0 B14R2.7724 CC1=C(C)c2ccccc2C(=O)N1 Amb23454481 [0,0,0,0,0,0|3,0,1]=4 1 B14R2.7724 CC1=C2C=CC=CC2=C(C)C(=O)N1 Amb27658771 [0,0,0,0,0,0|3,0,0]=3 2 B14R2.7724 CC1=CC(=O)N(C)c2ccccc21 Amb19653965 [0,0,0,0,0,0|1,0,0]=1 3 B14R2.7724 CC1=CC(=O)N(N)c2ccccc21 Amb18647836 [0,0,0,0,0,0|2,0,0]=2 4 B14R2.7724 CC1=CC(=O)c2ccccc2C1=O Amb2717711 [0,0,0,0,0,0|3,0,1]=4 5 B14R2.7724 CC1=NC(=O)c2ccccc2N1C Amb22753723 [0,0,0,0,0,0|2,0,1]=3 6 B14R2.7724 CC1C(=O)NC(=O)c2ccccc21 Amb22364372 [0,0,0,0,0,0|2,0,1]=3 7 B14R2.7724 CC1CC(=O)N(C)c2ccccc21 Amb18061648 [0,0,0,0,0,0|1,0,2]=3 8 B14R2.7724 CC1NC(=O)c2ccccc2N1C Amb27446680 [0,0,0,0,0,0|2,0,2]=4 9 B14R2.7724 CN1C(=O)C=C(Cl)c2ccccc21 Amb17997066 [0,0,0,0,0,0|1,0,0]=1 10 B14R2.7724 CN1C(=O)C=C(N)c2ccccc21 Amb18127278 [0,0,0,0,0,0|1,0,0]=1 11 B14R2.7724 CN1C(=O)C=C(O)c2ccccc21 Amb18011109 [0,0,0,0,0,0|0,0,0]=0 12 B14R2.7724 CN1C(=O)CC(=O)c2ccccc21 Amb1421567 [0,0,0,0,0,0|0,0,2]=2 13 B14R2.7724 CN1C(=O)CC(N)c2ccccc21 Amb9620854 [0,0,0,0,0,0|1,0,2]=3 14 B14R2.7724 CN1C(=O)CC(S)c2ccccc21 Amb32788830 [0,0,0,0,0,0|0,1,2]=3 15 B14R2.7724 CN1C(=O)N=C(N)c2nccnc21 Amb28290364 [0,0,0,0,0,0|4,0,0]=4 16 B14R2.7724 CN1C(=O)NC(=O)c2ccccc21 Amb19516832 [0,0,0,0,0,0|1,0,1]=2 17 B14R2.7724 CN1C(=O)NC(=O)c2cccnc21 Amb22713456 [0,0,0,0,0,0|2,0,1]=3 18 B14R2.7724 CN1C(=O)NC(=O)c2cncnc21 Amb25040138 [0,0,0,0,0,0|3,0,1]=4 19 B14R2.7724 CN1C(=O)NC(=S)c2ccccc21 Amb27407873 [0,0,0,0,0,0|1,1,0]=2 20 B14R2.7724 CN1C(=O)OC(=O)c2ccccc21 Amb17933878 [0,0,0,0,0,0|1,0,1]=2 21 B14R2.7724 CN1C(=O)OC(=O)c2cccnc21 Amb19891273 [0,0,0,0,0,0|2,0,1]=3 22 B14R2.7724 CN1C(=O)OC(=O)c2ncccc21 Amb27258228 [0,0,0,0,0,0|2,0,1]=3 23 B14R2.7724 CN1C(N)=CC(=O)c2ccccc21 Amb27484098 [0,0,0,0,0,0|1,0,1]=2 24 B14R2.7724 CN1C(N)=NC(=O)c2ccccc21 Amb18647897 [0,0,0,0,0,0|2,0,1]=3 25 B14R2.7724 CN1C(O)=CC(=O)c2ccccc21 Amb22564234 [0,0,0,0,0,0|0,0,2]=2 26 B14R2.7724 CN1C(S)=NC(=O)c2ccccc21 Amb21867966 [0,0,0,0,0,0|1,1,1]=3 27 B14R2.7724 CN1C(S)=NC(=O)c2cccnc21 Amb19769483 [0,0,0,0,0,0|2,1,1]=4 28 B14R2.7724 CN1C=C(O)c2ccccc2C1=O Amb24761294 [0,0,0,0,0,0|4,0,0]=4 29 B14R2.7724 CN1CC(=O)N(C)c2ccccc21 Amb20462941 [0,0,0,0,0,0|2,0,1]=3 30 B14R2.7724 Cc1c(Cl)cc(N)c2ccccc12 Amb28250139 [0,0,0,0,0,0|3,0,0]=3 31 B14R2.7724 Cc1c(Cl)nc(Br)c2ccccc12 Amb25034223 [0,0,0,0,0,0|4,0,0]=4 32 B14R2.7724 Cc1c(Cl)nc(Cl)c2ccccc12 Amb23440668 [0,0,0,0,0,0|4,0,0]=4 33 B14R2.7724 Cc1c(F)cc(Br)c2cccnc12 Amb33623503 [0,0,0,0,0,0|4,0,0]=4 34 B14R2.7724 Cc1c(F)cc(Br)c2ncccc12 Amb23448762 [0,0,0,0,0,0|4,0,0]=4 35 B14R2.7724 Cc1c(F)cc(Cl)c2ncccc12 Amb27204782 [0,0,0,0,0,0|4,0,0]=4 36 B14R2.7724 Cc1c(F)cc(I)c2ncccc12 Amb23448764 [0,0,0,0,0,0|4,0,0]=4 37 B14R2.7724 Cc1c(F)cc(N)c2cccnc12 Amb26850508 [0,0,0,0,0,0|4,0,0]=4 38 B14R2.7724 Cc1c(F)cc(N)c2ncccc12 Amb23448759 [0,0,0,0,0,0|4,0,0]=4 39 B14R2.7724 Cc1c(F)cc(O)c2ncccc12 Amb23448766 [0,0,0,0,0,0|3,0,0]=3 40 B14R2.7724 Cc1c(F)nc(Br)c2ccccc12 Amb27813113 [0,0,0,0,0,0|4,0,0]=4 41 B14R2.7724 Cc1c(N)cc(C)c2ncccc12 Amb27841876 [0,0,0,0,0,0|4,0,0]=4 42 B14R2.7724 Cc1c(N)cc(F)c2cccnc12 Amb27407005 [0,0,0,0,0,0|4,0,0]=4 43 B14R2.7724 Cc1c(N)cc(N)c2ccccc12 Amb28366076 [0,0,0,0,0,0|3,0,0]=3 44 B14R2.7724 Cc1c(N)nc(I)c2ccccc12 Amb27466231 [0,0,0,0,0,0|4,0,0]=4 45 B14R2.7724 Cc1c(O)cc(C)c2ncccc12 Amb27448019 [0,0,0,0,0,0|3,0,1]=4 46 B14R2.7724 Cc1cc(Br)c(C)c2cnccc12 Amb27778606 [0,0,0,0,0,0|4,0,0]=4 47 B14R2.7724 Cc1cc(Br)c2ccccc2c1N Amb18135739 [0,0,0,0,0,0|4,0,0]=4 48 B14R2.7724 Cc1cc(Br)c2ncccc2c1C Amb23589107 [0,0,0,0,0,0|4,0,0]=4 49 B14R2.7724 Cc1cc(C)c2ccccc2c1C Amb341458 [0,0,0,0,0,0|3,0,0]=3 50 B14R2.7724 Cc1cc(C)c2ccccc2c1N Amb22751127 [0,0,0,0,0,0|4,0,0]=4 51 B14R2.7724 Cc1cc(C)c2ccncc2c1C Amb32670329 [0,0,0,0,0,0|4,0,0]=4 52 B14R2.7724 Cc1cc(Cl)c(N)c2ccccc12 Amb27144697 [0,0,0,0,0,0|4,0,0]=4 53 B14R2.7724 Cc1cc(Cl)c2ccccc2[n+]1C Amb22359536 [0,0,0,0,0,0|2,0,1]=3 54 B14R2.7724 Cc1cc(Cl)c2ccccc2[n+]1[O-] Amb4466948 [0,0,0,0,0,0|3,0,1]=4 55 B14R2.7724 Cc1cc(Cl)c2ccccc2c1N Amb18650981 [0,0,0,0,0,0|4,0,0]=4 56 B14R2.7724 Cc1cc(Cl)c2ccccc2c1O Amb24408291 [0,0,0,0,0,0|4,0,0]=4 57 B14R2.7724 Cc1cc(N)c(C)c2ccccc12 Amb27983799 [0,0,0,0,0,0|3,0,0]=3 58 B14R2.7724 Cc1cc(N)c(C)c2cnccc12 Amb27599835 [0,0,0,0,0,0|4,0,0]=4 59 B14R2.7724 Cc1cc(N)c2ccccc2c1C Amb18647537 [0,0,0,0,0,0|3,0,0]=3 60 B14R2.7724 Cc1cc(N)c2ccccc2c1N Amb17594326 [0,0,0,0,0,0|4,0,0]=4 61 B14R2.7724 Cc1cc(N)c2ccccc2c1O Amb9827067 [0,0,0,0,0,0|4,0,0]=4 62 B14R2.7724 Cc1cc(N)c2cccnc2c1C Amb19337852 [0,0,0,0,0,0|4,0,0]=4 63 B14R2.7724 Cc1cc(N)c2ncccc2c1C Amb22899683 [0,0,0,0,0,0|4,0,0]=4 64 B14R2.7724 Cc1cc(O)c(C)c2cnccc12 Amb27260467 [0,0,0,0,0,0|3,0,1]=4 65 B14R2.7724 Cc1cc(O)c2ccccc2c1N Amb17594348 [0,0,0,0,0,0|3,0,0]=3 66 B14R2.7724 Cc1cc(O)c2ncccc2c1C Amb23589109 [0,0,0,0,0,0|3,0,0]=3 67 B14R2.7724 Cc1nc(Br)c2ccccc2c1C Amb23560121 [0,0,0,0,0,0|4,0,0]=4 68 B14R2.7724 Cc1nc(C)c2ccccc2c1C Amb23560141 [0,0,0,0,0,0|4,0,0]=4 69 B14R2.7724 Cc1nc(Cl)c2ccccc2c1C Amb23454482 [0,0,0,0,0,0|4,0,0]=4 70 B14R2.7724 Cc1nc(N)c2ccccc2c1C Amb23454483 [0,0,0,0,0,0|4,0,0]=4 71 B14R2.7724 Cc1nc(S)c2ccccc2c1C Amb23560123 [0,0,0,0,0,0|3,1,0]=4 72 B14R2.7724 Clc1c(I)cc(Br)c2ccccc12 Amb22546705 [0,0,0,0,0,0|4,0,0]=4 73 B14R2.7724 Cn1c(=O)cc(S)c2ccccc21 Amb2794682 [0,0,0,0,0,0|0,1,0]=1 74 B14R2.7724 Cn1c(=O)nc(=O)c2nccnc21 Amb2609208 [0,0,0,0,0,0|3,0,1]=4 75 B14R2.7724 N=C1C=C(N)C(=O)c2ccccc21 Amb17594308 [0,0,0,0,0,0|4,0,0]=4 76 B14R2.7724 NC1=CC(=O)C(=O)c2ccccc21 Amb17594342 [0,0,0,0,0,0|3,0,0]=3 77 B14R2.7724 NC1=CC(=O)N(O)c2ncccc21 Amb27644172 [0,0,0,0,0,0|3,0,0]=3 78 B14R2.7724 NC1=CC(=O)c2ccccc2C1=O Amb2747896 [0,0,0,0,0,0|3,0,1]=4 79 B14R2.7724 NC1C(=O)NC(=O)c2ccccc21 Amb22751304 [0,0,0,0,0,0|3,0,1]=4 80 B14R2.7724 NN1C(=O)C=C(O)c2ccccc21 Amb27165265 [0,0,0,0,0,0|1,0,0]=1 81 B14R2.7724 Nc1c(Br)cc(Br)c2ccccc12 Amb4014476 [0,0,0,0,0,0|4,0,0]=4 82 B14R2.7724 Nc1c(Br)cc(F)c2ccccc12 Amb24594020 [0,0,0,0,0,0|4,0,0]=4 83 B14R2.7724 Nc1c(Cl)cc(Br)c2ccccc12 Amb24694987 [0,0,0,0,0,0|4,0,0]=4 84 B14R2.7724 Nc1c(Cl)cc(Cl)c2ccccc12 Amb17595709 [0,0,0,0,0,0|4,0,0]=4 85 B14R2.7724 Nc1c(O)cc(O)c2ccccc12 Amb17594428 [0,0,0,0,0,0|2,0,1]=3 86 B14R2.7724 Nc1cc(Br)c(Cl)c2ccccc12 Amb27467539 [0,0,0,0,0,0|4,0,0]=4 87 B14R2.7724 Nc1cc(Br)c(I)c2ccccc12 Amb25155017 [0,0,0,0,0,0|4,0,0]=4 88 B14R2.7724 Nc1cc(Br)c(N)c2ccccc12 Amb27986209 [0,0,0,0,0,0|4,0,0]=4 89 B14R2.7724 Nc1cc(Br)c(O)c2ccccc12 Amb32668034 [0,0,0,0,0,0|4,0,0]=4 90 B14R2.7724 Nc1cc(Cl)c(Cl)c2ccccc12 Amb26588367 [0,0,0,0,0,0|4,0,0]=4 91 B14R2.7724 Nc1cc(Cl)c(O)c2ccccc12 Amb26478609 [0,0,0,0,0,0|4,0,0]=4 92 B14R2.7724 Nc1cc(Cl)c2ccccc2c1Cl Amb17595704 [0,0,0,0,0,0|4,0,0]=4 93 B14R2.7724 Nc1cc(Cl)c2ccccc2c1O Amb27658868 [0,0,0,0,0,0|4,0,0]=4 94 B14R2.7724 Nc1cc(I)c(Br)c2ccccc12 Amb26317253 [0,0,0,0,0,0|4,0,0]=4 95 B14R2.7724 Nc1cc(I)c(I)c2ccccc12 Amb24441052 [0,0,0,0,0,0|4,0,0]=4 96 B14R2.7724 Nc1cc(N)c2ccccc2c1N Amb17594360 [0,0,0,0,0,0|4,0,0]=4 97 B14R2.7724 Nc1cc(N)c2ccccc2c1O Amb17594385 [0,0,0,0,0,0|4,0,0]=4 98 B14R2.7724 Nc1cc(O)c(N)c2ccccc12 Amb17594396 [0,0,0,0,0,0|3,0,1]=4 99 B14R2.7724 Nc1cc(O)c(O)c2ccccc12 Amb17594427 [0,0,0,0,0,0|3,0,1]=4 100 B14R2.7724 Nc1cc(O)c2ccccc2c1N Amb17594389 [0,0,0,0,0,0|3,0,0]=3 101 B14R2.7724 Nc1cc(O)c2ccccc2c1O Amb17594429 [0,0,0,0,0,0|3,0,0]=3 102 B14R2.7724 O=C1C=C(Br)C(=O)c2ccccc21 Amb2629377 [0,0,0,0,0,0|3,0,1]=4 103 B14R2.7724 O=C1C=C(Cl)C(=O)c2ccccc21 Amb4011279 [0,0,0,0,0,0|3,0,1]=4 104 B14R2.7724 O=C1C=C(O)C(=O)c2ccccc21 Amb533267 [0,0,0,0,0,0|2,0,2]=4 105 B14R2.7724 O=C1C=C(O)c2cccnc2N1O Amb28205194 [0,0,0,0,0,0|2,0,0]=2 106 B14R2.7724 O=C1C=C(O)c2ncccc2C1=O Amb27212014 [0,0,0,0,0,0|3,0,0]=3 107 B14R2.7724 O=C1C=[N+]([O-])c2ccccc2N1O Amb21913117 [0,0,0,0,0,0|2,0,1]=3 108 B14R2.7724 O=C1NC(=O)N(Cl)c2ccccc21 Amb27606447 [0,0,0,0,0,0|2,0,1]=3 109 B14R2.7724 O=C1NC(=O)N(O)c2ccccc21 Amb27876620 [0,0,0,0,0,0|2,0,1]=3 110 B14R2.7724 O=C1NC(=O)c2ccccc2C1=O Amb8391652 [0,0,0,0,0,0|3,0,1]=4 111 B14R2.7724 Oc1c(Br)cc(Br)c2ccccc12 Amb20240597 [0,0,0,0,0,0|4,0,0]=4 112 B14R2.7724 Oc1c(Cl)cc(Cl)c2ccccc12 Amb3939634 [0,0,0,0,0,0|4,0,0]=4 113 B14R2.7724 Oc1c(F)cc(F)c2ccccc12 Amb18128534 [0,0,0,0,0,0|4,0,0]=4 114 B14R2.7724 Oc1c(I)cc(Cl)c2ccccc12 Amb20248186 [0,0,0,0,0,0|4,0,0]=4 115 B14R2.7724 Oc1cc(Cl)c(O)c2ccccc12 Amb18130135 [0,0,0,0,0,0|3,0,0]=3 116 B14R2.7724 Oc1cc(Cl)c2ccccc2c1Cl Amb17595765 [0,0,0,0,0,0|3,0,1]=4 117 B14R2.7724 Oc1cc(F)c(F)c2cccnc12 Amb27971479 [0,0,0,0,0,0|4,0,0]=4 118 B14R2.7724 Oc1cc(O)c2ccccc2c1Br Amb23537509 [0,0,0,0,0,0|2,0,1]=3 119 B14R2.7724 Oc1cc(O)c2ccccc2c1Cl Amb23537510 [0,0,0,0,0,0|2,0,1]=3 120 B14R2.7724 Oc1cc(O)c2ccccc2c1O Amb17594460 [0,0,0,0,0,0|2,0,1]=3 121 B14R2.7724 Oc1cc(O)c2cccnc2c1O Amb27410398 [0,0,0,0,0,0|3,0,1]=4 122 B14R2.7724 Oc1cc(S)c(O)c2ccccc12 Amb20247731 [0,0,0,0,0,0|2,1,0]=3 123 B13R2.32 Brc1ccc2ccccc2c1I Amb24594397 [1,0,0,0,0,0|3,0,0]=4 124 B13R2.32 C=C1C(=O)C=Cc2ccccc21 Amb27270865 [1,0,0,0,0,0|1,0,1]=3 125 B13R2.32 C=C1C=Cc2ccccc2N1C Amb25918137 [1,0,0,0,0,0|1,0,0]=2 126 B13R2.32 CC1=C2C=CC=CC2=CNC1=O Amb27857230 [1,0,0,0,0,0|2,0,0]=3 127 B13R2.32 CC1C(=O)CCc2ccccc21 Amb4605911 [1,0,0,0,0,0|1,0,2]=4 128 B13R2.32 CN1C(=O)C=Cc2ccccc21 Amb19116112 [1,0,0,0,0,0|0,0,0]=1 129 B13R2.32 CN1C(=O)C=Cc2cccnc21 Amb28365713 [1,0,0,0,0,0|1,0,0]=2 130 B13R2.32 CN1C(=O)C=Cc2cnccc21 Amb22491898 [1,0,0,0,0,0|1,0,0]=2 131 B13R2.32 CN1C(=O)C=Cc2ncccc21 Amb28254581 [1,0,0,0,0,0|1,0,0]=2 132 B13R2.32 CN1C(=O)CCc2ccccc21 Amb17322846 [1,0,0,0,0,0|0,0,2]=3 133 B13R2.32 CN1C(=O)CNc2ccccc21 Amb8471882 [1,0,0,0,0,0|1,0,1]=3 134 B13R2.32 CN1C(=O)CNc2cccnc21 Amb25997952 [1,0,0,0,0,0|2,0,1]=4 135 B13R2.32 CN1C(=O)CNc2ncccc21 Amb27265837 [1,0,0,0,0,0|2,0,1]=4 136 B13R2.32 CN1C(=O)COc2ccccc21 Amb1351378 [1,0,0,0,0,0|1,0,1]=3 137 B13R2.32 CN1C(=O)CSc2ccccc21 Amb3484441 [1,0,0,0,0,0|1,0,1]=3 138 B13R2.32 CN1C(=O)NCc2ccccc21 Amb28243973 [1,0,0,0,0,0|1,0,1]=3 139 B13R2.32 CN1C(=O)NCc2cccnc21 Amb27949163 [1,0,0,0,0,0|2,0,1]=4 140 B13R2.32 CN1C(=O)NCc2ncccc21 Amb27600581 [1,0,0,0,0,0|2,0,1]=4 141 B13R2.32 CN1C(=S)C=Cc2ccccc21 Amb19651670 [1,0,0,0,0,0|0,1,0]=2 142 B13R2.32 CN1C(=S)CCc2ccccc21 Amb28185012 [1,0,0,0,0,0|0,1,2]=4 143 B13R2.32 CN1c2ccccc2C=CC1O Amb27484700 [1,0,0,0,0,0|0,0,2]=3 144 B13R2.32 CN1c2ncccc2C=CC1N Amb27400299 [1,0,0,0,0,0|2,0,1]=4 145 B13R2.32 C[n+]1c(I)ccc2ccccc21 Amb348184 [1,0,0,0,0,0|1,0,1]=3 146 B13R2.32 C[n+]1c(N)ccc2ccccc21 Amb2609713 [1,0,0,0,0,0|1,0,1]=3 147 B13R2.32 Cc1c(Br)ccc2ccccc12 Amb21929204 [1,0,0,0,0,0|2,0,0]=3 148 B13R2.32 Cc1c(Br)ccc2cccnc12 Amb19895195 [1,0,0,0,0,0|3,0,0]=4 149 B13R2.32 Cc1c(Br)ccc2ncccc12 Amb27230462 [1,0,0,0,0,0|3,0,0]=4 150 B13R2.32 Cc1c(Br)cnc2ccccc12 Amb22263020 [1,0,0,0,0,0|3,0,0]=4 151 B13R2.32 Cc1c(Cl)ccc2ccccc12 Amb26843093 [1,0,0,0,0,0|2,0,0]=3 152 B13R2.32 Cc1c(Cl)ccc2cccnc12 Amb10607058 [1,0,0,0,0,0|3,0,0]=4 153 B13R2.32 Cc1c(F)ccc2ccccc12 Amb26880002 [1,0,0,0,0,0|2,0,0]=3 154 B13R2.32 Cc1c(F)ccc2cccnc12 Amb24454469 [1,0,0,0,0,0|3,0,0]=4 155 B13R2.32 Cc1c(F)cnc2ccccc12 Amb25872717 [1,0,0,0,0,0|3,0,0]=4 156 B13R2.32 Cc1c(I)ccc2ccccc12 Amb26367182 [1,0,0,0,0,0|2,0,0]=3 157 B13R2.32 Cc1c(N)ccc2ccccc12 Amb17593938 [1,0,0,0,0,0|2,0,0]=3 158 B13R2.32 Cc1c(N)ccc2ccncc12 Amb22753791 [1,0,0,0,0,0|3,0,0]=4 159 B13R2.32 Cc1c(N)ccc2cnccc12 Amb27175658 [1,0,0,0,0,0|3,0,0]=4 160 B13R2.32 Cc1c(N)cnc2ccccc12 Amb4016185 [1,0,0,0,0,0|3,0,0]=4 161 B13R2.32 Cc1c(O)ccc2ccccc12 Amb4016608 [1,0,0,0,0,0|1,0,1]=3 162 B13R2.32 Cc1c(O)ccc2ccncc12 Amb4013117 [1,0,0,0,0,0|2,0,1]=4 163 B13R2.32 Cc1c(O)ccc2ncccc12 Amb18645164 [1,0,0,0,0,0|2,0,1]=4 164 B13R2.32 Cc1c(O)ccc2ncccc12 Amb35748094 [1,0,0,0,0,0|2,0,1]=4 165 B13R2.32 Cc1c(O)cnc2ccccc12 Amb18645166 [1,0,0,0,0,0|2,0,1]=4 166 B13R2.32 Cc1ccc2ccccc2[n+]1C Amb17843414 [1,0,0,0,0,0|1,0,1]=3 167 B13R2.32 Cc1ccc2ccccc2[n+]1C Amb2540178 [1,0,0,0,0,0|1,0,1]=3 168 B13R2.32 Cc1ccc2ccccc2[n+]1C Amb4322944 [1,0,0,0,0,0|1,0,1]=3 169 B13R2.32 Cc1ccc2ccccc2c1Br Amb3939041 [1,0,0,0,0,0|3,0,0]=4 170 B13R2.32 Cc1ccc2ccccc2c1C Amb6297194 [1,0,0,0,0,0|2,0,0]=3 171 B13R2.32 Cc1ccc2ccccc2c1I Amb27851450 [1,0,0,0,0,0|3,0,0]=4 172 B13R2.32 Cc1ccc2ccccc2c1N Amb2429201 [1,0,0,0,0,0|3,0,0]=4 173 B13R2.32 Cc1ccc2ccccc2c1N Amb6383344 [1,0,0,0,0,0|3,0,0]=4 174 B13R2.32 Cc1ccc2ccccc2c1O Amb3939072 [1,0,0,0,0,0|3,0,0]=4 175 B13R2.32 Cc1ccc2ccccc2c1S Amb25340394 [1,0,0,0,0,0|3,0,0]=4 176 B13R2.32 Cc1ccc2cccnc2c1C Amb19101295 [1,0,0,0,0,0|3,0,0]=4 177 B13R2.32 Cc1ccc2cccnc2c1C Amb34202228 [1,0,0,0,0,0|3,0,0]=4 178 B13R2.32 Cc1ccc2cnccc2c1C Amb25940951 [1,0,0,0,0,0|3,0,0]=4 179 B13R2.32 Cc1ccc2ncccc2c1C Amb2612996 [1,0,0,0,0,0|3,0,0]=4 180 B13R2.32 Cc1cnc2ccccc2c1C Amb2612997 [1,0,0,0,0,0|3,0,0]=4 181 B13R2.32 Cc1ncc2ccccc2c1C Amb23560126 [1,0,0,0,0,0|3,0,0]=4 182 B13R2.32 Clc1c(Br)ccc2ccccc12 Amb24444356 [1,0,0,0,0,0|3,0,0]=4 183 B13R2.32 Clc1c(I)ccc2ccccc12 Amb25866644 [1,0,0,0,0,0|3,0,0]=4 184 B13R2.32 Clc1ccc2ccccc2c1Br Amb25082370 [1,0,0,0,0,0|3,0,0]=4 185 B13R2.32 Clc1ccc2ccccc2c1Cl Amb25189491 [1,0,0,0,0,0|3,0,0]=4 186 B13R2.32 Clc1ccc2ccccc2c1I Amb25309391 [1,0,0,0,0,0|3,0,0]=4 187 B13R2.32 Cn1c(=N)ccc2ccccc21 Amb8439002 [1,0,0,0,0,0|1,0,0]=2 188 B13R2.32 Cn1c(=O)cnc2ccccc21 Amb2612192 [1,0,0,0,0,0|1,0,0]=2 189 B13R2.32 Fc1c(Br)ccc2ccccc12 Amb16186009 [1,0,0,0,0,0|3,0,0]=4 190 B13R2.32 Fc1c(I)ccc2ccccc12 Amb22547558 [1,0,0,0,0,0|3,0,0]=4 191 B13R2.32 Fc1ccc2ccccc2c1Br Amb25068848 [1,0,0,0,0,0|3,0,0]=4 192 B13R2.32 Fc1ccc2ccccc2c1Cl Amb25232022 [1,0,0,0,0,0|3,0,0]=4 193 B13R2.32 Fc1ccc2ccccc2c1I Amb28250690 [1,0,0,0,0,0|3,0,0]=4 194 B13R2.32 Ic1ccc2ccccc2c1I Amb8392015 [1,0,0,0,0,0|3,0,0]=4 195 B13R2.32 N=C1C(=O)C=Cc2ccccc21 Amb27227038 [1,0,0,0,0,0|2,0,0]=3 196 B13R2.32 N=C1C=Cc2ccccc2C1=O Amb27948681 [1,0,0,0,0,0|3,0,0]=4 197 B13R2.32 Nc1c(Br)ccc2ccccc12 Amb17596049 [1,0,0,0,0,0|3,0,0]=4 198 B13R2.32 Nc1c(Cl)ccc2ccccc12 Amb17594523 [1,0,0,0,0,0|3,0,0]=4 199 B13R2.32 Nc1c(F)ccc2ccccc12 Amb17594017 [1,0,0,0,0,0|3,0,0]=4 200 B13R2.32 Nc1c(I)ccc2ccccc12 Amb22491989 [1,0,0,0,0,0|3,0,0]=4 201 B13R2.32 Nc1c(O)ccc2ccccc12 Amb1088955 [1,0,0,0,0,0|2,0,1]=4 202 B13R2.32 Nc1c(O)ccc2ccccc12 Amb2592795 [1,0,0,0,0,0|2,0,1]=4 203 B13R2.32 Nc1c(P)ccc2ccccc12 Amb28186928 [1,0,0,0,0,0|3,0,0]=4 204 B13R2.32 Nc1c(S)ccc2ccccc12 Amb17594453 [1,0,0,0,0,0|2,1,0]=4 205 B13R2.32 Nc1ccc2ccccc2c1Br Amb19374680 [1,0,0,0,0,0|3,0,0]=4 206 B13R2.32 Nc1ccc2ccccc2c1Br Amb4012961 [1,0,0,0,0,0|3,0,0]=4 207 B13R2.32 Nc1ccc2ccccc2c1Cl Amb4006312 [1,0,0,0,0,0|3,0,0]=4 208 B13R2.32 Nc1ccc2ccccc2c1F Amb22497545 [1,0,0,0,0,0|3,0,0]=4 209 B13R2.32 Nc1ccc2ccccc2c1I Amb27407346 [1,0,0,0,0,0|3,0,0]=4 210 B13R2.32 Nc1ccc2ccccc2c1N Amb16191900 [1,0,0,0,0,0|3,0,0]=4 211 B13R2.32 Nc1ccc2ccccc2c1O Amb17593980 [1,0,0,0,0,0|3,0,0]=4 212 B13R2.32 Nc1ccc2ccccc2c1O Amb19930160 [1,0,0,0,0,0|3,0,0]=4 213 B13R2.32 Nc1ccc2ccccc2c1S Amb18647914 [1,0,0,0,0,0|3,0,0]=4 214 B13R2.32 O=C1C=Cc2ccccc2C1=O Amb534349 [1,0,0,0,0,0|2,0,0]=3 215 B13R2.32 O=C1C=Cc2ccccc2C1=S Amb27177701 [1,0,0,0,0,0|2,0,0]=3 216 B13R2.32 O=C1C=Cc2ccccc2N1O Amb22723451 [1,0,0,0,0,0|1,0,0]=2 217 B13R2.32 O=C1CCc2ccccc2N1O Amb1099957 [1,0,0,0,0,0|1,0,2]=4 218 B13R2.32 O=C1COc2ccccc2N1O Amb2423861 [1,0,0,0,0,0|2,0,1]=4 219 B13R2.32 O=C1N=Cc2ccccc2N1O Amb28248668 [1,0,0,0,0,0|2,0,0]=3 220 B13R2.32 O=C1NC=C2C=CC=CC2=C1F Amb25269874 [1,0,0,0,0,0|3,0,0]=4 221 B13R2.32 OC1C(=S)C=Cc2ccccc21 Amb26035492 [1,0,0,0,0,0|2,1,0]=4 222 B13R2.32 Oc1c(Br)ccc2ccccc12 Amb8394123 [1,0,0,0,0,0|3,0,0]=4 223 B13R2.32 Oc1c(Cl)ccc2ccccc12 Amb17594568 [1,0,0,0,0,0|3,0,0]=4 224 B13R2.32 Oc1c(F)ccc2ccccc12 Amb18645623 [1,0,0,0,0,0|3,0,0]=4 225 B13R2.32 Oc1c(I)ccc2ccccc12 Amb26478044 [1,0,0,0,0,0|3,0,0]=4 226 B13R2.32 Oc1ccc2ccccc2c1Br Amb6399651 [1,0,0,0,0,0|2,0,1]=4 227 B13R2.32 Oc1ccc2ccccc2c1Cl Amb17594574 [1,0,0,0,0,0|2,0,1]=4 228 B13R2.32 Oc1ccc2ccccc2c1F Amb18645624 [1,0,0,0,0,0|2,0,1]=4 229 B13R2.32 Oc1ccc2ccccc2c1I Amb2782872 [1,0,0,0,0,0|2,0,1]=4 230 B13R2.32 Oc1ccc2ccccc2c1O Amb18054059 [1,0,0,0,0,0|2,0,1]=4 231 B13R2.32 Oc1ccc2ccccc2c1S Amb20093303 [1,0,0,0,0,0|2,0,1]=4 232 B13R2.32 [NH3+]c1c(O)ccc2ccccc12 Amb22489532 [1,0,0,0,0,0|2,0,1]=4 233 B13R2.32 [NH3+]c1c([O-])ccc2ccccc12 Amb4268650 [1,0,0,0,0,0|2,0,1]=4 234 B13R2.32 [O-][n+]1c(Cl)ccc2ccccc21 Amb27439580 [1,0,0,0,0,0|2,0,1]=4 235 B13R2.32 [O-][n+]1c(S)ccc2ccccc21 Amb27438214 [1,0,0,0,0,0|1,1,1]=4 236 B13R2.328 Brc1cc(Br)c2ccccc2n1 Amb2610048 [1,0,0,0,0,0|2,0,1]=4 237 B13R2.328 Brc1cc(I)c2ccccc2c1 Amb26331453 [1,0,0,0,0,0|3,0,0]=4 238 B13R2.328 Brc1cc(I)c2ccccc2n1 Amb27642315 [1,0,0,0,0,0|2,0,1]=4 239 B13R2.328 Brc1cc(I)cc2ccccc12 Amb27804458 [1,0,0,0,0,0|3,0,0]=4 240 B13R2.328 C=C1NC(=O)Nc2ccccc21 Amb25150937 [1,0,0,0,0,0|2,0,0]=3 241 B13R2.328 C=C1OC(=O)Nc2ccccc21 Amb24497158 [1,0,0,0,0,0|2,0,0]=3 242 B13R2.328 CC1=C2C=CC=CC2=CC(=O)N1 Amb22371049 [1,0,0,0,0,0|3,0,0]=4 243 B13R2.328 CC1=C2C=CC=CC2=NC(=O)N1 Amb22493795 [1,0,0,0,0,0|2,0,1]=4 244 B13R2.328 CC1=CC(=O)Cc2ccccc21 Amb28287006 [1,0,0,0,0,0|2,0,0]=3 245 B13R2.328 CC1=CC(=O)N=C2C=CC=CN12 Amb20655584 [1,0,0,0,0,0|2,0,1]=4 246 B13R2.328 CC1=CC(=O)Nc2ccccc21 Amb19654011 [1,0,0,0,0,0|1,0,0]=2 247 B13R2.328 CC1=CC(=O)Nc2ccncc21 Amb18015580 [1,0,0,0,0,0|2,0,0]=3 248 B13R2.328 CC1=CC(=O)Oc2ccccc21 Amb20001467 [1,0,0,0,0,0|2,0,0]=3 249 B13R2.328 CC1=CC(=O)c2ccccc2N1 Amb18368798 [1,0,0,0,0,0|1,0,1]=3 250 B13R2.328 CC1=CC(=O)c2ccccc2O1 Amb19666848 [1,0,0,0,0,0|2,0,1]=4 251 B13R2.328 CC1=CC(=O)c2ccccc2S1 Amb20414518 [1,0,0,0,0,0|2,0,1]=4 252 B13R2.328 CC1=CC(=O)c2ccncc2N1 Amb25759073 [1,0,0,0,0,0|2,0,1]=4 253 B13R2.328 CC1=CC(=O)c2ncccc2N1 Amb24497195 [1,0,0,0,0,0|2,0,1]=4 254 B13R2.328 CC1=CC(=S)Nc2ccccc21 Amb18010309 [1,0,0,0,0,0|1,1,0]=3 255 B13R2.328 CC1=CC(=S)Nc2ccncc21 Amb18528730 [1,0,0,0,0,0|2,1,0]=4 256 B13R2.328 CC1=CN(C)c2ccccc2N1 Amb27620722 [1,0,0,0,0,0|3,0,0]=4 257 B13R2.328 CC1=NC(=O)c2ccccc2N1 Amb19844242 [1,0,0,0,0,0|2,0,1]=4 258 B13R2.328 CC1CC(=O)Nc2ccccc21 Amb17836212 [1,0,0,0,0,0|1,0,2]=4 259 B13R2.328 CC1NC(=O)Nc2ccccc21 Amb22756019 [1,0,0,0,0,0|2,0,1]=4 260 B13R2.328 CN1CC(=O)Nc2ccccc21 Amb21864918 [1,0,0,0,0,0|2,0,1]=4 261 B13R2.328 Cc1cc(Br)c2ccccc2c1 Amb20669369 [1,0,0,0,0,0|3,0,0]=4 262 B13R2.328 Cc1cc(Br)c2ccccc2n1 Amb9386790 [1,0,0,0,0,0|2,0,1]=4 263 B13R2.328 Cc1cc(Br)cc2ccccc12 Amb27603982 [1,0,0,0,0,0|3,0,0]=4 264 B13R2.328 Cc1cc(Br)nc2ccccc12 Amb18355120 [1,0,0,0,0,0|2,0,1]=4 265 B13R2.328 Cc1cc(C)c2ccccc2c1 Amb6296604 [1,0,0,0,0,0|3,0,0]=4 266 B13R2.328 Cc1cc(C)c2ccccc2n1 Amb4037272 [1,0,0,0,0,0|2,0,1]=4 267 B13R2.328 Cc1cc(Cl)c2ccccc2n1 Amb22496125 [1,0,0,0,0,0|2,0,1]=4 268 B13R2.328 Cc1cc(Cl)c2ccccc2n1 Amb6335281 [1,0,0,0,0,0|2,0,1]=4 269 B13R2.328 Cc1cc(Cl)cc2ccccc12 Amb27231656 [1,0,0,0,0,0|3,0,0]=4 270 B13R2.328 Cc1cc(Cl)nc2ccccc12 Amb1351694 [1,0,0,0,0,0|2,0,1]=4 271 B13R2.328 Cc1cc(F)cc2ccccc12 Amb26895615 [1,0,0,0,0,0|3,0,0]=4 272 B13R2.328 Cc1cc(I)c2ccccc2c1 Amb26442248 [1,0,0,0,0,0|3,0,0]=4 273 B13R2.328 Cc1cc(I)c2ccccc2n1 Amb22756186 [1,0,0,0,0,0|2,0,1]=4 274 B13R2.328 Cc1cc(I)cc2ccccc12 Amb24427637 [1,0,0,0,0,0|3,0,0]=4 275 B13R2.328 Cc1cc(I)nc2ccccc12 Amb27439605 [1,0,0,0,0,0|2,0,1]=4 276 B13R2.328 Cc1cc(N)c2ccccc2c1 Amb18644932 [1,0,0,0,0,0|3,0,0]=4 277 B13R2.328 Cc1cc(N)c2ccccc2n1 Amb1204080 [1,0,0,0,0,0|2,0,1]=4 278 B13R2.328 Cc1cc(N)cc2ccccc12 Amb18126074 [1,0,0,0,0,0|3,0,0]=4 279 B13R2.328 Cc1cc(N)nc2ccccc12 Amb1994857 [1,0,0,0,0,0|2,0,1]=4 280 B13R2.328 Cc1cc(N)nc2ccccc12 Amb1994874 [1,0,0,0,0,0|2,0,1]=4 281 B13R2.328 Cc1cc(O)c2ccccc2n1 Amb1796824 [1,0,0,0,0,0|1,0,1]=3 282 B13R2.328 Cc1cc(O)c2cccnc2c1 Amb23589101 [1,0,0,0,0,0|3,0,0]=4 283 B13R2.328 Cc1cc(O)c2ncccc2c1 Amb18645162 [1,0,0,0,0,0|3,0,0]=4 284 B13R2.328 Cc1cc(O)cc2ccccc12 Amb18645052 [1,0,0,0,0,0|2,0,1]=4 285 B13R2.328 Cc1cc(O)nc2ccccc12 Amb6335240 [1,0,0,0,0,0|1,0,2]=4 286 B13R2.328 Cc1cc(S)c2ccccc2n1 Amb534230 [1,0,0,0,0,0|1,1,1]=4 287 B13R2.328 Cc1cc(S)nc2ccccc12 Amb1104121 [1,0,0,0,0,0|1,1,1]=4 288 B13R2.328 Cc1cc2ccccc2c(O)n1 Amb18645154 [1,0,0,0,0,0|3,0,0]=4 289 B13R2.328 Cc1nc(O)c2ccccc2n1 Amb6540413 [1,0,0,0,0,0|2,0,1]=4 290 B13R2.328 Clc1cc(Br)c2ccccc2c1 Amb28411408 [1,0,0,0,0,0|3,0,0]=4 291 B13R2.328 Clc1cc(Br)nc2ccccc12 Amb22263015 [1,0,0,0,0,0|2,0,1]=4 292 B13R2.328 Clc1cc(Cl)c2ccccc2c1 Amb27233231 [1,0,0,0,0,0|3,0,0]=4 293 B13R2.328 Clc1cc(Cl)c2ccccc2n1 Amb2610837 [1,0,0,0,0,0|2,0,1]=4 294 B13R2.328 Clc1cc(I)c2ccccc2n1 Amb27445733 [1,0,0,0,0,0|2,0,1]=4 295 B13R2.328 Clc1cc(I)cc2ccccc12 Amb25217612 [1,0,0,0,0,0|3,0,0]=4 296 B13R2.328 Fc1cc(Br)c2ccccc2c1 Amb26969445 [1,0,0,0,0,0|3,0,0]=4 297 B13R2.328 Fc1cc(Br)cc2ccccc12 Amb8629527 [1,0,0,0,0,0|3,0,0]=4 298 B13R2.328 Fc1cc(Cl)c2ccccc2c1 Amb25121500 [1,0,0,0,0,0|3,0,0]=4 299 B13R2.328 Fc1cc(Cl)c2ccccc2n1 Amb27488292 [1,0,0,0,0,0|2,0,1]=4 300 B13R2.328 Fc1cc(Cl)cc2ccccc12 Amb26511445 [1,0,0,0,0,0|3,0,0]=4 301 B13R2.328 Fc1cc(F)c2ccccc2c1 Amb26319288 [1,0,0,0,0,0|3,0,0]=4 302 B13R2.328 Fc1cc(I)c2ccccc2c1 Amb26024837 [1,0,0,0,0,0|3,0,0]=4 303 B13R2.328 Fc1cc(I)cc2ccccc12 Amb22547559 [1,0,0,0,0,0|3,0,0]=4 304 B13R2.328 Ic1cc(I)c2ccccc2c1 Amb25848812 [1,0,0,0,0,0|3,0,0]=4 305 B13R2.328 N=C1N=C(O)c2ccccc2S1 Amb22572494 [1,0,0,0,0,0|3,0,0]=4 306 B13R2.328 NC1=C2C=CC=CC2=CC(=O)N1 Amb24511574 [1,0,0,0,0,0|3,0,0]=4 307 B13R2.328 NC1=C2C=CC=CC2=NC(=O)N1 Amb22015224 [1,0,0,0,0,0|2,0,1]=4 308 B13R2.328 NC1=CC(=O)Nc2ccccc21 Amb18645325 [1,0,0,0,0,0|1,0,0]=2 309 B13R2.328 NC1=CC(=O)Oc2ccccc21 Amb18645456 [1,0,0,0,0,0|2,0,0]=3 310 B13R2.328 NC1=CC(=O)c2ccccc2N1 Amb21856421 [1,0,0,0,0,0|1,0,1]=3 311 B13R2.328 NC1=CC(=O)c2ccccc2O1 Amb19870090 [1,0,0,0,0,0|2,0,1]=4 312 B13R2.328 NC1=CC(=O)c2ccccc2S1 Amb25097114 [1,0,0,0,0,0|2,0,1]=4 313 B13R2.328 NC1=NC(=O)Nc2ncccc21 Amb18026135 [1,0,0,0,0,0|3,0,0]=4 314 B13R2.328 NC1=NC(=O)c2ccccc2N1 Amb19665071 [1,0,0,0,0,0|2,0,1]=4 315 B13R2.328 NC1=NC(=S)Nc2ccccc21 Amb18048537 [1,0,0,0,0,0|2,1,0]=4 316 B13R2.328 NC1CC(=O)Nc2ccccc21 Amb10607650 [1,0,0,0,0,0|1,0,2]=4 317 B13R2.328 NC1CC(=O)Nc2ccccc21 Amb22586933 [1,0,0,0,0,0|1,0,2]=4 318 B13R2.328 Nc1cc(Br)c2ccccc2c1 Amb17596046 [1,0,0,0,0,0|3,0,0]=4 319 B13R2.328 Nc1cc(Br)c2ccccc2c1 Amb32675699 [1,0,0,0,0,0|3,0,0]=4 320 B13R2.328 Nc1cc(Br)c2ccccc2n1 Amb10070902 [1,0,0,0,0,0|2,0,1]=4 321 B13R2.328 Nc1cc(Br)cc2ccccc12 Amb17596048 [1,0,0,0,0,0|3,0,0]=4 322 B13R2.328 Nc1cc(Br)cc2ccccc12 Amb32992791 [1,0,0,0,0,0|3,0,0]=4 323 B13R2.328 Nc1cc(Br)nc2ccccc12 Amb20248088 [1,0,0,0,0,0|2,0,1]=4 324 B13R2.328 Nc1cc(Cl)c2ccccc2c1 Amb17594518 [1,0,0,0,0,0|3,0,0]=4 325 B13R2.328 Nc1cc(Cl)c2ccccc2n1 Amb18648192 [1,0,0,0,0,0|2,0,1]=4 326 B13R2.328 Nc1cc(Cl)cc2ccccc12 Amb17594522 [1,0,0,0,0,0|3,0,0]=4 327 B13R2.328 Nc1cc(Cl)nc2ccccc12 Amb18648199 [1,0,0,0,0,0|2,0,1]=4 328 B13R2.328 Nc1cc(Cl)nc2ccccc12 Amb22275993 [1,0,0,0,0,0|2,0,1]=4 329 B13R2.328 Nc1cc(F)c2ccccc2n1 Amb25760167 [1,0,0,0,0,0|2,0,1]=4 330 B13R2.328 Nc1cc(F)cc2ccccc12 Amb26464234 [1,0,0,0,0,0|3,0,0]=4 331 B13R2.328 Nc1cc(I)c2ccccc2n1 Amb26370708 [1,0,0,0,0,0|2,0,1]=4 332 B13R2.328 Nc1cc(I)cc2ccccc12 Amb26016187 [1,0,0,0,0,0|3,0,0]=4 333 B13R2.328 Nc1cc(I)nc2ccccc12 Amb27197064 [1,0,0,0,0,0|2,0,1]=4 334 B13R2.328 Nc1cc(N)c2ccccc2c1 Amb17593963 [1,0,0,0,0,0|3,0,0]=4 335 B13R2.328 Nc1cc(N)c2ccccc2n1 Amb26484632 [1,0,0,0,0,0|2,0,1]=4 336 B13R2.328 Nc1cc(O)c2ccccc2c1 Amb17593981 [1,0,0,0,0,0|2,0,0]=3 337 B13R2.328 Nc1cc(O)c2ccccc2c1 Amb28555827 [1,0,0,0,0,0|2,0,0]=3 338 B13R2.328 Nc1cc(O)c2ccccc2n1 Amb2610300 [1,0,0,0,0,0|1,0,1]=3 339 B13R2.328 Nc1cc(O)c2cccnc2c1 Amb28282762 [1,0,0,0,0,0|3,0,0]=4 340 B13R2.328 Nc1cc(O)c2ncccc2c1 Amb33329375 [1,0,0,0,0,0|3,0,0]=4 341 B13R2.328 Nc1cc(O)c2ncccc2c1 Amb4303927 [1,0,0,0,0,0|3,0,0]=4 342 B13R2.328 Nc1cc(O)cc2ccccc12 Amb18048469 [1,0,0,0,0,0|2,0,1]=4 343 B13R2.328 O=C1C=C(Br)c2ccccc2N1 Amb21520307 [1,0,0,0,0,0|1,0,0]=2 344 B13R2.328 O=C1C=C(Br)c2ccccc2O1 Amb20248285 [1,0,0,0,0,0|2,0,0]=3 345 B13R2.328 O=C1C=C(Br)c2ccncc2N1 Amb25864668 [1,0,0,0,0,0|2,0,0]=3 346 B13R2.328 O=C1C=C(Cl)Nc2ccccc21 Amb22500808 [1,0,0,0,0,0|1,0,1]=3 347 B13R2.328 O=C1C=C(Cl)Oc2ccccc21 Amb28140666 [1,0,0,0,0,0|2,0,1]=4 348 B13R2.328 O=C1C=C(Cl)c2ccccc2N1 Amb19516664 [1,0,0,0,0,0|1,0,0]=2 349 B13R2.328 O=C1C=C(Cl)c2ccccc2O1 Amb20414537 [1,0,0,0,0,0|2,0,0]=3 350 B13R2.328 O=C1C=C(Cl)c2cccnc2N1 Amb22753696 [1,0,0,0,0,0|2,0,0]=3 351 B13R2.328 O=C1C=C(Cl)c2ccncc2N1 Amb33456380 [1,0,0,0,0,0|2,0,0]=3 352 B13R2.328 O=C1C=C(F)c2ccccc2N1 Amb26375660 [1,0,0,0,0,0|1,0,0]=2 353 B13R2.328 O=C1C=C(I)c2ccccc2O1 Amb27442019 [1,0,0,0,0,0|2,0,0]=3 354 B13R2.328 O=C1C=C(O)N2C=CC=CC2N1 Amb27849944 [1,0,0,0,0,0|1,0,1]=3 355 B13R2.328 O=C1C=C(O)Sc2ccccc21 Amb26517364 [1,0,0,0,0,0|1,0,2]=4 356 B13R2.328 O=C1C=C(O)c2ccccc2N1 Amb18002636 [1,0,0,0,0,0|0,0,0]=1 357 B13R2.328 O=C1C=C(O)c2ccccc2O1 Amb18372000 [1,0,0,0,0,0|1,0,0]=2 358 B13R2.328 O=C1C=C(O)c2ccccc2S1 Amb19517275 [1,0,0,0,0,0|1,0,0]=2 359 B13R2.328 O=C1C=C(O)c2cccnc2N1 Amb20662029 [1,0,0,0,0,0|1,0,0]=2 360 B13R2.328 O=C1C=C(O)c2ccncc2N1 Amb22494124 [1,0,0,0,0,0|1,0,0]=2 361 B13R2.328 O=C1C=C(O)c2ncccc2N1 Amb22372203 [1,0,0,0,0,0|1,0,0]=2 362 B13R2.328 O=C1C=C(O)c2nccnc2N1 Amb27803663 [1,0,0,0,0,0|2,0,0]=3 363 B13R2.328 O=C1C=C(S)Oc2ccccc21 Amb27407667 [1,0,0,0,0,0|1,1,1]=4 364 B13R2.328 O=C1C=C(S)c2ccccc2O1 Amb24446596 [1,0,0,0,0,0|1,1,0]=3 365 B13R2.328 O=C1C=C([O-])[n+]2ccccc2N1 Amb20415253 [1,0,0,0,0,0|1,0,1]=3 366 B13R2.328 O=C1C=C([O-])c2ccccc2N1 Amb22731733 [1,0,0,0,0,0|0,0,1]=2 367 B13R2.328 O=C1C=C2C=CC=CC2=C(Br)N1 Amb26067798 [1,0,0,0,0,0|3,0,0]=4 368 B13R2.328 O=C1C=C2C=CC=CC2=C(I)N1 Amb27624963 [1,0,0,0,0,0|3,0,0]=4 369 B13R2.328 O=C1CC(=O)c2ccccc2N1 Amb22263121 [1,0,0,0,0,0|0,0,2]=3 370 B13R2.328 O=C1CC(=O)c2ccccc2O1 Amb19748567 [1,0,0,0,0,0|1,0,2]=4 371 B13R2.328 O=C1CC(O)c2ccccc2N1 Amb27592921 [1,0,0,0,0,0|0,0,2]=3 372 B13R2.328 O=C1CC(O)c2ccccc2O1 Amb8385084 [1,0,0,0,0,0|1,0,2]=4 373 B13R2.328 O=C1Cc2ccccc2C(=O)N1 Amb1221580 [1,0,0,0,0,0|2,0,1]=4 374 B13R2.328 O=C1Cc2ccccc2C(=O)O1 Amb1157145 [1,0,0,0,0,0|2,0,1]=4 375 B13R2.328 O=C1Cc2ccccc2C(=S)N1 Amb17843901 [1,0,0,0,0,0|2,1,0]=4 376 B13R2.328 O=C1N=C(Cl)c2ccccc2N1 Amb22371858 [1,0,0,0,0,0|2,0,0]=3 377 B13R2.328 O=C1N=C(S)Nc2ccccc21 Amb19748659 [1,0,0,0,0,0|1,1,1]=4 378 B13R2.328 O=C1N=[N+]([O-])c2ccccc2N1 Amb20527610 [1,0,0,0,0,0|2,0,1]=4 379 B13R2.328 O=C1NB(O)c2ccccc2N1 Amb25315057 [1,0,0,0,0,0|2,0,0]=3 380 B13R2.328 O=C1NC(=O)c2ccccc2N1 Amb18005794 [1,0,0,0,0,0|1,0,1]=3 381 B13R2.328 O=C1NC(=O)c2ccccc2O1 Amb20243206 [1,0,0,0,0,0|2,0,1]=4 382 B13R2.328 O=C1NC(=O)c2ccccc2S1 Amb22036855 [1,0,0,0,0,0|2,0,1]=4 383 B13R2.328 O=C1NC(=O)c2cccnc2N1 Amb22001013 [1,0,0,0,0,0|2,0,1]=4 384 B13R2.328 O=C1NC(=O)c2ccncc2N1 Amb19515865 [1,0,0,0,0,0|2,0,1]=4 385 B13R2.328 O=C1NC(=O)c2cnccc2N1 Amb22234336 [1,0,0,0,0,0|2,0,1]=4 386 B13R2.328 O=C1NC(=O)c2ncccc2N1 Amb20242004 [1,0,0,0,0,0|2,0,1]=4 387 B13R2.328 O=C1NC(=S)Nc2ccccc21 Amb18010655 [1,0,0,0,0,0|1,1,1]=4 388 B13R2.328 O=C1NC(=S)c2ccccc2O1 Amb27870853 [1,0,0,0,0,0|2,1,0]=4 389 B13R2.328 O=C1NS(=O)Nc2ccccc21 Amb32455867 [1,0,0,0,0,0|2,0,1]=4 390 B13R2.328 O=C1Nc2ccccc2C(=O)O1 Amb18183505 [1,0,0,0,0,0|1,0,1]=3 391 B13R2.328 O=C1Nc2ncccc2C(=O)O1 Amb19325140 [1,0,0,0,0,0|2,0,1]=4 392 B13R2.328 O=C1Nc2ncccc2C(O)N1 Amb27622157 [1,0,0,0,0,0|2,0,1]=4 393 B13R2.328 OC1=NC(=S)Nc2ccccc21 Amb22527681 [1,0,0,0,0,0|1,1,0]=3 394 B13R2.328 OC1=NC(=S)Sc2ccccc21 Amb22572201 [1,0,0,0,0,0|2,1,0]=4 395 B13R2.328 Oc1cc(Br)c2ccccc2c1 Amb17596081 [1,0,0,0,0,0|2,0,1]=4 396 B13R2.328 Oc1cc(Br)cc2ccccc12 Amb17596075 [1,0,0,0,0,0|2,0,0]=3 397 B13R2.328 Oc1cc(Br)cc2cccnc12 Amb23399826 [1,0,0,0,0,0|3,0,0]=4 398 B13R2.328 Oc1cc(Br)cc2ncccc12 Amb21964828 [1,0,0,0,0,0|3,0,0]=4 399 B13R2.328 Oc1cc(Br)nc2ccccc12 Amb22500448 [1,0,0,0,0,0|1,0,1]=3 400 B13R2.328 Oc1cc(Br)nc2ncccc12 Amb25313324 [1,0,0,0,0,0|2,0,1]=4 401 B13R2.328 Oc1cc(Cl)cc2ccccc12 Amb17594569 [1,0,0,0,0,0|2,0,0]=3 402 B13R2.328 Oc1cc(Cl)cc2cccnc12 Amb22886928 [1,0,0,0,0,0|3,0,0]=4 403 B13R2.328 Oc1cc(Cl)cc2cccnc12 Amb33553001 [1,0,0,0,0,0|3,0,0]=4 404 B13R2.328 Oc1cc(Cl)nc2ccccc12 Amb19957815 [1,0,0,0,0,0|1,0,1]=3 405 B13R2.328 Oc1cc(Cl)nc2ncccc12 Amb27808656 [1,0,0,0,0,0|2,0,1]=4 406 B13R2.328 Oc1cc(F)c2ccccc2c1 Amb26843113 [1,0,0,0,0,0|2,0,1]=4 407 B13R2.328 Oc1cc(F)cc2ccccc12 Amb26966920 [1,0,0,0,0,0|2,0,0]=3 408 B13R2.328 Oc1cc(F)cc2cccnc12 Amb22234249 [1,0,0,0,0,0|3,0,0]=4 409 B13R2.328 Oc1cc(F)cc2ncccc12 Amb23437357 [1,0,0,0,0,0|3,0,0]=4 410 B13R2.328 Oc1cc(F)nc2ccccc12 Amb26944759 [1,0,0,0,0,0|1,0,1]=3 411 B13R2.328 Oc1cc(I)c2ccccc2c1 Amb26850789 [1,0,0,0,0,0|2,0,1]=4 412 B13R2.328 Oc1cc(I)cc2ccccc12 Amb27260646 [1,0,0,0,0,0|2,0,0]=3 413 B13R2.328 Oc1cc(I)cc2cccnc12 Amb23437359 [1,0,0,0,0,0|3,0,0]=4 414 B13R2.328 Oc1cc(I)cc2ncccc12 Amb23437361 [1,0,0,0,0,0|3,0,0]=4 415 B13R2.328 Oc1cc(O)c2ccccc2c1 Amb6357421 [1,0,0,0,0,0|1,0,1]=3 416 B13R2.328 Oc1cc(O)c2ccccc2n1 Amb1104174 [1,0,0,0,0,0|0,0,2]=3 417 B13R2.328 Oc1cc(O)c2cccnc2c1 Amb24484214 [1,0,0,0,0,0|2,0,1]=4 418 B13R2.328 Oc1cc(O)c2cnccc2n1 Amb18645591 [1,0,0,0,0,0|1,0,2]=4 419 B13R2.328 Oc1cc(O)c2ncccc2c1 Amb8559059 [1,0,0,0,0,0|2,0,1]=4 420 B13R2.328 Oc1nc(Br)nc2ccccc12 Amb20618706 [1,0,0,0,0,0|2,0,1]=4 421 B13R2.328 Oc1nc(F)nc2ccccc12 Amb35677176 [1,0,0,0,0,0|2,0,1]=4 422 B13R2.328 Oc1nc(O)c2ccccc2n1 Amb776682 [1,0,0,0,0,0|1,0,2]=4 423 B13R2.328 S=C1C=C(S)Oc2ccccc21 Amb28455804 [1,0,0,0,0,0|1,2,0]=4 424 B13R2.328 S=C1N=C(Cl)c2ccccc2N1 Amb28241352 [1,0,0,0,0,0|2,1,0]=4 425 B13R2.328 S=C1NC(=S)c2ccccc2N1 Amb19205460 [1,0,0,0,0,0|1,2,0]=4 426 B13R2.328 S=C1Nc2ccccc2C(=S)S1 Amb19654095 [1,0,0,0,0,0|1,2,0]=4 427 B13R2.371 Bc1ccc(N)c2ccccc12 Amb27614617 [1,0,0,0,0,0|3,0,0]=4 428 B13R2.371 Brc1ccc(Br)c2ccccc12 Amb2731459 [1,0,0,0,0,0|3,0,0]=4 429 B13R2.371 Brc1ccc(I)c2ccccc12 Amb4016208 [1,0,0,0,0,0|3,0,0]=4 430 B13R2.371 CC1=CCC(C)c2ccccc21 Amb27800693 [1,0,0,0,0,0|2,0,1]=4 431 B13R2.371 CN1C=CC(=O)c2ccccc21 Amb18048473 [1,0,0,0,0,0|0,0,1]=2 432 B13R2.371 CN1C=CC(=O)c2cnccc21 Amb27176107 [1,0,0,0,0,0|1,0,1]=3 433 B13R2.371 CN1C=CC(O)c2ccccc21 Amb25324366 [1,0,0,0,0,0|0,0,1]=2 434 B13R2.371 CN1C=NC(=O)c2ccccc21 Amb22752698 [1,0,0,0,0,0|1,0,1]=3 435 B13R2.371 CN1CCC(=O)c2ccccc21 Amb18560299 [1,0,0,0,0,0|0,0,3]=4 436 B13R2.371 CN1CC[C@@H](O)c2ccccc21 Amb28126988 [1,0,0,0,0,0|0,0,3]=4 437 B13R2.371 CN1CNC(=O)c2ccccc21 Amb27754082 [1,0,0,0,0,0|1,0,2]=4 438 B13R2.371 CN1N=CC(=O)c2ccccc21 Amb26626061 [1,0,0,0,0,0|1,0,1]=3 439 B13R2.371 CN1NCC(=O)c2ccccc21 Amb27177499 [1,0,0,0,0,0|1,0,2]=4 440 B13R2.371 C[n+]1ccc(N)c2ccccc21 Amb2609714 [1,0,0,0,0,0|1,0,1]=3 441 B13R2.371 Cc1cc[n+]([O-])c2ccccc12 Amb25071754 [1,0,0,0,0,0|2,0,1]=4 442 B13R2.371 Cc1ccc(Br)c2ccccc12 Amb3939306 [1,0,0,0,0,0|2,0,0]=3 443 B13R2.371 Cc1ccc(Br)c2cccnc12 Amb2234894 [1,0,0,0,0,0|3,0,0]=4 444 B13R2.371 Cc1ccc(Br)c2cnccc12 Amb18349261 [1,0,0,0,0,0|3,0,0]=4 445 B13R2.371 Cc1ccc(Br)c2ncccc12 Amb23441933 [1,0,0,0,0,0|3,0,0]=4 446 B13R2.371 Cc1ccc(C)c2ccccc12 Amb16192902 [1,0,0,0,0,0|2,0,0]=3 447 B13R2.371 Cc1ccc(C)c2cnccc12 Amb24487232 [1,0,0,0,0,0|3,0,0]=4 448 B13R2.371 Cc1ccc(Cl)c2ccccc12 Amb22499152 [1,0,0,0,0,0|2,0,0]=3 449 B13R2.371 Cc1ccc(Cl)c2cccnc12 Amb3318569 [1,0,0,0,0,0|3,0,0]=4 450 B13R2.371 Cc1ccc(Cl)c2ncccc12 Amb21964462 [1,0,0,0,0,0|3,0,0]=4 451 B13R2.371 Cc1ccc(F)c2ccccc12 Amb27595813 [1,0,0,0,0,0|2,0,0]=3 452 B13R2.371 Cc1ccc(F)c2cccnc12 Amb6892339 [1,0,0,0,0,0|3,0,0]=4 453 B13R2.371 Cc1ccc(F)c2ccncc12 Amb32670338 [1,0,0,0,0,0|3,0,0]=4 454 B13R2.371 Cc1ccc(F)c2cnccc12 Amb32670339 [1,0,0,0,0,0|3,0,0]=4 455 B13R2.371 Cc1ccc(F)c2ncccc12 Amb23448836 [1,0,0,0,0,0|3,0,0]=4 456 B13R2.371 Cc1ccc(I)c2ccccc12 Amb28241507 [1,0,0,0,0,0|2,0,0]=3 457 B13R2.371 Cc1ccc(I)c2cccnc12 Amb27871965 [1,0,0,0,0,0|3,0,0]=4 458 B13R2.371 Cc1ccc(N)c2ccccc12 Amb17200158 [1,0,0,0,0,0|2,0,0]=3 459 B13R2.371 Cc1ccc(N)c2cccnc12 Amb1119721 [1,0,0,0,0,0|3,0,0]=4 460 B13R2.371 Cc1ccc(N)c2ccncc12 Amb25133266 [1,0,0,0,0,0|3,0,0]=4 461 B13R2.371 Cc1ccc(N)c2cnccc12 Amb25774370 [1,0,0,0,0,0|3,0,0]=4 462 B13R2.371 Cc1ccc(N)c2ncccc12 Amb18645059 [1,0,0,0,0,0|3,0,0]=4 463 B13R2.371 Cc1ccc(O)c2ccccc12 Amb17200159 [1,0,0,0,0,0|1,0,0]=2 464 B13R2.371 Cc1ccc(O)c2cccnc12 Amb22750815 [1,0,0,0,0,0|2,0,0]=3 465 B13R2.371 Cc1ccc(O)c2cccnc12 Amb32651928 [1,0,0,0,0,0|2,0,0]=3 466 B13R2.371 Cc1ccc(O)c2ncccc12 Amb8559057 [1,0,0,0,0,0|2,0,0]=3 467 B13R2.371 Cc1ccc(S)c2ccccc12 Amb25133203 [1,0,0,0,0,0|1,1,0]=3 468 B13R2.371 Cc1cnc(Br)c2ccccc12 Amb18346618 [1,0,0,0,0,0|3,0,0]=4 469 B13R2.371 Cc1cnc(Cl)c2ccccc12 Amb18346727 [1,0,0,0,0,0|3,0,0]=4 470 B13R2.371 Cc1cnc(O)c2ccccc12 Amb18645157 [1,0,0,0,0,0|2,0,0]=3 471 B13R2.371 Cc1ncc(Br)c2ccccc12 Amb22757013 [1,0,0,0,0,0|3,0,0]=4 472 B13R2.371 Cc1ncc(N)c2ccccc12 Amb22753790 [1,0,0,0,0,0|3,0,0]=4 473 B13R2.371 Cc1nnc(O)c2ccccc12 Amb2371419 [1,0,0,0,0,0|3,0,0]=4 474 B13R2.371 Clc1ccc(Br)c2ccccc12 Amb4009914 [1,0,0,0,0,0|3,0,0]=4 475 B13R2.371 Clc1ccc(Cl)c2ccccc12 Amb20622401 [1,0,0,0,0,0|3,0,0]=4 476 B13R2.371 Clc1ccc(I)c2ccccc12 Amb4016209 [1,0,0,0,0,0|3,0,0]=4 477 B13R2.371 Cn1ccc(=O)c2ccccc21 Amb4009128 [1,0,0,0,0,0|0,0,1]=2 478 B13R2.371 Fc1ccc(Br)c2ccccc12 Amb6366073 [1,0,0,0,0,0|3,0,0]=4 479 B13R2.371 Fc1ccc(Cl)c2ccccc12 Amb24625777 [1,0,0,0,0,0|3,0,0]=4 480 B13R2.371 Fc1ccc(F)c2ccccc12 Amb27252129 [1,0,0,0,0,0|3,0,0]=4 481 B13R2.371 Fc1ccc(S)c2ccccc12 Amb25726189 [1,0,0,0,0,0|2,1,0]=4 482 B13R2.371 Ic1ccc(I)c2ccccc12 Amb28246695 [1,0,0,0,0,0|3,0,0]=4 483 B13R2.371 N=C1C=CC(Cl)c2ccccc21 Amb28121168 [1,0,0,0,0,0|3,0,0]=4 484 B13R2.371 NC1C=CN([K])c2ccccc21 Amb25980299 [1,0,0,0,0,0|2,0,1]=4 485 B13R2.371 Nc1cc[n+]([O-])c2ccccc12 Amb9171345 [1,0,0,0,0,0|2,0,1]=4 486 B13R2.371 Nc1ccc(Br)c2ccccc12 Amb3939770 [1,0,0,0,0,0|3,0,0]=4 487 B13R2.371 Nc1ccc(Cl)c2ccccc12 Amb2720190 [1,0,0,0,0,0|3,0,0]=4 488 B13R2.371 Nc1ccc(F)c2ccccc12 Amb17594016 [1,0,0,0,0,0|3,0,0]=4 489 B13R2.371 Nc1ccc(F)c2ccccc12 Amb23439059 [1,0,0,0,0,0|3,0,0]=4 490 B13R2.371 Nc1ccc(I)c2ccccc12 Amb8390036 [1,0,0,0,0,0|3,0,0]=4 491 B13R2.371 Nc1ccc(N)c2ccccc12 Amb15701565 [1,0,0,0,0,0|3,0,0]=4 492 B13R2.371 Nc1ccc(N)c2ccccc12 Amb22587376 [1,0,0,0,0,0|3,0,0]=4 493 B13R2.371 Nc1ccc(N)c2ccccc12 Amb23468554 [1,0,0,0,0,0|3,0,0]=4 494 B13R2.371 Nc1ccc(O)c2ccccc12 Amb2371292 [1,0,0,0,0,0|2,0,0]=3 495 B13R2.371 Nc1ccc(O)c2cccnc12 Amb2966757 [1,0,0,0,0,0|3,0,0]=4 496 B13R2.371 Nc1ccc(O)c2cccnc12 Amb32686496 [1,0,0,0,0,0|3,0,0]=4 497 B13R2.371 Nc1ccc(O)c2ccncc12 Amb9308192 [1,0,0,0,0,0|3,0,0]=4 498 B13R2.371 Nc1ccc(O)c2cnccc12 Amb24109269 [1,0,0,0,0,0|3,0,0]=4 499 B13R2.371 Nc1ccc(O)c2cnccc12 Amb26420736 [1,0,0,0,0,0|3,0,0]=4 500 B13R2.371 Nc1ccc(O)c2cnccc12 Amb32656259 [1,0,0,0,0,0|3,0,0]=4 501 B13R2.371 Nc1ccc(O)c2ncccc12 Amb2699162 [1,0,0,0,0,0|3,0,0]=4 502 B13R2.371 Nc1ccc(O)c2ncccc12 Amb535226 [1,0,0,0,0,0|3,0,0]=4 503 B13R2.371 Nc1ccc(O)c2ncccc12 Amb6870560 [1,0,0,0,0,0|3,0,0]=4 504 B13R2.371 Nc1ccc(S)c2ccccc12 Amb28138000 [1,0,0,0,0,0|2,1,0]=4 505 B13R2.371 O=C1C=CC(=O)c2ccccc21 Amb8513654 [1,0,0,0,0,0|2,0,1]=4 506 B13R2.371 O=C1C=CN(O)c2ccccc21 Amb27176075 [1,0,0,0,0,0|1,0,1]=3 507 B13R2.371 O=C1N=CN(O)c2ccccc21 Amb22752699 [1,0,0,0,0,0|2,0,1]=4 508 B13R2.371 Oc1ccc(Br)c2ccccc12 Amb6487355 [1,0,0,0,0,0|2,0,0]=3 509 B13R2.371 Oc1ccc(Br)c2cccnc12 Amb2500199 [1,0,0,0,0,0|3,0,0]=4 510 B13R2.371 Oc1ccc(Br)c2cnccc12 Amb26628953 [1,0,0,0,0,0|3,0,0]=4 511 B13R2.371 Oc1ccc(Br)c2ncccc12 Amb22752324 [1,0,0,0,0,0|3,0,0]=4 512 B13R2.371 Oc1ccc(Cl)c2ccccc12 Amb6297771 [1,0,0,0,0,0|2,0,0]=3 513 B13R2.371 Oc1ccc(Cl)c2cccnc12 Amb1777292 [1,0,0,0,0,0|3,0,0]=4 514 B13R2.371 Oc1ccc(Cl)c2cccnc12 Amb4015481 [1,0,0,0,0,0|3,0,0]=4 515 B13R2.371 Oc1ccc(Cl)c2ncccc12 Amb19957335 [1,0,0,0,0,0|3,0,0]=4 516 B13R2.371 Oc1ccc(Cl)c2ncccc12 Amb24710944 [1,0,0,0,0,0|3,0,0]=4 517 B13R2.371 Oc1ccc(F)c2ccccc12 Amb8467864 [1,0,0,0,0,0|2,0,0]=3 518 B13R2.371 Oc1ccc(F)c2cccnc12 Amb2414034 [1,0,0,0,0,0|3,0,0]=4 519 B13R2.371 Oc1ccc(F)c2cccnc12 Amb28555787 [1,0,0,0,0,0|3,0,0]=4 520 B13R2.371 Oc1ccc(F)c2ncccc12 Amb23437330 [1,0,0,0,0,0|3,0,0]=4 521 B13R2.371 Oc1ccc(I)c2ccccc12 Amb23402064 [1,0,0,0,0,0|2,0,0]=3 522 B13R2.371 Oc1ccc(I)c2cnccc12 Amb28187455 [1,0,0,0,0,0|3,0,0]=4 523 B13R2.371 Oc1ccc(O)c2ccccc12 Amb2725812 [1,0,0,0,0,0|2,0,0]=3 524 B13R2.371 Oc1ccc(O)c2cnccc12 Amb28076112 [1,0,0,0,0,0|3,0,0]=4 525 B13R2.371 Oc1ccc(O)c2ncccc12 Amb18554404 [1,0,0,0,0,0|3,0,0]=4 526 B13R2.371 Oc1ccc(S)c2ccccc12 Amb17594486 [1,0,0,0,0,0|2,0,0]=3 527 B13R2.371 Oc1cnc(Br)c2ccccc12 Amb28145361 [1,0,0,0,0,0|3,0,0]=4 528 B13R2.371 Oc1cnc(Cl)c2ccccc12 Amb16231030 [1,0,0,0,0,0|3,0,0]=4 529 B13R2.371 Oc1cnc(O)c2ccccc12 Amb22295929 [1,0,0,0,0,0|3,0,0]=4 530 B13R2.371 Oc1ncc(Br)c2ccccc12 Amb16185652 [1,0,0,0,0,0|3,0,0]=4 531 B13R2.371 Oc1ncc(F)c2ccccc12 Amb27623321 [1,0,0,0,0,0|3,0,0]=4 532 B13R2.371 Sc1ccc(Br)c2ccccc12 Amb23580548 [1,0,0,0,0,0|2,1,0]=4 533 B13R2.371 [NH3+]c1ccc(O)c2ccccc12 Amb22034889 [1,0,0,0,0,0|2,0,0]=3 534 B13R2.371 [O-][n+]1ccc(O)c2ccccc21 Amb2609672 [1,0,0,0,0,0|1,0,1]=3 535 B15R2.6124 CC1=CC(=O)N(C#N)c2ccccc21 Amb26334292 [0,1,0,0,0,0|1,0,1]=3 536 B15R2.6124 CCC1C(=O)NC(=O)c2ccccc21 Amb27463143 [0,1,0,0,0,0|2,0,1]=4 537 B15R2.6124 CCC1C(=O)OC(=O)c2ccccc21 Amb23580672 [0,1,0,0,0,0|2,0,1]=4 538 B15R2.6124 CCN1C(=O)C=C(Cl)c2ccccc21 Amb22463202 [0,1,0,0,0,0|1,0,0]=2 539 B15R2.6124 CCN1C(=O)C=C(O)c2ccccc21 Amb19517249 [0,1,0,0,0,0|0,0,0]=1 540 B15R2.6124 CCN1C(=O)N=C(N)c2ccccc21 Amb24506507 [0,1,0,0,0,0|2,0,0]=3 541 B15R2.6124 CCN1C(=O)NC(=O)c2ccccc21 Amb19651650 [0,1,0,0,0,0|1,0,1]=3 542 B15R2.6124 CCN1C(=O)OC(=O)c2ccccc21 Amb18533334 [0,1,0,0,0,0|1,0,1]=3 543 B15R2.6124 CCN1C(=S)NC(=O)c2ccccc21 Amb27603180 [0,1,0,0,0,0|1,1,1]=4 544 B15R2.6124 CCN1C(C)=CC(N)c2ccccc21 Amb9782731 [0,1,0,0,0,0|2,0,1]=4 545 B15R2.6124 CNc1c(C)cc(C)c2ccccc12 Amb27747078 [0,1,0,0,0,0|3,0,0]=4 546 B15R2.6124 CNc1c(O)cc(O)c2ccccc12 Amb27482622 [0,1,0,0,0,0|1,0,1]=3 547 B15R2.6124 COc1c(Br)cc(Br)c2ccccc12 Amb4010922 [0,1,0,0,0,0|3,0,0]=4 548 B15R2.6124 COc1c(C)cc(C)c2ccccc12 Amb3990821 [0,1,0,0,0,0|3,0,0]=4 549 B15R2.6124 COc1c(C)cc(O)c2ccccc12 Amb18649858 [0,1,0,0,0,0|2,0,0]=3 550 B15R2.6124 COc1c(Cl)cc(O)c2ccccc12 Amb18656351 [0,1,0,0,0,0|2,0,0]=3 551 B15R2.6124 NC1=CC(=O)\C(=N/O)c2ccccc21 Amb25264370 [0,1,0,0,0,0|3,0,0]=4 552 B15R2.6124 Nc1cc(O)c2ccccc2c1N=O Amb27657645 [0,1,0,0,0,0|3,0,0]=4 553 B15R2.6124 O=Cc1c(O)cc(O)c2ccccc12 Amb27957831 [0,1,0,0,0,0|1,0,2]=4 554 B15R2.6124 O=Nc1c(O)cc(O)c2ccccc12 Amb27199059 [0,1,0,0,0,0|2,0,1]=4 555 B15R2.9032 CC1=C(C)c2ccccc2C(=O)C1=O Amb28457278 [0,1,0,0,0,0|2,0,1]=4 556 B15R2.9032 CC1=C(N)C(=O)N(C)c2ccccc21 Amb23448332 [0,1,0,0,0,0|1,0,0]=2 557 B15R2.9032 CC1=C(O)C(=O)N(C)c2ccccc21 Amb22751148 [0,1,0,0,0,0|1,0,0]=2 558 B15R2.9032 CC1=C(O)C(=O)c2ccccc2N1C Amb20242314 [0,1,0,0,0,0|1,0,1]=3 559 B15R2.9032 CC1=C(O)c2ccccc2N(C)C1=O Amb19668039 [0,1,0,0,0,0|0,0,0]=1 560 B15R2.9032 CC1=[N+]([O-])c2ccccc2N(O)C1=O Amb19773770 [0,1,0,0,0,0|2,0,1]=4 561 B15R2.9032 CN1C(=O)C(=O)N(C)c2ccccc21 Amb19654053 [0,1,0,0,0,0|2,0,0]=3 562 B15R2.9032 CN1C(=O)C(=O)N(C)c2ncccc21 Amb20249396 [0,1,0,0,0,0|3,0,0]=4 563 B15R2.9032 CN1C(=O)C(=O)N(N)c2ccccc21 Amb27946708 [0,1,0,0,0,0|2,0,0]=3 564 B15R2.9032 CN1C(=O)C(Br)=C(Cl)c2ccccc21 Amb32456024 [0,1,0,0,0,0|1,0,0]=2 565 B15R2.9032 CN1C(=O)C(Br)=C(O)c2ccccc21 Amb20660833 [0,1,0,0,0,0|0,0,0]=1 566 B15R2.9032 CN1C(=O)C(Cl)=C(O)c2ccccc21 Amb19520628 [0,1,0,0,0,0|0,0,0]=1 567 B15R2.9032 CN1C(=O)C(I)=C(Cl)c2ccccc21 Amb23509158 [0,1,0,0,0,0|1,0,0]=2 568 B15R2.9032 CN1C(=O)C(N)=C(N)c2cccnc21 Amb24695288 [0,1,0,0,0,0|2,0,0]=3 569 B15R2.9032 CN1C(=O)C(N)=C(O)c2ccccc21 Amb21927455 [0,1,0,0,0,0|0,0,0]=1 570 B15R2.9032 CN1C(=O)C(N)=[N+]([O-])c2ccccc21 Amb27791297 [0,1,0,0,0,0|1,0,1]=3 571 B15R2.9032 CN1C(=O)C(O)=C(O)c2ccccc21 Amb21912831 [0,1,0,0,0,0|0,0,0]=1 572 B15R2.9032 CN1C(=O)C(O)N(C)c2ccccc21 Amb28319906 [0,1,0,0,0,0|2,0,1]=4 573 B15R2.9032 CN1C(=O)c2ccccc2N(C)C1=O Amb19653986 [0,1,0,0,0,0|1,0,1]=3 574 B15R2.9032 CN1C(=O)c2ccccc2N(C)C1=S Amb20462525 [0,1,0,0,0,0|1,1,1]=4 575 B15R2.9032 CN1C(=O)c2ccccc2N(N)C1=O Amb22896487 [0,1,0,0,0,0|2,0,1]=4 576 B15R2.9032 CN1C(=O)c2cnccc2N(C)C1=O Amb27866721 [0,1,0,0,0,0|2,0,1]=4 577 B15R2.9032 Cc1c(Br)c(O)c2ccccc2c1O Amb4006856 [0,1,0,0,0,0|3,0,0]=4 578 B15R2.9032 Cc1c(C)c(O)c2ccccc2c1C Amb28324410 [0,1,0,0,0,0|2,0,0]=3 579 B15R2.9032 Cc1c(C)c(O)c2ccccc2c1O Amb18129767 [0,1,0,0,0,0|3,0,0]=4 580 B15R2.9032 Nc1c(O)c(N)c2ccccc2c1O Amb17594946 [0,1,0,0,0,0|2,0,1]=4 581 B15R2.9032 Nc1c(O)c(O)c2ccccc2c1N Amb17594945 [0,1,0,0,0,0|3,0,0]=4 582 B15R2.9032 O=C1C(=O)C(=O)c2ccccc2C1=O Amb18048565 [0,1,0,0,0,0|2,0,1]=4 583 B15R2.9032 O=C1C(=O)N(O)c2ccccc2N1O Amb22360845 [0,1,0,0,0,0|2,0,0]=3 584 B15R2.9032 O=C1C(=O)c2ccccc2C(Br)=C1Br Amb26839430 [0,1,0,0,0,0|3,0,0]=4 585 B15R2.9032 Oc1c(Cl)c(O)c2ccccc2c1O Amb27612637 [0,1,0,0,0,0|2,0,1]=4 586 B15R2.9032 Oc1c(O)c(O)c2ccccc2c1O Amb17595014 [0,1,0,0,0,0|2,0,1]=4 587 B15R2.13166 CN1C(=O)CC(C)(C)c2ccccc21 Amb18559276 [0,1,0,0,0,0|1,0,2]=4 588 B15R2.13166 CN1C(=O)CC(C)(N)c2ccccc21 Amb17605520 [0,1,0,0,0,0|1,0,2]=4 589 B15R2.13166 CN1C(=O)NS(=O)(=O)c2ccccc21 Amb22455071 [0,1,0,0,0,0|2,0,1]=4 590 B15R2.13626 CC1=CC(C)=C2C(=O)C=CC=C2N1C Amb22359252 [0,1,0,0,0,0|2,0,0]=3 591 B15R2.13626 CN1C(=O)NC(=O)c2c(O)ccnc21 Amb21936600 [0,1,0,0,0,0|2,0,1]=4 592 B15R2.13626 CN1C(=O)OC(=O)c2c(Cl)cccc21 Amb20247073 [0,1,0,0,0,0|1,0,1]=3 593 B15R2.13626 CN1CC(=O)N(C)c2cccc(Cl)c21 Amb29845249 [0,1,0,0,0,0|2,0,1]=4 594 B15R2.13626 Cc1cc(O)c2c(O)cccc2c1O Amb18650353 [0,1,0,0,0,0|3,0,0]=4 595 B15R2.13626 Cc1ccnc2c1C(=O)OC(=O)N2C Amb32416910 [0,1,0,0,0,0|2,0,1]=4 596 B15R2.13626 O=C1C=C(O)c2c(O)cccc2C1=O Amb25718321 [0,1,0,0,0,0|2,0,0]=3 597 B15R2.13626 Oc1c(S)cc(O)c2c(O)cccc12 Amb27227304 [0,1,0,0,0,0|2,1,0]=4 598 B15R2.13626 Oc1cc(O)c2c(O)cccc2c1O Amb17595015 [0,1,0,0,0,0|2,0,1]=4 599 B15R2.13627 CC1=CC(=O)N(C)c2c(C)cccc21 Amb21927209 [0,1,0,0,0,0|1,0,0]=2 600 B15R2.13627 CC1=CC(N)c2cccc(C)c2N1C Amb9782734 [0,1,0,0,0,0|2,0,1]=4 601 B15R2.13627 CN1C(=O)OC(=O)c2cccc(Br)c21 Amb27224660 [0,1,0,0,0,0|1,0,1]=3 602 B15R2.13627 Cn1c(=O)oc(=O)c2cccc(Cl)c21 Amb2788296 [0,1,0,0,0,0|1,0,1]=3 603 B15R2.13627 NC1=CC(=O)C(=O)c2c(N)cccc21 Amb27409026 [0,1,0,0,0,0|3,0,0]=4 604 B15R2.13627 O=C1C=C(O)c2cccc(O)c2C1=O Amb24631231 [0,1,0,0,0,0|2,0,0]=3 605 B15R2.13627 Oc1cc(O)c2cccc(O)c2c1O Amb17595018 [0,1,0,0,0,0|2,0,1]=4 606 B15R2.13861 CC1=CC(C)(C)N(C)c2ccccc21 Amb8629647 [0,1,0,0,0,0|2,0,1]=4 607 B15R2.13861 CN1c2ccccc2C(=O)CS1(=O)=O Amb2445888 [0,1,0,0,0,0|1,0,2]=4 608 B15R2.13861 CN1c2ccccc2C(N)=CS1(=O)=O Amb32831022 [0,1,0,0,0,0|2,0,0]=3 609 B15R2.13861 CN1c2ncccc2C(N)=CS1(=O)=O Amb22896365 [0,1,0,0,0,0|3,0,0]=4 610 B15R2.19973 CCC1=NC(=O)c2ccccc2N1C Amb27772906 [0,1,0,0,0,0|2,0,1]=4 611 B15R2.19973 CN1C(C#N)=CC(=O)c2ccccc21 Amb26071559 [0,1,0,0,0,0|1,0,1]=3 612 B15R2.19973 CN1C(CO)=CC(=O)c2ccccc21 Amb28460667 [0,1,0,0,0,0|0,0,2]=3 613 B15R2.19973 CN1C(NN)=NC(=O)c2ccccc21 Amb18650478 [0,1,0,0,0,0|2,0,1]=4 614 B15R2.19973 CNC1C=C(C)c2ccccc2N1C Amb27758696 [0,1,0,0,0,0|2,0,1]=4 615 B15R2.19973 CNc1cc(O)c2ccccc2c1O Amb28397264 [0,1,0,0,0,0|3,0,0]=4 616 B15R2.19973 COc1cc(O)c2ccccc2c1O Amb18650360 [0,1,0,0,0,0|2,0,1]=4 617 B15R2.19973 Cc1c(CO)cc(O)c2ccccc12 Amb28365259 [0,1,0,0,0,0|1,0,1]=3 618 B15R2.19973 Cc1cc(CCl)c(C)c2ccccc12 Amb27194963 [0,1,0,0,0,0|3,0,0]=4 619 B15R2.19973 O=Cc1cc(Br)c2ccccc2c1F Amb20247985 [0,1,0,0,0,0|3,0,0]=4 620 B15R2.19973 O=Cc1cc(Cl)c2ccccc2c1O Amb18130973 [0,1,0,0,0,0|3,0,0]=4 621 B15R2.19973 O=Nc1cc(Cl)c2ccccc2c1O Amb27599409 [0,1,0,0,0,0|3,0,0]=4 622 B15R2.21211 CN1C(=O)C=C(C#N)c2ccccc21 Amb18648875 [0,1,0,0,0,0|1,0,0]=2 623 B15R2.21211 CN1C(=O)C=C(C=O)c2ccccc21 Amb18649521 [0,1,0,0,0,0|0,0,1]=2 624 B15R2.21211 CN1C(=O)C=C(CCl)c2ccccc21 Amb23448572 [0,1,0,0,0,0|1,0,0]=2 625 B15R2.21211 CN1C(=O)C=C(CN)c2ccccc21 Amb18909694 [0,1,0,0,0,0|1,0,0]=2 626 B15R2.21211 CN1C(=O)C=C(CN)c2ccccc21 Amb29844648 [0,1,0,0,0,0|1,0,0]=2 627 B15R2.21211 CN1C(=O)C=C(NN)c2ccccc21 Amb19517105 [0,1,0,0,0,0|1,0,0]=2 628 B15R2.21211 CN1C(=O)CC(CN)c2ccccc21 Amb19516992 [0,1,0,0,0,0|1,0,2]=4 629 B15R2.21211 CN1C(=O)CC(CN)c2ccccc21 Amb22587459 [0,1,0,0,0,0|1,0,2]=4 630 B15R2.21211 CNC1=CC(=O)C(=O)c2ccccc21 Amb25732009 [0,1,0,0,0,0|3,0,0]=4 631 B15R2.21211 COC1=CC(=O)C(=O)c2ccccc21 Amb17594871 [0,1,0,0,0,0|2,0,0]=3 632 B15R2.21211 COc1cc(C)[n+]([O-])c2ccccc12 Amb28400143 [0,1,0,0,0,0|2,0,1]=4 633 B15R2.21211 COc1cc(C)c(N)c2ccccc12 Amb18129690 [0,1,0,0,0,0|3,0,0]=4 634 B15R2.21211 COc1nc(=O)n(C)c2nccnc12 Amb2613684 [0,1,0,0,0,0|3,0,0]=4 635 B15R2.21211 COc1nc(N)c(C)c2ccccc12 Amb25321881 [0,1,0,0,0,0|3,0,0]=4 636 B15R2.21211 Cc1cc(C=O)c2ccccc2c1C Amb27619206 [0,1,0,0,0,0|2,0,1]=4 637 B15R2.21211 Cc1cc(CO)c2ccccc2c1C Amb28206138 [0,1,0,0,0,0|2,0,0]=3 638 B15R2.21211 Cc1nc(CO)c2ccccc2c1C Amb23560135 [0,1,0,0,0,0|3,0,0]=4 639 B15R2.61763 CC1(C)C(=O)C=C(O)c2ccccc21 Amb27218194 [0,1,0,0,0,0|1,0,0]=2 640 B15R2.61763 CC1(C)C(=O)CC(=O)c2ccccc21 Amb17594880 [0,1,0,0,0,0|1,0,2]=4 641 B15R2.61763 CC1(C)C(=O)NC(=O)c2ccccc21 Amb4009527 [0,1,0,0,0,0|2,0,1]=4 642 B15R2.61763 CC1(C)C(=O)OC(=O)c2ccccc21 Amb21964032 [0,1,0,0,0,0|2,0,1]=4 643 B15R2.63814 CC1=CC(=N)c2cc(N)ccc2N1C Amb27430519 [0,1,0,0,0,0|2,0,0]=3 644 B15R2.63814 CC1=CC(=O)N(C)c2ccc(C)cc21 Amb25672424 [0,1,0,0,0,0|1,0,0]=2 645 B15R2.63814 CC1=CC(=O)N(C)c2ccc(I)cc21 Amb23448574 [0,1,0,0,0,0|1,0,0]=2 646 B15R2.63814 CC1=CC(=O)N(C)c2ccc(N)cc21 Amb22524553 [0,1,0,0,0,0|1,0,0]=2 647 B15R2.63814 CC1=CC(=O)N(C)c2ccc(N)cc21 Amb29844655 [0,1,0,0,0,0|1,0,0]=2 648 B15R2.63814 CC1=CC(=O)c2cc(N)ccc2N1C Amb22410693 [0,1,0,0,0,0|1,0,1]=3 649 B15R2.63814 CC1=CC(N)c2cc(C)ccc2N1C Amb9782732 [0,1,0,0,0,0|2,0,1]=4 650 B15R2.63814 CC1CC(=O)N(C)c2ccc(Br)cc21 Amb18559267 [0,1,0,0,0,0|1,0,2]=4 651 B15R2.63814 CC1CC(=O)N(C)c2ccc(N)cc21 Amb18559265 [0,1,0,0,0,0|1,0,2]=4 652 B15R2.63814 CC1CC(=O)N(C)c2ccc(N)cc21 Amb28653338 [0,1,0,0,0,0|1,0,2]=4 653 B15R2.63814 CN1C(=O)C=C(O)c2cc(Cl)ccc21 Amb22751155 [0,1,0,0,0,0|0,0,0]=1 654 B15R2.63814 CN1C(=O)C=C(O)c2cc(Cl)ncc21 Amb26899575 [0,1,0,0,0,0|1,0,0]=2 655 B15R2.63814 CN1C(=O)C=C(O)c2cc(O)ccc21 Amb27585771 [0,1,0,0,0,0|0,0,0]=1 656 B15R2.63814 CN1C(=O)CS(=O)c2cc(Br)ccc21 Amb28052797 [0,1,0,0,0,0|1,0,2]=4 657 B15R2.63814 CN1C(=O)NC(=O)c2cc(Br)cnc21 Amb35788500 [0,1,0,0,0,0|2,0,1]=4 658 B15R2.63814 CN1C(=O)NC(=O)c2cc(Cl)ccc21 Amb26007992 [0,1,0,0,0,0|1,0,1]=3 659 B15R2.63814 CN1C(=O)NC(=O)c2cc(N)ccc21 Amb18669585 [0,1,0,0,0,0|1,0,1]=3 660 B15R2.63814 CN1C(=O)NC(=O)c2cc(N)cnc21 Amb18034219 [0,1,0,0,0,0|2,0,1]=4 661 B15R2.63814 CN1C(=O)OC(=O)c2cc(Br)ccc21 Amb18026189 [0,1,0,0,0,0|1,0,1]=3 662 B15R2.63814 CN1C(=O)OC(=O)c2cc(Cl)ccc21 Amb20240636 [0,1,0,0,0,0|1,0,1]=3 663 B15R2.63814 CN1C(=O)OC(=O)c2cc(N)ccc21 Amb18538540 [0,1,0,0,0,0|1,0,1]=3 664 B15R2.63814 Cc1ccc2c(C)c(F)cc(O)c2n1 Amb23448767 [0,1,0,0,0,0|3,0,0]=4 665 B15R2.63814 Cc1ccc2c(O)c(C)cc(O)c2c1 Amb27750278 [0,1,0,0,0,0|3,0,0]=4 666 B15R2.63814 Cc1ccc2c(c1)C(=O)NC(=O)N2C Amb27790852 [0,1,0,0,0,0|1,0,1]=3 667 B15R2.63814 Cc1ccc2c(c1)C(=O)OC(=O)N2C Amb19825655 [0,1,0,0,0,0|1,0,1]=3 668 B15R2.63814 O=C1C=CC2=C(N1)C(O)=CC(=O)C2=O Amb27607903 [0,1,0,0,0,0|3,0,0]=4 669 B15R2.63814 Oc1ccc2c(O)c(O)cc(O)c2c1 Amb17595016 [0,1,0,0,0,0|2,0,1]=4 670 B15R2.63927 CN1C(=O)C=C(O)c2ccc(Cl)cc21 Amb27813232 [0,1,0,0,0,0|0,0,0]=1 671 B15R2.63927 CN1C(=O)CC(=O)c2ccc(I)cc21 Amb25162686 [0,1,0,0,0,0|0,0,2]=3 672 B15R2.63927 CN1C(=O)NC(=O)c2ccc(F)cc21 Amb27746831 [0,1,0,0,0,0|1,0,1]=3 673 B15R2.63927 CN1C(=O)OC(=O)c2ccc(F)cc21 Amb26967520 [0,1,0,0,0,0|1,0,1]=3 674 B15R2.63927 CN1C(=O)OC(=O)c2ccc(N)cc21 Amb18035962 [0,1,0,0,0,0|1,0,1]=3 675 B15R2.63927 CN1CC(=O)N(C)c2cc(Cl)ccc21 Amb29845245 [0,1,0,0,0,0|2,0,1]=4 676 B15R2.63927 CN1CC(=O)N(C)c2cc(F)ccc21 Amb29845241 [0,1,0,0,0,0|2,0,1]=4 677 B15R2.63927 Cc1cc(=O)n(C)c2cc(O)ccc12 Amb24092114 [0,1,0,0,0,0|1,0,0]=2 678 B15R2.63927 Cc1ccc2c(C)cc(O)c(C)c2c1 Amb27612564 [0,1,0,0,0,0|2,0,1]=4 679 B15R2.63927 Cc1ccc2c(n1)N(C)C(=O)N=C2O Amb22571841 [0,1,0,0,0,0|2,0,0]=3 680 B15R2.63927 Cc1ccc2c(n1)N(C)C(=O)OC2=O Amb19891247 [0,1,0,0,0,0|2,0,1]=4 681 B15R2.63927 Oc1ccc2c(O)cc(O)c(O)c2c1 Amb17595017 [0,1,0,0,0,0|2,0,1]=4 682 B13R1.11 C=C(NC(=O)CC)c1ccccc1 Amb26619762 [0,0,1,0,0,0|3,0,0]=4 683 B13R1.11 C=CC(=O)\C=C(\N)c1ccccc1 Amb27984681 [0,0,1,0,0,0|2,0,1]=4 684 B13R1.11 CCC(=O)CC(=O)c1ccccc1 Amb7766301 [0,0,1,0,0,0|1,0,2]=4 685 B13R1.11 CCC(=O)OC(=O)c1ccccc1 Amb22500123 [0,0,1,0,0,0|2,0,1]=4 686 B13R1.11 CCC(=O)\C=C(/C)c1ccccc1 Amb27802793 [0,0,1,0,0,0|2,0,0]=3 687 B13R1.11 CCC(=O)\C=C(\N)c1ccccc1 Amb27252260 [0,0,1,0,0,0|2,0,0]=3 688 B13R1.11 CNC(=O)CC(=O)c1ccccc1 Amb24361603 [0,0,1,0,0,0|0,0,2]=3 689 B13R1.11 CNC(=O)CC(=O)c1ccncc1 Amb27758803 [0,0,1,0,0,0|1,0,2]=4 690 B13R1.11 CNC(=O)CC(C)c1ccccc1 Amb6846870 [0,0,1,0,0,0|1,0,2]=4 691 B13R1.11 CNC(=O)CC(N)c1ccccc1 Amb6274807 [0,0,1,0,0,0|1,0,2]=4 692 B13R1.11 CNC(=O)C[C@@H](C)c1ccccc1 Amb27624580 [0,0,1,0,0,0|1,0,2]=4 693 B13R1.11 CNC(=O)NC(=O)c1ccccc1 Amb28287343 [0,0,1,0,0,0|1,0,1]=3 694 B13R1.11 CNC(=O)NN(C)c1ccccc1 Amb25137162 [0,0,1,0,0,0|3,0,0]=4 695 B13R1.11 CNC(=O)SC(C)c1ccccc1 Amb27442996 [0,0,1,0,0,0|2,0,1]=4 696 B13R1.11 CNC(=O)\C=C(/C)c1ccccc1 Amb27860376 [0,0,1,0,0,0|1,0,0]=2 697 B13R1.11 CNC(=O)\C=C(\C)c1ccncc1 Amb27256011 [0,0,1,0,0,0|2,0,0]=3 698 B13R1.11 CNC(=O)\C=C(\O)c1ccccc1 Amb8492599 [0,0,1,0,0,0|0,0,0]=1 699 B13R1.11 CNC(=O)\C=C(\S)c1ccccc1 Amb27464395 [0,0,1,0,0,0|0,1,0]=2 700 B13R1.11 CNC(=S)CC(=O)c1ccccc1 Amb27394060 [0,0,1,0,0,0|0,1,2]=4 701 B13R1.11 CNC(=S)NC(=O)c1ccccc1 Amb1625173 [0,0,1,0,0,0|1,1,1]=4 702 B13R1.11 CNC(=S)SC(=O)c1ccccc1 Amb28287334 [0,0,1,0,0,0|1,1,1]=4 703 B13R1.11 CNC(C)\C=C(\C)c1ccccc1 Amb28247465 [0,0,1,0,0,0|2,0,1]=4 704 B13R1.11 CN\C(C)=C/C(=S)c1ccccc1 Amb27667972 [0,0,1,0,0,0|1,1,0]=3 705 B13R1.11 COC(=O)CC(=O)c1ccccc1 Amb10553935 [0,0,1,0,0,0|1,0,2]=4 706 B13R1.11 COC(=O)CC(O)c1ccccc1 Amb22731500 [0,0,1,0,0,0|1,0,2]=4 707 B13R1.11 COC(=O)C[C@@H](O)c1ccccc1 Amb6357238 [0,0,1,0,0,0|1,0,2]=4 708 B13R1.11 COC(=O)C[C@H](O)c1ccccc1 Amb8516703 [0,0,1,0,0,0|1,0,2]=4 709 B13R1.11 COC(=O)NC(=N)c1ccccc1 Amb25254191 [0,0,1,0,0,0|3,0,0]=4 710 B13R1.11 COC(=O)NC(O)c1ccccc1 Amb27413659 [0,0,1,0,0,0|2,0,1]=4 711 B13R1.11 COC(=O)\C=C(/C)c1ccccn1 Amb33529166 [0,0,1,0,0,0|3,0,0]=4 712 B13R1.11 COC(=O)\C=C(/C)c1cccnc1 Amb33551487 [0,0,1,0,0,0|3,0,0]=4 713 B13R1.11 COC(=O)\C=C(/C)c1ccncc1 Amb32644786 [0,0,1,0,0,0|3,0,0]=4 714 B13R1.11 COC(=O)\C=C(/N)c1ccccc1 Amb26953655 [0,0,1,0,0,0|2,0,0]=3 715 B13R1.11 COC(=O)\C=C(\C)c1ccccc1 Amb4035457 [0,0,1,0,0,0|2,0,0]=3 716 B13R1.11 COC(=O)\C=C(\C)c1ccccn1 Amb28075561 [0,0,1,0,0,0|3,0,0]=4 717 B13R1.11 COC(=O)\C=C(\C)c1cccnc1 Amb25191857 [0,0,1,0,0,0|3,0,0]=4 718 B13R1.11 COC(=O)\C=C(\C)c1ccncc1 Amb26571261 [0,0,1,0,0,0|3,0,0]=4 719 B13R1.11 COC(=O)\C=C(\N)c1cccnc1 Amb27191681 [0,0,1,0,0,0|3,0,0]=4 720 B13R1.11 CO\C(C)=C\C(=O)c1ccccc1 Amb25988190 [0,0,1,0,0,0|2,0,1]=4 721 B13R1.11 C\C(=C\C(=O)NO)c1ccccc1 Amb27982484 [0,0,1,0,0,0|2,0,0]=3 722 B13R1.11 NNC(=O)CC(O)c1ccccc1 Amb24720262 [0,0,1,0,0,0|1,0,2]=4 723 B13R1.11 NNC(=O)C[C@H](O)c1ccccc1 Amb27980624 [0,0,1,0,0,0|1,0,2]=4 724 B13R1.11 N\C(=C/C(=O)CO)c1ccccc1 Amb27248345 [0,0,1,0,0,0|3,0,0]=4 725 B13R1.11 N\C(=C\C(=O)CO)c1ccccc1 Amb27436162 [0,0,1,0,0,0|3,0,0]=4 726 B13R1.11 O=C(CC(O)c1ccccc1)NO Amb27213884 [0,0,1,0,0,0|1,0,2]=4 727 B13R1.11 O=C(NCl)NC(=O)c1ccccc1 Amb27848986 [0,0,1,0,0,0|2,0,1]=4 728 B13R1.47 C#CCC(=O)N(C)c1ccccc1 Amb35727913 [0,0,1,0,0,0|1,0,2]=4 729 B13R1.47 C=CNC(=O)N(C)c1ccccc1 Amb27166159 [0,0,1,0,0,0|2,0,0]=3 730 B13R1.47 CC#CC(=O)N(C)c1ccccc1 Amb27981477 [0,0,1,0,0,0|1,0,2]=4 731 B13R1.47 CC(C(=O)\C=C\Cl)c1ccccc1 Amb29880206 [0,0,1,0,0,0|2,0,0]=3 732 B13R1.47 CCOC(=O)N(C)c1ccccc1 Amb4017512 [0,0,1,0,0,0|2,0,1]=4 733 B13R1.47 CN(C(=O)CC#N)c1ccccc1 Amb6273099 [0,0,1,0,0,0|1,0,2]=4 734 B13R1.47 CN(C(=O)CCBr)c1ccccc1 Amb17324151 [0,0,1,0,0,0|1,0,2]=4 735 B13R1.47 CN(C(=O)CCCl)c1ccccc1 Amb1141646 [0,0,1,0,0,0|1,0,2]=4 736 B13R1.47 CN(C(=O)CCN)c1ccccc1 Amb1134878 [0,0,1,0,0,0|1,0,2]=4 737 B13R1.47 CN(C(=O)CCN)c1ccccc1 Amb9147569 [0,0,1,0,0,0|1,0,2]=4 738 B13R1.47 CN(C(=O)CCO)c1ccccc1 Amb17335302 [0,0,1,0,0,0|0,0,2]=3 739 B13R1.47 CN(C(=O)CNN)c1ccccc1 Amb31174819 [0,0,1,0,0,0|2,0,1]=4 740 B13R1.47 CNCC(=O)N(C)c1ccccc1 Amb2694351 [0,0,1,0,0,0|2,0,1]=4 741 B13R1.47 CNCC(=O)N(C)c1ccccc1 Amb6273922 [0,0,1,0,0,0|2,0,1]=4 742 B13R1.47 C\C=C\C(=O)C(C)c1ccccc1 Amb24529691 [0,0,1,0,0,0|2,0,0]=3 743 B13R1.47 C\C=C\C(=O)N(C)c1ccccc1 Amb27174961 [0,0,1,0,0,0|1,0,0]=2 744 B13R1.47 C\C=C\C(=O)N(C)c1ccncn1 Amb28207067 [0,0,1,0,0,0|3,0,0]=4 745 B13R1.47 C\C=C\C(=O)N(N)c1ccccc1 Amb33191338 [0,0,1,0,0,0|2,0,0]=3 746 B13R1.47 C\C=C\C(=O)N(N)c1ccccn1 Amb33191456 [0,0,1,0,0,0|3,0,0]=4 747 B13R1.89 CC(=O)N(C)c1ccccc1C=O Amb27403479 [0,0,1,0,0,0|0,0,2]=3 748 B13R1.89 CC(=O)N(C)c1ccccc1CN Amb18252417 [0,0,1,0,0,0|1,0,2]=4 749 B13R1.89 CC(=O)N(C)c1ccccc1CN Amb33803199 [0,0,1,0,0,0|1,0,2]=4 750 B13R1.89 CCc1ccccc1N(C)C(N)=O Amb28062136 [0,0,1,0,0,0|2,0,1]=4 751 B13R1.89 CN(C(N)=O)c1ccccc1C#N Amb18127437 [0,0,1,0,0,0|2,0,1]=4 752 B13R1.89 CN(C(N)=O)c1ccccc1CN Amb18252476 [0,0,1,0,0,0|2,0,1]=4 753 B13R1.89 CN(C(N)=O)c1ccccc1CO Amb28071532 [0,0,1,0,0,0|1,0,1]=3 754 B13R1.89 CNc1ccccc1N(C)C(C)=O Amb28195787 [0,0,1,0,0,0|2,0,1]=4 755 B13R1.89 CSc1ccccc1N(C)C(C)=O Amb27769533 [0,0,1,0,0,0|2,0,1]=4 756 B13R1.464 CCc1ccccc1C(=O)\C=C\Cl Amb29880200 [0,0,1,0,0,0|2,0,1]=4 757 B13R1.464 COc1ccccc1C(=O)CC=O Amb7766250 [0,0,1,0,0,0|1,0,2]=4 758 B13R1.464 COc1ccccc1C(=O)\C=C\Cl Amb35645319 [0,0,1,0,0,0|2,0,1]=4 759 B13R1.464 COc1ccccc1C(=O)\C=C\[O-] Amb27759095 [0,0,1,0,0,0|1,0,2]=4 760 B13R1.464 COc1ccccc1\C(Cl)=C\C=O Amb17236495 [0,0,1,0,0,0|2,0,0]=3 761 B13R1.464 CSc1ccccc1C(=O)\C=C\Cl Amb35609136 [0,0,1,0,0,0|2,0,1]=4 762 B13R1.464 C\C=C\C(=O)c1ccccc1OC Amb27439101 [0,0,1,0,0,0|2,0,1]=4 763 B13R1.464 C\C=C\C(O)c1ccccc1NC Amb24488925 [0,0,1,0,0,0|1,0,1]=3 764 B13R1.547 CC(C=O)c1ccccc1C(=O)O Amb27482145 [0,0,1,0,0,0|2,0,0]=3 765 B13R1.547 CN(C#N)c1ccccc1C(=O)O Amb29870378 [0,0,1,0,0,0|2,0,1]=4 766 B13R1.547 CN(C=O)c1ccccc1C(N)=O Amb28254510 [0,0,1,0,0,0|1,0,1]=3 767 B13R1.547 O=CN(O)c1ccccc1C(=O)O Amb27955814 [0,0,1,0,0,0|2,0,0]=3 768 B13R1.1630 Cc1cc(O)c(\C=C\C=O)cc1C Amb25669378 [0,0,1,0,0,0|3,0,0]=4 769 B13R2.3085 CC1=C(C)c2ccccc2C1=O Amb27177578 [0,0,0,0,1,0|2,0,1]=4 770 B13R2.3085 CC1C(=N)N(C)c2ccccc21 Amb22536459 [0,0,0,0,1,0|2,0,1]=4 771 B13R2.3085 CC1C(=O)N(C)c2ccccc21 Amb24273383 [0,0,0,0,1,0|1,0,1]=3 772 B13R2.3085 CN1C(=N)C(Cl)c2ccccc21 Amb27816558 [0,0,0,0,1,0|2,0,1]=4 773 B13R2.3085 CN1C(=O)C(=O)c2ccccc21 Amb6335574 [0,0,0,0,1,0|0,0,1]=2 774 B13R2.3085 CN1C(=O)C(=O)c2cccnc21 Amb24465137 [0,0,0,0,1,0|1,0,1]=3 775 B13R2.3085 CN1C(=O)C(Br)c2ccccc21 Amb22749190 [0,0,0,0,1,0|1,0,1]=3 776 B13R2.3085 CN1C(=O)C(N)c2ccccc21 Amb22586861 [0,0,0,0,1,0|1,0,1]=3 777 B13R2.3085 CN1C(=O)C(N)c2ccccc21 Amb535212 [0,0,0,0,1,0|1,0,1]=3 778 B13R2.3085 CN1C(=O)C(N)c2ccccc21 Amb5633811 [0,0,0,0,1,0|1,0,1]=3 779 B13R2.3085 CN1C(=O)C(O)c2ccccc21 Amb2613141 [0,0,0,0,1,0|0,0,1]=2 780 B13R2.3085 CN1C(=O)N(C)c2ccccc21 Amb18004177 [0,0,0,0,1,0|2,0,0]=3 781 B13R2.3085 CN1C(=O)N(C)c2ncccc21 Amb21884677 [0,0,0,0,1,0|3,0,0]=4 782 B13R2.3085 CN1C(=O)N(N)c2ccccc21 Amb30017851 [0,0,0,0,1,0|2,0,0]=3 783 B13R2.3085 CN1C(=O)[C@@H](O)c2ccccc21 Amb27426901 [0,0,0,0,1,0|0,0,1]=2 784 B13R2.3085 CN1C(=S)N(C)c2ccccc21 Amb20666683 [0,0,0,0,1,0|2,1,0]=4 785 B13R2.3085 CN1c2ccccc2C(=O)C1O Amb27164622 [0,0,0,0,1,0|0,0,3]=4 786 B13R2.3085 Cc1c(Br)c2ccccc2n1C Amb17133648 [0,0,0,0,1,0|2,0,0]=3 787 B13R2.3085 Cc1c(Br)c2cccnc2n1C Amb18161294 [0,0,0,0,1,0|3,0,0]=4 788 B13R2.3085 Cc1c(C)n(C)c2ccccc12 Amb26899733 [0,0,0,0,1,0|2,0,0]=3 789 B13R2.3085 Cc1c(Cl)n(C)c2ccccc12 Amb23569031 [0,0,0,0,1,0|2,0,0]=3 790 B13R2.3085 Cc1c(I)c2ccccc2n1C Amb17134454 [0,0,0,0,1,0|2,0,0]=3 791 B13R2.3085 Cc1c(I)n(C)c2ccccc12 Amb21963101 [0,0,0,0,1,0|2,0,0]=3 792 B13R2.3085 Cc1c(N)c2ccccc2n1C Amb18563503 [0,0,0,0,1,0|2,0,0]=3 793 B13R2.3085 Cc1c(N)c2cccnc2n1C Amb18829910 [0,0,0,0,1,0|3,0,0]=4 794 B13R2.3085 Cc1c(O)c2ccccc2n1C Amb32732864 [0,0,0,0,1,0|1,0,0]=2 795 B13R2.3085 Cc1c(S)c2ccccc2n1C Amb24361774 [0,0,0,0,1,0|1,1,0]=3 796 B13R2.3085 Cc1n(C)c2ccccc2[n+]1C Amb2779891 [0,0,0,0,1,0|3,0,0]=4 797 B13R2.3085 Cc1n(C)c2ccccc2[n+]1N Amb1032750 [0,0,0,0,1,0|3,0,0]=4 798 B13R2.3085 Cc1n(C)c2ccccc2[n+]1[O-] Amb8393339 [0,0,0,0,1,0|2,0,1]=4 799 B13R2.3085 Cn1c(=O)n(C)c2cnccc21 Amb4098463 [0,0,0,0,1,0|3,0,0]=4 800 B13R2.3085 Cn1c(Br)c(Br)c2ccccc21 Amb33435856 [0,0,0,0,1,0|2,0,0]=3 801 B13R2.3085 Cn1c(O)c(Br)c2ccccc21 Amb33430506 [0,0,0,0,1,0|1,0,1]=3 802 B13R2.3085 NC1C(=O)N(O)c2ccccc21 Amb24073758 [0,0,0,0,1,0|2,0,1]=4 803 B13R2.3085 O=C1C(=O)N(Cl)c2ccccc21 Amb2720848 [0,0,0,0,1,0|1,0,1]=3 804 B13R2.3085 O=C1C(=O)N(O)c2ccccc21 Amb27177861 [0,0,0,0,1,0|1,0,1]=3 805 B13R2.3085 O=C1C(=O)c2ccccc2C1=O Amb18048474 [0,0,0,0,1,0|2,0,1]=4 806 B13R2.3085 O=C1C(=O)c2ccccc2C1=O Amb22001415 [0,0,0,0,1,0|2,0,1]=4 807 B13R2.3085 O=c1n(O)c2ccccc2n1O Amb1042148 [0,0,0,0,1,0|2,0,0]=3 808 B13R2.5393 CN1C(=O)NC(=O)c2ccsc21 Amb28351161 [0,0,0,0,1,0|2,0,1]=4 809 B13R2.5393 Cc1c(Br)cc(O)c2ccsc12 Amb27619952 [0,0,0,0,1,0|3,0,0]=4 810 B13R2.5393 Cc1c(Br)cc(O)c2sccc12 Amb27264101 [0,0,0,0,1,0|3,0,0]=4 811 B13R2.5393 Cc1c(Cl)cc(O)c2sccc12 Amb27964080 [0,0,0,0,1,0|3,0,0]=4 812 B13R2.5393 Cc1c(F)cc(O)c2ccsc12 Amb27214737 [0,0,0,0,1,0|3,0,0]=4 813 B13R2.5393 Cc1c(O)cc(O)c2ccsc12 Amb27489934 [0,0,0,0,1,0|2,0,1]=4 814 B13R2.5393 Cc1c(O)cc(O)c2sccc12 Amb28133705 [0,0,0,0,1,0|2,0,1]=4 815 B13R2.5393 Cc1c(S)cc(O)c2sccc12 Amb28195441 [0,0,0,0,1,0|2,1,0]=4 816 B13R2.5393 Cc1cc(O)c2sccc2c1C Amb28286990 [0,0,0,0,1,0|3,0,0]=4 817 B15R2.7340 CC1NCC(=O)N(C)c2ccccc21 Amb25801815 [0,0,0,0,0,1|1,0,2]=4 818 B15R2.7340 CN1C(=N)CNC(=O)c2ccccc21 Amb27957796 [0,0,0,0,0,1|1,0,2]=4 819 B15R2.7340 CN1C(=O)CNC(=O)c2ccccc21 Amb2928038 [0,0,0,0,0,1|0,0,2]=3 820 B15R2.8448 CC1=Nc2ccccc2N(C)C(=O)C1 Amb24110597 [0,0,0,0,0,1|1,0,1]=3 821 B15R2.8448 CC1CC(=O)N(C)c2ccccc2N1 Amb19337762 [0,0,0,0,0,1|1,0,2]=4 822 B15R2.8448 CC1CC(=O)N(C)c2ccccc2O1 Amb17570542 [0,0,0,0,0,1|1,0,2]=4 823 B15R2.8448 CN1C(=O)CC(=O)Sc2ccccc21 Amb27479929 [0,0,0,0,0,1|0,0,2]=3 824 B15R2.8448 CN1C(=O)NC(=O)Nc2ccccc21 Amb28048825 [0,0,0,0,0,1|1,0,1]=3 825 B15R2.8448 CN1C(N)=NC(N)=Nc2ccccc21 Amb27632468 [0,0,0,0,0,1|3,0,0]=4 826 B15R2.13167 CC1Oc2ccccc2C(=O)NC1=O Amb1765147 [0,0,0,0,0,1|2,0,1]=4 827 B12R1.27 C=CC(=O)\C=C\c1ccccc1 Amb33503118 [1,0,1,0,0,0|1,0,1]=4 828 B12R1.27 CCC(=O)\C=C\c1ccccc1 Amb10565332 [1,0,1,0,0,0|1,0,0]=3 829 B12R1.27 CCC(=O)\C=C\c1ccncc1 Amb25962375 [1,0,1,0,0,0|2,0,0]=4 830 B12R1.27 CNC(=O)CCc1ccccc1 Amb3886651 [1,0,1,0,0,0|0,0,2]=4 831 B12R1.27 CNC(=O)CSc1ccccc1 Amb33545141 [1,0,1,0,0,0|1,0,1]=4 832 B12R1.27 CNC(=O)NNc1ccccc1 Amb25751263 [1,0,1,0,0,0|2,0,0]=4 833 B12R1.27 CNC(=O)NOc1ccccc1 Amb27848154 [1,0,1,0,0,0|2,0,0]=4 834 B12R1.27 CNC(=O)OCc1ccccc1 Amb26883461 [1,0,1,0,0,0|1,0,1]=4 835 B12R1.27 CNC(=O)SCc1ccccc1 Amb28243771 [1,0,1,0,0,0|1,0,1]=4 836 B12R1.27 CNC(=O)\C=C\c1ccncc1 Amb28454984 [1,0,1,0,0,0|1,0,0]=3 837 B12R1.27 COC(=O)\C=C\c1ccccc1 Amb33716217 [1,0,1,0,0,0|1,0,0]=3 838 B12R1.27 COC(=O)\C=C\c1ccccc1 Amb8515074 [1,0,1,0,0,0|1,0,0]=3 839 B12R1.27 COC(=O)\C=C\c1ccccn1 Amb25036096 [1,0,1,0,0,0|2,0,0]=4 840 B12R1.27 COC(=O)\C=C\c1cccnc1 Amb17844385 [1,0,1,0,0,0|2,0,0]=4 841 B12R1.27 COC(=O)\C=C\c1ccncc1 Amb20668041 [1,0,1,0,0,0|2,0,0]=4 842 B12R1.27 COC(=O)\C=C\c1ccncc1 Amb24074160 [1,0,1,0,0,0|2,0,0]=4 843 B12R1.27 NCC(=O)\C=C\c1ccccc1 Amb32954851 [1,0,1,0,0,0|2,0,0]=4 844 B12R1.27 NNC(=O)\C=C\c1ccccc1 Amb9817076 [1,0,1,0,0,0|1,0,0]=3 845 B12R1.27 NNC(=O)\C=C\c1cccnc1 Amb2612884 [1,0,1,0,0,0|2,0,0]=4 846 B12R1.27 NNC(=O)\C=C\c1ccncc1 Amb26611701 [1,0,1,0,0,0|2,0,0]=4 847 B12R1.27 O=C(\C=C\c1ccccc1)CBr Amb17596167 [1,0,1,0,0,0|2,0,0]=4 848 B12R1.27 O=C(\C=C\c1ccccc1)CCl Amb17594640 [1,0,1,0,0,0|2,0,0]=4 849 B12R1.27 O=C(\C=C\c1ccccc1)N[O-] Amb27185829 [1,0,1,0,0,0|1,0,0]=3 850 B12R1.27 O=C(\C=C\c1ccccn1)NO Amb28370532 [1,0,1,0,0,0|2,0,0]=4 851 B12R1.27 O=C(\C=C\c1cccnc1)NO Amb28140433 [1,0,1,0,0,0|2,0,0]=4 852 B12R1.30 C=C\C=C\N(C)c1ccccc1 Amb27875410 [1,0,1,0,0,0|1,0,0]=3 853 B12R1.30 CC(\C=C\C=O)c1ccccc1 Amb33042868 [1,0,1,0,0,0|1,0,1]=4 854 B12R1.30 CC(\C=C\CO)c1ccccc1 Amb33042867 [1,0,1,0,0,0|1,0,1]=4 855 B12R1.30 CC\C=C\C(O)c1ccccc1 Amb22546781 [1,0,1,0,0,0|1,0,1]=4 856 B12R1.30 CC\C=C\[C@@H](O)c1ccccc1 Amb27598606 [1,0,1,0,0,0|1,0,1]=4 857 B12R1.30 CN(C\C=C\Cl)c1ccccc1 Amb27409057 [1,0,1,0,0,0|1,0,1]=4 858 B12R1.30 CN(\C=C/C=O)c1ccccc1 Amb27848292 [1,0,1,0,0,0|0,0,1]=3 859 B12R1.30 CN(\C=C\C=O)c1ccccc1 Amb34006653 [1,0,1,0,0,0|0,0,1]=3 860 B12R1.30 CNC\C=C(/C)c1ccccc1 Amb23555664 [1,0,1,0,0,0|1,0,1]=4 861 B12R1.30 CNC\C=C(\C)c1ccccc1 Amb27963918 [1,0,1,0,0,0|1,0,1]=4 862 B12R1.30 CN\C=C/C(=O)c1ccccc1 Amb2386631 [1,0,1,0,0,0|0,0,1]=3 863 B12R1.30 CN\C=C\C(=S)c1ccccc1 Amb27462236 [1,0,1,0,0,0|0,1,0]=3 864 B12R1.30 CS\C=C\C(=O)c1ccccc1 Amb27973048 [1,0,1,0,0,0|1,0,1]=4 865 B12R1.30 C\C=C\CN(C)c1ccccc1 Amb22546831 [1,0,1,0,0,0|1,0,1]=4 866 B12R1.107 C=C(CC(C)=O)c1ccccc1 Amb27802448 [1,0,1,0,0,0|1,0,1]=4 867 B12R1.107 C=C(NC(C)=O)c1ccccc1 Amb8394362 [1,0,1,0,0,0|2,0,0]=4 868 B12R1.107 CC(=O)CC(=O)c1ccccc1 Amb534154 [1,0,1,0,0,0|0,0,2]=4 869 B12R1.107 CC(=O)CC(O)c1ccccc1 Amb28324943 [1,0,1,0,0,0|0,0,2]=4 870 B12R1.107 CC(=O)C[C@@H](O)c1ccccc1 Amb27802735 [1,0,1,0,0,0|0,0,2]=4 871 B12R1.107 CC(=O)SC(O)c1ccccc1 Amb27775515 [1,0,1,0,0,0|1,0,1]=4 872 B12R1.107 CC(=O)\C=C(/N)c1ccncc1 Amb27616615 [1,0,1,0,0,0|2,0,0]=4 873 B12R1.107 CC(=O)\C=C(/O)c1ccccn1 Amb24309430 [1,0,1,0,0,0|1,0,0]=3 874 B12R1.107 CC(=O)\C=C(\N)c1cccnc1 Amb27875125 [1,0,1,0,0,0|2,0,0]=4 875 B12R1.107 CC(=O)\C=C(\S)c1ccccc1 Amb27428395 [1,0,1,0,0,0|0,1,0]=3 876 B12R1.107 CC(=O)\N=C(\N)c1ccccc1 Amb25150972 [1,0,1,0,0,0|2,0,0]=4 877 B12R1.107 CC(C)=CC(=O)c1ccccc1 Amb10874044 [1,0,1,0,0,0|1,0,1]=4 878 B12R1.107 CC(C)=C[C@@H](O)c1ccccc1 Amb27432272 [1,0,1,0,0,0|1,0,1]=4 879 B12R1.107 CN(C)\C=C(/O)c1ccccc1 Amb24068870 [1,0,1,0,0,0|2,0,0]=4 880 B12R1.107 C\C(=C/C(=O)O)c1ccccc1 Amb6749182 [1,0,1,0,0,0|2,0,0]=4 881 B12R1.107 C\C(=C/C(N)=O)c1ccccc1 Amb24648875 [1,0,1,0,0,0|1,0,0]=3 882 B12R1.107 C\C(N)=C/C(=O)c1ccccc1 Amb27666841 [1,0,1,0,0,0|1,0,1]=4 883 B12R1.107 C\C(N)=C\C(=O)c1ccccc1 Amb2386640 [1,0,1,0,0,0|1,0,1]=4 884 B12R1.107 NC(=O)CC(=O)c1ccccc1 Amb2734576 [1,0,1,0,0,0|0,0,2]=4 885 B12R1.107 NC(=O)CC(=S)c1ccccc1 Amb28384134 [1,0,1,0,0,0|0,1,1]=4 886 B12R1.107 NC(=O)NC(=O)c1ccccc1 Amb3989198 [1,0,1,0,0,0|1,0,1]=4 887 B12R1.107 NC(=O)\C=C(\O)c1cccnc1 Amb28291337 [1,0,1,0,0,0|1,0,0]=3 888 B12R1.107 NC(=O)\C=C(\O)c1ccncc1 Amb27165220 [1,0,1,0,0,0|1,0,0]=3 889 B12R1.107 NC(=O)\C=C(\S)c1ccccc1 Amb27862500 [1,0,1,0,0,0|0,1,0]=3 890 B12R1.107 NC(=S)\C=C(/N)c1ccccc1 Amb19374001 [1,0,1,0,0,0|1,1,0]=4 891 B12R1.107 NC(N)=CC(=O)c1ccccc1 Amb25108111 [1,0,1,0,0,0|1,0,1]=4 892 B12R1.107 O=C(O)\C=C(/Cl)c1ccccc1 Amb17594707 [1,0,1,0,0,0|2,0,0]=4 893 B12R1.107 O=C(O)\C=C(/I)c1ccccc1 Amb33620462 [1,0,1,0,0,0|2,0,0]=4 894 B12R1.107 O=C(O)\C=C(\O)c1ccccc1 Amb28052099 [1,0,1,0,0,0|1,0,0]=3 895 B12R1.32 C=CCC(=O)Nc1ccccc1 Amb25123880 [1,0,1,0,0,0|1,0,1]=4 896 B12R1.32 C\C=C\C(=O)Nc1ccccc1 Amb31280308 [1,0,1,0,0,0|1,0,0]=3 897 B12R1.32 C\C=C\C(=O)Nc1cccnc1 Amb27766723 [1,0,1,0,0,0|2,0,0]=4 898 B12R1.32 C\C=C\C(=O)Nc1ccncc1 Amb27858099 [1,0,1,0,0,0|2,0,0]=4 899 B12R1.32 C\C=C\C(=O)Oc1ccccc1 Amb27857446 [1,0,1,0,0,0|2,0,0]=4 900 B12R1.32 C\C=C\C(=S)Nc1ccccc1 Amb28285588 [1,0,1,0,0,0|1,1,0]=4 901 B12R1.32 O=C(CCO)Nc1ccccc1 Amb9421562 [1,0,1,0,0,0|0,0,2]=4 902 B12R1.32 O=C(\C=C\Cl)Nc1ccccc1 Amb28342211 [1,0,1,0,0,0|1,0,0]=3 903 B12R1.32 O=C(\C=C\F)Nc1ccccc1 Amb24386157 [1,0,1,0,0,0|1,0,0]=3 904 B12R1.32 O=C(\C=N\O)Nc1ccccc1 Amb1205570 [1,0,1,0,0,0|1,0,0]=3 905 B12R1.34 C=CC(=O)C(C)c1ccccc1 Amb24537754 [1,0,1,0,0,0|1,0,0]=3 906 B12R1.34 C=CC(=O)N(C)c1ccccc1 Amb9480405 [1,0,1,0,0,0|0,0,0]=2 907 B12R1.34 C=CC(C)N(C)c1ccccc1 Amb27979353 [1,0,1,0,0,0|1,0,1]=4 908 B12R1.34 CC(C(=O)CO)c1ccccc1 Amb28250155 [1,0,1,0,0,0|1,0,1]=4 909 B12R1.34 CCC(=O)N(C)c1ccccc1 Amb2611725 [1,0,1,0,0,0|0,0,2]=4 910 B12R1.34 CN(C(=O)C=O)c1ccccc1 Amb28287730 [1,0,1,0,0,0|0,0,1]=3 911 B12R1.34 CN(C(=O)CBr)c1ccccc1 Amb2081957 [1,0,1,0,0,0|1,0,1]=4 912 B12R1.34 CN(C(=O)CCl)c1ccccc1 Amb1207237 [1,0,1,0,0,0|1,0,1]=4 913 B12R1.34 CN(C(=O)CN)c1ccccc1 Amb5783073 [1,0,1,0,0,0|1,0,1]=4 914 B12R1.34 CN(C(=O)CO)c1ccccc1 Amb5798072 [1,0,1,0,0,0|0,0,1]=3 915 B12R1.34 CN(C(=O)NO)c1ccccc1 Amb26639375 [1,0,1,0,0,0|1,0,0]=3 916 B12R1.34 CN(\C(N)=N\O)c1ccccc1 Amb18800911 [1,0,1,0,0,0|2,0,0]=4 917 B12R1.34 C\C=C(\Cl)N(C)c1ccccc1 Amb27619788 [1,0,1,0,0,0|1,0,1]=4 918 B12R1.34 O=C(CO)N(O)c1ccccc1 Amb27588913 [1,0,1,0,0,0|1,0,1]=4 919 B12R1.75 C=Cc1ccccc1NC(C)=O Amb27230576 [1,0,1,0,0,0|1,0,1]=4 920 B12R1.75 CC(=O)Nc1ccccc1C=O Amb2693665 [1,0,1,0,0,0|0,0,2]=4 921 B12R1.75 CC(=O)Nc1ccccc1CO Amb13952729 [1,0,1,0,0,0|0,0,2]=4 922 B12R1.77 C=CC(=O)c1ccccc1CC Amb25692004 [1,0,1,0,0,0|1,0,1]=4 923 B12R1.77 C=CC(=O)c1ccccc1OC Amb18563546 [1,0,1,0,0,0|1,0,1]=4 924 B12R1.77 C=CC(=O)c1ccccc1SC Amb26365299 [1,0,1,0,0,0|1,0,1]=4 925 B12R1.77 C=CC(O)c1ccccc1CC Amb24532684 [1,0,1,0,0,0|1,0,1]=4 926 B12R1.77 C=CC(O)c1ccccc1OC Amb27984970 [1,0,1,0,0,0|1,0,1]=4 927 B12R1.77 C=CC(O)c1ccccc1SC Amb25787609 [1,0,1,0,0,0|1,0,1]=4 928 B12R1.77 COc1ccccc1C(=O)C=O Amb9826945 [1,0,1,0,0,0|1,0,1]=4 929 B12R1.124 CC(=O)N(C)c1ccccc1Cl Amb4477464 [1,0,1,0,0,0|1,0,1]=4 930 B12R1.124 CC(=O)N(C)c1ccccc1I Amb27968389 [1,0,1,0,0,0|1,0,1]=4 931 B12R1.124 CC(=O)N(C)c1ccccc1N Amb2444993 [1,0,1,0,0,0|1,0,1]=4 932 B12R1.124 CC(=O)N(C)c1ccccc1O Amb18646273 [1,0,1,0,0,0|0,0,1]=3 933 B12R1.124 CC(C(=O)O)c1ccccc1O Amb22228079 [1,0,1,0,0,0|2,0,0]=4 934 B12R1.124 CC(C(N)=O)c1ccccc1O Amb27607071 [1,0,1,0,0,0|2,0,0]=4 935 B12R1.124 CN(C(=O)Cl)c1ccccc1F Amb27614734 [1,0,1,0,0,0|2,0,0]=4 936 B12R1.124 CN(C(N)=O)c1ccccc1Br Amb27636044 [1,0,1,0,0,0|2,0,0]=4 937 B12R1.124 CN(C(N)=O)c1ccccc1I Amb28351117 [1,0,1,0,0,0|2,0,0]=4 938 B12R1.374 C=C\C=C/c1cc(Cl)ccc1O Amb28243957 [1,0,1,0,0,0|2,0,0]=4 939 B12R1.374 Cc1ccc(O)c(\C=C\C=O)c1 Amb33079853 [1,0,1,0,0,0|2,0,0]=4 940 B12R1.121 C#Cc1ccccc1\C=C\C=O Amb33080081 [1,0,1,0,0,0|1,0,1]=4 941 B12R1.121 CCc1ccccc1\C=C\C=O Amb33079602 [1,0,1,0,0,0|1,0,0]=3 942 B12R1.121 CNc1ccccc1\C=C\C#N Amb28123108 [1,0,1,0,0,0|1,0,1]=4 943 B12R1.121 COc1ccccc1\C=C\C=O Amb6608853 [1,0,1,0,0,0|1,0,0]=3 944 B12R1.121 COc1cccnc1\C=C\C=O Amb33272635 [1,0,1,0,0,0|2,0,0]=4 945 B12R1.121 COc1ncccc1\C=C\C=O Amb33378961 [1,0,1,0,0,0|2,0,0]=4 946 B12R1.121 CSc1ccccc1\C=C\C=O Amb33448986 [1,0,1,0,0,0|1,0,0]=3 947 B12R1.121 C\C=C\Cc1ccccc1NC Amb27477966 [1,0,1,0,0,0|1,0,1]=4 948 B12R1.121 N#Cc1ccccc1\C=C/C=O Amb28194555 [1,0,1,0,0,0|2,0,0]=4 949 B12R1.121 N#Cc1ccccc1\C=C\C=O Amb33474618 [1,0,1,0,0,0|2,0,0]=4 950 B12R1.308 C\C(=C\C=O)c1ccccc1F Amb27476015 [1,0,1,0,0,0|2,0,0]=4 951 B12R1.308 Cc1ccccc1C(=O)CC=O Amb7766349 [1,0,1,0,0,0|0,0,2]=4 952 B12R1.308 Cc1ccccc1C(=O)\C=C\[O-] Amb27624352 [1,0,1,0,0,0|0,0,2]=4 953 B12R1.308 O=C\C=C(\Cl)c1ccccc1Cl Amb28140307 [1,0,1,0,0,0|2,0,0]=4 954 B12R1.261 C=C(C)c1ccccc1C(=O)O Amb18126330 [1,0,1,0,0,0|2,0,0]=4 955 B12R1.261 C=C(C)c1ccccc1C(C)=O Amb27177439 [1,0,1,0,0,0|2,0,0]=4 956 B12R1.261 CC(=O)c1ccccc1C(=O)O Amb2792458 [1,0,1,0,0,0|2,0,0]=4 957 B12R1.261 CN(C)c1ccccc1C(=O)O Amb21964350 [1,0,1,0,0,0|1,0,1]=4 958 B12R1.261 CN(C)c1ccccc1C(=O)O Amb6357485 [1,0,1,0,0,0|1,0,1]=4 959 B12R1.261 CN(N)c1ccccc1C(=O)O Amb28118977 [1,0,1,0,0,0|2,0,0]=4 960 B12R1.261 CS(=O)c1ccccc1C(=O)O Amb1216535 [1,0,1,0,0,0|2,0,0]=4 961 B12R1.283 NC(=O)c1ccccc1NC=O Amb27984337 [1,0,1,0,0,0|1,0,1]=4 962 B12R1.283 NC(=S)c1ccccc1NC=O Amb27593988 [1,0,1,0,0,0|1,1,0]=4 963 B12R1.283 O=CCc1ccccc1C(=O)O Amb17594062 [1,0,1,0,0,0|2,0,0]=4 964 B12R1.283 O=CNc1ccccc1B(O)O Amb27162154 [1,0,1,0,0,0|2,0,0]=4 965 B12R1.283 O=CNc1ccccc1C(=O)O Amb3998047 [1,0,1,0,0,0|1,0,0]=3 966 B12R1.283 O=CNc1cnccc1C(=O)O Amb27412854 [1,0,1,0,0,0|2,0,0]=4 967 B12R1.283 O=COc1ccccc1C(=O)O Amb27753467 [1,0,1,0,0,0|2,0,0]=4 968 B12R2.24 Brc1ccc2ccccc2c1 Amb1159157 [2,0,0,0,0,0|2,0,0]=4 969 B12R2.24 Brc1ccc2ccccc2n1 Amb8397285 [2,0,0,0,0,0|1,0,1]=4 970 B12R2.24 CC1C=Cc2ccccc2N1 Amb17593644 [2,0,0,0,0,0|1,0,1]=4 971 B12R2.24 Cc1ccc2ccccc2c1 Amb6608830 [2,0,0,0,0,0|2,0,0]=4 972 B12R2.24 Cc1ccc2ccccc2n1 Amb1151967 [2,0,0,0,0,0|1,0,1]=4 973 B12R2.24 Cc1ccc2ccccc2n1 Amb33249592 [2,0,0,0,0,0|1,0,1]=4 974 B12R2.24 Clc1ccc2ccccc2c1 Amb6365655 [2,0,0,0,0,0|2,0,0]=4 975 B12R2.24 Clc1ccc2ccccc2n1 Amb2611299 [2,0,0,0,0,0|1,0,1]=4 976 B12R2.24 Fc1ccc2ccccc2c1 Amb5544291 [2,0,0,0,0,0|2,0,0]=4 977 B12R2.24 Fc1ccc2ccccc2n1 Amb20171185 [2,0,0,0,0,0|1,0,1]=4 978 B12R2.24 Ic1ccc2ccccc2c1 Amb4013025 [2,0,0,0,0,0|2,0,0]=4 979 B12R2.24 Ic1ccc2ccccc2n1 Amb10604284 [2,0,0,0,0,0|1,0,1]=4 980 B12R2.24 Nc1ccc2ccccc2c1 Amb22057457 [2,0,0,0,0,0|2,0,0]=4 981 B12R2.24 Nc1ccc2ccccc2c1 Amb3940108 [2,0,0,0,0,0|2,0,0]=4 982 B12R2.24 Nc1ccc2ccccc2n1 Amb1152993 [2,0,0,0,0,0|1,0,1]=4 983 B12R2.24 O=C1C=C2C=CC=CC2=CN1 Amb19958596 [2,0,0,0,0,0|2,0,0]=4 984 B12R2.24 O=C1C=Cc2ccccc2N1 Amb18546039 [2,0,0,0,0,0|0,0,0]=2 985 B12R2.24 O=C1C=Cc2ccccc2O1 Amb18511466 [2,0,0,0,0,0|1,0,0]=3 986 B12R2.24 O=C1C=Cc2ccccc2[N-]1 Amb21940629 [2,0,0,0,0,0|0,0,1]=3 987 B12R2.24 O=C1C=Cc2ccccc2[N-]1 Amb28991227 [2,0,0,0,0,0|0,0,1]=3 988 B12R2.24 O=C1C=Cc2cccnc2N1 Amb22001403 [2,0,0,0,0,0|1,0,0]=3 989 B12R2.24 O=C1C=Cc2ccncc2N1 Amb22493786 [2,0,0,0,0,0|1,0,0]=3 990 B12R2.24 O=C1C=Cc2ccncc2O1 Amb24395883 [2,0,0,0,0,0|2,0,0]=4 991 B12R2.24 O=C1C=Cc2cnccc2N1 Amb21618693 [2,0,0,0,0,0|1,0,0]=3 992 B12R2.24 O=C1C=Cc2ncccc2N1 Amb21856966 [2,0,0,0,0,0|1,0,0]=3 993 B12R2.24 O=C1C=Cc2nccnc2N1 Amb19957771 [2,0,0,0,0,0|2,0,0]=4 994 B12R2.24 O=C1C=Cc2ncncc2N1 Amb21811941 [2,0,0,0,0,0|2,0,0]=4 995 B12R2.24 O=C1C=Nc2ccccc2N1 Amb18372452 [2,0,0,0,0,0|1,0,0]=3 996 B12R2.24 O=C1C=Nc2cccnc2N1 Amb20461570 [2,0,0,0,0,0|2,0,0]=4 997 B12R2.24 O=C1C=Nc2ccncc2N1 Amb18016830 [2,0,0,0,0,0|2,0,0]=4 998 B12R2.24 O=C1CCc2ccccc2N1 Amb6358187 [2,0,0,0,0,0|0,0,2]=4 999 B12R2.24 O=C1CNc2ccccc2N1 Amb6355388 [2,0,0,0,0,0|1,0,1]=4 1000 B12R2.24 O=C1COc2ccccc2N1 Amb1011836 [2,0,0,0,0,0|1,0,1]=4 1001 B12R2.24 O=C1CSc2ccccc2N1 Amb1007458 [2,0,0,0,0,0|1,0,1]=4 1002 B12R2.24 O=C1N=Cc2ccccc2N1 Amb20653982 [2,0,0,0,0,0|1,0,0]=3 1003 B12R2.24 O=C1N=Cc2ccccc2O1 Amb22054765 [2,0,0,0,0,0|2,0,0]=4 1004 B12R2.24 O=C1Nc2ccccc2CO1 Amb19516356 [2,0,0,0,0,0|1,0,1]=4 1005 B12R2.24 O=c1ccn2ccccc2c1 Amb2609671 [2,0,0,0,0,0|2,0,0]=4 1006 B12R2.24 O=n1ccc2ccccc2c1 Amb20247039 [2,0,0,0,0,0|2,0,0]=4 1007 B12R2.24 Oc1ccc2ccccc2c1 Amb2609036 [2,0,0,0,0,0|1,0,1]=4 1008 B12R2.24 S=C1C=Cc2ccccc2N1 Amb18526983 [2,0,0,0,0,0|0,1,0]=3 1009 B12R2.24 S=C1C=Cc2cccnc2N1 Amb27233738 [2,0,0,0,0,0|1,1,0]=4 1010 B12R2.24 S=C1C=Nc2ccccc2N1 Amb18043605 [2,0,0,0,0,0|1,1,0]=4 1011 B12R2.24 SC1=COc2ccccc2N1 Amb28204091 [2,0,0,0,0,0|1,1,0]=4 1012 B12R2.24 Sc1ccc2ccccc2c1 Amb1152959 [2,0,0,0,0,0|1,1,0]=4 1013 B12R2.24 Sc1ccc2ccccc2n1 Amb1151737 [2,0,0,0,0,0|0,1,1]=4 1014 B12R2.24 [Mg+]c1ccc2ccccc2c1 Amb22044011 [2,0,0,0,0,0|2,0,0]=4 1015 B12R2.1081 Brc1cccc2ccccc12 Amb2795757 [2,0,0,0,0,0|2,0,0]=4 1016 B12R2.1081 Brc1ccnc2ccccc12 Amb2447564 [2,0,0,0,0,0|1,0,1]=4 1017 B12R2.1081 C=C1C=CNc2ccccc21 Amb24070554 [2,0,0,0,0,0|1,0,0]=3 1018 B12R2.1081 CC1NC=Cc2ccccc21 Amb28424328 [2,0,0,0,0,0|2,0,0]=4 1019 B12R2.1081 CN1CC=Cc2ccccc21 Amb26960927 [2,0,0,0,0,0|0,0,1]=3 1020 B12R2.1081 C[n+]1cccc2ccccc21 Amb2602430 [2,0,0,0,0,0|0,0,1]=3 1021 B12R2.1081 C[n+]1cccc2ncccc21 Amb2610098 [2,0,0,0,0,0|1,0,1]=4 1022 B12R2.1081 Cc1cccc2ccccc12 Amb6608819 [2,0,0,0,0,0|1,0,0]=3 1023 B12R2.1081 Cc1cccc2cccnc12 Amb1229978 [2,0,0,0,0,0|2,0,0]=4 1024 B12R2.1081 Cc1cccc2ccncc12 Amb10070397 [2,0,0,0,0,0|2,0,0]=4 1025 B12R2.1081 Cc1cccc2cnccc12 Amb2447327 [2,0,0,0,0,0|2,0,0]=4 1026 B12R2.1081 Cc1cccc2ncccc12 Amb2447286 [2,0,0,0,0,0|2,0,0]=4 1027 B12R2.1081 Cc1ccnc2ccccc12 Amb6608646 [2,0,0,0,0,0|1,0,1]=4 1028 B12R2.1081 Cc1cncc2ccccc12 Amb15691609 [2,0,0,0,0,0|2,0,0]=4 1029 B12R2.1081 Cc1nccc2ccccc12 Amb17672018 [2,0,0,0,0,0|2,0,0]=4 1030 B12R2.1081 ClN1C=CNc2ccccc21 Amb27823291 [2,0,0,0,0,0|2,0,0]=4 1031 B12R2.1081 Clc1ccnc2ccccc12 Amb1033000 [2,0,0,0,0,0|1,0,1]=4 1032 B12R2.1081 Fc1cccc2ccccc12 Amb2688247 [2,0,0,0,0,0|2,0,0]=4 1033 B12R2.1081 Fc1ccnc2ccccc12 Amb10067580 [2,0,0,0,0,0|1,0,1]=4 1034 B12R2.1081 Ic1cccc2ccccc12 Amb4605973 [2,0,0,0,0,0|2,0,0]=4 1035 B12R2.1081 Ic1ccnc2ccccc12 Amb5492738 [2,0,0,0,0,0|1,0,1]=4 1036 B12R2.1081 N[n+]1cccc2ccccc21 Amb2613573 [2,0,0,0,0,0|1,0,1]=4 1037 B12R2.1081 Nc1cccc2ccccc12 Amb1935098 [2,0,0,0,0,0|2,0,0]=4 1038 B12R2.1081 Nc1ccnc2ccccc12 Amb1102727 [2,0,0,0,0,0|1,0,1]=4 1039 B12R2.1081 Nc1ccnc2ccccc12 Amb7969523 [2,0,0,0,0,0|1,0,1]=4 1040 B12R2.1081 O=C1C=CCc2ccccc21 Amb2388336 [2,0,0,0,0,0|1,0,1]=4 1041 B12R2.1081 O=C1C=CNc2ccccc21 Amb18369085 [2,0,0,0,0,0|0,0,1]=3 1042 B12R2.1081 O=C1C=CNc2cccnc21 Amb22489921 [2,0,0,0,0,0|1,0,1]=4 1043 B12R2.1081 O=C1C=CNc2ccncc21 Amb20623103 [2,0,0,0,0,0|1,0,1]=4 1044 B12R2.1081 O=C1C=CNc2cnccc21 Amb22055906 [2,0,0,0,0,0|1,0,1]=4 1045 B12R2.1081 O=C1C=CNc2ncccc21 Amb22490480 [2,0,0,0,0,0|1,0,1]=4 1046 B12R2.1081 O=C1C=COc2ccccc21 Amb19894749 [2,0,0,0,0,0|1,0,1]=4 1047 B12R2.1081 O=C1C=CSc2ccccc21 Amb22347337 [2,0,0,0,0,0|1,0,1]=4 1048 B12R2.1081 O=C1C=NNc2ccccc21 Amb18528334 [2,0,0,0,0,0|1,0,1]=4 1049 B12R2.1081 OC1=C2C=CC=CN2CC=C1 Amb17835332 [2,0,0,0,0,0|2,0,0]=4 1050 B12R2.1081 OC1=CNNc2ccccc21 Amb22057612 [2,0,0,0,0,0|1,0,0]=3 1051 B12R2.1081 OC1=COCc2ccccc21 Amb10603427 [2,0,0,0,0,0|2,0,0]=4 1052 B12R2.1081 OC1C=CNc2cccnc21 Amb25921485 [2,0,0,0,0,0|1,0,1]=4 1053 B12R2.1081 OC1C=CSc2ccccc21 Amb27980705 [2,0,0,0,0,0|1,0,1]=4 1054 B12R2.1081 ON1CC=Cc2ccccc21 Amb26600953 [2,0,0,0,0,0|1,0,1]=4 1055 B12R2.1081 O[C@@H]1C=COc2ccccc21 Amb25108504 [2,0,0,0,0,0|1,0,1]=4 1056 B12R2.1081 O[C@H]1C=CCc2ccccc21 Amb28249097 [2,0,0,0,0,0|1,0,1]=4 1057 B12R2.1081 O[C@H]1C=COc2ccccc21 Amb27589685 [2,0,0,0,0,0|1,0,1]=4 1058 B12R2.1081 Oc1cccc2ccccc12 Amb2609031 [2,0,0,0,0,0|1,0,0]=3 1059 B12R2.1081 Oc1cccc2cccnc12 Amb10843705 [2,0,0,0,0,0|2,0,0]=4 1060 B12R2.1081 Oc1cccc2cccnc12 Amb1151957 [2,0,0,0,0,0|2,0,0]=4 1061 B12R2.1081 Oc1cccc2cccnc12 Amb22167517 [2,0,0,0,0,0|2,0,0]=4 1062 B12R2.1081 Oc1cccc2cccnc12 Amb8386462 [2,0,0,0,0,0|2,0,0]=4 1063 B12R2.1081 Oc1cccc2ccncc12 Amb8439357 [2,0,0,0,0,0|2,0,0]=4 1064 B12R2.1081 Oc1cccc2cnccc12 Amb534916 [2,0,0,0,0,0|2,0,0]=4 1065 B12R2.1081 Oc1cccc2ncccc12 Amb2613004 [2,0,0,0,0,0|2,0,0]=4 1066 B12R2.1081 Oc1ccnc2ccccc12 Amb2719646 [2,0,0,0,0,0|0,0,1]=3 1067 B12R2.1081 Oc1ccnc2cccnc12 Amb2610875 [2,0,0,0,0,0|1,0,1]=4 1068 B12R2.1081 Oc1cncc2ccccc12 Amb10553148 [2,0,0,0,0,0|2,0,0]=4 1069 B12R2.1081 Oc1cncc2ccccc12 Amb21964404 [2,0,0,0,0,0|2,0,0]=4 1070 B12R2.1081 Oc1cnnc2ccccc12 Amb2371264 [2,0,0,0,0,0|1,0,1]=4 1071 B12R2.1081 Oc1cnnc2ccccc12 Amb482495 [2,0,0,0,0,0|1,0,1]=4 1072 B12R2.1081 Oc1nccc2ccccc12 Amb2610663 [2,0,0,0,0,0|2,0,0]=4 1073 B12R2.1081 Oc1ncnc2ccccc12 Amb6335374 [2,0,0,0,0,0|1,0,1]=4 1074 B12R2.1081 S=C1C=CNc2ccccc21 Amb19414493 [2,0,0,0,0,0|0,1,0]=3 1075 B12R2.1081 S=C1C=NNc2ccccc21 Amb18043628 [2,0,0,0,0,0|1,1,0]=4 1076 B12R2.1081 Sc1cccc2ccccc12 Amb8516722 [2,0,0,0,0,0|1,1,0]=4 1077 B12R2.1081 Sc1ccnc2ccccc12 Amb10603792 [2,0,0,0,0,0|0,1,1]=4 1078 B12R2.1081 [Mg+]c1cccc2ccccc12 Amb22044005 [2,0,0,0,0,0|2,0,0]=4 1079 B12R2.1081 [O-][n+]1cccc2ccccc21 Amb2609905 [2,0,0,0,0,0|1,0,1]=4 1080 B12R2.1081 [S-]c1cccc2ccccc12 Amb33513016 [2,0,0,0,0,0|1,1,0]=4 1081 B14R1.10 CCC(=O)\C=C(\I)c1ccc(Br)cc1 Amb28430779 [0,1,1,0,0,0|2,0,0]=4 1082 B14R1.10 CNC(=O)CC(=O)c1ccc(C)cc1 Amb28408933 [0,1,1,0,0,0|0,0,2]=4 1083 B14R1.10 CNC(=O)CC(=O)c1ccc(Cl)cc1 Amb27957679 [0,1,1,0,0,0|0,0,2]=4 1084 B14R1.10 CNC(=O)CC(=O)c1ccc(F)cc1 Amb27413660 [0,1,1,0,0,0|0,0,2]=4 1085 B14R1.10 CNC(=O)C[C@H](O)c1ccc(C)cc1 Amb27464442 [0,1,1,0,0,0|0,0,2]=4 1086 B14R1.10 CNC(=O)C[C@H](O)c1ccc(F)cc1 Amb27413642 [0,1,1,0,0,0|0,0,2]=4 1087 B14R1.10 CN\C(C)=C\C(=O)c1ccc(C)cc1 Amb27463271 [0,1,1,0,0,0|1,0,1]=4 1088 B14R1.10 COC(=O)\C=C(/C)c1ccc(F)cc1 Amb33249601 [0,1,1,0,0,0|2,0,0]=4 1089 B14R1.10 COC(=O)\C=C(/C)c1ccc(N)cc1 Amb27199738 [0,1,1,0,0,0|2,0,0]=4 1090 B14R1.10 COC(=O)\C=C(\C)c1ccc(Br)cc1 Amb25717231 [0,1,1,0,0,0|2,0,0]=4 1091 B14R1.10 COC(=O)\C=C(\C)c1ccc(C)cc1 Amb24635465 [0,1,1,0,0,0|2,0,0]=4 1092 B14R1.10 COC(=O)\C=C(\C)c1ccc(Cl)cc1 Amb26535762 [0,1,1,0,0,0|2,0,0]=4 1093 B14R1.10 COC(=O)\C=C(\C)c1ccc(F)cc1 Amb27478776 [0,1,1,0,0,0|2,0,0]=4 1094 B14R1.10 COC(=O)\C=C(\C)c1ccc(N)cc1 Amb27440008 [0,1,1,0,0,0|2,0,0]=4 1095 B14R1.10 COC(=O)\C=C(\N)c1ccc(Cl)cc1 Amb27882741 [0,1,1,0,0,0|2,0,0]=4 1096 B14R1.11 COC(=O)\C=C(\C)c1cccc(Br)c1 Amb25871790 [0,1,1,0,0,0|2,0,0]=4 1097 B14R1.11 COC(=O)\C=C(\C)c1cccc(C)c1 Amb28352254 [0,1,1,0,0,0|2,0,0]=4 1098 B14R1.11 COC(=O)\C=C(\C)c1cccc(Cl)c1 Amb25850659 [0,1,1,0,0,0|2,0,0]=4 1099 B14R1.11 COC(=O)\C=C(\C)c1cccc(F)c1 Amb26640967 [0,1,1,0,0,0|2,0,0]=4 1100 B14R1.11 COC(=O)\C=C(\C)c1cccc(N)c1 Amb33472130 [0,1,1,0,0,0|2,0,0]=4 1101 B14R1.29 CCNC(=O)\C=C(\C)c1ccccc1 Amb27792973 [0,1,1,0,0,0|1,0,0]=3 1102 B14R1.29 CCNC(=O)\C=C(\Cl)c1ccccc1 Amb27875186 [0,1,1,0,0,0|1,0,0]=3 1103 B14R1.29 CCNC(=O)\C=C(\S)c1ccccc1 Amb27162822 [0,1,1,0,0,0|0,1,0]=3 1104 B14R1.29 CCOC(=O)\C=C(/C)c1ccccc1 Amb8391067 [0,1,1,0,0,0|2,0,0]=4 1105 B14R1.29 CCOC(=O)\C=C(\C)c1ccccc1 Amb10566527 [0,1,1,0,0,0|2,0,0]=4 1106 B14R1.29 N\C(=C/C(=O)NC=O)c1ccccc1 Amb28145844 [0,1,1,0,0,0|1,0,1]=4 1107 B14R1.58 CC\C(=C\C(=O)c1ccccc1)NC Amb25664183 [0,1,1,0,0,0|1,0,1]=4 1108 B14R1.58 CN\C(C#N)=C\C(=O)c1ccccc1 Amb27984994 [0,1,1,0,0,0|1,0,1]=4 1109 B14R1.85 C=C(C(=O)OC)C(O)c1ccccc1 Amb6671058 [0,1,1,0,0,0|1,0,1]=4 1110 B14R1.85 CCC(=O)\C(C)=C(\N)c1ccccc1 Amb27863440 [0,1,1,0,0,0|2,0,0]=4 1111 B14R1.85 CNC(=O)N(C)C(=O)c1ccccc1 Amb24551879 [0,1,1,0,0,0|1,0,1]=4 1112 B14R1.85 CNC(=O)\C(C)=C(\C)c1ccccc1 Amb26443927 [0,1,1,0,0,0|1,0,0]=3 1113 B14R1.85 COC(=O)\C(N)=C(\C)c1ccccc1 Amb27629677 [0,1,1,0,0,0|2,0,0]=4 1114 B14R1.415 C\C(=C/C(=O)c1ccccc1)N(C)C Amb6384170 [0,1,1,0,0,0|1,0,1]=4 1115 B14R1.587 CNC(=O)NC(=O)c1ccccc1Cl Amb27876465 [0,1,1,0,0,0|1,0,1]=4 1116 B14R1.587 COC(=O)\C=C(/C)c1ccccc1Cl Amb25776873 [0,1,1,0,0,0|2,0,0]=4 1117 B14R1.587 COC(=O)\C=C(\C)c1ccccc1Br Amb24687209 [0,1,1,0,0,0|2,0,0]=4 1118 B14R1.587 COC(=O)\C=C(\C)c1ccccc1C Amb24701693 [0,1,1,0,0,0|2,0,0]=4 1119 B14R1.587 COC(=O)\C=C(\C)c1ccccc1Cl Amb24463095 [0,1,1,0,0,0|2,0,0]=4 1120 B14R1.587 COC(=O)\C=C(\C)c1ccccc1F Amb25856433 [0,1,1,0,0,0|2,0,0]=4 1121 B14R1.587 C\N=C(C)/C=C(\O)c1ccccc1O Amb27210540 [0,1,1,0,0,0|1,0,1]=4 1122 B14R1.3297 CCC(=O)\C=C(/NC)c1ccccc1 Amb27747015 [0,1,1,0,0,0|2,0,0]=4 1123 B14R1.3297 CCC(=O)\C=C(\NC)c1ccccc1 Amb28246440 [0,1,1,0,0,0|2,0,0]=4 1124 B14R1.3297 CC\C(=C\C(=O)OC)c1ccccc1 Amb33472110 [0,1,1,0,0,0|2,0,0]=4 1125 B14R1.3297 CNC(=O)NC(CO)c1ccccc1 Amb27450957 [0,1,1,0,0,0|1,0,1]=4 1126 B14R1.3297 CNC(=O)N[C@@H](CO)c1ccccc1 Amb27598857 [0,1,1,0,0,0|1,0,1]=4 1127 B14R1.3297 CNC(=O)\C=C(/NC)c1ccccc1 Amb8492591 [0,1,1,0,0,0|1,0,0]=3 1128 B14R1.3297 CN\C(=C/C(=O)OC)c1ccccc1 Amb28119210 [0,1,1,0,0,0|2,0,0]=4 1129 B14R1.3297 CN\C(=C\C(=O)OC)c1ccccc1 Amb27268330 [0,1,1,0,0,0|2,0,0]=4 1130 B14R1.3297 C\N=C(\NC(=O)NC)c1ccccc1 Amb27957912 [0,1,1,0,0,0|2,0,0]=4 1131 B14R1.35 C\C=C\C(=O)N(N)c1ccc(C)cc1 Amb33191386 [0,1,1,0,0,0|2,0,0]=4 1132 B14R1.35 C\C=C\C(=O)N(N)c1ccc(F)cc1 Amb33191415 [0,1,1,0,0,0|2,0,0]=4 1133 B14R1.36 C\C=C\C(=O)N(C)c1cccc(F)c1 Amb27836917 [0,1,1,0,0,0|1,0,0]=3 1134 B14R1.36 C\C=C\C(=O)N(N)c1cccc(C)c1 Amb33191401 [0,1,1,0,0,0|2,0,0]=4 1135 B14R1.166 CN(C(=O)CCCO)c1ccccc1 Amb17235619 [0,1,1,0,0,0|0,0,2]=4 1136 B14R1.417 CC(=O)CC(=O)N(C)c1ccccc1 Amb6373995 [0,1,1,0,0,0|0,0,2]=4 1137 B14R1.417 CC(=O)NC(=O)N(C)c1ccccc1 Amb28047303 [0,1,1,0,0,0|1,0,1]=4 1138 B14R1.417 CC(C)=CC(=O)N(C)c1ccccc1 Amb5355209 [0,1,1,0,0,0|1,0,0]=3 1139 B14R1.417 CC(C)=CC(=O)N(C)c1ccccn1 Amb27605613 [0,1,1,0,0,0|2,0,0]=4 1140 B14R1.417 CN(C(=O)CC(=O)O)c1ccccc1 Amb17401705 [0,1,1,0,0,0|0,0,1]=3 1141 B14R1.510 CC(C)(C(=O)\C=C\Cl)c1ccccc1 Amb35609149 [0,1,1,0,0,0|2,0,0]=4 1142 B14R1.604 CCN(C(=O)CCO)c1ccccc1 Amb17336617 [0,1,1,0,0,0|0,0,2]=4 1143 B14R1.429 CC(=O)N(C)c1ccccc1C(=O)O Amb1235492 [0,1,1,0,0,0|0,0,1]=3 1144 B14R1.429 CC(=O)N(C)c1ccccc1C(N)=O Amb9004011 [0,1,1,0,0,0|0,0,2]=4 1145 B14R1.429 CC(=O)c1ccccc1N(C)C(C)=O Amb28071370 [0,1,1,0,0,0|0,0,2]=4 1146 B14R1.429 CC(=O)c1ccccc1N(C)C(N)=O Amb27816717 [0,1,1,0,0,0|1,0,1]=4 1147 B14R1.429 CC(C(=O)O)c1ccccc1C(=O)O Amb18651689 [0,1,1,0,0,0|2,0,0]=4 1148 B14R1.429 CN(c1ccccc1C(=O)O)S(C)=O Amb27476569 [0,1,1,0,0,0|1,0,1]=4 1149 B14R1.599 COc1ccc(Br)cc1\C(Cl)=C\C=O Amb17278770 [0,1,1,0,0,0|2,0,0]=4 1150 B14R1.599 COc1ccc(C)cc1\C(Cl)=C\C=O Amb17240739 [0,1,1,0,0,0|2,0,0]=4 1151 B14R1.599 COc1ccc(Cl)cc1\C(Cl)=C\C=O Amb17249274 [0,1,1,0,0,0|2,0,0]=4 1152 B14R1.599 COc1ccc(F)cc1\C(Cl)=C\C=O Amb17241778 [0,1,1,0,0,0|2,0,0]=4 1153 B14R1.623 CC(=O)c1ccccc1\C(C)=C\C=O Amb26474129 [0,1,1,0,0,0|2,0,0]=4 1154 B14R1.623 C\C=C\C(=O)c1ccccc1N(C)C Amb28350161 [0,1,1,0,0,0|1,0,1]=4 1155 B14R1.840 CNc1ccccc1C(O)C=C(C)C Amb27985020 [0,1,1,0,0,0|1,0,1]=4 1156 B14R1.840 COc1ccccc1\C(C)=C\C(=O)O Amb24271448 [0,1,1,0,0,0|2,0,0]=4 1157 B14R1.840 COc1ccccc1\C(C)=C\C(C)=O Amb28460818 [0,1,1,0,0,0|2,0,0]=4 1158 B14R1.7233 COc1cc(C)ccc1\C(C)=C/C=O Amb27808252 [0,1,1,0,0,0|2,0,0]=4 1159 B14R1.317 CC(C)(C=O)c1ccccc1C(=O)O Amb33072962 [0,1,1,0,0,0|2,0,0]=4 1160 B14R1.746 CN(C=O)c1ccccc1C(=O)CCl Amb24073095 [0,1,1,0,0,0|0,0,2]=4 1161 B14R1.746 CNC(=O)c1ccccc1N(C)C=O Amb27403083 [0,1,1,0,0,0|0,0,2]=4 1162 B14R2.92 COc1ccc2ccccc2c1C Amb17743960 [1,1,0,0,0,0|1,0,1]=4 1163 B14R2.92 C[n+]1c(NN)ccc2ccccc21 Amb27869603 [1,1,0,0,0,0|1,0,1]=4 1164 B14R2.92 Cc1c(C#N)ccc2ccccc12 Amb17594178 [1,1,0,0,0,0|2,0,0]=4 1165 B14R2.92 Cc1c(C=O)ccc2ccccc12 Amb17594259 [1,1,0,0,0,0|1,0,0]=3 1166 B14R2.92 Cc1c(CBr)ccc2ccccc12 Amb27180973 [1,1,0,0,0,0|2,0,0]=4 1167 B14R2.92 Cc1c(CCl)ccc2ccccc12 Amb25927087 [1,1,0,0,0,0|2,0,0]=4 1168 B14R2.92 Cc1c(CN)ccc2ccccc12 Amb25815347 [1,1,0,0,0,0|2,0,0]=4 1169 B14R2.92 Nc1c(C=O)ccc2ccccc12 Amb27389594 [1,1,0,0,0,0|2,0,0]=4 1170 B14R2.92 O=Cc1ccc2ccccc2[n+]1[O-] Amb9776106 [1,1,0,0,0,0|1,0,1]=4 1171 B14R2.92 O=Cc1ccc2ccccc2c1Br Amb3939652 [1,1,0,0,0,0|2,0,0]=4 1172 B14R2.92 O=Cc1ccc2ccccc2c1Cl Amb8388177 [1,1,0,0,0,0|2,0,0]=4 1173 B14R2.92 O=Cc1ccc2ccccc2c1F Amb8388176 [1,1,0,0,0,0|2,0,0]=4 1174 B14R2.92 O=Cc1ccc2ccccc2c1I Amb27647571 [1,1,0,0,0,0|2,0,0]=4 1175 B14R2.92 O=Cc1ccc2ccccc2c1O Amb4007826 [1,1,0,0,0,0|2,0,0]=4 1176 B14R2.92 O=Nc1ccc2ccccc2c1O Amb6357361 [1,1,0,0,0,0|2,0,0]=4 1177 B14R2.203 BrCc1c(Br)ccc2ccccc12 Amb22040437 [1,1,0,0,0,0|2,0,0]=4 1178 B14R2.203 BrCc1c(I)ccc2ccccc12 Amb25351584 [1,1,0,0,0,0|2,0,0]=4 1179 B14R2.203 CCN1C(=O)C=Cc2ccccc21 Amb22360524 [1,1,0,0,0,0|0,0,0]=2 1180 B14R2.203 CCN1C(=O)C=Cc2cccnc21 Amb26376360 [1,1,0,0,0,0|1,0,0]=3 1181 B14R2.203 CCN1C(=O)C=Nc2ccccc21 Amb26053521 [1,1,0,0,0,0|1,0,0]=3 1182 B14R2.203 CCN1C(=O)CCc2ccccc21 Amb28243212 [1,1,0,0,0,0|0,0,2]=4 1183 B14R2.203 CCN1C(=O)CNc2ccccc21 Amb8471883 [1,1,0,0,0,0|1,0,1]=4 1184 B14R2.203 CCN1C(=O)COc2ccccc21 Amb17096162 [1,1,0,0,0,0|1,0,1]=4 1185 B14R2.203 CCN1C(=S)C=Cc2ccccc21 Amb20247294 [1,1,0,0,0,0|0,1,0]=3 1186 B14R2.203 CC[n+]1c(C)ccc2ccccc21 Amb1144527 [1,1,0,0,0,0|1,0,1]=4 1187 B14R2.203 CC[n+]1c(C)ccc2ccccc21 Amb2609772 [1,1,0,0,0,0|1,0,1]=4 1188 B14R2.203 CCc1c(N)ccc2ccccc12 Amb28322316 [1,1,0,0,0,0|2,0,0]=4 1189 B14R2.203 CNc1c(C)ccc2ccccc12 Amb18553377 [1,1,0,0,0,0|2,0,0]=4 1190 B14R2.203 COc1c(Br)ccc2ccccc12 Amb18559387 [1,1,0,0,0,0|2,0,0]=4 1191 B14R2.203 COc1c(C)ccc2ccccc12 Amb25829445 [1,1,0,0,0,0|2,0,0]=4 1192 B14R2.203 COc1c(Cl)ccc2ccccc12 Amb26846125 [1,1,0,0,0,0|2,0,0]=4 1193 B14R2.203 COc1c(F)ccc2ccccc12 Amb26556586 [1,1,0,0,0,0|2,0,0]=4 1194 B14R2.203 COc1c(I)ccc2ccccc12 Amb25237394 [1,1,0,0,0,0|2,0,0]=4 1195 B14R2.203 COc1c(N)ccc2ccccc12 Amb18127046 [1,1,0,0,0,0|2,0,0]=4 1196 B14R2.203 COc1c(O)ccc2ccccc12 Amb18127193 [1,1,0,0,0,0|1,0,1]=4 1197 B14R2.203 CSc1c(N)ccc2ccccc12 Amb27860266 [1,1,0,0,0,0|2,0,0]=4 1198 B14R2.203 Cc1ccc2ccccc2c1CBr Amb24080215 [1,1,0,0,0,0|2,0,0]=4 1199 B14R2.203 Cc1ccc2ccccc2c1CCl Amb2609042 [1,1,0,0,0,0|2,0,0]=4 1200 B14R2.203 Cc1ccc2ccccc2c1CN Amb18051856 [1,1,0,0,0,0|2,0,0]=4 1201 B14R2.203 ClCc1c(Br)ccc2ccccc12 Amb25995195 [1,1,0,0,0,0|2,0,0]=4 1202 B14R2.203 ClCc1c(Cl)ccc2ccccc12 Amb27986203 [1,1,0,0,0,0|2,0,0]=4 1203 B14R2.203 ClCc1c(I)ccc2ccccc12 Amb26025835 [1,1,0,0,0,0|2,0,0]=4 1204 B14R2.203 Clc1ccc2ccccc2c1CBr Amb27753540 [1,1,0,0,0,0|2,0,0]=4 1205 B14R2.203 Fc1ccc2ccccc2c1CBr Amb26654237 [1,1,0,0,0,0|2,0,0]=4 1206 B14R2.203 Fc1ccc2ccccc2c1CCl Amb24055306 [1,1,0,0,0,0|2,0,0]=4 1207 B14R2.203 NCc1c(Cl)ccc2ccccc12 Amb27803653 [1,1,0,0,0,0|2,0,0]=4 1208 B14R2.203 NCc1c(F)ccc2ccccc12 Amb24054596 [1,1,0,0,0,0|2,0,0]=4 1209 B14R2.203 NCc1c(I)ccc2ccccc12 Amb25324000 [1,1,0,0,0,0|2,0,0]=4 1210 B14R2.203 NCc1c(N)ccc2ccccc12 Amb28243692 [1,1,0,0,0,0|2,0,0]=4 1211 B14R2.203 NCc1c(N)ccc2ccccc12 Amb32667593 [1,1,0,0,0,0|2,0,0]=4 1212 B14R2.203 NCc1c(O)ccc2ccccc12 Amb1133018 [1,1,0,0,0,0|1,0,1]=4 1213 B14R2.203 NCc1c(O)ccc2ccccc12 Amb1993926 [1,1,0,0,0,0|1,0,1]=4 1214 B14R2.203 N\C=C1\C(=O)C=Cc2ccccc21 Amb27446516 [1,1,0,0,0,0|1,0,1]=4 1215 B14R2.203 Nc1ccc2ccccc2c1CBr Amb27180644 [1,1,0,0,0,0|2,0,0]=4 1216 B14R2.203 Nc1ccc2ccccc2c1CO Amb27250669 [1,1,0,0,0,0|2,0,0]=4 1217 B14R2.203 O=C1C=Cc2ccccc2\C1=N/O Amb19748272 [1,1,0,0,0,0|2,0,0]=4 1218 B14R2.203 OCc1c(Cl)ccc2ccccc12 Amb25808641 [1,1,0,0,0,0|2,0,0]=4 1219 B14R2.203 OCc1c(F)ccc2ccccc12 Amb25945307 [1,1,0,0,0,0|2,0,0]=4 1220 B14R2.203 OCc1c(I)ccc2ccccc12 Amb27796250 [1,1,0,0,0,0|2,0,0]=4 1221 B14R2.203 OCc1c(O)ccc2ccccc12 Amb1111444 [1,1,0,0,0,0|1,0,1]=4 1222 B14R2.203 OCc1c(S)ccc2ccccc12 Amb27665549 [1,1,0,0,0,0|1,1,0]=4 1223 B14R2.203 Oc1ccc2ccccc2c1CBr Amb25211050 [1,1,0,0,0,0|1,0,1]=4 1224 B14R2.203 Oc1ccc2ccccc2c1CCl Amb17477547 [1,1,0,0,0,0|1,0,1]=4 1225 B14R2.203 Oc1ccc2ccccc2c1CS Amb32788722 [1,1,0,0,0,0|1,0,1]=4 1226 B14R2.743 CC1(N)C(=O)C=Cc2ccccc21 Amb27400286 [1,1,0,0,0,0|1,0,0]=3 1227 B14R2.743 CC1(O)C(=O)C=Cc2ccccc21 Amb4006659 [1,1,0,0,0,0|1,0,0]=3 1228 B14R2.743 O=C1C=Cc2ccccc2C1(Cl)Cl Amb28370028 [1,1,0,0,0,0|2,0,0]=4 1229 B14R2.4513 CN1C(=O)C=Cc2ccc(Br)cc21 Amb22495249 [1,1,0,0,0,0|0,0,0]=2 1230 B14R2.4513 CN1C(=O)C=Cc2ccc(Cl)nc21 Amb27872447 [1,1,0,0,0,0|1,0,0]=3 1231 B14R2.4513 CN1C(=O)C=Cc2ccc(F)cc21 Amb26064690 [1,1,0,0,0,0|0,0,0]=2 1232 B14R2.4513 CN1C(=O)C=Cc2ccc(N)cc21 Amb27179353 [1,1,0,0,0,0|0,0,0]=2 1233 B14R2.4513 CN1C(=O)C=Cc2ccc(N)nc21 Amb27984856 [1,1,0,0,0,0|1,0,0]=3 1234 B14R2.4513 CN1C(=O)C=Cc2ncc(F)cc21 Amb27756420 [1,1,0,0,0,0|1,0,0]=3 1235 B14R2.4513 CN1C(=O)C=NC2=C1NC(=O)C=C2 Amb28208455 [1,1,0,0,0,0|2,0,0]=4 1236 B14R2.4513 CN1C(=O)C=Nc2ccc(Br)cc21 Amb19957640 [1,1,0,0,0,0|1,0,0]=3 1237 B14R2.4513 CN1C(=O)C=Nc2ccc(Cl)cc21 Amb27475957 [1,1,0,0,0,0|1,0,0]=3 1238 B14R2.4513 CN1C(=O)CCc2ccc(Br)cc21 Amb8496593 [1,1,0,0,0,0|0,0,2]=4 1239 B14R2.4513 CN1C(=O)CCc2ccc(Cl)cc21 Amb27660828 [1,1,0,0,0,0|0,0,2]=4 1240 B14R2.4513 CN1C(=O)CCc2ccc(F)cc21 Amb25045654 [1,1,0,0,0,0|0,0,2]=4 1241 B14R2.4513 CN1C(=O)CCc2ccc(N)cc21 Amb13881434 [1,1,0,0,0,0|0,0,2]=4 1242 B14R2.4513 CN1C(=O)CNc2ccc(Br)cc21 Amb32648098 [1,1,0,0,0,0|1,0,1]=4 1243 B14R2.4513 CN1C(=O)COc2ccc(Br)cc21 Amb17572941 [1,1,0,0,0,0|1,0,1]=4 1244 B14R2.4513 CN1C(=O)COc2ccc(F)cc21 Amb17570331 [1,1,0,0,0,0|1,0,1]=4 1245 B14R2.4513 CN1C(=O)COc2ccc(N)cc21 Amb1397750 [1,1,0,0,0,0|1,0,1]=4 1246 B14R2.4513 CN1C(=O)COc2ccc(N)cc21 Amb2579340 [1,1,0,0,0,0|1,0,1]=4 1247 B14R2.4513 CN1C(=O)COc2ccc(O)cc21 Amb17217523 [1,1,0,0,0,0|1,0,1]=4 1248 B14R2.4513 CN1C(=O)COc2ccc(S)cc21 Amb25191629 [1,1,0,0,0,0|1,0,1]=4 1249 B14R2.4513 CN1C(=O)CSc2ccc(Br)cc21 Amb28052796 [1,1,0,0,0,0|1,0,1]=4 1250 B14R2.4513 CN1C(=O)NCc2ccc(Br)cc21 Amb26417130 [1,1,0,0,0,0|1,0,1]=4 1251 B14R2.4513 CN1C(=O)NCc2ccc(N)cc21 Amb24537376 [1,1,0,0,0,0|1,0,1]=4 1252 B14R2.4513 Cc1ccc2c(c1)N(C)C(=O)CC2 Amb27953179 [1,1,0,0,0,0|0,0,2]=4 1253 B14R2.4513 Cc1ccc2c(c1)N(C)C(=O)CN2 Amb26346622 [1,1,0,0,0,0|1,0,1]=4 1254 B14R2.4513 Cc1ccc2c(c1)N(C)C(=O)CO2 Amb4036887 [1,1,0,0,0,0|1,0,1]=4 1255 B14R2.4513 Cc1ccc2c(c1)N(O)C(=O)C=C2 Amb25793546 [1,1,0,0,0,0|1,0,0]=3 1256 B14R2.4513 Cc1ccc2ccc(C)c(C)c2c1 Amb6296402 [1,1,0,0,0,0|2,0,0]=4 1257 B14R2.4513 Cc1ccc2ccc(O)cc2c1C Amb27750229 [1,1,0,0,0,0|2,0,0]=4 1258 B14R2.4513 O=C1C=Cc2ccc(Cl)cc2C1=O Amb27461312 [1,1,0,0,0,0|2,0,0]=4 1259 B14R2.4513 O=C1C=Cc2ccc(O)cc2C1=O Amb17594375 [1,1,0,0,0,0|2,0,0]=4 1260 B14R2.8038 CN1C(=O)C=CC2=C1C=CNC2=O Amb23592126 [1,1,0,0,0,0|1,0,0]=3 1261 B14R2.8038 CN1C(=O)C=Cc2c(Br)cccc21 Amb26331987 [1,1,0,0,0,0|0,0,0]=2 1262 B14R2.8038 CN1C(=O)C=Cc2c(F)cccc21 Amb23448941 [1,1,0,0,0,0|0,0,0]=2 1263 B14R2.8038 CN1C(=O)C=Cc2c(N)cccc21 Amb28243197 [1,1,0,0,0,0|0,0,0]=2 1264 B14R2.8038 CN1C(=O)C=Cc2c(N)cccc21 Amb32664671 [1,1,0,0,0,0|0,0,0]=2 1265 B14R2.8038 CN1C(=O)C=Cc2c(O)cccc21 Amb26476600 [1,1,0,0,0,0|0,0,0]=2 1266 B14R2.8038 CN1C(=O)C=Cc2c1ccnc2Cl Amb23592151 [1,1,0,0,0,0|1,0,0]=3 1267 B14R2.8038 CN1C(=O)C=Cc2c1ccnc2N Amb23592153 [1,1,0,0,0,0|1,0,0]=3 1268 B14R2.8038 CN1C(=O)C=Nc2c(Br)cccc21 Amb27394228 [1,1,0,0,0,0|1,0,0]=3 1269 B14R2.8038 CN1C(=O)C=Nc2c(F)cccc21 Amb27180485 [1,1,0,0,0,0|1,0,0]=3 1270 B14R2.8038 CN1C(=O)CCc2c(Br)cccc21 Amb27201489 [1,1,0,0,0,0|0,0,2]=4 1271 B14R2.8038 CN1C(=O)CCc2c(Cl)cccc21 Amb23401463 [1,1,0,0,0,0|0,0,2]=4 1272 B14R2.8038 CN1C(=O)CCc2c(F)cccc21 Amb27600796 [1,1,0,0,0,0|0,0,2]=4 1273 B14R2.8038 CN1C(=O)CCc2c(N)cccc21 Amb22755472 [1,1,0,0,0,0|0,0,2]=4 1274 B14R2.8038 CN1C(=O)COc2c(Br)cccc21 Amb17572944 [1,1,0,0,0,0|1,0,1]=4 1275 B14R2.8038 CN1C(=O)COc2c(Cl)cccc21 Amb17570782 [1,1,0,0,0,0|1,0,1]=4 1276 B14R2.8038 CN1C(=O)COc2c(F)cccc21 Amb17570332 [1,1,0,0,0,0|1,0,1]=4 1277 B14R2.8038 CN1C(=O)COc2c(N)cccc21 Amb10068366 [1,1,0,0,0,0|1,0,1]=4 1278 B14R2.8038 CN1C(=O)NCc2c(Br)cccc21 Amb25939653 [1,1,0,0,0,0|1,0,1]=4 1279 B14R2.8038 CN1C(=O)NCc2c(N)cccc21 Amb24413927 [1,1,0,0,0,0|1,0,1]=4 1280 B14R2.8038 Cc1ccc2c(C)cccc2c1C Amb16192708 [1,1,0,0,0,0|2,0,0]=4 1281 B14R2.8038 Cc1cccc2c1NCC(=O)N2C Amb25158334 [1,1,0,0,0,0|1,0,1]=4 1282 B14R2.8038 Cc1cccc2c1OCC(=O)N2C Amb17570219 [1,1,0,0,0,0|1,0,1]=4 1283 B14R2.8038 Cc1ccnc2c1C=CC(=O)N2C Amb27946259 [1,1,0,0,0,0|1,0,0]=3 1284 B14R2.8188 CC1=Cc2ccccc2N(C)C1=O Amb22904186 [1,1,0,0,0,0|0,0,0]=2 1285 B14R2.8188 CC1=Nc2ccccc2N(C)C1=O Amb19652902 [1,1,0,0,0,0|1,0,0]=3 1286 B14R2.8188 CC1=Nc2ccccc2N(N)C1=O Amb28319544 [1,1,0,0,0,0|2,0,0]=4 1287 B14R2.8188 CC1=Nc2ccccc2N(O)C1=O Amb27205386 [1,1,0,0,0,0|2,0,0]=4 1288 B14R2.8188 CC1=Nc2cccnc2N(C)C1=O Amb27768989 [1,1,0,0,0,0|2,0,0]=4 1289 B14R2.8188 CC1=Nc2cnccc2N(C)C1=O Amb28242334 [1,1,0,0,0,0|2,0,0]=4 1290 B14R2.8188 CC1Cc2ccccc2N(C)C1=O Amb18061650 [1,1,0,0,0,0|0,0,2]=4 1291 B14R2.8188 CC1Nc2ccccc2N(C)C1=O Amb17468988 [1,1,0,0,0,0|1,0,1]=4 1292 B14R2.8188 CC1Oc2ccccc2N(C)C1=O Amb2607014 [1,1,0,0,0,0|1,0,1]=4 1293 B14R2.8188 CN1C(=O)C(=O)Nc2ccccc21 Amb19516760 [1,1,0,0,0,0|1,0,0]=3 1294 B14R2.8188 CN1C(=O)C(=O)Nc2cccnc21 Amb21940098 [1,1,0,0,0,0|2,0,0]=4 1295 B14R2.8188 CN1C(=O)C(=O)Nc2ccncc21 Amb27868476 [1,1,0,0,0,0|2,0,0]=4 1296 B14R2.8188 CN1C(=O)C(Br)=Cc2ccccc21 Amb20246919 [1,1,0,0,0,0|0,0,0]=2 1297 B14R2.8188 CN1C(=O)C(Cl)=Nc2cccnc21 Amb21937163 [1,1,0,0,0,0|2,0,0]=4 1298 B14R2.8188 CN1C(=O)C(Cl)=Nc2ccncc21 Amb32416815 [1,1,0,0,0,0|2,0,0]=4 1299 B14R2.8188 CN1C(=O)C(Cl)=Nc2ncccc21 Amb23557989 [1,1,0,0,0,0|2,0,0]=4 1300 B14R2.8188 CN1C(=O)C(F)=Cc2ccccc21 Amb22547226 [1,1,0,0,0,0|0,0,0]=2 1301 B14R2.8188 CN1C(=O)C(N)=Cc2ccccc21 Amb18065259 [1,1,0,0,0,0|0,0,0]=2 1302 B14R2.8188 CN1C(=O)C(N)Cc2ccccc21 Amb18559243 [1,1,0,0,0,0|0,0,2]=4 1303 B14R2.8188 CN1C(=O)C(N)Cc2ccccc21 Amb28600349 [1,1,0,0,0,0|0,0,2]=4 1304 B14R2.8188 CN1C(=O)C(O)=Nc2ncccc21 Amb23557988 [1,1,0,0,0,0|2,0,0]=4 1305 B14R2.8188 CN1Sc2ccccc2N(C)C1=O Amb27983317 [1,1,0,0,0,0|2,0,0]=4 1306 B14R2.8188 Cc1c(O)cc2ccccc2c1C Amb24309351 [1,1,0,0,0,0|2,0,0]=4 1307 B14R2.8188 Cc1cc2ccccc2c(C)c1C Amb6296864 [1,1,0,0,0,0|2,0,0]=4 1308 B14R2.8188 Cn1c(=O)c(N)nc2ccccc21 Amb8439682 [1,1,0,0,0,0|1,0,0]=3 1309 B14R2.8188 NC1=Cc2ccccc2N(O)C1=O Amb27244820 [1,1,0,0,0,0|1,0,0]=3 1310 B14R2.8188 NN1C(=O)C(=O)Nc2ccccc21 Amb25828466 [1,1,0,0,0,0|2,0,0]=4 1311 B14R2.8188 O=C1C(=O)c2ccccc2C=C1Cl Amb27404598 [1,1,0,0,0,0|2,0,0]=4 1312 B14R2.8188 O=C1C(=O)c2ccccc2C=C1O Amb17594373 [1,1,0,0,0,0|2,0,0]=4 1313 B14R2.28523 CN1C(=O)C=Cc2cccc(N)c21 Amb25689714 [1,1,0,0,0,0|0,0,0]=2 1314 B14R2.28523 CN1C(=O)C=Cc2cccc(O)c21 Amb22751142 [1,1,0,0,0,0|0,0,0]=2 1315 B14R2.28523 CN1C(=O)C=Cc2nccc(O)c21 Amb27974128 [1,1,0,0,0,0|1,0,0]=3 1316 B14R2.28523 CN1C(=O)C=Nc2cccc(Cl)c21 Amb27451759 [1,1,0,0,0,0|1,0,0]=3 1317 B14R2.28523 CN1C(=O)CCc2cccc(Br)c21 Amb27808652 [1,1,0,0,0,0|0,0,2]=4 1318 B14R2.28523 CN1C(=O)CCc2cccc(Cl)c21 Amb25755285 [1,1,0,0,0,0|0,0,2]=4 1319 B14R2.28523 CN1C(=O)CCc2cccc(F)c21 Amb25884631 [1,1,0,0,0,0|0,0,2]=4 1320 B14R2.28523 CN1C(=O)CCc2cccc(N)c21 Amb27597468 [1,1,0,0,0,0|0,0,2]=4 1321 B14R2.28523 CN1C(=O)CNc2cccc(Cl)c21 Amb27242899 [1,1,0,0,0,0|1,0,1]=4 1322 B14R2.28523 CN1C(=O)COc2cccc(F)c21 Amb25191597 [1,1,0,0,0,0|1,0,1]=4 1323 B14R2.28523 CN1C(=O)COc2cccc(N)c21 Amb18559335 [1,1,0,0,0,0|1,0,1]=4 1324 B14R2.28523 CN1C(=O)NCc2cccc(Br)c21 Amb27639060 [1,1,0,0,0,0|1,0,1]=4 1325 B14R2.28523 CN1C(=O)OCc2cccc(O)c21 Amb18128314 [1,1,0,0,0,0|1,0,1]=4 1326 B14R2.28523 Cc1ccc2cccc(C)c2c1C Amb6298592 [1,1,0,0,0,0|2,0,0]=4 1327 B14R2.28523 Cc1cccc2c1N(C)C(=O)CC2 Amb5718535 [1,1,0,0,0,0|0,0,2]=4 1328 B14R2.28523 Cc1cccc2c1N(C)C(=O)CO2 Amb25737758 [1,1,0,0,0,0|1,0,1]=4 1329 B14R2.28523 Cn1c(=O)ccc2cccc(Br)c21 Amb24092279 [1,1,0,0,0,0|0,0,0]=2 1330 B14R2.28523 N=C1C(=O)C=Cc2cccc(N)c21 Amb27415544 [1,1,0,0,0,0|2,0,0]=4 1331 B14R2.28523 O=C1C=Cc2cccc(Br)c2C1=O Amb28121485 [1,1,0,0,0,0|2,0,0]=4 1332 B14R2.29369 CN1C(=O)C=Cc2cc(Br)ccc21 Amb22522657 [1,1,0,0,0,0|0,0,0]=2 1333 B14R2.29369 CN1C(=O)C=Cc2cc(O)ccc21 Amb18127365 [1,1,0,0,0,0|0,0,0]=2 1334 B14R2.29369 CN1C(=O)C=Nc2cc(Br)ccc21 Amb27177111 [1,1,0,0,0,0|1,0,0]=3 1335 B14R2.29369 CN1C(=O)C=Nc2cc(Cl)ccc21 Amb27605467 [1,1,0,0,0,0|1,0,0]=3 1336 B14R2.29369 CN1C(=O)C=Nc2cc(F)ccc21 Amb24559947 [1,1,0,0,0,0|1,0,0]=3 1337 B14R2.29369 CN1C(=O)CCc2cc(Br)ccc21 Amb17348339 [1,1,0,0,0,0|0,0,2]=4 1338 B14R2.29369 CN1C(=O)CCc2cc(Cl)ccc21 Amb24341256 [1,1,0,0,0,0|0,0,2]=4 1339 B14R2.29369 CN1C(=O)CCc2cc(F)ccc21 Amb26563282 [1,1,0,0,0,0|0,0,2]=4 1340 B14R2.29369 CN1C(=O)CCc2cc(I)ccc21 Amb28128648 [1,1,0,0,0,0|0,0,2]=4 1341 B14R2.29369 CN1C(=O)CCc2cc(N)ccc21 Amb9305789 [1,1,0,0,0,0|0,0,2]=4 1342 B14R2.29369 CN1C(=O)CCc2cc(O)ccc21 Amb18243684 [1,1,0,0,0,0|0,0,2]=4 1343 B14R2.29369 CN1C(=O)CCc2cc(S)ccc21 Amb26549528 [1,1,0,0,0,0|0,0,2]=4 1344 B14R2.29369 CN1C(=O)CNc2cc(Cl)ccc21 Amb22494793 [1,1,0,0,0,0|1,0,1]=4 1345 B14R2.29369 CN1C(=O)COc2cc(Br)ccc21 Amb17572942 [1,1,0,0,0,0|1,0,1]=4 1346 B14R2.29369 CN1C(=O)COc2cc(Cl)ccc21 Amb22586296 [1,1,0,0,0,0|1,0,1]=4 1347 B14R2.29369 CN1C(=O)COc2cc(F)ccc21 Amb28316725 [1,1,0,0,0,0|1,0,1]=4 1348 B14R2.29369 CN1C(=O)COc2cc(I)ccc21 Amb28044479 [1,1,0,0,0,0|1,0,1]=4 1349 B14R2.29369 CN1C(=O)COc2cc(N)ccc21 Amb18602707 [1,1,0,0,0,0|1,0,1]=4 1350 B14R2.29369 CN1C(=O)COc2cc(N)ccc21 Amb6384208 [1,1,0,0,0,0|1,0,1]=4 1351 B14R2.29369 CN1C(=O)COc2cc(O)ccc21 Amb17217740 [1,1,0,0,0,0|1,0,1]=4 1352 B14R2.29369 CN1C(=O)CSc2cc(F)ccc21 Amb2444880 [1,1,0,0,0,0|1,0,1]=4 1353 B14R2.29369 CN1C(=O)NCc2cc(Br)ccc21 Amb25239676 [1,1,0,0,0,0|1,0,1]=4 1354 B14R2.29369 CN1C(=O)NCc2cc(N)ccc21 Amb26582005 [1,1,0,0,0,0|1,0,1]=4 1355 B14R2.29369 Cc1ccc2c(c1)C=CC(=O)N2C Amb21994767 [1,1,0,0,0,0|0,0,0]=2 1356 B14R2.29369 Cc1ccc2c(c1)C=CC(=O)N2O Amb27954617 [1,1,0,0,0,0|1,0,0]=3 1357 B14R2.29369 Cc1ccc2c(c1)CCC(=O)N2C Amb27961256 [1,1,0,0,0,0|0,0,2]=4 1358 B14R2.29369 Cc1ccc2c(c1)COC(=O)N2C Amb25089316 [1,1,0,0,0,0|1,0,1]=4 1359 B14R2.29369 Cc1ccc2c(c1)NCC(=O)N2C Amb27790184 [1,1,0,0,0,0|1,0,1]=4 1360 B14R2.29369 Cc1ccc2c(c1)OCC(=O)N2C Amb26561492 [1,1,0,0,0,0|1,0,1]=4 1361 B14R2.29369 Cc1ccc2cc(F)ccc2[n+]1C Amb2728008 [1,1,0,0,0,0|1,0,1]=4 1362 B14R2.29369 O=C1C=Cc2cc(Br)ccc2C1=O Amb1783962 [1,1,0,0,0,0|2,0,0]=4 1363 B14R2.29369 O=C1C=Cc2cc(O)ccc2C1=O Amb17594374 [1,1,0,0,0,0|2,0,0]=4 1364 B14R2.1019 CCC1=CC(=S)c2ccccc2N1 Amb28041388 [1,1,0,0,0,0|1,1,0]=4 1365 B14R2.1019 CCc1cc(O)c2ccccc2n1 Amb22410671 [1,1,0,0,0,0|1,0,1]=4 1366 B14R2.1019 COc1cc(O)c2ccccc2c1 Amb18127199 [1,1,0,0,0,0|1,0,1]=4 1367 B14R2.1019 CSC1=CC(=O)c2ccccc2N1 Amb27224827 [1,1,0,0,0,0|0,1,1]=4 1368 B14R2.1019 Cc1cc(C=O)cc2ccccc12 Amb18126680 [1,1,0,0,0,0|2,0,0]=4 1369 B14R2.1019 N#CC1=CC(=O)c2ccccc2N1 Amb18547572 [1,1,0,0,0,0|1,0,1]=4 1370 B14R2.1019 N#Cc1cc(O)c2ccccc2c1 Amb25065212 [1,1,0,0,0,0|2,0,0]=4 1371 B14R2.1019 NCC1=CC(=O)c2ccccc2N1 Amb18252218 [1,1,0,0,0,0|1,0,1]=4 1372 B14R2.1019 NCc1cc(O)c2ccccc2c1 Amb25923927 [1,1,0,0,0,0|2,0,0]=4 1373 B14R2.1019 NCc1cc(O)c2ccccc2n1 Amb32660495 [1,1,0,0,0,0|1,0,1]=4 1374 B14R2.1019 NNC1=CC(=O)c2ccccc2N1 Amb28457258 [1,1,0,0,0,0|1,0,1]=4 1375 B14R2.1019 O=C1C=C(CCl)Nc2ccccc21 Amb19516708 [1,1,0,0,0,0|1,0,1]=4 1376 B14R2.1019 O=C1C=C(CO)Nc2ccccc21 Amb22372303 [1,1,0,0,0,0|0,0,2]=4 1377 B14R2.1019 O=CC1=CC(=O)c2ccccc2O1 Amb18127147 [1,1,0,0,0,0|1,0,1]=4 1378 B14R2.1019 O=CC1=CC(=O)c2ccccc2S1 Amb18129854 [1,1,0,0,0,0|1,0,1]=4 1379 B14R2.1019 O=Cc1cc(Br)c2ccccc2c1 Amb27827913 [1,1,0,0,0,0|2,0,0]=4 1380 B14R2.1019 O=Cc1cc(Cl)c2ccccc2c1 Amb25279349 [1,1,0,0,0,0|2,0,0]=4 1381 B14R2.1019 O=Cc1cc(F)c2ccccc2c1 Amb28127643 [1,1,0,0,0,0|2,0,0]=4 1382 B14R2.1019 O=Cc1cc(F)c2ccccc2n1 Amb28242910 [1,1,0,0,0,0|1,0,1]=4 1383 B14R2.1019 O=Cc1cc(I)c2ccccc2c1 Amb25865357 [1,1,0,0,0,0|2,0,0]=4 1384 B14R2.1019 O=Cc1cc(O)c2ccccc2c1 Amb27267901 [1,1,0,0,0,0|1,0,0]=3 1385 B14R2.1019 O=Cc1cc(O)c2ccccc2n1 Amb2797662 [1,1,0,0,0,0|0,0,1]=3 1386 B14R2.1019 O=Cc1cc(O)c2cccnc2c1 Amb25983130 [1,1,0,0,0,0|2,0,0]=4 1387 B14R2.1019 O=Cc1cc(O)c2ncccc2c1 Amb18127017 [1,1,0,0,0,0|2,0,0]=4 1388 B14R2.1019 OCc1cc(O)c2ccccc2c1 Amb23570400 [1,1,0,0,0,0|1,0,1]=4 1389 B14R2.1019 Oc1cc(CBr)cc2ccccc12 Amb26988702 [1,1,0,0,0,0|2,0,0]=4 1390 B14R2.1019 Oc1cc(CCl)cc2ccccc12 Amb27658821 [1,1,0,0,0,0|2,0,0]=4 1391 B14R2.1146 C#CC1=CC(=O)Oc2ccccc21 Amb23598950 [1,1,0,0,0,0|2,0,0]=4 1392 B14R2.1146 C=CC1=CC(=O)Oc2ccccc21 Amb27877602 [1,1,0,0,0,0|2,0,0]=4 1393 B14R2.1146 CCC1=CC(=O)Oc2ccccc21 Amb27665848 [1,1,0,0,0,0|2,0,0]=4 1394 B14R2.1146 CNC1=CC(=O)Oc2ccccc21 Amb21948594 [1,1,0,0,0,0|2,0,0]=4 1395 B14R2.1146 COC1=CC(=O)Nc2ccccc21 Amb21856838 [1,1,0,0,0,0|0,0,0]=2 1396 B14R2.1146 COC1=CC(=O)Oc2ccccc21 Amb18511495 [1,1,0,0,0,0|1,0,0]=3 1397 B14R2.1146 COC1=CC(=S)Nc2ccccc21 Amb27872221 [1,1,0,0,0,0|0,1,0]=3 1398 B14R2.1146 COC1OC(=O)Nc2ccccc21 Amb27607847 [1,1,0,0,0,0|1,0,1]=4 1399 B14R2.1146 COc1cc(Br)cc2ccccc12 Amb24520830 [1,1,0,0,0,0|2,0,0]=4 1400 B14R2.1146 COc1cc(Br)nc2ccccc12 Amb22500805 [1,1,0,0,0,0|1,0,1]=4 1401 B14R2.1146 COc1cc(C)cc2ccccc12 Amb28196256 [1,1,0,0,0,0|2,0,0]=4 1402 B14R2.1146 COc1cc(Cl)cc2ccccc12 Amb28243565 [1,1,0,0,0,0|2,0,0]=4 1403 B14R2.1146 COc1cc(Cl)nc2ccccc12 Amb22500806 [1,1,0,0,0,0|1,0,1]=4 1404 B14R2.1146 COc1cc(F)cc2ccccc12 Amb26021534 [1,1,0,0,0,0|2,0,0]=4 1405 B14R2.1146 COc1cc(I)cc2ccccc12 Amb27955521 [1,1,0,0,0,0|2,0,0]=4 1406 B14R2.1146 COc1cc(N)cc2ccccc12 Amb10603793 [1,1,0,0,0,0|2,0,0]=4 1407 B14R2.1146 COc1cc(N)cc2ccccc12 Amb33098545 [1,1,0,0,0,0|2,0,0]=4 1408 B14R2.1146 COc1cc(N)nc2ccccc12 Amb18127230 [1,1,0,0,0,0|1,0,1]=4 1409 B14R2.1146 COc1cc(O)cc2ccccc12 Amb2721334 [1,1,0,0,0,0|1,0,1]=4 1410 B14R2.1146 CSC1=CC(=O)Nc2ccccc21 Amb27983341 [1,1,0,0,0,0|0,1,0]=3 1411 B14R2.1146 Cc1cc(CO)c2ccccc2c1 Amb27242418 [1,1,0,0,0,0|2,0,0]=4 1412 B14R2.1146 Cc1cc(CO)c2ccccc2n1 Amb9004310 [1,1,0,0,0,0|1,0,1]=4 1413 B14R2.1146 N#CC1=CC(=O)Nc2ccccc21 Amb18126659 [1,1,0,0,0,0|1,0,0]=3 1414 B14R2.1146 NCC1=CC(=O)Nc2ccccc21 Amb19361592 [1,1,0,0,0,0|1,0,0]=3 1415 B14R2.1146 NCC1=CC(=O)Oc2ccccc21 Amb18560585 [1,1,0,0,0,0|2,0,0]=4 1416 B14R2.1146 NNC1=CC(=O)Nc2ccncc21 Amb27473247 [1,1,0,0,0,0|2,0,0]=4 1417 B14R2.1146 NNC1=CC(=O)Oc2ccccc21 Amb19116123 [1,1,0,0,0,0|2,0,0]=4 1418 B14R2.1146 Nc1cc(CO)c2ccccc2n1 Amb20248865 [1,1,0,0,0,0|1,0,1]=4 1419 B14R2.1146 O=C1C=C(CBr)c2ccccc2N1 Amb18015278 [1,1,0,0,0,0|1,0,0]=3 1420 B14R2.1146 O=C1C=C(CS)c2ccccc2N1 Amb27393052 [1,1,0,0,0,0|0,1,0]=3 1421 B14R2.1146 O=C1CC(CO)c2ccccc2N1 Amb17138809 [1,1,0,0,0,0|0,0,2]=4 1422 B14R2.1146 O=C1C\C(=N\O)c2ccccc2N1 Amb27273484 [1,1,0,0,0,0|0,0,1]=3 1423 B14R2.1146 O=C1Cc2ccccc2C(NO)=N1 Amb26513358 [1,1,0,0,0,0|2,0,0]=4 1424 B14R2.1146 O=C1Nc2ccccc2C(CO)N1 Amb27482106 [1,1,0,0,0,0|1,0,1]=4 1425 B14R2.1146 O=CC1=CC(=O)Nc2ccccc21 Amb24749077 [1,1,0,0,0,0|0,0,1]=3 1426 B14R2.1146 O=CC1=CC(=O)Oc2ccccc21 Amb18127145 [1,1,0,0,0,0|1,0,1]=4 1427 B14R2.1146 OCc1cc(Br)nc2ccccc12 Amb20248851 [1,1,0,0,0,0|1,0,1]=4 1428 B14R2.1146 OCc1cc(Cl)cc2ccccc12 Amb25123973 [1,1,0,0,0,0|2,0,0]=4 1429 B14R2.1146 OCc1cc(Cl)nc2ccccc12 Amb23400037 [1,1,0,0,0,0|1,0,1]=4 1430 B14R2.1146 OCc1cc(F)cc2ccccc12 Amb28243494 [1,1,0,0,0,0|2,0,0]=4 1431 B14R2.1146 OCc1cc(I)cc2ccccc12 Amb25737695 [1,1,0,0,0,0|2,0,0]=4 1432 B14R2.1146 OCc1cc(O)cc2ccccc12 Amb28047509 [1,1,0,0,0,0|1,0,1]=4 1433 B14R2.1146 OCc1cc(O)nc2ccccc12 Amb26859574 [1,1,0,0,0,0|0,0,2]=4 1434 B14R2.8045 CC1=CC(=O)Nc2c(Br)cccc21 Amb22522960 [1,1,0,0,0,0|1,0,0]=3 1435 B14R2.8045 CC1=CC(=O)Nc2c(C)cccc21 Amb19789098 [1,1,0,0,0,0|1,0,0]=3 1436 B14R2.8045 CC1=CC(=O)Nc2c(I)cccc21 Amb29857465 [1,1,0,0,0,0|1,0,0]=3 1437 B14R2.8045 CC1=CC(=O)Nc2c(O)cccc21 Amb18127367 [1,1,0,0,0,0|1,0,0]=3 1438 B14R2.8045 CC1=CC(=O)c2cccc(C)c2N1 Amb18178053 [1,1,0,0,0,0|1,0,1]=4 1439 B14R2.8045 CC1=CC(=O)c2cccc(Cl)c2N1 Amb19079891 [1,1,0,0,0,0|1,0,1]=4 1440 B14R2.8045 CC1=CC(=O)c2cccc(F)c2N1 Amb18178344 [1,1,0,0,0,0|1,0,1]=4 1441 B14R2.8045 CC1=CC(=S)Nc2c(Br)cccc21 Amb18540325 [1,1,0,0,0,0|1,1,0]=4 1442 B14R2.8045 CC1=CC(=S)Nc2c(C)cccc21 Amb18372526 [1,1,0,0,0,0|1,1,0]=4 1443 B14R2.8045 CC1=CC(=S)Nc2c(Cl)cccc21 Amb18540324 [1,1,0,0,0,0|1,1,0]=4 1444 B14R2.8045 CC1=CC(=S)Nc2c(F)cccc21 Amb18540326 [1,1,0,0,0,0|1,1,0]=4 1445 B14R2.8045 CC1=NC(=O)Nc2c(C)cccc21 Amb27793546 [1,1,0,0,0,0|2,0,0]=4 1446 B14R2.8045 CC1=NC(=O)Nc2c(O)cccc21 Amb18127611 [1,1,0,0,0,0|2,0,0]=4 1447 B14R2.8045 Cc1cc(O)c2cccc(Br)c2n1 Amb1778627 [1,1,0,0,0,0|1,0,1]=4 1448 B14R2.8045 Cc1cc(O)c2cccc(C)c2n1 Amb1099190 [1,1,0,0,0,0|1,0,1]=4 1449 B14R2.8045 Cc1cc(O)c2cccc(Cl)c2n1 Amb1199154 [1,1,0,0,0,0|1,0,1]=4 1450 B14R2.8045 Cc1cc(O)c2cccc(F)c2n1 Amb1994266 [1,1,0,0,0,0|1,0,1]=4 1451 B14R2.8045 Cc1cc(O)c2cccc(O)c2n1 Amb1283841 [1,1,0,0,0,0|1,0,1]=4 1452 B14R2.8045 Cc1cccc2c(O)cc(N)nc12 Amb26549784 [1,1,0,0,0,0|1,0,1]=4 1453 B14R2.8045 Cc1cccc2c1NC(=O)C=C2O Amb19517153 [1,1,0,0,0,0|0,0,0]=2 1454 B14R2.8045 Cc1cccc2c1NC(=O)C=C2S Amb28128471 [1,1,0,0,0,0|0,1,0]=3 1455 B14R2.8045 Cc1cccc2c1NC(=O)CC2=O Amb27985627 [1,1,0,0,0,0|0,0,2]=4 1456 B14R2.8045 Cc1cccc2c1NC(=O)N=C2N Amb26014451 [1,1,0,0,0,0|2,0,0]=4 1457 B14R2.8045 Cc1cccc2c1NC(=O)NC2=O Amb20243383 [1,1,0,0,0,0|1,0,1]=4 1458 B14R2.8045 Cc1cccc2c1NC(=O)OC2=O Amb18061619 [1,1,0,0,0,0|1,0,1]=4 1459 B14R2.8045 Cc1cccc2c1NC(=S)C=C2N Amb25691543 [1,1,0,0,0,0|1,1,0]=4 1460 B14R2.8045 Cc1cccc2c1OC(=O)C=C2O Amb19667408 [1,1,0,0,0,0|1,0,0]=3 1461 B14R2.8045 Nc1cc(O)c2cccc(Cl)c2n1 Amb28137740 [1,1,0,0,0,0|1,0,1]=4 1462 B14R2.8045 Nc1cccc2c1NC(=O)OC2=O Amb27415542 [1,1,0,0,0,0|1,0,1]=4 1463 B14R2.8045 O=C1C=C(O)c2cccc(Br)c2N1 Amb23571494 [1,1,0,0,0,0|0,0,0]=2 1464 B14R2.8045 O=C1C=C(O)c2cccc(F)c2N1 Amb24662699 [1,1,0,0,0,0|0,0,0]=2 1465 B14R2.8045 O=C1C=C(O)c2cccc(F)c2O1 Amb26481822 [1,1,0,0,0,0|1,0,0]=3 1466 B14R2.8045 O=C1C=C(O)c2cccc(I)c2N1 Amb28368282 [1,1,0,0,0,0|0,0,0]=2 1467 B14R2.8045 O=C1C=C(O)c2cccc(O)c2N1 Amb18127814 [1,1,0,0,0,0|0,0,0]=2 1468 B14R2.8045 O=C1C=C(O)c2cccc(O)c2O1 Amb18128038 [1,1,0,0,0,0|1,0,0]=3 1469 B14R2.8045 O=C1CC(=O)c2cccc(Br)c2N1 Amb26316742 [1,1,0,0,0,0|0,0,2]=4 1470 B14R2.8045 O=C1CC(=O)c2cccc(Cl)c2N1 Amb24366738 [1,1,0,0,0,0|0,0,2]=4 1471 B14R2.8045 O=C1CC(=O)c2cccc(I)c2N1 Amb33989424 [1,1,0,0,0,0|0,0,2]=4 1472 B14R2.8045 O=C1NC(=O)c2cccc(Br)c2N1 Amb20243334 [1,1,0,0,0,0|1,0,1]=4 1473 B14R2.8045 O=C1NC(=O)c2cccc(F)c2N1 Amb19958576 [1,1,0,0,0,0|1,0,1]=4 1474 B14R2.8045 O=C1NC(=O)c2cccc(I)c2N1 Amb19958580 [1,1,0,0,0,0|1,0,1]=4 1475 B14R2.8045 O=C1NC(=O)c2cccc(O)c2N1 Amb28323179 [1,1,0,0,0,0|1,0,1]=4 1476 B14R2.8045 O=C1Nc2c(Br)cccc2C(=O)O1 Amb19888498 [1,1,0,0,0,0|1,0,1]=4 1477 B14R2.8045 O=C1Nc2c(Cl)cccc2C(=O)O1 Amb19815980 [1,1,0,0,0,0|1,0,1]=4 1478 B14R2.8045 O=C1Nc2c(F)cccc2C(=O)O1 Amb19888390 [1,1,0,0,0,0|1,0,1]=4 1479 B14R2.8045 O=C1Nc2c(I)cccc2C(=O)O1 Amb31156115 [1,1,0,0,0,0|1,0,1]=4 1480 B14R2.8045 O=C1Nc2c(O)cccc2C(=O)O1 Amb28364288 [1,1,0,0,0,0|1,0,1]=4 1481 B14R2.8045 OC1=NC(=S)Nc2c(O)cccc21 Amb28204052 [1,1,0,0,0,0|1,1,0]=4 1482 B14R2.8045 Oc1cc(O)c2cccc(Cl)c2n1 Amb23449371 [1,1,0,0,0,0|0,0,2]=4 1483 B14R2.8235 CC1=CC(=O)Nc2ccc(Br)cc21 Amb19517145 [1,1,0,0,0,0|1,0,0]=3 1484 B14R2.8235 CC1=CC(=O)Nc2ccc(C)cc21 Amb19768113 [1,1,0,0,0,0|1,0,0]=3 1485 B14R2.8235 CC1=CC(=O)Nc2ccc(Cl)cc21 Amb18372520 [1,1,0,0,0,0|1,0,0]=3 1486 B14R2.8235 CC1=CC(=O)Nc2ccc(N)cc21 Amb19655547 [1,1,0,0,0,0|1,0,0]=3 1487 B14R2.8235 CC1=CC(=O)Nc2ccc(N)nc21 Amb27400288 [1,1,0,0,0,0|2,0,0]=4 1488 B14R2.8235 CC1=CC(=O)Nc2ncc(Br)cc21 Amb27224605 [1,1,0,0,0,0|2,0,0]=4 1489 B14R2.8235 CC1=CC(=O)Oc2ccc(Br)cc21 Amb26855810 [1,1,0,0,0,0|2,0,0]=4 1490 B14R2.8235 CC1=CC(=O)Oc2ccc(C)cc21 Amb19748166 [1,1,0,0,0,0|2,0,0]=4 1491 B14R2.8235 CC1=CC(=O)Oc2ccc(Cl)cc21 Amb26573682 [1,1,0,0,0,0|2,0,0]=4 1492 B14R2.8235 CC1=CC(=O)c2cc(Br)ccc2N1 Amb18368792 [1,1,0,0,0,0|1,0,1]=4 1493 B14R2.8235 CC1=CC(=O)c2cc(C)ccc2N1 Amb18178052 [1,1,0,0,0,0|1,0,1]=4 1494 B14R2.8235 CC1=CC(=O)c2cc(Cl)ccc2N1 Amb18317783 [1,1,0,0,0,0|1,0,1]=4 1495 B14R2.8235 CC1=CC(=O)c2cc(F)ccc2N1 Amb18184133 [1,1,0,0,0,0|1,0,1]=4 1496 B14R2.8235 CC1=CC(=O)c2cc([NH3+])ccc2N1 Amb22565389 [1,1,0,0,0,0|1,0,1]=4 1497 B14R2.8235 CC1=CC(=S)Nc2ccc(Br)cc21 Amb18038016 [1,1,0,0,0,0|1,1,0]=4 1498 B14R2.8235 CC1=CC(=S)Nc2ccc(C)cc21 Amb18540320 [1,1,0,0,0,0|1,1,0]=4 1499 B14R2.8235 CC1=CC(=S)Nc2ccc(Cl)cc21 Amb18037995 [1,1,0,0,0,0|1,1,0]=4 1500 B14R2.8235 CC1=CC(=S)Nc2ccc(F)cc21 Amb18037987 [1,1,0,0,0,0|1,1,0]=4 1501 B14R2.8235 CC1=NC(=O)Nc2ccc(Cl)cc21 Amb27830051 [1,1,0,0,0,0|2,0,0]=4 1502 B14R2.8235 Cc1cc(=O)oc2ccc(O)cc12 Amb1041165 [1,1,0,0,0,0|2,0,0]=4 1503 B14R2.8235 Cc1cc(O)c2cc(Br)ccc2c1 Amb27841023 [1,1,0,0,0,0|2,0,0]=4 1504 B14R2.8235 Cc1cc(O)c2cc(Br)ccc2n1 Amb1395387 [1,1,0,0,0,0|1,0,1]=4 1505 B14R2.8235 Cc1cc(O)c2cc(Cl)ccc2n1 Amb1269355 [1,1,0,0,0,0|1,0,1]=4 1506 B14R2.8235 Cc1cc(O)c2cc(F)ccc2n1 Amb1395674 [1,1,0,0,0,0|1,0,1]=4 1507 B14R2.8235 Cc1cc(O)c2cc(N)ccc2n1 Amb534619 [1,1,0,0,0,0|1,0,1]=4 1508 B14R2.8235 Cc1ccc2c(c1)C(=O)C=C(O)N2 Amb22492451 [1,1,0,0,0,0|0,0,2]=4 1509 B14R2.8235 Cc1ccc2c(c1)C(=O)CC(=O)N2 Amb22490755 [1,1,0,0,0,0|0,0,2]=4 1510 B14R2.8235 Cc1ccc2c(c1)C(=O)NC(=O)N2 Amb19667593 [1,1,0,0,0,0|1,0,1]=4 1511 B14R2.8235 Cc1ccc2c(c1)C(=O)OC(=O)N2 Amb19373930 [1,1,0,0,0,0|1,0,1]=4 1512 B14R2.8235 Cc1ccc2c(c1)C(Cl)=CC(=O)O2 Amb18525204 [1,1,0,0,0,0|2,0,0]=4 1513 B14R2.8235 Cc1ccc2c(c1)C(N)=NC(=O)N2 Amb25139575 [1,1,0,0,0,0|2,0,0]=4 1514 B14R2.8235 Cc1ccc2c(c1)C(O)=CC(=O)N2 Amb21948621 [1,1,0,0,0,0|0,0,0]=2 1515 B14R2.8235 Cc1ccc2c(c1)C(O)=CC(=O)O2 Amb17992884 [1,1,0,0,0,0|1,0,0]=3 1516 B14R2.8235 Cc1ccc2c(c1)[N+]([O-])=CC(=O)N2 Amb24604603 [1,1,0,0,0,0|1,0,1]=4 1517 B14R2.8235 Cc1ccc2nc(C)cc(O)c2c1 Amb1094118 [1,1,0,0,0,0|1,0,1]=4 1518 B14R2.8235 Cc1ccc2nc(N)cc(O)c2c1 Amb18127238 [1,1,0,0,0,0|1,0,1]=4 1519 B14R2.8235 Cc1ccc2nc(O)cc(O)c2c1 Amb2924054 [1,1,0,0,0,0|0,0,2]=4 1520 B14R2.8235 NC1=CC(=O)Nc2ncc(Br)cc21 Amb27601012 [1,1,0,0,0,0|2,0,0]=4 1521 B14R2.8235 NC1=NC(=O)Nc2ccc(Br)cc21 Amb22263284 [1,1,0,0,0,0|2,0,0]=4 1522 B14R2.8235 Nc1cc(O)c2cc(Br)ccc2n1 Amb9677764 [1,1,0,0,0,0|1,0,1]=4 1523 B14R2.8235 Nc1cc(O)c2cc(O)ccc2n1 Amb25759686 [1,1,0,0,0,0|1,0,1]=4 1524 B14R2.8235 Nc1ccc2c(c1)C(=O)NC(=O)N2 Amb18943709 [1,1,0,0,0,0|1,0,1]=4 1525 B14R2.8235 Nc1ccc2c(c1)C(=O)OC(=O)N2 Amb18538506 [1,1,0,0,0,0|1,0,1]=4 1526 B14R2.8235 Nc1ccc2c(c1)C(O)=CC(=O)N2 Amb22372296 [1,1,0,0,0,0|0,0,0]=2 1527 B14R2.8235 O=C1C=C(O)c2cc(Br)ccc2N1 Amb19958762 [1,1,0,0,0,0|0,0,0]=2 1528 B14R2.8235 O=C1C=C(O)c2cc(Br)ccc2O1 Amb19665431 [1,1,0,0,0,0|1,0,0]=3 1529 B14R2.8235 O=C1C=C(O)c2cc(Cl)ccc2N1 Amb22489948 [1,1,0,0,0,0|0,0,0]=2 1530 B14R2.8235 O=C1C=C(O)c2cc(Cl)ccc2O1 Amb19665435 [1,1,0,0,0,0|1,0,0]=3 1531 B14R2.8235 O=C1C=C(O)c2cc(F)ccc2O1 Amb19895520 [1,1,0,0,0,0|1,0,0]=3 1532 B14R2.8235 O=C1C=C(O)c2cc(I)ccc2N1 Amb24427559 [1,1,0,0,0,0|0,0,0]=2 1533 B14R2.8235 O=C1C=C(O)c2cc(O)ccc2N1 Amb32455688 [1,1,0,0,0,0|0,0,0]=2 1534 B14R2.8235 O=C1C=C(O)c2cc(O)ccc2O1 Amb18648094 [1,1,0,0,0,0|1,0,0]=3 1535 B14R2.8235 O=C1CC(=O)c2cc(Br)ccc2N1 Amb34146773 [1,1,0,0,0,0|0,0,2]=4 1536 B14R2.8235 O=C1CC(=O)c2cc(Cl)ccc2N1 Amb28342393 [1,1,0,0,0,0|0,0,2]=4 1537 B14R2.8235 O=C1CC(=O)c2cc(F)ccc2N1 Amb34155064 [1,1,0,0,0,0|0,0,2]=4 1538 B14R2.8235 O=C1CC(=O)c2cc(I)ccc2N1 Amb33989599 [1,1,0,0,0,0|0,0,2]=4 1539 B14R2.8235 O=C1NC(=O)c2cc(Br)ccc2N1 Amb19894628 [1,1,0,0,0,0|1,0,1]=4 1540 B14R2.8235 O=C1NC(=O)c2cc(Cl)ccc2N1 Amb19894625 [1,1,0,0,0,0|1,0,1]=4 1541 B14R2.8235 O=C1NC(=O)c2cc(F)ccc2N1 Amb20241387 [1,1,0,0,0,0|1,0,1]=4 1542 B14R2.8235 O=C1NC(=O)c2cc(I)ccc2N1 Amb20243320 [1,1,0,0,0,0|1,0,1]=4 1543 B14R2.8235 O=C1NC(=O)c2cc(O)ccc2N1 Amb24489150 [1,1,0,0,0,0|1,0,1]=4 1544 B14R2.8235 O=C1Nc2ccc(Br)cc2C(=O)O1 Amb18026188 [1,1,0,0,0,0|1,0,1]=4 1545 B14R2.8235 O=C1Nc2ccc(Cl)cc2C(=O)O1 Amb19748226 [1,1,0,0,0,0|1,0,1]=4 1546 B14R2.8235 O=C1Nc2ccc(F)cc2C(=O)O1 Amb19761701 [1,1,0,0,0,0|1,0,1]=4 1547 B14R2.8235 O=C1Nc2ccc(I)cc2C(=O)O1 Amb19650646 [1,1,0,0,0,0|1,0,1]=4 1548 B14R2.8235 O=C1Nc2ccc(O)cc2C(=O)O1 Amb19330379 [1,1,0,0,0,0|1,0,1]=4 1549 B14R2.8235 Oc1cc(O)c2cc(Br)ccc2n1 Amb22057661 [1,1,0,0,0,0|0,0,2]=4 1550 B14R2.8235 Oc1cc(O)c2cc(F)ccc2n1 Amb22496118 [1,1,0,0,0,0|0,0,2]=4 1551 B14R2.28480 CC1=CC(=O)Nc2cccc(O)c21 Amb22752591 [1,1,0,0,0,0|1,0,0]=3 1552 B14R2.28480 CC1=CC(=O)Nc2nccc(Cl)c21 Amb28243643 [1,1,0,0,0,0|2,0,0]=4 1553 B14R2.28480 CC1=CC(=O)Oc2cccc(F)c21 Amb28400691 [1,1,0,0,0,0|2,0,0]=4 1554 B14R2.28480 CC1=CC(=O)Oc2cccc(O)c21 Amb25707483 [1,1,0,0,0,0|2,0,0]=4 1555 B14R2.28480 CC1=CC(=O)c2c(C)cccc2N1 Amb26916505 [1,1,0,0,0,0|1,0,1]=4 1556 B14R2.28480 Cc1cccc2c1C(=O)OC(=O)N2 Amb22059420 [1,1,0,0,0,0|1,0,1]=4 1557 B14R2.28480 Cc1cccc2c1C(N)=CC(=O)N2 Amb28066622 [1,1,0,0,0,0|1,0,0]=3 1558 B14R2.28480 Cc1cccc2c1C(N)=NC(=O)N2 Amb24558311 [1,1,0,0,0,0|2,0,0]=4 1559 B14R2.28480 Cc1cccc2nc(N)cc(O)c12 Amb27165221 [1,1,0,0,0,0|1,0,1]=4 1560 B14R2.28480 Cc1cccc2nc(O)cc(O)c12 Amb23401106 [1,1,0,0,0,0|0,0,2]=4 1561 B14R2.28480 Cc1ccnc2c1C(O)=CC(=O)N2 Amb26480737 [1,1,0,0,0,0|1,0,0]=3 1562 B14R2.28480 NC1=NC(=O)Nc2cccc(O)c21 Amb26004705 [1,1,0,0,0,0|2,0,0]=4 1563 B14R2.28480 Nc1cccc2c1C(=O)NC(=O)N2 Amb26981101 [1,1,0,0,0,0|1,0,1]=4 1564 B14R2.28480 Nc1cccc2c1C(=O)OC(=O)N2 Amb25702514 [1,1,0,0,0,0|1,0,1]=4 1565 B14R2.28480 O=C1C=C(O)c2c(Br)cccc2N1 Amb27230446 [1,1,0,0,0,0|0,0,0]=2 1566 B14R2.28480 O=C1C=C(O)c2c(Cl)cccc2O1 Amb22481193 [1,1,0,0,0,0|1,0,0]=3 1567 B14R2.28480 O=C1C=C(O)c2c(F)cccc2N1 Amb25738208 [1,1,0,0,0,0|0,0,0]=2 1568 B14R2.28480 O=C1C=C(O)c2c(F)cccc2O1 Amb25761169 [1,1,0,0,0,0|1,0,0]=3 1569 B14R2.28480 O=C1C=C(O)c2c(O)cccc2O1 Amb18128041 [1,1,0,0,0,0|1,0,0]=3 1570 B14R2.28480 O=C1CC(=O)c2c(Br)cccc2N1 Amb8392946 [1,1,0,0,0,0|0,0,2]=4 1571 B14R2.28480 O=C1NC(=O)c2c(Br)cccc2N1 Amb19958571 [1,1,0,0,0,0|1,0,1]=4 1572 B14R2.28480 O=C1NC(=O)c2c(Cl)cccc2N1 Amb20240939 [1,1,0,0,0,0|1,0,1]=4 1573 B14R2.28480 O=C1NC(=O)c2c(F)cccc2N1 Amb20243331 [1,1,0,0,0,0|1,0,1]=4 1574 B14R2.28480 O=C1Nc2cccc(Br)c2C(=O)O1 Amb19984918 [1,1,0,0,0,0|1,0,1]=4 1575 B14R2.28480 O=C1Nc2cccc(Cl)c2C(=O)O1 Amb20247072 [1,1,0,0,0,0|1,0,1]=4 1576 B14R2.28480 O=C1Nc2cccc(F)c2C(=O)O1 Amb21926885 [1,1,0,0,0,0|1,0,1]=4 1577 B14R2.28480 O=C1Nc2cccc(I)c2C(=O)O1 Amb28135920 [1,1,0,0,0,0|1,0,1]=4 1578 B14R2.28480 O=C1Nc2cccc(O)c2C(=O)O1 Amb28398457 [1,1,0,0,0,0|1,0,1]=4 1579 B14R2.28480 Oc1cc(O)c2c(Cl)cccc2n1 Amb26577186 [1,1,0,0,0,0|0,0,2]=4 1580 B14R2.29365 CC1=C2C=CC(=N)C=C2NC(Cl)=C1 Amb27240623 [1,1,0,0,0,0|2,0,0]=4 1581 B14R2.29365 CC1=CC(=O)Nc2cc(Br)ccc21 Amb22039453 [1,1,0,0,0,0|1,0,0]=3 1582 B14R2.29365 CC1=CC(=O)Nc2cc(C)ccc21 Amb19514337 [1,1,0,0,0,0|1,0,0]=3 1583 B14R2.29365 CC1=CC(=O)Nc2cc(Cl)ccc21 Amb22000082 [1,1,0,0,0,0|1,0,0]=3 1584 B14R2.29365 CC1=CC(=O)Nc2cc(F)ccc21 Amb27766123 [1,1,0,0,0,0|1,0,0]=3 1585 B14R2.29365 CC1=CC(=O)Nc2cc(N)ccc21 Amb19131103 [1,1,0,0,0,0|1,0,0]=3 1586 B14R2.29365 CC1=CC(=O)Nc2cc(O)ccc21 Amb19816738 [1,1,0,0,0,0|1,0,0]=3 1587 B14R2.29365 CC1=CC(=O)Nc2nc(C)ccc21 Amb22753692 [1,1,0,0,0,0|2,0,0]=4 1588 B14R2.29365 CC1=CC(=O)Nc2nc(N)ccc21 Amb18127420 [1,1,0,0,0,0|2,0,0]=4 1589 B14R2.29365 CC1=CC(=O)Oc2cc(C)ccc21 Amb20670275 [1,1,0,0,0,0|2,0,0]=4 1590 B14R2.29365 CC1=CC(=O)Oc2cc(F)ccc21 Amb24077233 [1,1,0,0,0,0|2,0,0]=4 1591 B14R2.29365 CC1=CC(=O)Oc2cc(N)ccc21 Amb18197479 [1,1,0,0,0,0|2,0,0]=4 1592 B14R2.29365 CC1=CC(=O)Oc2cc(O)ccc21 Amb18012848 [1,1,0,0,0,0|2,0,0]=4 1593 B14R2.29365 CC1=CC(=O)Oc2cc(S)ccc21 Amb20662809 [1,1,0,0,0,0|2,0,0]=4 1594 B14R2.29365 CC1=CC(=O)Oc2cc([O-])ccc21 Amb22265072 [1,1,0,0,0,0|2,0,0]=4 1595 B14R2.29365 CC1=CC(=O)c2ccc(C)cc2N1 Amb20258515 [1,1,0,0,0,0|1,0,1]=4 1596 B14R2.29365 CC1=CC(=O)c2ccc(Cl)cc2N1 Amb20415295 [1,1,0,0,0,0|1,0,1]=4 1597 B14R2.29365 CC1=CC(=S)Nc2cc(Br)ccc21 Amb18012458 [1,1,0,0,0,0|1,1,0]=4 1598 B14R2.29365 CC1=CC(=S)c2ccc(Cl)cc2N1 Amb25799513 [1,1,0,0,0,0|1,1,0]=4 1599 B14R2.29365 Cc1cc(O)c2ccc(Br)cc2n1 Amb9134268 [1,1,0,0,0,0|1,0,1]=4 1600 B14R2.29365 Cc1cc(O)c2ccc(Cl)cc2n1 Amb1994304 [1,1,0,0,0,0|1,0,1]=4 1601 B14R2.29365 Cc1cc(O)c2ccc(F)cc2n1 Amb1994812 [1,1,0,0,0,0|1,0,1]=4 1602 B14R2.29365 Cc1cc(O)c2ccc(I)cc2n1 Amb27481201 [1,1,0,0,0,0|1,0,1]=4 1603 B14R2.29365 Cc1cc(O)c2ccc(O)cc2n1 Amb26063388 [1,1,0,0,0,0|1,0,1]=4 1604 B14R2.29365 Cc1ccc2c(O)cc(C)cc2c1 Amb27229147 [1,1,0,0,0,0|2,0,0]=4 1605 B14R2.29365 Cc1ccc2c(O)cc(N)nc2c1 Amb28129262 [1,1,0,0,0,0|1,0,1]=4 1606 B14R2.29365 Cc1ccc2c(c1)NC(=O)C=C2N Amb28189714 [1,1,0,0,0,0|1,0,0]=3 1607 B14R2.29365 Cc1ccc2c(c1)NC(=O)CC2=O Amb26880887 [1,1,0,0,0,0|0,0,2]=4 1608 B14R2.29365 Cc1ccc2c(c1)NC(=O)N=C2N Amb28240338 [1,1,0,0,0,0|2,0,0]=4 1609 B14R2.29365 Cc1ccc2c(c1)NC(=O)NC2=O Amb20243382 [1,1,0,0,0,0|1,0,1]=4 1610 B14R2.29365 Cc1ccc2c(c1)NC(=O)OC2=O Amb20247291 [1,1,0,0,0,0|1,0,1]=4 1611 B14R2.29365 Cc1ccc2c(c1)OC(=O)C=C2O Amb19894643 [1,1,0,0,0,0|1,0,0]=3 1612 B14R2.29365 Cc1ccc2c(n1)NC(=O)C=C2O Amb20660417 [1,1,0,0,0,0|1,0,0]=3 1613 B14R2.29365 NC1=NC(=O)Nc2cc(O)ccc21 Amb26043717 [1,1,0,0,0,0|2,0,0]=4 1614 B14R2.29365 Nc1cc(O)c2ccc(Cl)cc2n1 Amb27760393 [1,1,0,0,0,0|1,0,1]=4 1615 B14R2.29365 Nc1ccc2c(c1)NC(=O)NC2=O Amb19958566 [1,1,0,0,0,0|1,0,1]=4 1616 B14R2.29365 Nc1ccc2c(c1)NC(=O)OC2=O Amb18538507 [1,1,0,0,0,0|1,0,1]=4 1617 B14R2.29365 Nc1ccc2c(c1)OC(=O)C=C2Cl Amb27882696 [1,1,0,0,0,0|2,0,0]=4 1618 B14R2.29365 Nc1ccc2c(c1)OC(=O)C=C2O Amb27607156 [1,1,0,0,0,0|1,0,0]=3 1619 B14R2.29365 O=C1C=C(Cl)c2ccc(Cl)cc2O1 Amb21997875 [1,1,0,0,0,0|2,0,0]=4 1620 B14R2.29365 O=C1C=C(Cl)c2ccc(F)cc2N1 Amb25315323 [1,1,0,0,0,0|1,0,0]=3 1621 B14R2.29365 O=C1C=C(Cl)c2ccc(O)cc2O1 Amb26843969 [1,1,0,0,0,0|2,0,0]=4 1622 B14R2.29365 O=C1C=C(O)c2ccc(Br)cc2N1 Amb26352033 [1,1,0,0,0,0|0,0,0]=2 1623 B14R2.29365 O=C1C=C(O)c2ccc(Br)cc2O1 Amb24452712 [1,1,0,0,0,0|1,0,0]=3 1624 B14R2.29365 O=C1C=C(O)c2ccc(Cl)cc2O1 Amb22472325 [1,1,0,0,0,0|1,0,0]=3 1625 B14R2.29365 O=C1C=C(O)c2ccc(F)cc2N1 Amb26971018 [1,1,0,0,0,0|0,0,0]=2 1626 B14R2.29365 O=C1C=C(O)c2ccc(F)cc2O1 Amb24084296 [1,1,0,0,0,0|1,0,0]=3 1627 B14R2.29365 O=C1C=C(O)c2ccc(I)cc2N1 Amb26316274 [1,1,0,0,0,0|0,0,0]=2 1628 B14R2.29365 O=C1C=C(O)c2ccc(O)cc2N1 Amb27264761 [1,1,0,0,0,0|0,0,0]=2 1629 B14R2.29365 O=C1C=C(O)c2ccc(O)cc2O1 Amb18648095 [1,1,0,0,0,0|1,0,0]=3 1630 B14R2.29365 O=C1CC(=O)c2ccc(Br)cc2N1 Amb22495040 [1,1,0,0,0,0|0,0,2]=4 1631 B14R2.29365 O=C1CC(=O)c2ccc(F)cc2N1 Amb27494618 [1,1,0,0,0,0|0,0,2]=4 1632 B14R2.29365 O=C1CC(O)c2ccc(O)cc2N1 Amb28411694 [1,1,0,0,0,0|0,0,2]=4 1633 B14R2.29365 O=C1NC(=O)c2ccc(Br)cc2N1 Amb20243333 [1,1,0,0,0,0|1,0,1]=4 1634 B14R2.29365 O=C1NC(=O)c2ccc(Cl)cc2N1 Amb19667592 [1,1,0,0,0,0|1,0,1]=4 1635 B14R2.29365 O=C1NC(=O)c2ccc(F)cc2N1 Amb19958559 [1,1,0,0,0,0|1,0,1]=4 1636 B14R2.29365 O=C1NC(=O)c2ccc(I)cc2N1 Amb20243321 [1,1,0,0,0,0|1,0,1]=4 1637 B14R2.29365 O=C1Nc2cc(Br)ccc2C(=O)O1 Amb20241650 [1,1,0,0,0,0|1,0,1]=4 1638 B14R2.29365 O=C1Nc2cc(Cl)ccc2C(=O)O1 Amb19372879 [1,1,0,0,0,0|1,0,1]=4 1639 B14R2.29365 O=C1Nc2cc(F)ccc2C(=O)O1 Amb19372866 [1,1,0,0,0,0|1,0,1]=4 1640 B14R2.29365 O=C1Nc2cc(O)ccc2C(=O)O1 Amb26318684 [1,1,0,0,0,0|1,0,1]=4 1641 B14R2.29365 Oc1ccc2c(O)cc(O)cc2c1 Amb17594463 [1,1,0,0,0,0|1,0,1]=4 1642 B14R2.29496 CC1(C)C=C(O)c2ccccc2N1 Amb32663308 [1,1,0,0,0,0|1,0,1]=4 1643 B14R2.1131 BrCc1ccc(Br)c2ccccc12 Amb19868316 [1,1,0,0,0,0|2,0,0]=4 1644 B14R2.1131 BrCc1ccc(I)c2ccccc12 Amb27814183 [1,1,0,0,0,0|2,0,0]=4 1645 B14R2.1131 C#Cc1ccc(C)c2ccccc12 Amb26606207 [1,1,0,0,0,0|2,0,0]=4 1646 B14R2.1131 C=Cc1ccc(C)c2ccccc12 Amb33198553 [1,1,0,0,0,0|2,0,0]=4 1647 B14R2.1131 CCN1C=NC(=O)c2ccccc21 Amb22752701 [1,1,0,0,0,0|1,0,1]=4 1648 B14R2.1131 CCN1N=CC(=O)c2ccccc21 Amb24625808 [1,1,0,0,0,0|1,0,1]=4 1649 B14R2.1131 CC[n+]1ccc(C)c2ccccc21 Amb27632946 [1,1,0,0,0,0|1,0,1]=4 1650 B14R2.1131 CCc1ccc(Br)c2ccccc12 Amb25735789 [1,1,0,0,0,0|2,0,0]=4 1651 B14R2.1131 CCc1ccc(C)c2ccccc12 Amb24658690 [1,1,0,0,0,0|2,0,0]=4 1652 B14R2.1131 CCc1ccc(Cl)c2ccccc12 Amb27248935 [1,1,0,0,0,0|2,0,0]=4 1653 B14R2.1131 CCc1ccc(F)c2ccccc12 Amb25330873 [1,1,0,0,0,0|2,0,0]=4 1654 B14R2.1131 CCc1ccc(I)c2ccccc12 Amb25070676 [1,1,0,0,0,0|2,0,0]=4 1655 B14R2.1131 CCc1ccc(N)c2ccccc12 Amb23556445 [1,1,0,0,0,0|2,0,0]=4 1656 B14R2.1131 CCc1ccc(O)c2ccccc12 Amb28144208 [1,1,0,0,0,0|1,0,0]=3 1657 B14R2.1131 CCc1ccc(O)c2ncccc12 Amb18127054 [1,1,0,0,0,0|2,0,0]=4 1658 B14R2.1131 CN1CC\C(=N\O)c2ccccc21 Amb27592689 [1,1,0,0,0,0|0,0,2]=4 1659 B14R2.1131 CNc1ccc(Br)c2ccccc12 Amb18275340 [1,1,0,0,0,0|2,0,0]=4 1660 B14R2.1131 CNc1ccc(C)c2ccccc12 Amb18553385 [1,1,0,0,0,0|2,0,0]=4 1661 B14R2.1131 CNc1ccc(O)c2ccccc12 Amb18553406 [1,1,0,0,0,0|1,0,0]=3 1662 B14R2.1131 CON1N=CC(=O)c2ccccc21 Amb27256384 [1,1,0,0,0,0|1,0,1]=4 1663 B14R2.1131 COc1cc[n+]([O-])c2ccccc12 Amb27585491 [1,1,0,0,0,0|1,0,1]=4 1664 B14R2.1131 COc1ccc(Br)c2ccccc12 Amb7808606 [1,1,0,0,0,0|2,0,0]=4 1665 B14R2.1131 COc1ccc(C)c2ccccc12 Amb4020876 [1,1,0,0,0,0|1,0,0]=3 1666 B14R2.1131 COc1ccc(C)c2cccnc12 Amb2592641 [1,1,0,0,0,0|2,0,0]=4 1667 B14R2.1131 COc1ccc(C)c2cnccc12 Amb32670330 [1,1,0,0,0,0|2,0,0]=4 1668 B14R2.1131 COc1ccc(C)c2ncccc12 Amb23412262 [1,1,0,0,0,0|2,0,0]=4 1669 B14R2.1131 COc1ccc(Cl)c2ccccc12 Amb23402063 [1,1,0,0,0,0|2,0,0]=4 1670 B14R2.1131 COc1ccc(F)c2ccccc12 Amb28243365 [1,1,0,0,0,0|2,0,0]=4 1671 B14R2.1131 COc1ccc(I)c2ccccc12 Amb4009915 [1,1,0,0,0,0|2,0,0]=4 1672 B14R2.1131 COc1ccc(N)c2ccccc12 Amb19959322 [1,1,0,0,0,0|2,0,0]=4 1673 B14R2.1131 COc1ccc(N)c2ccccc12 Amb7173070 [1,1,0,0,0,0|2,0,0]=4 1674 B14R2.1131 COc1ccc(O)c2ccccc12 Amb3939556 [1,1,0,0,0,0|1,0,0]=3 1675 B14R2.1131 COc1ccc(O)c2cccnc12 Amb17202568 [1,1,0,0,0,0|2,0,0]=4 1676 B14R2.1131 COc1ccc(O)c2ncccc12 Amb22491509 [1,1,0,0,0,0|2,0,0]=4 1677 B14R2.1131 COc1ccc(S)c2ccccc12 Amb7808614 [1,1,0,0,0,0|1,1,0]=4 1678 B14R2.1131 COc1ncc(O)c2ccccc12 Amb27809074 [1,1,0,0,0,0|2,0,0]=4 1679 B14R2.1131 CSc1ccc(F)c2ccccc12 Amb2691988 [1,1,0,0,0,0|2,0,0]=4 1680 B14R2.1131 CSc1ccc(N)c2ccccc12 Amb27179306 [1,1,0,0,0,0|2,0,0]=4 1681 B14R2.1131 C[n+]1ccc(C#N)c2ccccc21 Amb4019307 [1,1,0,0,0,0|1,0,1]=4 1682 B14R2.1131 Cc1ccc(C#N)c2ccccc12 Amb2686592 [1,1,0,0,0,0|2,0,0]=4 1683 B14R2.1131 Cc1ccc(C=O)c2ccccc12 Amb2689532 [1,1,0,0,0,0|1,0,1]=4 1684 B14R2.1131 Cc1ccc(CBr)c2ccccc12 Amb23556464 [1,1,0,0,0,0|2,0,0]=4 1685 B14R2.1131 Cc1ccc(CCl)c2ccccc12 Amb2686219 [1,1,0,0,0,0|2,0,0]=4 1686 B14R2.1131 Cc1ccc(CN)c2ccccc12 Amb18553390 [1,1,0,0,0,0|2,0,0]=4 1687 B14R2.1131 Cc1ccc(CO)c2ccccc12 Amb4036247 [1,1,0,0,0,0|1,0,0]=3 1688 B14R2.1131 Cc1ccc(CO)c2cccnc12 Amb16186926 [1,1,0,0,0,0|2,0,0]=4 1689 B14R2.1131 Cc1ccc(CO)c2cnccc12 Amb18353007 [1,1,0,0,0,0|2,0,0]=4 1690 B14R2.1131 Cc1ccc(CO)c2ncccc12 Amb22498534 [1,1,0,0,0,0|2,0,0]=4 1691 B14R2.1131 Cc1ccc(CS)c2ccccc12 Amb33197781 [1,1,0,0,0,0|1,1,0]=4 1692 B14R2.1131 Cc1ccc(NN)c2ccccc12 Amb23580565 [1,1,0,0,0,0|2,0,0]=4 1693 B14R2.1131 Cc1ccc([Mg]Br)c2ccccc12 Amb22000530 [1,1,0,0,0,0|2,0,0]=4 1694 B14R2.1131 Cc1cnc(CO)c2ccccc12 Amb19104953 [1,1,0,0,0,0|2,0,0]=4 1695 B14R2.1131 Cc1cnc(CO)c2ccccc12 Amb32683318 [1,1,0,0,0,0|2,0,0]=4 1696 B14R2.1131 ClCc1ccc(Br)c2ccccc12 Amb28119177 [1,1,0,0,0,0|2,0,0]=4 1697 B14R2.1131 ClCc1ccc(Cl)c2ccccc12 Amb25075550 [1,1,0,0,0,0|2,0,0]=4 1698 B14R2.1131 ClCc1ccc(I)c2ccccc12 Amb25130259 [1,1,0,0,0,0|2,0,0]=4 1699 B14R2.1131 Clc1ccc(CBr)c2ccccc12 Amb25937162 [1,1,0,0,0,0|2,0,0]=4 1700 B14R2.1131 Fc1ccc(CBr)c2ccccc12 Amb23537909 [1,1,0,0,0,0|2,0,0]=4 1701 B14R2.1131 Fc1ccc(CCl)c2ccccc12 Amb2099566 [1,1,0,0,0,0|2,0,0]=4 1702 B14R2.1131 N#Cc1ccc(O)c2ccccc12 Amb18553403 [1,1,0,0,0,0|1,0,1]=4 1703 B14R2.1131 NCc1ccc(Br)c2ccccc12 Amb10975996 [1,1,0,0,0,0|2,0,0]=4 1704 B14R2.1131 NCc1ccc(Br)c2ccccc12 Amb23537354 [1,1,0,0,0,0|2,0,0]=4 1705 B14R2.1131 NCc1ccc(Cl)c2ccccc12 Amb18055451 [1,1,0,0,0,0|2,0,0]=4 1706 B14R2.1131 NCc1ccc(Cl)c2ccccc12 Amb32666502 [1,1,0,0,0,0|2,0,0]=4 1707 B14R2.1131 NCc1ccc(F)c2ccccc12 Amb22584199 [1,1,0,0,0,0|2,0,0]=4 1708 B14R2.1131 NCc1ccc(I)c2ccccc12 Amb24427761 [1,1,0,0,0,0|2,0,0]=4 1709 B14R2.1131 NCc1ccc(N)c2ccccc12 Amb25789521 [1,1,0,0,0,0|2,0,0]=4 1710 B14R2.1131 NCc1ccc(O)c2ccccc12 Amb18053776 [1,1,0,0,0,0|1,0,0]=3 1711 B14R2.1131 NCc1ccc(O)c2ccccc12 Amb32660911 [1,1,0,0,0,0|1,0,0]=3 1712 B14R2.1131 NCc1ccc(O)c2ncccc12 Amb23440939 [1,1,0,0,0,0|2,0,0]=4 1713 B14R2.1131 NCc1ccc(O)c2ncccc12 Amb24121233 [1,1,0,0,0,0|2,0,0]=4 1714 B14R2.1131 NCc1ccc(O)c2ncccc12 Amb2693237 [1,1,0,0,0,0|2,0,0]=4 1715 B14R2.1131 Nc1ccc(CBr)c2ccccc12 Amb24468889 [1,1,0,0,0,0|2,0,0]=4 1716 B14R2.1131 Nc1ccc(CCl)c2ccccc12 Amb27848526 [1,1,0,0,0,0|2,0,0]=4 1717 B14R2.1131 Nc1ccc(CO)c2ccccc12 Amb27597697 [1,1,0,0,0,0|2,0,0]=4 1718 B14R2.1131 O=Cc1ccc(O)c2ccccc12 Amb2688771 [1,1,0,0,0,0|1,0,1]=4 1719 B14R2.1131 O=Nc1ccc(O)c2ccccc12 Amb17594340 [1,1,0,0,0,0|2,0,0]=4 1720 B14R2.1131 OCc1ccc(Br)c2ccccc12 Amb22227908 [1,1,0,0,0,0|2,0,0]=4 1721 B14R2.1131 OCc1ccc(Cl)c2ccccc12 Amb22481368 [1,1,0,0,0,0|2,0,0]=4 1722 B14R2.1131 OCc1ccc(F)c2ccccc12 Amb25778382 [1,1,0,0,0,0|2,0,0]=4 1723 B14R2.1131 OCc1ccc(I)c2ccccc12 Amb28383423 [1,1,0,0,0,0|2,0,0]=4 1724 B14R2.1131 OCc1ccc(O)c2ccccc12 Amb24763770 [1,1,0,0,0,0|1,0,0]=3 1725 B14R2.1131 OCc1ccc(O)c2cccnc12 Amb28066144 [1,1,0,0,0,0|2,0,0]=4 1726 B14R2.1131 OCc1ccc(O)c2ncccc12 Amb6315701 [1,1,0,0,0,0|2,0,0]=4 1727 B14R2.1131 Oc1ccc(CBr)c2ccccc12 Amb27947501 [1,1,0,0,0,0|1,0,0]=3 1728 B14R2.1131 Oc1ccc(CCl)c2ccc[nH+]c12 Amb5358776 [1,1,0,0,0,0|2,0,0]=4 1729 B14R2.1131 Oc1ccc(CCl)c2cccnc12 Amb1105007 [1,1,0,0,0,0|2,0,0]=4 1730 B14R2.1131 Oc1ccc(CCl)c2cccnc12 Amb1154133 [1,1,0,0,0,0|2,0,0]=4 1731 B14R2.1131 [C-]#[N+]c1ccc(C)c2ccccc12 Amb33198907 [1,1,0,0,0,0|2,0,0]=4 1732 B14R2.1131 [O-][n+]1ccc(CO)c2ccccc21 Amb27201985 [1,1,0,0,0,0|1,0,1]=4 1733 B14R2.8051 CN1C=CC(=O)c2cccc(N)c21 Amb23569352 [1,1,0,0,0,0|0,0,1]=3 1734 B14R2.8051 CN1C=CC(=O)c2cccc(O)c21 Amb27256387 [1,1,0,0,0,0|0,0,1]=3 1735 B14R2.8051 Cc1cc[n+](C)c2c(O)cccc12 Amb3985385 [1,1,0,0,0,0|1,0,1]=4 1736 B14R2.8051 Cc1ccc(Br)c2cccc(N)c12 Amb27755320 [1,1,0,0,0,0|2,0,0]=4 1737 B14R2.8051 Cc1ccc(C)c2c(C)cccc12 Amb6298481 [1,1,0,0,0,0|2,0,0]=4 1738 B14R2.8051 Cc1ccc(O)c2c(O)cccc12 Amb27256347 [1,1,0,0,0,0|1,0,0]=3 1739 B14R2.8051 Cc1ccc(O)c2c1NC=CC2=O Amb22752598 [1,1,0,0,0,0|2,0,0]=4 1740 B14R2.8051 Cc1cccc2c(N)ccc(C)c12 Amb22751125 [1,1,0,0,0,0|2,0,0]=4 1741 B14R2.8051 Nc1ccc(O)c2c(N)cccc12 Amb17594391 [1,1,0,0,0,0|2,0,0]=4 1742 B14R2.8051 Nc1ccc(O)c2c(O)cccc12 Amb17594434 [1,1,0,0,0,0|2,0,0]=4 1743 B14R2.8051 Nc1cccc2c(O)ccc(N)c12 Amb17594390 [1,1,0,0,0,0|2,0,0]=4 1744 B14R2.8051 Nc1cccc2c(O)ccc(O)c12 Amb17594430 [1,1,0,0,0,0|2,0,0]=4 1745 B14R2.8051 Oc1ccc(O)c2c(O)cccc12 Amb17594464 [1,1,0,0,0,0|2,0,0]=4 1746 B14R2.8751 CN1C=CC(=O)c2cc(Br)ccc21 Amb21972216 [1,1,0,0,0,0|0,0,1]=3 1747 B14R2.8751 CN1C=CC(=O)c2cc(O)ccc21 Amb32424378 [1,1,0,0,0,0|0,0,1]=3 1748 B14R2.8751 CN1C=CC(=O)c2ccc(Cl)cc21 Amb28242654 [1,1,0,0,0,0|0,0,1]=3 1749 B14R2.8751 CN1C=CC(=O)c2ccc(F)cc21 Amb22750766 [1,1,0,0,0,0|0,0,1]=3 1750 B14R2.8751 CN1C=CC(=O)c2ccc(N)cc21 Amb27772030 [1,1,0,0,0,0|0,0,1]=3 1751 B14R2.8751 CN1C=NC(=O)c2cc(Cl)ccc21 Amb27789109 [1,1,0,0,0,0|1,0,1]=4 1752 B14R2.8751 CN1N=CC(=O)c2ccc(F)cc21 Amb24658041 [1,1,0,0,0,0|1,0,1]=4 1753 B14R2.8751 Cc1ccc(O)c2c1C=CC(=O)O2 Amb27599491 [1,1,0,0,0,0|2,0,0]=4 1754 B14R2.8751 Cc1ccc(O)c2c1NC(=O)C=C2 Amb22752600 [1,1,0,0,0,0|2,0,0]=4 1755 B14R2.8751 Cc1ccc2c(C)ccc(N)c2c1 Amb28458103 [1,1,0,0,0,0|2,0,0]=4 1756 B14R2.8751 Cc1ccc2c(C)ccc(O)c2n1 Amb11032488 [1,1,0,0,0,0|2,0,0]=4 1757 B14R2.8751 Cc1ccc2c(C)ccc(O)c2n1 Amb32882443 [1,1,0,0,0,0|2,0,0]=4 1758 B14R2.8751 Cc1ccc2c(O)ccc(C)c2n1 Amb23401099 [1,1,0,0,0,0|2,0,0]=4 1759 B14R2.8751 Cc1ccc2c(c1)C(=O)N=CN2C Amb22753724 [1,1,0,0,0,0|1,0,1]=4 1760 B14R2.8751 Nc1ccc(O)c2cc(Cl)ccc12 Amb26874846 [1,1,0,0,0,0|2,0,0]=4 1761 B14R2.8751 Nc1ccc(O)c2cc(Cl)ccc12 Amb33620368 [1,1,0,0,0,0|2,0,0]=4 1762 B14R2.8751 Nc1ccc(O)c2ccc(Cl)cc12 Amb27233525 [1,1,0,0,0,0|2,0,0]=4 1763 B14R2.8751 Nc1ccc(O)c2ccc(O)cc12 Amb17594433 [1,1,0,0,0,0|2,0,0]=4 1764 B14R2.8751 Oc1ccc(F)c2ccc(F)cc12 Amb27646866 [1,1,0,0,0,0|2,0,0]=4 1765 B14R2.8751 Oc1ccc2c(O)ccc(F)c2c1 Amb27151590 [1,1,0,0,0,0|2,0,0]=4 1766 B14R2.8751 Oc1ccc2c(O)ccc(O)c2c1 Amb17594465 [1,1,0,0,0,0|2,0,0]=4 1767 B14R2.8751 [O-][n+]1ccc(O)c2ccc(Cl)cc21 Amb26519866 [1,1,0,0,0,0|1,0,1]=4 1768 B14R2.29285 CC1(C)C=CC(=O)c2ccccc21 Amb17594321 [1,1,0,0,0,0|1,0,1]=4 1769 B14R2.29285 CC1(C)C=CC(O)c2ccccc21 Amb27456739 [1,1,0,0,0,0|1,0,1]=4 1770 B14R2.215 C#Cc1c(Br)c2ccccc2n1C Amb33435903 [0,1,0,0,1,0|2,0,0]=4 1771 B14R2.215 C=Cc1c(Br)c2ccccc2n1C Amb33430503 [0,1,0,0,1,0|2,0,0]=4 1772 B14R2.215 CCc1c(Br)c2ccccc2n1C Amb27879126 [0,1,0,0,1,0|2,0,0]=4 1773 B14R2.215 Cc1c(C#N)n(C)c2ccccc12 Amb17778653 [0,1,0,0,1,0|2,0,0]=4 1774 B14R2.215 Cc1c(C=O)n(C)c2ccccc12 Amb1980939 [0,1,0,0,1,0|1,0,0]=3 1775 B14R2.215 Cc1c(CN)n(C)c2ccccc12 Amb26304224 [0,1,0,0,1,0|2,0,0]=4 1776 B14R2.215 Cc1c(CS)n(C)c2ccccc12 Amb32788071 [0,1,0,0,1,0|1,1,0]=4 1777 B14R2.215 Cn1c(C=O)c(Br)c2ccccc21 Amb28368433 [0,1,0,0,1,0|1,0,0]=3 1778 B14R2.215 Cn1c(C=O)c(Br)c2cccnc21 Amb18157394 [0,1,0,0,1,0|2,0,0]=4 1779 B14R2.215 Cn1c(C=O)c(Br)c2cnccc21 Amb18157400 [0,1,0,0,1,0|2,0,0]=4 1780 B14R2.215 Cn1c(C=O)c(Br)c2ncccc21 Amb18157397 [0,1,0,0,1,0|2,0,0]=4 1781 B14R2.215 Cn1c(C=O)c(Cl)c2ccccc21 Amb443873 [0,1,0,0,1,0|1,0,0]=3 1782 B14R2.215 Cn1c(C=O)c(Cl)c2cccnc21 Amb18189637 [0,1,0,0,1,0|2,0,0]=4 1783 B14R2.215 Cn1c(C=O)c(Cl)c2cnccc21 Amb18189638 [0,1,0,0,1,0|2,0,0]=4 1784 B14R2.215 Cn1c(C=O)c(N)c2ccccc21 Amb18197693 [0,1,0,0,1,0|1,0,0]=3 1785 B14R2.215 Cn1c(C=O)c(O)c2ccccc21 Amb8439272 [0,1,0,0,1,0|0,0,0]=2 1786 B14R2.215 Cn1c(CCl)c(Br)c2ccccc21 Amb33435859 [0,1,0,0,1,0|2,0,0]=4 1787 B14R2.215 Cn1c(CN)c(Br)c2ccccc21 Amb26638334 [0,1,0,0,1,0|2,0,0]=4 1788 B14R2.215 Cn1c(CO)c(Br)c2ccccc21 Amb25377122 [0,1,0,0,1,0|1,0,1]=4 1789 B14R2.215 Cn1c(CS)c(Br)c2ccccc21 Amb33430510 [0,1,0,0,1,0|1,1,0]=4 1790 B14R2.8716 CC1C(=O)N(C)c2cc(Br)ccc21 Amb26591751 [0,1,0,0,1,0|1,0,1]=4 1791 B14R2.8716 CC1C(=O)N(C)c2ccc(Br)cc21 Amb33714564 [0,1,0,0,1,0|1,0,1]=4 1792 B14R2.8716 CC1C(=O)N(C)c2ccc(N)cc21 Amb17101115 [0,1,0,0,1,0|1,0,1]=4 1793 B14R2.8716 CN1C(=O)C(=O)c2cc(Br)ccc21 Amb6335572 [0,1,0,0,1,0|0,0,1]=3 1794 B14R2.8716 CN1C(=O)C(=O)c2cc(Cl)ccc21 Amb1917073 [0,1,0,0,1,0|0,0,1]=3 1795 B14R2.8716 CN1C(=O)C(=O)c2cc(F)ccc21 Amb1080954 [0,1,0,0,1,0|0,0,1]=3 1796 B14R2.8716 CN1C(=O)C(=O)c2cc(I)ccc21 Amb23401103 [0,1,0,0,1,0|0,0,1]=3 1797 B14R2.8716 CN1C(=O)C(=O)c2cc(N)ccc21 Amb23401104 [0,1,0,0,1,0|0,0,1]=3 1798 B14R2.8716 CN1C(=O)C(=O)c2ccc(Br)cc21 Amb6702925 [0,1,0,0,1,0|0,0,1]=3 1799 B14R2.8716 CN1C(=O)C(=O)c2ccc(Cl)cc21 Amb19043526 [0,1,0,0,1,0|0,0,1]=3 1800 B14R2.8716 CN1C(=O)C(=O)c2ccc(F)cc21 Amb6702791 [0,1,0,0,1,0|0,0,1]=3 1801 B14R2.8716 CN1C(=O)C(N)c2cc(Br)ccc21 Amb17597806 [0,1,0,0,1,0|1,0,1]=4 1802 B14R2.8716 CN1C(=O)C(N)c2cc(Br)ccc21 Amb8882260 [0,1,0,0,1,0|1,0,1]=4 1803 B14R2.8716 CN1C(=O)C(N)c2cc(Cl)ccc21 Amb21896796 [0,1,0,0,1,0|1,0,1]=4 1804 B14R2.8716 CN1C(=O)C(N)c2cc(Cl)ccc21 Amb8882082 [0,1,0,0,1,0|1,0,1]=4 1805 B14R2.8716 CN1C(=O)C(N)c2cc(F)ccc21 Amb8881942 [0,1,0,0,1,0|1,0,1]=4 1806 B14R2.8716 CN1C(=O)C(N)c2ccc(F)cc21 Amb8882327 [0,1,0,0,1,0|1,0,1]=4 1807 B14R2.8716 CN1C(=O)C(O)c2ccc(Cl)cc21 Amb28069727 [0,1,0,0,1,0|0,0,1]=3 1808 B14R2.8716 CN1C(=O)N(C)c2cc(Br)ccc21 Amb18034502 [0,1,0,0,1,0|2,0,0]=4 1809 B14R2.8716 CN1C(=O)N(C)c2cc(Cl)ccc21 Amb19654293 [0,1,0,0,1,0|2,0,0]=4 1810 B14R2.8716 CN1C(=O)N(C)c2cc(N)ccc21 Amb18046747 [0,1,0,0,1,0|2,0,0]=4 1811 B14R2.8716 CN1C(=O)N(C)c2cc(N)ccc21 Amb20228588 [0,1,0,0,1,0|2,0,0]=4 1812 B14R2.8716 CN1C(=O)N(C)c2cc(O)ccc21 Amb18046749 [0,1,0,0,1,0|2,0,0]=4 1813 B14R2.8716 CN1C(=O)N(C)c2cc(S)ccc21 Amb18330478 [0,1,0,0,1,0|2,0,0]=4 1814 B14R2.8716 Cc1c(Br)c2cc(Cl)ccc2n1C Amb18563294 [0,1,0,0,1,0|2,0,0]=4 1815 B14R2.8716 Cc1c(Br)c2cc(F)ccc2n1C Amb18563293 [0,1,0,0,1,0|2,0,0]=4 1816 B14R2.8716 Cc1c(Br)c2ccc(Cl)cc2n1C Amb18563297 [0,1,0,0,1,0|2,0,0]=4 1817 B14R2.8716 Cc1c(Br)c2ccc(F)cc2n1C Amb18065249 [0,1,0,0,1,0|2,0,0]=4 1818 B14R2.8716 Cc1c(C)n(C)c2cc(N)ccc12 Amb27203405 [0,1,0,0,1,0|2,0,0]=4 1819 B14R2.8716 Cc1c(C)n(C)c2ccc(Br)cc12 Amb17506904 [0,1,0,0,1,0|2,0,0]=4 1820 B14R2.8716 Cc1c(C)n(C)c2ccc(N)cc12 Amb5501642 [0,1,0,0,1,0|2,0,0]=4 1821 B14R2.8716 Cc1c(C)n(C)c2ccc(O)cc12 Amb26304277 [0,1,0,0,1,0|2,0,0]=4 1822 B14R2.8716 Cc1c(N)c2cc(O)ccc2n1C Amb32698533 [0,1,0,0,1,0|2,0,0]=4 1823 B14R2.8716 Cc1c(N)n(C)c2ccc(Br)cc12 Amb28242723 [0,1,0,0,1,0|2,0,0]=4 1824 B14R2.8716 Cc1ccc2c(c1)C(=O)C(=O)N2C Amb2785391 [0,1,0,0,1,0|0,0,1]=3 1825 B14R2.8716 Cc1ccc2c(c1)C(N)C(=O)N2C Amb19373635 [0,1,0,0,1,0|1,0,1]=4 1826 B14R2.8716 Cc1ccc2c(c1)C(N)C(=O)N2C Amb19373662 [0,1,0,0,1,0|1,0,1]=4 1827 B14R2.8716 Cc1ccc2c(c1)C(N)C(=O)N2C Amb33526889 [0,1,0,0,1,0|1,0,1]=4 1828 B14R2.8716 Cc1ccc2c(c1)C(O)C(=O)N2C Amb28079069 [0,1,0,0,1,0|0,0,1]=3 1829 B14R2.8716 Cc1ccc2c(c1)N(C)C(=O)C2=O Amb18243609 [0,1,0,0,1,0|0,0,1]=3 1830 B14R2.8716 Cc1ccc2c(c1)N(C)C(=O)C2N Amb18243659 [0,1,0,0,1,0|1,0,1]=4 1831 B14R2.8716 Cc1ccc2c(c1)N(C)C(=O)N2C Amb19654181 [0,1,0,0,1,0|2,0,0]=4 1832 B14R2.8716 Cc1ccc2c(c1)c(Br)c(C)n2C Amb18563289 [0,1,0,0,1,0|2,0,0]=4 1833 B14R2.8716 Cn1c(Br)c(Br)c2ccc(Br)cc21 Amb27224913 [0,1,0,0,1,0|2,0,0]=4 1834 B14R2.19306 C#Cc1c(C)n(C)c2ccccc12 Amb32732109 [0,1,0,0,1,0|2,0,0]=4 1835 B14R2.19306 C=CN1C(=O)C(=O)c2ccccc21 Amb27772302 [0,1,0,0,1,0|0,0,2]=4 1836 B14R2.19306 C=Cc1c(C)n(C)c2ccccc12 Amb32732099 [0,1,0,0,1,0|2,0,0]=4 1837 B14R2.19306 CCC1C(=O)N(C)c2ccccc21 Amb15693467 [0,1,0,0,1,0|1,0,1]=4 1838 B14R2.19306 CCN1C(=O)C(=O)c2ccccc21 Amb6335570 [0,1,0,0,1,0|0,0,1]=3 1839 B14R2.19306 CCN1C(=O)C(N)c2ccccc21 Amb13949076 [0,1,0,0,1,0|1,0,1]=4 1840 B14R2.19306 CCN1C(=O)C(N)c2ccccc21 Amb8882184 [0,1,0,0,1,0|1,0,1]=4 1841 B14R2.19306 CCc1c(N)n(C)c2ccccc12 Amb27657621 [0,1,0,0,1,0|2,0,0]=4 1842 B14R2.19306 CCn1c(Cl)c(C)c2ccccc21 Amb23569032 [0,1,0,0,1,0|2,0,0]=4 1843 B14R2.19306 CN1C(=O)C(C#N)c2ccccc21 Amb27232674 [0,1,0,0,1,0|1,0,1]=4 1844 B14R2.19306 CN1C(=O)C(C=O)c2ccccc21 Amb18127394 [0,1,0,0,1,0|0,0,2]=4 1845 B14R2.19306 CN1C(=O)C(CN)c2ccccc21 Amb27405072 [0,1,0,0,1,0|1,0,1]=4 1846 B14R2.19306 CN1C(=O)\C(=C/O)c2ccccc21 Amb10809902 [0,1,0,0,1,0|0,0,0]=2 1847 B14R2.19306 CN1C(=O)\C(=C\O)c2ccccc21 Amb27444811 [0,1,0,0,1,0|0,0,0]=2 1848 B14R2.19306 CN1C(=O)\C(=N/N)c2ccccc21 Amb365508 [0,1,0,0,1,0|1,0,0]=3 1849 B14R2.19306 CN1C(=O)\C(=N/O)c2ccccc21 Amb2760925 [0,1,0,0,1,0|0,0,0]=2 1850 B14R2.19306 CN1C(=S)\C(=C\N)c2ccccc21 Amb27482560 [0,1,0,0,1,0|1,1,0]=4 1851 B14R2.19306 CNc1c(C)n(C)c2ccccc12 Amb18564021 [0,1,0,0,1,0|2,0,0]=4 1852 B14R2.19306 C\C=C1\C(=O)N(C)c2ncccc21 Amb28185002 [0,1,0,0,1,0|2,0,0]=4 1853 B14R2.19306 Cc1c(C#N)c2ccccc2n1C Amb1001991 [0,1,0,0,1,0|2,0,0]=4 1854 B14R2.19306 Cc1c(C=O)c2ccccc2n1C Amb1008884 [0,1,0,0,1,0|1,0,1]=4 1855 B14R2.19306 Cc1c(CBr)c2ccccc2n1C Amb33434919 [0,1,0,0,1,0|2,0,0]=4 1856 B14R2.19306 Cc1c(CCl)c2ccccc2n1C Amb18863877 [0,1,0,0,1,0|2,0,0]=4 1857 B14R2.19306 Cc1c(CN)c2ccccc2n1C Amb5781893 [0,1,0,0,1,0|2,0,0]=4 1858 B14R2.19306 Cc1c(CO)c2ccccc2n1C Amb18224487 [0,1,0,0,1,0|1,0,0]=3 1859 B14R2.19306 Cc1c(CS)c2ccccc2n1C Amb28322107 [0,1,0,0,1,0|1,1,0]=4 1860 B14R2.19306 Cn1c(Cl)c(C#N)c2ccccc21 Amb2419097 [0,1,0,0,1,0|2,0,0]=4 1861 B14R2.19306 Cn1c(Cl)c(C=O)c2ccccc21 Amb1157532 [0,1,0,0,1,0|1,0,1]=4 1862 B14R2.19306 Cn1c(Cl)c(CN)c2ccccc21 Amb3653916 [0,1,0,0,1,0|2,0,0]=4 1863 B14R2.19306 Cn1c(Cl)c(CN)c2ccccc21 Amb6344836 [0,1,0,0,1,0|2,0,0]=4 1864 B14R2.19306 Cn1c(I)c(C#N)c2ccccc21 Amb21963326 [0,1,0,0,1,0|2,0,0]=4 1865 B14R2.19306 Cn1c(N)c(C=O)c2ccccc21 Amb18197774 [0,1,0,0,1,0|1,0,1]=4 1866 B14R2.19306 Cn1c(N)c(C=S)c2ccccc21 Amb27477734 [0,1,0,0,1,0|1,1,0]=4 1867 B14R2.19306 Cn1c(O)c(C#N)c2ccccc21 Amb32716332 [0,1,0,0,1,0|1,0,1]=4 1868 B14R2.19306 N#CN1C(=O)C(=O)c2ccccc21 Amb28043165 [0,1,0,0,1,0|0,0,2]=4 1869 B14R2.19306 O=C1C(=O)N(CCl)c2ccccc21 Amb17595162 [0,1,0,0,1,0|0,0,1]=3 1870 B14R2.19306 O=C1C(=O)N(CO)c2ccccc21 Amb6316618 [0,1,0,0,1,0|0,0,1]=3 1871 B14R2.19306 O=NN1C(=O)C(O)c2ccccc21 Amb28455161 [0,1,0,0,1,0|1,0,1]=4 1872 B14R2.19306 [C-]#[N+]c1c(C)n(C)c2ccccc12 Amb32732149 [0,1,0,0,1,0|2,0,0]=4 1873 B14R2.28485 CC1C(=O)N(C)c2cccc(O)c21 Amb27954104 [0,1,0,0,1,0|1,0,1]=4 1874 B14R2.28485 CN1C(=O)C(=O)c2c(Br)cccc21 Amb6702514 [0,1,0,0,1,0|0,0,1]=3 1875 B14R2.28485 CN1C(=O)C(=O)c2c(Cl)cccc21 Amb19043527 [0,1,0,0,1,0|0,0,1]=3 1876 B14R2.28485 CN1C(=O)C(=O)c2cccc(Br)c21 Amb22886726 [0,1,0,0,1,0|0,0,1]=3 1877 B14R2.28485 CN1C(=O)C(=O)c2cccc(Cl)c21 Amb1102739 [0,1,0,0,1,0|0,0,1]=3 1878 B14R2.28485 CN1C(=O)C(=O)c2cccc(F)c21 Amb18243747 [0,1,0,0,1,0|0,0,1]=3 1879 B14R2.28485 CN1C(=O)C(N)c2cccc(F)c21 Amb18893644 [0,1,0,0,1,0|1,0,1]=4 1880 B14R2.28485 CN1C(=O)N(C)c2c(N)cccc21 Amb27179332 [0,1,0,0,1,0|2,0,0]=4 1881 B14R2.28485 Cc1c(Br)c2cccc(Cl)c2n1C Amb18563304 [0,1,0,0,1,0|2,0,0]=4 1882 B14R2.28485 Cc1c(Br)c2cccc(F)c2n1C Amb18563303 [0,1,0,0,1,0|2,0,0]=4 1883 B14R2.28485 Cc1c(C)n(C)c2c(N)cccc12 Amb27179242 [0,1,0,0,1,0|2,0,0]=4 1884 B14R2.28485 Cc1c(C)n(C)c2cccc(N)c12 Amb27415644 [0,1,0,0,1,0|2,0,0]=4 1885 B14R2.28485 Cc1c(C)n(C)c2cccc(O)c12 Amb18127479 [0,1,0,0,1,0|2,0,0]=4 1886 B14R2.28485 Cc1cccc2c(Br)c(C)n(C)c12 Amb18563300 [0,1,0,0,1,0|2,0,0]=4 1887 B14R2.28485 Cc1cccc2c1N(C)C(=O)C2=O Amb1085871 [0,1,0,0,1,0|0,0,1]=3 1888 B14R2.28485 Cc1cccc2c1N(C)C(=O)C2N Amb16187113 [0,1,0,0,1,0|1,0,1]=4 1889 B14R2.28485 Cc1cccc2c1N(C)C(=O)C2N Amb21959837 [0,1,0,0,1,0|1,0,1]=4 1890 B14R2.57380 CC1(C)C(=O)C(=O)c2ccccc21 Amb8484638 [0,1,0,0,1,0|1,0,1]=4 1891 B14R2.57380 CN1C(=O)C(C)(C)c2ccccc21 Amb18669470 [0,1,0,0,1,0|1,0,1]=4 1892 B14R2.57380 CN1C(=O)C(C)(O)c2ccccc21 Amb28317257 [0,1,0,0,1,0|0,0,1]=3 1893 B14R2.57380 CN1C(=O)C(Cl)(Cl)c2ccccc21 Amb10976624 [0,1,0,0,1,0|1,0,1]=4 1894 B14R2.57380 CN1C(=O)C(F)(F)c2ccccc21 Amb27478463 [0,1,0,0,1,0|1,0,1]=4 1895 B14R2.2296 Cc1c(C=O)cc(O)c2sccc12 Amb27202905 [0,1,0,0,1,0|2,0,0]=4 1896 B14R2.11806 CN1C(=O)C=C(CN)c2occc21 Amb18195556 [0,1,0,0,1,0|2,0,0]=4 1897 B14R2.11806 CN1C(=O)C=C(CN)c2sccc21 Amb18189877 [0,1,0,0,1,0|2,0,0]=4 1898 B16R2.14090 CN1CC(=O)N(C)c2ccccc2C1=O Amb7172762 [0,1,0,0,0,1|0,0,2]=4 1899 B16R2.103824 C=C1C[C@H](N)C(=O)N(C)c2ccccc21 Amb33715260 [0,1,0,0,0,1|1,0,1]=4 1900 B16R2.103824 CC1NC(=O)c2ccccc2N(C)C1=O Amb6805170 [0,1,0,0,0,1|0,0,2]=4 1901 B16R2.64030 CCN1C(=O)CC(C)=Nc2ccccc21 Amb19671795 [0,1,0,0,0,1|1,0,1]=4 1902 B16R2.128840 CC1=Nc2ccc(C)cc2N(C)C(=O)C1 Amb24110657 [0,1,0,0,0,1|1,0,1]=4 1903 B16R2.128840 CC1=Nc2ccc(Cl)cc2N(C)C(=O)C1 Amb24110642 [0,1,0,0,0,1|1,0,1]=4 1904 B16R2.9566 CCN1C(=O)C(Br)=C(Cl)c2ccccc21 Amb32456026 [0,2,0,0,0,0|1,0,0]=3 1905 B16R2.9566 CCN1C(=O)C(Cl)=C(Cl)c2ccccc21 Amb32456027 [0,2,0,0,0,0|1,0,0]=3 1906 B16R2.9913 CCN1C(=O)C=C(O)c2cc(C)ccc21 Amb19650707 [0,2,0,0,0,0|0,0,0]=2 1907 B16R2.9913 CCN1C(=O)NC(=O)c2cc(N)ccc21 Amb18669587 [0,2,0,0,0,0|1,0,1]=4 1908 B16R2.9913 CCN1C(=O)OC(=O)c2cc(Br)ccc21 Amb18533335 [0,2,0,0,0,0|1,0,1]=4 1909 B16R2.9913 CCN1C(=O)OC(=O)c2cc(N)ccc21 Amb18538597 [0,2,0,0,0,0|1,0,1]=4 1910 B16R2.9913 CCN1C(C)=CC(=O)c2cc(Br)ccc21 Amb19816079 [0,2,0,0,0,0|1,0,1]=4 1911 B16R2.9913 CCN1C(C)=CC(=O)c2cc(N)ccc21 Amb22410676 [0,2,0,0,0,0|1,0,1]=4 1912 B16R2.9913 CCn1c(=O)oc(=O)c2cc(C)ccc21 Amb841526 [0,2,0,0,0,0|1,0,1]=4 1913 B16R2.9913 CCn1c(C)cc(=O)c2cc(C)ccc21 Amb10976743 [0,2,0,0,0,0|1,0,1]=4 1914 B16R2.9913 CCn1c(C)cc(=O)c2cc(Cl)ccc21 Amb10976747 [0,2,0,0,0,0|1,0,1]=4 1915 B16R2.9913 CCn1c(C)cc(=O)c2cc(F)ccc21 Amb10976749 [0,2,0,0,0,0|1,0,1]=4 1916 B16R2.23332 CC(=O)n1c(=O)oc(=O)c2ccccc21 Amb841533 [0,2,0,0,0,0|1,0,1]=4 1917 B16R2.23332 CC(C)N1C(=O)OC(=O)c2ccccc21 Amb21936298 [0,2,0,0,0,0|1,0,1]=4 1918 B16R2.35373 COc1c(C=O)cc(Br)c2ccccc12 Amb33716450 [0,2,0,0,0,0|2,0,0]=4 1919 B16R2.35373 COc1c(C=O)cc(F)c2ccccc12 Amb28990832 [0,2,0,0,0,0|2,0,0]=4 1920 B16R2.37410 COc1cc(N)c(OC)c2ccccc12 Amb2613532 [0,2,0,0,0,0|2,0,0]=4 1921 B16R2.44545 C=CCN1C(=O)OC(=O)c2ccccc21 Amb19665066 [0,2,0,0,0,0|1,0,1]=4 1922 B16R2.44545 CC1=CC(=O)c2ccccc2N1CC#N Amb22009654 [0,2,0,0,0,0|1,0,1]=4 1923 B16R2.44545 CCCn1c(=O)oc(=O)c2ccccc21 Amb2796141 [0,2,0,0,0,0|1,0,1]=4 1924 B16R2.44545 CCCn1c(=S)cc(C)c2ccccc21 Amb24070481 [0,2,0,0,0,0|1,1,0]=4 1925 B16R2.44545 N#CCN1C(=O)NC(=O)c2ccccc21 Amb20413777 [0,2,0,0,0,0|1,0,1]=4 1926 B16R2.44545 N#CCN1C(=O)OC(=O)c2ccccc21 Amb20413779 [0,2,0,0,0,0|1,0,1]=4 1927 B16R2.44545 O=C1NC(=O)N(CCCl)c2ccccc21 Amb27842829 [0,2,0,0,0,0|1,0,1]=4 1928 B16R2.70217 CCn1c(C)cc(=O)c2cccc(C)c21 Amb10976742 [0,2,0,0,0,0|1,0,1]=4 1929 B16R2.70217 CCn1c(C)cc(=O)c2cccc(Cl)c21 Amb10976746 [0,2,0,0,0,0|1,0,1]=4 1930 B16R2.70217 CCn1c(C)cc(=O)c2cccc(F)c21 Amb10976748 [0,2,0,0,0,0|1,0,1]=4 1931 B16R2.70221 CCN1C(C)=CC(=O)c2ccc(N)cc21 Amb23569479 [0,2,0,0,0,0|1,0,1]=4 1932 B16R2.8682 CN1C(=O)C(C#N)=C(O)c2ccccc21 Amb19667458 [0,2,0,0,0,0|0,0,0]=2 1933 B16R2.8682 CN1C(=O)C(C=O)=C(Cl)c2ccccc21 Amb18658583 [0,2,0,0,0,0|1,0,0]=3 1934 B16R2.22899 CC1=C(Cl)c2c(Br)cccc2N(C)C1=O Amb33356757 [0,2,0,0,0,0|1,0,0]=3 1935 B16R2.22899 CC1=C(Cl)c2cccc(Br)c2N(C)C1=O Amb33356984 [0,2,0,0,0,0|1,0,0]=3 1936 B16R2.22899 CC1=C(Cl)c2cccc(F)c2N(C)C1=O Amb33357076 [0,2,0,0,0,0|1,0,0]=3 1937 B16R2.22899 CN1C(=O)c2c(I)cccc2N(C)C1=O Amb22234590 [0,2,0,0,0,0|1,0,1]=4 1938 B16R2.133343 CC1=C(Cl)c2cc(F)ccc2N(C)C1=O Amb33356590 [0,2,0,0,0,0|1,0,0]=3 1939 B16R2.133343 CC1=C(Cl)c2cc(N)ccc2N(C)C1=O Amb33357075 [0,2,0,0,0,0|1,0,0]=3 1940 B16R2.133343 CC1=C(Cl)c2ccc(Br)cc2N(C)C1=O Amb33356926 [0,2,0,0,0,0|1,0,0]=3 1941 B16R2.133343 CC1=C(Cl)c2ccc(F)cc2N(C)C1=O Amb33356617 [0,2,0,0,0,0|1,0,0]=3 1942 B16R2.133343 CN1C(=O)C(=O)N(C)c2cc(Br)ccc21 Amb19654265 [0,2,0,0,0,0|2,0,0]=4 1943 B16R2.133343 CN1C(=O)C(=O)N(C)c2cc(N)ccc21 Amb18654946 [0,2,0,0,0,0|2,0,0]=4 1944 B16R2.133343 CN1C(=O)c2cc(Br)ccc2N(C)C1=O Amb19546116 [0,2,0,0,0,0|1,0,1]=4 1945 B16R2.133343 CN1C(=O)c2cc(O)ccc2N(C)C1=O Amb30628556 [0,2,0,0,0,0|1,0,1]=4 1946 B16R2.133343 CN1C(=O)c2ccc(N)cc2N(C)C1=O Amb18654945 [0,2,0,0,0,0|1,0,1]=4 1947 B16R2.24454 CC1=CC(=S)N(C)C2=C1C(=O)C=CC2=O Amb24093790 [0,2,0,0,0,0|1,1,0]=4 1948 B16R2.36854 COc1cccc2c1C(=O)OC(=O)N2C Amb21943639 [0,2,0,0,0,0|1,0,1]=4 1949 B16R2.36854 COc1cccc2c1C(O)=CC(=O)N2C Amb32405046 [0,2,0,0,0,0|0,0,0]=2 1950 B16R2.36855 COc1cccc2c(=O)cc(C)n(C)c12 Amb10976713 [0,2,0,0,0,0|1,0,1]=4 1951 B16R2.36855 COc1cccc2c1N(C)C(=O)OC2=O Amb22754370 [0,2,0,0,0,0|1,0,1]=4 1952 B16R2.37419 CN1C(=O)C=C(C#N)c2cccc(Cl)c21 Amb31096487 [0,2,0,0,0,0|1,0,0]=3 1953 B16R2.37419 CN1C(=O)C=C(C#N)c2cccc(F)c21 Amb31096489 [0,2,0,0,0,0|1,0,0]=3 1954 B16R2.37419 CN1C(=O)C=C(C=O)c2cccc(Br)c21 Amb31164950 [0,2,0,0,0,0|0,0,1]=3 1955 B16R2.37419 CN1C(=O)C=C(C=O)c2cccc(Cl)c21 Amb31124151 [0,2,0,0,0,0|0,0,1]=3 1956 B16R2.37419 CN1C(=O)C=C(C=O)c2cccc(F)c21 Amb31142836 [0,2,0,0,0,0|0,0,1]=3 1957 B16R2.37419 CN1C(=O)C=C(CN)c2cccc(Br)c21 Amb31115547 [0,2,0,0,0,0|1,0,0]=3 1958 B16R2.37419 CN1C(=O)C=C(CN)c2cccc(Cl)c21 Amb31096488 [0,2,0,0,0,0|1,0,0]=3 1959 B16R2.37419 Cc1cccc2c1N(C)C(=O)C=C2C#N Amb31096430 [0,2,0,0,0,0|1,0,0]=3 1960 B16R2.37419 Cc1cccc2c1N(C)C(=O)C=C2C=O Amb31142477 [0,2,0,0,0,0|0,0,1]=3 1961 B16R2.41887 CN1C(C#N)=CC(=O)c2cccc(Cl)c21 Amb31096395 [0,2,0,0,0,0|1,0,1]=4 1962 B16R2.41887 CN1C(C#N)=CC(=O)c2cccc(F)c21 Amb31096396 [0,2,0,0,0,0|1,0,1]=4 1963 B16R2.41887 CN1C(CN)=CC(=O)c2cccc(Cl)c21 Amb31096414 [0,2,0,0,0,0|1,0,1]=4 1964 B16R2.41887 Cc1cccc2c1N(C)C(C#N)=CC2=O Amb31096365 [0,2,0,0,0,0|1,0,1]=4 1965 B16R2.41887 Cc1cccc2c1N(C)C(CN)=CC2=O Amb31096406 [0,2,0,0,0,0|1,0,1]=4 1966 B16R2.104316 Cc1cc(=O)c2cc(F)cc(F)c2n1C Amb10976733 [0,2,0,0,0,0|1,0,1]=4 1967 B16R2.104316 Cc1cc(Br)c2c(c1)c(=O)oc(=O)n2C Amb2787344 [0,2,0,0,0,0|1,0,1]=4 1968 B16R2.104316 Cc1cc(C)c2c(c1)c(=O)cc(C)n2C Amb10976719 [0,2,0,0,0,0|1,0,1]=4 1969 B16R2.104316 Cn1c(=O)oc(=O)c2cc(Br)cc(Br)c21 Amb7092106 [0,2,0,0,0,0|1,0,1]=4 1970 B16R2.104316 Cn1c(=O)oc(=O)c2cc(Br)cc(Cl)c21 Amb7092109 [0,2,0,0,0,0|1,0,1]=4 1971 B16R2.104316 Cn1c(=O)oc(=O)c2cc(Br)cc(F)c21 Amb7092108 [0,2,0,0,0,0|1,0,1]=4 1972 B16R2.104316 Cn1c(=O)oc(=O)c2cc(Cl)cc(Br)c21 Amb7092105 [0,2,0,0,0,0|1,0,1]=4 1973 B16R2.37411 CN1c2ccccc2C(CO)=CC1(C)C Amb24116281 [0,2,0,0,0,0|1,0,1]=4 1974 B16R2.21692 CCOC1=CC(=O)c2ccccc2N1C Amb24062729 [0,2,0,0,0,0|0,0,2]=4 1975 B16R2.23331 CN1C(C(=O)O)=CC(=O)c2ccccc21 Amb18547589 [0,2,0,0,0,0|0,0,1]=3 1976 B16R2.23331 Cc1c([N+](=O)[O-])cc(Br)c2ccccc12 Amb32661705 [0,2,0,0,0,0|2,0,0]=4 1977 B16R2.23331 O=C(O)c1cc(O)c2ccccc2c1O Amb544636 [0,2,0,0,0,0|2,0,0]=4 1978 B16R2.41797 CN1C(C#N)=CC(=O)c2ccc(Cl)cc21 Amb31096388 [0,2,0,0,0,0|1,0,1]=4 1979 B16R2.41797 CN1C(C#N)=CC(=O)c2ccc(F)cc21 Amb31096387 [0,2,0,0,0,0|1,0,1]=4 1980 B16R2.41797 CN1C(CN)=CC(=O)c2ccc(Cl)cc21 Amb31096411 [0,2,0,0,0,0|1,0,1]=4 1981 B16R2.41797 Cc1ccc2c(c1)N(C)C(C#N)=CC2=O Amb31096386 [0,2,0,0,0,0|1,0,1]=4 1982 B16R2.41797 Cc1ccc2c(c1)N(C)C(CN)=CC2=O Amb31096410 [0,2,0,0,0,0|1,0,1]=4 1983 B16R2.41813 CN1C(C#N)=CC(=O)c2cc(Br)ccc21 Amb31096397 [0,2,0,0,0,0|1,0,1]=4 1984 B16R2.41813 CN1C(C#N)=CC(=O)c2cc(Cl)ccc21 Amb31096384 [0,2,0,0,0,0|1,0,1]=4 1985 B16R2.41813 CN1C(C#N)=CC(=O)c2cc(F)ccc21 Amb31096383 [0,2,0,0,0,0|1,0,1]=4 1986 B16R2.41813 CN1C(CN)=CC(=O)c2cc(Br)ccc21 Amb31096415 [0,2,0,0,0,0|1,0,1]=4 1987 B16R2.41813 CN1C(CN)=CC(=O)c2cc(Cl)ccc21 Amb31096408 [0,2,0,0,0,0|1,0,1]=4 1988 B16R2.41813 Cc1ccc2c(c1)C(=O)C=C(C#N)N2C Amb31096377 [0,2,0,0,0,0|1,0,1]=4 1989 B16R2.41813 Cc1ccc2c(c1)C(=O)C=C(CN)N2C Amb31096401 [0,2,0,0,0,0|1,0,1]=4 1990 B16R2.22312 CN1C(=O)C=C(C(=O)O)c2ccccc21 Amb18545028 [0,2,0,0,0,0|0,0,0]=2 1991 B16R2.22312 CN1C(=O)CC(C(=O)O)c2ccccc21 Amb149550 [0,2,0,0,0,0|0,0,2]=4 1992 B16R2.37414 CN1C(=O)C=C(C#N)c2ccc(Cl)cc21 Amb31096477 [0,2,0,0,0,0|1,0,0]=3 1993 B16R2.37414 CN1C(=O)C=C(C#N)c2ccc(F)cc21 Amb31096476 [0,2,0,0,0,0|1,0,0]=3 1994 B16R2.37414 CN1C(=O)C=C(C=O)c2ccc(Cl)cc21 Amb31124149 [0,2,0,0,0,0|0,0,1]=3 1995 B16R2.37414 CN1C(=O)C=C(C=O)c2ccc(F)cc21 Amb31142835 [0,2,0,0,0,0|0,0,1]=3 1996 B16R2.37414 CN1C(=O)C=C(CN)c2ccc(Cl)cc21 Amb31096478 [0,2,0,0,0,0|1,0,0]=3 1997 B16R2.37414 Cc1ccc2c(c1)N(C)C(=O)C=C2C#N Amb31096475 [0,2,0,0,0,0|1,0,0]=3 1998 B16R2.37414 Cc1ccc2c(c1)N(C)C(=O)C=C2C=O Amb24099693 [0,2,0,0,0,0|0,0,1]=3 1999 B16R2.50940 CN1C(=O)C=C(CCO)c2ccccc21 Amb23448567 [0,2,0,0,0,0|0,0,0]=2 2000 B16R2.50940 CN1C(=O)C=C(\C=N\O)c2ccccc21 Amb19671989 [0,2,0,0,0,0|0,0,0]=2 2001 B16R2.50940 CNCC1=CC(=O)N(C)c2ccccc21 Amb31112375 [0,2,0,0,0,0|1,0,0]=3 2002 B16R2.191238 CN1C(=O)C=C(C#N)c2cc(Br)ccc21 Amb31096490 [0,2,0,0,0,0|1,0,0]=3 2003 B16R2.191238 CN1C(=O)C=C(C#N)c2cc(Cl)ccc21 Amb31096469 [0,2,0,0,0,0|1,0,0]=3 2004 B16R2.191238 CN1C(=O)C=C(C#N)c2cc(F)ccc21 Amb31096434 [0,2,0,0,0,0|1,0,0]=3 2005 B16R2.191238 CN1C(=O)C=C(C=O)c2cc(Br)ccc21 Amb31164949 [0,2,0,0,0,0|0,0,1]=3 2006 B16R2.191238 CN1C(=O)C=C(C=O)c2cc(Cl)ccc21 Amb31124148 [0,2,0,0,0,0|0,0,1]=3 2007 B16R2.191238 CN1C(=O)C=C(C=O)c2cc(F)ccc21 Amb31142834 [0,2,0,0,0,0|0,0,1]=3 2008 B16R2.191238 CN1C(=O)C=C(CN)c2cc(Br)ccc21 Amb31096491 [0,2,0,0,0,0|1,0,0]=3 2009 B16R2.191238 CN1C(=O)C=C(CN)c2cc(Cl)ccc21 Amb31096470 [0,2,0,0,0,0|1,0,0]=3 2010 B16R2.191238 Cc1ccc2c(c1)C(C#N)=CC(=O)N2C Amb31096417 [0,2,0,0,0,0|1,0,0]=3 2011 B16R2.191238 Cc1ccc2c(c1)C(C=O)=CC(=O)N2C Amb31142475 [0,2,0,0,0,0|0,0,1]=3 2012 B16R2.196882 COc1ccc2c(c1)c(=O)cc(C)n2C Amb10976714 [0,2,0,0,0,0|1,0,1]=4 2013 B14R2.8 CNc1cc(-c2ccccc2)no1 Amb24678779 [0,0,1,1,0,0|1,0,1]=4 2014 B14R2.8 CNc1cc(-c2ccccc2)sn1 Amb27796233 [0,0,1,1,0,0|1,1,0]=4 2015 B14R2.21 NC1=CC(c2ccccc2)=CCN1 Amb28118874 [0,0,1,1,0,0|2,0,0]=4 2016 B14R2.21 O=C1C=C(c2ccccc2)C=NN1 Amb25859226 [0,0,1,1,0,0|2,0,0]=4 2017 B14R2.21 O=C1C=C(c2ccccc2)CCC1 Amb2613651 [0,0,1,1,0,0|2,0,0]=4 2018 B14R2.21 O=C1C=C(c2ccccc2)N=CN1 Amb18001789 [0,0,1,1,0,0|1,0,1]=4 2019 B14R2.21 O=C1C=C(c2ccccc2)OCC1 Amb22750040 [0,0,1,1,0,0|1,0,0]=3 2020 B14R2.21 O=C1C=COC(c2ccccc2)=C1 Amb22750060 [0,0,1,1,0,0|1,0,1]=4 2021 B14R2.52 O=C1NCc2ccccc2C(=O)O1 Amb28130439 [0,0,1,1,0,0|1,0,1]=4 2022 B14R2.260 CC1CC(c2ccccc2)=CC1=O Amb28240634 [0,0,1,1,0,0|2,0,0]=4 2023 B14R2.260 CN1C=C(c2ccccc2)SC1=O Amb28183097 [0,0,1,1,0,0|2,0,0]=4 2024 B14R2.260 CN1N=C(c2ccccc2)CC1=O Amb17712376 [0,0,1,1,0,0|1,0,1]=4 2025 B14R2.260 CN1NC(c2ccccc2)=CC1=O Amb19769388 [0,0,1,1,0,0|1,0,0]=3 2026 B14R2.260 CN1OC(c2ccccc2)=NC1=O Amb28182733 [0,0,1,1,0,0|1,0,0]=3 2027 B14R2.260 Cc1cc(-c2ccccc2)cn1C Amb17666668 [0,0,1,1,0,0|2,0,0]=4 2028 B14R2.260 Cc1cc(-c2ccccc2)nn1C Amb26592408 [0,0,1,1,0,0|2,0,0]=4 2029 B14R2.260 Cn1nc(-c2ccccc2)cc1Br Amb22301186 [0,0,1,1,0,0|2,0,0]=4 2030 B14R2.260 Cn1nc(-c2ccccc2)cc1Cl Amb22453272 [0,0,1,1,0,0|2,0,0]=4 2031 B14R2.260 Cn1nc(-c2ccccc2)cc1N Amb2684469 [0,0,1,1,0,0|2,0,0]=4 2032 B14R2.260 Cn1nc(-c2ccccc2)cc1O Amb2608456 [0,0,1,1,0,0|1,0,1]=4 2033 B14R2.260 Cn1nc(-c2ccccc2)cc1S Amb19073087 [0,0,1,1,0,0|1,1,0]=4 2034 B14R2.260 O=C1C=C(c2ccccc2)OC1=O Amb9685644 [0,0,1,1,0,0|2,0,0]=4 2035 B14R2.335 O=C1NCC1C(=O)c2ccccc2 Amb27206601 [0,0,1,1,0,0|0,0,2]=4 2036 B14R2.335 O=C1NCC1C(O)c2ccccc2 Amb28128474 [0,0,1,1,0,0|0,0,2]=4 2037 B14R2.335 O=C1NC[C@H]1[C@H](O)c2ccccc2 Amb27789997 [0,0,1,1,0,0|0,0,2]=4 2038 B14R2.958 CNC(=O)[C@H]1O[C@@H]1c2ccccc2 Amb27255278 [0,0,1,1,0,0|0,0,2]=4 2039 B14R2.2950 O=C1CC(O)(c2ccccc2)CN1 Amb27653252 [0,0,1,1,0,0|0,0,2]=4 2040 B14R2.24 O=C1C=CC=CN1c2ccccc2 Amb19133652 [0,0,1,1,0,0|1,0,1]=4 2041 B14R2.24 O=C1C=CC=NN1c2ccccc2 Amb22491545 [0,0,1,1,0,0|2,0,0]=4 2042 B14R2.24 O=C1C=CCCN1c2ccccc2 Amb22500740 [0,0,1,1,0,0|1,0,0]=3 2043 B14R2.44 CN1\C(=C\C=O)Sc2ccccc21 Amb31128502 [0,0,1,1,0,0|0,1,1]=4 2044 B14R2.44 CN1\C(=C\CO)Sc2ccccc21 Amb28065217 [0,0,1,1,0,0|0,1,1]=4 2045 B14R2.44 Cn1c(\C=C\Cl)nc2ccccc21 Amb27445117 [0,0,1,1,0,0|2,0,0]=4 2046 B14R2.279 CN1C(=O)CCOc2ccccc21 Amb17570222 [0,0,1,1,0,0|0,0,2]=4 2047 B14R2.598 CC1=CC(=O)N(c2ccccc2)O1 Amb28242905 [0,0,1,1,0,0|2,0,0]=4 2048 B14R2.598 CC1=CC(=O)N(c2ccccc2)S1 Amb27603419 [0,0,1,1,0,0|2,0,0]=4 2049 B14R2.598 Nc1cc(O)nn1-c2ccccc2 Amb18944742 [0,0,1,1,0,0|2,0,0]=4 2050 B14R2.598 O=C1CC(=O)N(c2ccccc2)C1 Amb20622677 [0,0,1,1,0,0|0,0,2]=4 2051 B14R2.598 O=C1CN(c2ccccc2)C(=O)N1 Amb582169 [0,0,1,1,0,0|1,0,1]=4 2052 B14R2.598 O=C1NC(=S)CN1c2ccccc2 Amb585535 [0,0,1,1,0,0|1,1,0]=4 2053 B14R2.33858 O=C(\C=C\Cl)C1Cc2ccccc21 Amb29880217 [0,0,1,1,0,0|2,0,0]=4 2054 B14R2.11690 CN1C(=O)Cc2cccc(C=O)c21 Amb18197489 [0,0,1,1,0,0|0,0,2]=4 2055 B14R2.11690 CN1C(=O)Oc2cccc(C=O)c21 Amb18196470 [0,0,1,1,0,0|1,0,1]=4 2056 B14R2.11690 Cc1cc2cccc(C=O)c2n1C Amb18198020 [0,0,1,1,0,0|1,0,1]=4 2057 B14R2.25733 CC(=O)N1CC(=O)c2ccccc21 Amb533887 [0,0,1,1,0,0|0,0,2]=4 2058 B14R2.25733 CC(=O)N1CC(O)c2ccccc21 Amb28428026 [0,0,1,1,0,0|0,0,2]=4 2059 B14R2.25733 CC(=O)n1cc(O)c2ccccc21 Amb3445153 [0,0,1,1,0,0|0,0,2]=4 2060 B14R2.31359 CC(=O)N1CC=Cc2ccccc21 Amb26639322 [0,0,1,1,0,0|1,0,1]=4 2061 B14R2.98 CNc1ccccc1-c2ncno2 Amb18951460 [0,0,1,1,0,0|2,0,0]=4 2062 B14R2.98 COc1ccccc1-c2ccco2 Amb24184097 [0,0,1,1,0,0|2,0,0]=4 2063 B14R2.98 COc1ccccc1-c2ccno2 Amb22043707 [0,0,1,1,0,0|2,0,0]=4 2064 B14R2.510 Cn1nc(CC=O)c2ccccc21 Amb26440589 [0,0,1,1,0,0|1,0,1]=4 2065 B14R2.7150 O=C\C=C1/CCCc2ccccc21 Amb18647673 [0,0,1,1,0,0|2,0,0]=4 2066 B14R2.7150 O=C\C=C1/NCCc2ccccc21 Amb27625679 [0,0,1,1,0,0|2,0,0]=4 2067 B14R2.7150 O=C\C=C1\CCCc2ccccc21 Amb28057448 [0,0,1,1,0,0|2,0,0]=4 2068 B14R2.7150 O=C\C=C1\NCCc2ccccc21 Amb27254671 [0,0,1,1,0,0|2,0,0]=4 2069 B14R2.11635 CCc1cccc2cccc(O)c12 Amb27802544 [0,0,1,1,0,0|2,0,0]=4 2070 B14R2.11635 CNc1cccc2cccc(N)c12 Amb18126928 [0,0,1,1,0,0|2,0,0]=4 2071 B14R2.11635 CNc1cccc2cccc(S)c12 Amb27393519 [0,0,1,1,0,0|1,1,0]=4 2072 B14R2.11635 CNc1cccc2ccnc(O)c12 Amb27398537 [0,0,1,1,0,0|2,0,0]=4 2073 B14R2.11635 COc1cccc2cccc(O)c12 Amb18127191 [0,0,1,1,0,0|2,0,0]=4 2074 B14R2.11635 COc1cccc2nccc(O)c12 Amb10602739 [0,0,1,1,0,0|2,0,0]=4 2075 B14R2.24350 Cn1ccc2cccc(C(=O)O)c21 Amb6572374 [0,0,1,1,0,0|2,0,0]=4 2076 B14R2.24350 Cn1cnc2cccc(C(=O)O)c21 Amb24088933 [0,0,1,1,0,0|2,0,0]=4 2077 B16R3.33838 CC1=CC(=O)N2CCc3cccc1c32 Amb19654057 [0,1,0,1,0,0|1,0,0]=3 2078 B16R3.33838 O=C1C=C(Cl)c2cccc3c2N1CC3 Amb24119522 [0,1,0,1,0,0|1,0,0]=3 2079 B16R3.33838 O=C1NC(=O)N2CCc3cccc1c32 Amb27746830 [0,1,0,1,0,0|1,0,1]=4 2080 B12R2.18 C=C1Sc2ccccc2N1C Amb17842907 [1,0,0,0,1,0|2,0,0]=4 2081 B12R2.18 CC1C(=O)Cc2ccccc21 Amb20622460 [1,0,0,0,1,0|1,0,1]=4 2082 B12R2.18 CC1C(=O)Nc2ccccc21 Amb2612193 [1,0,0,0,1,0|2,0,0]=4 2083 B12R2.18 CC1C(=O)Oc2ccccc21 Amb25150504 [1,0,0,0,1,0|2,0,0]=4 2084 B12R2.18 CN1C(=N)Sc2ccccc21 Amb19202293 [1,0,0,0,1,0|2,0,0]=4 2085 B12R2.18 CN1C(=O)Cc2ccccc21 Amb1398903 [1,0,0,0,1,0|0,0,1]=3 2086 B12R2.18 CN1C(=O)Cc2cccnc21 Amb24334650 [1,0,0,0,1,0|1,0,1]=4 2087 B12R2.18 CN1C(=O)Cc2ccncc21 Amb22491400 [1,0,0,0,1,0|1,0,1]=4 2088 B12R2.18 CN1C(=O)Cc2cnccc21 Amb26371015 [1,0,0,0,1,0|1,0,1]=4 2089 B12R2.18 CN1C(=O)Cc2ncccc21 Amb28399277 [1,0,0,0,1,0|1,0,1]=4 2090 B12R2.18 CN1C(=O)Nc2ccccc21 Amb18537193 [1,0,0,0,1,0|1,0,0]=3 2091 B12R2.18 CN1C(=O)Nc2cccnc21 Amb21963725 [1,0,0,0,1,0|2,0,0]=4 2092 B12R2.18 CN1C(=O)Nc2cnccc21 Amb19148095 [1,0,0,0,1,0|2,0,0]=4 2093 B12R2.18 CN1C(=O)Nc2ncccc21 Amb20661045 [1,0,0,0,1,0|2,0,0]=4 2094 B12R2.18 CN1C(=O)Oc2ccccc21 Amb18043105 [1,0,0,0,1,0|1,0,0]=3 2095 B12R2.18 CN1C(=O)Oc2ncccc21 Amb26560695 [1,0,0,0,1,0|2,0,0]=4 2096 B12R2.18 CN1C(=O)Sc2ccccc21 Amb19654015 [1,0,0,0,1,0|1,0,0]=3 2097 B12R2.18 CN1C(=S)Cc2ccccc21 Amb8389728 [1,0,0,0,1,0|0,1,1]=4 2098 B12R2.18 CN1C(=S)Nc2ccccc21 Amb19815991 [1,0,0,0,1,0|1,1,0]=4 2099 B12R2.18 Cc1cc2ccccc2n1C Amb1934988 [1,0,0,0,1,0|1,0,0]=3 2100 B12R2.18 Cc1cc2ccccc2n1N Amb28457281 [1,0,0,0,1,0|2,0,0]=4 2101 B12R2.18 Cc1nc2ccccc2n1C Amb6367586 [1,0,0,0,1,0|2,0,0]=4 2102 B12R2.18 Cn1c(=N)sc2ccccc21 Amb4008099 [1,0,0,0,1,0|2,0,0]=4 2103 B12R2.18 Cn1c(Br)cc2ccccc21 Amb22232574 [1,0,0,0,1,0|1,0,0]=3 2104 B12R2.18 Cn1c(Br)cc2cnccc21 Amb18175875 [1,0,0,0,1,0|2,0,0]=4 2105 B12R2.18 Cn1c(Br)cc2ncccc21 Amb18175870 [1,0,0,0,1,0|2,0,0]=4 2106 B12R2.18 Cn1c(Br)nc2ccccc21 Amb7173246 [1,0,0,0,1,0|2,0,0]=4 2107 B12R2.18 Cn1c(Cl)cc2ccccc21 Amb26587274 [1,0,0,0,1,0|1,0,0]=3 2108 B12R2.18 Cn1c(Cl)nc2ccccc21 Amb534320 [1,0,0,0,1,0|2,0,0]=4 2109 B12R2.18 Cn1c(F)cc2ccccc21 Amb27882722 [1,0,0,0,1,0|1,0,0]=3 2110 B12R2.18 Cn1c(F)nc2ccccc21 Amb32675167 [1,0,0,0,1,0|2,0,0]=4 2111 B12R2.18 Cn1c(I)cc2ccccc21 Amb24067548 [1,0,0,0,1,0|1,0,0]=3 2112 B12R2.18 Cn1c(I)cc2cccnc21 Amb25196637 [1,0,0,0,1,0|2,0,0]=4 2113 B12R2.18 Cn1c(I)nc2ccccc21 Amb9687265 [1,0,0,0,1,0|2,0,0]=4 2114 B12R2.18 Cn1c(N)cc2ccccc21 Amb18644284 [1,0,0,0,1,0|1,0,0]=3 2115 B12R2.18 Cn1c(N)cc2ccccc21 Amb19944548 [1,0,0,0,1,0|1,0,0]=3 2116 B12R2.18 Cn1c(N)cc2cnccc21 Amb18202290 [1,0,0,0,1,0|2,0,0]=4 2117 B12R2.18 Cn1c(N)nc2ccccc21 Amb33528349 [1,0,0,0,1,0|2,0,0]=4 2118 B12R2.18 Cn1c(N)nc2ccccc21 Amb6383046 [1,0,0,0,1,0|2,0,0]=4 2119 B12R2.18 Cn1c(O)cc2ccccc21 Amb3427957 [1,0,0,0,1,0|0,0,1]=3 2120 B12R2.18 Cn1c(S)cc2ccccc21 Amb26845572 [1,0,0,0,1,0|0,1,0]=3 2121 B12R2.18 Cn1c(S)nc2ccccc21 Amb1104434 [1,0,0,0,1,0|1,1,0]=4 2122 B12R2.18 NN1C(=O)Cc2ccccc21 Amb10560115 [1,0,0,0,1,0|1,0,1]=4 2123 B12R2.18 NN1C(=O)Oc2ccccc21 Amb18644412 [1,0,0,0,1,0|2,0,0]=4 2124 B12R2.18 O=C1Cc2ccccc2N1O Amb17940424 [1,0,0,0,1,0|1,0,1]=4 2125 B12R2.18 O=C1Nc2ccccc2N1O Amb26332921 [1,0,0,0,1,0|2,0,0]=4 2126 B12R2.246 CC1=CC(=O)Nc2ccsc21 Amb29857469 [1,0,0,0,1,0|2,0,0]=4 2127 B12R2.246 CC1=CC(=O)Nc2occc21 Amb28365531 [1,0,0,0,1,0|2,0,0]=4 2128 B12R2.246 O=C1C=C(Cl)c2ccsc2N1 Amb22500816 [1,0,0,0,1,0|2,0,0]=4 2129 B12R2.246 O=C1C=C(Cl)c2sccc2N1 Amb23560707 [1,0,0,0,1,0|2,0,0]=4 2130 B12R2.246 O=C1C=C(O)c2ccsc2N1 Amb21857124 [1,0,0,0,1,0|1,0,0]=3 2131 B12R2.246 O=C1C=C(O)n2ccnc2N1 Amb22496265 [1,0,0,0,1,0|2,0,0]=4 2132 B12R2.246 O=C1C=C(O)n2nccc2N1 Amb22753418 [1,0,0,0,1,0|2,0,0]=4 2133 B12R2.2028 C=C1NC(=O)c2ccccc21 Amb27487451 [1,0,0,0,1,0|2,0,0]=4 2134 B12R2.2028 C=C1OC(=O)c2ccccc21 Amb22229358 [1,0,0,0,1,0|2,0,0]=4 2135 B12R2.2028 CC1=CC(=O)c2ccccc21 Amb9783432 [1,0,0,0,1,0|1,0,0]=3 2136 B12R2.2028 CC1=CC(O)c2ccccc21 Amb17778893 [1,0,0,0,1,0|1,0,1]=4 2137 B12R2.2028 Cn1cc(O)c2ccccc21 Amb24069283 [1,0,0,0,1,0|2,0,0]=4 2138 B12R2.2028 N=C1NC(=O)c2ccccc21 Amb21811514 [1,0,0,0,1,0|2,0,0]=4 2139 B12R2.2028 NC1=NC(=O)c2ccccc21 Amb6252622 [1,0,0,0,1,0|2,0,0]=4 2140 B12R2.2028 O=C1C=[N+]([O-])c2ccccc21 Amb17843025 [1,0,0,0,1,0|1,0,1]=4 2141 B12R2.2028 O=C1CC(=O)c2ccccc21 Amb1883008 [1,0,0,0,1,0|0,0,2]=4 2142 B12R2.2028 O=C1CC(O)c2ccccc21 Amb27872121 [1,0,0,0,1,0|0,0,2]=4 2143 B12R2.2028 O=C1NC(=O)c2ccccc21 Amb1934252 [1,0,0,0,1,0|1,0,1]=4 2144 B12R2.2028 O=C1NC(=O)c2ccccc21 Amb33868500 [1,0,0,0,1,0|1,0,1]=4 2145 B12R2.2028 O=C1NC(O)c2ccccc21 Amb17593710 [1,0,0,0,1,0|1,0,1]=4 2146 B12R2.2028 O=C1OC(=O)c2ccccc21 Amb17748796 [1,0,0,0,1,0|1,0,1]=4 2147 B12R2.2028 O=C1OC(O)c2ccccc21 Amb10552913 [1,0,0,0,1,0|1,0,1]=4 2148 B12R2.2028 O=C1OC(O)c2ccccc21 Amb16226896 [1,0,0,0,1,0|1,0,1]=4 2149 B12R2.2028 O=C1O[IH2](O)c2ccccc21 Amb33548934 [1,0,0,0,1,0|2,0,0]=4 2150 B12R2.2028 O=C1SC(=O)c2ccccc21 Amb2610321 [1,0,0,0,1,0|1,0,1]=4 2151 B12R2.2028 O=C1SC(O)c2ccccc21 Amb28207229 [1,0,0,0,1,0|1,0,1]=4 2152 B12R2.2028 O=C1[N-]C(=O)c2ccccc21 Amb28990952 [1,0,0,0,1,0|1,0,1]=4 2153 B12R2.2028 O=C1[N-]C(=O)c2ccccc21 Amb6365847 [1,0,0,0,1,0|1,0,1]=4 2154 B12R2.221 CN1C=CC(=O)c2ccsc21 Amb27410168 [1,0,0,0,1,0|1,0,1]=4 2155 B12R2.221 Cc1ccc(O)c2c1C=CC2 Amb28199830 [1,0,0,0,1,0|1,0,1]=4 2156 B12R2.221 Cc1ccc(O)c2ccsc12 Amb27246341 [1,0,0,0,1,0|2,0,0]=4 2157 B12R2.221 Cc1ccc(O)c2occc12 Amb27431709 [1,0,0,0,1,0|2,0,0]=4 2158 B14R1.163 CNC(=O)CCC(=O)c1ccccc1 Amb17336307 [0,0,1,0,0,1|0,0,2]=4 2159 B14R1.163 CNC(=O)CCC(O)c1ccccc1 Amb17336618 [0,0,1,0,0,1|0,0,2]=4 2160 B14R1.163 CNC(=O)NCC(O)c1ccccc1 Amb24181770 [0,0,1,0,0,1|0,0,2]=4 2161 B14R1.163 CNC(=O)NNC(=O)c1ccccc1 Amb2748084 [0,0,1,0,0,1|1,0,1]=4 2162 B14R1.163 CNC(=O)O\N=C(\C)c1ccccc1 Amb27830169 [0,0,1,0,0,1|2,0,0]=4 2163 B14R1.163 CNC(=O)O\N=C(\N)c1ccccc1 Amb27860246 [0,0,1,0,0,1|2,0,0]=4 2164 B14R1.163 COC(=O)\C=C\C(=O)c1ccccc1 Amb2435415 [0,0,1,0,0,1|1,0,1]=4 2165 B14R1.743 CNC(=O)NC(=O)Cc1ccccc1 Amb27387925 [0,0,1,0,0,1|1,0,1]=4 2166 B14R1.743 CNC(=O)NC(=S)Nc1ccccc1 Amb27957491 [0,0,1,0,0,1|1,1,0]=4 2167 B14R1.743 CNC(=O)\C=C(\C)Nc1ccccc1 Amb28240397 [0,0,1,0,0,1|1,0,0]=3 2168 B14R1.743 CNC(=O)\C=C(\C)Sc1ccccc1 Amb27215373 [0,0,1,0,0,1|1,0,0]=3 2169 B14R1.743 CN\C(C)=C/C(=O)Oc1ccccc1 Amb2386641 [0,0,1,0,0,1|1,0,1]=4 2170 B14R1.743 CN\C(C)=C\C(=O)Nc1ccccc1 Amb27758693 [0,0,1,0,0,1|1,0,1]=4 2171 B14R1.743 COC(=O)\C=C(/C)Nc1ccccc1 Amb6808898 [0,0,1,0,0,1|2,0,0]=4 2172 B14R1.743 COC(=O)\C=C(\C)Nc1ccccc1 Amb2386652 [0,0,1,0,0,1|2,0,0]=4 2173 B14R1.60 CN(Cc1ccccc1)C(=O)CCO Amb17336607 [0,0,1,0,0,1|0,0,2]=4 2174 B14R1.60 C\C(=C/c1ccccc1)C(=O)\C=C/N Amb27858691 [0,0,1,0,0,1|2,0,0]=4 2175 B14R1.60 C\C(=C/c1ccccc1)C(=O)\C=C/[O-] Amb22728792 [0,0,1,0,0,1|1,0,1]=4 2176 B14R1.60 C\C(=C/c1ccccc1)C(=O)\C=C\[O-] Amb24090361 [0,0,1,0,0,1|1,0,1]=4 2177 B14R1.60 C\C(=C\c1ccccc1)C(=O)\C=C\N Amb28137904 [0,0,1,0,0,1|2,0,0]=4 2178 B14R1.60 C\C(=C\c1ccccc1)C(=O)\C=C\O Amb27197219 [0,0,1,0,0,1|1,0,0]=3 2179 B14R2.741 CC1=Cc2ccccc2C=CC1=O Amb21948167 [1,0,0,0,0,1|1,0,0]=3 2180 B14R2.287 CC1=NOC(=O)Nc2ccccc21 Amb28388619 [1,0,0,0,0,1|2,0,0]=4 2181 B14R2.287 O=C1C=CC(O)=C2C=CC=NC2=N1 Amb25214670 [1,0,0,0,0,1|1,0,1]=4 2182 B14R2.287 O=C1C=NC(=O)c2ccccc2N1 Amb24597661 [1,0,0,0,0,1|0,0,1]=3 2183 B14R2.287 O=C1CCC(=O)c2ccccc2N1 Amb17608787 [1,0,0,0,0,1|0,0,2]=4 2184 B14R2.287 O=C1CNC(=O)c2ccccc2N1 Amb627736 [1,0,0,0,0,1|0,0,2]=4 2185 B14R2.287 O=C1NCC(O)c2ccccc2N1 Amb27238605 [1,0,0,0,0,1|0,0,2]=4 2186 B14R2.287 O=C1NNC(=O)c2ccccc2N1 Amb27169393 [1,0,0,0,0,1|1,0,1]=4 2187 B14R2.738 CC1=CC(=O)Nc2ccccc2N1 Amb17912774 [1,0,0,0,0,1|1,0,0]=3 2188 B14R2.738 CC1=CC(=O)Nc2cccnc2N1 Amb28401418 [1,0,0,0,0,1|2,0,0]=4 2189 B14R2.738 CC1=CC(=O)Nc2ccncc2N1 Amb28411441 [1,0,0,0,0,1|2,0,0]=4 2190 B14R2.738 CC1=CC(C)=Nc2ccccc2N1 Amb633973 [1,0,0,0,0,1|2,0,0]=4 2191 B14R2.738 CC1=CC(C)=[NH+]c2ccccc2N1 Amb10638 [1,0,0,0,0,1|2,0,0]=4 2192 B14R2.738 CC1=Nc2ccccc2NC(=O)C1 Amb1396300 [1,0,0,0,0,1|1,0,1]=4 2193 B14R2.738 O=C1C=C(O)Nc2ccccc2O1 Amb27427124 [1,0,0,0,0,1|1,0,0]=3 2194 B14R2.738 O=C1CC(=O)Nc2ccccc2N1 Amb1678046 [1,0,0,0,0,1|0,0,2]=4