0 B11R2.2 C1=C(c2ccoc2)CNC1 Amb27494200 [0,0,0,0,0,0|2,0,2]=4 1 B11R2.2 C1=C(c2cnsc2)CNC1 Amb35580151 [0,0,0,0,0,0|1,1,2]=4 2 B11R2.2 c1cc(-c2cc[se]c2)c[se]1 Amb2611583 [0,0,0,0,0,0|3,1,0]=4 3 B11R2.2 c1cc(-c2ccon2)co1 Amb28050451 [0,0,0,0,0,0|2,0,0]=2 4 B11R2.2 c1cc(-c2ccon2)no1 Amb8393956 [0,0,0,0,0,0|3,0,0]=3 5 B11R2.2 c1cc(-c2ccsc2)cs1 Amb2611582 [0,0,0,0,0,0|3,1,0]=4 6 B11R2.2 c1cc(-c2ccsc2)no1 Amb26872722 [0,0,0,0,0,0|2,0,0]=2 7 B11R2.2 c1cc(-c2ccsc2)on1 Amb8384697 [0,0,0,0,0,0|4,0,0]=4 8 B11R2.2 c1cc(-c2cnco2)co1 Amb23437039 [0,0,0,0,0,0|3,0,0]=3 9 B11R2.2 c1cc(-c2cnco2)no1 Amb35652269 [0,0,0,0,0,0|2,0,1]=3 10 B11R2.2 c1cc(-c2cnoc2)co1 Amb27623516 [0,0,0,0,0,0|2,0,0]=2 11 B11R2.2 c1cc(-c2cscn2)co1 Amb27951303 [0,0,0,0,0,0|3,0,0]=3 12 B11R2.2 c1cc(C2=NCCC2)cs1 Amb23578324 [0,0,0,0,0,0|3,0,1]=4 13 B11R2.2 c1cc(C2=NCCN2)cs1 Amb27424945 [0,0,0,0,0,0|4,0,0]=4 14 B11R2.2 c1cc(C2=NCCS2)co1 Amb27945552 [0,0,0,0,0,0|4,0,0]=4 15 B11R2.2 c1ccn(-c2ccon2)c1 Amb3974109 [0,0,0,0,0,0|3,0,0]=3 16 B11R2.2 c1ccn(-c2cnns2)c1 Amb27198636 [0,0,0,0,0,0|4,0,0]=4 17 B11R2.2 c1ccn(-c2cnoc2)c1 Amb27629475 [0,0,0,0,0,0|3,0,0]=3 18 B11R2.2 c1ccn(-c2cnsc2)c1 Amb28122946 [0,0,0,0,0,0|3,1,0]=4 19 B11R2.2 c1ccn(-c2csnn2)c1 Amb35707364 [0,0,0,0,0,0|4,0,0]=4 20 B11R2.2 c1ccn(-c2nnns2)c1 Amb35699585 [0,0,0,0,0,0|4,0,0]=4 21 B11R2.2 c1coc(-c2ccon2)c1 Amb27754602 [0,0,0,0,0,0|3,0,0]=3 22 B11R2.2 c1coc(-c2cnco2)c1 Amb591268 [0,0,0,0,0,0|4,0,0]=4 23 B11R2.2 c1coc(-c2ncon2)c1 Amb28133293 [0,0,0,0,0,0|4,0,0]=4 24 B11R2.2 c1csc(-c2ccoc2)n1 Amb10601018 [0,0,0,0,0,0|4,0,0]=4 25 B11R2.2 c1csc(-c2ccsc2)n1 Amb10601019 [0,0,0,0,0,0|4,0,0]=4 26 B11R2.2 c1csc(-c2cnco2)c1 Amb2725746 [0,0,0,0,0,0|4,0,0]=4 27 B11R2.2 c1csc(-c2cnon2)c1 Amb33623909 [0,0,0,0,0,0|2,0,0]=2 28 B11R2.2 c1csc(-c2cocn2)c1 Amb17399918 [0,0,0,0,0,0|4,0,0]=4 29 B11R2.2 c1csc(-c2cscn2)c1 Amb17400243 [0,0,0,0,0,0|4,0,0]=4 30 B11R2.2 c1csc(-c2csnn2)c1 Amb2409842 [0,0,0,0,0,0|4,0,0]=4 31 B11R2.2 c1nc(-c2cnco2)co1 Amb23437037 [0,0,0,0,0,0|3,0,1]=4 32 B11R2.2 c1nc(-c2cncs2)no1 Amb28323484 [0,0,0,0,0,0|3,0,1]=4 33 B11R2.2 c1nc(-c2cnoc2)cs1 Amb28315949 [0,0,0,0,0,0|3,0,0]=3 34 B11R2.2 c1nc(-c2cscn2)cs1 Amb27389581 [0,0,0,0,0,0|4,0,0]=4 35 B11R2.2 c1ncc(-c2ccsc2)o1 Amb23437042 [0,0,0,0,0,0|3,0,0]=3 36 B11R2.2 c1ncc(-c2cnco2)o1 Amb23437038 [0,0,0,0,0,0|3,0,1]=4 37 B11R2.2 c1ncc(-c2cncs2)o1 Amb23402877 [0,0,0,0,0,0|3,0,1]=4 38 B11R2.2 c1ncc(-c2cncs2)s1 Amb27215620 [0,0,0,0,0,0|3,0,1]=4 39 B11R2.2 c1ncc(-c2cscn2)o1 Amb23402875 [0,0,0,0,0,0|3,0,1]=4 40 B12R2.6 Brc1cc(-c2ccco2)no1 Amb28398163 [0,1,0,0,0,0|3,0,0]=4 41 B12R2.6 Brc1cc(-c2cnco2)co1 Amb35652447 [0,1,0,0,0,0|3,0,0]=4 42 B12R2.6 Brc1cc(-c2cnco2)cs1 Amb35652458 [0,1,0,0,0,0|3,0,0]=4 43 B12R2.6 Brc1cc(-c2cncs2)co1 Amb18753185 [0,1,0,0,0,0|3,0,0]=4 44 B12R2.6 Brc1cc(-c2cncs2)cs1 Amb18717824 [0,1,0,0,0,0|3,0,0]=4 45 B12R2.6 Brc1nc(-c2ccoc2)co1 Amb28397821 [0,1,0,0,0,0|3,0,0]=4 46 B12R2.6 Brc1nc(-c2ccoc2)cs1 Amb13884337 [0,1,0,0,0,0|3,0,0]=4 47 B12R2.6 Brc1nc(-c2ccsc2)co1 Amb27174032 [0,1,0,0,0,0|3,0,0]=4 48 B12R2.6 Brc1nc(-c2ccsc2)cs1 Amb13884335 [0,1,0,0,0,0|3,0,0]=4 49 B12R2.6 Brc1ncc(-c2ccoc2)s1 Amb13884325 [0,1,0,0,0,0|3,0,0]=4 50 B12R2.6 Brc1ncc(-c2ccsc2)s1 Amb13884323 [0,1,0,0,0,0|3,0,0]=4 51 B12R2.6 Cc1cc(-c2ccsc2)no1 Amb28239672 [0,1,0,0,0,0|2,0,0]=3 52 B12R2.6 Cc1cc(-c2cnco2)co1 Amb35652616 [0,1,0,0,0,0|3,0,0]=4 53 B12R2.6 Cc1cc(-c2cnco2)cs1 Amb35652476 [0,1,0,0,0,0|3,0,0]=4 54 B12R2.6 Cc1cc(-c2cnco2)no1 Amb27154400 [0,1,0,0,0,0|2,0,1]=4 55 B12R2.6 Cc1cc(-n2cccc2)no1 Amb2235057 [0,1,0,0,0,0|3,0,0]=4 56 B12R2.6 Cc1nc(-c2ccoc2)no1 Amb27206847 [0,1,0,0,0,0|3,0,0]=4 57 B12R2.6 Cc1ncc(-c2ccsc2)s1 Amb32672033 [0,1,0,0,0,0|3,0,0]=4 58 B12R2.6 Cc1noc(-c2ccsc2)n1 Amb21936701 [0,1,0,0,0,0|3,0,0]=4 59 B12R2.6 Clc1cc(-c2cnco2)cs1 Amb35652504 [0,1,0,0,0,0|3,0,0]=4 60 B12R2.6 Clc1ccc(-c2ccon2)s1 Amb27197775 [0,1,0,0,0,0|3,0,0]=4 61 B12R2.6 Clc1nc(-c2ccsc2)cs1 Amb19664339 [0,1,0,0,0,0|3,0,0]=4 62 B12R2.6 Clc1nc(-c2ccsc2)no1 Amb18320693 [0,1,0,0,0,0|3,0,0]=4 63 B12R2.6 Clc1noc(-c2ccoc2)n1 Amb26020575 [0,1,0,0,0,0|3,0,0]=4 64 B12R2.6 Clc1noc(-c2ccsc2)n1 Amb26870972 [0,1,0,0,0,0|3,0,0]=4 65 B12R2.6 Cn1cc(-c2ccsc2)cn1 Amb2611598 [0,1,0,0,0,0|3,0,0]=4 66 B12R2.6 Cn1cc(-c2cnco2)cn1 Amb35647907 [0,1,0,0,0,0|3,0,0]=4 67 B12R2.6 Cn1cc(-c2cscn2)cn1 Amb27872402 [0,1,0,0,0,0|3,0,0]=4 68 B12R2.6 Cn1ccc(-c2cnco2)n1 Amb35652462 [0,1,0,0,0,0|3,0,0]=4 69 B12R2.6 Cn1ccc(-n2cnnc2)c1 Amb27851567 [0,1,0,0,0,0|3,0,0]=4 70 B12R2.6 Cn1cnc(-c2cnco2)c1 Amb35652449 [0,1,0,0,0,0|3,0,0]=4 71 B12R2.6 Cn1ncc(-c2cnco2)n1 Amb35652475 [0,1,0,0,0,0|2,0,1]=4 72 B12R2.6 Cn1ncc(C2=CCNC2)n1 Amb28282100 [0,1,0,0,0,0|1,0,2]=4 73 B12R2.6 Ic1cc(-c2cnco2)cs1 Amb35652479 [0,1,0,0,0,0|3,0,0]=4 74 B12R2.6 Nc1cc(-c2ccco2)no1 Amb1133277 [0,1,0,0,0,0|3,0,0]=4 75 B12R2.6 Nc1cc(-c2cccs2)no1 Amb1132912 [0,1,0,0,0,0|3,0,0]=4 76 B12R2.6 Nc1cc(-c2ccoc2)no1 Amb6717502 [0,1,0,0,0,0|2,0,0]=3 77 B12R2.6 Nc1cc(-c2ccon2)no1 Amb33199042 [0,1,0,0,0,0|3,0,0]=4 78 B12R2.6 Nc1cc(-c2ccon2)on1 Amb33199041 [0,1,0,0,0,0|2,0,1]=4 79 B12R2.6 Nc1cc(-c2ccsc2)no1 Amb33528103 [0,1,0,0,0,0|2,0,0]=3 80 B12R2.6 Nc1cc(-c2cnco2)cs1 Amb18827724 [0,1,0,0,0,0|3,0,0]=4 81 B12R2.6 Nc1cc(-c2cnco2)no1 Amb33321231 [0,1,0,0,0,0|2,0,1]=4 82 B12R2.6 Nc1cc(-c2cncs2)no1 Amb26632432 [0,1,0,0,0,0|2,0,1]=4 83 B12R2.6 Nc1cc(-c2cscn2)no1 Amb33417282 [0,1,0,0,0,0|3,0,0]=4 84 B12R2.6 Nc1cn(-c2ccon2)cn1 Amb18831312 [0,1,0,0,0,0|2,0,1]=4 85 B12R2.6 Nc1nc(-c2ccoc2)cs1 Amb13884187 [0,1,0,0,0,0|3,0,0]=4 86 B12R2.6 Nc1nc(-c2ccoc2)cs1 Amb31196599 [0,1,0,0,0,0|3,0,0]=4 87 B12R2.6 Nc1nc(-c2ccon2)cs1 Amb24654413 [0,1,0,0,0,0|3,0,0]=4 88 B12R2.6 Nc1nc(-c2ccsc2)cs1 Amb13884188 [0,1,0,0,0,0|3,0,0]=4 89 B12R2.6 Nc1ncc(-c2ccoc2)o1 Amb32954312 [0,1,0,0,0,0|3,0,0]=4 90 B12R2.6 Nc1ncc(-c2ccoc2)s1 Amb13884190 [0,1,0,0,0,0|3,0,0]=4 91 B12R2.6 Nc1ncc(-c2ccon2)o1 Amb33226175 [0,1,0,0,0,0|2,0,1]=4 92 B12R2.6 Nc1ncc(-c2ccsc2)o1 Amb33358563 [0,1,0,0,0,0|3,0,0]=4 93 B12R2.6 Nc1ncc(-c2ccsc2)s1 Amb13884191 [0,1,0,0,0,0|3,0,0]=4 94 B12R2.6 Nc1noc(-c2ccoc2)n1 Amb27831786 [0,1,0,0,0,0|3,0,0]=4 95 B12R2.6 Nc1noc(-c2ccsc2)n1 Amb18646726 [0,1,0,0,0,0|3,0,0]=4 96 B12R2.6 O=C1CC(c2ccoc2)=NO1 Amb27175225 [0,1,0,0,0,0|2,0,1]=4 97 B12R2.6 Oc1cc(-c2ccco2)no1 Amb20672893 [0,1,0,0,0,0|3,0,0]=4 98 B12R2.6 Oc1cc(-c2cccs2)no1 Amb20672777 [0,1,0,0,0,0|3,0,0]=4 99 B12R2.6 Oc1nc(-c2ccoc2)cs1 Amb13884336 [0,1,0,0,0,0|3,0,0]=4 100 B12R2.6 Oc1nc(-c2ccsc2)cs1 Amb13884334 [0,1,0,0,0,0|3,0,0]=4 101 B12R2.6 Oc1ncc(-c2ccoc2)s1 Amb13884324 [0,1,0,0,0,0|3,0,0]=4 102 B12R2.6 Oc1ncc(-c2ccsc2)s1 Amb13884322 [0,1,0,0,0,0|3,0,0]=4 103 B12R2.6 Sc1nc(-c2ccoc2)no1 Amb28423389 [0,1,0,0,0,0|3,0,0]=4 104 B12R2.6 Sc1nc(-c2ccsc2)cs1 Amb19664338 [0,1,0,0,0,0|3,0,0]=4 105 B12R2.10 Brc1cscc1-c2cnco2 Amb35652487 [0,1,0,0,0,0|3,0,0]=4 106 B12R2.10 Brc1ncsc1-c2ccoc2 Amb24317543 [0,1,0,0,0,0|3,0,0]=4 107 B12R2.10 Brc1ncsc1-c2ccsc2 Amb24317541 [0,1,0,0,0,0|3,0,0]=4 108 B12R2.10 Brc1occc1-c2cnco2 Amb35652499 [0,1,0,0,0,0|3,0,0]=4 109 B12R2.10 Brc1sccc1-c2cnco2 Amb30038052 [0,1,0,0,0,0|3,0,0]=4 110 B12R2.10 Brc1scnc1-c2ccsc2 Amb24317553 [0,1,0,0,0,0|3,0,0]=4 111 B12R2.10 Cc1cscc1-c2cnco2 Amb35652507 [0,1,0,0,0,0|3,0,0]=4 112 B12R2.10 Cc1nocc1-c2cnco2 Amb35647944 [0,1,0,0,0,0|2,0,1]=4 113 B12R2.10 Cc1nonc1-n2cccc2 Amb28144971 [0,1,0,0,0,0|2,0,0]=3 114 B12R2.10 Cc1occc1-c2cnco2 Amb35647900 [0,1,0,0,0,0|3,0,0]=4 115 B12R2.10 Cc1scnc1-c2ccsc2 Amb27777919 [0,1,0,0,0,0|3,0,0]=4 116 B12R2.10 Clc1nsnc1-c2ccco2 Amb17234351 [0,1,0,0,0,0|2,1,0]=4 117 B12R2.10 Clc1nsnc1-c2cccs2 Amb17237584 [0,1,0,0,0,0|2,1,0]=4 118 B12R2.10 Clc1nsnc1-c2ccns2 Amb28142487 [0,1,0,0,0,0|1,1,1]=4 119 B12R2.10 Clc1nsnc1-c2cncs2 Amb35613021 [0,1,0,0,0,0|1,1,1]=4 120 B12R2.10 Clc1nsnc1-c2cnsc2 Amb29863568 [0,1,0,0,0,0|1,1,1]=4 121 B12R2.10 Clc1nsnc1-n2ccnc2 Amb9674900 [0,1,0,0,0,0|1,1,1]=4 122 B12R2.10 Clc1occc1-c2cnco2 Amb35652628 [0,1,0,0,0,0|3,0,0]=4 123 B12R2.10 Nc1cnoc1-c2ccon2 Amb18831271 [0,1,0,0,0,0|2,0,1]=4 124 B12R2.10 Nc1ncsc1-c2ccsc2 Amb24317542 [0,1,0,0,0,0|3,0,0]=4 125 B12R2.10 Nc1nonc1-c2cccs2 Amb1102105 [0,1,0,0,0,0|2,0,0]=3 126 B12R2.10 Nc1nonc1-c2cnon2 Amb6355887 [0,1,0,0,0,0|2,0,1]=4 127 B12R2.10 Nc1nonc1-c2ncon2 Amb1092557 [0,1,0,0,0,0|3,0,0]=4 128 B12R2.10 Nc1nsnc1-c2cncs2 Amb35636038 [0,1,0,0,0,0|1,1,1]=4 129 B12R2.10 Nc1nsnc1-c2cnsc2 Amb35716762 [0,1,0,0,0,0|1,1,1]=4 130 B12R2.10 Nc1oncc1-c2cccs2 Amb18947633 [0,1,0,0,0,0|3,0,0]=4 131 B12R2.10 Nc1scnc1-c2ccoc2 Amb24317556 [0,1,0,0,0,0|3,0,0]=4 132 B12R2.10 Nc1scnc1-c2ccsc2 Amb24317554 [0,1,0,0,0,0|3,0,0]=4 133 B10R1.9 C=CC(NN)c1cnsn1 Amb28314438 [0,0,1,0,0,0|1,1,1]=4 134 B10R1.9 O\N=C(\CBr)c1ccoc1 Amb27632800 [0,0,1,0,0,0|2,0,1]=4 135 B10R1.11 C=C(CCN)c1ccon1 Amb33199359 [0,0,1,0,0,0|1,0,2]=4 136 B10R1.11 CO\N=C(\C)c1ccsc1 Amb27605129 [0,0,1,0,0,0|2,0,1]=4 137 B10R1.11 C\C(=C\CO)c1ccsc1 Amb27835608 [0,0,1,0,0,0|3,0,0]=4 138 B10R1.11 O=C(\C=C\Cl)c1ccon1 Amb35609139 [0,0,1,0,0,0|3,0,0]=4 139 B12R2.2 C1=C(c2ccoc2)CCOC1 Amb33077289 [0,0,0,0,0,1|3,0,0]=4 140 B12R2.2 C1=CC(=C2N=CC=N2)C=CN1 Amb24102752 [0,0,0,0,0,1|3,0,0]=4 141 B12R2.2 C1=CC(C2=NCC=C2)=CCC1 Amb24053768 [0,0,0,0,0,1|3,0,0]=4 142 B12R2.2 C1=CN=CC(C2=CNN=N2)=C1 Amb25179924 [0,0,0,0,0,1|1,0,2]=4 143 B12R2.2 C1=CN\C(=C2/C=CN=N2)C=C1 Amb24100389 [0,0,0,0,0,1|3,0,0]=4 144 B12R2.2 c1cc(-c2ccoc2)ccn1 Amb25151842 [0,0,0,0,0,1|2,0,1]=4 145 B12R2.2 c1cc(-c2ccsc2)ccn1 Amb2611626 [0,0,0,0,0,1|3,0,0]=4 146 B12R2.2 c1cc(-c2ccsc2)ncn1 Amb2611580 [0,0,0,0,0,1|2,0,0]=3 147 B12R2.2 c1cc(-c2cnco2)ccn1 Amb591128 [0,0,0,0,0,1|2,0,1]=4 148 B12R2.2 c1cc(-c2cnco2)cnn1 Amb23402870 [0,0,0,0,0,1|2,0,1]=4 149 B12R2.2 c1cc(-c2cnco2)ncn1 Amb23402871 [0,0,0,0,0,1|2,0,1]=4 150 B12R2.2 c1cc(-c2cncs2)ccn1 Amb28256811 [0,0,0,0,0,1|2,0,1]=4 151 B12R2.2 c1cc(-c2cnoc2)ncn1 Amb27462401 [0,0,0,0,0,1|1,0,1]=3 152 B12R2.2 c1cc(-c2cnon2)ccn1 Amb33623535 [0,0,0,0,0,1|0,0,1]=2 153 B12R2.2 c1cc(-c2cocn2)ccn1 Amb22235350 [0,0,0,0,0,1|2,0,1]=4 154 B12R2.2 c1cc(-c2cscn2)ccn1 Amb13884097 [0,0,0,0,0,1|2,0,1]=4 155 B12R2.2 c1cc(-c2csnn2)ccn1 Amb2409837 [0,0,0,0,0,1|2,0,1]=4 156 B12R2.2 c1cc(-c2ncon2)ccn1 Amb28124672 [0,0,0,0,0,1|2,0,1]=4 157 B12R2.2 c1cc(-n2cncn2)ccn1 Amb25365789 [0,0,0,0,0,1|2,0,1]=4 158 B12R2.2 c1cc(-n2cncn2)ccn1 Amb33621247 [0,0,0,0,0,1|2,0,1]=4 159 B12R2.2 c1cc(-n2cncn2)ncn1 Amb28130309 [0,0,0,0,0,1|2,0,1]=4 160 B12R2.2 c1ccc(-c2ccoc2)cc1 Amb27155517 [0,0,0,0,0,1|3,0,0]=4 161 B12R2.2 c1ccc(-c2ccoc2)nc1 Amb27632684 [0,0,0,0,0,1|3,0,0]=4 162 B12R2.2 c1ccc(-c2ccsn2)cc1 Amb24376714 [0,0,0,0,0,1|2,1,0]=4 163 B12R2.2 c1ccc(-c2cnco2)cc1 Amb2725800 [0,0,0,0,0,1|3,0,0]=4 164 B12R2.2 c1ccc(-c2cnco2)nc1 Amb590581 [0,0,0,0,0,1|3,0,0]=4 165 B12R2.2 c1ccc(-c2cncs2)cc1 Amb15691616 [0,0,0,0,0,1|3,0,0]=4 166 B12R2.2 c1ccc(-c2cnns2)cc1 Amb2754725 [0,0,0,0,0,1|3,0,0]=4 167 B12R2.2 c1ccc(-c2cnoc2)cc1 Amb33542838 [0,0,0,0,0,1|2,0,0]=3 168 B12R2.2 c1ccc(-c2cnoc2)nc1 Amb27764543 [0,0,0,0,0,1|2,0,0]=3 169 B12R2.2 c1ccc(-c2cnon2)cc1 Amb9791661 [0,0,0,0,0,1|1,0,0]=2 170 B12R2.2 c1ccc(-c2cnon2)nc1 Amb33623534 [0,0,0,0,0,1|1,0,0]=2 171 B12R2.2 c1ccc(-c2cocn2)cc1 Amb17399894 [0,0,0,0,0,1|3,0,0]=4 172 B12R2.2 c1ccc(-c2cscn2)cc1 Amb2234625 [0,0,0,0,0,1|3,0,0]=4 173 B12R2.2 c1ccc(-c2cscn2)nc1 Amb13884095 [0,0,0,0,0,1|3,0,0]=4 174 B12R2.2 c1ccc(-c2csnn2)cc1 Amb2765982 [0,0,0,0,0,1|3,0,0]=4 175 B12R2.2 c1ccc(-c2csnn2)nc1 Amb2384514 [0,0,0,0,0,1|3,0,0]=4 176 B12R2.2 c1ccc(-c2ncno2)cc1 Amb10552927 [0,0,0,0,0,1|3,0,0]=4 177 B12R2.2 c1ccc(-c2ncon2)cc1 Amb28457268 [0,0,0,0,0,1|3,0,0]=4 178 B12R2.2 c1ccc(-c2nn[n-]n2)cc1 Amb22489465 [0,0,0,0,0,1|3,0,0]=4 179 B12R2.2 c1ccc(-n2cncn2)cc1 Amb2237267 [0,0,0,0,0,1|3,0,0]=4 180 B12R2.2 c1ccc(-n2cncn2)nc1 Amb27606711 [0,0,0,0,0,1|3,0,0]=4 181 B12R2.2 c1ccc(-n2cnnn2)cc1 Amb2222042 [0,0,0,0,0,1|3,0,0]=4 182 B12R2.2 c1ccc(C2=NOCN2)cc1 Amb28120203 [0,0,0,0,0,1|3,0,0]=4 183 B12R2.2 c1ccn(-c2cnccn2)c1 Amb2235073 [0,0,0,0,0,1|3,0,0]=4 184 B12R2.2 c1cn(-c2cncnc2)cn1 Amb20622579 [0,0,0,0,0,1|2,0,1]=4 185 B12R2.2 c1cnc(-c2ccno2)cn1 Amb27469623 [0,0,0,0,0,1|2,0,1]=4 186 B12R2.2 c1cnc(-c2ccsc2)nc1 Amb2611577 [0,0,0,0,0,1|3,0,0]=4 187 B12R2.2 c1cnc(-c2cnco2)cn1 Amb23402867 [0,0,0,0,0,1|2,0,1]=4 188 B12R2.2 c1cnc(-c2cocn2)cn1 Amb26598166 [0,0,0,0,0,1|2,0,1]=4 189 B12R2.2 c1cnc(-c2csnn2)cn1 Amb27633669 [0,0,0,0,0,1|2,0,1]=4 190 B12R2.2 c1cnc(-n2ccnc2)cn1 Amb26027283 [0,0,0,0,0,1|2,0,1]=4 191 B12R2.2 c1cnc(-n2cncn2)cn1 Amb27606729 [0,0,0,0,0,1|2,0,1]=4 192 B12R2.2 c1cncc(-c2ccsc2)c1 Amb9769832 [0,0,0,0,0,1|3,0,0]=4 193 B12R2.2 c1cncc(-c2cnco2)c1 Amb593000 [0,0,0,0,0,1|2,0,1]=4 194 B12R2.2 c1cncc(-c2cnon2)c1 Amb24085083 [0,0,0,0,0,1|0,0,1]=2 195 B12R2.2 c1cncc(-c2cocn2)c1 Amb22235345 [0,0,0,0,0,1|2,0,1]=4 196 B12R2.2 c1cncc(-c2cscn2)c1 Amb13884096 [0,0,0,0,0,1|2,0,1]=4 197 B12R2.2 c1cncc(-c2csnn2)c1 Amb22044101 [0,0,0,0,0,1|2,0,1]=4 198 B12R2.2 c1cncc(-c2ncns2)c1 Amb28048236 [0,0,0,0,0,1|2,0,1]=4 199 B12R2.2 c1cncc(-c2ncon2)c1 Amb577836 [0,0,0,0,0,1|2,0,1]=4 200 B12R2.2 c1coc(-c2ccncn2)c1 Amb2611574 [0,0,0,0,0,1|3,0,0]=4 201 B12R2.2 c1coc(-c2cnccn2)c1 Amb24312793 [0,0,0,0,0,1|3,0,0]=4 202 B12R2.2 c1csc(-c2ccncn2)c1 Amb2611579 [0,0,0,0,0,1|3,0,0]=4 203 B12R2.2 c1csc(-c2cnccn2)c1 Amb10606253 [0,0,0,0,0,1|3,0,0]=4 204 B12R2.2 c1csc(-c2cncnc2)c1 Amb2611578 [0,0,0,0,0,1|3,0,0]=4 205 B12R2.2 c1ncc(-c2ccsc2)cn1 Amb2611581 [0,0,0,0,0,1|2,0,0]=3 206 B12R2.2 c1ncc(-c2cnco2)cn1 Amb23402872 [0,0,0,0,0,1|2,0,1]=4 207 B12R2.98 c1ccn(Cc2cnsn2)c1 Amb27867773 [0,0,0,0,0,1|2,1,0]=4 208 B9R1.11 C=C(CN)c1ccon1 Amb33197560 [1,0,1,0,0,0|1,0,1]=4 209 B9R1.11 C=C(CO)c1ccoc1 Amb8392419 [1,0,1,0,0,0|2,0,0]=4 210 B9R1.11 C=CC(=O)c1ccon1 Amb26516072 [1,0,1,0,0,0|2,0,0]=4 211 B9R1.11 C\C(=N\O)c1ccoc1 Amb28047667 [1,0,1,0,0,0|1,0,1]=4 212 B9R1.11 C\C(=N\O)c1ccsc1 Amb27833776 [1,0,1,0,0,0|1,0,1]=4 213 B9R1.11 N\C(=N/O)c1ccsc1 Amb1154671 [1,0,1,0,0,0|1,0,1]=4 214 B9R1.11 N\C(=N\O)c1ccoc1 Amb25728620 [1,0,1,0,0,0|1,0,1]=4 215 B9R1.11 N\C(=N\O)c1ccsc1 Amb22053011 [1,0,1,0,0,0|1,0,1]=4 216 B9R1.11 O\N=C(/Cl)c1ccsc1 Amb26570907 [1,0,1,0,0,0|2,0,0]=4 217 B9R1.12 C=C\C=C/n1cncn1 Amb27249505 [1,0,1,0,0,0|2,0,0]=4 218 B9R1.12 CO\C=C\c1ccoc1 Amb25349455 [1,0,1,0,0,0|2,0,0]=4 219 B9R1.12 CO\C=C\c1ccsc1 Amb27246685 [1,0,1,0,0,0|2,0,0]=4 220 B9R1.12 CO\N=C\c1ccoc1 Amb27837671 [1,0,1,0,0,0|1,0,1]=4 221 B9R1.12 CO\N=C\c1ccsc1 Amb25254911 [1,0,1,0,0,0|1,0,1]=4 222 B9R1.12 NC\C=C\c1ccon1 Amb33197557 [1,0,1,0,0,0|1,0,1]=4 223 B9R1.12 O=C\C=C\c1ccon1 Amb33197559 [1,0,1,0,0,0|2,0,0]=4 224 B9R1.12 OC\C=C\c1ccoc1 Amb33136449 [1,0,1,0,0,0|2,0,0]=4 225 B9R1.12 OC\C=C\c1ccsc1 Amb33136405 [1,0,1,0,0,0|2,0,0]=4 226 B11R1.298 O=C(O)\C(=N\O)c1ccsc1 Amb28076659 [0,1,1,0,0,0|2,0,0]=4 227 B11R1.27 CCO\N=C\c1ccn(C)c1 Amb27259992 [0,1,1,0,0,0|1,0,1]=4 228 B13R2.10 Brc1cc(-c2ccccc2)no1 Amb22491894 [0,1,0,0,0,1|2,0,0]=4 229 B13R2.10 Brc1cc(-c2ccncc2)no1 Amb27268316 [0,1,0,0,0,1|1,0,1]=4 230 B13R2.10 Cc1cc(-c2ccccc2)no1 Amb10553849 [0,1,0,0,0,1|2,0,0]=4 231 B13R2.10 Cc1cc(-c2ccccn2)no1 Amb24101122 [0,1,0,0,0,1|2,0,0]=4 232 B13R2.10 Clc1cc(-c2ccccc2)no1 Amb2615454 [0,1,0,0,0,1|2,0,0]=4 233 B13R2.10 Clc1cc(-c2cncnc2)no1 Amb28072225 [0,1,0,0,0,1|1,0,1]=4 234 B13R2.10 Cn1cc(-c2ccncn2)cn1 Amb4554754 [0,1,0,0,0,1|2,0,0]=4 235 B13R2.10 Cn1cc(-c2cnccn2)cn1 Amb4554714 [0,1,0,0,0,1|2,0,0]=4 236 B13R2.10 Cn1ccc(-c2ccccn2)c1 Amb27211311 [0,1,0,0,0,1|2,0,0]=4 237 B13R2.10 Nc1cc(-c2ccccc2)no1 Amb1156941 [0,1,0,0,0,1|2,0,0]=4 238 B13R2.10 Nc1cc(-c2ccccn2)no1 Amb18948476 [0,1,0,0,0,1|2,0,0]=4 239 B13R2.10 Nc1cc(-c2cccnc2)no1 Amb33528628 [0,1,0,0,0,1|1,0,1]=4 240 B13R2.10 Nc1cc(-c2ccncc2)no1 Amb33528623 [0,1,0,0,0,1|1,0,1]=4 241 B13R2.10 Nc1cc(-c2ccncn2)cs1 Amb23454893 [0,1,0,0,0,1|2,0,0]=4 242 B13R2.10 Nc1cc(-c2ccncn2)no1 Amb27193350 [0,1,0,0,0,1|1,0,1]=4 243 B13R2.10 Nc1cc(-c2cnccn2)no1 Amb23512587 [0,1,0,0,0,1|1,0,1]=4 244 B13R2.10 Nc1cc(-c2cncnc2)cs1 Amb18824992 [0,1,0,0,0,1|2,0,0]=4 245 B13R2.10 Nc1cc(-c2cncnc2)no1 Amb27606896 [0,1,0,0,0,1|1,0,1]=4 246 B13R2.10 Oc1cc(-c2ccccc2)no1 Amb6889229 [0,1,0,0,0,1|2,0,0]=4 247 B13R2.10 Oc1cc(-c2ccccn2)no1 Amb25124398 [0,1,0,0,0,1|2,0,0]=4 248 B13R2.10 Oc1cc(-c2cccnc2)no1 Amb20672881 [0,1,0,0,0,1|1,0,1]=4 249 B13R2.10 Oc1cc(-c2ccncc2)no1 Amb20672935 [0,1,0,0,0,1|1,0,1]=4 250 B13R2.10 S=C1N=CC(c2cccnc2)=N1 Amb27777340 [0,1,0,0,0,1|1,0,1]=4 251 B13R2.10 S=C1NC=C(c2ccncn2)N1 Amb28254747 [0,1,0,0,0,1|2,0,0]=4 252 B13R2.10 [O-][n+]1cc(-c2ccccc2)no1 Amb2369020 [0,1,0,0,0,1|1,0,1]=4 253 B13R2.10 [O-]c1c[n+](C2=CNC=CC2)no1 Amb27791738 [0,1,0,0,0,1|2,0,0]=4 254 B13R2.12 Brc1ccc(-c2ccon2)cc1 Amb19887520 [0,1,0,0,0,1|2,0,0]=4 255 B13R2.12 Brc1ccc(-c2ccon2)nc1 Amb35676784 [0,1,0,0,0,1|2,0,0]=4 256 B13R2.12 Brc1ccc(-c2cnoc2)cc1 Amb18755038 [0,1,0,0,0,1|2,0,0]=4 257 B13R2.12 Brc1ccc(-c2cnon2)cc1 Amb30628641 [0,1,0,0,0,1|1,0,0]=3 258 B13R2.12 Brc1cnc(-c2ccoc2)cn1 Amb10599493 [0,1,0,0,0,1|2,0,0]=4 259 B13R2.12 Brc1cnc(-c2ccsc2)cn1 Amb10599490 [0,1,0,0,0,1|2,0,0]=4 260 B13R2.12 Brc1ncc(-c2ccoc2)cn1 Amb20617986 [0,1,0,0,0,1|2,0,0]=4 261 B13R2.12 Brc1ncc(-c2ccsc2)cn1 Amb20617969 [0,1,0,0,0,1|2,0,0]=4 262 B13R2.12 Cc1ccc(-c2cnoc2)cc1 Amb27390601 [0,1,0,0,0,1|2,0,0]=4 263 B13R2.12 Cc1ccc(-c2cnon2)cc1 Amb2570570 [0,1,0,0,0,1|1,0,0]=3 264 B13R2.12 Cc1ncc(-c2ccon2)cn1 Amb27962631 [0,1,0,0,0,1|1,0,1]=4 265 B13R2.12 Clc1ccc(-c2ccon2)cc1 Amb19887513 [0,1,0,0,0,1|2,0,0]=4 266 B13R2.12 Clc1ccc(-c2ccon2)nc1 Amb35676777 [0,1,0,0,0,1|2,0,0]=4 267 B13R2.12 Clc1ccc(-c2cnoc2)cc1 Amb4560044 [0,1,0,0,0,1|2,0,0]=4 268 B13R2.12 Clc1ccc(-c2cnon2)cc1 Amb33624981 [0,1,0,0,0,1|1,0,0]=3 269 B13R2.12 Clc1cnc(-c2ccoc2)cn1 Amb27253392 [0,1,0,0,0,1|2,0,0]=4 270 B13R2.12 Clc1cnc(-c2ccsc2)cn1 Amb28134841 [0,1,0,0,0,1|2,0,0]=4 271 B13R2.12 Clc1ncc(-c2ccsc2)cn1 Amb24321521 [0,1,0,0,0,1|2,0,0]=4 272 B13R2.12 Fc1ccc(-c2ccon2)cc1 Amb19887525 [0,1,0,0,0,1|2,0,0]=4 273 B13R2.12 Fc1ccc(-c2ccon2)nc1 Amb27952785 [0,1,0,0,0,1|2,0,0]=4 274 B13R2.12 Fc1ccc(-c2cnon2)cc1 Amb33624985 [0,1,0,0,0,1|1,0,0]=3 275 B13R2.12 Ic1ccc(-c2ccon2)cc1 Amb27197638 [0,1,0,0,0,1|2,0,0]=4 276 B13R2.12 Nc1ccc(-c2ccon2)cc1 Amb22008913 [0,1,0,0,0,1|2,0,0]=4 277 B13R2.12 Nc1ccc(-c2ccon2)cc1 Amb30584927 [0,1,0,0,0,1|2,0,0]=4 278 B13R2.12 Nc1ccc(-c2ccon2)nc1 Amb18830032 [0,1,0,0,0,1|2,0,0]=4 279 B13R2.12 Nc1ccc(-c2cnoc2)cc1 Amb18862542 [0,1,0,0,0,1|2,0,0]=4 280 B13R2.12 Nc1ccc(-c2cnoc2)nc1 Amb18830035 [0,1,0,0,0,1|2,0,0]=4 281 B13R2.12 Nc1cnc(-c2ccoc2)cn1 Amb10599494 [0,1,0,0,0,1|2,0,0]=4 282 B13R2.12 Nc1cnc(-c2ccsc2)cn1 Amb10599491 [0,1,0,0,0,1|2,0,0]=4 283 B13R2.12 Nc1ncc(-c2ccoc2)cn1 Amb20617987 [0,1,0,0,0,1|2,0,0]=4 284 B13R2.12 Nc1ncc(-c2ccsc2)cn1 Amb20617984 [0,1,0,0,0,1|2,0,0]=4 285 B13R2.12 O=C1C=NC(c2cnsc2)=CN1 Amb35731238 [0,1,0,0,0,1|1,1,0]=4 286 B13R2.12 O=C1N=CC(c2cncs2)=CN1 Amb35616697 [0,1,0,0,0,1|2,0,0]=4 287 B13R2.12 O=C1N=CC(c2cnsc2)=CN1 Amb35731239 [0,1,0,0,0,1|1,1,0]=4 288 B13R2.12 O=C1N=CC(c2cscn2)=CN1 Amb28323937 [0,1,0,0,0,1|2,0,0]=4 289 B13R2.12 Oc1cnc(-c2ccoc2)cn1 Amb10599495 [0,1,0,0,0,1|2,0,0]=4 290 B13R2.12 Oc1cnc(-c2ccsc2)cn1 Amb10599492 [0,1,0,0,0,1|2,0,0]=4 291 B13R2.12 Oc1ncc(-c2ccoc2)cn1 Amb20617988 [0,1,0,0,0,1|2,0,0]=4 292 B13R2.12 Oc1ncc(-c2ccsc2)cn1 Amb20617985 [0,1,0,0,0,1|2,0,0]=4 293 B13R2.12 S=C1C=NC(c2cncs2)=CN1 Amb35616706 [0,1,0,0,0,1|2,0,0]=4 294 B13R2.12 S=C1C=NC(c2cnsc2)=CN1 Amb35731253 [0,1,0,0,0,1|1,1,0]=4 295 B13R2.13 BrC1=C\C(=C2/C=NN=N2)C=CN1 Amb27947084 [0,1,0,0,0,1|1,0,0]=3 296 B13R2.13 Brc1cc(-c2ccoc2)ncn1 Amb10600036 [0,1,0,0,0,1|2,0,0]=4 297 B13R2.13 Brc1cc(-c2ccsc2)ncn1 Amb10600039 [0,1,0,0,0,1|2,0,0]=4 298 B13R2.13 Brc1cc(-c2cnoc2)ccn1 Amb20617708 [0,1,0,0,0,1|1,0,1]=4 299 B13R2.13 Brc1cccc(-c2cnon2)c1 Amb33624979 [0,1,0,0,0,1|1,0,0]=3 300 B13R2.13 Brc1cncc(-c2ccoc2)n1 Amb10600343 [0,1,0,0,0,1|2,0,0]=4 301 B13R2.13 Brc1cncc(-c2ccon2)c1 Amb35676771 [0,1,0,0,0,1|1,0,1]=4 302 B13R2.13 Brc1cncc(-c2ccsc2)n1 Amb10600340 [0,1,0,0,0,1|2,0,0]=4 303 B13R2.13 Brc1ncnc(-c2ccoc2)n1 Amb24319415 [0,1,0,0,0,1|2,0,0]=4 304 B13R2.13 Brc1ncnc(-c2ccsc2)n1 Amb24319407 [0,1,0,0,0,1|2,0,0]=4 305 B13R2.13 Cc1cccc(-c2ccon2)c1 Amb27222119 [0,1,0,0,0,1|2,0,0]=4 306 B13R2.13 Clc1cc(-c2ccoc2)ncn1 Amb28046918 [0,1,0,0,0,1|2,0,0]=4 307 B13R2.13 Clc1cccc(-c2ccon2)c1 Amb25782731 [0,1,0,0,0,1|2,0,0]=4 308 B13R2.13 Clc1cccc(-c2cnon2)c1 Amb33624982 [0,1,0,0,0,1|1,0,0]=3 309 B13R2.13 Clc1nccc(-c2ccoc2)n1 Amb13884432 [0,1,0,0,0,1|2,0,0]=4 310 B13R2.13 Clc1nccc(-c2ccsc2)n1 Amb13884434 [0,1,0,0,0,1|2,0,0]=4 311 B13R2.13 Clc1ncnc(-c2ccoc2)n1 Amb24319413 [0,1,0,0,0,1|2,0,0]=4 312 B13R2.13 Fc1cccc(-c2cnon2)c1 Amb33624984 [0,1,0,0,0,1|1,0,0]=3 313 B13R2.13 Nc1cc(-c2ccoc2)ncn1 Amb10600037 [0,1,0,0,0,1|2,0,0]=4 314 B13R2.13 Nc1cc(-c2ccsc2)ncn1 Amb10600040 [0,1,0,0,0,1|2,0,0]=4 315 B13R2.13 Nc1cc(-c2cnoc2)ccn1 Amb18830042 [0,1,0,0,0,1|1,0,1]=4 316 B13R2.13 Nc1cccc(-c2ccon2)c1 Amb24085085 [0,1,0,0,0,1|2,0,0]=4 317 B13R2.13 Nc1cccc(-c2ccon2)c1 Amb30584935 [0,1,0,0,0,1|2,0,0]=4 318 B13R2.13 Nc1cccc(-c2ccon2)n1 Amb18830080 [0,1,0,0,0,1|2,0,0]=4 319 B13R2.13 Nc1cccc(-c2cnoc2)c1 Amb18862543 [0,1,0,0,0,1|2,0,0]=4 320 B13R2.13 Nc1cccc(-c2cnoc2)n1 Amb18830081 [0,1,0,0,0,1|2,0,0]=4 321 B13R2.13 Nc1cncc(-c2ccoc2)n1 Amb10600344 [0,1,0,0,0,1|2,0,0]=4 322 B13R2.13 Nc1cncc(-c2ccon2)c1 Amb18830029 [0,1,0,0,0,1|1,0,1]=4 323 B13R2.13 Nc1cncc(-c2ccsc2)n1 Amb10600341 [0,1,0,0,0,1|2,0,0]=4 324 B13R2.13 Nc1nccc(-c2ccsc2)n1 Amb6384152 [0,1,0,0,0,1|2,0,0]=4 325 B13R2.13 Nc1ncnc(-c2ccoc2)n1 Amb24319416 [0,1,0,0,0,1|2,0,0]=4 326 B13R2.13 Nc1ncnc(-c2ccsc2)n1 Amb24319408 [0,1,0,0,0,1|2,0,0]=4 327 B13R2.13 O=C1C=C(c2cncs2)C=NN1 Amb35616698 [0,1,0,0,0,1|2,0,0]=4 328 B13R2.13 O=C1C=C(c2cncs2)N=CN1 Amb35616702 [0,1,0,0,0,1|2,0,0]=4 329 B13R2.13 O=C1C=C(c2cnsc2)C=NN1 Amb35731242 [0,1,0,0,0,1|1,1,0]=4 330 B13R2.13 O=C1C=C(c2cnsc2)N=CN1 Amb35731248 [0,1,0,0,0,1|1,1,0]=4 331 B13R2.13 O=C1C=C(c2cscn2)N=CN1 Amb27648237 [0,1,0,0,0,1|2,0,0]=4 332 B13R2.13 O=C1N=C(c2ccoc2)C=CN1 Amb27852809 [0,1,0,0,0,1|2,0,0]=4 333 B13R2.13 O=C1N=C(c2cnoc2)C=CN1 Amb22497926 [0,1,0,0,0,1|1,0,0]=3 334 B13R2.13 O=C1N=C(c2cnsc2)C=CN1 Amb35731240 [0,1,0,0,0,1|1,1,0]=4 335 B13R2.13 Oc1cc(-c2ccoc2)ncn1 Amb10600038 [0,1,0,0,0,1|2,0,0]=4 336 B13R2.13 Oc1cc(-c2ccsc2)ncn1 Amb10600041 [0,1,0,0,0,1|2,0,0]=4 337 B13R2.13 Oc1cncc(-c2ccoc2)n1 Amb10600345 [0,1,0,0,0,1|2,0,0]=4 338 B13R2.13 Oc1cncc(-c2ccsc2)n1 Amb10600342 [0,1,0,0,0,1|2,0,0]=4 339 B13R2.13 S=C1C=C(c2cncs2)C=NN1 Amb35616711 [0,1,0,0,0,1|2,0,0]=4 340 B13R2.13 S=C1C=C(c2cncs2)N=CN1 Amb35616707 [0,1,0,0,0,1|2,0,0]=4 341 B13R2.13 S=C1C=C(c2cnsc2)C=NN1 Amb35731257 [0,1,0,0,0,1|1,1,0]=4 342 B13R2.13 S=C1C=C(c2cnsc2)N=CN1 Amb35731245 [0,1,0,0,0,1|1,1,0]=4 343 B13R2.13 S=C1C=C(c2cscn2)N=CN1 Amb28386109 [0,1,0,0,0,1|2,0,0]=4 344 B13R2.13 S=C1N=C(c2ccsn2)C=CN1 Amb28363633 [0,1,0,0,0,1|1,1,0]=4 345 B13R2.13 S=C1N=C(c2cncs2)C=CN1 Amb35616709 [0,1,0,0,0,1|2,0,0]=4 346 B13R2.13 S=C1N=C(c2cnsc2)C=CN1 Amb35731255 [0,1,0,0,0,1|1,1,0]=4 347 B13R2.13 Sc1nccc(-c2ccsc2)n1 Amb20413927 [0,1,0,0,0,1|2,0,0]=4 348 B13R2.15 Brc1nonc1-c2ccccn2 Amb18160719 [0,1,0,0,0,1|1,0,0]=3 349 B13R2.15 Brc1nsnc1-c2ccccc2 Amb27642311 [0,1,0,0,0,1|1,1,0]=4 350 B13R2.15 Brc1occc1-c2cncnc2 Amb13884556 [0,1,0,0,0,1|2,0,0]=4 351 B13R2.15 Brc1oncc1-c2ccccc2 Amb28129423 [0,1,0,0,0,1|2,0,0]=4 352 B13R2.15 Brc1sccc1-c2cncnc2 Amb13884555 [0,1,0,0,0,1|2,0,0]=4 353 B13R2.15 Cc1conc1-c2ccccc2 Amb25112012 [0,1,0,0,0,1|2,0,0]=4 354 B13R2.15 Cc1nocc1-c2ccccc2 Amb24707807 [0,1,0,0,0,1|2,0,0]=4 355 B13R2.15 Cc1nonc1-c2ccccc2 Amb22397210 [0,1,0,0,0,1|1,0,0]=3 356 B13R2.15 Cc1oncc1-c2ccccc2 Amb27243828 [0,1,0,0,0,1|2,0,0]=4 357 B13R2.15 Clc1nonc1-c2ccccc2 Amb20670958 [0,1,0,0,0,1|1,0,0]=3 358 B13R2.15 Clc1nonc1-c2cccnc2 Amb23455591 [0,1,0,0,0,1|0,0,1]=3 359 B13R2.15 Clc1nsnc1-c2ccccc2 Amb3918909 [0,1,0,0,0,1|1,1,0]=4 360 B13R2.15 Clc1nsnc1-c2cccnc2 Amb10982581 [0,1,0,0,0,1|0,1,1]=4 361 B13R2.15 Nc1conc1-c2ccccc2 Amb23571001 [0,1,0,0,0,1|2,0,0]=4 362 B13R2.15 Nc1conc1-c2ccccc2 Amb33483683 [0,1,0,0,0,1|2,0,0]=4 363 B13R2.15 Nc1nocc1-c2ccccc2 Amb17334490 [0,1,0,0,0,1|2,0,0]=4 364 B13R2.15 Nc1nonc1-c2ccccc2 Amb6316076 [0,1,0,0,0,1|1,0,0]=3 365 B13R2.15 Nc1nonc1-c2ccccn2 Amb1094051 [0,1,0,0,0,1|1,0,0]=3 366 B13R2.15 Nc1nonc1-c2cccnc2 Amb1090910 [0,1,0,0,0,1|0,0,1]=3 367 B13R2.15 Nc1nonc1-c2ccncc2 Amb6890403 [0,1,0,0,0,1|0,0,1]=3 368 B13R2.15 Nc1oncc1-c2ccccc2 Amb2384414 [0,1,0,0,0,1|2,0,0]=4 369 B13R2.15 Nc1oncc1-c2ccccn2 Amb2724233 [0,1,0,0,0,1|2,0,0]=4 370 B13R2.15 Nc1oncc1-c2cccnc2 Amb10605657 [0,1,0,0,0,1|1,0,1]=4 371 B13R2.15 O=C1CON=C1c2ccccc2 Amb27407668 [0,1,0,0,0,1|2,0,0]=4 372 B13R2.15 O=C1NC=CN1c2cncnc2 Amb28067296 [0,1,0,0,0,1|2,0,0]=4 373 B13R2.15 Oc1nonc1-c2ccccc2 Amb1102100 [0,1,0,0,0,1|1,0,0]=3 374 B13R2.15 Oc1oncc1-c2ccccc2 Amb27490784 [0,1,0,0,0,1|2,0,0]=4 375 B13R2.18 Brc1ccccc1-c2ccon2 Amb27411103 [0,1,0,0,0,1|2,0,0]=4 376 B13R2.18 Brc1ccccc1-c2cnoc2 Amb18755046 [0,1,0,0,0,1|2,0,0]=4 377 B13R2.18 Brc1ccccc1-c2cnon2 Amb33624877 [0,1,0,0,0,1|1,0,0]=3 378 B13R2.18 Cc1ccccc1-c2ccon2 Amb27480440 [0,1,0,0,0,1|2,0,0]=4 379 B13R2.18 Cc1ccccc1-c2cnoc2 Amb27814590 [0,1,0,0,0,1|2,0,0]=4 380 B13R2.18 Cc1ccccc1-c2cnon2 Amb33623532 [0,1,0,0,0,1|1,0,0]=3 381 B13R2.18 Cc1nccnc1-c2ccon2 Amb28345136 [0,1,0,0,0,1|1,0,1]=4 382 B13R2.18 Clc1ccccc1-c2ccon2 Amb27808342 [0,1,0,0,0,1|2,0,0]=4 383 B13R2.18 Clc1ccccc1-c2cnon2 Amb33624980 [0,1,0,0,0,1|1,0,0]=3 384 B13R2.18 Fc1ccccc1-c2cnon2 Amb33624983 [0,1,0,0,0,1|1,0,0]=3 385 B13R2.18 Nc1ccccc1-c2ccon2 Amb24496012 [0,1,0,0,0,1|2,0,0]=4 386 B13R2.18 Nc1ccccc1-c2cnsn2 Amb27476003 [0,1,0,0,0,1|1,1,0]=4 387 B13R2.18 Nc1cccnc1-c2ccon2 Amb18830037 [0,1,0,0,0,1|2,0,0]=4 388 B13R2.18 Nc1cccnc1-c2cnoc2 Amb18830038 [0,1,0,0,0,1|2,0,0]=4 389 B13R2.18 Nc1cnccc1-c2ccon2 Amb18830045 [0,1,0,0,0,1|1,0,1]=4 390 B13R2.18 Nc1cnccc1-c2cnoc2 Amb18830046 [0,1,0,0,0,1|1,0,1]=4 391 B13R2.18 Nc1ncccc1-c2cnoc2 Amb18830040 [0,1,0,0,0,1|1,0,1]=4 392 B13R2.18 O=C1NC=CN=C1c2ccsn2 Amb27600639 [0,1,0,0,0,1|1,1,0]=4 393 B13R2.18 O=C1NC=CN=C1c2cncs2 Amb35616701 [0,1,0,0,0,1|2,0,0]=4 394 B13R2.18 O=C1NC=CN=C1c2cnsc2 Amb35731247 [0,1,0,0,0,1|1,1,0]=4 395 B13R2.18 O=C1NC=NC=C1c2ccsn2 Amb28249696 [0,1,0,0,0,1|1,1,0]=4 396 B13R2.18 O=C1NC=NC=C1c2cncs2 Amb35616700 [0,1,0,0,0,1|2,0,0]=4 397 B13R2.18 O=C1NC=NC=C1c2cnsc2 Amb35731244 [0,1,0,0,0,1|1,1,0]=4 398 B13R2.18 Oc1ccccc1-c2cnoc2 Amb23313305 [0,1,0,0,0,1|2,0,0]=4 399 B13R2.18 Oc1ccccc1-c2cnon2 Amb18645585 [0,1,0,0,0,1|1,0,0]=3 400 B13R2.18 S=C1NC=CN=C1c2cncs2 Amb35616710 [0,1,0,0,0,1|2,0,0]=4 401 B13R2.18 S=C1NC=CN=C1c2cnsc2 Amb35731256 [0,1,0,0,0,1|1,1,0]=4 402 B13R2.18 S=C1NC=NC=C1c2cncs2 Amb35616705 [0,1,0,0,0,1|2,0,0]=4 403 B13R2.18 S=C1NC=NC=C1c2cnsc2 Amb35731252 [0,1,0,0,0,1|1,1,0]=4 404 B13R2.142 Nc1cc(Cc2ccon2)co1 Amb18674042 [0,1,0,0,0,1|2,0,0]=4 405 B13R2.674 OC(c1ccoc1)c2cnsn2 Amb27840782 [0,1,0,0,0,1|1,1,0]=4 406 B13R2.11 Cc1cc(-c2cc(N)on2)co1 Amb27436059 [0,2,0,0,0,0|2,0,0]=4 407 B13R2.11 Cc1cc(-c2ccn(C)n2)no1 Amb22292295 [0,2,0,0,0,0|2,0,0]=4 408 B13R2.11 Cn1cc(-c2cc(N)on2)cn1 Amb24364030 [0,2,0,0,0,0|2,0,0]=4 409 B13R2.11 Cn1ccc(-c2cc(N)on2)c1 Amb18862572 [0,2,0,0,0,0|1,0,0]=3 410 B13R2.11 Cn1ccc(-c2cc(N)on2)n1 Amb23511912 [0,2,0,0,0,0|2,0,0]=4 411 B13R2.11 Cn1ccc(-c2cnc(N)o2)c1 Amb18563567 [0,2,0,0,0,0|2,0,0]=4 412 B13R2.11 Cn1ccc(-c2coc(N)n2)c1 Amb18563568 [0,2,0,0,0,0|2,0,0]=4 413 B13R2.11 Cn1ccc(-c2csc(N)n2)c1 Amb845348 [0,2,0,0,0,0|2,0,0]=4 414 B13R2.11 Cn1ccc(-c2csc(S)n2)c1 Amb18565887 [0,2,0,0,0,0|2,0,0]=4 415 B13R2.11 Cn1cnc(-c2cc(N)on2)c1 Amb27752471 [0,2,0,0,0,0|2,0,0]=4 416 B13R2.11 Nc1cc(-c2csc(Br)c2)no1 Amb27197322 [0,2,0,0,0,0|2,0,0]=4 417 B13R2.144 Cc1cscc1-c2cc(N)on2 Amb27650821 [0,2,0,0,0,0|2,0,0]=4 418 B13R2.144 Cc1nc(-c2nonc2N)co1 Amb18827959 [0,2,0,0,0,0|2,0,0]=4 419 B13R2.144 Cc1nc(-c2nonc2N)cs1 Amb18823765 [0,2,0,0,0,0|2,0,0]=4 420 B13R2.144 Cc1nonc1-c2csc(N)n2 Amb1020138 [0,2,0,0,0,0|2,0,0]=4 421 B13R2.144 Cc1nonc1-c2csc(N)n2 Amb22282386 [0,2,0,0,0,0|2,0,0]=4 422 B13R2.144 Cc1occc1-c2cc(N)on2 Amb6717510 [0,2,0,0,0,0|2,0,0]=4 423 B13R2.144 Cn1ccc(-c2cnoc2N)c1 Amb18862573 [0,2,0,0,0,0|1,0,0]=3 424 B13R2.144 Cn1ccc(-c2ncsc2N)c1 Amb18862948 [0,2,0,0,0,0|2,0,0]=4 425 B13R2.144 Cn1cnc(-c2nsnc2Cl)c1 Amb29871070 [0,2,0,0,0,0|1,1,0]=4 426 B13R2.144 Cn1cnc(-c2nsnc2N)c1 Amb35678340 [0,2,0,0,0,0|1,1,0]=4 427 B13R2.144 Nc1cc(-c2ccsc2Br)no1 Amb29890970 [0,2,0,0,0,0|2,0,0]=4 428 B13R2.144 Nc1cc(-c2cscc2Br)no1 Amb29864284 [0,2,0,0,0,0|2,0,0]=4 429 B13R2.144 Nc1nonc1-c2ccc(Br)s2 Amb17350444 [0,2,0,0,0,0|2,0,0]=4 430 B13R2.144 Nc1nonc1-c2ccc(Cl)s2 Amb17337706 [0,2,0,0,0,0|2,0,0]=4 431 B13R2.149 Cn1nc(-c2ccon2)cc1N Amb33199043 [0,2,0,0,0,0|2,0,0]=4 432 B13R2.4666 Cc1cc(-c2ccon2)c(C)o1 Amb27198393 [0,2,0,0,0,0|2,0,0]=4 433 B13R2.61 NCc1nonc1-c2ccco2 Amb18828590 [0,2,0,0,0,0|2,0,0]=4 434 B13R2.61 NCc1nonc1-n2cccc2 Amb18828943 [0,2,0,0,0,0|2,0,0]=4 435 B13R2.61 NCc1sccc1-c2ccon2 Amb35585612 [0,2,0,0,0,0|2,0,0]=4 436 B13R2.61 O=Cc1cscc1-c2cnoc2 Amb18681090 [0,2,0,0,0,0|2,0,0]=4 437 B13R2.181 Cn1cncc1-c2nonc2N Amb18828509 [0,2,0,0,0,0|1,0,1]=4 438 B11R2.106 Brc1cccc2nonc12 Amb25146444 [0,0,1,1,0,0|2,0,0]=4 439 B11R2.106 Cc1cccc2nonc12 Amb2778456 [0,0,1,1,0,0|1,0,1]=4 440 B11R2.106 Clc1cccc2nonc12 Amb1076554 [0,0,1,1,0,0|2,0,0]=4 441 B11R2.106 Fc1cccc2nonc12 Amb17614386 [0,0,1,1,0,0|2,0,0]=4 442 B11R2.106 Nc1cccc2nonc12 Amb33527271 [0,0,1,1,0,0|2,0,0]=4 443 B11R2.106 Oc1cccc2nonc12 Amb4139677 [0,0,1,1,0,0|2,0,0]=4 444 B13R3.1913 C1=CC2=C3C=NC(OC3)C2=C1 Amb26583468 [0,0,0,1,0,1|2,0,0]=4 445 B11R1.12 C=C\C(=N/O)c1ccccc1 Amb5718393 [0,0,1,0,0,1|2,0,0]=4 446 B11R1.12 N=C\C(=C\O)c1ccccc1 Amb27397057 [0,0,1,0,0,1|2,0,0]=4 447 B11R1.12 O=C\C(=N/O)c1ccccc1 Amb28345218 [0,0,1,0,0,1|2,0,0]=4 448 B11R1.12 O=C\C(=N\O)c1ccccc1 Amb26580467 [0,0,1,0,0,1|2,0,0]=4 449 B11R1.16 O=C(\C=N\O)c1ccccc1 Amb2781112 [0,0,1,0,0,1|2,0,0]=4 450 B13R2.3 C1=CC(c2ccncc2)=CCN1 Amb27230131 [0,0,0,0,0,2|2,0,0]=4 451 B13R2.3 C1=CNC=C(c2ccccn2)C1 Amb27484097 [0,0,0,0,0,2|2,0,0]=4 452 B13R2.3 c1cc(-c2ccncn2)ncn1 Amb22730775 [0,0,0,0,0,2|1,0,1]=4 453 B13R2.3 c1cc(-c2cnccn2)ccn1 Amb25052460 [0,0,0,0,0,2|1,0,1]=4 454 B13R2.3 c1cc(-c2ncncn2)ccn1 Amb22266715 [0,0,0,0,0,2|1,0,1]=4 455 B13R2.3 c1ccc(-c2ccncn2)cc1 Amb2609975 [0,0,0,0,0,2|2,0,0]=4 456 B13R2.3 c1ccc(-c2ccncn2)nc1 Amb4009176 [0,0,0,0,0,2|2,0,0]=4 457 B13R2.3 c1ccc(-c2cnccn2)cc1 Amb2610101 [0,0,0,0,0,2|2,0,0]=4 458 B13R2.3 c1ccc(-c2cncnc2)cc1 Amb2196491 [0,0,0,0,0,2|2,0,0]=4 459 B13R2.3 c1ccc(-c2ncncn2)cc1 Amb27453528 [0,0,0,0,0,2|2,0,0]=4 460 B13R2.3 c1cnc(-c2ncncn2)cn1 Amb27843683 [0,0,0,0,0,2|1,0,1]=4 461 B13R2.3 c1cncc(-c2ccncn2)c1 Amb22494533 [0,0,0,0,0,2|1,0,1]=4 462 B13R2.3 c1cncc(-c2cnccn2)c1 Amb26643103 [0,0,0,0,0,2|1,0,1]=4 463 B13R2.64 c1ccc(Oc2ccon2)cc1 Amb26600905 [0,0,0,0,0,2|2,0,0]=4 464 B13R2.64 c1ccc(Oc2cnsn2)cc1 Amb24116477 [0,0,0,0,0,2|1,1,0]=4 465 B13R2.183 c1cc(NCc2cnsn2)cs1 Amb27783495 [0,0,0,0,0,2|1,1,0]=4