212060 [0,1,0,0,0,1|1,0,0]=3 2505 B10R1.13 CC(=O)c1cc[n+](C)cc1 Amb32455995 [0,1,0,0,0,1|2,0,0]=4 2506 B10R1.13 CC(=O)c1ccc(Br)cc1 Amb1221363 [0,1,0,0,0,1|2,0,0]=4 2507 B10R1.13 CC(=O)c1ccc(Br)cn1 Amb10601919 [0,1,0,0,0,1|1,0,0]=3 2508 B10R1.13 CC(=O)c1ccc(Br)cn1 Amb28555577 [0,1,0,0,0,1|1,0,0]=3 2509 B10R1.13 CC(=O)c1ccc(Br)nc1 Amb6572463 [0,1,0,0,0,1|1,0,0]=3 2510 B10R1.13 CC(=O)c1ccc(C)cc1 Amb2447132 [0,1,0,0,0,1|2,0,0]=4 2511 B10R1.13 CC(=O)c1ccc(C)cn1 Amb10608263 [0,1,0,0,0,1|1,0,0]=3 2512 B10R1.13 CC(=O)c1ccc(C)cn1 Amb22587200 [0,1,0,0,0,1|1,0,0]=3 2513 B10R1.13 CC(=O)c1ccc(C)nc1 Amb2691950 [0,1,0,0,0,1|1,0,0]=3 2514 B10R1.13 CC(=O)c1ccc(C)nn1 Amb25060161 [0,1,0,0,0,1|1,0,0]=3 2515 B10R1.13 CC(=O)c1ccc(Cl)cc1 Amb2685747 [0,1,0,0,0,1|2,0,0]=4 2516 B10R1.13 CC(=O)c1ccc(Cl)cn1 Amb16191910 [0,1,0,0,0,1|1,0,0]=3 2517 B10R1.13 CC(=O)c1ccc(Cl)nc1 Amb2724757 [0,1,0,0,0,1|1,0,0]=3 2518 B10R1.13 CC(=O)c1ccc(Cl)nn1 Amb20241427 [0,1,0,0,0,1|1,0,0]=3 2519 B10R1.13 CC(=O)c1ccc(F)cc1 Amb2688007 [0,1,0,0,0,1|2,0,0]=4 2520 B10R1.13 CC(=O)c1ccc(F)cn1 Amb21864749 [0,1,0,0,0,1|1,0,0]=3 2521 B10R1.13 CC(=O)c1ccc(F)cn1 Amb33527023 [0,1,0,0,0,1|1,0,0]=3 2522 B10R1.13 CC(=O)c1ccc(F)nc1 Amb10603339 [0,1,0,0,0,1|1,0,0]=3 2523 B10R1.13 CC(=O)c1ccc(I)cc1 Amb1233200 [0,1,0,0,0,1|2,0,0]=4 2524 B10R1.13 CC(=O)c1ccc(I)nn1 Amb23585437 [0,1,0,0,0,1|1,0,0]=3 2525 B10R1.13 CC(=O)c1ccc(N)cc1 Amb22734863 [0,1,0,0,0,1|2,0,0]=4 2526 B10R1.13 CC(=O)c1ccc(N)cc1 Amb534112 [0,1,0,0,0,1|2,0,0]=4 2527 B10R1.13 CC(=O)c1ccc(N)cn1 Amb20247966 [0,1,0,0,0,1|1,0,0]=3 2528 B10R1.13 CC(=O)c1ccc(N)nc1 Amb10608783 [0,1,0,0,0,1|1,0,0]=3 2529 B10R1.13 CC(=O)c1ccc(O)cc1 Amb1212250 [0,1,0,0,0,1|2,0,0]=4 2530 B10R1.13 CC(=O)c1ccc(O)cn1 Amb16231971 [0,1,0,0,0,1|1,0,0]=3 2531 B10R1.13 CC(=O)c1ccc(S)cc1 Amb17593795 [0,1,0,0,0,1|2,0,0]=4 2532 B10R1.13 CC(=O)c1ccc(S)nc1 Amb24505216 [0,1,0,0,0,1|1,0,0]=3 2533 B10R1.13 CC(=O)c1cnc(Br)cn1 Amb24321495 [0,1,0,0,0,1|1,0,0]=3 2534 B10R1.13 CC(=O)c1cnc(Br)nc1 Amb25063412 [0,1,0,0,0,1|2,0,0]=4 2535 B10R1.13 CC(=O)c1cnc(C)cn1 Amb22755693 [0,1,0,0,0,1|1,0,0]=3 2536 B10R1.13 CC(=O)c1cnc(C)nc1 Amb18832462 [0,1,0,0,0,1|2,0,0]=4 2537 B10R1.13 CC(=O)c1cnc(C)nn1 Amb18832374 [0,1,0,0,0,1|2,0,0]=4 2538 B10R1.13 CC(=O)c1cnc(Cl)cn1 Amb16232378 [0,1,0,0,0,1|1,0,0]=3 2539 B10R1.13 CC(=O)c1cnc(Cl)nc1 Amb22277123 [0,1,0,0,0,1|2,0,0]=4 2540 B10R1.13 CC(=O)c1cnc(N)nc1 Amb22494266 [0,1,0,0,0,1|2,0,0]=4 2541 B10R1.13 CC(=O)c1cnc(O)cn1 Amb22276069 [0,1,0,0,0,1|1,0,0]=3 2542 B10R1.13 CC(=O)c1ncc(Br)cn1 Amb22235694 [0,1,0,0,0,1|1,0,0]=3 2543 B10R1.13 CC(=O)c1ncc(C)cn1 Amb22735972 [0,1,0,0,0,1|1,0,0]=3 2544 B10R1.13 CC(=O)c1ncc(Cl)cn1 Amb25716753 [0,1,0,0,0,1|1,0,0]=3 2545 B10R1.13 CC(=O)c1ncc(F)cn1 Amb19958828 [0,1,0,0,0,1|1,0,0]=3 2546 B10R1.13 CC(=O)c1ncc(O)cn1 Amb24643950 [0,1,0,0,0,1|1,0,0]=3 2547 B10R1.13 CS(=O)c1ccc(Br)cn1 Amb26913948 [0,1,0,0,0,1|2,0,0]=4 2548 B10R1.13 CS(=O)c1ccc(Br)nc1 Amb22899805 [0,1,0,0,0,1|2,0,0]=4 2549 B10R1.13 CS(=O)c1ccc(Cl)cn1 Amb27443843 [0,1,0,0,0,1|2,0,0]=4 2550 B10R1.13 CS(=O)c1ccc(Cl)nc1 Amb27966202 [0,1,0,0,0,1|2,0,0]=4 2551 B10R1.13 CS(=O)c1ccc(N)nc1 Amb26593748 [0,1,0,0,0,1|2,0,0]=4 2552 B10R1.13 CS(=O)c1ncc(Br)cn1 Amb22235937 [0,1,0,0,0,1|2,0,0]=4 2553 B10R1.13 CS(=O)c1ncc(Cl)cn1 Amb25937357 [0,1,0,0,0,1|2,0,0]=4 2554 B10R1.13 CS(=O)c1ncc(O)cn1 Amb4010234 [0,1,0,0,0,1|2,0,0]=4 2555 B10R1.13 Cc1ccc(C(=O)Cl)cn1 Amb6743370 [0,1,0,0,0,1|2,0,0]=4 2556 B10R1.13 Cc1ccc(C(=O)O)cn1 Amb2371808 [0,1,0,0,0,1|2,0,0]=4 2557 B10R1.13 Cc1ccc(C(=O)O)nc1 Amb22276156 [0,1,0,0,0,1|2,0,0]=4 2558 B10R1.13 Cc1ccc(C(=O)O)nc1 Amb33550856 [0,1,0,0,0,1|2,0,0]=4 2559 B10R1.13 Cc1ccc(C(=O)O)nc1 Amb8386316 [0,1,0,0,0,1|2,0,0]=4 2560 B10R1.13 Cc1ccc(C(=O)O)nn1 Amb33543863 [0,1,0,0,0,1|2,0,0]=4 2561 B10R1.13 Cc1ccc(C(N)=O)cn1 Amb2719765 [0,1,0,0,0,1|2,0,0]=4 2562 B10R1.13 Cc1ccc(C(N)=O)nc1 Amb25288938 [0,1,0,0,0,1|2,0,0]=4 2563 B10R1.13 Cc1cnc(C(=O)O)cn1 Amb2689674 [0,1,0,0,0,1|2,0,0]=4 2564 B10R1.13 Cc1cnc(C(=O)O)nc1 Amb10602959 [0,1,0,0,0,1|2,0,0]=4 2565 B10R1.13 Cc1cnc(C(=O)O)nn1 Amb18832134 [0,1,0,0,0,1|2,0,0]=4 2566 B10R1.13 Cc1cnc(C(N)=O)cn1 Amb2689672 [0,1,0,0,0,1|2,0,0]=4 2567 B10R1.13 Cc1cnc(C(N)=O)nc1 Amb25724440 [0,1,0,0,0,1|2,0,0]=4 2568 B10R1.13 NC(=O)C1=NNC(=O)C=C1 Amb18034022 [0,1,0,0,0,1|2,0,0]=4 2569 B10R1.13 NC(=O)c1ccc(Br)cn1 Amb2795794 [0,1,0,0,0,1|2,0,0]=4 2570 B10R1.13 NC(=O)c1ccc(Br)nc1 Amb10070703 [0,1,0,0,0,1|2,0,0]=4 2571 B10R1.13 NC(=O)c1ccc(Br)nn1 Amb22011918 [0,1,0,0,0,1|2,0,0]=4 2572 B10R1.13 NC(=O)c1ccc(Cl)cn1 Amb22500440 [0,1,0,0,0,1|2,0,0]=4 2573 B10R1.13 NC(=O)c1ccc(Cl)nc1 Amb6370850 [0,1,0,0,0,1|2,0,0]=4 2574 B10R1.13 NC(=O)c1ccc(Cl)nn1 Amb10070775 [0,1,0,0,0,1|2,0,0]=4 2575 B10R1.13 NC(=O)c1ccc(F)cn1 Amb22001839 [0,1,0,0,0,1|2,0,0]=4 2576 B10R1.13 NC(=O)c1ccc(F)nc1 Amb33545196 [0,1,0,0,0,1|2,0,0]=4 2577 B10R1.13 NC(=O)c1ccc(I)cn1 Amb24482132 [0,1,0,0,0,1|2,0,0]=4 2578 B10R1.13 NC(=O)c1ccc(I)nc1 Amb28436361 [0,1,0,0,0,1|2,0,0]=4 2579 B10R1.13 NC(=O)c1ccc(N)cn1 Amb8397288 [0,1,0,0,0,1|2,0,0]=4 2580 B10R1.13 NC(=O)c1ccc(N)nc1 Amb3997308 [0,1,0,0,0,1|2,0,0]=4 2581 B10R1.13 NC(=O)c1ccc(N)nn1 Amb18279712 [0,1,0,0,0,1|2,0,0]=4 2582 B10R1.13 NC(=O)c1ccc(O)cn1 Amb27175316 [0,1,0,0,0,1|2,0,0]=4 2583 B10R1.13 NC(=O)c1ccc(O)nc1 Amb2371669 [0,1,0,0,0,1|2,0,0]=4 2584 B10R1.13 NC(=O)c1ccc(O)nn1 Amb22497224 [0,1,0,0,0,1|2,0,0]=4 2585 B10R1.13 NC(=O)c1ccc(S)nc1 Amb24081719 [0,1,0,0,0,1|2,0,0]=4 2586 B10R1.13 NC(=O)c1ccc(S)nn1 Amb25789134 [0,1,0,0,0,1|2,0,0]=4 2587 B10R1.13 NC(=O)c1cnc(Br)cn1 Amb22755345 [0,1,0,0,0,1|2,0,0]=4 2588 B10R1.13 NC(=O)c1cnc(Cl)cn1 Amb6893046 [0,1,0,0,0,1|2,0,0]=4 2589 B10R1.13 NC(=O)c1cnc(N)cn1 Amb18643220 [0,1,0,0,0,1|2,0,0]=4 2590 B10R1.13 NC(=O)c1cnc(O)cn1 Amb24652042 [0,1,0,0,0,1|2,0,0]=4 2591 B10R1.13 NC(=O)c1ncc(Br)cn1 Amb19958036 [0,1,0,0,0,1|2,0,0]=4 2592 B10R1.13 NC(=O)c1ncc(Cl)cn1 Amb2796323 [0,1,0,0,0,1|2,0,0]=4 2593 B10R1.13 NC(=O)c1ncc(F)cn1 Amb25273424 [0,1,0,0,0,1|2,0,0]=4 2594 B10R1.13 NC(=O)c1ncc(N)cn1 Amb17739971 [0,1,0,0,0,1|2,0,0]=4 2595 B10R1.13 NC1=NN=C(C(=O)O)CS1 Amb1981824 [0,1,0,0,0,1|2,0,0]=4 2596 B10R1.13 Nc1ccc(C(=O)O)cn1 Amb1215277 [0,1,0,0,0,1|2,0,0]=4 2597 B10R1.13 Nc1ccc(C(=O)O)cn1 Amb2697552 [0,1,0,0,0,1|2,0,0]=4 2598 B10R1.13 Nc1ccc(C(=O)O)nc1 Amb2612660 [0,1,0,0,0,1|2,0,0]=4 2599 B10R1.13 Nc1ccc(C(=O)O)nc1 Amb2697551 [0,1,0,0,0,1|2,0,0]=4 2600 B10R1.13 Nc1ccc(C(=O)O)nn1 Amb2699138 [0,1,0,0,0,1|2,0,0]=4 2601 B10R1.13 Nc1cnc(C(=O)O)cn1 Amb13883736 [0,1,0,0,0,1|2,0,0]=4 2602 B10R1.13 Nc1cnc(C(=O)O)nc1 Amb2699140 [0,1,0,0,0,1|2,0,0]=4 2603 B10R1.13 O=C(Cl)c1ccc(Br)cn1 Amb10068998 [0,1,0,0,0,1|2,0,0]=4 2604 B10R1.13 O=C(Cl)c1ccc(Br)nc1 Amb20620534 [0,1,0,0,0,1|2,0,0]=4 2605 B10R1.13 O=C(Cl)c1ccc(Cl)cn1 Amb22002486 [0,1,0,0,0,1|2,0,0]=4 2606 B10R1.13 O=C(Cl)c1ccc(Cl)nc1 Amb22728126 [0,1,0,0,0,1|2,0,0]=4 2607 B10R1.13 O=C(Cl)c1ccc(Cl)nc1 Amb2725223 [0,1,0,0,0,1|2,0,0]=4 2608 B10R1.13 O=C(Cl)c1ccc(Cl)nn1 Amb10604726 [0,1,0,0,0,1|2,0,0]=4 2609 B10R1.13 O=C(Cl)c1ccc(F)cn1 Amb22388450 [0,1,0,0,0,1|2,0,0]=4 2610 B10R1.13 O=C(Cl)c1ccc(F)cn1 Amb32655805 [0,1,0,0,0,1|2,0,0]=4 2611 B10R1.13 O=C(Cl)c1ccc(F)nc1 Amb2447511 [0,1,0,0,0,1|2,0,0]=4 2612 B10R1.13 O=C(Cl)c1ccc(I)cn1 Amb27843685 [0,1,0,0,0,1|2,0,0]=4 2613 B10R1.13 O=C(Cl)c1ccc(O)cn1 Amb27860850 [0,1,0,0,0,1|2,0,0]=4 2614 B10R1.13 O=C(Cl)c1cnc(Cl)cn1 Amb21618922 [0,1,0,0,0,1|2,0,0]=4 2615 B10R1.13 O=C(Cl)c1cnc(O)cn1 Amb22499483 [0,1,0,0,0,1|2,0,0]=4 2616 B10R1.13 O=C(Cl)c1ncc(Br)cn1 Amb26386501 [0,1,0,0,0,1|2,0,0]=4 2617 B10R1.13 O=C(Cl)c1ncc(Cl)cn1 Amb24529299 [0,1,0,0,0,1|2,0,0]=4 2618 B10R1.13 O=C(Cl)c1ncc(F)cn1 Amb28461104 [0,1,0,0,0,1|2,0,0]=4 2619 B10R1.13 O=C(F)c1ccc(F)cn1 Amb27200699 [0,1,0,0,0,1|2,0,0]=4 2620 B10R1.13 O=C(O)c1ccc(Br)cn1 Amb2447466 [0,1,0,0,0,1|2,0,0]=4 2621 B10R1.13 O=C(O)c1ccc(Br)nc1 Amb2611408 [0,1,0,0,0,1|2,0,0]=4 2622 B10R1.13 O=C(O)c1ccc(Br)nn1 Amb5282888 [0,1,0,0,0,1|2,0,0]=4 2623 B10R1.13 O=C(O)c1ccc(Cl)cn1 Amb6384305 [0,1,0,0,0,1|2,0,0]=4 2624 B10R1.13 O=C(O)c1ccc(Cl)nc1 Amb535150 [0,1,0,0,0,1|2,0,0]=4 2625 B10R1.13 O=C(O)c1ccc(Cl)nn1 Amb19889556 [0,1,0,0,0,1|2,0,0]=4 2626 B10R1.13 O=C(O)c1ccc(Cl)nn1 Amb2795205 [0,1,0,0,0,1|2,0,0]=4 2627 B10R1.13 O=C(O)c1ccc(F)cn1 Amb33069076 [0,1,0,0,0,1|2,0,0]=4 2628 B10R1.13 O=C(O)c1ccc(F)cn1 Amb6306446 [0,1,0,0,0,1|2,0,0]=4 2629 B10R1.13 O=C(O)c1ccc(F)nc1 Amb2447507 [0,1,0,0,0,1|2,0,0]=4 2630 B10R1.13 O=C(O)c1ccc(I)cn1 Amb33548875 [0,1,0,0,0,1|2,0,0]=4 2631 B10R1.13 O=C(O)c1ccc(O)cn1 Amb2235994 [0,1,0,0,0,1|2,0,0]=4 2632 B10R1.13 O=C(O)c1ccc(O)cn1 Amb2697988 [0,1,0,0,0,1|2,0,0]=4 2633 B10R1.13 O=C(O)c1ccc(O)cn1 Amb30594273 [0,1,0,0,0,1|2,0,0]=4 2634 B10R1.13 O=C(O)c1ccc(O)nc1 Amb1085852 [0,1,0,0,0,1|2,0,0]=4 2635 B10R1.13 O=C(O)c1ccc(O)nn1 Amb17755179 [0,1,0,0,0,1|2,0,0]=4 2636 B10R1.13 O=C(O)c1ccc(O)nn1 Amb30634341 [0,1,0,0,0,1|2,0,0]=4 2637 B10R1.13 O=C(O)c1ccc(S)cn1 Amb18644721 [0,1,0,0,0,1|2,0,0]=4 2638 B10R1.13 O=C(O)c1cnc(Br)cn1 Amb18176908 [0,1,0,0,0,1|2,0,0]=4 2639 B10R1.13 O=C(O)c1cnc(Cl)cn1 Amb8393938 [0,1,0,0,0,1|2,0,0]=4 2640 B10R1.13 O=C(O)c1cnc(F)cn1 Amb26021568 [0,1,0,0,0,1|2,0,0]=4 2641 B10R1.13 O=C(O)c1cnc(O)cn1 Amb6892308 [0,1,0,0,0,1|2,0,0]=4 2642 B10R1.13 O=C(O)c1ncc(Br)cn1 Amb2591550 [0,1,0,0,0,1|2,0,0]=4 2643 B10R1.13 O=C(O)c1ncc(Cl)cn1 Amb2796324 [0,1,0,0,0,1|2,0,0]=4 2644 B10R1.13 O=C(O)c1ncc(F)cn1 Amb21858020 [0,1,0,0,0,1|2,0,0]=4 2645 B10R1.13 O=C(O)c1ncc(O)cn1 Amb18831952 [0,1,0,0,0,1|2,0,0]=4 2646 B10R1.13 O=C([O-])c1ccc(Cl)nn1 Amb10982486 [0,1,0,0,0,1|2,0,0]=4 2647 B10R1.13 O=C([O-])c1ccc([S-])nc1 Amb2611975 [0,1,0,0,0,1|2,0,0]=4 2648 B10R1.13 O=C([O-])c1cnc(O)cn1 Amb22284358 [0,1,0,0,0,1|2,0,0]=4 2649 B10R1.13 O=C1C=CC(C(=O)Cl)=NN1 Amb18034038 [0,1,0,0,0,1|2,0,0]=4 2650 B10R1.13 O=C1C=CC(C(=O)O)=NN1 Amb18013052 [0,1,0,0,0,1|2,0,0]=4 2651 B10R1.13 O=C1C=CC(C(=O)O)=NN1 Amb19894728 [0,1,0,0,0,1|2,0,0]=4 2652 B10R1.13 O=C1C=NC(C(=O)O)=CN1 Amb18278228 [0,1,0,0,0,1|2,0,0]=4 2653 B10R1.15 C#CC(=O)c1ccccn1 Amb28120737 [0,1,0,0,0,1|1,0,1]=4 2654 B10R1.15 C#CC(=O)c1cccnc1 Amb27272672 [0,1,0,0,0,1|1,0,1]=4 2655 B10R1.15 C=C(CBr)c1ccccn1 Amb33387999 [0,1,0,0,0,1|2,0,0]=4 2656 B10R1.15 C=C(CBr)c1cccnc1 Amb33451443 [0,1,0,0,0,1|2,0,0]=4 2657 B10R1.15 C=C(CBr)c1ccncn1 Amb33009086 [0,1,0,0,0,1|2,0,0]=4 2658 B10R1.15 C=C(CBr)c1cnccn1 Amb33451451 [0,1,0,0,0,1|2,0,0]=4 2659 B10R1.15 C=C(CBr)c1ncccn1 Amb33007416 [0,1,0,0,0,1|2,0,0]=4 2660 B10R1.15 C=C(CC)c1ccccn1 Amb24467663 [0,1,0,0,0,1|2,0,0]=4 2661 B10R1.15 C=C(CCl)c1ccccn1 Amb26577778 [0,1,0,0,0,1|2,0,0]=4 2662 B10R1.15 C=C(CCl)c1cccnc1 Amb33052569 [0,1,0,0,0,1|2,0,0]=4 2663 B10R1.15 C=C(CCl)c1ccncn1 Amb33057655 [0,1,0,0,0,1|2,0,0]=4 2664 B10R1.15 C=C(CCl)c1cnccn1 Amb33052605 [0,1,0,0,0,1|2,0,0]=4 2665 B10R1.15 C=C(CCl)c1ncccn1 Amb33223637 [0,1,0,0,0,1|2,0,0]=4 2666 B10R1.15 C=C(CN)c1ccccn1 Amb27767907 [0,1,0,0,0,1|2,0,0]=4 2667 B10R1.15 C=C(CN)c1cccnc1 Amb33360054 [0,1,0,0,0,1|2,0,0]=4 2668 B10R1.15 C=C(CN)c1ccncn1 Amb33268582 [0,1,0,0,0,1|2,0,0]=4 2669 B10R1.15 C=C(CN)c1cnccn1 Amb33429660 [0,1,0,0,0,1|2,0,0]=4 2670 B10R1.15 C=C(CN)c1ncccn1 Amb33270379 [0,1,0,0,0,1|2,0,0]=4 2671 B10R1.15 C=C(OC)c1ccccn1 Amb28141881 [0,1,0,0,0,1|2,0,0]=4 2672 B10R1.15 C=CC(=O)c1ccccn1 Amb28399382 [0,1,0,0,0,1|1,0,1]=4 2673 B10R1.15 C=CC(=O)c1cccnc1 Amb25776729 [0,1,0,0,0,1|1,0,1]=4 2674 B10R1.15 C=CC(=O)c1ccncn1 Amb27203886 [0,1,0,0,0,1|1,0,1]=4 2675 B10R1.15 C=CC(=O)c1cnccn1 Amb26594874 [0,1,0,0,0,1|1,0,1]=4 2676 B10R1.15 C=CC(=O)c1ncccn1 Amb27794168 [0,1,0,0,0,1|1,0,1]=4 2677 B10R1.15 CC(C=O)c1ccccn1 Amb29762718 [0,1,0,0,0,1|1,0,1]=4 2678 B10R1.15 CC(C=O)c1cccnc1 Amb24100578 [0,1,0,0,0,1|1,0,1]=4 2679 B10R1.15 CC(C=O)c1ccncn1 Amb33268588 [0,1,0,0,0,1|1,0,1]=4 2680 B10R1.15 CC(C=O)c1cnccn1 Amb33080013 [0,1,0,0,0,1|1,0,1]=4 2681 B10R1.15 CC(C=O)c1ncccn1 Amb26040541 [0,1,0,0,0,1|1,0,1]=4 2682 B10R1.15 CCC(=N)c1ccccn1 Amb28182447 [0,1,0,0,0,1|2,0,0]=4 2683 B10R1.15 CCC(=O)c1ccccc1 Amb4037285 [0,1,0,0,0,1|2,0,0]=4 2684 B10R1.15 CCC(=O)c1ccccn1 Amb6301470 [0,1,0,0,0,1|1,0,0]=3 2685 B10R1.15 CCC(=O)c1cccnc1 Amb8386799 [0,1,0,0,0,1|1,0,0]=3 2686 B10R1.15 CCC(=O)c1ccncc1 Amb10576400 [0,1,0,0,0,1|2,0,0]=4 2687 B10R1.15 CCC(=O)c1ccncn1 Amb25737542 [0,1,0,0,0,1|1,0,0]=3 2688 B10R1.15 CCC(=O)c1cnccn1 Amb22235242 [0,1,0,0,0,1|1,0,0]=3 2689 B10R1.15 CCC(=O)c1cncnc1 Amb24082134 [0,1,0,0,0,1|2,0,0]=4 2690 B10R1.15 CCC(=O)c1cnncn1 Amb18203073 [0,1,0,0,0,1|2,0,0]=4 2691 B10R1.15 CCC(=O)c1ncccn1 Amb22236265 [0,1,0,0,0,1|1,0,0]=3 2692 B10R1.15 CCS(=O)c1ccccn1 Amb28049400 [0,1,0,0,0,1|2,0,0]=4 2693 B10R1.15 CN(C=O)c1ccccn1 Amb8396240 [0,1,0,0,0,1|2,0,0]=4 2694 B10R1.15 CN(C=O)c1cccnc1 Amb27262216 [0,1,0,0,0,1|2,0,0]=4 2695 B10R1.15 CN(N=O)c1cccnc1 Amb25254491 [0,1,0,0,0,1|2,0,0]=4 2696 B10R1.15 CNC(=N)c1cccnc1 Amb32667420 [0,1,0,0,0,1|2,0,0]=4 2697 B10R1.15 CNC(=N)c1ccncn1 Amb28119700 [0,1,0,0,0,1|2,0,0]=4 2698 B10R1.15 CNC(=N)c1cnccn1 Amb29847914 [0,1,0,0,0,1|2,0,0]=4 2699 B10R1.15 CNC(=O)C1=CC=CNC1 Amb27252063 [0,1,0,0,0,1|1,0,1]=4 2700 B10R1.15 CNC(=O)c1ccccc1 Amb2591685 [0,1,0,0,0,1|2,0,0]=4 2701 B10R1.15 CNC(=O)c1ccccn1 Amb6892873 [0,1,0,0,0,1|1,0,0]=3 2702 B10R1.15 CNC(=O)c1cccnc1 Amb3886560 [0,1,0,0,0,1|1,0,0]=3 2703 B10R1.15 CNC(=O)c1ccncc1 Amb26328844 [0,1,0,0,0,1|2,0,0]=4 2704 B10R1.15 CNC(=O)c1ccncn1 Amb27589630 [0,1,0,0,0,1|1,0,0]=3 2705 B10R1.15 CNC(=O)c1ncccn1 Amb25985661 [0,1,0,0,0,1|1,0,0]=3 2706 B10R1.15 CNC(=S)c1cccnc1 Amb27877638 [0,1,0,0,0,1|1,1,0]=4 2707 B10R1.15 COC(=N)c1cccnn1 Amb27618556 [0,1,0,0,0,1|2,0,0]=4 2708 B10R1.15 COC(=N)c1cnccn1 Amb10071951 [0,1,0,0,0,1|2,0,0]=4 2709 B10R1.15 COC(=O)C1=CC=CNC1 Amb28042598 [0,1,0,0,0,1|1,0,1]=4 2710 B10R1.15 COC(=O)C1=NCCCS1 Amb27983385 [0,1,0,0,0,1|0,0,2]=4 2711 B10R1.15 COC(=O)c1ccccc1 Amb4302710 [0,1,0,0,0,1|2,0,0]=4 2712 B10R1.15 COC(=O)c1ccccn1 Amb2721020 [0,1,0,0,0,1|1,0,0]=3 2713 B10R1.15 COC(=O)c1cccnc1 Amb1212078 [0,1,0,0,0,1|1,0,0]=3 2714 B10R1.15 COC(=O)c1cccnc1 Amb22741138 [0,1,0,0,0,1|1,0,0]=3 2715 B10R1.15 COC(=O)c1cccnn1 Amb21960450 [0,1,0,0,0,1|1,0,0]=3 2716 B10R1.15 COC(=O)c1ccncc1 Amb6608958 [0,1,0,0,0,1|2,0,0]=4 2717 B10R1.15 COC(=O)c1ccncn1 Amb7101502 [0,1,0,0,0,1|1,0,0]=3 2718 B10R1.15 COC(=O)c1ccnnc1 Amb17935713 [0,1,0,0,0,1|2,0,0]=4 2719 B10R1.15 COC(=O)c1cnccn1 Amb2455964 [0,1,0,0,0,1|1,0,0]=3 2720 B10R1.15 COC(=O)c1cnccn1 Amb33620824 [0,1,0,0,0,1|1,0,0]=3 2721 B10R1.15 COC(=O)c1cncnc1 Amb5492761 [0,1,0,0,0,1|2,0,0]=4 2722 B10R1.15 COC(=O)c1ncccn1 Amb7101492 [0,1,0,0,0,1|1,0,0]=3 2723 B10R1.15 COC(=O)c1nccnn1 Amb25327432 [0,1,0,0,0,1|1,0,0]=3 2724 B10R1.15 CSC(=O)c1ccccn1 Amb1487227 [0,1,0,0,0,1|1,0,0]=3 2725 B10R1.15 C\C(=C\Br)c1ccccn1 Amb25248819 [0,1,0,0,0,1|2,0,0]=4 2726 B10R1.15 C\C(=C\Br)c1cccnc1 Amb27471976 [0,1,0,0,0,1|2,0,0]=4 2727 B10R1.15 C\C(=C\Br)c1ccncn1 Amb28245272 [0,1,0,0,0,1|2,0,0]=4 2728 B10R1.15 C\C(=N/N)c1ccccn1 Amb22552431 [0,1,0,0,0,1|2,0,0]=4 2729 B10R1.15 C\C(=N/N)c1cnccn1 Amb20623314 [0,1,0,0,0,1|2,0,0]=4 2730 B10R1.15 C\C(=N/O)c1ccccn1 Amb2780070 [0,1,0,0,0,1|1,0,1]=4 2731 B10R1.15 C\C(=N/O)c1cccnc1 Amb598353 [0,1,0,0,0,1|1,0,1]=4 2732 B10R1.15 C\C(=N/O)c1cnccn1 Amb31295276 [0,1,0,0,0,1|1,0,1]=4 2733 B10R1.15 C\C(=N\N)c1cccnn1 Amb27782046 [0,1,0,0,0,1|2,0,0]=4 2734 B10R1.15 C\C(=N\O)c1ccccn1 Amb598336 [0,1,0,0,0,1|1,0,1]=4 2735 B10R1.15 C\C(=N\O)c1cccnc1 Amb10606945 [0,1,0,0,0,1|1,0,1]=4 2736 B10R1.15 C\C(=N\O)c1cnccn1 Amb2420090 [0,1,0,0,0,1|1,0,1]=4 2737 B10R1.15 C\C=C(\C)c1cccnc1 Amb27260271 [0,1,0,0,0,1|2,0,0]=4 2738 B10R1.15 C\N=C(/N)c1cccnc1 Amb21970335 [0,1,0,0,0,1|2,0,0]=4 2739 B10R1.15 C\N=C(\C)c1ccccn1 Amb24433259 [0,1,0,0,0,1|2,0,0]=4 2740 B10R1.15 C\N=C(\N)c1cccnc1 Amb28555473 [0,1,0,0,0,1|2,0,0]=4 2741 B10R1.15 NC(=S=O)c1ccccn1 Amb28291302 [0,1,0,0,0,1|2,0,0]=4 2742 B10R1.15 NC(=S=O)c1cccnc1 Amb27791856 [0,1,0,0,0,1|2,0,0]=4 2743 B10R1.15 NCC(=O)c1ccccc1 Amb1073498 [0,1,0,0,0,1|2,0,0]=4 2744 B10R1.15 NCC(=O)c1ccccc1 Amb33531112 [0,1,0,0,0,1|2,0,0]=4 2745 B10R1.15 NCC(=O)c1ccccn1 Amb10601921 [0,1,0,0,0,1|1,0,0]=3 2746 B10R1.15 NCC(=O)c1ccccn1 Amb18832469 [0,1,0,0,0,1|1,0,0]=3 2747 B10R1.15 NCC(=O)c1cccnc1 Amb17607867 [0,1,0,0,0,1|1,0,0]=3 2748 B10R1.15 NCC(=O)c1cccnc1 Amb22277079 [0,1,0,0,0,1|1,0,0]=3 2749 B10R1.15 NCC(=O)c1cccnc1 Amb22754018 [0,1,0,0,0,1|1,0,0]=3 2750 B10R1.15 NCC(=O)c1ccncc1 Amb18832471 [0,1,0,0,0,1|2,0,0]=4 2751 B10R1.15 NCC(=O)c1ccncc1 Amb22002046 [0,1,0,0,0,1|2,0,0]=4 2752 B10R1.15 NCC(=O)c1ccncn1 Amb18832380 [0,1,0,0,0,1|1,0,0]=3 2753 B10R1.15 NCC(=O)c1cnccn1 Amb21862012 [0,1,0,0,0,1|1,0,0]=3 2754 B10R1.15 NCC(=O)c1cnccn1 Amb33038182 [0,1,0,0,0,1|1,0,0]=3 2755 B10R1.15 NCC(=O)c1cncnc1 Amb18832378 [0,1,0,0,0,1|2,0,0]=4 2756 B10R1.15 NCC(=O)c1ncccn1 Amb24105961 [0,1,0,0,0,1|1,0,0]=3 2757 B10R1.15 NNC(=O)c1ccccn1 Amb1208395 [0,1,0,0,0,1|2,0,0]=4 2758 B10R1.15 NNC(=O)c1cccnc1 Amb1786962 [0,1,0,0,0,1|2,0,0]=4 2759 B10R1.15 NNC(=O)c1cccnn1 Amb33544789 [0,1,0,0,0,1|2,0,0]=4 2760 B10R1.15 NNC(=O)c1ccncn1 Amb10844888 [0,1,0,0,0,1|2,0,0]=4 2761 B10R1.15 NNC(=O)c1cnccn1 Amb1161624 [0,1,0,0,0,1|2,0,0]=4 2762 B10R1.15 NNC(=O)c1ncccn1 Amb16231289 [0,1,0,0,0,1|2,0,0]=4 2763 B10R1.15 NNC(=O)c1nccnn1 Amb27486004 [0,1,0,0,0,1|2,0,0]=4 2764 B10R1.15 O=C(CBr)c1ccccc1 Amb33533065 [0,1,0,0,0,1|2,0,0]=4 2765 B10R1.15 O=C(CBr)c1ccccn1 Amb1980867 [0,1,0,0,0,1|1,0,0]=3 2766 B10R1.15 O=C(CBr)c1ccccn1 Amb2684941 [0,1,0,0,0,1|1,0,0]=3 2767 B10R1.15 O=C(CBr)c1cccnc1 Amb1981330 [0,1,0,0,0,1|1,0,0]=3 2768 B10R1.15 O=C(CBr)c1cccnc1 Amb2684942 [0,1,0,0,0,1|1,0,0]=3 2769 B10R1.15 O=C(CBr)c1ccncc1 Amb1981329 [0,1,0,0,0,1|2,0,0]=4 2770 B10R1.15 O=C(CBr)c1ccncc1 Amb2684943 [0,1,0,0,0,1|2,0,0]=4 2771 B10R1.15 O=C(CBr)c1ccncn1 Amb22304669 [0,1,0,0,0,1|1,0,0]=3 2772 B10R1.15 O=C(CBr)c1ccncn1 Amb22490403 [0,1,0,0,0,1|1,0,0]=3 2773 B10R1.15 O=C(CBr)c1cnccn1 Amb16233325 [0,1,0,0,0,1|1,0,0]=3 2774 B10R1.15 O=C(CBr)c1cnccn1 Amb22235528 [0,1,0,0,0,1|1,0,0]=3 2775 B10R1.15 O=C(CBr)c1cncnc1 Amb21964583 [0,1,0,0,0,1|2,0,0]=4 2776 B10R1.15 O=C(CBr)c1cncnc1 Amb22276010 [0,1,0,0,0,1|2,0,0]=4 2777 B10R1.15 O=C(CBr)c1ncccn1 Amb22304716 [0,1,0,0,0,1|1,0,0]=3 2778 B10R1.15 O=C(CBr)c1ncccn1 Amb22491896 [0,1,0,0,0,1|1,0,0]=3 2779 B10R1.15 O=C(CCl)c1ccccc1 Amb3940253 [0,1,0,0,0,1|2,0,0]=4 2780 B10R1.15 O=C(CCl)c1ccccn1 Amb33329358 [0,1,0,0,0,1|1,0,0]=3 2781 B10R1.15 O=C(CCl)c1ccccn1 Amb33545115 [0,1,0,0,0,1|1,0,0]=3 2782 B10R1.15 O=C(CCl)c1cccnc1 Amb22371841 [0,1,0,0,0,1|1,0,0]=3 2783 B10R1.15 O=C(CCl)c1cccnc1 Amb7172585 [0,1,0,0,0,1|1,0,0]=3 2784 B10R1.15 O=C(CCl)c1ccncc1 Amb22371842 [0,1,0,0,0,1|2,0,0]=4 2785 B10R1.15 O=C(CCl)c1ccncc1 Amb3319289 [0,1,0,0,0,1|2,0,0]=4 2786 B10R1.15 O=C(CCl)c1ccncn1 Amb28456565 [0,1,0,0,0,1|1,0,0]=3 2787 B10R1.15 O=C(CCl)c1cnccn1 Amb24104161 [0,1,0,0,0,1|1,0,0]=3 2788 B10R1.15 O=C(CCl)c1cncnc1 Amb25281438 [0,1,0,0,0,1|2,0,0]=4 2789 B10R1.15 O=C(CCl)c1cncnc1 Amb33330976 [0,1,0,0,0,1|2,0,0]=4 2790 B10R1.15 O=C(CCl)c1ncccn1 Amb22753079 [0,1,0,0,0,1|1,0,0]=3 2791 B10R1.15 O=C(CF)c1ccccc1 Amb10603600 [0,1,0,0,0,1|2,0,0]=4 2792 B10R1.15 O=C(CI)c1ccccc1 Amb23579972 [0,1,0,0,0,1|2,0,0]=4 2793 B10R1.15 O=C(CO)c1ccccc1 Amb3940718 [0,1,0,0,0,1|2,0,0]=4 2794 B10R1.15 O=C(CO)c1ccccn1 Amb18063640 [0,1,0,0,0,1|1,0,0]=3 2795 B10R1.15 O=C(CO)c1cccnc1 Amb18063681 [0,1,0,0,0,1|1,0,0]=3 2796 B10R1.15 O=C(CO)c1ccncc1 Amb18063686 [0,1,0,0,0,1|2,0,0]=4 2797 B10R1.15 O=C(CS)c1ccccc1 Amb16192503 [0,1,0,0,0,1|2,0,0]=4 2798 B10R1.15 O=C(C[K])c1ccncn1 Amb28287563 [0,1,0,0,0,1|1,0,0]=3 2799 B10R1.15 O=C(NCl)c1cccnc1 Amb26039027 [0,1,0,0,0,1|2,0,0]=4 2800 B10R1.15 O=C(NO)c1ccccn1 Amb6268699 [0,1,0,0,0,1|2,0,0]=4 2801 B10R1.15 O=C(NO)c1cccnc1 Amb33532633 [0,1,0,0,0,1|2,0,0]=4 2802 B10R1.15 O=C(NO)c1ccncn1 Amb24099638 [0,1,0,0,0,1|2,0,0]=4 2803 B10R1.15 O=C(NO)c1cnccn1 Amb25937815 [0,1,0,0,0,1|2,0,0]=4 2804 B10R1.15 O=C(NO)c1ncccn1 Amb26420351 [0,1,0,0,0,1|2,0,0]=4 2805 B10R1.15 O=C(OCl)c1cnccn1 Amb27776207 [0,1,0,0,0,1|2,0,0]=4 2806 B10R1.15 O=C(OO)c1cccnc1 Amb24094187 [0,1,0,0,0,1|2,0,0]=4 2807 B10R1.15 O=C(O[K])c1cccnc1 Amb3150242 [0,1,0,0,0,1|2,0,0]=4 2808 B10R1.15 O=CC(=O)c1ccccn1 Amb25066902 [0,1,0,0,0,1|1,0,1]=4 2809 B10R1.15 [NH3+]CC(=O)c1ccccc1 Amb9787668 [0,1,0,0,0,1|2,0,0]=4 2810 B10R1.28 CP(C)(=O)c1cccnc1 Amb35789353 [0,1,0,0,0,1|2,0,0]=4 2811 B10R1.28 CS(=N)(=O)c1ccccn1 Amb25293043 [0,1,0,0,0,1|2,0,0]=4 2812 B10R1.28 CS(=N)(=O)c1cccnc1 Amb35750088 [0,1,0,0,0,1|2,0,0]=4 2813 B10R1.28 CS(=N)(=O)c1cccnc1 Amb35753163 [0,1,0,0,0,1|2,0,0]=4 2814 B10R1.28 CS(=N)(=O)c1ncccn1 Amb32668633 [0,1,0,0,0,1|2,0,0]=4 2815 B10R1.28 CS(=O)(=O)c1ccccn1 Amb8853641 [0,1,0,0,0,1|2,0,0]=4 2816 B10R1.28 CS(=O)(=O)c1cccnc1 Amb8389998 [0,1,0,0,0,1|2,0,0]=4 2817 B10R1.28 CS(=O)(=O)c1ccncn1 Amb27798920 [0,1,0,0,0,1|2,0,0]=4 2818 B10R1.28 CS(=O)(=O)c1cnccn1 Amb28141870 [0,1,0,0,0,1|2,0,0]=4 2819 B10R1.28 CS(=O)(=O)c1ncccn1 Amb8853639 [0,1,0,0,0,1|2,0,0]=4 2820 B10R1.28 CS(=O)(=O)c1nccnn1 Amb25772219 [0,1,0,0,0,1|2,0,0]=4 2821 B10R1.28 C[S@](=N)(=O)c1ccccn1 Amb33743804 [0,1,0,0,0,1|2,0,0]=4 2822 B10R1.28 C[S@](=N)(=O)c1ncccn1 Amb33743803 [0,1,0,0,0,1|2,0,0]=4 2823 B10R1.61 C=C(C)c1cccnc1Br Amb32641674 [0,1,0,0,0,1|2,0,0]=4 2824 B10R1.61 C=C(C)c1cccnc1C Amb26012595 [0,1,0,0,0,1|2,0,0]=4 2825 B10R1.61 C=C(C)c1cccnc1Cl Amb27402360 [0,1,0,0,0,1|2,0,0]=4 2826 B10R1.61 C=C(C)c1cccnc1F Amb32641721 [0,1,0,0,0,1|2,0,0]=4 2827 B10R1.61 C=C(C)c1cccnc1N Amb28074334 [0,1,0,0,0,1|2,0,0]=4 2828 B10R1.61 C=C(C)c1cnccc1Br Amb32641673 [0,1,0,0,0,1|2,0,0]=4 2829 B10R1.61 C=C(C)c1cnccc1C Amb32641669 [0,1,0,0,0,1|2,0,0]=4 2830 B10R1.61 C=C(C)c1cnccc1Cl Amb32641656 [0,1,0,0,0,1|2,0,0]=4 2831 B10R1.61 C=C(C)c1ncccc1C Amb32641671 [0,1,0,0,0,1|2,0,0]=4 2832 B10R1.61 C=C(C)c1ncccc1Cl Amb26391632 [0,1,0,0,0,1|2,0,0]=4 2833 B10R1.61 C=C(C)c1ncccc1F Amb32641720 [0,1,0,0,0,1|2,0,0]=4 2834 B10R1.61 C=C(C)c1ncccc1N Amb25223722 [0,1,0,0,0,1|2,0,0]=4 2835 B10R1.61 C=C(C)c1nccnc1C Amb28250308 [0,1,0,0,0,1|2,0,0]=4 2836 B10R1.61 CC(=O)C1=C(O)N=CCC1 Amb27765694 [0,1,0,0,0,1|1,0,1]=4 2837 B10R1.61 CC(=O)C1=CC=CNC1=O Amb18263217 [0,1,0,0,0,1|1,0,1]=4 2838 B10R1.61 CC(=O)C1=CC=COC1=O Amb26018895 [0,1,0,0,0,1|1,1,0]=4 2839 B10R1.61 CC(=O)C1=CCC=CN1C Amb27816898 [0,1,0,0,0,1|1,0,1]=4 2840 B10R1.61 CC(=O)C1=CNC=CC1=O Amb22522167 [0,1,0,0,0,1|1,0,1]=4 2841 B10R1.61 CC(=O)C1=NC=CNC1=O Amb27665834 [0,1,0,0,0,1|1,0,0]=3 2842 B10R1.61 CC(=O)C1SCC=CC1C Amb28204193 [0,1,0,0,0,1|1,0,1]=4 2843 B10R1.61 CC(=O)c1cccc[n+]1C Amb32455992 [0,1,0,0,0,1|1,0,1]=4 2844 B10R1.61 CC(=O)c1ccccc1Br Amb1232838 [0,1,0,0,0,1|2,0,0]=4 2845 B10R1.61 CC(=O)c1ccccc1C Amb2792441 [0,1,0,0,0,1|2,0,0]=4 2846 B10R1.61 CC(=O)c1ccccc1Cl Amb2685746 [0,1,0,0,0,1|2,0,0]=4 2847 B10R1.61 CC(=O)c1ccccc1F Amb2688005 [0,1,0,0,0,1|2,0,0]=4 2848 B10R1.61 CC(=O)c1ccccc1I Amb8517635 [0,1,0,0,0,1|2,0,0]=4 2849 B10R1.61 CC(=O)c1ccccc1N Amb2725478 [0,1,0,0,0,1|2,0,0]=4 2850 B10R1.61 CC(=O)c1ccccc1N Amb6296708 [0,1,0,0,0,1|2,0,0]=4 2851 B10R1.61 CC(=O)c1ccccc1O Amb2792764 [0,1,0,0,0,1|2,0,0]=4 2852 B10R1.61 CC(=O)c1ccccc1S Amb22396354 [0,1,0,0,0,1|2,0,0]=4 2853 B10R1.61 CC(=O)c1cccnc1Br Amb10602206 [0,1,0,0,0,1|1,0,0]=3 2854 B10R1.61 CC(=O)c1cccnc1C Amb18832502 [0,1,0,0,0,1|1,0,0]=3 2855 B10R1.61 CC(=O)c1cccnc1Cl Amb6384399 [0,1,0,0,0,1|1,0,0]=3 2856 B10R1.61 CC(=O)c1cccnc1F Amb2447597 [0,1,0,0,0,1|1,0,0]=3 2857 B10R1.61 CC(=O)c1cccnc1N Amb6384452 [0,1,0,0,0,1|1,0,0]=3 2858 B10R1.61 CC(=O)c1cccnc1O Amb18832396 [0,1,0,0,0,1|1,0,0]=3 2859 B10R1.61 CC(=O)c1ccncc1Br Amb21858252 [0,1,0,0,0,1|2,0,0]=4 2860 B10R1.61 CC(=O)c1ccncc1C Amb25757892 [0,1,0,0,0,1|2,0,0]=4 2861 B10R1.61 CC(=O)c1ccncc1Cl Amb22494032 [0,1,0,0,0,1|2,0,0]=4 2862 B10R1.61 CC(=O)c1ccncc1F Amb10603317 [0,1,0,0,0,1|2,0,0]=4 2863 B10R1.61 CC(=O)c1ccncc1I Amb24638217 [0,1,0,0,0,1|2,0,0]=4 2864 B10R1.61 CC(=O)c1ccncc1N Amb29083603 [0,1,0,0,0,1|2,0,0]=4 2865 B10R1.61 CC(=O)c1ccncc1N Amb8386717 [0,1,0,0,0,1|2,0,0]=4 2866 B10R1.61 CC(=O)c1ccncc1O Amb18643112 [0,1,0,0,0,1|2,0,0]=4 2867 B10R1.61 CC(=O)c1ccncc1S Amb27215298 [0,1,0,0,0,1|2,0,0]=4 2868 B10R1.61 CC(=O)c1cnccc1Br Amb26868083 [0,1,0,0,0,1|1,0,0]=3 2869 B10R1.61 CC(=O)c1cnccc1C Amb21964244 [0,1,0,0,0,1|1,0,0]=3 2870 B10R1.61 CC(=O)c1cnccc1C Amb3319273 [0,1,0,0,0,1|1,0,0]=3 2871 B10R1.61 CC(=O)c1cnccc1Cl Amb27405519 [0,1,0,0,0,1|1,0,0]=3 2872 B10R1.61 CC(=O)c1cnccc1F Amb22233738 [0,1,0,0,0,1|1,0,0]=3 2873 B10R1.61 CC(=O)c1cnccc1N Amb23401918 [0,1,0,0,0,1|1,0,0]=3 2874 B10R1.61 CC(=O)c1cncnc1C Amb23399587 [0,1,0,0,0,1|2,0,0]=4 2875 B10R1.61 CC(=O)c1cncnc1N Amb27470955 [0,1,0,0,0,1|2,0,0]=4 2876 B10R1.61 CC(=O)c1ncccc1Br Amb19959407 [0,1,0,0,0,1|1,0,0]=3 2877 B10R1.61 CC(=O)c1ncccc1C Amb10067752 [0,1,0,0,0,1|1,0,0]=3 2878 B10R1.61 CC(=O)c1ncccc1Cl Amb22233858 [0,1,0,0,0,1|1,0,0]=3 2879 B10R1.61 CC(=O)c1ncccc1F Amb8396921 [0,1,0,0,0,1|1,0,0]=3 2880 B10R1.61 CC(=O)c1ncccc1I Amb23402738 [0,1,0,0,0,1|1,0,0]=3 2881 B10R1.61 CC(=O)c1ncccc1N Amb2695009 [0,1,0,0,0,1|1,0,0]=3 2882 B10R1.61 CC(=O)c1ncccc1O Amb16233269 [0,1,0,0,0,1|1,0,0]=3 2883 B10R1.61 CC(=O)c1nccnc1C Amb2684259 [0,1,0,0,0,1|1,0,0]=3 2884 B10R1.61 CC(=O)c1nccnc1Cl Amb21857848 [0,1,0,0,0,1|1,0,0]=3 2885 B10R1.61 CC(=O)c1nccnc1F Amb22388294 [0,1,0,0,0,1|1,0,0]=3 2886 B10R1.61 CC(=O)c1nccnc1N Amb17933164 [0,1,0,0,0,1|1,0,0]=3 2887 B10R1.61 CC(=O)c1ncncc1Br Amb21856954 [0,1,0,0,0,1|1,0,0]=3 2888 B10R1.61 CC(=O)c1ncncc1F Amb27861475 [0,1,0,0,0,1|1,0,0]=3 2889 B10R1.61 CC(=O)c1nncnc1C Amb25288501 [0,1,0,0,0,1|2,0,0]=4 2890 B10R1.61 CC1=C(C(=O)O)SC=CO1 Amb24480390 [0,1,0,0,0,1|2,0,0]=4 2891 B10R1.61 CS(=O)c1ncccc1Cl Amb27854138 [0,1,0,0,0,1|2,0,0]=4 2892 B10R1.61 C\C(O)=C1\N=CC=CC1=O Amb27956145 [0,1,0,0,0,1|1,0,1]=4 2893 B10R1.61 Cc1cccnc1C(=O)Cl Amb18947043 [0,1,0,0,0,1|2,0,0]=4 2894 B10R1.61 Cc1cccnc1C(=O)O Amb21964439 [0,1,0,0,0,1|2,0,0]=4 2895 B10R1.61 Cc1cccnc1C(=O)O Amb2689642 [0,1,0,0,0,1|2,0,0]=4 2896 B10R1.61 Cc1cccnc1C(N)=O Amb5722196 [0,1,0,0,0,1|2,0,0]=4 2897 B10R1.61 Cc1ccncc1C(=O)Cl Amb16230802 [0,1,0,0,0,1|2,0,0]=4 2898 B10R1.61 Cc1ccncc1C(=O)O Amb1102435 [0,1,0,0,0,1|2,0,0]=4 2899 B10R1.61 Cc1ccncc1C(=O)O Amb2725643 [0,1,0,0,0,1|2,0,0]=4 2900 B10R1.61 Cc1ccncc1C(N)=O Amb2609600 [0,1,0,0,0,1|2,0,0]=4 2901 B10R1.61 Cc1ccnnc1C(=O)O Amb22276547 [0,1,0,0,0,1|2,0,0]=4 2902 B10R1.61 Cc1cncnc1C(=O)Cl Amb27847149 [0,1,0,0,0,1|2,0,0]=4 2903 B10R1.61 Cc1cncnc1C(=O)O Amb22497343 [0,1,0,0,0,1|2,0,0]=4 2904 B10R1.61 Cc1ncccc1C(=O)Cl Amb16230804 [0,1,0,0,0,1|2,0,0]=4 2905 B10R1.61 Cc1ncccc1C(=O)O Amb19514954 [0,1,0,0,0,1|2,0,0]=4 2906 B10R1.61 Cc1ncccc1C(=O)O Amb2613015 [0,1,0,0,0,1|2,0,0]=4 2907 B10R1.61 Cc1ncccc1C(N)=O Amb16231197 [0,1,0,0,0,1|2,0,0]=4 2908 B10R1.61 Cc1nccnc1C(=O)O Amb8011545 [0,1,0,0,0,1|2,0,0]=4 2909 B10R1.61 Cc1nccnc1S(C)=O Amb27827565 [0,1,0,0,0,1|2,0,0]=4 2910 B10R1.61 NC(=O)C1=NC=CNC1=O Amb32405026 [0,1,0,0,0,1|2,0,0]=4 2911 B10R1.61 NC(=O)c1cccnc1Br Amb2609526 [0,1,0,0,0,1|2,0,0]=4 2912 B10R1.61 NC(=O)c1cccnc1Cl Amb1239475 [0,1,0,0,0,1|2,0,0]=4 2913 B10R1.61 NC(=O)c1cccnc1F Amb16231205 [0,1,0,0,0,1|2,0,0]=4 2914 B10R1.61 NC(=O)c1cccnc1I Amb28315909 [0,1,0,0,0,1|2,0,0]=4 2915 B10R1.61 NC(=O)c1cccnc1N Amb13951562 [0,1,0,0,0,1|2,0,0]=4 2916 B10R1.61 NC(=O)c1cccnc1N Amb8833945 [0,1,0,0,0,1|2,0,0]=4 2917 B10R1.61 NC(=O)c1cccnc1O Amb18643213 [0,1,0,0,0,1|2,0,0]=4 2918 B10R1.61 NC(=O)c1cccnc1S Amb1131765 [0,1,0,0,0,1|2,0,0]=4 2919 B10R1.61 NC(=O)c1cncc[n+]1[O-] Amb25242588 [0,1,0,0,0,1|2,0,0]=4 2920 B10R1.61 NC(=O)c1cnccc1Cl Amb33544011 [0,1,0,0,0,1|2,0,0]=4 2921 B10R1.61 NC(=O)c1cnccc1F Amb26979844 [0,1,0,0,0,1|2,0,0]=4 2922 B10R1.61 NC(=O)c1cnccc1N Amb21927713 [0,1,0,0,0,1|2,0,0]=4 2923 B10R1.61 NC(=O)c1cnccc1N Amb8396942 [0,1,0,0,0,1|2,0,0]=4 2924 B10R1.61 NC(=O)c1cnccc1O Amb5493990 [0,1,0,0,0,1|2,0,0]=4 2925 B10R1.61 NC(=O)c1cnccc1S Amb27862502 [0,1,0,0,0,1|2,0,0]=4 2926 B10R1.61 NC(=O)c1ncccc1Cl Amb23399605 [0,1,0,0,0,1|2,0,0]=4 2927 B10R1.61 NC(=O)c1ncccc1F Amb23412448 [0,1,0,0,0,1|2,0,0]=4 2928 B10R1.61 NC(=O)c1ncccc1N Amb2700629 [0,1,0,0,0,1|2,0,0]=4 2929 B10R1.61 NC(=O)c1ncccc1O Amb6600564 [0,1,0,0,0,1|2,0,0]=4 2930 B10R1.61 NC(=O)c1ncccc1S Amb25114764 [0,1,0,0,0,1|2,0,0]=4 2931 B10R1.61 NC(=O)c1nccnc1Br Amb22755338 [0,1,0,0,0,1|2,0,0]=4 2932 B10R1.61 NC(=O)c1nccnc1Cl Amb7172693 [0,1,0,0,0,1|2,0,0]=4 2933 B10R1.61 NC(=O)c1nccnc1N Amb7172753 [0,1,0,0,0,1|2,0,0]=4 2934 B10R1.61 NC(=O)c1nccnc1O Amb8438916 [0,1,0,0,0,1|2,0,0]=4 2935 B10R1.61 NC(=O)c1ncncc1Br Amb22499710 [0,1,0,0,0,1|2,0,0]=4 2936 B10R1.61 NC(=O)c1ncncc1Cl Amb27660457 [0,1,0,0,0,1|2,0,0]=4 2937 B10R1.61 NC(=O)c1nnccc1N Amb24062271 [0,1,0,0,0,1|2,0,0]=4 2938 B10R1.61 Nc1cccnc1C(=O)O Amb22276123 [0,1,0,0,0,1|2,0,0]=4 2939 B10R1.61 Nc1cccnc1C(=O)O Amb2609539 [0,1,0,0,0,1|2,0,0]=4 2940 B10R1.61 Nc1ccncc1C(=O)O Amb10982498 [0,1,0,0,0,1|2,0,0]=4 2941 B10R1.61 Nc1ccncc1C(=O)O Amb2404894 [0,1,0,0,0,1|2,0,0]=4 2942 B10R1.61 Nc1ccnnc1C(=O)O Amb8439486 [0,1,0,0,0,1|2,0,0]=4 2943 B10R1.61 Nc1cncnc1C(=O)O Amb5751296 [0,1,0,0,0,1|2,0,0]=4 2944 B10R1.61 Nc1ncccc1C(=O)O Amb535151 [0,1,0,0,0,1|2,0,0]=4 2945 B10R1.61 Nc1nccnc1C(=O)O Amb1148690 [0,1,0,0,0,1|2,0,0]=4 2946 B10R1.61 O=C(Cl)c1cccnc1Br Amb26583421 [0,1,0,0,0,1|2,0,0]=4 2947 B10R1.61 O=C(Cl)c1cccnc1Cl Amb2778162 [0,1,0,0,0,1|2,0,0]=4 2948 B10R1.61 O=C(Cl)c1cccnc1F Amb16230805 [0,1,0,0,0,1|2,0,0]=4 2949 B10R1.61 O=C(Cl)c1cccnc1O Amb24371117 [0,1,0,0,0,1|2,0,0]=4 2950 B10R1.61 O=C(Cl)c1cccnc1S Amb19930039 [0,1,0,0,0,1|2,0,0]=4 2951 B10R1.61 O=C(Cl)c1cnccc1Cl Amb16230803 [0,1,0,0,0,1|2,0,0]=4 2952 B10R1.61 O=C(Cl)c1cnccc1F Amb27653512 [0,1,0,0,0,1|2,0,0]=4 2953 B10R1.61 O=C(Cl)c1cnccc1O Amb27778038 [0,1,0,0,0,1|2,0,0]=4 2954 B10R1.61 O=C(Cl)c1ncccc1Cl Amb27945622 [0,1,0,0,0,1|2,0,0]=4 2955 B10R1.61 O=C(Cl)c1ncccc1O Amb25939920 [0,1,0,0,0,1|2,0,0]=4 2956 B10R1.61 O=C(Cl)c1nccnc1Cl Amb22491233 [0,1,0,0,0,1|2,0,0]=4 2957 B10R1.61 O=C(Cl)c1nccnc1F Amb27163133 [0,1,0,0,0,1|2,0,0]=4 2958 B10R1.61 O=C(Cl)c1ncncc1Cl Amb27164860 [0,1,0,0,0,1|2,0,0]=4 2959 B10R1.61 O=C(Cl)c1ncncc1F Amb27638477 [0,1,0,0,0,1|2,0,0]=4 2960 B10R1.61 O=C(O)C1=NC=CNC1=O Amb21936458 [0,1,0,0,0,1|2,0,0]=4 2961 B10R1.61 O=C(O)c1cccnc1Br Amb2447561 [0,1,0,0,0,1|2,0,0]=4 2962 B10R1.61 O=C(O)c1cccnc1Cl Amb745876 [0,1,0,0,0,1|2,0,0]=4 2963 B10R1.61 O=C(O)c1cccnc1F Amb2447268 [0,1,0,0,0,1|2,0,0]=4 2964 B10R1.61 O=C(O)c1cccnc1I Amb33529189 [0,1,0,0,0,1|2,0,0]=4 2965 B10R1.61 O=C(O)c1cccnc1O Amb1950661 [0,1,0,0,0,1|2,0,0]=4 2966 B10R1.61 O=C(O)c1cccnc1S Amb1210101 [0,1,0,0,0,1|2,0,0]=4 2967 B10R1.61 O=C(O)c1cnccc1Br Amb21927781 [0,1,0,0,0,1|2,0,0]=4 2968 B10R1.61 O=C(O)c1cnccc1Br Amb30647471 [0,1,0,0,0,1|2,0,0]=4 2969 B10R1.61 O=C(O)c1cnccc1Br Amb6297661 [0,1,0,0,0,1|2,0,0]=4 2970 B10R1.61 O=C(O)c1cnccc1Cl Amb2610789 [0,1,0,0,0,1|2,0,0]=4 2971 B10R1.61 O=C(O)c1cnccc1F Amb17942817 [0,1,0,0,0,1|2,0,0]=4 2972 B10R1.61 O=C(O)c1cnccc1I Amb2610811 [0,1,0,0,0,1|2,0,0]=4 2973 B10R1.61 O=C(O)c1cnccc1I Amb33457296 [0,1,0,0,0,1|2,0,0]=4 2974 B10R1.61 O=C(O)c1cnccc1O Amb1420333 [0,1,0,0,0,1|2,0,0]=4 2975 B10R1.61 O=C(O)c1cnccc1S Amb2612001 [0,1,0,0,0,1|2,0,0]=4 2976 B10R1.61 O=C(O)c1cnccn1=O Amb22388358 [0,1,0,0,0,1|2,0,0]=4 2977 B10R1.61 O=C(O)c1ncccc1Br Amb2447560 [0,1,0,0,0,1|2,0,0]=4 2978 B10R1.61 O=C(O)c1ncccc1Br Amb33379069 [0,1,0,0,0,1|2,0,0]=4 2979 B10R1.61 O=C(O)c1ncccc1Cl Amb2610115 [0,1,0,0,0,1|2,0,0]=4 2980 B10R1.61 O=C(O)c1ncccc1F Amb2447510 [0,1,0,0,0,1|2,0,0]=4 2981 B10R1.61 O=C(O)c1ncccc1I Amb10602322 [0,1,0,0,0,1|2,0,0]=4 2982 B10R1.61 O=C(O)c1ncccc1O Amb2610788 [0,1,0,0,0,1|2,0,0]=4 2983 B10R1.61 O=C(O)c1ncccc1S Amb18644720 [0,1,0,0,0,1|2,0,0]=4 2984 B10R1.61 O=C(O)c1nccnc1Br Amb2797938 [0,1,0,0,0,1|2,0,0]=4 2985 B10R1.61 O=C(O)c1nccnc1Cl Amb2694780 [0,1,0,0,0,1|2,0,0]=4 2986 B10R1.61 O=C(O)c1nccnc1I Amb19957728 [0,1,0,0,0,1|2,0,0]=4 2987 B10R1.61 O=C(O)c1nccnc1O Amb2695554 [0,1,0,0,0,1|2,0,0]=4 2988 B10R1.61 O=C(O)c1nccnc1S Amb33531396 [0,1,0,0,0,1|2,0,0]=4 2989 B10R1.61 O=C(O)c1ncncc1Br Amb4443270 [0,1,0,0,0,1|2,0,0]=4 2990 B10R1.61 O=C(O)c1ncncc1Cl Amb5751295 [0,1,0,0,0,1|2,0,0]=4 2991 B10R1.61 O=C(O)c1ncncc1F Amb27630158 [0,1,0,0,0,1|2,0,0]=4 2992 B10R1.61 O=C(O)c1nnccc1Cl Amb27803878 [0,1,0,0,0,1|2,0,0]=4 2993 B10R1.61 O=C(O)c1nnccc1F Amb27214211 [0,1,0,0,0,1|2,0,0]=4 2994 B10R1.61 O=C(O)c1nnccc1O Amb26479954 [0,1,0,0,0,1|2,0,0]=4 2995 B10R1.61 O=C([O-])c1cccnc1O Amb2609528 [0,1,0,0,0,1|2,0,0]=4 2996 B10R1.61 O=C([O-])c1cccnc1[S-] Amb33512985 [0,1,0,0,0,1|2,0,0]=4 2997 B10R1.61 O=C([O-])c1cnccc1O Amb2609530 [0,1,0,0,0,1|2,0,0]=4 2998 B10R1.61 O=C([O-])c1ncccc1Br Amb17610074 [0,1,0,0,0,1|2,0,0]=4 2999 B10R1.113 C=C(C)c1cc(Br)ccn1 Amb20617320 [0,1,0,0,0,1|2,0,0]=4 3000 B10R1.113 C=C(C)c1cc(C)ccn1 Amb24397302 [0,1,0,0,0,1|2,0,0]=4 3001 B10R1.113 C=C(C)c1cc(Cl)ccn1 Amb27215445 [0,1,0,0,0,1|2,0,0]=4 3002 B10R1.113 C=C(C)c1cc(N)ccn1 Amb20617321 [0,1,0,0,0,1|2,0,0]=4 3003 B10R1.113 C=C(C)c1cccc(Br)n1 Amb20617318 [0,1,0,0,0,1|2,0,0]=4 3004 B10R1.113 C=C(C)c1cccc(C)n1 Amb24084454 [0,1,0,0,0,1|2,0,0]=4 3005 B10R1.113 C=C(C)c1cccc(N)n1 Amb20617319 [0,1,0,0,0,1|2,0,0]=4 3006 B10R1.113 C=C(C)c1cncc(Br)c1 Amb19957922 [0,1,0,0,0,1|2,0,0]=4 3007 B10R1.113 C=C(C)c1cncc(C)c1 Amb32641664 [0,1,0,0,0,1|2,0,0]=4 3008 B10R1.113 C=C(C)c1cncc(Cl)c1 Amb26391246 [0,1,0,0,0,1|2,0,0]=4 3009 B10R1.113 C=C(C)c1cncc(F)c1 Amb24414179 [0,1,0,0,0,1|2,0,0]=4 3010 B10R1.113 C=C(C)c1cncc(N)c1 Amb24320799 [0,1,0,0,0,1|2,0,0]=4 3011 B10R1.113 C=C(C)c1cncc(N)n1 Amb24321502 [0,1,0,0,0,1|2,0,0]=4 3012 B10R1.113 CC(=O)C1=CC(=O)NC=C1 Amb33545567 [0,1,0,0,0,1|2,0,0]=4 3013 B10R1.113 CC(=O)C1=CC(=O)NN=C1 Amb24736392 [0,1,0,0,0,1|2,0,0]=4 3014 B10R1.113 CC(=O)C1=CC=CC(=O)N1 Amb22372289 [0,1,0,0,0,1|1,0,1]=4 3015 B10R1.113 CC(=O)C1=CC=CN(C)C1 Amb27802906 [0,1,0,0,0,1|1,0,1]=4 3016 B10R1.113 CC(=O)C1=CN(C)C=CC1 Amb26474872 [0,1,0,0,0,1|1,0,1]=4 3017 B10R1.113 CC(=O)C1=NC(=O)CC=N1 Amb25146447 [0,1,0,0,0,1|1,0,0]=3 3018 B10R1.113 CC(=O)C1CC=CC(C)S1 Amb25286692 [0,1,0,0,0,1|1,0,1]=4 3019 B10R1.113 CC(=O)C1CCC=C(C)S1 Amb27434269 [0,1,0,0,0,1|1,0,1]=4 3020 B10R1.113 CC(=O)c1c[n+]([O-])ccn1 Amb28202158 [0,1,0,0,0,1|1,0,0]=3 3021 B10R1.113 CC(=O)c1cc(Br)ccn1 Amb21858737 [0,1,0,0,0,1|1,0,0]=3 3022 B10R1.113 CC(=O)c1cc(C)ccn1 Amb8392275 [0,1,0,0,0,1|1,0,0]=3 3023 B10R1.113 CC(=O)c1cc(C)ncn1 Amb8630234 [0,1,0,0,0,1|1,0,0]=3 3024 B10R1.113 CC(=O)c1cc(Cl)ccn1 Amb10603326 [0,1,0,0,0,1|1,0,0]=3 3025 B10R1.113 CC(=O)c1cc(Cl)ncn1 Amb25146886 [0,1,0,0,0,1|1,0,0]=3 3026 B10R1.113 CC(=O)c1cc(F)ccn1 Amb25689744 [0,1,0,0,0,1|1,0,0]=3 3027 B10R1.113 CC(=O)c1cc(N)ccn1 Amb23401922 [0,1,0,0,0,1|1,0,0]=3 3028 B10R1.113 CC(=O)c1cc(O)ccn1 Amb23399916 [0,1,0,0,0,1|1,0,0]=3 3029 B10R1.113 CC(=O)c1ccc[n+](C)c1 Amb32455996 [0,1,0,0,0,1|1,0,1]=4 3030 B10R1.113 CC(=O)c1ccc[n+]([O-])c1 Amb2612063 [0,1,0,0,0,1|1,0,1]=4 3031 B10R1.113 CC(=O)c1cccc(Br)c1 Amb2684932 [0,1,0,0,0,1|2,0,0]=4 3032 B10R1.113 CC(=O)c1cccc(Br)n1 Amb2786648 [0,1,0,0,0,1|1,0,0]=3 3033 B10R1.113 CC(=O)c1cccc(C)c1 Amb3940080 [0,1,0,0,0,1|2,0,0]=4 3034 B10R1.113 CC(=O)c1cccc(C)n1 Amb10069245 [0,1,0,0,0,1|1,0,0]=3 3035 B10R1.113 CC(=O)c1cccc(Cl)c1 Amb3940078 [0,1,0,0,0,1|2,0,0]=4 3036 B10R1.113 CC(=O)c1cccc(Cl)n1 Amb10603338 [0,1,0,0,0,1|1,0,0]=3 3037 B10R1.113 CC(=O)c1cccc(F)c1 Amb2688006 [0,1,0,0,0,1|2,0,0]=4 3038 B10R1.113 CC(=O)c1cccc(F)n1 Amb21857925 [0,1,0,0,0,1|1,0,0]=3 3039 B10R1.113 CC(=O)c1cccc(I)c1 Amb2688831 [0,1,0,0,0,1|2,0,0]=4 3040 B10R1.113 CC(=O)c1cccc(N)c1 Amb2684314 [0,1,0,0,0,1|2,0,0]=4 3041 B10R1.113 CC(=O)c1cccc(N)n1 Amb23401921 [0,1,0,0,0,1|1,0,0]=3 3042 B10R1.113 CC(=O)c1cccc(O)c1 Amb2792768 [0,1,0,0,0,1|2,0,0]=4 3043 B10R1.113 CC(=O)c1cccc(S)c1 Amb19374493 [0,1,0,0,0,1|2,0,0]=4 3044 B10R1.113 CC(=O)c1ccnc(Br)c1 Amb10069912 [0,1,0,0,0,1|2,0,0]=4 3045 B10R1.113 CC(=O)c1ccnc(Br)c1 Amb21964445 [0,1,0,0,0,1|2,0,0]=4 3046 B10R1.113 CC(=O)c1ccnc(C)c1 Amb19957654 [0,1,0,0,0,1|2,0,0]=4 3047 B10R1.113 CC(=O)c1ccnc(C)n1 Amb8630160 [0,1,0,0,0,1|1,0,0]=3 3048 B10R1.113 CC(=O)c1ccnc(Cl)c1 Amb6384342 [0,1,0,0,0,1|2,0,0]=4 3049 B10R1.113 CC(=O)c1ccnc(Cl)n1 Amb21857542 [0,1,0,0,0,1|1,0,0]=3 3050 B10R1.113 CC(=O)c1ccnc(F)c1 Amb33543793 [0,1,0,0,0,1|2,0,0]=4 3051 B10R1.113 CC(=O)c1ccnc(N)c1 Amb18643066 [0,1,0,0,0,1|2,0,0]=4 3052 B10R1.113 CC(=O)c1ccnc(N)n1 Amb10067086 [0,1,0,0,0,1|1,0,0]=3 3053 B10R1.113 CC(=O)c1ccnc(O)c1 Amb27259914 [0,1,0,0,0,1|2,0,0]=4 3054 B10R1.113 CC(=O)c1cncc(Br)c1 Amb2613045 [0,1,0,0,0,1|1,0,0]=3 3055 B10R1.113 CC(=O)c1cncc(Br)n1 Amb24321494 [0,1,0,0,0,1|1,0,0]=3 3056 B10R1.113 CC(=O)c1cncc(C)c1 Amb21964245 [0,1,0,0,0,1|1,0,0]=3 3057 B10R1.113 CC(=O)c1cncc(Cl)c1 Amb28254502 [0,1,0,0,0,1|1,0,0]=3 3058 B10R1.113 CC(=O)c1cncc(Cl)n1 Amb22001750 [0,1,0,0,0,1|1,0,0]=3 3059 B10R1.113 CC(=O)c1cncc(F)c1 Amb19374623 [0,1,0,0,0,1|1,0,0]=3 3060 B10R1.113 CC(=O)c1cncc(O)c1 Amb23399982 [0,1,0,0,0,1|1,0,0]=3 3061 B10R1.113 CC(=O)c1cnnc(Br)n1 Amb18787298 [0,1,0,0,0,1|2,0,0]=4 3062 B10R1.113 CC(=O)c1cnnc(C)n1 Amb26887455 [0,1,0,0,0,1|2,0,0]=4 3063 B10R1.113 CC(=O)c1cnnc(Cl)c1 Amb25169314 [0,1,0,0,0,1|2,0,0]=4 3064 B10R1.113 CC(=O)c1cnnc(Cl)n1 Amb18830521 [0,1,0,0,0,1|2,0,0]=4 3065 B10R1.113 CC(=O)c1cnnc(N)n1 Amb18832243 [0,1,0,0,0,1|2,0,0]=4 3066 B10R1.113 CC(=O)c1nccc(Cl)n1 Amb27960079 [0,1,0,0,0,1|1,0,0]=3 3067 B10R1.113 CC(=O)c1nccc(N)n1 Amb18832382 [0,1,0,0,0,1|1,0,0]=3 3068 B10R1.113 CC(=S)c1cncc(Cl)c1 Amb21961412 [0,1,0,0,0,1|1,1,0]=4 3069 B10R1.113 CS(=O)c1cc(Cl)ncn1 Amb19516139 [0,1,0,0,0,1|2,0,0]=4 3070 B10R1.113 CS(=O)c1cccc(Cl)n1 Amb27621591 [0,1,0,0,0,1|2,0,0]=4 3071 B10R1.113 CS(=O)c1cncc(Br)c1 Amb25376177 [0,1,0,0,0,1|2,0,0]=4 3072 B10R1.113 CS(=O)c1cncc(O)c1 Amb27615092 [0,1,0,0,0,1|2,0,0]=4 3073 B10R1.113 CS(=O)c1nccc(Cl)n1 Amb24679553 [0,1,0,0,0,1|2,0,0]=4 3074 B10R1.113 CS(=O)c1nccc(N)n1 Amb24309278 [0,1,0,0,0,1|2,0,0]=4 3075 B10R1.113 C[n+]1ccnc(C(N)=O)c1 Amb10573251 [0,1,0,0,0,1|2,0,0]=4 3076 B10R1.113 Cc1cc(C(=O)O)ncn1 Amb18948013 [0,1,0,0,0,1|2,0,0]=4 3077 B10R1.113 Cc1cccc(C(=O)Br)n1 Amb26869433 [0,1,0,0,0,1|2,0,0]=4 3078 B10R1.113 Cc1cccc(C(=O)Cl)n1 Amb10610376 [0,1,0,0,0,1|2,0,0]=4 3079 B10R1.113 Cc1cccc(C(=O)O)n1 Amb24081761 [0,1,0,0,0,1|2,0,0]=4 3080 B10R1.113 Cc1cccc(C(=O)O)n1 Amb2612995 [0,1,0,0,0,1|2,0,0]=4 3081 B10R1.113 Cc1cccc(C(N)=O)n1 Amb8858808 [0,1,0,0,0,1|2,0,0]=4 3082 B10R1.113 Cc1ccnc(C(=O)O)c1 Amb22490414 [0,1,0,0,0,1|2,0,0]=4 3083 B10R1.113 Cc1ccnc(C(=O)O)c1 Amb2795204 [0,1,0,0,0,1|2,0,0]=4 3084 B10R1.113 Cc1ccnc(C(=O)O)n1 Amb33204433 [0,1,0,0,0,1|2,0,0]=4 3085 B10R1.113 Cc1ccnc(C(=O)O)n1 Amb8010644 [0,1,0,0,0,1|2,0,0]=4 3086 B10R1.113 Cc1ccnc(C(=O)[O-])n1 Amb33299249 [0,1,0,0,0,1|2,0,0]=4 3087 B10R1.113 Cc1ccnc(C(N)=O)c1 Amb16231199 [0,1,0,0,0,1|2,0,0]=4 3088 B10R1.113 Cc1ccnc(S(C)=O)n1 Amb27186296 [0,1,0,0,0,1|2,0,0]=4 3089 B10R1.113 Cc1cncc(C(=O)O)c1 Amb10068354 [0,1,0,0,0,1|2,0,0]=4 3090 B10R1.113 Cc1cncc(C(=O)O)c1 Amb2694191 [0,1,0,0,0,1|2,0,0]=4 3091 B10R1.113 Cc1cncc(C(=O)O)n1 Amb8011544 [0,1,0,0,0,1|2,0,0]=4 3092 B10R1.113 Cc1cncc(C(N)=O)c1 Amb8388683 [0,1,0,0,0,1|2,0,0]=4 3093 B10R1.113 Cc1cnnc(C(=O)O)c1 Amb18832254 [0,1,0,0,0,1|2,0,0]=4 3094 B10R1.113 Cc1cnnc(C(=O)[O-])c1 Amb32667056 [0,1,0,0,0,1|2,0,0]=4 3095 B10R1.113 Cc1nccc(C(=O)Cl)n1 Amb28135689 [0,1,0,0,0,1|2,0,0]=4 3096 B10R1.113 Cc1nccc(C(=O)O)n1 Amb10602122 [0,1,0,0,0,1|2,0,0]=4 3097 B10R1.113 NC(=O)C1=CN=CC(=S)N1 Amb25238778 [0,1,0,0,0,1|2,0,0]=4 3098 B10R1.113 NC(=O)C1=NC(=O)NC=C1 Amb22501031 [0,1,0,0,0,1|2,0,0]=4 3099 B10R1.113 NC(=O)c1c[n+]([O-])ccn1 Amb2610821 [0,1,0,0,0,1|2,0,0]=4 3100 B10R1.113 NC(=O)c1cc(Br)ccn1 Amb2549772 [0,1,0,0,0,1|2,0,0]=4 3101 B10R1.113 NC(=O)c1cc(Cl)ccn1 Amb581610 [0,1,0,0,0,1|2,0,0]=4 3102 B10R1.113 NC(=O)c1cc(Cl)ncn1 Amb28251930 [0,1,0,0,0,1|2,0,0]=4 3103 B10R1.113 NC(=O)c1cc(I)ccn1 Amb27871356 [0,1,0,0,0,1|2,0,0]=4 3104 B10R1.113 NC(=O)c1cc(N)ccn1 Amb33531653 [0,1,0,0,0,1|2,0,0]=4 3105 B10R1.113 NC(=O)c1cccc(Br)n1 Amb10068098 [0,1,0,0,0,1|2,0,0]=4 3106 B10R1.113 NC(=O)c1cccc(Cl)n1 Amb4317884 [0,1,0,0,0,1|2,0,0]=4 3107 B10R1.113 NC(=O)c1cccc(F)n1 Amb10607167 [0,1,0,0,0,1|2,0,0]=4 3108 B10R1.113 NC(=O)c1cccc(N)n1 Amb18279842 [0,1,0,0,0,1|2,0,0]=4 3109 B10R1.113 NC(=O)c1cccc(O)n1 Amb24182048 [0,1,0,0,0,1|2,0,0]=4 3110 B10R1.113 NC(=O)c1ccnc(Cl)n1 Amb10067801 [0,1,0,0,0,1|2,0,0]=4 3111 B10R1.113 NC(=O)c1ccnc(N)n1 Amb22501032 [0,1,0,0,0,1|2,0,0]=4 3112 B10R1.113 NC(=O)c1ccnc(S)n1 Amb24417891 [0,1,0,0,0,1|2,0,0]=4 3113 B10R1.113 NC(=O)c1cncc(Br)c1 Amb2570605 [0,1,0,0,0,1|2,0,0]=4 3114 B10R1.113 NC(=O)c1cncc(Br)n1 Amb27947252 [0,1,0,0,0,1|2,0,0]=4 3115 B10R1.113 NC(=O)c1cncc(Cl)c1 Amb19895235 [0,1,0,0,0,1|2,0,0]=4 3116 B10R1.113 NC(=O)c1cncc(Cl)n1 Amb10608493 [0,1,0,0,0,1|2,0,0]=4 3117 B10R1.113 NC(=O)c1cncc(F)c1 Amb21856857 [0,1,0,0,0,1|2,0,0]=4 3118 B10R1.113 NC(=O)c1cncc(N)c1 Amb10602828 [0,1,0,0,0,1|2,0,0]=4 3119 B10R1.113 NC(=O)c1cncc(O)c1 Amb33541953 [0,1,0,0,0,1|2,0,0]=4 3120 B10R1.113 NC(=O)c1nccc(Br)n1 Amb25104303 [0,1,0,0,0,1|2,0,0]=4 3121 B10R1.113 Nc1cc(C(=O)O)ncn1 Amb17935623 [0,1,0,0,0,1|2,0,0]=4 3122 B10R1.113 Nc1cc(C(=O)O)ncn1 Amb31289701 [0,1,0,0,0,1|2,0,0]=4 3123 B10R1.113 Nc1cc(C(=O)[O-])ncn1 Amb5606301 [0,1,0,0,0,1|2,0,0]=4 3124 B10R1.113 Nc1cccc(C(=O)O)n1 Amb1235493 [0,1,0,0,0,1|2,0,0]=4 3125 B10R1.113 Nc1ccnc(C(=O)O)c1 Amb19958023 [0,1,0,0,0,1|2,0,0]=4 3126 B10R1.113 Nc1ccnc(C(=O)O)c1 Amb2794992 [0,1,0,0,0,1|2,0,0]=4 3127 B10R1.113 Nc1ccnc(C(=O)O)c1 Amb30588548 [0,1,0,0,0,1|2,0,0]=4 3128 B10R1.113 Nc1ccnc(C(=O)O)c1 Amb30640048 [0,1,0,0,0,1|2,0,0]=4 3129 B10R1.113 Nc1ccnc(C(=O)O)n1 Amb18202983 [0,1,0,0,0,1|2,0,0]=4 3130 B10R1.113 Nc1cncc(C(=O)O)c1 Amb535918 [0,1,0,0,0,1|2,0,0]=4 3131 B10R1.113 Nc1cncc(C(=O)O)n1 Amb18643357 [0,1,0,0,0,1|2,0,0]=4 3132 B10R1.113 Nc1nccc(C(=O)O)n1 Amb8630057 [0,1,0,0,0,1|2,0,0]=4 3133 B10R1.113 O=C(Cl)c1cc(Br)ccn1 Amb24520483 [0,1,0,0,0,1|2,0,0]=4 3134 B10R1.113 O=C(Cl)c1cc(Cl)ccn1 Amb17611082 [0,1,0,0,0,1|2,0,0]=4 3135 B10R1.113 O=C(Cl)c1cc(Cl)ccn1 Amb3319263 [0,1,0,0,0,1|2,0,0]=4 3136 B10R1.113 O=C(Cl)c1cc(Cl)ncn1 Amb21618944 [0,1,0,0,0,1|2,0,0]=4 3137 B10R1.113 O=C(Cl)c1cc(I)ccn1 Amb28119248 [0,1,0,0,0,1|2,0,0]=4 3138 B10R1.113 O=C(Cl)c1cc(O)ccn1 Amb27199840 [0,1,0,0,0,1|2,0,0]=4 3139 B10R1.113 O=C(Cl)c1cccc(Br)n1 Amb24077446 [0,1,0,0,0,1|2,0,0]=4 3140 B10R1.113 O=C(Cl)c1cccc(Cl)n1 Amb33542843 [0,1,0,0,0,1|2,0,0]=4 3141 B10R1.113 O=C(Cl)c1cccc(F)n1 Amb2688410 [0,1,0,0,0,1|2,0,0]=4 3142 B10R1.113 O=C(Cl)c1cncc(Br)c1 Amb2725092 [0,1,0,0,0,1|2,0,0]=4 3143 B10R1.113 O=C(Cl)c1cncc(Cl)c1 Amb24071250 [0,1,0,0,0,1|2,0,0]=4 3144 B10R1.113 O=C(Cl)c1cncc(Cl)n1 Amb24071948 [0,1,0,0,0,1|2,0,0]=4 3145 B10R1.113 O=C(Cl)c1cncc(F)c1 Amb25691932 [0,1,0,0,0,1|2,0,0]=4 3146 B10R1.113 O=C(Cl)c1cncc(I)c1 Amb27185985 [0,1,0,0,0,1|2,0,0]=4 3147 B10R1.113 O=C(Cl)c1cncc(O)n1 Amb25974928 [0,1,0,0,0,1|2,0,0]=4 3148 B10R1.113 O=C(O)c1c[n+]([O-])ccn1 Amb17619655 [0,1,0,0,0,1|2,0,0]=4 3149 B10R1.113 O=C(O)c1cc(Br)ccn1 Amb2541475 [0,1,0,0,0,1|2,0,0]=4 3150 B10R1.113 O=C(O)c1cc(Br)ncn1 Amb27205845 [0,1,0,0,0,1|2,0,0]=4 3151 B10R1.113 O=C(O)c1cc(Cl)ccn1 Amb1106613 [0,1,0,0,0,1|2,0,0]=4 3152 B10R1.113 O=C(O)c1cc(Cl)cnn1 Amb27392267 [0,1,0,0,0,1|2,0,0]=4 3153 B10R1.113 O=C(O)c1cc(Cl)ncn1 Amb5717806 [0,1,0,0,0,1|2,0,0]=4 3154 B10R1.113 O=C(O)c1cc(F)ccn1 Amb19958323 [0,1,0,0,0,1|2,0,0]=4 3155 B10R1.113 O=C(O)c1cc(F)ncn1 Amb28196478 [0,1,0,0,0,1|2,0,0]=4 3156 B10R1.113 O=C(O)c1cc(I)ccn1 Amb10975473 [0,1,0,0,0,1|2,0,0]=4 3157 B10R1.113 O=C(O)c1cc(I)ccn1 Amb2540668 [0,1,0,0,0,1|2,0,0]=4 3158 B10R1.113 O=C(O)c1cc(O)ccn1 Amb1303199 [0,1,0,0,0,1|2,0,0]=4 3159 B10R1.113 O=C(O)c1cc(O)ncn1 Amb2591546 [0,1,0,0,0,1|2,0,0]=4 3160 B10R1.113 O=C(O)c1cc(S)ccn1 Amb18278971 [0,1,0,0,0,1|2,0,0]=4 3161 B10R1.113 O=C(O)c1cccc(Br)n1 Amb2610030 [0,1,0,0,0,1|2,0,0]=4 3162 B10R1.113 O=C(O)c1cccc(Cl)n1 Amb33544792 [0,1,0,0,0,1|2,0,0]=4 3163 B10R1.113 O=C(O)c1cccc(F)n1 Amb2688411 [0,1,0,0,0,1|2,0,0]=4 3164 B10R1.113 O=C(O)c1cccc(I)n1 Amb6565075 [0,1,0,0,0,1|2,0,0]=4 3165 B10R1.113 O=C(O)c1cccc(O)n1 Amb535788 [0,1,0,0,0,1|2,0,0]=4 3166 B10R1.113 O=C(O)c1cccc(S)n1 Amb1208363 [0,1,0,0,0,1|2,0,0]=4 3167 B10R1.113 O=C(O)c1ccnc(Br)n1 Amb22499757 [0,1,0,0,0,1|2,0,0]=4 3168 B10R1.113 O=C(O)c1ccnc(Cl)n1 Amb33544410 [0,1,0,0,0,1|2,0,0]=4 3169 B10R1.113 O=C(O)c1ccnc(F)n1 Amb27488035 [0,1,0,0,0,1|2,0,0]=4 3170 B10R1.113 O=C(O)c1ccnc(O)n1 Amb21927951 [0,1,0,0,0,1|2,0,0]=4 3171 B10R1.113 O=C(O)c1ccnc(S)n1 Amb18200233 [0,1,0,0,0,1|2,0,0]=4 3172 B10R1.113 O=C(O)c1cncc(Br)c1 Amb1232836 [0,1,0,0,0,1|2,0,0]=4 3173 B10R1.113 O=C(O)c1cncc(Br)n1 Amb22728068 [0,1,0,0,0,1|2,0,0]=4 3174 B10R1.113 O=C(O)c1cncc(Cl)c1 Amb2540665 [0,1,0,0,0,1|2,0,0]=4 3175 B10R1.113 O=C(O)c1cncc(Cl)n1 Amb10067218 [0,1,0,0,0,1|2,0,0]=4 3176 B10R1.113 O=C(O)c1cncc(F)c1 Amb8009491 [0,1,0,0,0,1|2,0,0]=4 3177 B10R1.113 O=C(O)c1cncc(F)n1 Amb21961694 [0,1,0,0,0,1|2,0,0]=4 3178 B10R1.113 O=C(O)c1cncc(I)c1 Amb8630991 [0,1,0,0,0,1|2,0,0]=4 3179 B10R1.113 O=C(O)c1cncc(O)c1 Amb2610681 [0,1,0,0,0,1|2,0,0]=4 3180 B10R1.113 O=C(O)c1cncc(S)c1 Amb26366326 [0,1,0,0,0,1|2,0,0]=4 3181 B10R1.113 O=C(O)c1cncc(S)c1 Amb28555512 [0,1,0,0,0,1|2,0,0]=4 3182 B10R1.113 O=C(O)c1nccc(Br)n1 Amb25375744 [0,1,0,0,0,1|2,0,0]=4 3183 B10R1.113 O=C(O)c1nccc(Cl)n1 Amb20241397 [0,1,0,0,0,1|2,0,0]=4 3184 B10R1.113 O=C(O)c1nccc(F)n1 Amb27224179 [0,1,0,0,0,1|2,0,0]=4 3185 B10R1.113 O=C(O)c1ncnc(Cl)n1 Amb25267815 [0,1,0,0,0,1|2,0,0]=4 3186 B10R1.113 O=C([O-])c1cc(O)ncn1 Amb33038433 [0,1,0,0,0,1|2,0,0]=4 3187 B10R1.113 O=C([O-])c1cncc(O)n1 Amb33544286 [0,1,0,0,0,1|2,0,0]=4 3188 B10R1.113 O=C1C=C(C(=O)O)N=CN1 Amb18062111 [0,1,0,0,0,1|2,0,0]=4 3189 B10R1.113 O=C1C=NC=C(C(=O)O)N1 Amb22011470 [0,1,0,0,0,1|2,0,0]=4 3190 B10R1.113 [NH3+]c1cncc(C(=O)[O-])c1 Amb575382 [0,1,0,0,0,1|2,0,0]=4 3191 B10R1.23 C=C(C(=O)O)c1cccs1 Amb17322162 [0,1,0,0,0,1|2,0,0]=4 3192 B10R1.23 C=C(C(=O)O)c1nccs1 Amb33372249 [0,1,0,0,0,1|1,0,0]=3 3193 B10R1.23 C=C(C)C(=O)c1cccs1 Amb18065371 [0,1,0,0,0,1|2,0,0]=4 3194 B10R1.23 C=C(C)C(=O)c1nccs1 Amb27214157 [0,1,0,0,0,1|1,0,0]=3 3195 B10R1.23 CC(=O)C(=O)c1ccco1 Amb27861166 [0,1,0,0,0,1|1,1,0]=4 3196 B10R1.23 CC(=O)C(=O)c1cccs1 Amb17399955 [0,1,0,0,0,1|1,0,0]=3 3197 B10R1.23 CC(=O)C(Br)c1ccco1 Amb28315902 [0,1,0,0,0,1|1,1,0]=4 3198 B10R1.23 CC(=O)C(Br)c1cccs1 Amb31193102 [0,1,0,0,0,1|1,0,0]=3 3199 B10R1.23 CC(=O)C(C)c1cocn1 Amb18832113 [0,1,0,0,0,1|2,0,0]=4 3200 B10R1.23 CC(=O)C(C)n1cccn1 Amb9664496 [0,1,0,0,0,1|2,0,0]=4 3201 B10R1.23 CC(=O)C(Cl)c1cccs1 Amb17477839 [0,1,0,0,0,1|1,0,0]=3 3202 B10R1.23 CC(=O)C(N)c1ccco1 Amb27170705 [0,1,0,0,0,1|1,1,0]=4 3203 B10R1.23 CC(=O)C(N)c1cccs1 Amb25836886 [0,1,0,0,0,1|1,0,0]=3 3204 B10R1.23 CC(=O)C(O)c1ccco1 Amb26483648 [0,1,0,0,0,1|1,1,0]=4 3205 B10R1.23 CC(=O)C(O)c1cccs1 Amb25146757 [0,1,0,0,0,1|1,0,0]=3 3206 B10R1.23 CC(=O)[C@H](O)c1ccco1 Amb27433154 [0,1,0,0,0,1|1,1,0]=4 3207 B10R1.23 CC(C(=O)O)c1cccs1 Amb10844027 [0,1,0,0,0,1|2,0,0]=4 3208 B10R1.23 CC(C(=O)O)c1nccs1 Amb10844026 [0,1,0,0,0,1|1,0,0]=3 3209 B10R1.23 CC(C(=O)[O-])c1nccs1 Amb33803402 [0,1,0,0,0,1|1,0,0]=3 3210 B10R1.23 CC(C(N)=O)c1cccs1 Amb27228397 [0,1,0,0,0,1|2,0,0]=4 3211 B10R1.23 CC(C)C(=O)c1nccs1 Amb19886380 [0,1,0,0,0,1|1,0,1]=4 3212 B10R1.23 CC(C)C(Br)c1nccs1 Amb33188605 [0,1,0,0,0,1|1,0,1]=4 3213 B10R1.23 CC(C)C(N)c1nccs1 Amb5740528 [0,1,0,0,0,1|1,0,1]=4 3214 B10R1.23 CC(C)C(O)c1nccs1 Amb24470222 [0,1,0,0,0,1|1,0,1]=4 3215 B10R1.23 CC(C)[C@@H](N)c1nccs1 Amb27984882 [0,1,0,0,0,1|1,0,1]=4 3216 B10R1.23 CC(C)[C@H](N)c1nccs1 Amb27201314 [0,1,0,0,0,1|1,0,1]=4 3217 B10R1.23 CC(Cl)C(O)c1nccs1 Amb27782388 [0,1,0,0,0,1|1,0,1]=4 3218 B10R1.23 CC(N)C(=O)c1nccs1 Amb33132821 [0,1,0,0,0,1|1,0,1]=4 3219 B10R1.23 CC(N)C(O)c1nccs1 Amb26381721 [0,1,0,0,0,1|1,0,1]=4 3220 B10R1.23 CC(O)C(C)c1nccs1 Amb32944784 [0,1,0,0,0,1|0,0,2]=4 3221 B10R1.23 CN(C)C(=O)c1nccs1 Amb27481392 [0,1,0,0,0,1|2,0,0]=4 3222 B10R1.23 CN(c1nccs1)[N+](=O)[O-] Amb27224370 [0,1,0,0,0,1|2,0,0]=4 3223 B10R1.23 C[C@@H](C(=O)O)c1cccs1 Amb10844019 [0,1,0,0,0,1|2,0,0]=4 3224 B10R1.23 C[C@@H](N)C(=O)c1nccs1 Amb33132874 [0,1,0,0,0,1|1,0,1]=4 3225 B10R1.23 C[C@H](N)C(=O)c1nccs1 Amb33132871 [0,1,0,0,0,1|1,0,1]=4 3226 B10R1.23 C[C@H](N)[C@H](O)c1nccs1 Amb27833660 [0,1,0,0,0,1|1,0,1]=4 3227 B10R1.23 NC(=O)C(=O)c1cccs1 Amb28396525 [0,1,0,0,0,1|2,0,0]=4 3228 B10R1.23 NC(=O)C(N)c1cccs1 Amb17334394 [0,1,0,0,0,1|2,0,0]=4 3229 B10R1.23 NC(C(=O)O)c1cccs1 Amb1840251 [0,1,0,0,0,1|2,0,0]=4 3230 B10R1.23 NC(C(=O)[O-])c1nccs1 Amb35826253 [0,1,0,0,0,1|1,0,0]=3 3231 B10R1.23 N[C@@H](C(=O)O)c1cccs1 Amb22747193 [0,1,0,0,0,1|2,0,0]=4 3232 B10R1.23 N[C@H](C(=O)O)c1cccs1 Amb2694806 [0,1,0,0,0,1|2,0,0]=4 3233 B10R1.23 O=C(O)C(=O)c1cccs1 Amb3940404 [0,1,0,0,0,1|2,0,0]=4 3234 B10R1.23 O=C(O)C(Cl)c1cccs1 Amb17233234 [0,1,0,0,0,1|2,0,0]=4 3235 B10R1.23 O=C(O)C(F)c1cccs1 Amb28193693 [0,1,0,0,0,1|2,0,0]=4 3236 B10R1.23 O=C(O)C(F)c1nccs1 Amb32712926 [0,1,0,0,0,1|1,0,0]=3 3237 B10R1.23 O=C(O)C(O)c1cccs1 Amb17232241 [0,1,0,0,0,1|2,0,0]=4 3238 B10R1.23 O=C(O)C(O)c1nccs1 Amb24478433 [0,1,0,0,0,1|1,0,0]=3 3239 B10R1.23 O=C(O)[C@H](O)c1cccs1 Amb27614848 [0,1,0,0,0,1|2,0,0]=4 3240 B10R1.23 O=C([O-])C(=O)c1cccs1 Amb16232244 [0,1,0,0,0,1|2,0,0]=4 3241 B10R1.27 C=CC(C)Nc1nccs1 Amb28069912 [0,1,0,0,0,1|1,0,1]=4 3242 B10R1.27 CC(C#N)Sc1nccs1 Amb18177873 [0,1,0,0,0,1|1,0,1]=4 3243 B10R1.27 CC(C=O)Sc1cccs1 Amb30034330 [0,1,0,0,0,1|1,0,1]=4 3244 B10R1.27 CC(C=O)Sc1ncco1 Amb35652159 [0,1,0,0,0,1|0,1,1]=4 3245 B10R1.27 CC(C=O)Sc1nccs1 Amb35652163 [0,1,0,0,0,1|0,0,1]=3 3246 B10R1.27 CC(C=O)Sc1ncns1 Amb35652164 [0,1,0,0,0,1|1,0,1]=4 3247 B10R1.27 CC(C=O)Sc1nncs1 Amb30035465 [0,1,0,0,0,1|1,0,1]=4 3248 B10R1.27 CC(CBr)Cc1nccs1 Amb25794588 [0,1,0,0,0,1|1,0,1]=4 3249 B10R1.27 CC(CCl)Cc1nccs1 Amb27245522 [0,1,0,0,0,1|1,0,1]=4 3250 B10R1.27 CC(CN)Nc1nccs1 Amb18908531 [0,1,0,0,0,1|1,0,1]=4 3251 B10R1.27 CC(Cc1nccs1)NN Amb28364581 [0,1,0,0,0,1|1,0,1]=4 3252 B10R1.27 CCC(=O)Cc1ccco1 Amb1102322 [0,1,0,0,0,1|1,1,0]=4 3253 B10R1.27 CCC(=O)Cc1cccs1 Amb18041935 [0,1,0,0,0,1|1,0,0]=3 3254 B10R1.27 CCC(=O)Cc1ccns1 Amb35651566 [0,1,0,0,0,1|2,0,0]=4 3255 B10R1.27 CCC(=O)NC1=NCCS1 Amb1156055 [0,1,0,0,0,1|0,0,2]=4 3256 B10R1.27 CCC(=O)Nc1ccon1 Amb27170811 [0,1,0,0,0,1|2,0,0]=4 3257 B10R1.27 CCC(=O)Nc1cscn1 Amb27488414 [0,1,0,0,0,1|2,0,0]=4 3258 B10R1.27 CCC(=O)Nc1nccs1 Amb1852206 [0,1,0,0,0,1|0,0,0]=2 3259 B10R1.27 CCC(=O)Nc1ncns1 Amb27651535 [0,1,0,0,0,1|1,0,0]=3 3260 B10R1.27 CCC(=O)Nc1nncs1 Amb3123057 [0,1,0,0,0,1|1,0,0]=3 3261 B10R1.27 CCC(=O)Nc1nnns1 Amb35605300 [0,1,0,0,0,1|2,0,0]=4 3262 B10R1.27 CCC(=O)Sc1ccco1 Amb27968127 [0,1,0,0,0,1|1,1,0]=4 3263 B10R1.27 CCC(C)Cc1nccs1 Amb35671128 [0,1,0,0,0,1|1,0,1]=4 3264 B10R1.27 CCC(C)Nc1nccs1 Amb6639252 [0,1,0,0,0,1|1,0,1]=4 3265 B10R1.27 CCC(C)Sc1nccs1 Amb28124199 [0,1,0,0,0,1|1,0,1]=4 3266 B10R1.27 CCC(N)Cc1nccs1 Amb18299919 [0,1,0,0,0,1|1,0,1]=4 3267 B10R1.27 CN(C#N)Cc1nccs1 Amb28286420 [0,1,0,0,0,1|2,0,0]=4 3268 B10R1.27 CN(C=O)Cc1cccs1 Amb27667566 [0,1,0,0,0,1|2,0,0]=4 3269 B10R1.27 CNC(=O)Cc1cccs1 Amb3620366 [0,1,0,0,0,1|1,0,0]=3 3270 B10R1.27 CNC(=O)Cc1ccon1 Amb28070394 [0,1,0,0,0,1|2,0,0]=4 3271 B10R1.27 CNC(=O)Cc1cncs1 Amb27479595 [0,1,0,0,0,1|2,0,0]=4 3272 B10R1.27 CNC(=O)Cc1nccs1 Amb28049921 [0,1,0,0,0,1|0,0,0]=2 3273 B10R1.27 CNC(=O)Cc1nnco1 Amb27833514 [0,1,0,0,0,1|1,1,0]=4 3274 B10R1.27 CNC(=O)NC1=NCCS1 Amb28050018 [0,1,0,0,0,1|0,0,2]=4 3275 B10R1.27 CNC(=O)Nc1ccon1 Amb28042472 [0,1,0,0,0,1|2,0,0]=4 3276 B10R1.27 CNC(=O)Nc1nccs1 Amb27265823 [0,1,0,0,0,1|0,0,0]=2 3277 B10R1.27 CNC(=O)Nc1nnns1 Amb35707100 [0,1,0,0,0,1|2,0,0]=4 3278 B10R1.27 CNC(=S)Nc1nccs1 Amb2535749 [0,1,0,0,0,1|0,1,0]=3 3279 B10R1.27 CNC(C)Cc1nccs1 Amb17232177 [0,1,0,0,0,1|1,0,1]=4 3280 B10R1.27 COC(=N)Cc1cccs1 Amb18799604 [0,1,0,0,0,1|2,0,0]=4 3281 B10R1.27 COC(=O)Cc1cccs1 Amb8465809 [0,1,0,0,0,1|1,0,0]=3 3282 B10R1.27 COC(=O)Cc1ccon1 Amb23440842 [0,1,0,0,0,1|2,0,0]=4 3283 B10R1.27 COC(=O)Cc1cncs1 Amb23440683 [0,1,0,0,0,1|2,0,0]=4 3284 B10R1.27 COC(=O)Cc1cocn1 Amb23440855 [0,1,0,0,0,1|2,0,0]=4 3285 B10R1.27 COC(=O)Cc1cscn1 Amb27967102 [0,1,0,0,0,1|2,0,0]=4 3286 B10R1.27 COC(=O)Cc1nccs1 Amb18787677 [0,1,0,0,0,1|0,0,0]=2 3287 B10R1.27 COC(=O)Cc1nccs1 Amb33362337 [0,1,0,0,0,1|0,0,0]=2 3288 B10R1.27 COC(=O)Cc1nnco1 Amb22886633 [0,1,0,0,0,1|1,1,0]=4 3289 B10R1.27 COC(=O)Cn1cccn1 Amb6739862 [0,1,0,0,0,1|2,0,0]=4 3290 B10R1.27 COC(=O)Cn1nccn1 Amb25958017 [0,1,0,0,0,1|2,0,0]=4 3291 B10R1.27 COC(=O)Nc1ccco1 Amb28241377 [0,1,0,0,0,1|1,1,0]=4 3292 B10R1.27 COC(=O)Nc1ccon1 Amb28141096 [0,1,0,0,0,1|2,0,0]=4 3293 B10R1.27 COC(=O)Nc1nccs1 Amb6335243 [0,1,0,0,0,1|0,0,0]=2 3294 B10R1.27 COC(=O)Oc1ccco1 Amb27974836 [0,1,0,0,0,1|1,1,0]=4 3295 B10R1.27 COC(=O)Sc1cccs1 Amb28368652 [0,1,0,0,0,1|1,0,0]=3 3296 B10R1.27 CSC(=O)Cc1ccco1 Amb27843701 [0,1,0,0,0,1|1,1,0]=4 3297 B10R1.27 CSC(=O)Nc1nccs1 Amb27816280 [0,1,0,0,0,1|0,0,0]=2 3298 B10R1.27 CSC(=S)Nc1nccs1 Amb5716144 [0,1,0,0,0,1|0,1,0]=3 3299 B10R1.27 CSC(=S)Nc1nncs1 Amb27614158 [0,1,0,0,0,1|1,1,0]=4 3300 B10R1.27 C\C(=C\c1cccs1)CBr Amb27262831 [0,1,0,0,0,1|2,0,0]=4 3301 B10R1.27 C\C(=C\c1cccs1)CCl Amb27591691 [0,1,0,0,0,1|2,0,0]=4 3302 B10R1.27 C\C(C=O)=C/c1ccco1 Amb3599297 [0,1,0,0,0,1|1,1,0]=4 3303 B10R1.27 C\C(C=O)=C/c1cccs1 Amb17334333 [0,1,0,0,0,1|1,0,0]=3 3304 B10R1.27 C\C(C=O)=C/c1ccns1 Amb35719812 [0,1,0,0,0,1|2,0,0]=4 3305 B10R1.27 C\C(C=O)=C/c1cncs1 Amb27405461 [0,1,0,0,0,1|2,0,0]=4 3306 B10R1.27 C\C(C=O)=C\c1ccco1 Amb2792767 [0,1,0,0,0,1|1,1,0]=4 3307 B10R1.27 C\C(C=O)=C\c1nccs1 Amb27172890 [0,1,0,0,0,1|0,0,0]=2 3308 B10R1.27 C\C(Cc1cccs1)=N\O Amb29859701 [0,1,0,0,0,1|1,0,1]=4 3309 B10R1.27 N=C(NN)Nc1nccs1 Amb27827572 [0,1,0,0,0,1|2,0,0]=4 3310 B10R1.27 NC(CO)Cc1nccs1 Amb25684115 [0,1,0,0,0,1|1,0,1]=4 3311 B10R1.27 NC(CO)Cc1nccs1 Amb32795064 [0,1,0,0,0,1|1,0,1]=4 3312 B10R1.27 NCC(=O)Cc1ccco1 Amb18251183 [0,1,0,0,0,1|1,1,0]=4 3313 B10R1.27 NCC(=O)Cc1cccs1 Amb18908487 [0,1,0,0,0,1|1,0,0]=3 3314 B10R1.27 NCC(=O)Cc1ccns1 Amb33131343 [0,1,0,0,0,1|2,0,0]=4 3315 B10R1.27 NCC(=O)Cc1cncs1 Amb24585067 [0,1,0,0,0,1|2,0,0]=4 3316 B10R1.27 NCC(=O)Cc1cscn1 Amb18830757 [0,1,0,0,0,1|2,0,0]=4 3317 B10R1.27 NCC(=O)Cc1nccs1 Amb25302658 [0,1,0,0,0,1|0,0,0]=2 3318 B10R1.27 NCC(=O)Cn1cccn1 Amb27625212 [0,1,0,0,0,1|2,0,0]=4 3319 B10R1.27 NCC(=O)NC1=NCCS1 Amb18908568 [0,1,0,0,0,1|0,0,2]=4 3320 B10R1.27 NCC(=O)Nc1cccs1 Amb24480928 [0,1,0,0,0,1|1,0,0]=3 3321 B10R1.27 NCC(=O)Nc1nccs1 Amb10609835 [0,1,0,0,0,1|0,0,0]=2 3322 B10R1.27 NCC(=O)Nc1nccs1 Amb17622124 [0,1,0,0,0,1|0,0,0]=2 3323 B10R1.27 NCC(=O)Nc1nccs1 Amb6262736 [0,1,0,0,0,1|0,0,0]=2 3324 B10R1.27 NCC(=O)Oc1ccco1 Amb28428465 [0,1,0,0,0,1|1,1,0]=4 3325 B10R1.27 NCC(O)Cc1nccs1 Amb18560826 [0,1,0,0,0,1|0,0,2]=4 3326 B10R1.27 NNC(=O)Cc1cccs1 Amb1153785 [0,1,0,0,0,1|2,0,0]=4 3327 B10R1.27 NNC(=O)Cc1nccs1 Amb27862958 [0,1,0,0,0,1|1,0,0]=3 3328 B10R1.27 NNC(=O)Nc1nccs1 Amb27239901 [0,1,0,0,0,1|1,0,0]=3 3329 B10R1.27 NNC(=O)Nc1nncs1 Amb24524600 [0,1,0,0,0,1|2,0,0]=4 3330 B10R1.27 NNC(=S)Nc1nccs1 Amb597749 [0,1,0,0,0,1|1,1,0]=4 3331 B10R1.27 N\C(=C/c1cccs1)CO Amb28245870 [0,1,0,0,0,1|2,0,0]=4 3332 B10R1.27 N\C(=C\c1cccs1)CO Amb27624553 [0,1,0,0,0,1|2,0,0]=4 3333 B10R1.27 N\C(Cc1nccs1)=N\O Amb27837791 [0,1,0,0,0,1|1,0,1]=4 3334 B10R1.27 O=C(CBr)Cc1cccs1 Amb24076613 [0,1,0,0,0,1|1,0,0]=3 3335 B10R1.27 O=C(CBr)NC1=NCCS1 Amb17324663 [0,1,0,0,0,1|0,0,2]=4 3336 B10R1.27 O=C(CBr)Nc1ncco1 Amb27863899 [0,1,0,0,0,1|0,1,0]=3 3337 B10R1.27 O=C(CBr)Nc1nccs1 Amb4311213 [0,1,0,0,0,1|0,0,0]=2 3338 B10R1.27 O=C(CBr)Nc1nncs1 Amb17330091 [0,1,0,0,0,1|1,0,0]=3 3339 B10R1.27 O=C(CCl)Cc1ccco1 Amb27214672 [0,1,0,0,0,1|1,1,0]=4 3340 B10R1.27 O=C(CCl)Cc1cccs1 Amb6261931 [0,1,0,0,0,1|1,0,0]=3 3341 B10R1.27 O=C(CCl)NC1=NCCS1 Amb1897127 [0,1,0,0,0,1|0,0,2]=4 3342 B10R1.27 O=C(CCl)Nc1ccco1 Amb27184026 [0,1,0,0,0,1|1,1,0]=4 3343 B10R1.27 O=C(CCl)Nc1cccs1 Amb27863041 [0,1,0,0,0,1|1,0,0]=3 3344 B10R1.27 O=C(CCl)Nc1ccon1 Amb477907 [0,1,0,0,0,1|2,0,0]=4 3345 B10R1.27 O=C(CCl)Nc1nccs1 Amb6316608 [0,1,0,0,0,1|0,0,0]=2 3346 B10R1.27 O=C(CCl)Nc1ncns1 Amb27233537 [0,1,0,0,0,1|1,0,0]=3 3347 B10R1.27 O=C(CCl)Nc1nncs1 Amb6335623 [0,1,0,0,0,1|1,0,0]=3 3348 B10R1.27 O=C(CCl)Nc1nncs1 Amb9677316 [0,1,0,0,0,1|1,0,0]=3 3349 B10R1.27 O=C(CCl)Nc1nnns1 Amb27211669 [0,1,0,0,0,1|2,0,0]=4 3350 B10R1.27 O=C(CO)Cc1ccco1 Amb27226948 [0,1,0,0,0,1|1,1,0]=4 3351 B10R1.27 O=C(CO)NC1=NCCS1 Amb5800594 [0,1,0,0,0,1|0,0,2]=4 3352 B10R1.27 O=C(CO)Nc1ccon1 Amb28316073 [0,1,0,0,0,1|2,0,0]=4 3353 B10R1.27 O=C(CO)Nc1nccs1 Amb1110279 [0,1,0,0,0,1|0,0,0]=2 3354 B10R1.27 O=C(Cc1cccs1)NO Amb6274697 [0,1,0,0,0,1|2,0,0]=4 3355 B10R1.27 O=CC(O)Cc1nccs1 Amb27244061 [0,1,0,0,0,1|1,0,1]=4 3356 B10R1.27 O=C\C(Cl)=C/c1cccs1 Amb27227152 [0,1,0,0,0,1|2,0,0]=4 3357 B10R1.27 O=C\C(F)=C\c1cccs1 Amb27770449 [0,1,0,0,0,1|2,0,0]=4 3358 B10R1.27 OC\C(F)=C\c1cccs1 Amb27829738 [0,1,0,0,0,1|2,0,0]=4 3359 B10R1.54 C=C(C)Cc1ccc(C)s1 Amb25244717 [0,1,0,0,0,1|2,0,0]=4 3360 B10R1.54 C=C1CN\C(=C/C(C)=O)S1 Amb28252104 [0,1,0,0,0,1|0,0,2]=4 3361 B10R1.54 C=C1CN\C(=C\C(C)=O)S1 Amb27643446 [0,1,0,0,0,1|0,0,2]=4 3362 B10R1.54 CC(=O)CC1=NNC(=O)O1 Amb28436521 [0,1,0,0,0,1|1,1,0]=4 3363 B10R1.54 CC(=O)CC1=NOC(=O)C1 Amb27638501 [0,1,0,0,0,1|2,0,0]=4 3364 B10R1.54 CC(=O)Cc1cc(Br)co1 Amb33332649 [0,1,0,0,0,1|1,1,0]=4 3365 B10R1.54 CC(=O)Cc1cc(Br)cs1 Amb26048308 [0,1,0,0,0,1|1,0,0]=3 3366 B10R1.54 CC(=O)Cc1cc(C)cs1 Amb25146717 [0,1,0,0,0,1|1,0,0]=3 3367 B10R1.54 CC(=O)Cc1cc(C)on1 Amb27615044 [0,1,0,0,0,1|2,0,0]=4 3368 B10R1.54 CC(=O)Cc1cc(Cl)cs1 Amb33057519 [0,1,0,0,0,1|1,0,0]=3 3369 B10R1.54 CC(=O)Cc1ccc(Br)o1 Amb26003095 [0,1,0,0,0,1|1,1,0]=4 3370 B10R1.54 CC(=O)Cc1ccc(C)o1 Amb17477800 [0,1,0,0,0,1|1,1,0]=4 3371 B10R1.54 CC(=O)Cc1ccc(C)s1 Amb25146673 [0,1,0,0,0,1|1,0,0]=3 3372 B10R1.54 CC(=O)Cc1ccc(Cl)o1 Amb33258287 [0,1,0,0,0,1|1,1,0]=4 3373 B10R1.54 CC(=O)Cc1ccc(Cl)s1 Amb33531007 [0,1,0,0,0,1|1,0,0]=3 3374 B10R1.54 CC(=O)Cc1ccn(C)n1 Amb26507502 [0,1,0,0,0,1|2,0,0]=4 3375 B10R1.54 CC(=O)Cc1cn(C)cn1 Amb33224218 [0,1,0,0,0,1|2,0,0]=4 3376 B10R1.54 CC(=O)Cc1cnc(C)s1 Amb18062038 [0,1,0,0,0,1|2,0,0]=4 3377 B10R1.54 CC(=O)Cc1cnc(Cl)s1 Amb33059180 [0,1,0,0,0,1|2,0,0]=4 3378 B10R1.54 CC(=O)Cc1coc(Cl)n1 Amb28246177 [0,1,0,0,0,1|2,0,0]=4 3379 B10R1.54 CC(=O)Cc1csc(Br)n1 Amb18766886 [0,1,0,0,0,1|2,0,0]=4 3380 B10R1.54 CC(=O)Cc1csc(N)n1 Amb18830764 [0,1,0,0,0,1|2,0,0]=4 3381 B10R1.54 CC(=O)Cc1nc(Br)no1 Amb18783668 [0,1,0,0,0,1|1,1,0]=4 3382 B10R1.54 CC(=O)Cc1nc(C)cs1 Amb18791661 [0,1,0,0,0,1|0,0,0]=2 3383 B10R1.54 CC(=O)Cc1nc(C)no1 Amb10607317 [0,1,0,0,0,1|1,1,0]=4 3384 B10R1.54 CC(=O)Cc1ncc(Br)s1 Amb33435428 [0,1,0,0,0,1|0,0,0]=2 3385 B10R1.54 CC(=O)Cc1ncc(C)s1 Amb18830874 [0,1,0,0,0,1|0,0,0]=2 3386 B10R1.54 CC(=O)Cc1nnc(C)o1 Amb10068140 [0,1,0,0,0,1|1,1,0]=4 3387 B10R1.54 CC(=O)Cc1nnc(C)s1 Amb31293230 [0,1,0,0,0,1|1,0,0]=3 3388 B10R1.54 CC(=O)Cc1nnc(N)o1 Amb18643669 [0,1,0,0,0,1|1,1,0]=4 3389 B10R1.54 CC(=O)Cc1nsc(C)n1 Amb18830748 [0,1,0,0,0,1|2,0,0]=4 3390 B10R1.54 CC(=O)Cc1nsc(N)n1 Amb18830620 [0,1,0,0,0,1|2,0,0]=4 3391 B10R1.54 CC(=O)Cn1cc(Br)cn1 Amb6888773 [0,1,0,0,0,1|2,0,0]=4 3392 B10R1.54 CC(=O)Cn1cc(C)cn1 Amb6891252 [0,1,0,0,0,1|2,0,0]=4 3393 B10R1.54 CC(=O)Cn1cc(I)cn1 Amb27839125 [0,1,0,0,0,1|2,0,0]=4 3394 B10R1.54 CC(=O)Cn1cc(N)cn1 Amb26861545 [0,1,0,0,0,1|2,0,0]=4 3395 B10R1.54 CC(=O)Cn1ccc(C)n1 Amb1945708 [0,1,0,0,0,1|2,0,0]=4 3396 B10R1.54 CC(=O)Cn1ncc(N)n1 Amb27462665 [0,1,0,0,0,1|2,0,0]=4 3397 B10R1.54 CC(=O)NC1=NC(=O)CS1 Amb3469492 [0,1,0,0,0,1|0,0,1]=3 3398 B10R1.54 CC(=O)NC1=NCC(=O)N1 Amb24640420 [0,1,0,0,0,1|1,0,1]=4 3399 B10R1.54 CC(=O)NC1=NCC(=O)S1 Amb26584283 [0,1,0,0,0,1|0,0,1]=3 3400 B10R1.54 CC(=O)NC1=NCC(C)S1 Amb9685899 [0,1,0,0,0,1|0,0,2]=4 3401 B10R1.54 CC(=O)NC1=NNC(=S)S1 Amb19514285 [0,1,0,0,0,1|1,0,0]=3 3402 B10R1.54 CC(=O)NC1CC=C(Br)S1 Amb27800836 [0,1,0,0,0,1|1,0,1]=4 3403 B10R1.54 CC(=O)Nc1cc(C)on1 Amb6355999 [0,1,0,0,0,1|2,0,0]=4 3404 B10R1.54 CC(=O)Nc1cc(I)cs1 Amb23400215 [0,1,0,0,0,1|1,0,0]=3 3405 B10R1.54 CC(=O)Nc1ccc(Br)s1 Amb21864811 [0,1,0,0,0,1|1,0,0]=3 3406 B10R1.54 CC(=O)Nc1ccc(C)s1 Amb23447076 [0,1,0,0,0,1|1,0,0]=3 3407 B10R1.54 CC(=O)Nc1ccn(C)n1 Amb27839169 [0,1,0,0,0,1|2,0,0]=4 3408 B10R1.54 CC(=O)Nc1cnc(Br)s1 Amb26644369 [0,1,0,0,0,1|2,0,0]=4 3409 B10R1.54 CC(=O)Nc1cnc(C)s1 Amb22751060 [0,1,0,0,0,1|2,0,0]=4 3410 B10R1.54 CC(=O)Nc1csc(Br)n1 Amb25127547 [0,1,0,0,0,1|2,0,0]=4 3411 B10R1.54 CC(=O)Nc1csc(C)n1 Amb22751061 [0,1,0,0,0,1|2,0,0]=4 3412 B10R1.54 CC(=O)Nc1nc(C)cs1 Amb1196651 [0,1,0,0,0,1|0,0,0]=2 3413 B10R1.54 CC(=O)Nc1nc(C)no1 Amb27471680 [0,1,0,0,0,1|1,1,0]=4 3414 B10R1.54 CC(=O)Nc1nc(C)ns1 Amb8471484 [0,1,0,0,0,1|1,0,0]=3 3415 B10R1.54 CC(=O)Nc1nc(N)cs1 Amb27225205 [0,1,0,0,0,1|0,0,0]=2 3416 B10R1.54 CC(=O)Nc1ncc(Br)s1 Amb2031949 [0,1,0,0,0,1|0,0,0]=2 3417 B10R1.54 CC(=O)Nc1ncc(C)s1 Amb21862180 [0,1,0,0,0,1|0,0,0]=2 3418 B10R1.54 CC(=O)Nc1ncc(Cl)s1 Amb6366021 [0,1,0,0,0,1|0,0,0]=2 3419 B10R1.54 CC(=O)Nc1ncc(I)s1 Amb22755706 [0,1,0,0,0,1|0,0,0]=2 3420 B10R1.54 CC(=O)Nc1nnc(C)s1 Amb1151681 [0,1,0,0,0,1|1,0,0]=3 3421 B10R1.54 CC(=O)Nc1nnc(Cl)s1 Amb10566478 [0,1,0,0,0,1|1,0,0]=3 3422 B10R1.54 CC(=O)Nc1nnc(I)s1 Amb23401913 [0,1,0,0,0,1|1,0,0]=3 3423 B10R1.54 CC(=O)Nc1nnc(S)s1 Amb8390281 [0,1,0,0,0,1|1,0,0]=3 3424 B10R1.54 CC(=O)Nc1noc(C)n1 Amb19651452 [0,1,0,0,0,1|2,0,0]=4 3425 B10R1.54 CC(=O)Nc1nsc(N)n1 Amb2721851 [0,1,0,0,0,1|2,0,0]=4 3426 B10R1.54 CC(=O)OC1=CNC(=S)S1 Amb28051759 [0,1,0,0,0,1|2,0,0]=4 3427 B10R1.54 CC(=O)Oc1cnc(Br)s1 Amb10807804 [0,1,0,0,0,1|2,0,0]=4 3428 B10R1.54 CC(=O)Oc1csc(N)n1 Amb27768730 [0,1,0,0,0,1|2,0,0]=4 3429 B10R1.54 CC(=O)Oc1nc(Br)cs1 Amb20617514 [0,1,0,0,0,1|0,0,0]=2 3430 B10R1.54 CC(=O)Oc1ncc(Br)s1 Amb20617501 [0,1,0,0,0,1|0,0,0]=2 3431 B10R1.54 CC(=O)Sc1cc(C)on1 Amb27612930 [0,1,0,0,0,1|2,0,0]=4 3432 B10R1.54 CC(=O)Sc1nc(N)cs1 Amb27634126 [0,1,0,0,0,1|0,0,0]=2 3433 B10R1.54 CC(=O)\C=C1/C=C(C)SS1 Amb27432661 [0,1,0,0,0,1|2,0,0]=4 3434 B10R1.54 CC(=O)\C=C1\C=C(C)SS1 Amb27615129 [0,1,0,0,0,1|2,0,0]=4 3435 B10R1.54 CC(=O)\N=C1/N=C(S)SS1 Amb19372204 [0,1,0,0,0,1|1,0,0]=3 3436 B10R1.54 CC(=O)\N=C1/NC(=O)CS1 Amb3482995 [0,1,0,0,0,1|0,0,2]=4 3437 B10R1.54 CC(=O)\N=C1/NC(=S)SS1 Amb22558948 [0,1,0,0,0,1|1,0,1]=4 3438 B10R1.54 CC(Br)Cc1ncc(Br)s1 Amb33434413 [0,1,0,0,0,1|1,0,1]=4 3439 B10R1.54 CC(C)Cc1ncc(Br)s1 Amb20617638 [0,1,0,0,0,1|1,0,1]=4 3440 B10R1.54 CC(C)Nc1nc(Br)cs1 Amb27150399 [0,1,0,0,0,1|1,0,1]=4 3441 B10R1.54 CC(C)Nc1nc(O)cs1 Amb35710106 [0,1,0,0,0,1|1,0,1]=4 3442 B10R1.54 CC(C)Nc1ncc(Br)s1 Amb24624387 [0,1,0,0,0,1|1,0,1]=4 3443 B10R1.54 CC(C)Nc1ncc(Cl)s1 Amb26658664 [0,1,0,0,0,1|1,0,1]=4 3444 B10R1.54 CC(C)Oc1nc(Br)cs1 Amb10599323 [0,1,0,0,0,1|1,0,1]=4 3445 B10R1.54 CC(C)Oc1ncc(Br)s1 Amb10599349 [0,1,0,0,0,1|1,0,1]=4 3446 B10R1.54 CC(C)Oc1ncc(N)s1 Amb20617372 [0,1,0,0,0,1|1,0,1]=4 3447 B10R1.54 CC(N)Cc1nc(O)cs1 Amb30015664 [0,1,0,0,0,1|1,0,1]=4 3448 B10R1.54 CC(N)Cc1ncc(Br)s1 Amb27852642 [0,1,0,0,0,1|1,0,1]=4 3449 B10R1.54 CC(N)Cc1ncc(I)s1 Amb27971539 [0,1,0,0,0,1|1,0,1]=4 3450 B10R1.54 CC(O)Cc1ncc(Br)s1 Amb33435432 [0,1,0,0,0,1|0,0,2]=4 3451 B10R1.54 CN(C)Cc1nc(Br)cs1 Amb27462483 [0,1,0,0,0,1|2,0,0]=4 3452 B10R1.54 CN(C)Cc1nc(N)cs1 Amb18830576 [0,1,0,0,0,1|2,0,0]=4 3453 B10R1.54 CN(C)Nc1nc(O)cs1 Amb35710110 [0,1,0,0,0,1|2,0,0]=4 3454 B10R1.54 CN(C)Nc1ncc(Br)s1 Amb27210901 [0,1,0,0,0,1|2,0,0]=4 3455 B10R1.54 CN(C)Nc1ncc(N)s1 Amb27389753 [0,1,0,0,0,1|2,0,0]=4 3456 B10R1.54 CN(O)Cc1ncc(Br)s1 Amb33263673 [0,1,0,0,0,1|1,0,1]=4 3457 B10R1.54 C[C@@H](N)Cc1ncc(Br)s1 Amb33434461 [0,1,0,0,0,1|1,0,1]=4 3458 B10R1.54 C[C@@H](O)Cc1ncc(Br)s1 Amb33434713 [0,1,0,0,0,1|0,0,2]=4 3459 B10R1.54 C[C@H](N)Cc1ncc(Br)s1 Amb33434463 [0,1,0,0,0,1|1,0,1]=4 3460 B10R1.54 C[C@H](O)Cc1ncc(Br)s1 Amb33434466 [0,1,0,0,0,1|0,0,2]=4 3461 B10R1.54 C\C(N)=C/c1nc(C)ns1 Amb28291563 [0,1,0,0,0,1|2,0,0]=4 3462 B10R1.54 Cc1ccc(CC(=O)O)s1 Amb2234463 [0,1,0,0,0,1|2,0,0]=4 3463 B10R1.54 Cc1ccc(CC(N)=O)s1 Amb26000481 [0,1,0,0,0,1|2,0,0]=4 3464 B10R1.54 Cc1ccc(NC(N)=O)s1 Amb28049726 [0,1,0,0,0,1|2,0,0]=4 3465 B10R1.54 Cc1cnc(CC(=O)O)o1 Amb18831795 [0,1,0,0,0,1|1,1,0]=4 3466 B10R1.54 Cc1cnc(CC(=O)O)s1 Amb18286622 [0,1,0,0,0,1|1,0,0]=3 3467 B10R1.54 Cc1cnc(CC(=O)[O-])o1 Amb32656061 [0,1,0,0,0,1|1,1,0]=4 3468 B10R1.54 Cc1cnc(CC(=O)[O-])s1 Amb24271127 [0,1,0,0,0,1|1,0,0]=3 3469 B10R1.54 Cc1cnc(CC(C)N)s1 Amb18286726 [0,1,0,0,0,1|1,0,1]=4 3470 B10R1.54 Cc1cnc(CC(N)=O)s1 Amb23538541 [0,1,0,0,0,1|1,0,0]=3 3471 B10R1.54 Cc1cnc(CC(N)=S)s1 Amb23556185 [0,1,0,0,0,1|1,1,0]=4 3472 B10R1.54 Cc1cnc(N[N+](=O)[O-])s1 Amb27638696 [0,1,0,0,0,1|2,0,0]=4 3473 B10R1.54 Cc1coc(CC(=O)O)n1 Amb18831793 [0,1,0,0,0,1|1,1,0]=4 3474 B10R1.54 Cc1csc(CC(=O)O)c1 Amb8010099 [0,1,0,0,0,1|2,0,0]=4 3475 B10R1.54 Cc1csc(CC(=O)O)n1 Amb3978737 [0,1,0,0,0,1|1,0,0]=3 3476 B10R1.54 Cc1csc(CC(=O)[O-])n1 Amb465809 [0,1,0,0,0,1|1,0,0]=3 3477 B10R1.54 Cc1csc(CC(C)C)n1 Amb8628883 [0,1,0,0,0,1|1,0,1]=4 3478 B10R1.54 Cc1csc(CC(C)N)n1 Amb5740875 [0,1,0,0,0,1|1,0,1]=4 3479 B10R1.54 Cc1csc(CC(C)O)n1 Amb18791837 [0,1,0,0,0,1|0,0,2]=4 3480 B10R1.54 Cc1csc(CC(N)=O)n1 Amb672335 [0,1,0,0,0,1|1,0,0]=3 3481 B10R1.54 Cc1csc(CC(N)=S)n1 Amb435642 [0,1,0,0,0,1|1,1,0]=4 3482 B10R1.54 Cc1csc(NC(=N)N)n1 Amb2420396 [0,1,0,0,0,1|2,0,0]=4 3483 B10R1.54 Cc1csc(NC(=N)N)n1 Amb2724126 [0,1,0,0,0,1|2,0,0]=4 3484 B10R1.54 Cc1csc(NC(=N)[NH3+])n1 Amb24122690 [0,1,0,0,0,1|2,0,0]=4 3485 B10R1.54 Cc1csc(NC(C)C)n1 Amb2794052 [0,1,0,0,0,1|1,0,1]=4 3486 B10R1.54 Cc1csc(N[N+](=O)[O-])n1 Amb28135793 [0,1,0,0,0,1|2,0,0]=4 3487 B10R1.54 Cc1nnc(CC(=O)O)s1 Amb8009453 [0,1,0,0,0,1|2,0,0]=4 3488 B10R1.54 Cc1nnc(CC(=O)[O-])s1 Amb32662951 [0,1,0,0,0,1|2,0,0]=4 3489 B10R1.54 Cc1nnc(NC(N)=O)s1 Amb25138698 [0,1,0,0,0,1|2,0,0]=4 3490 B10R1.54 Cc1nsc(CC(=O)O)n1 Amb18830502 [0,1,0,0,0,1|2,0,0]=4 3491 B10R1.54 Cc1nsc(CC(=O)[O-])n1 Amb32675036 [0,1,0,0,0,1|2,0,0]=4 3492 B10R1.54 N=C(N)Cc1ncc(Br)s1 Amb33436114 [0,1,0,0,0,1|2,0,0]=4 3493 B10R1.54 N=C(N)Nc1nc(N)cs1 Amb24122536 [0,1,0,0,0,1|2,0,0]=4 3494 B10R1.54 N=C(N)Nc1nc(O)cs1 Amb28400065 [0,1,0,0,0,1|2,0,0]=4 3495 B10R1.54 N=C(N)Nc1ncc(N)s1 Amb30594948 [0,1,0,0,0,1|2,0,0]=4 3496 B10R1.54 NC(=O)CC1=NC(=O)CS1 Amb2713804 [0,1,0,0,0,1|1,0,1]=4 3497 B10R1.54 NC(=O)Cc1cc(Br)cs1 Amb18896728 [0,1,0,0,0,1|2,0,0]=4 3498 B10R1.54 NC(=O)Cc1ccc(Br)s1 Amb17405436 [0,1,0,0,0,1|2,0,0]=4 3499 B10R1.54 NC(=O)Cc1ccc(Cl)s1 Amb17400533 [0,1,0,0,0,1|2,0,0]=4 3500 B10R1.54 NC(=O)Cc1nc(O)cs1 Amb2411452 [0,1,0,0,0,1|1,0,0]=3 3501 B10R1.54 NC(=O)Cc1nnc(N)s1 Amb1069619 [0,1,0,0,0,1|2,0,0]=4 3502 B10R1.54 NC(=O)Cc1nnc(S)s1 Amb28119701 [0,1,0,0,0,1|2,0,0]=4 3503 B10R1.54 NC(=O)Nc1cc(Br)cs1 Amb25786551 [0,1,0,0,0,1|2,0,0]=4 3504 B10R1.54 NC(=O)Nc1ccc(Br)s1 Amb28400684 [0,1,0,0,0,1|2,0,0]=4 3505 B10R1.54 NC(=O)Nc1ccc(Cl)s1 Amb25851347 [0,1,0,0,0,1|2,0,0]=4 3506 B10R1.54 NC(=O)Nc1ncc(Br)s1 Amb27978107 [0,1,0,0,0,1|1,0,0]=3 3507 B10R1.54 NC(=S)Cc1nc(O)cs1 Amb2411405 [0,1,0,0,0,1|1,1,0]=4 3508 B10R1.54 NC(=S)Cc1ncc(Br)s1 Amb33436116 [0,1,0,0,0,1|1,1,0]=4 3509 B10R1.54 Nc1csc(CC(=O)O)c1 Amb18830633 [0,1,0,0,0,1|2,0,0]=4 3510 B10R1.54 Nc1nnc(CC(=O)O)s1 Amb2236079 [0,1,0,0,0,1|2,0,0]=4 3511 B10R1.54 Nc1nnc(CC(=O)O)s1 Amb32676790 [0,1,0,0,0,1|2,0,0]=4 3512 B10R1.54 O=C(O)CC1=NC(=O)CS1 Amb9774271 [0,1,0,0,0,1|1,0,1]=4 3513 B10R1.54 O=C(O)Cc1cc(Br)cs1 Amb10069924 [0,1,0,0,0,1|2,0,0]=4 3514 B10R1.54 O=C(O)Cc1cc(Cl)cs1 Amb26599631 [0,1,0,0,0,1|2,0,0]=4 3515 B10R1.54 O=C(O)Cc1ccc(Br)s1 Amb2237320 [0,1,0,0,0,1|2,0,0]=4 3516 B10R1.54 O=C(O)Cc1ccc(Cl)s1 Amb2235520 [0,1,0,0,0,1|2,0,0]=4 3517 B10R1.54 O=C(O)Cc1ccc(F)s1 Amb24269131 [0,1,0,0,0,1|2,0,0]=4 3518 B10R1.54 O=C(O)Cc1nc(Cl)co1 Amb18829877 [0,1,0,0,0,1|1,1,0]=4 3519 B10R1.54 O=C(O)Cc1nc(Cl)cs1 Amb27494965 [0,1,0,0,0,1|1,0,0]=3 3520 B10R1.54 O=C(O)Cc1nc(O)cs1 Amb35710164 [0,1,0,0,0,1|1,0,0]=3 3521 B10R1.54 O=C(O)Cc1ncc(Br)s1 Amb27812892 [0,1,0,0,0,1|1,0,0]=3 3522 B10R1.54 O=C(O)Cc1ncc(Cl)s1 Amb23439705 [0,1,0,0,0,1|1,0,0]=3 3523 B10R1.54 O=C(O)Cc1ncc(I)s1 Amb27614866 [0,1,0,0,0,1|1,0,0]=3 3524 B10R1.54 O=C([O-])Cc1ncc(Cl)s1 Amb33552717 [0,1,0,0,0,1|1,0,0]=3 3525 B10R1.54 O=[N+]([O-])Cc1ncc(Br)s1 Amb33434717 [0,1,0,0,0,1|2,0,0]=4 3526 B10R1.64 CC(=O)Cc1cccn1C Amb25053401 [0,1,0,0,0,1|1,0,1]=4 3527 B10R1.64 CC(=O)Cc1occc1C Amb26431468 [0,1,0,0,0,1|1,1,0]=4 3528 B10R1.64 CC(=O)Cc1sccc1Br Amb27424961 [0,1,0,0,0,1|1,0,0]=3 3529 B10R1.64 CC(=O)Cc1sccc1C Amb17477801 [0,1,0,0,0,1|1,0,0]=3 3530 B10R1.64 CC(=O)Cc1sccc1Cl Amb27632186 [0,1,0,0,0,1|1,0,0]=3 3531 B10R1.64 CC(=O)Cc1scnc1C Amb32877659 [0,1,0,0,0,1|2,0,0]=4 3532 B10R1.64 CC(=O)Cn1nccc1C Amb1945402 [0,1,0,0,0,1|2,0,0]=4 3533 B10R1.64 CC(=O)Nc1nccn1C Amb23437088 [0,1,0,0,0,1|1,0,0]=3 3534 B10R1.64 CC(=O)Nc1ncnn1C Amb27838068 [0,1,0,0,0,1|2,0,0]=4 3535 B10R1.64 CC(=O)Nc1sccc1Br Amb9175394 [0,1,0,0,0,1|1,0,0]=3 3536 B10R1.64 CC(=O)Nc1sccc1Cl Amb23400211 [0,1,0,0,0,1|1,0,0]=3 3537 B10R1.64 CC(=O)Nc1sccc1I Amb23400212 [0,1,0,0,0,1|1,0,0]=3 3538 B10R1.64 CC(=O)Nc1scnc1Br Amb27394803 [0,1,0,0,0,1|2,0,0]=4 3539 B10R1.64 CC(=O)Oc1sccc1N Amb10071362 [0,1,0,0,0,1|1,0,0]=3 3540 B10R1.64 CC(=O)Sc1nccn1C Amb27959172 [0,1,0,0,0,1|1,0,0]=3 3541 B10R1.64 CC(=O)\N=C1\SC=CN1C Amb19850210 [0,1,0,0,0,1|0,0,1]=3 3542 B10R1.64 Cc1ccsc1CC(=O)O Amb33530091 [0,1,0,0,0,1|2,0,0]=4 3543 B10R1.64 Cc1ccsc1CC(N)=O Amb27770390 [0,1,0,0,0,1|2,0,0]=4 3544 B10R1.64 Cn1ccnc1CC(=O)O Amb17106786 [0,1,0,0,0,1|2,0,0]=4 3545 B10R1.64 Cn1ccnc1CC(=O)O Amb28895979 [0,1,0,0,0,1|2,0,0]=4 3546 B10R1.64 Nc1ccsc1CC(=O)O Amb22499925 [0,1,0,0,0,1|2,0,0]=4 3547 B10R1.64 Nn1ccnc1CC(=O)O Amb26960372 [0,1,0,0,0,1|2,0,0]=4 3548 B10R1.64 O=C(O)Cc1sccc1Br Amb18283686 [0,1,0,0,0,1|2,0,0]=4 3549 B10R1.64 O=C(O)Cc1sccc1Cl Amb27160571 [0,1,0,0,0,1|2,0,0]=4 3550 B10R1.281 CC(C)(C)Nc1nccs1 Amb18965654 [0,1,0,0,0,1|1,0,1]=4 3551 B10R1.281 CC(C)(N)Cc1nccs1 Amb5740904 [0,1,0,0,0,1|1,0,1]=4 3552 B10R1.281 CC(C)(O)Cc1nccs1 Amb24513731 [0,1,0,0,0,1|0,0,2]=4 3553 B10R1.281 CS(=N)(=O)Nc1nccs1 Amb29851685 [0,1,0,0,0,1|1,0,0]=3 3554 B10R1.281 CS(=N)(=O)Nc1nncs1 Amb29850918 [0,1,0,0,0,1|2,0,0]=4 3555 B10R1.281 CS(=O)(=O)Cc1cccs1 Amb27642768 [0,1,0,0,0,1|2,0,0]=4 3556 B10R1.281 CS(=O)(=O)Nc1nccs1 Amb3886763 [0,1,0,0,0,1|1,0,0]=3 3557 B10R1.281 CS(C)(=O)=Nc1cccs1 Amb32654245 [0,1,0,0,0,1|2,0,0]=4 3558 B10R1.281 C[Si](C)(C)Sc1nccs1 Amb27636685 [0,1,0,0,0,1|1,1,0]=4 3559 B10R1.281 NS(=O)(=O)Cc1nccs1 Amb27470292 [0,1,0,0,0,1|2,0,0]=4 3560 B10R1.281 NS(=O)(=O)Oc1nccs1 Amb33056444 [0,1,0,0,0,1|2,0,0]=4 3561 B10R1.281 O=S(=O)(Cl)Cc1nccs1 Amb25138189 [0,1,0,0,0,1|2,0,0]=4 3562 B10R1.281 O=S(=O)(Cl)Nc1nccs1 Amb26581115 [0,1,0,0,0,1|2,0,0]=4 3563 B10R1.281 O=S(=O)(F)Cc1nccs1 Amb33076747 [0,1,0,0,0,1|2,0,0]=4 3564 B10R1.6 C#CC(C)(C)c1nccs1 Amb33310382 [0,2,0,0,0,0|1,0,1]=4 3565 B10R1.6 C#CC(C)(O)c1nccs1 Amb30594430 [0,2,0,0,0,0|0,0,2]=4 3566 B10R1.6 C=C[C@](C)(N)c1nccs1 Amb28124851 [0,2,0,0,0,0|1,0,1]=4 3567 B10R1.6 CC(C)(C#N)c1nccs1 Amb17506061 [0,2,0,0,0,0|1,0,1]=4 3568 B10R1.6 CC(C)(C=O)c1cccs1 Amb24742612 [0,2,0,0,0,0|1,0,1]=4 3569 B10R1.6 CC(C)(C=O)c1nccs1 Amb33225738 [0,2,0,0,0,0|0,0,1]=3 3570 B10R1.6 CC(C)(CBr)c1nccs1 Amb33386811 [0,2,0,0,0,0|1,0,1]=4 3571 B10R1.6 CC(C)(CN)c1nccs1 Amb27807016 [0,2,0,0,0,0|1,0,1]=4 3572 B10R1.6 CC(C)(CO)c1nccs1 Amb33311563 [0,2,0,0,0,0|0,0,2]=4 3573 B10R1.6 CC(C)(ON)c1nccs1 Amb33311515 [0,2,0,0,0,0|0,0,2]=4 3574 B10R1.6 CC(N)(CO)c1nccs1 Amb27432306 [0,2,0,0,0,0|0,0,2]=4 3575 B10R1.6 CC(O)(C#N)c1nccs1 Amb27976412 [0,2,0,0,0,0|0,0,2]=4 3576 B10R1.6 CC(O)(CN)c1nccs1 Amb25890434 [0,2,0,0,0,0|0,0,2]=4 3577 B10R1.6 CCC(C)(N)c1nccs1 Amb18953374 [0,2,0,0,0,0|1,0,1]=4 3578 B10R1.6 CCC(C)(N)c1nccs1 Amb19148001 [0,2,0,0,0,0|1,0,1]=4 3579 B10R1.6 CCS(=O)(=O)c1cccs1 Amb27396977 [0,2,0,0,0,0|2,0,0]=4 3580 B10R1.6 CNC(C)(C)c1nccs1 Amb18281105 [0,2,0,0,0,0|1,0,1]=4 3581 B10R1.6 CNS(=O)(=O)c1cccs1 Amb1152778 [0,2,0,0,0,0|2,0,0]=4 3582 B10R1.6 NCC(F)(F)c1nccs1 Amb26042332 [0,2,0,0,0,0|1,0,1]=4 3583 B10R1.6 O=CC(F)(F)c1nccs1 Amb27808079 [0,2,0,0,0,0|1,0,1]=4 3584 B10R1.6 OCC(F)(F)c1nccs1 Amb25229923 [0,2,0,0,0,0|1,0,1]=4 3585 B10R1.9 CCC(C=O)c1cccs1 Amb17138456 [0,2,0,0,0,0|1,0,1]=4 3586 B10R1.9 CCC(CC)c1nccs1 Amb27774362 [0,2,0,0,0,0|1,0,1]=4 3587 B10R1.9 CCC(NC)c1nccs1 Amb2592280 [0,2,0,0,0,0|1,0,1]=4 3588 B10R1.9 CCC(OC)c1nccs1 Amb28050536 [0,2,0,0,0,0|0,0,2]=4 3589 B10R1.9 CCN(CC)c1nccs1 Amb434274 [0,2,0,0,0,0|2,0,0]=4 3590 B10R1.9 CN\C(=N\N)c1cccs1 Amb18787580 [0,2,0,0,0,0|2,0,0]=4 3591 B10R1.9 COC(C=O)c1nccs1 Amb28396720 [0,2,0,0,0,0|0,0,1]=3 3592 B10R1.9 COC(CN)c1nccs1 Amb8009833 [0,2,0,0,0,0|0,0,2]=4 3593 B10R1.9 C\C=C(/C#N)c1cccs1 Amb17232056 [0,2,0,0,0,0|2,0,0]=4 3594 B10R1.9 C\C=C(\C#N)c1cccs1 Amb28352326 [0,2,0,0,0,0|2,0,0]=4 3595 B10R1.9 C\C=C(\CO)c1cccs1 Amb27945321 [0,2,0,0,0,0|1,0,1]=4 3596 B10R1.9 N#C\C(=N/O)c1nccs1 Amb25146244 [0,2,0,0,0,0|0,0,2]=4 3597 B10R1.9 N#C\C(=N\O)c1nccs1 Amb27637329 [0,2,0,0,0,0|0,0,2]=4 3598 B10R1.9 NCC(CO)c1nccs1 Amb25251116 [0,2,0,0,0,0|0,0,2]=4 3599 B10R1.9 O=CC(C=O)=C1SC=CS1 Amb27793092 [0,2,0,0,0,0|1,0,1]=4 3600 B10R1.9 O=CC(C=O)c1nccs1 Amb33330494 [0,2,0,0,0,0|0,0,2]=4 3601 B10R1.11 C#CCC(=O)c1cscn1 Amb28049595 [0,2,0,0,0,0|2,0,0]=4 3602 B10R1.11 C=C(CCN)c1cccs1 Amb33360633 [0,2,0,0,0,0|2,0,0]=4 3603 B10R1.11 C=C(CCN)c1nccs1 Amb33310302 [0,2,0,0,0,0|1,0,0]=3 3604 B10R1.11 C=C=CC(=O)c1cccs1 Amb28351543 [0,2,0,0,0,0|1,0,1]=4 3605 B10R1.11 C=CCC(=O)c1ccco1 Amb10562220 [0,2,0,0,0,0|1,1,0]=4 3606 B10R1.11 C=CCC(=O)c1cccs1 Amb10574830 [0,2,0,0,0,0|1,0,0]=3 3607 B10R1.11 C=CCC(=O)c1ccns1 Amb27845184 [0,2,0,0,0,0|2,0,0]=4 3608 B10R1.11 C=CCC(=O)c1cncs1 Amb27793793 [0,2,0,0,0,0|2,0,0]=4 3609 B10R1.11 C=CCC(=O)c1cscn1 Amb27450302 [0,2,0,0,0,0|2,0,0]=4 3610 B10R1.11 C=CCC(=O)c1nccs1 Amb27228901 [0,2,0,0,0,0|0,0,0]=2 3611 B10R1.11 C=CCC(O)c1nccs1 Amb27267918 [0,2,0,0,0,0|0,0,2]=4 3612 B10R1.11 C=CCN(C)c1nccs1 Amb28381503 [0,2,0,0,0,0|2,0,0]=4 3613 B10R1.11 C=CCS(=O)c1nccs1 Amb27186410 [0,2,0,0,0,0|1,0,0]=3 3614 B10R1.11 C=CC[C@@H](N)c1nccs1 Amb28323067 [0,2,0,0,0,0|1,0,1]=4 3615 B10R1.11 CC#CC(=O)c1cccs1 Amb27615141 [0,2,0,0,0,0|1,0,0]=3 3616 B10R1.11 CC(CCN)c1nccs1 Amb18251511 [0,2,0,0,0,0|1,0,1]=4 3617 B10R1.11 CC(CON)c1nccs1 Amb33311517 [0,2,0,0,0,0|0,0,2]=4 3618 B10R1.11 CC(N=C=O)c1cccs1 Amb25780438 [0,2,0,0,0,0|1,0,1]=4 3619 B10R1.11 CC(N=C=O)c1nccs1 Amb28126725 [0,2,0,0,0,0|0,0,1]=3 3620 B10R1.11 CCCC(=O)c1ccco1 Amb4018004 [0,2,0,0,0,0|1,1,0]=4 3621 B10R1.11 CCCC(=O)c1cccs1 Amb2700563 [0,2,0,0,0,0|1,0,0]=3 3622 B10R1.11 CCCC(=O)c1ccsn1 Amb27198650 [0,2,0,0,0,0|2,0,0]=4 3623 B10R1.11 CCCC(=O)c1cscn1 Amb25731997 [0,2,0,0,0,0|2,0,0]=4 3624 B10R1.11 CCCC(=O)c1nccs1 Amb19649390 [0,2,0,0,0,0|0,0,0]=2 3625 B10R1.11 CCCC(=O)n1cccn1 Amb17789979 [0,2,0,0,0,0|2,0,0]=4 3626 B10R1.11 CCCC(Br)c1nccs1 Amb33188621 [0,2,0,0,0,0|1,0,1]=4 3627 B10R1.11 CCCC(N)c1nccs1 Amb18291451 [0,2,0,0,0,0|1,0,1]=4 3628 B10R1.11 CCCC(O)c1nccs1 Amb4314143 [0,2,0,0,0,0|0,0,2]=4 3629 B10R1.11 CCCN(C)c1nccs1 Amb28241642 [0,2,0,0,0,0|2,0,0]=4 3630 B10R1.11 CCC[C@@H](O)c1nccs1 Amb27594797 [0,2,0,0,0,0|0,0,2]=4 3631 B10R1.11 CCNC(=O)c1cscn1 Amb26961153 [0,2,0,0,0,0|2,0,0]=4 3632 B10R1.11 CCNC(=O)c1nccs1 Amb27777348 [0,2,0,0,0,0|0,0,0]=2 3633 B10R1.11 CCNC(=O)n1cccn1 Amb9828524 [0,2,0,0,0,0|2,0,0]=4 3634 B10R1.11 CCNC(C)c1nccs1 Amb18291102 [0,2,0,0,0,0|1,0,1]=4 3635 B10R1.11 CCOC(=N)c1cccs1 Amb18791658 [0,2,0,0,0,0|2,0,0]=4 3636 B10R1.11 CCOC(=N)c1cccs1 Amb20673166 [0,2,0,0,0,0|2,0,0]=4 3637 B10R1.11 CCOC(=O)c1ccco1 Amb2725474 [0,2,0,0,0,0|1,1,0]=4 3638 B10R1.11 CCOC(=O)c1cccs1 Amb3940403 [0,2,0,0,0,0|1,0,0]=3 3639 B10R1.11 CCOC(=O)c1ccon1 Amb19930075 [0,2,0,0,0,0|2,0,0]=4 3640 B10R1.11 CCOC(=O)c1ccsn1 Amb27760364 [0,2,0,0,0,0|2,0,0]=4 3641 B10R1.11 CCOC(=O)c1cncs1 Amb10071288 [0,2,0,0,0,0|2,0,0]=4 3642 B10R1.11 CCOC(=O)c1cncs1 Amb33484290 [0,2,0,0,0,0|2,0,0]=4 3643 B10R1.11 CCOC(=O)c1cocn1 Amb6822838 [0,2,0,0,0,0|2,0,0]=4 3644 B10R1.11 CCOC(=O)c1cscn1 Amb1102588 [0,2,0,0,0,0|2,0,0]=4 3645 B10R1.11 CCOC(=O)c1cscn1 Amb22000945 [0,2,0,0,0,0|2,0,0]=4 3646 B10R1.11 CCOC(=O)c1ncco1 Amb19515922 [0,2,0,0,0,0|0,1,0]=3 3647 B10R1.11 CCOC(=O)c1nccs1 Amb6297669 [0,2,0,0,0,0|0,0,0]=2 3648 B10R1.11 CCOC(=O)c1ncns1 Amb22754133 [0,2,0,0,0,0|1,0,0]=3 3649 B10R1.11 CCOC(=O)c1ncon1 Amb2691286 [0,2,0,0,0,0|2,0,0]=4 3650 B10R1.11 CCOC(=O)c1nnco1 Amb25062996 [0,2,0,0,0,0|1,1,0]=4 3651 B10R1.11 CCOC(=O)c1nncs1 Amb22498943 [0,2,0,0,0,0|1,0,0]=3 3652 B10R1.11 CN(CC#N)c1nccs1 Amb28256492 [0,2,0,0,0,0|2,0,0]=4 3653 B10R1.11 CN(CCCl)c1nccs1 Amb27448258 [0,2,0,0,0,0|2,0,0]=4 3654 B10R1.11 CN(CCF)c1nccs1 Amb28281633 [0,2,0,0,0,0|2,0,0]=4 3655 B10R1.11 CN(CCN)c1nccs1 Amb18302295 [0,2,0,0,0,0|2,0,0]=4 3656 B10R1.11 CNCC(=O)c1ccco1 Amb21862170 [0,2,0,0,0,0|1,1,0]=4 3657 B10R1.11 CNCC(=O)c1cccs1 Amb17232156 [0,2,0,0,0,0|1,0,0]=3 3658 B10R1.11 CNCC(=O)c1ccns1 Amb25248493 [0,2,0,0,0,0|2,0,0]=4 3659 B10R1.11 CNCC(=O)c1ccon1 Amb33198786 [0,2,0,0,0,0|2,0,0]=4 3660 B10R1.11 CNCC(=O)c1ccsn1 Amb25865037 [0,2,0,0,0,0|2,0,0]=4 3661 B10R1.11 CNCC(=O)c1cncs1 Amb30020578 [0,2,0,0,0,0|2,0,0]=4 3662 B10R1.11 CNCC(=O)c1cscn1 Amb25993424 [0,2,0,0,0,0|2,0,0]=4 3663 B10R1.11 CNCC(=O)c1nccs1 Amb21861800 [0,2,0,0,0,0|0,0,0]=2 3664 B10R1.11 CNCC(C)c1nccs1 Amb17232178 [0,2,0,0,0,0|1,0,1]=4 3665 B10R1.11 CNCC(O)c1nccs1 Amb24334731 [0,2,0,0,0,0|0,0,2]=4 3666 B10R1.11 CNC[C@@H](O)c1nccs1 Amb27955862 [0,2,0,0,0,0|0,0,2]=4 3667 B10R1.11 COCC(=O)c1ccco1 Amb9665979 [0,2,0,0,0,0|1,1,0]=4 3668 B10R1.11 COCC(=O)c1ccns1 Amb27783568 [0,2,0,0,0,0|2,0,0]=4 3669 B10R1.11 COCC(=O)c1nccs1 Amb19649393 [0,2,0,0,0,0|0,0,0]=2 3670 B10R1.11 COCC(Br)c1nccs1 Amb33188630 [0,2,0,0,0,0|1,0,1]=4 3671 B10R1.11 COCC(N)c1nccs1 Amb19649395 [0,2,0,0,0,0|1,0,1]=4 3672 B10R1.11 COCC(O)c1nccs1 Amb19649394 [0,2,0,0,0,0|0,0,2]=4 3673 B10R1.11 CONC(=O)c1ccon1 Amb27166360 [0,2,0,0,0,0|2,0,0]=4 3674 B10R1.11 CONC(=O)c1cscn1 Amb27878373 [0,2,0,0,0,0|2,0,0]=4 3675 B10R1.11 CO\N=C(/C)c1cccs1 Amb33512986 [0,2,0,0,0,0|1,0,1]=4 3676 B10R1.11 CO\N=C(/N)c1cccs1 Amb18224386 [0,2,0,0,0,0|2,0,0]=4 3677 B10R1.11 CO\N=C(\C)c1cccs1 Amb24719334 [0,2,0,0,0,0|1,0,1]=4 3678 B10R1.11 CSCC(=O)c1ccco1 Amb18791728 [0,2,0,0,0,0|1,1,0]=4 3679 B10R1.11 CSCC(=O)c1cccs1 Amb18180366 [0,2,0,0,0,0|1,0,0]=3 3680 B10R1.11 CSCC(=O)c1ccns1 Amb28197313 [0,2,0,0,0,0|2,0,0]=4 3681 B10R1.11 C\C(=C/CN)c1cccs1 Amb23555596 [0,2,0,0,0,0|2,0,0]=4 3682 B10R1.11 C\C(=C\C#N)c1nccs1 Amb27457041 [0,2,0,0,0,0|1,0,0]=3 3683 B10R1.11 C\C(=C\CO)c1cccs1 Amb28134112 [0,2,0,0,0,0|1,0,1]=4 3684 B10R1.11 C\C=C\C(=O)c1cncs1 Amb24646601 [0,2,0,0,0,0|2,0,0]=4 3685 B10R1.11 C\C=C\C(=O)n1cccn1 Amb27448112 [0,2,0,0,0,0|2,0,0]=4 3686 B10R1.11 N#CCC(=O)c1ccco1 Amb1154496 [0,2,0,0,0,0|1,1,0]=4 3687 B10R1.11 N#CCC(=O)c1cccs1 Amb1075350 [0,2,0,0,0,0|1,0,0]=3 3688 B10R1.11 N#CCC(=O)c1nccs1 Amb16231259 [0,2,0,0,0,0|0,0,0]=2 3689 B10R1.11 N#CCC(Br)c1nccs1 Amb33188627 [0,2,0,0,0,0|1,0,1]=4 3690 B10R1.11 N#CCC(O)c1nccs1 Amb25788514 [0,2,0,0,0,0|0,0,2]=4 3691 B10R1.11 N#CCS(=O)c1cccs1 Amb27839081 [0,2,0,0,0,0|2,0,0]=4 3692 B10R1.11 N#CC[C@H](N)c1nccs1 Amb27797410 [0,2,0,0,0,0|1,0,1]=4 3693 B10R1.11 NC(CCO)c1nccs1 Amb8010928 [0,2,0,0,0,0|1,0,1]=4 3694 B10R1.11 NCCC(=O)c1ccco1 Amb18639567 [0,2,0,0,0,0|1,1,0]=4 3695 B10R1.11 NCCC(=O)c1cccs1 Amb17194466 [0,2,0,0,0,0|1,0,0]=3 3696 B10R1.11 NCCC(=O)c1ccns1 Amb27626304 [0,2,0,0,0,0|2,0,0]=4 3697 B10R1.11 NCCC(=O)c1ccon1 Amb33198789 [0,2,0,0,0,0|2,0,0]=4 3698 B10R1.11 NCCC(=O)c1ccsn1 Amb27190462 [0,2,0,0,0,0|2,0,0]=4 3699 B10R1.11 NCCC(=O)c1cncs1 Amb18830760 [0,2,0,0,0,0|2,0,0]=4 3700 B10R1.11 NCCC(=O)c1cscn1 Amb25723119 [0,2,0,0,0,0|2,0,0]=4 3701 B10R1.11 NCCC(=O)c1nccs1 Amb33132895 [0,2,0,0,0,0|0,0,0]=2 3702 B10R1.11 NCCC(=O)c1ncns1 Amb18830621 [0,2,0,0,0,0|1,0,0]=3 3703 B10R1.11 NCCC(F)c1nccs1 Amb33313060 [0,2,0,0,0,0|1,0,1]=4 3704 B10R1.11 NCCC(O)c1nccs1 Amb27440679 [0,2,0,0,0,0|0,0,2]=4 3705 B10R1.11 NCCS(=O)c1cccs1 Amb18288870 [0,2,0,0,0,0|2,0,0]=4 3706 B10R1.11 NCC[C@@H](O)c1nccs1 Amb33311524 [0,2,0,0,0,0|0,0,2]=4 3707 B10R1.11 NCC[C@H](O)c1nccs1 Amb33311523 [0,2,0,0,0,0|0,0,2]=4 3708 B10R1.11 N[C@@H](CCO)c1nccs1 Amb28184356 [0,2,0,0,0,0|1,0,1]=4 3709 B10R1.11 N[C@H](CCO)c1nccs1 Amb25117312 [0,2,0,0,0,0|1,0,1]=4 3710 B10R1.11 O=C(CCBr)c1cccs1 Amb17437890 [0,2,0,0,0,0|1,0,0]=3 3711 B10R1.11 O=C(CCCl)C1=CC=CC1 Amb27645257 [0,2,0,0,0,0|2,0,0]=4 3712 B10R1.11 O=C(CCCl)c1ccco1 Amb17138476 [0,2,0,0,0,0|1,1,0]=4 3713 B10R1.11 O=C(CCCl)c1cccs1 Amb6306487 [0,2,0,0,0,0|1,0,0]=3 3714 B10R1.11 O=C(CCCl)c1ccon1 Amb24085898 [0,2,0,0,0,0|2,0,0]=4 3715 B10R1.11 O=C(CCO)c1cccs1 Amb18563468 [0,2,0,0,0,0|1,0,0]=3 3716 B10R1.11 O=C(CCS)c1cccs1 Amb17400372 [0,2,0,0,0,0|1,0,0]=3 3717 B10R1.11 O=C(OCF)c1ccco1 Amb24553124 [0,2,0,0,0,0|1,1,0]=4 3718 B10R1.11 O=C(\C=C\Cl)c1cccs1 Amb24478325 [0,2,0,0,0,0|1,0,1]=4 3719 B10R1.11 O=C(\C=C\[O-])c1cccs1 Amb27251932 [0,2,0,0,0,0|1,0,1]=4 3720 B10R1.11 O=C=NC(=O)c1cccs1 Amb6252636 [0,2,0,0,0,0|1,0,1]=4 3721 B10R1.11 O=CCC(=O)c1ccco1 Amb9204969 [0,2,0,0,0,0|1,1,0]=4 3722 B10R1.11 O=CCC(=O)c1cccs1 Amb9204971 [0,2,0,0,0,0|1,0,0]=3 3723 B10R1.11 O=CCC(=O)c1cncs1 Amb25147746 [0,2,0,0,0,0|2,0,0]=4 3724 B10R1.11 O=CCC(=O)c1cscn1 Amb26972671 [0,2,0,0,0,0|2,0,0]=4 3725 B10R1.11 O=CCC(=O)c1nccs1 Amb24590145 [0,2,0,0,0,0|0,0,0]=2 3726 B10R1.11 O=CNC(=O)c1cccs1 Amb5282864 [0,2,0,0,0,0|1,0,1]=4 3727 B10R1.11 O=C\C=C(/Cl)c1cccs1 Amb28076086 [0,2,0,0,0,0|2,0,0]=4 3728 B10R1.11 O=C\C=C(\Cl)c1cccs1 Amb28049394 [0,2,0,0,0,0|2,0,0]=4 3729 B10R1.11 [N-]=[N+]=CC(=O)c1cccs1 Amb27466464 [0,2,0,0,0,0|1,0,1]=4 3730 B10R1.11 [N-]=[N+]=NC(=O)c1cccs1 Amb8938202 [0,2,0,0,0,0|2,0,0]=4 3731 B10R1.14 C#CC(=O)c1cc(Br)cs1 Amb27866530 [0,2,0,0,0,0|1,0,1]=4 3732 B10R1.14 C#CC(C)c1ncc(Br)s1 Amb33434719 [0,2,0,0,0,0|1,0,1]=4 3733 B10R1.14 C=C(CBr)c1cc(Br)cs1 Amb33388320 [0,2,0,0,0,0|2,0,0]=4 3734 B10R1.14 C=C(CBr)c1cc(C)cs1 Amb33333216 [0,2,0,0,0,0|2,0,0]=4 3735 B10R1.14 C=C(CBr)c1cc(Cl)cs1 Amb33431800 [0,2,0,0,0,0|2,0,0]=4 3736 B10R1.14 C=C(CBr)c1ccc(Br)s1 Amb33008009 [0,2,0,0,0,0|2,0,0]=4 3737 B10R1.14 C=C(CBr)c1ccc(C)s1 Amb33388127 [0,2,0,0,0,0|2,0,0]=4 3738 B10R1.14 C=C(CBr)c1ccc(Cl)s1 Amb33263642 [0,2,0,0,0,0|2,0,0]=4 3739 B10R1.14 C=C(CBr)c1ncc(Br)s1 Amb33434725 [0,2,0,0,0,0|1,0,0]=3 3740 B10R1.14 C=C(CCl)c1cc(Br)cs1 Amb33388295 [0,2,0,0,0,0|2,0,0]=4 3741 B10R1.14 C=C(CCl)c1cc(Cl)cs1 Amb33058594 [0,2,0,0,0,0|2,0,0]=4 3742 B10R1.14 C=C(CCl)c1ccc(Br)s1 Amb33008012 [0,2,0,0,0,0|2,0,0]=4 3743 B10R1.14 C=C(CCl)c1ccc(C)s1 Amb33220796 [0,2,0,0,0,0|2,0,0]=4 3744 B10R1.14 C=C(CCl)c1ccc(Cl)s1 Amb25364539 [0,2,0,0,0,0|2,0,0]=4 3745 B10R1.14 C=C(CCl)c1ncc(Br)s1 Amb33434774 [0,2,0,0,0,0|1,0,0]=3 3746 B10R1.14 C=C(CN)c1cc(Br)cs1 Amb33388732 [0,2,0,0,0,0|2,0,0]=4 3747 B10R1.14 C=C(CN)c1cc(C)cs1 Amb33427138 [0,2,0,0,0,0|2,0,0]=4 3748 B10R1.14 C=C(CN)c1cc(Cl)cs1 Amb33057910 [0,2,0,0,0,0|2,0,0]=4 3749 B10R1.14 C=C(CN)c1ccc(Br)s1 Amb33007984 [0,2,0,0,0,0|2,0,0]=4 3750 B10R1.14 C=C(CN)c1ccc(C)s1 Amb33375450 [0,2,0,0,0,0|2,0,0]=4 3751 B10R1.14 C=C(CN)c1ncc(Br)s1 Amb33434746 [0,2,0,0,0,0|1,0,0]=3 3752 B10R1.14 C=CC(=O)c1cc(Br)cs1 Amb18570017 [0,2,0,0,0,0|1,0,1]=4 3753 B10R1.14 C=CC(=O)c1cc(C)cs1 Amb25059734 [0,2,0,0,0,0|1,0,1]=4 3754 B10R1.14 C=CC(=O)c1cc(Cl)cs1 Amb33057756 [0,2,0,0,0,0|1,0,1]=4 3755 B10R1.14 C=CC(=O)c1ccc(Br)s1 Amb18570012 [0,2,0,0,0,0|1,0,1]=4 3756 B10R1.14 C=CC(=O)c1ccc(C)s1 Amb27780840 [0,2,0,0,0,0|1,0,1]=4 3757 B10R1.14 C=CC(=O)c1ccc(Cl)s1 Amb18563993 [0,2,0,0,0,0|1,0,1]=4 3758 B10R1.14 C=CC(=O)c1nc(C)cs1 Amb25718452 [0,2,0,0,0,0|0,0,1]=3 3759 B10R1.14 C=CC(=O)c1ncc(Br)s1 Amb33434425 [0,2,0,0,0,0|0,0,1]=3 3760 B10R1.14 CC(C#N)c1ncc(Br)s1 Amb33434333 [0,2,0,0,0,0|1,0,1]=4 3761 B10R1.14 CC(C=O)c1cc(Br)cs1 Amb33388350 [0,2,0,0,0,0|1,0,1]=4 3762 B10R1.14 CC(C=O)c1cc(Cl)cs1 Amb33058128 [0,2,0,0,0,0|1,0,1]=4 3763 B10R1.14 CC(C=O)c1ccc(Br)s1 Amb17195324 [0,2,0,0,0,0|1,0,1]=4 3764 B10R1.14 CC(C=O)c1ccc(Cl)s1 Amb17194493 [0,2,0,0,0,0|1,0,1]=4 3765 B10R1.14 CC(C=O)c1ncc(Br)s1 Amb33434724 [0,2,0,0,0,0|0,0,1]=3 3766 B10R1.14 CC(CBr)c1ncc(Br)s1 Amb33434716 [0,2,0,0,0,0|1,0,1]=4 3767 B10R1.14 CC(CN)c1nc(O)cs1 Amb30016910 [0,2,0,0,0,0|1,0,1]=4 3768 B10R1.14 CC(CN)c1ncc(Br)s1 Amb27823385 [0,2,0,0,0,0|1,0,1]=4 3769 B10R1.14 CC(CN)c1ncc(Cl)s1 Amb27201548 [0,2,0,0,0,0|1,0,1]=4 3770 B10R1.14 CC(ON)c1ncc(Br)s1 Amb33434449 [0,2,0,0,0,0|0,0,2]=4 3771 B10R1.14 CCC(=O)C1=CC(=O)SS1 Amb27227263 [0,2,0,0,0,0|2,0,0]=4 3772 B10R1.14 CCC(=O)c1cc(Br)cs1 Amb8439409 [0,2,0,0,0,0|1,0,0]=3 3773 B10R1.14 CCC(=O)c1cc(C)cs1 Amb24614589 [0,2,0,0,0,0|1,0,0]=3 3774 B10R1.14 CCC(=O)c1cc(N)cs1 Amb18143865 [0,2,0,0,0,0|1,0,0]=3 3775 B10R1.14 CCC(=O)c1cc(N)on1 Amb25878249 [0,2,0,0,0,0|2,0,0]=4 3776 B10R1.14 CCC(=O)c1ccc(Br)s1 Amb1950418 [0,2,0,0,0,0|1,0,0]=3 3777 B10R1.14 CCC(=O)c1ccc(C)o1 Amb8514778 [0,2,0,0,0,0|1,1,0]=4 3778 B10R1.14 CCC(=O)c1ccc(C)s1 Amb6492833 [0,2,0,0,0,0|1,0,0]=3 3779 B10R1.14 CCC(=O)c1ccc(Cl)s1 Amb6492829 [0,2,0,0,0,0|1,0,0]=3 3780 B10R1.14 CCC(=O)c1ccc(F)s1 Amb27445114 [0,2,0,0,0,0|1,0,0]=3 3781 B10R1.14 CCC(=O)c1ccc(I)o1 Amb27444733 [0,2,0,0,0,0|1,1,0]=4 3782 B10R1.14 CCC(=O)c1ccc(I)s1 Amb25162794 [0,2,0,0,0,0|1,0,0]=3 3783 B10R1.14 CCC(=O)c1ccn(C)n1 Amb25209922 [0,2,0,0,0,0|2,0,0]=4 3784 B10R1.14 CCC(=O)c1cn(C)cn1 Amb27978814 [0,2,0,0,0,0|2,0,0]=4 3785 B10R1.14 CCC(=O)c1cnc(Br)s1 Amb22749411 [0,2,0,0,0,0|2,0,0]=4 3786 B10R1.14 CCC(=O)c1cnc(Cl)s1 Amb27624939 [0,2,0,0,0,0|2,0,0]=4 3787 B10R1.14 CCC(=O)c1cnc(N)s1 Amb25992525 [0,2,0,0,0,0|2,0,0]=4 3788 B10R1.14 CCC(=O)c1coc(C)n1 Amb24423885 [0,2,0,0,0,0|2,0,0]=4 3789 B10R1.14 CCC(=O)c1csc(C)n1 Amb27489311 [0,2,0,0,0,0|2,0,0]=4 3790 B10R1.14 CCC(=O)c1csc(N)n1 Amb24725271 [0,2,0,0,0,0|2,0,0]=4 3791 B10R1.14 CCC(=O)c1nc(C)cs1 Amb27948732 [0,2,0,0,0,0|0,0,0]=2 3792 B10R1.14 CCC(Br)c1nc(C)cs1 Amb33188625 [0,2,0,0,0,0|1,0,1]=4 3793 B10R1.14 CCC(C)c1nc(Br)cs1 Amb10600063 [0,2,0,0,0,0|1,0,1]=4 3794 B10R1.14 CCC(C)c1nc(C)cs1 Amb27966022 [0,2,0,0,0,0|1,0,1]=4 3795 B10R1.14 CCC(C)c1nc(O)cs1 Amb27845223 [0,2,0,0,0,0|1,0,1]=4 3796 B10R1.14 CCC(C)c1ncc(Br)s1 Amb24318785 [0,2,0,0,0,0|1,0,1]=4 3797 B10R1.14 CCC(N)c1nc(C)cs1 Amb5740499 [0,2,0,0,0,0|1,0,1]=4 3798 B10R1.14 CCC(N)c1nc(O)cs1 Amb30015234 [0,2,0,0,0,0|1,0,1]=4 3799 B10R1.14 CCC(N)c1ncc(C)s1 Amb9421703 [0,2,0,0,0,0|1,0,1]=4 3800 B10R1.14 CCC(O)c1nc(Br)cs1 Amb28455512 [0,2,0,0,0,0|0,0,2]=4 3801 B10R1.14 CCC(O)c1nc(C)cs1 Amb26074615 [0,2,0,0,0,0|0,0,2]=4 3802 B10R1.14 CCC(O)c1ncc(Cl)s1 Amb27879590 [0,2,0,0,0,0|0,0,2]=4 3803 B10R1.14 CCN(C)c1nc(Br)cs1 Amb10599618 [0,2,0,0,0,0|2,0,0]=4 3804 B10R1.14 CCN(C)c1nc(C)cs1 Amb27457205 [0,2,0,0,0,0|2,0,0]=4 3805 B10R1.14 CCN(C)c1nc(Cl)cs1 Amb27847865 [0,2,0,0,0,0|2,0,0]=4 3806 B10R1.14 CCN(C)c1nc(N)cs1 Amb20617486 [0,2,0,0,0,0|2,0,0]=4 3807 B10R1.14 CCN(C)c1ncc(Br)s1 Amb10599642 [0,2,0,0,0,0|2,0,0]=4 3808 B10R1.14 CCN(C)c1ncc(N)s1 Amb20617485 [0,2,0,0,0,0|2,0,0]=4 3809 B10R1.14 CNC(=N)c1cc(Br)cs1 Amb27839030 [0,2,0,0,0,0|2,0,0]=4 3810 B10R1.14 CNC(=N)c1ccc(Br)s1 Amb27453035 [0,2,0,0,0,0|2,0,0]=4 3811 B10R1.14 CNC(=N)c1ccc(C)s1 Amb27433132 [0,2,0,0,0,0|2,0,0]=4 3812 B10R1.14 CNC(=O)C1=NNC(=O)C1 Amb27605163 [0,2,0,0,0,0|2,0,0]=4 3813 B10R1.14 CNC(=O)c1cc(C)on1 Amb20513976 [0,2,0,0,0,0|2,0,0]=4 3814 B10R1.14 CNC(=O)c1ccc(Br)o1 Amb5677 [0,2,0,0,0,0|1,1,0]=4 3815 B10R1.14 CNC(=O)c1ccc(Br)s1 Amb8264840 [0,2,0,0,0,0|1,0,0]=3 3816 B10R1.14 CNC(=O)c1ccc(C)s1 Amb8333493 [0,2,0,0,0,0|1,0,0]=3 3817 B10R1.14 CNC(=O)c1ccc(Cl)s1 Amb20635246 [0,2,0,0,0,0|1,0,0]=3 3818 B10R1.14 CNC(=O)c1ccc(N)o1 Amb18625497 [0,2,0,0,0,0|1,1,0]=4 3819 B10R1.14 CNC(=O)c1ccn(C)n1 Amb20619587 [0,2,0,0,0,0|2,0,0]=4 3820 B10R1.14 CNC(=O)c1cn(C)cn1 Amb9677738 [0,2,0,0,0,0|2,0,0]=4 3821 B10R1.14 CNC(=O)c1cnc(C)s1 Amb13951240 [0,2,0,0,0,0|2,0,0]=4 3822 B10R1.14 CNC(=O)c1cnc(N)s1 Amb17490793 [0,2,0,0,0,0|2,0,0]=4 3823 B10R1.14 CNC(=O)c1coc(C)n1 Amb8483753 [0,2,0,0,0,0|2,0,0]=4 3824 B10R1.14 CNC(=O)c1coc(N)n1 Amb21936687 [0,2,0,0,0,0|2,0,0]=4 3825 B10R1.14 CNC(=O)c1csc(Br)n1 Amb22001436 [0,2,0,0,0,0|2,0,0]=4 3826 B10R1.14 CNC(=O)c1csc(N)n1 Amb7173179 [0,2,0,0,0,0|2,0,0]=4 3827 B10R1.14 CNC(=O)c1nc(C)ns1 Amb27970731 [0,2,0,0,0,0|1,0,0]=3 3828 B10R1.14 CNC(=O)c1nc(Cl)cs1 Amb27487302 [0,2,0,0,0,0|0,0,0]=2 3829 B10R1.14 CNC(=O)c1ncc(Br)s1 Amb25728381 [0,2,0,0,0,0|0,0,0]=2 3830 B10R1.14 CNC(=O)c1ncc(N)s1 Amb24479213 [0,2,0,0,0,0|0,0,0]=2 3831 B10R1.14 CNC(=O)c1nnc(N)s1 Amb24609760 [0,2,0,0,0,0|1,0,0]=3 3832 B10R1.14 CNC(=O)c1nnc(S)o1 Amb28049910 [0,2,0,0,0,0|1,1,0]=4 3833 B10R1.14 CNC(=O)n1cc(O)cn1 Amb32413487 [0,2,0,0,0,0|2,0,0]=4 3834 B10R1.14 CNC(=S)c1ccc(C)s1 Amb27794533 [0,2,0,0,0,0|1,1,0]=4 3835 B10R1.14 CNC(C)c1nc(C)cs1 Amb3788155 [0,2,0,0,0,0|1,0,1]=4 3836 B10R1.14 CNC(C)c1ncc(C)s1 Amb19648757 [0,2,0,0,0,0|1,0,1]=4 3837 B10R1.14 COC(=N)c1ccc(Br)s1 Amb27198544 [0,2,0,0,0,0|2,0,0]=4 3838 B10R1.14 COC(=N)c1ccc(Cl)s1 Amb18180549 [0,2,0,0,0,0|2,0,0]=4 3839 B10R1.14 COC(=N)c1nc(C)cs1 Amb27245074 [0,2,0,0,0,0|1,0,0]=3 3840 B10R1.14 COC(=N)c1ncc(Cl)s1 Amb27594120 [0,2,0,0,0,0|1,0,0]=3 3841 B10R1.14 COC(=O)C1=NNC(=O)C1 Amb2496134 [0,2,0,0,0,0|2,0,0]=4 3842 B10R1.14 COC(=O)C1=NNC(=O)N1 Amb19516890 [0,2,0,0,0,0|2,0,0]=4 3843 B10R1.14 COC(=O)C1=NOC(=O)C1 Amb22498282 [0,2,0,0,0,0|2,0,0]=4 3844 B10R1.14 COC(=O)c1cc(Br)co1 Amb19957913 [0,2,0,0,0,0|1,1,0]=4 3845 B10R1.14 COC(=O)c1cc(Br)cs1 Amb21962120 [0,2,0,0,0,0|1,0,0]=3 3846 B10R1.14 COC(=O)c1cc(C)cs1 Amb2691599 [0,2,0,0,0,0|1,0,0]=3 3847 B10R1.14 COC(=O)c1cc(C)ns1 Amb28344663 [0,2,0,0,0,0|2,0,0]=4 3848 B10R1.14 COC(=O)c1cc(C)on1 Amb6356377 [0,2,0,0,0,0|2,0,0]=4 3849 B10R1.14 COC(=O)c1cc(Cl)co1 Amb23537732 [0,2,0,0,0,0|1,1,0]=4 3850 B10R1.14 COC(=O)c1cc(Cl)cs1 Amb21857119 [0,2,0,0,0,0|1,0,0]=3 3851 B10R1.14 COC(=O)c1cc(F)cs1 Amb22490427 [0,2,0,0,0,0|1,0,0]=3 3852 B10R1.14 COC(=O)c1cc(I)on1 Amb33098558 [0,2,0,0,0,0|2,0,0]=4 3853 B10R1.14 COC(=O)c1cc(I)sn1 Amb32685271 [0,2,0,0,0,0|2,0,0]=4 3854 B10R1.14 COC(=O)c1cc(N)cs1 Amb18644914 [0,2,0,0,0,0|1,0,0]=3 3855 B10R1.14 COC(=O)c1cc(N)on1 Amb22498456 [0,2,0,0,0,0|2,0,0]=4 3856 B10R1.14 COC(=O)c1cc(O)cs1 Amb23509310 [0,2,0,0,0,0|1,0,0]=3 3857 B10R1.14 COC(=O)c1cc(O)ns1 Amb17617483 [0,2,0,0,0,0|2,0,0]=4 3858 B10R1.14 COC(=O)c1ccc(Br)o1 Amb6346290 [0,2,0,0,0,0|1,1,0]=4 3859 B10R1.14 COC(=O)c1ccc(Br)s1 Amb33531511 [0,2,0,0,0,0|1,0,0]=3 3860 B10R1.14 COC(=O)c1ccc(C)o1 Amb843218 [0,2,0,0,0,0|1,1,0]=4 3861 B10R1.14 COC(=O)c1ccc(C)s1 Amb9241848 [0,2,0,0,0,0|1,0,0]=3 3862 B10R1.14 COC(=O)c1ccc(Cl)o1 Amb4012098 [0,2,0,0,0,0|1,1,0]=4 3863 B10R1.14 COC(=O)c1ccc(Cl)s1 Amb33529812 [0,2,0,0,0,0|1,0,0]=3 3864 B10R1.14 COC(=O)c1ccc(F)o1 Amb25882154 [0,2,0,0,0,0|1,1,0]=4 3865 B10R1.14 COC(=O)c1ccc(F)s1 Amb24269173 [0,2,0,0,0,0|1,0,0]=3 3866 B10R1.14 COC(=O)c1ccc(I)o1 Amb24524315 [0,2,0,0,0,0|1,1,0]=4 3867 B10R1.14 COC(=O)c1ccc(I)s1 Amb22727984 [0,2,0,0,0,0|1,0,0]=3 3868 B10R1.14 COC(=O)c1ccc(N)o1 Amb1131133 [0,2,0,0,0,0|1,1,0]=4 3869 B10R1.14 COC(=O)c1ccc(N)s1 Amb1092582 [0,2,0,0,0,0|1,0,0]=3 3870 B10R1.14 COC(=O)c1ccc(N)s1 Amb7067178 [0,2,0,0,0,0|1,0,0]=3 3871 B10R1.14 COC(=O)c1ccc(O)o1 Amb24642814 [0,2,0,0,0,0|1,1,0]=4 3872 B10R1.14 COC(=O)c1ccc(O)s1 Amb24518783 [0,2,0,0,0,0|1,0,0]=3 3873 B10R1.14 COC(=O)c1ccc(S)s1 Amb26887469 [0,2,0,0,0,0|1,0,0]=3 3874 B10R1.14 COC(=O)c1ccn(C)n1 Amb1946067 [0,2,0,0,0,0|2,0,0]=4 3875 B10R1.14 COC(=O)c1ccn(N)n1 Amb28283832 [0,2,0,0,0,0|2,0,0]=4 3876 B10R1.14 COC(=O)c1cn(C)cn1 Amb2723071 [0,2,0,0,0,0|2,0,0]=4 3877 B10R1.14 COC(=O)c1cnc(Br)s1 Amb2455725 [0,2,0,0,0,0|2,0,0]=4 3878 B10R1.14 COC(=O)c1cnc(C)s1 Amb13951757 [0,2,0,0,0,0|2,0,0]=4 3879 B10R1.14 COC(=O)c1cnc(Cl)s1 Amb2455950 [0,2,0,0,0,0|2,0,0]=4 3880 B10R1.14 COC(=O)c1cnc(I)s1 Amb27867379 [0,2,0,0,0,0|2,0,0]=4 3881 B10R1.14 COC(=O)c1cnc(N)s1 Amb1156679 [0,2,0,0,0,0|2,0,0]=4 3882 B10R1.14 COC(=O)c1cnc(O)s1 Amb24329330 [0,2,0,0,0,0|2,0,0]=4 3883 B10R1.14 COC(=O)c1cnc(S)s1 Amb28203005 [0,2,0,0,0,0|2,0,0]=4 3884 B10R1.14 COC(=O)c1coc(Br)n1 Amb10067558 [0,2,0,0,0,0|2,0,0]=4 3885 B10R1.14 COC(=O)c1coc(C)n1 Amb6307240 [0,2,0,0,0,0|2,0,0]=4 3886 B10R1.14 COC(=O)c1coc(Cl)n1 Amb2455956 [0,2,0,0,0,0|2,0,0]=4 3887 B10R1.14 COC(=O)c1coc(I)n1 Amb23412127 [0,2,0,0,0,0|2,0,0]=4 3888 B10R1.14 COC(=O)c1coc(N)n1 Amb10067339 [0,2,0,0,0,0|2,0,0]=4 3889 B10R1.14 COC(=O)c1csc(Br)n1 Amb2455724 [0,2,0,0,0,0|2,0,0]=4 3890 B10R1.14 COC(=O)c1csc(C)n1 Amb10067299 [0,2,0,0,0,0|2,0,0]=4 3891 B10R1.14 COC(=O)c1csc(Cl)n1 Amb10067341 [0,2,0,0,0,0|2,0,0]=4 3892 B10R1.14 COC(=O)c1csc(F)n1 Amb25889985 [0,2,0,0,0,0|2,0,0]=4 3893 B10R1.14 COC(=O)c1csc(I)n1 Amb25351746 [0,2,0,0,0,0|2,0,0]=4 3894 B10R1.14 COC(=O)c1csc(N)n1 Amb4460545 [0,2,0,0,0,0|2,0,0]=4 3895 B10R1.14 COC(=O)c1csc(O)n1 Amb27985486 [0,2,0,0,0,0|2,0,0]=4 3896 B10R1.14 COC(=O)c1csc(S)n1 Amb27424799 [0,2,0,0,0,0|2,0,0]=4 3897 B10R1.14 COC(=O)c1nc(Br)co1 Amb22899156 [0,2,0,0,0,0|0,1,0]=3 3898 B10R1.14 COC(=O)c1nc(Br)cs1 Amb13884116 [0,2,0,0,0,0|0,0,0]=2 3899 B10R1.14 COC(=O)c1nc(C)cs1 Amb5759011 [0,2,0,0,0,0|0,0,0]=2 3900 B10R1.14 COC(=O)c1nc(C)no1 Amb33715387 [0,2,0,0,0,0|1,1,0]=4 3901 B10R1.14 COC(=O)c1nc(C)ns1 Amb22886643 [0,2,0,0,0,0|1,0,0]=3 3902 B10R1.14 COC(=O)c1nc(Cl)no1 Amb27211176 [0,2,0,0,0,0|1,1,0]=4 3903 B10R1.14 COC(=O)c1nc(F)cs1 Amb27193244 [0,2,0,0,0,0|0,0,0]=2 3904 B10R1.14 COC(=O)c1ncc(Br)s1 Amb19889096 [0,2,0,0,0,0|0,0,0]=2 3905 B10R1.14 COC(=O)c1ncc(C)o1 Amb22496621 [0,2,0,0,0,0|0,1,0]=3 3906 B10R1.14 COC(=O)c1ncc(C)s1 Amb8438908 [0,2,0,0,0,0|0,0,0]=2 3907 B10R1.14 COC(=O)c1ncc(Cl)s1 Amb21962481 [0,2,0,0,0,0|0,0,0]=2 3908 B10R1.14 COC(=O)c1ncc(F)s1 Amb27965611 [0,2,0,0,0,0|0,0,0]=2 3909 B10R1.14 COC(=O)c1ncc(I)s1 Amb27203486 [0,2,0,0,0,0|0,0,0]=2 3910 B10R1.14 COC(=O)c1ncc(N)s1 Amb26926603 [0,2,0,0,0,0|0,0,0]=2 3911 B10R1.14 COC(=O)c1ncn(C)n1 Amb19957941 [0,2,0,0,0,0|2,0,0]=4 3912 B10R1.14 COC(=O)c1nnc(Br)s1 Amb23402883 [0,2,0,0,0,0|1,0,0]=3 3913 B10R1.14 COC(=O)c1nnc(C)o1 Amb21963513 [0,2,0,0,0,0|1,1,0]=4 3914 B10R1.14 COC(=O)c1nnc(N)o1 Amb20248786 [0,2,0,0,0,0|1,1,0]=4 3915 B10R1.14 COC(=O)c1nnc(N)s1 Amb22490524 [0,2,0,0,0,0|1,0,0]=3 3916 B10R1.14 COC(=O)c1nsc(Br)n1 Amb33744029 [0,2,0,0,0,0|2,0,0]=4 3917 B10R1.14 COC(=O)c1nsc(Cl)n1 Amb33482990 [0,2,0,0,0,0|2,0,0]=4 3918 B10R1.14 COC(=O)c1nsc(N)n1 Amb22395025 [0,2,0,0,0,0|2,0,0]=4 3919 B10R1.14 COC(=O)n1cc(O)cn1 Amb32413887 [0,2,0,0,0,0|2,0,0]=4 3920 B10R1.14 COC(=O)n1ccc(C)n1 Amb17778926 [0,2,0,0,0,0|2,0,0]=4 3921 B10R1.14 CON(C)c1ncc(Cl)s1 Amb27397460 [0,2,0,0,0,0|1,0,1]=4 3922 B10R1.14 C\C(=N/N)c1nc(C)cs1 Amb27595349 [0,2,0,0,0,0|1,0,0]=3 3923 B10R1.14 C\C(=N/O)c1ccc(F)s1 Amb32651699 [0,2,0,0,0,0|1,0,1]=4 3924 B10R1.14 C\C(=N\N)c1ccc(Cl)s1 Amb27486002 [0,2,0,0,0,0|2,0,0]=4 3925 B10R1.14 C\C(=N\O)c1ccc(C)s1 Amb4013509 [0,2,0,0,0,0|1,0,1]=4 3926 B10R1.14 C\C(=N\O)c1ccc(Cl)s1 Amb27436483 [0,2,0,0,0,0|1,0,1]=4 3927 B10R1.14 C\C(=N\O)c1ccc(F)s1 Amb27185888 [0,2,0,0,0,0|1,0,1]=4 3928 B10R1.14 Cc1cc(C(=O)CBr)no1 Amb20620531 [0,2,0,0,0,0|2,0,0]=4 3929 B10R1.14 Cc1cc(C(=O)CBr)sn1 Amb28348469 [0,2,0,0,0,0|2,0,0]=4 3930 B10R1.14 Cc1cc(C(=O)CCl)no1 Amb22395331 [0,2,0,0,0,0|2,0,0]=4 3931 B10R1.14 Cc1cc(C(=O)CN)no1 Amb18202899 [0,2,0,0,0,0|2,0,0]=4 3932 B10R1.14 Cc1cc(C(=O)CN)sn1 Amb27162874 [0,2,0,0,0,0|2,0,0]=4 3933 B10R1.14 Cc1ccc(C(=O)CBr)o1 Amb19516417 [0,2,0,0,0,0|1,1,0]=4 3934 B10R1.14 Cc1ccc(C(=O)CBr)s1 Amb33528811 [0,2,0,0,0,0|1,0,0]=3 3935 B10R1.14 Cc1ccc(C(=O)CCl)o1 Amb9870401 [0,2,0,0,0,0|1,1,0]=4 3936 B10R1.14 Cc1ccc(C(=O)CCl)s1 Amb433074 [0,2,0,0,0,0|1,0,0]=3 3937 B10R1.14 Cc1ccc(C(=O)CN)o1 Amb18832120 [0,2,0,0,0,0|1,1,0]=4 3938 B10R1.14 Cc1ccc(C(=O)CN)s1 Amb18644749 [0,2,0,0,0,0|1,0,0]=3 3939 B10R1.14 Cc1ccc(C(=O)CO)o1 Amb26627260 [0,2,0,0,0,0|1,1,0]=4 3940 B10R1.14 Cc1ccc(C(=O)CO)s1 Amb5638998 [0,2,0,0,0,0|1,0,0]=3 3941 B10R1.14 Cc1ccc(C(=O)NN)s1 Amb6537515 [0,2,0,0,0,0|2,0,0]=4 3942 B10R1.14 Cc1ccc(C(=O)NO)s1 Amb6271284 [0,2,0,0,0,0|2,0,0]=4 3943 B10R1.14 Cc1ccc(C(C)C=O)s1 Amb27614857 [0,2,0,0,0,0|1,0,1]=4 3944 B10R1.14 Cc1ccc([C@@H](C)C=O)s1 Amb28201122 [0,2,0,0,0,0|1,0,1]=4 3945 B10R1.14 Cc1ccn(C(=O)CCl)n1 Amb25992662 [0,2,0,0,0,0|2,0,0]=4 3946 B10R1.14 Cc1cnc(C(=O)CBr)o1 Amb27986267 [0,2,0,0,0,0|0,1,0]=3 3947 B10R1.14 Cc1cnc(C(=O)NN)s1 Amb26612504 [0,2,0,0,0,0|1,0,0]=3 3948 B10R1.14 Cc1cnc(C(C)CN)s1 Amb5754157 [0,2,0,0,0,0|1,0,1]=4 3949 B10R1.14 Cc1cnc(C(O)CN)s1 Amb28067199 [0,2,0,0,0,0|0,0,2]=4 3950 B10R1.14 Cc1cnc(C(O)CO)s1 Amb28138113 [0,2,0,0,0,0|0,0,2]=4 3951 B10R1.14 Cc1cnc(\C(N)=N\N)s1 Amb27423144 [0,2,0,0,0,0|2,0,0]=4 3952 B10R1.14 Cc1cnc(\C(N)=N\O)s1 Amb27423143 [0,2,0,0,0,0|1,0,1]=4 3953 B10R1.14 Cc1coc(C(=O)CN)c1 Amb18832119 [0,2,0,0,0,0|1,1,0]=4 3954 B10R1.14 Cc1coc(C(=O)NN)n1 Amb27642710 [0,2,0,0,0,0|1,1,0]=4 3955 B10R1.14 Cc1csc(C(=O)CBr)n1 Amb27667974 [0,2,0,0,0,0|0,0,0]=2 3956 B10R1.14 Cc1csc(C(=O)CCl)c1 Amb22395270 [0,2,0,0,0,0|1,0,0]=3 3957 B10R1.14 Cc1csc(C(=O)CN)c1 Amb18200378 [0,2,0,0,0,0|1,0,0]=3 3958 B10R1.14 Cc1csc(C(=O)CN)n1 Amb27851818 [0,2,0,0,0,0|0,0,0]=2 3959 B10R1.14 Cc1csc(C(=O)NN)c1 Amb2738050 [0,2,0,0,0,0|2,0,0]=4 3960 B10R1.14 Cc1csc(C(=O)NO)c1 Amb27185760 [0,2,0,0,0,0|2,0,0]=4 3961 B10R1.14 Cc1csc(C(C)C=O)c1 Amb33427148 [0,2,0,0,0,0|1,0,1]=4 3962 B10R1.14 Cc1csc(C(C)CN)n1 Amb5740845 [0,2,0,0,0,0|1,0,1]=4 3963 B10R1.14 Cc1csc(C(N)CS)n1 Amb27649368 [0,2,0,0,0,0|1,0,1]=4 3964 B10R1.14 Cc1csc(C(O)CN)n1 Amb8009870 [0,2,0,0,0,0|0,0,2]=4 3965 B10R1.14 Cc1csc([C@@H](N)CO)n1 Amb27792167 [0,2,0,0,0,0|1,0,1]=4 3966 B10R1.14 Cc1csc([C@@H](N)CS)n1 Amb28280951 [0,2,0,0,0,0|1,0,1]=4 3967 B10R1.14 Cc1csc([C@@H](O)CN)n1 Amb27660792 [0,2,0,0,0,0|0,0,2]=4 3968 B10R1.14 Cc1csc([C@H](O)CN)n1 Amb32942013 [0,2,0,0,0,0|0,0,2]=4 3969 B10R1.14 Cc1csc(\C(N)=N\N)n1 Amb27197109 [0,2,0,0,0,0|2,0,0]=4 3970 B10R1.14 Cc1csc(\C(N)=N\O)n1 Amb27600677 [0,2,0,0,0,0|1,0,1]=4 3971 B10R1.14 Cc1nc(C(=O)CBr)cs1 Amb24106263 [0,2,0,0,0,0|2,0,0]=4 3972 B10R1.14 Cc1nc(C(=O)CCl)cs1 Amb17506260 [0,2,0,0,0,0|2,0,0]=4 3973 B10R1.14 Cc1nc(C(=O)CN)cs1 Amb18830756 [0,2,0,0,0,0|2,0,0]=4 3974 B10R1.14 Cc1nc(C(=O)CN)cs1 Amb33299320 [0,2,0,0,0,0|2,0,0]=4 3975 B10R1.14 Cc1ncc(C(=O)CBr)s1 Amb27598847 [0,2,0,0,0,0|2,0,0]=4 3976 B10R1.14 Cc1ncc(C(=O)CCl)s1 Amb27980750 [0,2,0,0,0,0|2,0,0]=4 3977 B10R1.14 Cc1ncc(C(=O)CN)s1 Amb18830754 [0,2,0,0,0,0|2,0,0]=4 3978 B10R1.14 Cc1nsc(C(=O)NN)n1 Amb22395195 [0,2,0,0,0,0|2,0,0]=4 3979 B10R1.14 Cn1ccc(C(=O)CCl)n1 Amb25905103 [0,2,0,0,0,0|2,0,0]=4 3980 B10R1.14 Cn1ccc(C(=O)CN)n1 Amb18832034 [0,2,0,0,0,0|2,0,0]=4 3981 B10R1.14 Cn1cnc(C(=O)CBr)c1 Amb24659148 [0,2,0,0,0,0|2,0,0]=4 3982 B10R1.14 Cn1cnc(C(=O)CBr)c1 Amb33733826 [0,2,0,0,0,0|2,0,0]=4 3983 B10R1.14 Cn1cnc(C(=O)CCl)c1 Amb24480838 [0,2,0,0,0,0|2,0,0]=4 3984 B10R1.14 Cn1cnc(C(=O)CN)c1 Amb26400477 [0,2,0,0,0,0|2,0,0]=4 3985 B10R1.14 Cn1cnc(C(=O)CN)n1 Amb33307762 [0,2,0,0,0,0|2,0,0]=4 3986 B10R1.14 NC(CO)c1ncc(Br)s1 Amb33434392 [0,2,0,0,0,0|1,0,1]=4 3987 B10R1.14 NC(CO)c1ncc(I)s1 Amb27874161 [0,2,0,0,0,0|1,0,1]=4 3988 B10R1.14 NCC(=O)c1cc(Br)co1 Amb33332863 [0,2,0,0,0,0|1,1,0]=4 3989 B10R1.14 NCC(=O)c1cc(Br)cs1 Amb18570715 [0,2,0,0,0,0|1,0,0]=3 3990 B10R1.14 NCC(=O)c1cc(Cl)cs1 Amb18191154 [0,2,0,0,0,0|1,0,0]=3 3991 B10R1.14 NCC(=O)c1ccc(Br)o1 Amb26486128 [0,2,0,0,0,0|1,1,0]=4 3992 B10R1.14 NCC(=O)c1ccc(Br)s1 Amb17195356 [0,2,0,0,0,0|1,0,0]=3 3993 B10R1.14 NCC(=O)c1ccc(Cl)o1 Amb28042078 [0,2,0,0,0,0|1,1,0]=4 3994 B10R1.14 NCC(=O)c1ccc(Cl)s1 Amb17194497 [0,2,0,0,0,0|1,0,0]=3 3995 B10R1.14 NCC(=O)c1ccc(Cl)s1 Amb32671393 [0,2,0,0,0,0|1,0,0]=3 3996 B10R1.14 NCC(=O)c1ccc(I)s1 Amb27423599 [0,2,0,0,0,0|1,0,0]=3 3997 B10R1.14 NCC(=O)c1cnc(Cl)s1 Amb33059189 [0,2,0,0,0,0|2,0,0]=4 3998 B10R1.14 NCC(=O)c1coc(Cl)n1 Amb27864518 [0,2,0,0,0,0|2,0,0]=4 3999 B10R1.14 NCC(=O)c1csc(Br)n1 Amb33334922 [0,2,0,0,0,0|2,0,0]=4 4000 B10R1.14 NCC(=O)c1ncc(Br)s1 Amb33434344 [0,2,0,0,0,0|0,0,0]=2 4001 B10R1.14 NCC(=O)n1cc(Br)cn1 Amb18783685 [0,2,0,0,0,0|2,0,0]=4 4002 B10R1.14 NCC(F)c1ncc(Br)s1 Amb33263678 [0,2,0,0,0,0|1,0,1]=4 4003 B10R1.14 NCC(O)c1nc(Br)cs1 Amb27960193 [0,2,0,0,0,0|0,0,2]=4 4004 B10R1.14 NCC(O)c1ncc(Br)s1 Amb33435430 [0,2,0,0,0,0|0,0,2]=4 4005 B10R1.14 NC[C@@H](O)c1ncc(Br)s1 Amb33434454 [0,2,0,0,0,0|0,0,2]=4 4006 B10R1.14 NC[C@H](O)c1ncc(Br)s1 Amb33434452 [0,2,0,0,0,0|0,0,2]=4 4007 B10R1.14 NNC(=O)C1=NNC(=S)S1 Amb28342483 [0,2,0,0,0,0|2,0,0]=4 4008 B10R1.14 NNC(=O)c1cc(Br)cs1 Amb1935126 [0,2,0,0,0,0|2,0,0]=4 4009 B10R1.14 NNC(=O)c1cc(Cl)cs1 Amb23441689 [0,2,0,0,0,0|2,0,0]=4 4010 B10R1.14 NNC(=O)c1ccc(Br)s1 Amb6544983 [0,2,0,0,0,0|2,0,0]=4 4011 B10R1.14 NNC(=O)c1ccc(Cl)s1 Amb6462680 [0,2,0,0,0,0|2,0,0]=4 4012 B10R1.14 NNC(=O)c1ccc(F)s1 Amb24269163 [0,2,0,0,0,0|2,0,0]=4 4013 B10R1.14 NNC(=O)c1ncc(I)s1 Amb27494160 [0,2,0,0,0,0|1,0,0]=3 4014 B10R1.14 N[C@@H](CO)c1ncc(Br)s1 Amb33434458 [0,2,0,0,0,0|1,0,1]=4 4015 B10R1.14 N[C@H](CO)c1ncc(Br)s1 Amb33434456 [0,2,0,0,0,0|1,0,1]=4 4016 B10R1.14 N\N=C(\N)c1ncc(Cl)s1 Amb28401211 [0,2,0,0,0,0|2,0,0]=4 4017 B10R1.14 N\N=C(\N)c1ncc(I)s1 Amb27390604 [0,2,0,0,0,0|2,0,0]=4 4018 B10R1.14 Nc1ccn(C(=O)CCl)n1 Amb24433316 [0,2,0,0,0,0|2,0,0]=4 4019 B10R1.14 Nc1nc(C(=O)CBr)cs1 Amb27605405 [0,2,0,0,0,0|2,0,0]=4 4020 B10R1.14 Nc1nc(C(=O)CBr)no1 Amb24674673 [0,2,0,0,0,0|2,0,0]=4 4021 B10R1.14 Nc1nc(C(=O)CCl)cs1 Amb17506262 [0,2,0,0,0,0|2,0,0]=4 4022 B10R1.14 Nc1nc(C(=O)CCl)cs1 Amb32718706 [0,2,0,0,0,0|2,0,0]=4 4023 B10R1.14 Nc1nc(C(=O)CO)cs1 Amb27455695 [0,2,0,0,0,0|2,0,0]=4 4024 B10R1.14 Nc1ncc(C(=O)CBr)s1 Amb27770555 [0,2,0,0,0,0|2,0,0]=4 4025 B10R1.14 Nc1ncc(C(=O)CCl)s1 Amb26863777 [0,2,0,0,0,0|2,0,0]=4 4026 B10R1.14 O=C(CBr)c1ccc(Br)o1 Amb22275742 [0,2,0,0,0,0|1,1,0]=4 4027 B10R1.14 O=C(CBr)c1ccc(Br)s1 Amb1153103 [0,2,0,0,0,0|1,0,0]=3 4028 B10R1.14 O=C(CBr)c1ccc(Cl)s1 Amb1103631 [0,2,0,0,0,0|1,0,0]=3 4029 B10R1.14 O=C(CBr)c1ccc(F)s1 Amb26394463 [0,2,0,0,0,0|1,0,0]=3 4030 B10R1.14 O=C(CBr)c1ccc(I)s1 Amb27837834 [0,2,0,0,0,0|1,0,0]=3 4031 B10R1.14 O=C(CBr)c1cnc(Br)s1 Amb35752384 [0,2,0,0,0,0|2,0,0]=4 4032 B10R1.14 O=C(CBr)c1csc(Br)n1 Amb28049366 [0,2,0,0,0,0|2,0,0]=4 4033 B10R1.14 O=C(CBr)c1nc(Br)cs1 Amb27459591 [0,2,0,0,0,0|0,0,0]=2 4034 B10R1.14 O=C(CBr)c1ncc(Br)s1 Amb27424860 [0,2,0,0,0,0|0,0,0]=2 4035 B10R1.14 O=C(CBr)c1ncc(I)s1 Amb28344116 [0,2,0,0,0,0|0,0,0]=2 4036 B10R1.14 O=C(CCl)c1cc(Br)co1 Amb33431969 [0,2,0,0,0,0|1,1,0]=4 4037 B10R1.14 O=C(CCl)c1cc(Br)cs1 Amb18071480 [0,2,0,0,0,0|1,0,0]=3 4038 B10R1.14 O=C(CCl)c1cc(Cl)cs1 Amb33058540 [0,2,0,0,0,0|1,0,0]=3 4039 B10R1.14 O=C(CCl)c1ccc(Br)o1 Amb22395315 [0,2,0,0,0,0|1,1,0]=4 4040 B10R1.14 O=C(CCl)c1ccc(Br)s1 Amb2685509 [0,2,0,0,0,0|1,0,0]=3 4041 B10R1.14 O=C(CCl)c1ccc(Cl)o1 Amb26945814 [0,2,0,0,0,0|1,1,0]=4 4042 B10R1.14 O=C(CCl)c1ccc(Cl)s1 Amb7766107 [0,2,0,0,0,0|1,0,0]=3 4043 B10R1.14 O=C(CCl)c1cnc(=O)n1 Amb16244949 [0,2,0,0,0,0|2,0,0]=4 4044 B10R1.14 O=C(CCl)c1cnc(Cl)s1 Amb26022871 [0,2,0,0,0,0|2,0,0]=4 4045 B10R1.14 O=C(CCl)c1csc(Br)n1 Amb33335856 [0,2,0,0,0,0|2,0,0]=4 4046 B10R1.14 O=C(CCl)c1csc(O)n1 Amb35719120 [0,2,0,0,0,0|2,0,0]=4 4047 B10R1.14 O=C(CCl)c1ncc(Br)s1 Amb26963052 [0,2,0,0,0,0|0,0,0]=2 4048 B10R1.14 O=C(CCl)n1cc(Br)cn1 Amb1948603 [0,2,0,0,0,0|2,0,0]=4 4049 B10R1.14 O=C(CCl)n1cc(Cl)cn1 Amb17801215 [0,2,0,0,0,0|2,0,0]=4 4050 B10R1.14 O=C(CO)c1cc(Br)cs1 Amb18570787 [0,2,0,0,0,0|1,0,0]=3 4051 B10R1.14 O=C(CO)c1ccc(Br)s1 Amb27617061 [0,2,0,0,0,0|1,0,0]=3 4052 B10R1.14 O=C(CS)c1ccc(Br)s1 Amb17409468 [0,2,0,0,0,0|1,0,0]=3 4053 B10R1.14 O=C(CS)c1ccc(Cl)s1 Amb17401696 [0,2,0,0,0,0|1,0,0]=3 4054 B10R1.14 O=C(NO)c1cc(O)cs1 Amb27762310 [0,2,0,0,0,0|2,0,0]=4 4055 B10R1.14 O=C(NO)c1ccc(Br)s1 Amb2330556 [0,2,0,0,0,0|2,0,0]=4 4056 B10R1.14 O=C(NO)c1nc(Cl)cs1 Amb28315979 [0,2,0,0,0,0|1,0,0]=3 4057 B10R1.14 O=CC(=O)c1cc(Br)cs1 Amb24645119 [0,2,0,0,0,0|1,0,1]=4 4058 B10R1.14 O=CC(=O)c1ccc(Br)s1 Amb10067950 [0,2,0,0,0,0|1,0,1]=4 4059 B10R1.14 O=CC(=O)c1ccc(Br)s1 Amb20671216 [0,2,0,0,0,0|1,0,1]=4 4060 B10R1.14 OC(CBr)c1ncc(Br)s1 Amb33434733 [0,2,0,0,0,0|0,0,2]=4 4061 B10R1.14 OC(CCl)c1ncc(Br)s1 Amb33434731 [0,2,0,0,0,0|0,0,2]=4 4062 B10R1.14 OC(CF)c1ncc(Br)s1 Amb33434736 [0,2,0,0,0,0|0,0,2]=4 4063 B10R1.14 OCC(O)c1ncc(Br)s1 Amb33435946 [0,2,0,0,0,0|0,0,2]=4 4064 B10R1.14 OCC(O)c1ncc(I)s1 Amb27975588 [0,2,0,0,0,0|0,0,2]=4 4065 B10R1.149 C#CC(=O)c1sccc1C Amb27945524 [0,2,0,0,0,0|1,0,1]=4 4066 B10R1.149 C=C(CBr)c1nccn1C Amb33332949 [0,2,0,0,0,0|2,0,0]=4 4067 B10R1.149 C=C(CBr)c1sccc1Br Amb33387858 [0,2,0,0,0,0|2,0,0]=4 4068 B10R1.149 C=C(CBr)c1sccc1C Amb33335010 [0,2,0,0,0,0|2,0,0]=4 4069 B10R1.149 C=C(CBr)c1sccc1Cl Amb33335946 [0,2,0,0,0,0|2,0,0]=4 4070 B10R1.149 C=C(CCl)c1sccc1Br Amb33387646 [0,2,0,0,0,0|2,0,0]=4 4071 B10R1.149 C=C(CCl)c1sccc1C Amb33259520 [0,2,0,0,0,0|2,0,0]=4 4072 B10R1.149 C=C(CCl)c1sccc1Cl Amb33258016 [0,2,0,0,0,0|2,0,0]=4 4073 B10R1.149 C=C(CN)c1nccn1C Amb33427264 [0,2,0,0,0,0|2,0,0]=4 4074 B10R1.149 C=C(CN)c1sccc1Br Amb33387619 [0,2,0,0,0,0|2,0,0]=4 4075 B10R1.149 C=C(CN)c1sccc1C Amb33202953 [0,2,0,0,0,0|2,0,0]=4 4076 B10R1.149 C=C(CN)c1sccc1Cl Amb33257993 [0,2,0,0,0,0|2,0,0]=4 4077 B10R1.149 C=CC(=O)c1nccn1C Amb25266864 [0,2,0,0,0,0|1,0,1]=4 4078 B10R1.149 C=CC(=O)c1sccc1Br Amb25169346 [0,2,0,0,0,0|1,0,1]=4 4079 B10R1.149 C=CC(=O)c1sccc1C Amb25097253 [0,2,0,0,0,0|1,0,1]=4 4080 B10R1.149 C=CC(=O)c1sccc1Cl Amb27829277 [0,2,0,0,0,0|1,0,1]=4 4081 B10R1.149 CC(C=O)c1nccn1C Amb33427276 [0,2,0,0,0,0|1,0,1]=4 4082 B10R1.149 CC(C=O)c1sccc1Br Amb33387595 [0,2,0,0,0,0|1,0,1]=4 4083 B10R1.149 CC(C=O)c1sccc1Cl Amb33257983 [0,2,0,0,0,0|1,0,1]=4 4084 B10R1.149 CCC(=O)c1cccn1C Amb17593480 [0,2,0,0,0,0|1,0,1]=4 4085 B10R1.149 CCC(=O)c1nccn1C Amb18862204 [0,2,0,0,0,0|1,0,0]=3 4086 B10R1.149 CCC(=O)c1ncnn1C Amb10607968 [0,2,0,0,0,0|2,0,0]=4 4087 B10R1.149 CCC(=O)c1ncsc1Br Amb29893092 [0,2,0,0,0,0|2,0,0]=4 4088 B10R1.149 CCC(=O)c1nncn1C Amb27862011 [0,2,0,0,0,0|2,0,0]=4 4089 B10R1.149 CCC(=O)c1nscc1Br Amb29863268 [0,2,0,0,0,0|2,0,0]=4 4090 B10R1.149 CCC(=O)c1sccc1Br Amb27652029 [0,2,0,0,0,0|1,0,0]=3 4091 B10R1.149 CCC(=O)c1sccc1C Amb18791602 [0,2,0,0,0,0|1,0,0]=3 4092 B10R1.149 CCC(=O)c1sccc1Cl Amb25825839 [0,2,0,0,0,0|1,0,0]=3 4093 B10R1.149 CCC(=O)c1sccc1I Amb28254910 [0,2,0,0,0,0|1,0,0]=3 4094 B10R1.149 CCC(=O)c1scnc1C Amb24364730 [0,2,0,0,0,0|2,0,0]=4 4095 B10R1.149 CNC(=N)c1nccn1C Amb28049422 [0,2,0,0,0,0|2,0,0]=4 4096 B10R1.149 CNC(=O)c1cccn1C Amb22001260 [0,2,0,0,0,0|1,0,1]=4 4097 B10R1.149 CNC(=O)c1ncsc1S Amb27636446 [0,2,0,0,0,0|2,0,0]=4 4098 B10R1.149 CNC(=O)c1nscc1Br Amb35705987 [0,2,0,0,0,0|2,0,0]=4 4099 B10R1.149 CNC(=O)c1sccc1Br Amb11370089 [0,2,0,0,0,0|1,0,0]=3 4100 B10R1.149 CNC(=O)c1sccc1C Amb8336391 [0,2,0,0,0,0|1,0,0]=3 4101 B10R1.149 CNC(=O)c1sccc1Cl Amb27759614 [0,2,0,0,0,0|1,0,0]=3 4102 B10R1.149 CNC(=O)c1sccc1F Amb27456604 [0,2,0,0,0,0|1,0,0]=3 4103 B10R1.149 CNC(=O)c1sccc1N Amb15701298 [0,2,0,0,0,0|1,0,0]=3 4104 B10R1.149 CNC(=O)c1scnc1Cl Amb26027509 [0,2,0,0,0,0|2,0,0]=4 4105 B10R1.149 COC(=N)c1nccn1C Amb27192890 [0,2,0,0,0,0|2,0,0]=4 4106 B10R1.149 COC(=N)c1sccc1O Amb28254350 [0,2,0,0,0,0|2,0,0]=4 4107 B10R1.149 COC(=O)C1SC=CC1O Amb27980396 [0,2,0,0,0,0|1,0,1]=4 4108 B10R1.149 COC(=O)c1cccn1C Amb3650079 [0,2,0,0,0,0|1,0,1]=4 4109 B10R1.149 COC(=O)c1cccn1N Amb16233282 [0,2,0,0,0,0|1,0,1]=4 4110 B10R1.149 COC(=O)c1nccn1C Amb5759009 [0,2,0,0,0,0|1,0,0]=3 4111 B10R1.149 COC(=O)c1ncnn1C Amb16230891 [0,2,0,0,0,0|2,0,0]=4 4112 B10R1.149 COC(=O)c1ncoc1C Amb10070321 [0,2,0,0,0,0|2,0,0]=4 4113 B10R1.149 COC(=O)c1ncoc1N Amb24120147 [0,2,0,0,0,0|2,0,0]=4 4114 B10R1.149 COC(=O)c1ncsc1Br Amb10067422 [0,2,0,0,0,0|2,0,0]=4 4115 B10R1.149 COC(=O)c1ncsc1C Amb10067520 [0,2,0,0,0,0|2,0,0]=4 4116 B10R1.149 COC(=O)c1ncsc1Cl Amb23400580 [0,2,0,0,0,0|2,0,0]=4 4117 B10R1.149 COC(=O)c1ncsc1F Amb26602375 [0,2,0,0,0,0|2,0,0]=4 4118 B10R1.149 COC(=O)c1ncsc1I Amb28073937 [0,2,0,0,0,0|2,0,0]=4 4119 B10R1.149 COC(=O)c1ncsc1N Amb22753931 [0,2,0,0,0,0|2,0,0]=4 4120 B10R1.149 COC(=O)c1nncn1C Amb26053573 [0,2,0,0,0,0|2,0,0]=4 4121 B10R1.149 COC(=O)c1nocc1Br Amb28424218 [0,2,0,0,0,0|2,0,0]=4 4122 B10R1.149 COC(=O)c1nocc1C Amb32671273 [0,2,0,0,0,0|2,0,0]=4 4123 B10R1.149 COC(=O)c1nscc1C Amb22491020 [0,2,0,0,0,0|2,0,0]=4 4124 B10R1.149 COC(=O)c1nscc1I Amb25287330 [0,2,0,0,0,0|2,0,0]=4 4125 B10R1.149 COC(=O)c1nscc1N Amb20667656 [0,2,0,0,0,0|2,0,0]=4 4126 B10R1.149 COC(=O)c1occc1Br Amb22899621 [0,2,0,0,0,0|1,1,0]=4 4127 B10R1.149 COC(=O)c1occc1C Amb6356382 [0,2,0,0,0,0|1,1,0]=4 4128 B10R1.149 COC(=O)c1occc1I Amb27424894 [0,2,0,0,0,0|1,1,0]=4 4129 B10R1.149 COC(=O)c1occc1N Amb10604150 [0,2,0,0,0,0|1,1,0]=4 4130 B10R1.149 COC(=O)c1occc1N Amb30869353 [0,2,0,0,0,0|1,1,0]=4 4131 B10R1.149 COC(=O)c1sccc1Br Amb2725750 [0,2,0,0,0,0|1,0,0]=3 4132 B10R1.149 COC(=O)c1sccc1C Amb8396433 [0,2,0,0,0,0|1,0,0]=3 4133 B10R1.149 COC(=O)c1sccc1Cl Amb2689399 [0,2,0,0,0,0|1,0,0]=3 4134 B10R1.149 COC(=O)c1sccc1F Amb13783620 [0,2,0,0,0,0|1,0,0]=3 4135 B10R1.149 COC(=O)c1sccc1I Amb2689460 [0,2,0,0,0,0|1,0,0]=3 4136 B10R1.149 COC(=O)c1sccc1N Amb535153 [0,2,0,0,0,0|1,0,0]=3 4137 B10R1.149 COC(=O)c1sccc1O Amb1398893 [0,2,0,0,0,0|1,0,0]=3 4138 B10R1.149 COC(=O)c1scnc1Br Amb25998710 [0,2,0,0,0,0|2,0,0]=4 4139 B10R1.149 COC(=O)c1scnc1C Amb2445239 [0,2,0,0,0,0|2,0,0]=4 4140 B10R1.149 COC(=O)c1scnc1Cl Amb6479177 [0,2,0,0,0,0|2,0,0]=4 4141 B10R1.149 COC(=O)c1scnc1I Amb28350072 [0,2,0,0,0,0|2,0,0]=4 4142 B10R1.149 COC(=O)c1scnc1N Amb7172570 [0,2,0,0,0,0|2,0,0]=4 4143 B10R1.149 COC(=O)n1nccc1Br Amb33298166 [0,2,0,0,0,0|2,0,0]=4 4144 B10R1.149 COC(=O)n1nccc1C Amb17778971 [0,2,0,0,0,0|2,0,0]=4 4145 B10R1.149 COC(=O)n1nccc1N Amb26597085 [0,2,0,0,0,0|2,0,0]=4 4146 B10R1.149 CO\C(O)=C1/SC=CC1=O Amb33513010 [0,2,0,0,0,0|1,0,1]=4 4147 B10R1.149 C\C(=N/O)c1nccn1C Amb2153296 [0,2,0,0,0,0|1,0,1]=4 4148 B10R1.149 C\C(=N\N)c1sccc1C Amb28193167 [0,2,0,0,0,0|2,0,0]=4 4149 B10R1.149 C\C(=N\O)c1sccc1Br Amb27424922 [0,2,0,0,0,0|1,0,1]=4 4150 B10R1.149 Cc1ccoc1C(=O)CCl Amb26845109 [0,2,0,0,0,0|1,1,0]=4 4151 B10R1.149 Cc1ccoc1C(=O)CN Amb24458130 [0,2,0,0,0,0|1,1,0]=4 4152 B10R1.149 Cc1ccsc1C(=O)CCl Amb18180346 [0,2,0,0,0,0|1,0,0]=3 4153 B10R1.149 Cc1ccsc1C(=O)CN Amb18251480 [0,2,0,0,0,0|1,0,0]=3 4154 B10R1.149 Cc1ccsc1C(=O)NN Amb1950412 [0,2,0,0,0,0|2,0,0]=4 4155 B10R1.149 Cc1ccsc1C(C)C=O Amb33172140 [0,2,0,0,0,0|1,0,1]=4 4156 B10R1.149 Cc1ncsc1C(=O)CCl Amb26480845 [0,2,0,0,0,0|2,0,0]=4 4157 B10R1.149 Cc1ncsc1C(=O)CN Amb18830749 [0,2,0,0,0,0|2,0,0]=4 4158 B10R1.149 Cc1ocnc1C(=O)CCl Amb33457508 [0,2,0,0,0,0|2,0,0]=4 4159 B10R1.149 Cn1cccc1C(=O)CCl Amb1107459 [0,2,0,0,0,0|1,0,1]=4 4160 B10R1.149 Cn1cccc1C(=O)CN Amb18832209 [0,2,0,0,0,0|1,0,1]=4 4161 B10R1.149 Cn1ccnc1C(=O)CCl Amb25051512 [0,2,0,0,0,0|1,0,0]=3 4162 B10R1.149 Cn1ccnc1C(=O)CN Amb18223237 [0,2,0,0,0,0|1,0,0]=3 4163 B10R1.149 Cn1ccnc1C(=O)CO Amb28347336 [0,2,0,0,0,0|1,0,0]=3 4164 B10R1.149 Cn1ccnc1C(=O)NN Amb6373955 [0,2,0,0,0,0|2,0,0]=4 4165 B10R1.149 Cn1cnnc1C(=O)CN Amb27843925 [0,2,0,0,0,0|2,0,0]=4 4166 B10R1.149 Cn1ncnc1C(=O)CBr Amb32418356 [0,2,0,0,0,0|2,0,0]=4 4167 B10R1.149 Cn1ncnc1C(=O)CCl Amb27961786 [0,2,0,0,0,0|2,0,0]=4 4168 B10R1.149 Cn1ncnc1C(=O)CN Amb24433537 [0,2,0,0,0,0|2,0,0]=4 4169 B10R1.149 NCC(=O)c1ncsc1Br Amb35659568 [0,2,0,0,0,0|2,0,0]=4 4170 B10R1.149 NCC(=O)c1nscc1Br Amb30015378 [0,2,0,0,0,0|2,0,0]=4 4171 B10R1.149 NCC(=O)c1occc1Br Amb24357342 [0,2,0,0,0,0|1,1,0]=4 4172 B10R1.149 NCC(=O)c1sccc1Br Amb24675888 [0,2,0,0,0,0|1,0,0]=3 4173 B10R1.149 NCC(=O)c1sccc1Cl Amb18822609 [0,2,0,0,0,0|1,0,0]=3 4174 B10R1.149 NCC(=O)c1sccc1N Amb28132869 [0,2,0,0,0,0|1,0,0]=3 4175 B10R1.149 NCC(=O)c1sncc1Br Amb33307989 [0,2,0,0,0,0|2,0,0]=4 4176 B10R1.149 NNC(=O)c1sccc1Br Amb22736361 [0,2,0,0,0,0|2,0,0]=4 4177 B10R1.149 NNC(=O)c1sccc1Cl Amb22432395 [0,2,0,0,0,0|2,0,0]=4 4178 B10R1.149 NNC(=O)c1sccc1N Amb2737574 [0,2,0,0,0,0|2,0,0]=4 4179 B10R1.149 Nc1ccnn1C(=O)CCl Amb24480555 [0,2,0,0,0,0|2,0,0]=4 4180 B10R1.149 O=C(CBr)c1ncsc1Br Amb29889861 [0,2,0,0,0,0|2,0,0]=4 4181 B10R1.149 O=C(CBr)c1ncsc1I Amb28350299 [0,2,0,0,0,0|2,0,0]=4 4182 B10R1.149 O=C(CBr)c1nscc1Br Amb29864127 [0,2,0,0,0,0|2,0,0]=4 4183 B10R1.149 O=C(CBr)c1occc1Br Amb35580961 [0,2,0,0,0,0|1,1,0]=4 4184 B10R1.149 O=C(CBr)c1sccc1Br Amb2440290 [0,2,0,0,0,0|1,0,0]=3 4185 B10R1.149 O=C(CBr)c1sccc1Cl Amb2440296 [0,2,0,0,0,0|1,0,0]=3 4186 B10R1.149 O=C(CCl)c1ncsc1Br Amb30037931 [0,2,0,0,0,0|2,0,0]=4 4187 B10R1.149 O=C(CCl)c1nscc1Br Amb29864147 [0,2,0,0,0,0|2,0,0]=4 4188 B10R1.149 O=C(CCl)c1occc1Br Amb35688688 [0,2,0,0,0,0|1,1,0]=4 4189 B10R1.149 O=C(CCl)c1sccc1Br Amb19373543 [0,2,0,0,0,0|1,0,0]=3 4190 B10R1.149 O=C(CCl)c1sccc1Cl Amb28197582 [0,2,0,0,0,0|1,0,0]=3 4191 B10R1.149 O=C(CCl)c1sccc1I Amb27483186 [0,2,0,0,0,0|1,0,0]=3 4192 B10R1.149 O=C(NO)c1sccc1Cl Amb27193719 [0,2,0,0,0,0|2,0,0]=4 4193 B10R1.149 O=C(NO)c1sccc1O Amb27658871 [0,2,0,0,0,0|2,0,0]=4 4194 B10R1.149 O=C1C=CSN1C(=O)CCl Amb24061554 [0,2,0,0,0,0|2,0,0]=4 4195 B10R1.55 CC(C)(C)c1nc(Br)cs1 Amb10599613 [0,2,0,0,0,0|1,0,1]=4 4196 B10R1.55 CC(C)(C)c1nc(N)cs1 Amb10599614 [0,2,0,0,0,0|1,0,1]=4 4197 B10R1.55 CC(C)(C)c1nc(O)cs1 Amb10599615 [0,2,0,0,0,0|1,0,1]=4 4198 B10R1.55 CC(C)(C)c1ncc(Br)s1 Amb10599447 [0,2,0,0,0,0|1,0,1]=4 4199 B10R1.55 CC(C)(C)c1ncc(N)s1 Amb10599448 [0,2,0,0,0,0|1,0,1]=4 4200 B10R1.55 CC(C)(C)c1ncc(O)s1 Amb10599449 [0,2,0,0,0,0|1,0,1]=4 4201 B10R1.55 CC(C)(F)c1nc(N)cs1 Amb27879246 [0,2,0,0,0,0|1,0,1]=4 4202 B10R1.55 CC(C)(N)c1nc(Br)cs1 Amb24319124 [0,2,0,0,0,0|1,0,1]=4 4203 B10R1.55 CC(C)(N)c1nc(O)cs1 Amb30014507 [0,2,0,0,0,0|1,0,1]=4 4204 B10R1.55 CC(C)(N)c1ncc(Br)s1 Amb18765458 [0,2,0,0,0,0|1,0,1]=4 4205 B10R1.55 CC(C)(N)c1ncc(Cl)s1 Amb27614869 [0,2,0,0,0,0|1,0,1]=4 4206 B10R1.55 CC(C)(O)c1nc(Br)cs1 Amb2455676 [0,2,0,0,0,0|0,0,2]=4 4207 B10R1.55 CC(C)(O)c1ncc(Br)s1 Amb21927759 [0,2,0,0,0,0|0,0,2]=4 4208 B10R1.55 CC(F)(F)c1nc(Br)cs1 Amb27424067 [0,2,0,0,0,0|1,0,1]=4 4209 B10R1.55 CC(F)(F)c1ncc(O)s1 Amb27879074 [0,2,0,0,0,0|1,0,1]=4 4210 B10R1.55 CS(=O)(=O)c1cc(Br)cs1 Amb27839584 [0,2,0,0,0,0|2,0,0]=4 4211 B10R1.55 CS(=O)(=O)c1cc(F)cs1 Amb2611480 [0,2,0,0,0,0|2,0,0]=4 4212 B10R1.55 CS(=O)(=O)c1ccc(Br)s1 Amb2237074 [0,2,0,0,0,0|2,0,0]=4 4213 B10R1.55 CS(=O)(=O)c1ccc(Cl)s1 Amb25801772 [0,2,0,0,0,0|2,0,0]=4 4214 B10R1.55 CS(=O)(=O)c1nc(Br)cs1 Amb20616795 [0,2,0,0,0,0|1,0,0]=3 4215 B10R1.55 CS(=O)(=O)c1nc(Cl)ns1 Amb33309656 [0,2,0,0,0,0|2,0,0]=4 4216 B10R1.55 CS(=O)(=O)c1ncc(Br)o1 Amb27612878 [0,2,0,0,0,0|1,1,0]=4 4217 B10R1.55 CS(=O)(=O)c1ncc(Br)s1 Amb20617249 [0,2,0,0,0,0|1,0,0]=3 4218 B10R1.55 CS(=O)(=O)c1ncc(Cl)s1 Amb26428364 [0,2,0,0,0,0|1,0,0]=3 4219 B10R1.55 CS(=O)(=O)c1nnc(N)s1 Amb2577767 [0,2,0,0,0,0|2,0,0]=4 4220 B10R1.55 C[Si](C)(C)c1nc(Br)cs1 Amb10067367 [0,2,0,0,0,0|1,1,0]=4 4221 B10R1.55 C[Si](C)(C)c1ncc(Br)s1 Amb13889597 [0,2,0,0,0,0|1,1,0]=4 4222 B10R1.55 Cc1ccc(S(C)(=O)=O)s1 Amb8505509 [0,2,0,0,0,0|2,0,0]=4 4223 B10R1.55 Cc1cnc(C(C)(C)N)s1 Amb9421791 [0,2,0,0,0,0|1,0,1]=4 4224 B10R1.55 Cc1cnc(C(C)(C)O)s1 Amb27604324 [0,2,0,0,0,0|0,0,2]=4 4225 B10R1.55 Cc1cnc([Si](C)(C)C)s1 Amb28247303 [0,2,0,0,0,0|1,1,0]=4 4226 B10R1.55 Cc1csc(C(C)(C)C)n1 Amb25724154 [0,2,0,0,0,0|1,0,1]=4 4227 B10R1.55 Cc1csc(C(C)(C)N)n1 Amb17084616 [0,2,0,0,0,0|1,0,1]=4 4228 B10R1.55 Cc1csc(C(C)(C)N)n1 Amb17602620 [0,2,0,0,0,0|1,0,1]=4 4229 B10R1.55 Cc1csc(C(C)(C)O)n1 Amb24479744 [0,2,0,0,0,0|0,0,2]=4 4230 B10R1.55 Cc1csc(S(=O)(=O)Cl)n1 Amb6651183 [0,2,0,0,0,0|2,0,0]=4 4231 B10R1.55 Cc1csc(S(=O)(=O)F)n1 Amb24646200 [0,2,0,0,0,0|2,0,0]=4 4232 B10R1.55 Cc1csc(S(N)(=O)=O)n1 Amb18809061 [0,2,0,0,0,0|2,0,0]=4 4233 B10R1.55 NS(=O)(=O)c1nc(Br)cs1 Amb26338436 [0,2,0,0,0,0|2,0,0]=4 4234 B10R1.55 NS(=O)(=O)c1nc(Cl)cs1 Amb28195754 [0,2,0,0,0,0|2,0,0]=4 4235 B10R1.55 NS(=O)(=O)c1ncc(Br)s1 Amb27842335 [0,2,0,0,0,0|2,0,0]=4 4236 B10R1.55 NS(=O)(=O)c1ncc(Cl)s1 Amb24479215 [0,2,0,0,0,0|2,0,0]=4 4237 B10R1.55 O=S(=O)(Cl)c1nc(Cl)cs1 Amb6893176 [0,2,0,0,0,0|2,0,0]=4 4238 B10R1.55 O=S(=O)(Cl)c1ncc(Br)s1 Amb24340296 [0,2,0,0,0,0|2,0,0]=4 4239 B10R1.55 O=S(=O)(F)c1ncc(Br)s1 Amb33263516 [0,2,0,0,0,0|2,0,0]=4 4240 B10R1.65 Cn1ccnc1P(C)(=O)Cl Amb27765076 [0,2,0,0,0,0|2,0,0]=4 4241 B10R1.65 Cn1ccnc1P(C)(=O)O Amb26654950 [0,2,0,0,0,0|2,0,0]=4 4242 B10R1.65 Cn1ccnc1S(C)(=N)=O Amb32668649 [0,2,0,0,0,0|2,0,0]=4 4243 B10R1.65 Cn1ccnc1S(C)(=O)=O Amb8853640 [0,2,0,0,0,0|2,0,0]=4 4244 B10R1.31 C#Cc1cnc(C(C)C)s1 Amb33345543 [0,2,0,0,0,0|1,0,1]=4 4245 B10R1.31 C#Cc1cnc(C(N)=O)s1 Amb26866266 [0,2,0,0,0,0|1,0,0]=3 4246 B10R1.31 C#Cc1cnc(N(C)C)s1 Amb32875152 [0,2,0,0,0,0|2,0,0]=4 4247 B10R1.31 C#Cc1csc(C(=O)O)c1 Amb23598967 [0,2,0,0,0,0|2,0,0]=4 4248 B10R1.31 C#Cc1csc(C(C)C)n1 Amb26459896 [0,2,0,0,0,0|1,0,1]=4 4249 B10R1.31 C#Cc1csc(C(N)=O)n1 Amb24364275 [0,2,0,0,0,0|1,0,0]=3 4250 B10R1.31 C#Cc1csc([C@H](C)N)n1 Amb35671650 [0,2,0,0,0,0|1,0,1]=4 4251 B10R1.31 C=C(C)c1ccc(C#N)s1 Amb28400745 [0,2,0,0,0,0|2,0,0]=4 4252 B10R1.31 C=C(C)c1ccc(CC)s1 Amb27838933 [0,2,0,0,0,0|2,0,0]=4 4253 B10R1.31 C=Cc1ccc(C(=O)O)s1 Amb27606833 [0,2,0,0,0,0|2,0,0]=4 4254 B10R1.31 C=Cc1ccc(C(C)=O)s1 Amb28145327 [0,2,0,0,0,0|1,0,0]=3 4255 B10R1.31 C=Cc1cnc(C(C)C)s1 Amb33345535 [0,2,0,0,0,0|1,0,1]=4 4256 B10R1.31 C=Cc1cnc(N(C)C)s1 Amb32875151 [0,2,0,0,0,0|2,0,0]=4 4257 B10R1.31 C=Cc1csc(C(=O)O)c1 Amb32682054 [0,2,0,0,0,0|2,0,0]=4 4258 B10R1.31 C=Cc1csc(C(C)=O)c1 Amb27841466 [0,2,0,0,0,0|1,0,0]=3 4259 B10R1.31 C=Cc1csc(C(C)C)n1 Amb33147788 [0,2,0,0,0,0|1,0,1]=4 4260 B10R1.31 CC(=O)c1cc(C#N)cs1 Amb18644467 [0,2,0,0,0,0|1,0,0]=3 4261 B10R1.31 CC(=O)c1cc(C#N)ns1 Amb18201336 [0,2,0,0,0,0|2,0,0]=4 4262 B10R1.31 CC(=O)c1cc(C#N)on1 Amb18832487 [0,2,0,0,0,0|2,0,0]=4 4263 B10R1.31 CC(=O)c1cc(C=O)cs1 Amb6357078 [0,2,0,0,0,0|1,0,0]=3 4264 B10R1.31 CC(=O)c1cc(CBr)on1 Amb25701862 [0,2,0,0,0,0|2,0,0]=4 4265 B10R1.31 CC(=O)c1cc(CCl)cs1 Amb1102125 [0,2,0,0,0,0|1,0,0]=3 4266 B10R1.31 CC(=O)c1cc(CCl)on1 Amb26329986 [0,2,0,0,0,0|2,0,0]=4 4267 B10R1.31 CC(=O)c1cc(CN)cs1 Amb27959069 [0,2,0,0,0,0|1,0,0]=3 4268 B10R1.31 CC(=O)c1cc(CO)cs1 Amb1102124 [0,2,0,0,0,0|1,0,0]=3 4269 B10R1.31 CC(=O)c1cc(CO)on1 Amb23440969 [0,2,0,0,0,0|2,0,0]=4 4270 B10R1.31 CC(=O)c1ccc(C#N)o1 Amb21963422 [0,2,0,0,0,0|1,1,0]=4 4271 B10R1.31 CC(=O)c1ccc(C#N)s1 Amb2684239 [0,2,0,0,0,0|1,0,0]=3 4272 B10R1.31 CC(=O)c1ccc(C=O)o1 Amb4165626 [0,2,0,0,0,0|1,1,0]=4 4273 B10R1.31 CC(=O)c1ccc(C=O)s1 Amb2724894 [0,2,0,0,0,0|1,0,0]=3 4274 B10R1.31 CC(=O)c1ccc(CN)o1 Amb18202974 [0,2,0,0,0,0|1,1,0]=4 4275 B10R1.31 CC(=O)c1ccc(CN)o1 Amb33447088 [0,2,0,0,0,0|1,1,0]=4 4276 B10R1.31 CC(=O)c1ccc(CN)s1 Amb18830875 [0,2,0,0,0,0|1,0,0]=3 4277 B10R1.31 CC(=O)c1ccc(NN)s1 Amb18830766 [0,2,0,0,0,0|1,0,0]=3 4278 B10R1.31 CC(=O)c1cnc(CN)s1 Amb33132706 [0,2,0,0,0,0|2,0,0]=4 4279 B10R1.31 CC(=O)c1cnc(CO)s1 Amb28200329 [0,2,0,0,0,0|2,0,0]=4 4280 B10R1.31 CC(=O)c1coc(CO)n1 Amb26451255 [0,2,0,0,0,0|2,0,0]=4 4281 B10R1.31 CC(=O)c1csc(C#N)n1 Amb26642968 [0,2,0,0,0,0|2,0,0]=4 4282 B10R1.31 CC(=O)c1csc(CN)n1 Amb25727128 [0,2,0,0,0,0|2,0,0]=4 4283 B10R1.31 CC(=O)c1nc(C#N)cs1 Amb27194975 [0,2,0,0,0,0|0,0,0]=2 4284 B10R1.31 CC(=O)c1nc(CCl)co1 Amb28381298 [0,2,0,0,0,0|0,1,0]=3 4285 B10R1.31 CC(=O)c1nc(CF)cs1 Amb27792316 [0,2,0,0,0,0|0,0,0]=2 4286 B10R1.31 CC(=O)c1nc(CO)cs1 Amb26418027 [0,2,0,0,0,0|0,0,0]=2 4287 B10R1.31 CC(=O)c1ncc(C#N)s1 Amb18831201 [0,2,0,0,0,0|0,0,0]=2 4288 B10R1.31 CC(=O)c1ncc(CCl)s1 Amb28401575 [0,2,0,0,0,0|0,0,0]=2 4289 B10R1.31 CC(=O)c1ncc(CO)s1 Amb25679552 [0,2,0,0,0,0|0,0,0]=2 4290 B10R1.31 CC(=O)n1ccc(C#N)n1 Amb33623945 [0,2,0,0,0,0|2,0,0]=4 4291 B10R1.31 CC(Br)c1nc(C=O)cs1 Amb33188773 [0,2,0,0,0,0|1,0,1]=4 4292 B10R1.31 CC(Br)c1nc(CN)cs1 Amb27797038 [0,2,0,0,0,0|1,0,1]=4 4293 B10R1.31 CC(Br)c1ncc(C=O)s1 Amb33188753 [0,2,0,0,0,0|1,0,1]=4 4294 B10R1.31 CC(C)c1nc(C#N)cs1 Amb21857215 [0,2,0,0,0,0|1,0,1]=4 4295 B10R1.31 CC(C)c1nc(C=O)cs1 Amb2455682 [0,2,0,0,0,0|1,0,1]=4 4296 B10R1.31 CC(C)c1nc(CBr)cs1 Amb26975622 [0,2,0,0,0,0|1,0,1]=4 4297 B10R1.31 CC(C)c1nc(CCl)cs1 Amb2455683 [0,2,0,0,0,0|1,0,1]=4 4298 B10R1.31 CC(C)c1nc(CN)cs1 Amb19550593 [0,2,0,0,0,0|1,0,1]=4 4299 B10R1.31 CC(C)c1nc(CN)cs1 Amb2455845 [0,2,0,0,0,0|1,0,1]=4 4300 B10R1.31 CC(C)c1nc(CO)cs1 Amb10067332 [0,2,0,0,0,0|1,0,1]=4 4301 B10R1.31 CC(C)c1nc(CS)cs1 Amb17108590 [0,2,0,0,0,0|1,0,1]=4 4302 B10R1.31 CC(C)c1ncc(C#N)s1 Amb18256870 [0,2,0,0,0,0|1,0,1]=4 4303 B10R1.31 CC(C)c1ncc(C=O)s1 Amb18177415 [0,2,0,0,0,0|1,0,1]=4 4304 B10R1.31 CC(C)c1ncc(CBr)s1 Amb18255510 [0,2,0,0,0,0|1,0,1]=4 4305 B10R1.31 CC(C)c1ncc(CCl)s1 Amb18255723 [0,2,0,0,0,0|1,0,1]=4 4306 B10R1.31 CC(C)c1ncc(CI)s1 Amb22266776 [0,2,0,0,0,0|1,0,1]=4 4307 B10R1.31 CC(C)c1ncc(CN)s1 Amb5758521 [0,2,0,0,0,0|1,0,1]=4 4308 B10R1.31 CC(C)c1ncc(CO)s1 Amb17514238 [0,2,0,0,0,0|1,0,1]=4 4309 B10R1.31 CC(C)c1ncc(CS)s1 Amb18917632 [0,2,0,0,0,0|1,0,1]=4 4310 B10R1.31 CC(N)c1ncc(CO)s1 Amb27945551 [0,2,0,0,0,0|1,0,1]=4 4311 B10R1.31 CC(O)c1nc(CCl)cs1 Amb27184037 [0,2,0,0,0,0|0,0,2]=4 4312 B10R1.31 CC(O)c1ncc(C=O)s1 Amb27146170 [0,2,0,0,0,0|0,0,2]=4 4313 B10R1.31 CCc1cc(C(C)=O)no1 Amb27267095 [0,2,0,0,0,0|2,0,0]=4 4314 B10R1.31 CCc1ccc(C(=O)Cl)s1 Amb16186423 [0,2,0,0,0,0|2,0,0]=4 4315 B10R1.31 CCc1ccc(C(=O)O)s1 Amb1216581 [0,2,0,0,0,0|2,0,0]=4 4316 B10R1.31 CCc1ccc(C(=O)[O-])s1 Amb33512994 [0,2,0,0,0,0|2,0,0]=4 4317 B10R1.31 CCc1ccc(C(C)=O)o1 Amb20667621 [0,2,0,0,0,0|1,1,0]=4 4318 B10R1.31 CCc1ccc(C(C)=O)s1 Amb33545742 [0,2,0,0,0,0|1,0,0]=3 4319 B10R1.31 CCc1ccc(C(N)=O)s1 Amb8858645 [0,2,0,0,0,0|2,0,0]=4 4320 B10R1.31 CCc1cnc(C(=N)N)s1 Amb27645589 [0,2,0,0,0,0|2,0,0]=4 4321 B10R1.31 CCc1cnc(C(=O)O)o1 Amb18831796 [0,2,0,0,0,0|1,1,0]=4 4322 B10R1.31 CCc1cnc(C(=O)[O-])s1 Amb32718793 [0,2,0,0,0,0|1,0,0]=3 4323 B10R1.31 CCc1cnc(C(C)=O)s1 Amb24387171 [0,2,0,0,0,0|0,0,0]=2 4324 B10R1.31 CCc1cnc(C(C)N)s1 Amb5754066 [0,2,0,0,0,0|1,0,1]=4 4325 B10R1.31 CCc1cnc(C(N)=O)s1 Amb27260065 [0,2,0,0,0,0|1,0,0]=3 4326 B10R1.31 CCc1cnc(C(N)=S)s1 Amb27983878 [0,2,0,0,0,0|1,1,0]=4 4327 B10R1.31 CCc1cnc(N(C)C)s1 Amb27796955 [0,2,0,0,0,0|2,0,0]=4 4328 B10R1.31 CCc1cnc(S(=O)O)s1 Amb32992469 [0,2,0,0,0,0|2,0,0]=4 4329 B10R1.31 CCc1cnc(S(=O)[O-])s1 Amb32992556 [0,2,0,0,0,0|2,0,0]=4 4330 B10R1.31 CCc1cnc(S(C)=O)o1 Amb27804255 [0,2,0,0,0,0|1,1,0]=4 4331 B10R1.31 CCc1cnc([C@@H](C)N)s1 Amb35671492 [0,2,0,0,0,0|1,0,1]=4 4332 B10R1.31 CCc1cnc([C@H](C)N)s1 Amb35671652 [0,2,0,0,0,0|1,0,1]=4 4333 B10R1.31 CCc1cnc([N+](=O)[O-])s1 Amb27237106 [0,2,0,0,0,0|2,0,0]=4 4334 B10R1.31 CCc1coc(C(=O)O)n1 Amb32663014 [0,2,0,0,0,0|1,1,0]=4 4335 B10R1.31 CCc1csc(C(=O)O)n1 Amb17138463 [0,2,0,0,0,0|1,0,0]=3 4336 B10R1.31 CCc1csc(C(C)=O)c1 Amb27460179 [0,2,0,0,0,0|1,0,0]=3 4337 B10R1.31 CCc1csc(C(C)C)n1 Amb27947407 [0,2,0,0,0,0|1,0,1]=4 4338 B10R1.31 CCc1csc(C(C)N)n1 Amb28895971 [0,2,0,0,0,0|1,0,1]=4 4339 B10R1.31 CCc1csc(C(C)N)n1 Amb32663315 [0,2,0,0,0,0|1,0,1]=4 4340 B10R1.31 CCc1csc(C(C)N)n1 Amb5740491 [0,2,0,0,0,0|1,0,1]=4 4341 B10R1.31 CCc1csc(C(N)=S)n1 Amb33250304 [0,2,0,0,0,0|1,1,0]=4 4342 B10R1.31 CCc1csc(N(C)C)n1 Amb27877864 [0,2,0,0,0,0|2,0,0]=4 4343 B10R1.31 CCc1csc(N(C)N)n1 Amb28316061 [0,2,0,0,0,0|2,0,0]=4 4344 B10R1.31 CCc1csc([C@@H](C)N)n1 Amb35671490 [0,2,0,0,0,0|1,0,1]=4 4345 B10R1.31 CCc1csc([C@H](C)N)n1 Amb35671651 [0,2,0,0,0,0|1,0,1]=4 4346 B10R1.31 CCc1csc([N+](=O)[O-])n1 Amb25825280 [0,2,0,0,0,0|2,0,0]=4 4347 B10R1.31 CCc1nc(C(C)=O)cs1 Amb27455016 [0,2,0,0,0,0|2,0,0]=4 4348 B10R1.31 CCc1nnc(C(=O)O)s1 Amb32663335 [0,2,0,0,0,0|2,0,0]=4 4349 B10R1.31 CCc1nnc(C(=O)[O-])s1 Amb32663191 [0,2,0,0,0,0|2,0,0]=4 4350 B10R1.31 CCc1nnc(C(C)=O)o1 Amb27242622 [0,2,0,0,0,0|1,1,0]=4 4351 B10R1.31 CCn1ccc(C(C)=O)n1 Amb1945620 [0,2,0,0,0,0|2,0,0]=4 4352 B10R1.31 CCn1cnc(C(C)=O)c1 Amb23585671 [0,2,0,0,0,0|2,0,0]=4 4353 B10R1.31 CN(C)c1nc(CCl)cs1 Amb9393689 [0,2,0,0,0,0|2,0,0]=4 4354 B10R1.31 CN(C)c1nc(CN)cs1 Amb13949082 [0,2,0,0,0,0|2,0,0]=4 4355 B10R1.31 CN(C)c1nc(CN)cs1 Amb8010130 [0,2,0,0,0,0|2,0,0]=4 4356 B10R1.31 CN(C)c1nc(CO)cs1 Amb26980642 [0,2,0,0,0,0|2,0,0]=4 4357 B10R1.31 CN(C)c1ncc(C#N)s1 Amb18205939 [0,2,0,0,0,0|2,0,0]=4 4358 B10R1.31 CN(C)c1ncc(C=O)s1 Amb8009619 [0,2,0,0,0,0|2,0,0]=4 4359 B10R1.31 CN(C)c1ncc(CBr)s1 Amb18203648 [0,2,0,0,0,0|2,0,0]=4 4360 B10R1.31 CN(C)c1ncc(CCl)s1 Amb26460611 [0,2,0,0,0,0|2,0,0]=4 4361 B10R1.31 CN(C)c1ncc(CCl)s1 Amb32757565 [0,2,0,0,0,0|2,0,0]=4 4362 B10R1.31 CN(C)c1ncc(CN)s1 Amb18287230 [0,2,0,0,0,0|2,0,0]=4 4363 B10R1.31 CN(C)c1ncc(CO)s1 Amb17514971 [0,2,0,0,0,0|2,0,0]=4 4364 B10R1.31 CN(C)c1ncc(CS)s1 Amb18836827 [0,2,0,0,0,0|2,0,0]=4 4365 B10R1.31 CNc1ccc(C(N)=O)s1 Amb27458658 [0,2,0,0,0,0|2,0,0]=4 4366 B10R1.31 CNc1cnc(C(C)C)s1 Amb25269669 [0,2,0,0,0,0|1,0,1]=4 4367 B10R1.31 CNc1cnc(C(N)=O)s1 Amb32685654 [0,2,0,0,0,0|1,0,0]=3 4368 B10R1.31 CNc1nc(C(C)=O)cs1 Amb18563470 [0,2,0,0,0,0|2,0,0]=4 4369 B10R1.31 CNc1ncc(C(C)=O)s1 Amb2436664 [0,2,0,0,0,0|2,0,0]=4 4370 B10R1.31 CNc1nnc(C(=O)O)s1 Amb27188542 [0,2,0,0,0,0|2,0,0]=4 4371 B10R1.31 COc1cc(C(C)=O)sn1 Amb27455532 [0,2,0,0,0,0|2,0,0]=4 4372 B10R1.31 COc1ccc(C(=O)O)s1 Amb2611701 [0,2,0,0,0,0|2,0,0]=4 4373 B10R1.31 COc1ccc(C(C)=O)s1 Amb28126809 [0,2,0,0,0,0|1,0,0]=3 4374 B10R1.31 COc1ccc(C(N)=O)s1 Amb27974232 [0,2,0,0,0,0|2,0,0]=4 4375 B10R1.31 COc1cnc(C(=O)O)o1 Amb3428237 [0,2,0,0,0,0|1,1,0]=4 4376 B10R1.31 COc1cnc(C(=O)O)s1 Amb28343037 [0,2,0,0,0,0|1,0,0]=3 4377 B10R1.31 COc1cnc(C(C)=O)o1 Amb18202771 [0,2,0,0,0,0|0,1,0]=3 4378 B10R1.31 COc1cnc(C(C)=O)s1 Amb18830636 [0,2,0,0,0,0|0,0,0]=2 4379 B10R1.31 COc1cnc(C(N)=O)o1 Amb27847275 [0,2,0,0,0,0|1,1,0]=4 4380 B10R1.31 COc1coc(C(=O)O)n1 Amb18202497 [0,2,0,0,0,0|1,1,0]=4 4381 B10R1.31 COc1csc(C(=O)Cl)c1 Amb25182501 [0,2,0,0,0,0|2,0,0]=4 4382 B10R1.31 COc1csc(C(=O)O)c1 Amb33528140 [0,2,0,0,0,0|2,0,0]=4 4383 B10R1.31 COc1csc(C(C)=O)n1 Amb27801343 [0,2,0,0,0,0|0,0,0]=2 4384 B10R1.31 COc1csc(C(N)=O)c1 Amb26967077 [0,2,0,0,0,0|2,0,0]=4 4385 B10R1.31 COc1ncc(C(C)=O)s1 Amb27192597 [0,2,0,0,0,0|2,0,0]=4 4386 B10R1.31 COc1nnc(C(=O)O)s1 Amb27958993 [0,2,0,0,0,0|2,0,0]=4 4387 B10R1.31 CS(=O)c1ccc(C=O)s1 Amb18127005 [0,2,0,0,0,0|2,0,0]=4 4388 B10R1.31 CS(=O)c1ncc(C#N)s1 Amb28129879 [0,2,0,0,0,0|1,0,0]=3 4389 B10R1.31 CS(=O)c1ncc(CCl)s1 Amb27778229 [0,2,0,0,0,0|1,0,0]=3 4390 B10R1.31 CSc1ccc(C(=O)O)s1 Amb1102122 [0,2,0,0,0,0|2,0,0]=4 4391 B10R1.31 CSc1ccc(C(C)=O)s1 Amb2707732 [0,2,0,0,0,0|1,0,0]=3 4392 B10R1.31 CSc1ccc(C(N)=O)s1 Amb2767238 [0,2,0,0,0,0|2,0,0]=4 4393 B10R1.31 CSc1cnc(C(C)Cl)s1 Amb27232902 [0,2,0,0,0,0|1,0,1]=4 4394 B10R1.31 CSc1cnc(C(C)O)s1 Amb27757407 [0,2,0,0,0,0|0,0,2]=4 4395 B10R1.31 CSc1cnc(C(N)=O)s1 Amb26390822 [0,2,0,0,0,0|1,0,0]=3 4396 B10R1.31 CSc1csc(C(=O)Cl)c1 Amb27185501 [0,2,0,0,0,0|2,0,0]=4 4397 B10R1.31 CSc1csc(C(N)=O)n1 Amb27490678 [0,2,0,0,0,0|1,0,0]=3 4398 B10R1.31 CSc1ncc(C(C)=O)s1 Amb19882271 [0,2,0,0,0,0|2,0,0]=4 4399 B10R1.31 CSc1nnc(C(N)=O)s1 Amb24482434 [0,2,0,0,0,0|2,0,0]=4 4400 B10R1.31 C[C@H](Cl)c1nc(CN)cs1 Amb27857481 [0,2,0,0,0,0|1,0,1]=4 4401 B10R1.31 N#Cc1ccc(C(=O)O)s1 Amb9173837 [0,2,0,0,0,0|2,0,0]=4 4402 B10R1.31 N#Cc1cnc(C(=O)O)s1 Amb27669413 [0,2,0,0,0,0|1,0,0]=3 4403 B10R1.31 N#Cc1csc(C(=O)Cl)c1 Amb25887566 [0,2,0,0,0,0|2,0,0]=4 4404 B10R1.31 N#Cc1csc(C(=O)O)c1 Amb10069118 [0,2,0,0,0,0|2,0,0]=4 4405 B10R1.31 N#Cc1nnc(C(N)=O)s1 Amb27786931 [0,2,0,0,0,0|2,0,0]=4 4406 B10R1.31 NC(=O)c1ccc(C=O)s1 Amb20669538 [0,2,0,0,0,0|2,0,0]=4 4407 B10R1.31 NC(=S)c1nc(C=O)cs1 Amb33250296 [0,2,0,0,0,0|1,1,0]=4 4408 B10R1.31 NC(=S)c1ncc(CO)s1 Amb33250297 [0,2,0,0,0,0|1,1,0]=4 4409 B10R1.31 NCc1ccc(C(=O)O)s1 Amb2592452 [0,2,0,0,0,0|2,0,0]=4 4410 B10R1.31 NCc1ccc(C(=O)O)s1 Amb32992646 [0,2,0,0,0,0|2,0,0]=4 4411 B10R1.31 NCc1ccc(C(N)=O)s1 Amb18908500 [0,2,0,0,0,0|2,0,0]=4 4412 B10R1.31 NCc1csc(C(=O)O)c1 Amb22011445 [0,2,0,0,0,0|2,0,0]=4 4413 B10R1.31 NCc1csc(C(N)=O)n1 Amb28187156 [0,2,0,0,0,0|1,0,0]=3 4414 B10R1.31 NCc1csc(C(N)=S)n1 Amb27983506 [0,2,0,0,0,0|1,1,0]=4 4415 B10R1.31 NNc1ccc(C(=O)O)s1 Amb18830492 [0,2,0,0,0,0|2,0,0]=4 4416 B10R1.31 O=C(Cl)c1nc(CCl)cs1 Amb25737477 [0,2,0,0,0,0|1,0,0]=3 4417 B10R1.31 O=C(O)c1cc(CBr)cs1 Amb28314098 [0,2,0,0,0,0|2,0,0]=4 4418 B10R1.31 O=C(O)c1cc(CS)cs1 Amb27400333 [0,2,0,0,0,0|2,0,0]=4 4419 B10R1.31 O=C(O)c1ccc(CBr)s1 Amb27642584 [0,2,0,0,0,0|2,0,0]=4 4420 B10R1.31 O=C(O)c1ccc(CCl)s1 Amb28120179 [0,2,0,0,0,0|2,0,0]=4 4421 B10R1.31 O=C(O)c1ccc(CO)s1 Amb24329406 [0,2,0,0,0,0|2,0,0]=4 4422 B10R1.31 O=C(O)c1ccc(CS)s1 Amb24556891 [0,2,0,0,0,0|2,0,0]=4 4423 B10R1.31 O=C(O)c1ncc(CF)o1 Amb28251571 [0,2,0,0,0,0|1,1,0]=4 4424 B10R1.31 O=Cc1ccc(C(=O)O)s1 Amb2611502 [0,2,0,0,0,0|2,0,0]=4 4425 B10R1.31 O=Cc1ccc(C(=O)[O-])s1 Amb33512992 [0,2,0,0,0,0|2,0,0]=4 4426 B10R1.31 O=Cc1cnc(C(=O)O)o1 Amb18202791 [0,2,0,0,0,0|1,1,0]=4 4427 B10R1.31 O=Cc1cnc(C(=O)O)s1 Amb18830658 [0,2,0,0,0,0|1,0,0]=3 4428 B10R1.31 O=Cc1cnc([N+](=O)[O-])s1 Amb24616475 [0,2,0,0,0,0|2,0,0]=4 4429 B10R1.31 O=Cc1csc(C(=O)O)c1 Amb18125941 [0,2,0,0,0,0|2,0,0]=4 4430 B10R1.31 O=Cc1csc(C(=O)O)n1 Amb18830656 [0,2,0,0,0,0|1,0,0]=3 4431 B10R1.31 O=Cc1csc([N+](=O)[O-])n1 Amb28384661 [0,2,0,0,0,0|2,0,0]=4 4432 B10R1.31 [C-]#[N+]c1cnc(C(C)C)s1 Amb33145534 [0,2,0,0,0,0|1,0,1]=4 4433 B10R1.31 [C-]#[N+]c1cnc(N(C)C)s1 Amb32874555 [0,2,0,0,0,0|2,0,0]=4 4434 B10R1.31 [C-]#[N+]c1csc(C(C)C)n1 Amb33147412 [0,2,0,0,0,0|1,0,1]=4 4435 B10R1.58 C=C(C)c1nc(C)c(Br)s1 Amb25224128 [0,2,0,0,0,0|1,0,0]=3 4436 B10R1.58 CC(=O)C1=NN(C)C(=O)O1 Amb27670284 [0,2,0,0,0,0|1,1,0]=4 4437 B10R1.58 CC(=O)c1cc(Br)c(Br)o1 Amb2611496 [0,2,0,0,0,0|1,1,0]=4 4438 B10R1.58 CC(=O)c1cc(Br)c(Br)s1 Amb5294896 [0,2,0,0,0,0|1,0,0]=3 4439 B10R1.58 CC(=O)c1cc(Br)c(C)s1 Amb22750463 [0,2,0,0,0,0|1,0,0]=3 4440 B10R1.58 CC(=O)c1cc(Br)c(Cl)s1 Amb22753474 [0,2,0,0,0,0|1,0,0]=3 4441 B10R1.58 CC(=O)c1cc(Br)c(N)s1 Amb18766901 [0,2,0,0,0,0|1,0,0]=3 4442 B10R1.58 CC(=O)c1cc(C)c(Br)s1 Amb22233649 [0,2,0,0,0,0|1,0,0]=3 4443 B10R1.58 CC(=O)c1cc(C)c(C)o1 Amb22229922 [0,2,0,0,0,0|1,1,0]=4 4444 B10R1.58 CC(=O)c1cc(C)c(C)s1 Amb10068529 [0,2,0,0,0,0|1,0,0]=3 4445 B10R1.58 CC(=O)c1cc(C)c(Cl)s1 Amb19888116 [0,2,0,0,0,0|1,0,0]=3 4446 B10R1.58 CC(=O)c1cc(C)c(N)o1 Amb18832099 [0,2,0,0,0,0|1,1,0]=4 4447 B10R1.58 CC(=O)c1cc(C)c(N)s1 Amb18830868 [0,2,0,0,0,0|1,0,0]=3 4448 B10R1.58 CC(=O)c1cc(C)n(C)n1 Amb18832183 [0,2,0,0,0,0|2,0,0]=4 4449 B10R1.58 CC(=O)c1cc(Cl)c(Br)s1 Amb18157043 [0,2,0,0,0,0|1,0,0]=3 4450 B10R1.58 CC(=O)c1cc(Cl)c(C)s1 Amb22753471 [0,2,0,0,0,0|1,0,0]=3 4451 B10R1.58 CC(=O)c1cc(Cl)c(Cl)s1 Amb5720050 [0,2,0,0,0,0|1,0,0]=3 4452 B10R1.58 CC(=O)c1cc(F)c(C)s1 Amb18830489 [0,2,0,0,0,0|1,0,0]=3 4453 B10R1.58 CC(=O)c1cc(I)c(I)s1 Amb22751222 [0,2,0,0,0,0|1,0,0]=3 4454 B10R1.58 CC(=O)c1cc(N)c(Br)o1 Amb18176669 [0,2,0,0,0,0|1,1,0]=4 4455 B10R1.58 CC(=O)c1cc(N)c(Br)s1 Amb18766871 [0,2,0,0,0,0|1,0,0]=3 4456 B10R1.58 CC(=O)c1cc(N)c(C)o1 Amb18832124 [0,2,0,0,0,0|1,1,0]=4 4457 B10R1.58 CC(=O)c1cc(N)c(C)s1 Amb18200380 [0,2,0,0,0,0|1,0,0]=3 4458 B10R1.58 CC(=O)c1cc(N)c(N)s1 Amb26484336 [0,2,0,0,0,0|1,0,0]=3 4459 B10R1.58 CC(=O)c1cc(N)n(C)n1 Amb24540425 [0,2,0,0,0,0|2,0,0]=4 4460 B10R1.58 CC(=O)c1cn(C)c(Br)n1 Amb29856072 [0,2,0,0,0,0|2,0,0]=4 4461 B10R1.58 CC(=O)c1cn(C)c(C)n1 Amb25348500 [0,2,0,0,0,0|2,0,0]=4 4462 B10R1.58 CC(=O)c1nc(C)c(Br)s1 Amb27839447 [0,2,0,0,0,0|0,0,0]=2 4463 B10R1.58 CC(=O)c1nc(C)c(C)o1 Amb22904305 [0,2,0,0,0,0|0,1,0]=3 4464 B10R1.58 CC(=O)c1nc(C)c(C)s1 Amb2684243 [0,2,0,0,0,0|0,0,0]=2 4465 B10R1.58 CC(=O)n1cc(F)c(F)n1 Amb28325922 [0,2,0,0,0,0|2,0,0]=4 4466 B10R1.58 CC(C)c1nc(Br)c(Br)s1 Amb20618374 [0,2,0,0,0,0|1,0,1]=4 4467 B10R1.58 CN(C)c1nc(Br)c(Br)s1 Amb20617992 [0,2,0,0,0,0|2,0,0]=4 4468 B10R1.58 CN(C)c1nc(N)c(N)s1 Amb28049918 [0,2,0,0,0,0|2,0,0]=4 4469 B10R1.58 Cc1cc(C(=O)Cl)sc1C Amb20667957 [0,2,0,0,0,0|2,0,0]=4 4470 B10R1.58 Cc1cc(C(=O)O)sc1Br Amb20622803 [0,2,0,0,0,0|2,0,0]=4 4471 B10R1.58 Cc1cc(C(=O)O)sc1C Amb1107632 [0,2,0,0,0,0|2,0,0]=4 4472 B10R1.58 Cc1cc(C(=O)O)sc1Cl Amb4056788 [0,2,0,0,0,0|2,0,0]=4 4473 B10R1.58 Cc1cc(C(=O)O)sc1N Amb18830630 [0,2,0,0,0,0|2,0,0]=4 4474 B10R1.58 Cc1cc(C(=O)[O-])sc1C Amb15691660 [0,2,0,0,0,0|2,0,0]=4 4475 B10R1.58 Cc1cc(C(N)=O)sc1C Amb8998206 [0,2,0,0,0,0|2,0,0]=4 4476 B10R1.58 Cc1nc(C(=O)Cl)oc1C Amb27434398 [0,2,0,0,0,0|1,1,0]=4 4477 B10R1.58 Cc1nc(C(=O)O)oc1Br Amb27664093 [0,2,0,0,0,0|1,1,0]=4 4478 B10R1.58 Cc1nc(C(=O)O)oc1C Amb18202775 [0,2,0,0,0,0|1,1,0]=4 4479 B10R1.58 Cc1nc(C(=O)O)sc1Br Amb16231450 [0,2,0,0,0,0|1,0,0]=3 4480 B10R1.58 Cc1nc(C(=O)O)sc1C Amb8009865 [0,2,0,0,0,0|1,0,0]=3 4481 B10R1.58 Cc1nc(C(=O)[O-])sc1Br Amb32932454 [0,2,0,0,0,0|1,0,0]=3 4482 B10R1.58 Cc1nc(C(C)Br)sc1C Amb33188731 [0,2,0,0,0,0|1,0,1]=4 4483 B10R1.58 Cc1nc(C(C)C)sc1Br Amb18671676 [0,2,0,0,0,0|1,0,1]=4 4484 B10R1.58 Cc1nc(C(C)C)sc1C Amb2687537 [0,2,0,0,0,0|1,0,1]=4 4485 B10R1.58 Cc1nc(C(C)C)sc1N Amb18279661 [0,2,0,0,0,0|1,0,1]=4 4486 B10R1.58 Cc1nc(C(C)Cl)sc1C Amb27490967 [0,2,0,0,0,0|1,0,1]=4 4487 B10R1.58 Cc1nc(C(C)N)sc1C Amb22587228 [0,2,0,0,0,0|1,0,1]=4 4488 B10R1.58 Cc1nc(C(C)N)sc1C Amb5740490 [0,2,0,0,0,0|1,0,1]=4 4489 B10R1.58 Cc1nc(C(C)O)sc1C Amb19649043 [0,2,0,0,0,0|0,0,2]=4 4490 B10R1.58 Cc1nc(C(C)S)sc1C Amb32788474 [0,2,0,0,0,0|0,1,1]=4 4491 B10R1.58 Cc1nc(C(N)=O)sc1C Amb28059173 [0,2,0,0,0,0|1,0,0]=3 4492 B10R1.58 Cc1nc(C(N)=S)sc1C Amb33250298 [0,2,0,0,0,0|1,1,0]=4 4493 B10R1.58 Cc1nc(N(C)C)sc1Br Amb20618209 [0,2,0,0,0,0|2,0,0]=4 4494 B10R1.58 Cc1nc(N(C)C)sc1C Amb24365947 [0,2,0,0,0,0|2,0,0]=4 4495 B10R1.58 Cc1nc(N(C)C)sc1O Amb33345138 [0,2,0,0,0,0|2,0,0]=4 4496 B10R1.58 Cc1nc(N(C)C)sc1S Amb33345237 [0,2,0,0,0,0|2,0,0]=4 4497 B10R1.58 Cc1nc([C@@H](C)N)sc1C Amb35671489 [0,2,0,0,0,0|1,0,1]=4 4498 B10R1.58 Cc1sc(C(=O)O)cc1Br Amb2611509 [0,2,0,0,0,0|2,0,0]=4 4499 B10R1.58 Cc1sc(C(=O)O)cc1Cl Amb23537641 [0,2,0,0,0,0|2,0,0]=4 4500 B10R1.58 Cc1sc(C(=O)O)cc1F Amb18830296 [0,2,0,0,0,0|2,0,0]=4 4501 B10R1.58 Cc1sc(C(=O)O)nc1Br Amb26397785 [0,2,0,0,0,0|1,0,0]=3 4502 B10R1.58 Cc1sc(C(=O)O)nc1O Amb24061368 [0,2,0,0,0,0|1,0,0]=3 4503 B10R1.58 Cc1sc(C(=O)[O-])nc1Br Amb32992076 [0,2,0,0,0,0|1,0,0]=3 4504 B10R1.58 Cc1sc(C(C)C)nc1Br Amb24321394 [0,2,0,0,0,0|1,0,1]=4 4505 B10R1.58 Cc1sc(C(C)C)nc1N Amb18671689 [0,2,0,0,0,0|1,0,1]=4 4506 B10R1.58 Cc1sc(C(N)=O)cc1N Amb18278394 [0,2,0,0,0,0|2,0,0]=4 4507 B10R1.58 Cc1sc(N(C)C)nc1Br Amb22497657 [0,2,0,0,0,0|2,0,0]=4 4508 B10R1.58 Cc1sc(N(C)C)nc1N Amb27453002 [0,2,0,0,0,0|2,0,0]=4 4509 B10R1.58 NC(=O)c1cc(Br)c(N)s1 Amb27793149 [0,2,0,0,0,0|2,0,0]=4 4510 B10R1.58 NC(=O)c1cc(Cl)c(Br)s1 Amb35788600 [0,2,0,0,0,0|2,0,0]=4 4511 B10R1.58 NC(=O)c1cc(F)c(Br)s1 Amb26896459 [0,2,0,0,0,0|2,0,0]=4 4512 B10R1.58 Nc1cc(C(=O)O)sc1Cl Amb2227908 [0,2,0,0,0,0|2,0,0]=4 4513 B10R1.58 Nc1sc(C(=O)O)cc1Br Amb18161045 [0,2,0,0,0,0|2,0,0]=4 4514 B10R1.58 O=C(O)c1cc(Br)c(Br)s1 Amb1159156 [0,2,0,0,0,0|2,0,0]=4 4515 B10R1.58 O=C(O)c1cc(Br)c(Cl)s1 Amb5718793 [0,2,0,0,0,0|2,0,0]=4 4516 B10R1.58 O=C(O)c1cc(Cl)c(Br)s1 Amb5719856 [0,2,0,0,0,0|2,0,0]=4 4517 B10R1.58 O=C(O)c1cc(Cl)c(Cl)s1 Amb19958451 [0,2,0,0,0,0|2,0,0]=4 4518 B10R1.58 O=C(O)c1cc(F)c(Br)s1 Amb27793867 [0,2,0,0,0,0|2,0,0]=4 4519 B10R1.58 O=C(O)c1nc(Br)c(Br)s1 Amb27615893 [0,2,0,0,0,0|1,0,0]=3 4520 B10R1.58 O=C(O)c1nc(Cl)c(Cl)s1 Amb18130067 [0,2,0,0,0,0|1,0,0]=3 4521 B10R1.59 CC(=O)C1=C(C)NC(=O)S1 Amb18830645 [0,2,0,0,0,0|2,0,0]=4 4522 B10R1.59 CC(=O)C1=CC(C)=C[C@@H]1C Amb27614931 [0,2,0,0,0,0|2,0,0]=4 4523 B10R1.59 CC(=O)C1=NC(=S)N=C1C Amb26464076 [0,2,0,0,0,0|2,0,0]=4 4524 B10R1.59 CC(=O)c1cc(C)cn1C Amb24400567 [0,2,0,0,0,0|1,0,1]=4 4525 B10R1.59 CC(=O)c1cc(N)cn1C Amb18522216 [0,2,0,0,0,0|1,0,1]=4 4526 B10R1.59 CC(=O)c1nc(Br)sc1C Amb25192360 [0,2,0,0,0,0|2,0,0]=4 4527 B10R1.59 CC(=O)c1nc(C)oc1C Amb20621132 [0,2,0,0,0,0|2,0,0]=4 4528 B10R1.59 CC(=O)c1nc(C)sc1Br Amb26061941 [0,2,0,0,0,0|2,0,0]=4 4529 B10R1.59 CC(=O)c1nc(C)sc1C Amb20668461 [0,2,0,0,0,0|2,0,0]=4 4530 B10R1.59 CC(=O)c1nc(C)sc1C Amb434227 [0,2,0,0,0,0|2,0,0]=4 4531 B10R1.59 CC(=O)c1nc(N)nn1C Amb27186256 [0,2,0,0,0,0|2,0,0]=4 4532 B10R1.59 CC(=O)c1nc(N)oc1C Amb27186335 [0,2,0,0,0,0|2,0,0]=4 4533 B10R1.59 CC(=O)c1nc(N)sc1C Amb10608769 [0,2,0,0,0,0|2,0,0]=4 4534 B10R1.59 CC(=O)c1nc(N)sc1C Amb19892816 [0,2,0,0,0,0|2,0,0]=4 4535 B10R1.59 CC(=O)c1nc(N)sc1C Amb22500856 [0,2,0,0,0,0|2,0,0]=4 4536 B10R1.59 CC(=O)c1nn(C)cc1C Amb24524652 [0,2,0,0,0,0|2,0,0]=4 4537 B10R1.59 CC(=O)c1nn(C)cc1C Amb29837895 [0,2,0,0,0,0|2,0,0]=4 4538 B10R1.59 CC(=O)c1nn(C)cc1Cl Amb1946509 [0,2,0,0,0,0|2,0,0]=4 4539 B10R1.59 CC(=O)c1nn(C)cc1I Amb20619818 [0,2,0,0,0,0|2,0,0]=4 4540 B10R1.59 CC(=O)c1nn(C)cc1N Amb33132837 [0,2,0,0,0,0|2,0,0]=4 4541 B10R1.59 CC(=O)c1nn(C)cc1O Amb23598841 [0,2,0,0,0,0|2,0,0]=4 4542 B10R1.59 CC(=O)c1oc(C)cc1C Amb5494021 [0,2,0,0,0,0|1,1,0]=4 4543 B10R1.59 CC(=O)c1oc(C)cc1N Amb18832123 [0,2,0,0,0,0|1,1,0]=4 4544 B10R1.59 CC(=O)c1oc(N)cc1C Amb18202973 [0,2,0,0,0,0|1,1,0]=4 4545 B10R1.59 CC(=O)c1sc(Br)cc1Br Amb2611762 [0,2,0,0,0,0|1,0,0]=3 4546 B10R1.59 CC(=O)c1sc(Br)cc1Cl Amb22753475 [0,2,0,0,0,0|1,0,0]=3 4547 B10R1.59 CC(=O)c1sc(Br)nc1Br Amb22900903 [0,2,0,0,0,0|2,0,0]=4 4548 B10R1.59 CC(=O)c1sc(Br)nc1C Amb17471724 [0,2,0,0,0,0|2,0,0]=4 4549 B10R1.59 CC(=O)c1sc(C)cc1Br Amb18768493 [0,2,0,0,0,0|1,0,0]=3 4550 B10R1.59 CC(=O)c1sc(C)cc1F Amb18830488 [0,2,0,0,0,0|1,0,0]=3 4551 B10R1.59 CC(=O)c1sc(C)cc1N Amb18146867 [0,2,0,0,0,0|1,0,0]=3 4552 B10R1.59 CC(=O)c1sc(C)cc1O Amb18830767 [0,2,0,0,0,0|1,0,0]=3 4553 B10R1.59 CC(=O)c1sc(C)nc1Br Amb28124932 [0,2,0,0,0,0|2,0,0]=4 4554 B10R1.59 CC(=O)c1sc(C)nc1C Amb2099679 [0,2,0,0,0,0|2,0,0]=4 4555 B10R1.59 CC(=O)c1sc(C)nc1C Amb2720534 [0,2,0,0,0,0|2,0,0]=4 4556 B10R1.59 CC(=O)c1sc(C)nc1N Amb18830747 [0,2,0,0,0,0|2,0,0]=4 4557 B10R1.59 CC(=O)c1sc(Cl)cc1Cl Amb22753472 [0,2,0,0,0,0|1,0,0]=3 4558 B10R1.59 CC(=O)c1sc(Cl)nc1C Amb26921159 [0,2,0,0,0,0|2,0,0]=4 4559 B10R1.59 CC(=O)c1sc(Cl)nc1Cl Amb27411525 [0,2,0,0,0,0|2,0,0]=4 4560 B10R1.59 CC(=O)c1sc(F)cc1Br Amb28049473 [0,2,0,0,0,0|1,0,0]=3 4561 B10R1.59 CC(=O)c1sc(F)cc1F Amb28246589 [0,2,0,0,0,0|1,0,0]=3 4562 B10R1.59 CC(=O)c1sc(N)cc1C Amb18200375 [0,2,0,0,0,0|1,0,0]=3 4563 B10R1.59 CC(=O)c1sc(N)nc1C Amb4256137 [0,2,0,0,0,0|2,0,0]=4 4564 B10R1.59 CC(=O)c1sc(N)nc1C Amb6336139 [0,2,0,0,0,0|2,0,0]=4 4565 B10R1.59 CC(=O)c1sc(S)nc1N Amb18824376 [0,2,0,0,0,0|2,0,0]=4 4566 B10R1.59 CC(=O)n1nc(C)cc1C Amb2436435 [0,2,0,0,0,0|2,0,0]=4 4567 B10R1.59 CC(=O)n1nc(F)cc1F Amb27985277 [0,2,0,0,0,0|2,0,0]=4 4568 B10R1.59 CC1=CC(C)=N\C1=C(/C)O Amb27800611 [0,2,0,0,0,0|1,0,1]=4 4569 B10R1.59 Cc1cc(Br)c(C(=O)O)s1 Amb33547929 [0,2,0,0,0,0|2,0,0]=4 4570 B10R1.59 Cc1cc(Br)sc1C(=O)O Amb13883762 [0,2,0,0,0,0|2,0,0]=4 4571 B10R1.59 Cc1cc(C)c(C(=O)Cl)s1 Amb26980845 [0,2,0,0,0,0|2,0,0]=4 4572 B10R1.59 Cc1cc(C)c(C(=O)O)s1 Amb33533406 [0,2,0,0,0,0|2,0,0]=4 4573 B10R1.59 Cc1cc(Cl)c(C(=O)O)s1 Amb33543723 [0,2,0,0,0,0|2,0,0]=4 4574 B10R1.59 Cc1cc(F)sc1C(=O)O Amb33743832 [0,2,0,0,0,0|2,0,0]=4 4575 B10R1.59 Cc1cc(N)sc1C(=O)O Amb18830647 [0,2,0,0,0,0|2,0,0]=4 4576 B10R1.59 Cc1cc(N)sc1C(N)=O Amb17096059 [0,2,0,0,0,0|2,0,0]=4 4577 B10R1.59 Cc1cn(C)c(C(=O)O)n1 Amb33811891 [0,2,0,0,0,0|2,0,0]=4 4578 B10R1.59 Cn1cc(Br)nc1C(=O)O Amb24759269 [0,2,0,0,0,0|2,0,0]=4 4579 B10R1.59 Cn1cc(Cl)nc1C(=O)O Amb24538093 [0,2,0,0,0,0|2,0,0]=4 4580 B10R1.59 Cn1cc(N)nc1C(=O)O Amb25340017 [0,2,0,0,0,0|2,0,0]=4 4581 B10R1.59 Cn1cc(N)nc1C(N)=O Amb24556918 [0,2,0,0,0,0|2,0,0]=4 4582 B10R1.59 NC(=O)c1sc(Br)cc1N Amb24443867 [0,2,0,0,0,0|2,0,0]=4 4583 B10R1.59 Nc1cc(Br)sc1C(=O)O Amb18117969 [0,2,0,0,0,0|2,0,0]=4 4584 B10R1.59 O=C(O)c1sc(Br)cc1Br Amb8486046 [0,2,0,0,0,0|2,0,0]=4 4585 B10R1.59 O=C(O)c1sc(Br)cc1F Amb25293843 [0,2,0,0,0,0|2,0,0]=4 4586 B10R1.59 O=C(O)c1sc(Br)cc1I Amb25786040 [0,2,0,0,0,0|2,0,0]=4 4587 B10R1.59 O=C(O)c1sc(Cl)cc1Br Amb22755141 [0,2,0,0,0,0|2,0,0]=4 4588 B10R1.59 O=C(O)c1sc(Cl)cc1Cl Amb26392244 [0,2,0,0,0,0|2,0,0]=4 4589 B10R1.59 O=C(O)c1sc(Cl)cc1O Amb27231791 [0,2,0,0,0,0|2,0,0]=4 4590 B10R1.59 O=C(O)c1sc(I)cc1I Amb28315890 [0,2,0,0,0,0|2,0,0]=4 4591 B10R1.194 CC(=O)C1=NOC(=O)C1C Amb27200655 [0,2,0,0,0,0|2,0,0]=4 4592 B10R1.194 CC(=O)c1ccc(C)n1C Amb18203057 [0,2,0,0,0,0|1,0,1]=4 4593 B10R1.194 CC(=O)c1ccc(F)n1C Amb24556616 [0,2,0,0,0,0|1,0,1]=4 4594 B10R1.194 CC(=O)c1ncc(Br)n1C Amb28251387 [0,2,0,0,0,0|1,0,0]=3 4595 B10R1.194 CC(=O)c1ncc(Cl)n1C Amb25178276 [0,2,0,0,0,0|1,0,0]=3 4596 B10R1.194 CC(=O)c1ncn(C)c1C Amb27590367 [0,2,0,0,0,0|2,0,0]=4 4597 B10R1.194 CC(=O)c1ncn(C)c1N Amb25876218 [0,2,0,0,0,0|2,0,0]=4 4598 B10R1.194 CC(=O)c1noc(C)c1C Amb27459346 [0,2,0,0,0,0|2,0,0]=4 4599 B10R1.194 CC(=O)c1noc(C)c1Cl Amb25132726 [0,2,0,0,0,0|2,0,0]=4 4600 B10R1.194 CC(=O)c1scc(Br)c1Br Amb6384241 [0,2,0,0,0,0|1,0,0]=3 4601 B10R1.194 CC(=O)c1scc(C)c1Br Amb33433469 [0,2,0,0,0,0|1,0,0]=3 4602 B10R1.194 CC(=O)c1scc(C)c1C Amb18830970 [0,2,0,0,0,0|1,0,0]=3 4603 B10R1.194 CC(=O)c1scc(C)c1Cl Amb25937849 [0,2,0,0,0,0|1,0,0]=3 4604 B10R1.194 CC(=O)c1scc(C)c1N Amb26535501 [0,2,0,0,0,0|1,0,0]=3 4605 B10R1.194 CC(=O)c1scc(Cl)c1Cl Amb5720905 [0,2,0,0,0,0|1,0,0]=3 4606 B10R1.194 CC(=O)c1snc(C)c1Br Amb27826337 [0,2,0,0,0,0|2,0,0]=4 4607 B10R1.194 Cc1c(Br)csc1C(=O)O Amb2685345 [0,2,0,0,0,0|2,0,0]=4 4608 B10R1.194 Cc1c(Br)csc1C(=O)O Amb29599234 [0,2,0,0,0,0|2,0,0]=4 4609 B10R1.194 Cc1c(I)csc1C(=O)O Amb22755166 [0,2,0,0,0,0|2,0,0]=4 4610 B10R1.194 Cc1c(N)csc1C(=O)O Amb18830627 [0,2,0,0,0,0|2,0,0]=4 4611 B10R1.194 Cc1cnc(C(=O)O)n1C Amb25109322 [0,2,0,0,0,0|2,0,0]=4 4612 B10R1.194 Cc1csc(C(=O)Cl)c1Cl Amb2724299 [0,2,0,0,0,0|2,0,0]=4 4613 B10R1.194 Cc1csc(C(=O)O)c1Br Amb22755101 [0,2,0,0,0,0|2,0,0]=4 4614 B10R1.194 Cc1csc(C(=O)O)c1C Amb18830772 [0,2,0,0,0,0|2,0,0]=4 4615 B10R1.194 Cc1csc(C(=O)O)c1Cl Amb2686259 [0,2,0,0,0,0|2,0,0]=4 4616 B10R1.194 Cc1csc(C(=O)O)c1F Amb27965752 [0,2,0,0,0,0|2,0,0]=4 4617 B10R1.194 Cc1csc(C(=O)O)c1I Amb22754613 [0,2,0,0,0,0|2,0,0]=4 4618 B10R1.194 Cc1csc(C(=O)O)c1N Amb21857967 [0,2,0,0,0,0|2,0,0]=4 4619 B10R1.194 Cc1csc(C(=O)[O-])c1I Amb2691833 [0,2,0,0,0,0|2,0,0]=4 4620 B10R1.194 Cc1csc(C(N)=O)c1N Amb20670064 [0,2,0,0,0,0|2,0,0]=4 4621 B10R1.194 Cn1c(Br)cnc1C(=O)O Amb28068567 [0,2,0,0,0,0|2,0,0]=4 4622 B10R1.194 Cn1c(Br)cnc1C(=O)[O-] Amb33339141 [0,2,0,0,0,0|2,0,0]=4 4623 B10R1.194 Cn1c(Cl)cnc1C(=O)O Amb27641513 [0,2,0,0,0,0|2,0,0]=4 4624 B10R1.194 Cn1c(Cl)cnc1C(=O)[O-] Amb32668954 [0,2,0,0,0,0|2,0,0]=4 4625 B10R1.194 Nc1c(Br)csc1C(=O)O Amb28397999 [0,2,0,0,0,0|2,0,0]=4 4626 B10R1.194 Nc1c(Cl)csc1C(=O)O Amb33804095 [0,2,0,0,0,0|2,0,0]=4 4627 B10R1.194 O=C(O)c1scc(Br)c1Br Amb8486048 [0,2,0,0,0,0|2,0,0]=4 4628 B10R1.194 O=C(O)c1scc(Br)c1O Amb25103760 [0,2,0,0,0,0|2,0,0]=4 4629 B10R1.194 O=C(O)c1scc(Cl)c1Cl Amb5720906 [0,2,0,0,0,0|2,0,0]=4 4630 B10R1.194 O=C(O)c1scc(I)c1I Amb2611684 [0,2,0,0,0,0|2,0,0]=4 4631 B10R1.39 C=Cc1ccsc1C(C)=O Amb32682053 [0,2,0,0,0,0|1,0,0]=3 4632 B10R1.39 C=Cn1cccc1C(C)=O Amb27950376 [0,2,0,0,0,0|1,0,1]=4 4633 B10R1.39 C=Cn1ccnc1C(C)=O Amb27852798 [0,2,0,0,0,0|1,0,0]=3 4634 B10R1.39 CC(=O)C1=CC=C\C1=C/O Amb17593449 [0,2,0,0,0,0|2,0,0]=4 4635 B10R1.39 CC(=O)c1nocc1C#N Amb2434206 [0,2,0,0,0,0|2,0,0]=4 4636 B10R1.39 CC(=O)c1occc1CBr Amb27849270 [0,2,0,0,0,0|1,1,0]=4 4637 B10R1.39 CC(=O)c1sccc1C#N Amb27165146 [0,2,0,0,0,0|1,0,0]=3 4638 B10R1.39 CC(=O)c1sccc1C=O Amb27811046 [0,2,0,0,0,0|1,0,0]=3 4639 B10R1.39 CCc1ccsc1C(=O)O Amb5492701 [0,2,0,0,0,0|2,0,0]=4 4640 B10R1.39 CCc1ccsc1C(C)=O Amb18200627 [0,2,0,0,0,0|1,0,0]=3 4641 B10R1.39 CCc1ccsc1C(N)=O Amb18177398 [0,2,0,0,0,0|2,0,0]=4 4642 B10R1.39 CCc1ncsc1C(C)=O Amb18207281 [0,2,0,0,0,0|2,0,0]=4 4643 B10R1.39 CCn1cccc1C(C)=O Amb2684247 [0,2,0,0,0,0|1,0,1]=4 4644 B10R1.39 CCn1ccnc1C(=O)[O-] Amb474678 [0,2,0,0,0,0|2,0,0]=4 4645 B10R1.39 CCn1ccnc1C(C)=O Amb22270993 [0,2,0,0,0,0|1,0,0]=3 4646 B10R1.39 CCn1ccnc1C(N)=O Amb28044049 [0,2,0,0,0,0|2,0,0]=4 4647 B10R1.39 CCn1cnnc1C(C)=O Amb32993754 [0,2,0,0,0,0|2,0,0]=4 4648 B10R1.39 CCn1ncnc1C(C)=O Amb24076519 [0,2,0,0,0,0|2,0,0]=4 4649 B10R1.39 COc1ccoc1C(C)=O Amb18831941 [0,2,0,0,0,0|1,1,0]=4 4650 B10R1.39 COc1ccsc1C(=O)Cl Amb25299101 [0,2,0,0,0,0|2,0,0]=4 4651 B10R1.39 COc1ccsc1C(=O)O Amb2434046 [0,2,0,0,0,0|2,0,0]=4 4652 B10R1.39 COc1ccsc1C(C)=O Amb18830768 [0,2,0,0,0,0|1,0,0]=3 4653 B10R1.39 COc1ccsc1C(N)=O Amb9677680 [0,2,0,0,0,0|2,0,0]=4 4654 B10R1.39 CSc1ccoc1C(C)=O Amb18677515 [0,2,0,0,0,0|1,1,0]=4 4655 B10R1.39 CSc1ccsc1C(=O)O Amb18126750 [0,2,0,0,0,0|2,0,0]=4 4656 B10R1.39 CSc1ccsc1C(C)=O Amb2614469 [0,2,0,0,0,0|1,0,0]=3 4657 B10R1.39 CSc1ccsc1C(N)=O Amb24432455 [0,2,0,0,0,0|2,0,0]=4 4658 B10R1.39 N#Cc1ccsc1C(=O)Cl Amb27878539 [0,2,0,0,0,0|2,0,0]=4 4659 B10R1.39 N#Cc1ccsc1C(=O)O Amb13951874 [0,2,0,0,0,0|2,0,0]=4 4660 B10R1.39 NCc1ccsc1C(=O)O Amb25124938 [0,2,0,0,0,0|2,0,0]=4 4661 B10R1.39 NCc1ccsc1C(=O)O Amb31156637 [0,2,0,0,0,0|2,0,0]=4 4662 B10R1.39 O=C(O)c1sccc1CBr Amb28068237 [0,2,0,0,0,0|2,0,0]=4 4663 B10R1.39 O=C(O)c1sccc1CCl Amb18648005 [0,2,0,0,0,0|2,0,0]=4 4664 B10R1.39 O=C(O)c1sccc1CO Amb27174146 [0,2,0,0,0,0|2,0,0]=4 4665 B10R1.39 O=Cc1ccsc1C(=O)O Amb8439401 [0,2,0,0,0,0|2,0,0]=4 4666 B10R1.192 CC(=O)c1c(C)ccn1C Amb24546040 [0,2,0,0,0,0|1,0,1]=4 4667 B10R1.192 CC(=O)c1c(N)ccn1C Amb18832186 [0,2,0,0,0,0|1,0,1]=4 4668 B8R1.4 CC1=CN=CC(=O)N1 Amb20240903 [0,0,1,1,0,0|1,1,0]=4 4669 B8R1.4 CC1=CN=NC(=O)C1 Amb28984085 [0,0,1,1,0,0|2,0,0]=4 4670 B8R1.4 Cc1cccc(S)c1 Amb2690595 [0,0,1,1,0,0|2,0,0]=4 4671 B8R1.4 Cc1cccc(S)n1 Amb17943113 [0,0,1,1,0,0|2,0,0]=4 4672 B8R1.4 Cc1cncc(Br)c1 Amb21964859 [0,0,1,1,0,0|2,0,0]=4 4673 B8R1.4 Cc1cncc(Br)c1 Amb2610070 [0,0,1,1,0,0|2,0,0]=4 4674 B8R1.4 Cc1cncc(Br)n1 Amb10068364 [0,0,1,1,0,0|2,0,0]=4 4675 B8R1.4 Cc1cncc(C)c1 Amb8387099 [0,0,1,1,0,0|2,0,0]=4 4676 B8R1.4 Cc1cncc(C)n1 Amb8387600 [0,0,1,1,0,0|2,0,0]=4 4677 B8R1.4 Cc1cncc(Cl)c1 Amb10602291 [0,0,1,1,0,0|2,0,0]=4 4678 B8R1.4 Cc1cncc(Cl)n1 Amb2725017 [0,0,1,1,0,0|2,0,0]=4 4679 B8R1.4 Cc1cncc(F)c1 Amb8393037 [0,0,1,1,0,0|2,0,0]=4 4680 B8R1.4 Cc1cncc(I)c1 Amb27870759 [0,0,1,1,0,0|2,0,0]=4 4681 B8R1.4 Cc1cncc(I)n1 Amb28129757 [0,0,1,1,0,0|2,0,0]=4 4682 B8R1.4 Cc1cncc(N)c1 Amb10071116 [0,0,1,1,0,0|2,0,0]=4 4683 B8R1.4 Cc1cncc(N)c1 Amb2447680 [0,0,1,1,0,0|2,0,0]=4 4684 B8R1.4 Cc1cncc(N)n1 Amb10071574 [0,0,1,1,0,0|2,0,0]=4 4685 B8R1.4 Cc1cncc(O)c1 Amb3978939 [0,0,1,1,0,0|1,1,0]=4 4686 B8R1.4 Cc1cncc(O)n1 Amb10599623 [0,0,1,1,0,0|1,1,0]=4 4687 B8R1.4 Cc1cncc(S)c1 Amb24062447 [0,0,1,1,0,0|1,0,0]=3 4688 B8R1.4 Cc1cnnc(S)n1 Amb27766491 [0,0,1,1,0,0|2,0,0]=4 4689 B8R1.4 Fc1cncc(S)c1 Amb28141866 [0,0,1,1,0,0|1,0,1]=4 4690 B8R1.4 O=C1C=C=CC(=O)C1 Amb27486115 [0,0,1,1,0,0|1,1,0]=4 4691 B8R1.4 O=C1C=NC=C(Br)N1 Amb22499624 [0,0,1,1,0,0|2,0,0]=4 4692 B8R1.4 O=C1C=NC=C(Cl)N1 Amb20527586 [0,0,1,1,0,0|2,0,0]=4 4693 B8R1.4 O=C1C=NC=C(F)N1 Amb22387081 [0,0,1,1,0,0|2,0,0]=4 4694 B8R1.4 Sc1cncc(Br)c1 Amb22499840 [0,0,1,1,0,0|1,0,1]=4 4695 B8R1.22 O=C1C=CC=CCC1 Amb17593120 [0,0,1,1,0,0|2,0,0]=4 4696 B8R1.5 CC1=NC=CNC1=O Amb22436791 [0,0,1,1,0,0|2,0,0]=4 4697 B8R1.5 CC1=NC=CNC1=O Amb32653329 [0,0,1,1,0,0|2,0,0]=4 4698 B8R1.5 Cc1ccccc1S Amb2690594 [0,0,1,1,0,0|2,0,0]=4 4699 B8R1.5 Cc1cccnc1Br Amb2447402 [0,0,1,1,0,0|2,0,0]=4 4700 B8R1.5 Cc1cccnc1C Amb8514941 [0,0,1,1,0,0|2,0,0]=4 4701 B8R1.5 Cc1cccnc1Cl Amb3940000 [0,0,1,1,0,0|2,0,0]=4 4702 B8R1.5 Cc1cccnc1F Amb2447290 [0,0,1,1,0,0|2,0,0]=4 4703 B8R1.5 Cc1cccnc1I Amb10069327 [0,0,1,1,0,0|2,0,0]=4 4704 B8R1.5 Cc1cccnc1N Amb16233775 [0,0,1,1,0,0|2,0,0]=4 4705 B8R1.5 Cc1cccnc1N Amb2694490 [0,0,1,1,0,0|2,0,0]=4 4706 B8R1.5 Cc1cccnc1O Amb2389971 [0,0,1,1,0,0|1,1,0]=4 4707 B8R1.5 Cc1cccnc1S Amb10573534 [0,0,1,1,0,0|1,0,0]=3 4708 B8R1.5 Cc1ncccc1S Amb24062554 [0,0,1,1,0,0|2,0,0]=4 4709 B8R1.5 Cc1nccnc1Br Amb15701217 [0,0,1,1,0,0|2,0,0]=4 4710 B8R1.5 Cc1nccnc1C Amb8513879 [0,0,1,1,0,0|2,0,0]=4 4711 B8R1.5 Cc1nccnc1Cl Amb17515939 [0,0,1,1,0,0|2,0,0]=4 4712 B8R1.5 Cc1nccnc1F Amb24686578 [0,0,1,1,0,0|2,0,0]=4 4713 B8R1.5 Cc1nccnc1I Amb22751685 [0,0,1,1,0,0|2,0,0]=4 4714 B8R1.5 Cc1nccnc1N Amb16233707 [0,0,1,1,0,0|2,0,0]=4 4715 B8R1.5 Cc1nccnc1N Amb31217478 [0,0,1,1,0,0|2,0,0]=4 4716 B8R1.5 Cc1nccnc1S Amb22299180 [0,0,1,1,0,0|1,0,0]=3 4717 B8R1.5 Fc1cccnc1S Amb26943430 [0,0,1,1,0,0|1,0,1]=4 4718 B8R1.5 NC1=NC=CNC1=O Amb22388516 [0,0,1,1,0,0|2,0,0]=4 4719 B8R1.5 NC1=NN=CCC1=O Amb27468610 [0,0,1,1,0,0|2,0,0]=4 4720 B8R1.5 Nc1cccnc1S Amb8929758 [0,0,1,1,0,0|1,0,1]=4 4721 B8R1.5 O=C1C=CC=NC1=O Amb27802733 [0,0,1,1,0,0|0,1,1]=4 4722 B8R1.5 O=C1NC=CC=C1S Amb25261155 [0,0,1,1,0,0|2,0,0]=4 4723 B8R1.5 O=C1NC=CN=C1Cl Amb19148377 [0,0,1,1,0,0|2,0,0]=4 4724 B8R1.5 O=C1NC=CN=C1I Amb28316181 [0,0,1,1,0,0|2,0,0]=4 4725 B8R1.5 O=C1NC=CN=C1S Amb28316182 [0,0,1,1,0,0|1,0,0]=3 4726 B8R1.5 Oc1cccnc1S Amb2698064 [0,0,1,1,0,0|0,0,2]=4 4727 B8R1.5 Sc1ncccc1Br Amb33538374 [0,0,1,1,0,0|1,0,1]=4 4728 B8R1.5 Sc1ncccc1Cl Amb2371701 [0,0,1,1,0,0|1,0,1]=4 4729 B8R1.18 C=C1NC(=O)C(=O)S1 Amb27794765 [0,0,1,1,0,0|2,0,0]=4 4730 B8R2.11 O=C1c2ccsc21 Amb27802559 [1,0,0,1,0,0|1,0,0]=3 4731 B10R2.320 O=C1Cc2ccccc21 Amb8395940 [0,0,0,1,0,1|2,0,0]=4 4732 B10R2.320 O=C1Sc2ncccc21 Amb28342602 [0,0,0,1,0,1|2,0,0]=4 4733 B10R2.2 Cc1cc2sccn2n1 Amb24478619 [0,0,0,1,0,1|1,0,1]=4 4734 B10R2.2 Cc1cn2ccsc2n1 Amb385307 [0,0,0,1,0,1|1,0,1]=4 4735 B10R2.2 Cc1nn2ccnc2s1 Amb27244330 [0,0,0,1,0,1|2,0,0]=4 4736 B10R2.2 O=C1CN2N=CSC2=N1 Amb29850690 [0,0,0,1,0,1|1,0,1]=4 4737 B10R2.2 O=C1Cc2ccnn2C1 Amb33714898 [0,0,0,1,0,1|2,0,0]=4 4738 B10R2.2 O=C1Cc2ccoc2C1 Amb18203345 [0,0,0,1,0,1|1,1,0]=4 4739 B10R2.2 O=C1Cc2ccsc2C1 Amb18203007 [0,0,0,1,0,1|1,0,0]=3 4740 B10R2.2 O=C1Cc2sccc2S1 Amb27842152 [0,0,0,1,0,1|2,0,0]=4 4741 B10R2.2 O=C1Nc2ccsc2N1 Amb22899034 [0,0,0,1,0,1|2,0,0]=4 4742 B10R2.5 NC1CC1c2nccs2 Amb28342912 [0,0,0,1,0,1|1,0,1]=4 4743 B10R2.5 N[C@@H]1C[C@H]1c2nccs2 Amb33311573 [0,0,0,1,0,1|1,0,1]=4 4744 B10R2.193 c1csc(CC2CC2)n1 Amb28325001 [0,0,0,1,0,1|1,0,1]=4 4745 B10R2.193 c1csc(CC2CO2)n1 Amb33429874 [0,0,0,1,0,1|0,0,2]=4 4746 B10R2.16 CC1(c2nccs2)CO1 Amb24070152 [0,1,0,1,0,0|0,0,2]=4 4747 B10R2.16 NC1(c2nccs2)CC1 Amb18202843 [0,1,0,1,0,0|1,0,1]=4 4748 B10R2.16 OC1(c2nccs2)CC1 Amb25278643 [0,1,0,1,0,0|0,0,2]=4 4749 B10R2.32 O=C1CCC2C=CC=C12 Amb9836335 [0,1,0,1,0,0|2,0,0]=4 4750 B10R2.32 O=C1CCc2ccoc21 Amb27246670 [0,1,0,1,0,0|1,1,0]=4 4751 B10R2.32 O=C1CCc2ccsc21 Amb18203008 [0,1,0,1,0,0|1,0,0]=3 4752 B10R2.32 O=C1CCc2conc21 Amb28135012 [0,1,0,1,0,0|2,0,0]=4 4753 B10R2.32 O=C1CCn2cccc21 Amb1154029 [0,1,0,1,0,0|1,0,1]=4 4754 B10R2.32 O=C1CCn2ccnc21 Amb24070855 [0,1,0,1,0,0|1,0,0]=3 4755 B10R2.32 O=C1CCn2cnnc21 Amb23449859 [0,1,0,1,0,0|2,0,0]=4 4756 B10R2.32 O=C1CNc2ccoc21 Amb18832975 [0,1,0,1,0,0|1,1,0]=4 4757 B10R2.32 O=C1CNc2ccsc21 Amb18202968 [0,1,0,1,0,0|1,0,0]=3 4758 B10R2.32 O=C1NCc2ccoc21 Amb18832974 [0,1,0,1,0,0|1,1,0]=4 4759 B10R2.32 O=C1NCc2ccsc21 Amb18202967 [0,1,0,1,0,0|1,0,0]=3 4760 B10R2.32 O=C1OCc2conc21 Amb35751406 [0,1,0,1,0,0|2,0,0]=4 4761 B10R2.136 c1csc(C2CCC2)n1 Amb28208136 [0,1,0,1,0,0|1,0,1]=4 4762 B10R2.136 c1csc(C2CCN2)n1 Amb26575876 [0,1,0,1,0,0|1,0,1]=4 4763 B10R2.136 c1csc(C2CNC2)n1 Amb19516814 [0,1,0,1,0,0|1,0,1]=4 4764 B10R2.136 c1csc(C2CNC2)n1 Amb22587313 [0,1,0,1,0,0|1,0,1]=4 4765 B10R2.136 c1csc(C2CSC2)n1 Amb35689022 [0,1,0,1,0,0|0,1,1]=4 4766 B10R2.14 Brc1cnc(C2CC2)s1 Amb10600226 [0,1,0,1,0,0|1,0,1]=4 4767 B10R2.14 Brc1cnc(C2CO2)s1 Amb33434998 [0,1,0,1,0,0|0,0,2]=4 4768 B10R2.14 Brc1cnc([C@@H]2CO2)s1 Amb33435125 [0,1,0,1,0,0|0,0,2]=4 4769 B10R2.14 Brc1cnc([C@H]2CO2)s1 Amb33434837 [0,1,0,1,0,0|0,0,2]=4 4770 B10R2.14 Brc1csc(C2CC2)n1 Amb10599927 [0,1,0,1,0,0|1,0,1]=4 4771 B10R2.14 Cc1cnc(C2CC2)s1 Amb27591196 [0,1,0,1,0,0|1,0,1]=4 4772 B10R2.14 Cc1csc(C2CC2)n1 Amb23539276 [0,1,0,1,0,0|1,0,1]=4 4773 B10R2.14 Cc1csc(C2CO2)n1 Amb27667998 [0,1,0,1,0,0|0,0,2]=4 4774 B10R2.14 Clc1cnc(C2CC2)s1 Amb27233228 [0,1,0,1,0,0|1,0,1]=4 4775 B10R2.14 Ic1cnc(C2CC2)s1 Amb27424643 [0,1,0,1,0,0|1,0,1]=4 4776 B10R2.14 Nc1cnc(C2CC2)s1 Amb10600227 [0,1,0,1,0,0|1,0,1]=4 4777 B10R2.14 Nc1csc(C2CC2)n1 Amb10599928 [0,1,0,1,0,0|1,0,1]=4 4778 B10R2.14 Oc1cnc(C2CC2)s1 Amb10600228 [0,1,0,1,0,0|1,0,1]=4 4779 B10R2.14 Oc1csc(C2CC2)n1 Amb10599929 [0,1,0,1,0,0|1,0,1]=4 4780 B6R1.11 O=C(O)C1C=C1 Amb27185565 [0,0,0,0,2,0|1,0,1]=4 4781 B8R0.16 C=C\C(=N/O)NC(C)=O Amb25249213 [0,0,1,0,0,1|2,0,0]=4 4782 B8R1.2 C=Cc1ccccn1 Amb6600549 [1,0,0,0,0,1|1,0,1]=4 4783 B8R1.2 C=Cc1cccnc1 Amb33544464 [1,0,0,0,0,1|1,0,1]=4 4784 B8R1.2 C=Cc1cccnn1 Amb25026421 [1,0,0,0,0,1|1,0,1]=4 4785 B8R1.2 C=Cc1ccncn1 Amb24056360 [1,0,0,0,0,1|1,0,1]=4 4786 B8R1.2 C=Cc1cnccn1 Amb2695475 [1,0,0,0,0,1|1,0,1]=4 4787 B8R1.2 C=Cc1ncccn1 Amb23411991 [1,0,0,0,0,1|1,0,1]=4 4788 B8R1.2 CCc1ccccn1 Amb6608978 [1,0,0,0,0,1|1,0,1]=4 4789 B8R1.2 CCc1cccnc1 Amb4037096 [1,0,0,0,0,1|1,0,1]=4 4790 B8R1.2 CCc1cccnn1 Amb28290156 [1,0,0,0,0,1|1,0,1]=4 4791 B8R1.2 CCc1ccncn1 Amb20242304 [1,0,0,0,0,1|1,0,1]=4 4792 B8R1.2 CCc1cnccn1 Amb6374282 [1,0,0,0,0,1|1,0,1]=4 4793 B8R1.2 CCc1ncccn1 Amb33544267 [1,0,0,0,0,1|1,0,1]=4 4794 B8R1.2 CNc1ccccn1 Amb3429849 [1,0,0,0,0,1|2,0,0]=4 4795 B8R1.2 CNc1cccnc1 Amb8396762 [1,0,0,0,0,1|2,0,0]=4 4796 B8R1.2 CNc1cccnn1 Amb18947507 [1,0,0,0,0,1|2,0,0]=4 4797 B8R1.2 CNc1ccncn1 Amb18944730 [1,0,0,0,0,1|2,0,0]=4 4798 B8R1.2 CNc1cnccn1 Amb1102655 [1,0,0,0,0,1|2,0,0]=4 4799 B8R1.2 CNc1ncccn1 Amb2609521 [1,0,0,0,0,1|2,0,0]=4 4800 B8R1.2 CNc1nccnn1 Amb22755635 [1,0,0,0,0,1|2,0,0]=4 4801 B8R1.2 COc1ccccn1 Amb4037280 [1,0,0,0,0,1|2,0,0]=4 4802 B8R1.2 COc1cccnc1 Amb8517634 [1,0,0,0,0,1|2,0,0]=4 4803 B8R1.2 COc1cccnn1 Amb5751228 [1,0,0,0,0,1|2,0,0]=4 4804 B8R1.2 COc1ccncn1 Amb15692928 [1,0,0,0,0,1|2,0,0]=4 4805 B8R1.2 COc1cnccn1 Amb2689275 [1,0,0,0,0,1|2,0,0]=4 4806 B8R1.2 COc1ncccn1 Amb2609513 [1,0,0,0,0,1|2,0,0]=4 4807 B8R1.2 CSc1ccccn1 Amb8392843 [1,0,0,0,0,1|2,0,0]=4 4808 B8R1.2 CSc1cccnc1 Amb24087396 [1,0,0,0,0,1|2,0,0]=4 4809 B8R1.2 CSc1ccncn1 Amb27958790 [1,0,0,0,0,1|2,0,0]=4 4810 B8R1.2 CSc1cnccn1 Amb2689740 [1,0,0,0,0,1|2,0,0]=4 4811 B8R1.2 CSc1ncccn1 Amb22295856 [1,0,0,0,0,1|2,0,0]=4 4812 B8R1.2 CSc1ncccn1 Amb2455862 [1,0,0,0,0,1|2,0,0]=4 4813 B8R1.2 CSc1nccnn1 Amb6374154 [1,0,0,0,0,1|2,0,0]=4 4814 B8R1.2 CSc1ncncn1 Amb27834277 [1,0,0,0,0,1|2,0,0]=4 4815 B8R1.2 O=CC1=CC=CSC1 Amb28194907 [1,0,0,0,0,1|1,0,0]=3 4816 B8R1.2 O=CC1=CCC=CO1 Amb27437201 [1,0,0,0,0,1|1,1,0]=4 4817 B8R1.2 O=CC1=CNC=CC1 Amb27216667 [1,0,0,0,0,1|1,0,1]=4 4818 B8R1.2 O=CC1CC=CSC1 Amb27434846 [1,0,0,0,0,1|1,0,1]=4 4819 B8R1.2 O=Cc1ccccc1 Amb2792754 [1,0,0,0,0,1|2,0,0]=4 4820 B8R1.2 O=Cc1ccccn1 Amb2720349 [1,0,0,0,0,1|1,0,0]=3 4821 B8R1.2 O=Cc1cccnc1 Amb2720350 [1,0,0,0,0,1|1,0,0]=3 4822 B8R1.2 O=Cc1cccnn1 Amb8010287 [1,0,0,0,0,1|1,0,0]=3 4823 B8R1.2 O=Cc1ccncc1 Amb932832 [1,0,0,0,0,1|2,0,0]=4 4824 B8R1.2 O=Cc1ccncn1 Amb8009550 [1,0,0,0,0,1|1,0,0]=3 4825 B8R1.2 O=Cc1ccnnc1 Amb8010397 [1,0,0,0,0,1|2,0,0]=4 4826 B8R1.2 O=Cc1cnccn1 Amb8009498 [1,0,0,0,0,1|1,0,0]=3 4827 B8R1.2 O=Cc1cncnc1 Amb2235993 [1,0,0,0,0,1|2,0,0]=4 4828 B8R1.2 O=Cc1cncnn1 Amb28135777 [1,0,0,0,0,1|2,0,0]=4 4829 B8R1.2 O=Cc1cnncn1 Amb18833127 [1,0,0,0,0,1|2,0,0]=4 4830 B8R1.2 O=Cc1ncccn1 Amb8010587 [1,0,0,0,0,1|1,0,0]=3 4831 B8R1.2 O=Cc1nccnn1 Amb25662574 [1,0,0,0,0,1|1,0,0]=3 4832 B8R1.2 O=Cc1ncncn1 Amb24409104 [1,0,0,0,0,1|1,0,0]=3 4833 B8R1.2 O=Nc1ccccn1 Amb31031129 [1,0,0,0,0,1|2,0,0]=4 4834 B8R1.2 O=Nc1cccnn1 Amb27962605 [1,0,0,0,0,1|2,0,0]=4 4835 B10R1.18 C=C(C)Cc1cccnc1 Amb27624891 [0,0,0,0,0,2|2,0,0]=4 4836 B10R1.18 CC(=N)Nc1ccccn1 Amb28050174 [0,0,0,0,0,2|2,0,0]=4 4837 B10R1.18 CC(=N)Nc1cnccn1 Amb27949632 [0,0,0,0,0,2|2,0,0]=4 4838 B10R1.18 CC(=O)Cc1ccccc1 Amb4136401 [0,0,0,0,0,2|2,0,0]=4 4839 B10R1.18 CC(=O)Cc1ccccn1 Amb33527266 [0,0,0,0,0,2|1,0,0]=3 4840 B10R1.18 CC(=O)Cc1cccnc1 Amb10608569 [0,0,0,0,0,2|1,0,0]=3 4841 B10R1.18 CC(=O)Cc1cccnc1 Amb22587708 [0,0,0,0,0,2|1,0,0]=3 4842 B10R1.18 CC(=O)Cc1ccncc1 Amb17935754 [0,0,0,0,0,2|2,0,0]=4 4843 B10R1.18 CC(=O)Cc1ccncc1 Amb8390737 [0,0,0,0,0,2|2,0,0]=4 4844 B10R1.18 CC(=O)Cc1ccncn1 Amb33225151 [0,0,0,0,0,2|1,0,0]=3 4845 B10R1.18 CC(=O)Cc1cnccn1 Amb1995176 [0,0,0,0,0,2|1,0,0]=3 4846 B10R1.18 CC(=O)Cc1cncnc1 Amb25328576 [0,0,0,0,0,2|2,0,0]=4 4847 B10R1.18 CC(=O)Cc1ncccn1 Amb21864927 [0,0,0,0,0,2|1,0,0]=3 4848 B10R1.18 CC(=O)NC1=NC=CCN1 Amb27595553 [0,0,0,0,0,2|1,0,0]=3 4849 B10R1.18 CC(=O)Nc1ccccc1 Amb6346349 [0,0,0,0,0,2|2,0,0]=4 4850 B10R1.18 CC(=O)Nc1ccccn1 Amb6374183 [0,0,0,0,0,2|1,0,0]=3 4851 B10R1.18 CC(=O)Nc1cccnc1 Amb6608635 [0,0,0,0,0,2|1,0,0]=3 4852 B10R1.18 CC(=O)Nc1ccncc1 Amb6395765 [0,0,0,0,0,2|2,0,0]=4 4853 B10R1.18 CC(=O)Nc1ccncn1 Amb24072458 [0,0,0,0,0,2|1,0,0]=3 4854 B10R1.18 CC(=O)Nc1cnccn1 Amb2609548 [0,0,0,0,0,2|1,0,0]=3 4855 B10R1.18 CC(=O)Nc1cncnc1 Amb21962991 [0,0,0,0,0,2|2,0,0]=4 4856 B10R1.18 CC(=O)Nc1ncccn1 Amb3373225 [0,0,0,0,0,2|1,0,0]=3 4857 B10R1.18 CC(=O)Nc1nccnn1 Amb35684547 [0,0,0,0,0,2|1,0,0]=3 4858 B10R1.18 CC(=O)Oc1cccnc1 Amb6297781 [0,0,0,0,0,2|1,0,0]=3 4859 B10R1.18 CC(=O)Oc1ccncc1 Amb22522585 [0,0,0,0,0,2|2,0,0]=4 4860 B10R1.18 CC(=O)Oc1cnccn1 Amb28457181 [0,0,0,0,0,2|1,0,0]=3 4861 B10R1.18 CC(=O)Sc1ccccc1 Amb10575810 [0,0,0,0,0,2|2,0,0]=4 4862 B10R1.18 CC(=O)Sc1cccnc1 Amb27429372 [0,0,0,0,0,2|1,0,0]=3 4863 B10R1.18 NC(=O)Cc1cccnc1 Amb21856113 [0,0,0,0,0,2|2,0,0]=4 4864 B10R1.18 NC(=O)Cc1ccncn1 Amb23440836 [0,0,0,0,0,2|2,0,0]=4 4865 B10R1.18 NC(=O)Cc1ncccn1 Amb22277045 [0,0,0,0,0,2|2,0,0]=4 4866 B10R1.18 NC(=O)Nc1ccccn1 Amb2691587 [0,0,0,0,0,2|2,0,0]=4 4867 B10R1.18 NC(=O)Nc1cccnc1 Amb1137270 [0,0,0,0,0,2|2,0,0]=4 4868 B10R1.18 NC(=O)Nc1ccncn1 Amb28458014 [0,0,0,0,0,2|2,0,0]=4 4869 B10R1.18 NC(=O)Nc1cnccn1 Amb28134771 [0,0,0,0,0,2|2,0,0]=4 4870 B10R1.18 NC(=O)Nc1ncccn1 Amb8471616 [0,0,0,0,0,2|2,0,0]=4 4871 B10R1.18 NC(=O)Nc1nccnn1 Amb35662922 [0,0,0,0,0,2|2,0,0]=4 4872 B10R1.18 O=C(Cl)Cc1ccccn1 Amb26458529 [0,0,0,0,0,2|2,0,0]=4 4873 B10R1.18 O=C(Cl)Cc1cccnc1 Amb24605722 [0,0,0,0,0,2|2,0,0]=4 4874 B10R1.18 O=C(Cl)Cc1cnccn1 Amb27200077 [0,0,0,0,0,2|2,0,0]=4 4875 B10R1.18 O=C(Cl)Nc1cccnc1 Amb35637042 [0,0,0,0,0,2|2,0,0]=4 4876 B10R1.18 O=C(Cl)Oc1ccccn1 Amb33296824 [0,0,0,0,0,2|2,0,0]=4 4877 B10R1.18 O=C(Cl)Oc1cccnc1 Amb26956091 [0,0,0,0,0,2|2,0,0]=4 4878 B10R1.18 O=C(Cl)Oc1ccncn1 Amb33296988 [0,0,0,0,0,2|2,0,0]=4 4879 B10R1.18 O=C(Cl)Oc1cnccn1 Amb25121175 [0,0,0,0,0,2|2,0,0]=4 4880 B10R1.18 O=C(O)Cc1ccccn1 Amb2720201 [0,0,0,0,0,2|2,0,0]=4 4881 B10R1.18 O=C(O)Cc1ccccn1 Amb3940142 [0,0,0,0,0,2|2,0,0]=4 4882 B10R1.18 O=C(O)Cc1cccnc1 Amb2720203 [0,0,0,0,0,2|2,0,0]=4 4883 B10R1.18 O=C(O)Cc1cccnc1 Amb2720470 [0,0,0,0,0,2|2,0,0]=4 4884 B10R1.18 O=C(O)Cc1cccnn1 Amb33806311 [0,0,0,0,0,2|2,0,0]=4 4885 B10R1.18 O=C(O)Cc1cccnn1 Amb8009415 [0,0,0,0,0,2|2,0,0]=4 4886 B10R1.18 O=C(O)Cc1ccncn1 Amb8009416 [0,0,0,0,0,2|2,0,0]=4 4887 B10R1.18 O=C(O)Cc1cnccn1 Amb10602133 [0,0,0,0,0,2|2,0,0]=4 4888 B10R1.18 O=C(O)Cc1cnccn1 Amb19929342 [0,0,0,0,0,2|2,0,0]=4 4889 B10R1.18 O=C(O)Cc1ncccn1 Amb7101493 [0,0,0,0,0,2|2,0,0]=4 4890 B10R1.18 O=C(O)Cc1nccnn1 Amb18832133 [0,0,0,0,0,2|2,0,0]=4 4891 B10R1.18 O=C(O)Cc1ncncn1 Amb18223164 [0,0,0,0,0,2|2,0,0]=4 4892 B10R1.18 O=C(O)Nc1cccnc1 Amb24102579 [0,0,0,0,0,2|2,0,0]=4 4893 B10R1.18 O=C(O)Nc1ncccn1 Amb24085046 [0,0,0,0,0,2|2,0,0]=4 4894 B10R1.18 O=C([O-])Cc1ccccn1 Amb22000882 [0,0,0,0,0,2|2,0,0]=4 4895 B10R1.18 O=C([O-])Cc1cccnc1 Amb33513106 [0,0,0,0,0,2|2,0,0]=4 4896 B10R1.18 O=C([O-])Cc1cccnn1 Amb22499484 [0,0,0,0,0,2|2,0,0]=4 4897 B10R1.18 O=C([O-])Cc1cccnn1 Amb23439149 [0,0,0,0,0,2|2,0,0]=4 4898 B10R1.18 O=C([O-])Cc1ccncn1 Amb22755792 [0,0,0,0,0,2|2,0,0]=4 4899 B10R1.18 O=C([O-])Cc1ccncn1 Amb22899178 [0,0,0,0,0,2|2,0,0]=4 4900 B10R1.18 O=C([O-])Cc1cnccn1 Amb33473710 [0,0,0,0,0,2|2,0,0]=4 4901 B10R1.18 O=C([O-])Cc1ncccn1 Amb30594223 [0,0,0,0,0,2|2,0,0]=4 4902 B10R1.348 CC(=O)C1=CC=CC=CN1 Amb25921212 [0,0,0,0,0,2|1,0,1]=4 4903 B10R1.348 CC(=O)C1=CC=CCCC1 Amb28351614 [0,0,0,0,0,2|2,0,0]=4 4904 B10R1.348 CC(=O)C1=CCC=CC=C1 Amb27164696 [0,0,0,0,0,2|2,0,0]=4 4905 B10R1.348 O=C(O)C1=COC=CN=C1 Amb28126709 [0,0,0,0,0,2|1,1,0]=4 4906 B10R1.66 C=C(Br)CNc1nccs1 Amb27250166 [0,0,0,0,0,2|1,0,1]=4 4907 B10R1.66 C=C(C)C#Cc1cccs1 Amb27423871 [0,0,0,0,0,2|2,0,0]=4 4908 B10R1.66 C=C(C)CNc1nncs1 Amb27633809 [0,0,0,0,0,2|2,0,0]=4 4909 B10R1.66 C=C(C)CSc1ncco1 Amb27867926 [0,0,0,0,0,2|1,1,0]=4 4910 B10R1.66 C=C(C)CSc1nccs1 Amb28314086 [0,0,0,0,0,2|1,0,0]=3 4911 B10R1.66 CC(=N)NCc1cccs1 Amb27260850 [0,0,0,0,0,2|2,0,0]=4 4912 B10R1.66 CC(=O)CCc1ccco1 Amb1107538 [0,0,0,0,0,2|1,1,0]=4 4913 B10R1.66 CC(=O)CCc1cccs1 Amb5740049 [0,0,0,0,0,2|1,0,0]=3 4914 B10R1.66 CC(=O)CCc1ccon1 Amb18832105 [0,0,0,0,0,2|2,0,0]=4 4915 B10R1.66 CC(=O)CCc1ccsn1 Amb27190352 [0,0,0,0,0,2|2,0,0]=4 4916 B10R1.66 CC(=O)CCc1cncs1 Amb27469825 [0,0,0,0,0,2|2,0,0]=4 4917 B10R1.66 CC(=O)CCc1cscn1 Amb25133415 [0,0,0,0,0,2|2,0,0]=4 4918 B10R1.66 CC(=O)CCc1ncco1 Amb18832106 [0,0,0,0,0,2|0,1,0]=3 4919 B10R1.66 CC(=O)CCc1nccs1 Amb17334384 [0,0,0,0,0,2|0,0,0]=2 4920 B10R1.66 CC(=O)CCc1nnco1 Amb27169119 [0,0,0,0,0,2|1,1,0]=4 4921 B10R1.66 CC(=O)CCn1cccn1 Amb594009 [0,0,0,0,0,2|2,0,0]=4 4922 B10R1.66 CC(=O)CSC1=NCCS1 Amb24432079 [0,0,0,0,0,2|0,0,2]=4 4923 B10R1.66 CC(=O)CSc1cccs1 Amb2724458 [0,0,0,0,0,2|1,0,0]=3 4924 B10R1.66 CC(=O)CSc1ncns1 Amb27865258 [0,0,0,0,0,2|1,0,0]=3 4925 B10R1.66 CC(=O)CSc1nncs1 Amb6892447 [0,0,0,0,0,2|1,0,0]=3 4926 B10R1.66 CC(=O)NCc1ccco1 Amb1209246 [0,0,0,0,0,2|1,1,0]=4 4927 B10R1.66 CC(=O)NCc1cccs1 Amb1218150 [0,0,0,0,0,2|1,0,0]=3 4928 B10R1.66 CC(=O)NCc1ccns1 Amb35720522 [0,0,0,0,0,2|2,0,0]=4 4929 B10R1.66 CC(=O)NCc1ccon1 Amb28049485 [0,0,0,0,0,2|2,0,0]=4 4930 B10R1.66 CC(=O)NCc1cncs1 Amb27955071 [0,0,0,0,0,2|2,0,0]=4 4931 B10R1.66 CC(=O)OCc1ccco1 Amb4334378 [0,0,0,0,0,2|1,1,0]=4 4932 B10R1.66 CC(=O)OCc1nccs1 Amb26079763 [0,0,0,0,0,2|0,0,0]=2 4933 B10R1.66 CC(=O)\C=C/c1ccco1 Amb25066388 [0,0,0,0,0,2|1,1,0]=4 4934 B10R1.66 CC(=O)\C=C\c1ccco1 Amb6608963 [0,0,0,0,0,2|1,1,0]=4 4935 B10R1.66 CC(=O)\C=C\c1cccs1 Amb33512960 [0,0,0,0,0,2|1,0,0]=3 4936 B10R1.66 CC(=O)\C=C\c1ccns1 Amb35720406 [0,0,0,0,0,2|2,0,0]=4 4937 B10R1.66 CC(=O)\C=C\c1ccon1 Amb33199366 [0,0,0,0,0,2|2,0,0]=4 4938 B10R1.66 CC(=O)\C=C\c1cncs1 Amb33359799 [0,0,0,0,0,2|2,0,0]=4 4939 B10R1.66 CC(=O)\C=C\c1cscn1 Amb32954498 [0,0,0,0,0,2|2,0,0]=4 4940 B10R1.66 CC(=O)\C=C\c1nccs1 Amb33449103 [0,0,0,0,0,2|0,0,0]=2 4941 B10R1.66 CC(Br)CCc1nccs1 Amb27400186 [0,0,0,0,0,2|1,0,1]=4 4942 B10R1.66 CC(C)=NNc1nccs1 Amb3685570 [0,0,0,0,0,2|1,0,0]=3 4943 B10R1.66 CC(C)CCc1nccs1 Amb25123504 [0,0,0,0,0,2|1,0,1]=4 4944 B10R1.66 CC(C)NCc1nccs1 Amb2693218 [0,0,0,0,0,2|1,0,1]=4 4945 B10R1.66 CC(Cl)\C=C\c1nccs1 Amb27593818 [0,0,0,0,0,2|1,0,1]=4 4946 B10R1.66 CC(N)CCc1nccs1 Amb24624978 [0,0,0,0,0,2|1,0,1]=4 4947 B10R1.66 CC(N)COc1nccs1 Amb35727563 [0,0,0,0,0,2|1,0,1]=4 4948 B10R1.66 CC(N)\C=C\c1nccs1 Amb33358937 [0,0,0,0,0,2|1,0,1]=4 4949 B10R1.66 CC(O)CCc1nccs1 Amb27837795 [0,0,0,0,0,2|0,0,2]=4 4950 B10R1.66 CC(O)\C=C\c1nccs1 Amb28126823 [0,0,0,0,0,2|0,0,2]=4 4951 B10R1.66 CN(C)CNc1nccs1 Amb27636380 [0,0,0,0,0,2|2,0,0]=4 4952 B10R1.66 CN(C)NCc1nccs1 Amb19648753 [0,0,0,0,0,2|2,0,0]=4 4953 B10R1.66 CN(C)\C=N\c1nccs1 Amb32661851 [0,0,0,0,0,2|2,0,0]=4 4954 B10R1.66 CS(=O)\N=C\c1cccs1 Amb35681657 [0,0,0,0,0,2|2,0,0]=4 4955 B10R1.66 CS(=O)\N=C\c1nccs1 Amb35692857 [0,0,0,0,0,2|1,0,0]=3 4956 B10R1.66 C[C@@H](N)CCc1nccs1 Amb33311511 [0,0,0,0,0,2|1,0,1]=4 4957 B10R1.66 C[C@@H](O)CCc1nccs1 Amb33311512 [0,0,0,0,0,2|0,0,2]=4 4958 B10R1.66 C[C@H](N)CCc1nccs1 Amb33312077 [0,0,0,0,0,2|1,0,1]=4 4959 B10R1.66 C[C@H](O)CCc1nccs1 Amb33312078 [0,0,0,0,0,2|0,0,2]=4 4960 B10R1.66 C[C@H](O)CSc1nccs1 Amb27813711 [0,0,0,0,0,2|0,0,2]=4 4961 B10R1.66 N=C(N)CSc1nccs1 Amb18790133 [0,0,0,0,0,2|2,0,0]=4 4962 B10R1.66 N=C(N)SCc1nccs1 Amb27768658 [0,0,0,0,0,2|2,0,0]=4 4963 B10R1.66 NC(=O)C#Cc1cccs1 Amb26378787 [0,0,0,0,0,2|2,0,0]=4 4964 B10R1.66 NC(=O)CNc1ncns1 Amb27823569 [0,0,0,0,0,2|2,0,0]=4 4965 B10R1.66 NC(=O)CSc1cccs1 Amb4330204 [0,0,0,0,0,2|2,0,0]=4 4966 B10R1.66 NC(=O)CSc1ncns1 Amb28384337 [0,0,0,0,0,2|2,0,0]=4 4967 B10R1.66 NC(=O)NCc1cccs1 Amb1106145 [0,0,0,0,0,2|2,0,0]=4 4968 B10R1.66 NC(=O)NCc1nccs1 Amb18791803 [0,0,0,0,0,2|1,0,0]=3 4969 B10R1.66 NC(=O)NNc1nccs1 Amb25137442 [0,0,0,0,0,2|1,0,0]=3 4970 B10R1.66 NC(=O)\C=C\c1cccs1 Amb3429140 [0,0,0,0,0,2|2,0,0]=4 4971 B10R1.66 NC(=S)NCc1nccs1 Amb18795008 [0,0,0,0,0,2|1,1,0]=4 4972 B10R1.66 NC(=S)NNc1nccs1 Amb8472746 [0,0,0,0,0,2|1,1,0]=4 4973 B10R1.66 O=C(Cl)CCc1cccs1 Amb23440823 [0,0,0,0,0,2|2,0,0]=4 4974 B10R1.66 O=C(Cl)CCc1nccs1 Amb27192253 [0,0,0,0,0,2|1,0,0]=3 4975 B10R1.66 O=C(Cl)NCc1cccs1 Amb30028127 [0,0,0,0,0,2|2,0,0]=4 4976 B10R1.66 O=C(Cl)OCc1cccs1 Amb28049418 [0,0,0,0,0,2|2,0,0]=4 4977 B10R1.66 O=C(Cl)\C=C\c1cccs1 Amb7173093 [0,0,0,0,0,2|2,0,0]=4 4978 B10R1.66 O=C(O)C#Cc1cccs1 Amb17138439 [0,0,0,0,0,2|2,0,0]=4 4979 B10R1.66 O=C(O)C#Cc1nccs1 Amb26982316 [0,0,0,0,0,2|1,0,0]=3 4980 B10R1.66 O=C(O)C#Cc1nncs1 Amb33169023 [0,0,0,0,0,2|2,0,0]=4 4981 B10R1.66 O=C(O)CCc1cccs1 Amb1154297 [0,0,0,0,0,2|2,0,0]=4 4982 B10R1.66 O=C(O)CCc1ncco1 Amb17399867 [0,0,0,0,0,2|1,1,0]=4 4983 B10R1.66 O=C(O)CCc1nccs1 Amb33528763 [0,0,0,0,0,2|1,0,0]=3 4984 B10R1.66 O=C(O)CCc1ncns1 Amb18830503 [0,0,0,0,0,2|2,0,0]=4 4985 B10R1.66 O=C(O)CNc1cccs1 Amb26516474 [0,0,0,0,0,2|2,0,0]=4 4986 B10R1.66 O=C(O)CNc1nccs1 Amb10610433 [0,0,0,0,0,2|1,0,0]=3 4987 B10R1.66 O=C(O)CNc1nccs1 Amb6259550 [0,0,0,0,0,2|1,0,0]=3 4988 B10R1.66 O=C(O)CNc1nncs1 Amb25737188 [0,0,0,0,0,2|2,0,0]=4 4989 B10R1.66 O=C(O)COc1cccs1 Amb27233232 [0,0,0,0,0,2|2,0,0]=4 4990 B10R1.66 O=C(O)COc1nccs1 Amb27494184 [0,0,0,0,0,2|1,0,0]=3 4991 B10R1.66 O=C(O)CSc1cccs1 Amb2796029 [0,0,0,0,0,2|2,0,0]=4 4992 B10R1.66 O=C(O)CSc1nccs1 Amb4157323 [0,0,0,0,0,2|1,0,0]=3 4993 B10R1.66 O=C(O)CSc1nncs1 Amb33543061 [0,0,0,0,0,2|2,0,0]=4 4994 B10R1.66 O=C(O)\C=C/c1cccs1 Amb27658635 [0,0,0,0,0,2|2,0,0]=4 4995 B10R1.66 O=C(O)\C=C\c1cccs1 Amb24076486 [0,0,0,0,0,2|2,0,0]=4 4996 B10R1.66 O=C(O)\C=C\c1cccs1 Amb33716246 [0,0,0,0,0,2|2,0,0]=4 4997 B10R1.66 O=C(O)\C=C\c1ncco1 Amb26921286 [0,0,0,0,0,2|1,1,0]=4 4998 B10R1.66 O=C(O)\C=C\c1nccs1 Amb8836307 [0,0,0,0,0,2|1,0,0]=3 4999 B10R1.66 O=C([O-])CCc1cccs1 Amb33512993 [0,0,0,0,0,2|2,0,0]=4 5000 B10R1.66 O=[N+]([O-])CCc1nccs1 Amb33456704 [0,0,0,0,0,2|2,0,0]=4 5001 B10R1.66 O=[N+]([O-])\C=C\c1nccs1 Amb24106743 [0,0,0,0,0,2|2,0,0]=4