0 B15R2.60 CC(=O)C1=CC=C(C=C1)C2=CC=CS2 Z234809820 [0,0,0,0,0,0|4,0,0]=4 1 B15R2.60 CC(=O)C1=CC=C(C=C1)N2C=CC=N2 Z235340087 [0,0,0,0,0,0|4,0,0]=4 2 B15R2.60 CC(=O)C1=CC=C(C=C1)N2C=CN=N2 Z238885206 [0,0,0,0,0,0|3,0,1]=4 3 B15R2.60 CN(C)C1=NC=C(C=C1)C2=NNC=C2 Z5809387680 [0,0,0,0,0,0|3,0,1]=4 4 B15R2.60 NC(=O)C1=CC=C(C=C1)C2=CNC=N2 Z3026293004 [0,0,0,0,0,0|4,0,0]=4 5 B15R2.60 NC(=O)C1=CC=C(C=C1)C2=CSC=C2 Z1509405965 [0,0,0,0,0,0|4,0,0]=4 6 B15R2.60 NC(=O)C1=CC=C(C=C1)C2=NN=CO2 Z116821628 [0,0,0,0,0,0|3,0,1]=4 7 B15R2.60 NC(=O)C1=CC=C(C=C1)C2=NNN=N2 Z104341536 [0,0,0,0,0,0|4,0,0]=4 8 B15R2.60 NC(=O)C1=CC=C(C=C1)N2C=CC=N2 Z82670287 [0,0,0,0,0,0|4,0,0]=4 9 B15R2.60 O=C(O)C1=CC=C(C=C1)C2=CNC=N2 Z1160901524 [0,0,0,0,0,0|3,0,1]=4 10 B15R2.60 O=C(O)C1=CC=C(C=C1)C2=CSC=N2 Z415646066 [0,0,0,0,0,0|3,0,1]=4 11 B15R2.60 O=C(O)C1=CC=C(C=C1)C2=CSN=N2 Z1269242653 [0,0,0,0,0,0|2,0,2]=4 12 B15R2.60 O=C(O)C1=CC=C(C=C1)C2=NC=CS2 Z803330510 [0,0,0,0,0,0|3,0,1]=4 13 B15R2.60 O=C(O)C1=CC=C(C=C1)C2=NN=CN2 Z1715300894 [0,0,0,0,0,0|2,0,2]=4 14 B15R2.60 O=C(O)C1=CC=C(C=C1)C2=NN=CO2 Z108578610 [0,0,0,0,0,0|2,0,2]=4 15 B15R2.60 O=C(O)C1=CC=C(C=C1)C2=NNC=C2 Z2757437976 [0,0,0,0,0,0|1,0,1]=2 16 B15R2.60 O=C(O)C1=CC=C(C=C1)C2=NNN=N2 Z99601150 [0,0,0,0,0,0|3,0,1]=4 17 B15R2.60 O=C(O)C1=CC=C(C=C1)C2=NOC=C2 Z1862025590 [0,0,0,0,0,0|2,0,1]=3 18 B15R2.60 O=C(O)C1=CC=C(C=C1)C2=NOC=N2 Z803310410 [0,0,0,0,0,0|3,0,1]=4 19 B15R2.60 O=C(O)C1=CC=C(C=C1)N2C=CC=N2 Z85923465 [0,0,0,0,0,0|3,0,1]=4 20 B15R2.60 O=C(O)C1=CC=C(C=C1)N2C=CN=N2 Z1262528913 [0,0,0,0,0,0|2,0,2]=4 21 B15R2.60 O=[N+]([O-])C1=CC=C(C=C1)C2=CC=NN2 Z324553596 [0,0,0,0,0,0|0,0,2]=2 22 B15R2.60 O=[N+]([O-])C1=CC=C(C=C1)C2=CNC=N2 Z90663564 [0,0,0,0,0,0|2,0,0]=2 23 B15R2.60 O=[N+]([O-])C1=CC=C(C=C1)C2=CNN=C2 Z1041149066 [0,0,0,0,0,0|2,0,0]=2 24 B15R2.60 O=[N+]([O-])C1=CC=C(C=C1)C2=NC=CN2 Z607822522 [0,0,0,0,0,0|2,0,0]=2 25 B15R2.60 O=[N+]([O-])C1=CC=C(C=C1)C2=NN=CO2 Z55670790 [0,0,0,0,0,0|1,0,1]=2 26 B15R2.60 O=[N+]([O-])C1=CC=C(C=C1)C2=NNC=N2 Z359384190 [0,0,0,0,0,0|1,0,0]=1 27 B15R2.60 O=[N+]([O-])C1=CC=C(C=C1)C2=NOC=N2 Z351495110 [0,0,0,0,0,0|2,0,0]=2 28 B15R2.60 O=[N+]([O-])C1=CC=C(C=C1)N2C=NN=N2 Z56769737 [0,0,0,0,0,0|2,0,1]=3 29 B15R2.60 O=[N+]([O-])C1=CN=C(C=C1)N2C=CC=C2 Z55892918 [0,0,0,0,0,0|4,0,0]=4 30 B14R2.1 COC1=CC=C(C=C1)C2=NNC=C2 Z815437682 [1,0,0,0,0,0|2,0,0]=3 31 B14R2.1 NCC1=CC=C(C=C1)C2=NNC=N2 Z3190317789 [1,0,0,0,0,0|3,0,0]=4 32 B14R2.1 O=CC1=CC=C(C=C1)C2=CC=CO2 Z1179935673 [1,0,0,0,0,0|3,0,0]=4 33 B14R2.1 O=CC1=CC=C(C=C1)C2=CC=CS2 Z756110738 [1,0,0,0,0,0|3,0,0]=4 34 B14R2.1 O=CC1=CC=C(C=C1)C2=CSC=C2 Z1201622737 [1,0,0,0,0,0|3,0,0]=4 35 B14R2.1 O=CC1=CC=C(C=C1)C2=NNC=C2 Z3300394022 [1,0,0,0,0,0|1,0,0]=2 36 B14R2.1 O=CC1=CC=C(C=C1)N2C=CC=N2 Z235340061 [1,0,0,0,0,0|3,0,0]=4 37 B14R2.1 O=CC1=CC=C(C=C1)N2C=CN=N2 Z1255446766 [1,0,0,0,0,0|2,0,1]=4 38 B14R2.1 OCC1=CC=C(C=C1)C2=NNC=C2 Z1255495909 [1,0,0,0,0,0|1,0,1]=3 39 B16R2.2817 CC1=C(C=CC(=C1)C2=NN=CO2)[N+](=O)[O-] Z359347996 [0,1,0,0,0,0|1,0,1]=3 40 B16R2.2817 CC1=C(C=CC(=C1)N2C=CN=C2)[N+](=O)[O-] Z642522556 [0,1,0,0,0,0|2,0,1]=4 41 B16R2.2817 NC1=C(C=CC(=C1)C2=NNC=C2)C(=O)O Z4872402200 [0,1,0,0,0,0|1,0,1]=3 42 B16R2.2827 CC1=CSC(=N1)C2=CC=C(C=C2)[N+](=O)[O-] Z440629590 [0,1,0,0,0,0|2,0,0]=3 43 B16R2.2827 CC1=NC(=CS1)C2=CC=C(C=C2)[N+](=O)[O-] Z48850708 [0,1,0,0,0,0|2,0,0]=3 44 B16R2.2827 CC1=NN=C(O1)C2=CC=C(C=C2)[N+](=O)[O-] Z56763887 [0,1,0,0,0,0|1,0,1]=3 45 B16R2.2827 CN1C=NC(=N1)C2=CC=C(C=C2)C(=O)O Z1603833966 [0,1,0,0,0,0|2,0,1]=4 46 B16R2.2827 NC1=CC(=NO1)C2=CC=C(C=C2)[N+](=O)[O-] Z56943578 [0,1,0,0,0,0|1,0,0]=2 47 B16R2.2827 NC1=NC(=CN1)C2=CC=C(C=C2)[N+](=O)[O-] Z477283602 [0,1,0,0,0,0|2,0,0]=3 48 B16R2.2827 NC1=NC(=CS1)C2=CC=C(C=C2)[N+](=O)[O-] Z56760293 [0,1,0,0,0,0|2,0,0]=3 49 B16R2.2827 NC1=NC(=NN1)C2=CC=C(C=C2)[N+](=O)[O-] Z1211228972 [0,1,0,0,0,0|1,0,0]=2 50 B16R2.2827 NC1=NC(=NO1)C2=CC=C(C=C2)[N+](=O)[O-] Z991477760 [0,1,0,0,0,0|2,0,0]=3 51 B16R2.2827 NC1=NN=C(O1)C2=CC=C(C=C2)[N+](=O)[O-] Z235363007 [0,1,0,0,0,0|1,0,1]=3 52 B16R2.2827 NC1=NN=C(S1)C2=CC=C(C=C2)[N+](=O)[O-] Z332385258 [0,1,0,0,0,0|1,0,1]=3 53 B16R2.2827 O=C1C=CN(N1)C2=CC=C(C=C2)[N+](=O)[O-] Z1509645110 [0,1,0,0,0,0|2,0,1]=4 54 B16R2.2827 O=C1NC(=NO1)C2=CC=C(C=C2)[N+](=O)[O-] Z685593980 [0,1,0,0,0,0|2,0,0]=3 55 B16R2.2827 O=C1NN=C(O1)C2=CC=C(C=C2)C(=O)O Z2732875439 [0,1,0,0,0,0|2,0,1]=4 56 B16R2.2827 O=[N+]([O-])C1=CC=C(C=C1)C2=NN=C(O2)O Z381026126 [0,1,0,0,0,0|1,0,1]=3 57 B16R2.2827 O=[N+]([O-])C1=CC=C(C=C1)N2C=NC(=C2)Cl Z1245633478 [0,1,0,0,0,0|2,0,1]=4 58 B16R2.3212 CC1=CN=NN1C2=CC=C(C=C2)[N+](=O)[O-] Z56758730 [0,1,0,0,0,0|1,0,1]=3 59 B16R2.3212 CN1C=CN=C1C2=CC=C(C=C2)[N+](=O)[O-] Z1212695225 [0,1,0,0,0,0|2,0,0]=3 60 B16R2.3212 NC1=C(C=NN1)C2=CC=C(C=C2)[N+](=O)[O-] Z3485566270 [0,1,0,0,0,0|2,0,0]=3 61 B16R2.3212 NC1=CC=NN1C2=CC=C(C=C2)[N+](=O)[O-] Z415654454 [0,1,0,0,0,0|2,0,0]=3 62 B14R1.462 O=CN/N=C/C1=CC=C(C=C1)[N+](=O)[O-] Z49645564 [0,0,1,0,0,0|1,0,0]=2 63 B14R1.610 N#C/C=C(\Cl)/C1=CC=C(C=C1)[N+](=O)[O-] Z56943771 [0,0,1,0,0,0|1,0,2]=4 64 B14R2.53 O=C(O)C1=CC=C(O1)C2=NNC=C2 Z1198177195 [0,0,0,0,1,0|2,0,1]=4 65 B14R2.53 O=C(O)C1=CC=C(S1)C2=NNC=C2 Z1198177197 [0,0,0,0,1,0|2,0,1]=4 66 B16R2.85 O=C(O)C1=CC=C(C=C1)C2=CN=CC=C2 Z4995707292 [0,0,0,0,0,1|2,0,1]=4 67 B16R2.85 O=C(O)C1=CC=C(C=C1)C2=NC=CN=C2 Z1183457815 [0,0,0,0,0,1|2,0,1]=4 68 B16R2.158 CC(=O)NC1=CC=C(C=C1)C2=NNC=C2 Z383318944 [0,0,0,0,0,1|2,0,0]=3 69 B16R2.158 CC(=O)NC1=NC=C(C=C1)C2=NNC=C2 Z2227601390 [0,0,0,0,0,1|3,0,0]=4 70 B16R2.481 O=[N+]([O-])C1=CC=C(C=C1)CC2=NN=NN2 Z335295184 [0,0,0,0,0,1|2,0,1]=4 71 B16R2.481 O=[N+]([O-])C1=CC=C(C=C1)CN2C=CN=C2 Z57479549 [0,0,0,0,0,1|2,0,1]=4 72 B16R2.481 O=[N+]([O-])C1=CC=C(C=C1)CN2C=CN=N2 Z1726117903 [0,0,0,0,0,1|1,0,1]=3 73 B16R2.481 O=[N+]([O-])C1=CN=C(C=C1)SC2=NC=CS2 Z805439254 [0,0,0,0,0,1|3,0,0]=4 74 B13R1.537 N/C(=N\O)/C1=CC=C(C=C1)[N+](=O)[O-] Z291235500 [1,0,1,0,0,0|2,0,0]=4 75 B13R1.537 NNC(=O)C1=CC=C(C=C1)[N+](=O)[O-] Z57659326 [1,0,1,0,0,0|1,0,1]=4 76 B13R1.74 O=C/C=C/C1=CC=C(C=C1)[N+](=O)[O-] Z1255430997 [1,0,1,0,0,0|1,0,0]=3 77 B13R2.12 BrC1=CC=C(C=C1)C2=NNC=C2 Z815437630 [2,0,0,0,0,0|1,0,0]=3 78 B13R2.12 CC1=CC=C(C=C1)C2=NNN=C2 Z1255400292 [2,0,0,0,0,0|2,0,0]=4 79 B13R2.12 ClC1=CC=C(C=C1)C2=NNC=C2 Z3247494392 [2,0,0,0,0,0|1,0,0]=3 80 B13R2.12 ClC1=CC=C(C=C1)C2=NNC=N2 Z1216815679 [2,0,0,0,0,0|2,0,0]=4 81 B13R2.12 FC1=CC=C(C=C1)C2=NNC=C2 Z336079900 [2,0,0,0,0,0|1,0,0]=3 82 B13R2.12 FC1=CN=C(C=C1)C2=NNC=C2 Z1575337975 [2,0,0,0,0,0|2,0,0]=4 83 B13R2.12 IC1=CC=C(C=C1)C2=NNC=C2 Z1269127795 [2,0,0,0,0,0|1,0,0]=3 84 B13R2.12 NC1=CC=C(C=C1)C2=CNC=C2 Z1277281155 [2,0,0,0,0,0|1,0,1]=4 85 B13R2.12 NC1=CC=C(C=C1)C2=NNC=C2 Z320949640 [2,0,0,0,0,0|0,0,1]=3 86 B13R2.12 NC1=CC=C(C=C1)C2=NOC=C2 Z2901974733 [2,0,0,0,0,0|1,0,1]=4 87 B13R2.12 OC1=CC=C(C=C1)C2=NNC=C2 Z1737940715 [2,0,0,0,0,0|0,0,1]=3 88 B15R1.956 COC(=O)/C=C/C1=CC=C(C=C1)[N+](=O)[O-] Z19781094 [0,1,1,0,0,0|2,0,0]=4 89 B15R1.956 O=C(/C=C/C1=CC=C(C=C1)[N+](=O)[O-])NO Z59181953 [0,1,1,0,0,0|1,0,0]=3 90 B15R1.1030 O=[N+]([O-])C1=CC=C(C=C1)/C=N/NCCO Z56850475 [0,1,1,0,0,0|0,0,2]=4 91 B15R1.1222 C=CCNC(=O)C1=CC=C(C=C1)[N+](=O)[O-] Z32064570 [0,1,1,0,0,0|1,0,1]=4 92 B15R1.5504 C/C(=C\C(=O)O)/C1=CC=C(C=C1)[N+](=O)[O-] Z1815157397 [0,1,1,0,0,0|2,0,0]=4 93 B15R2.2 COC1=CC=C(C=C1)C2=NNC(=C2)N Z317042244 [1,1,0,0,0,0|2,0,0]=4 94 B17R2.3358 NC1=NC(=CC=N1)C2=CC=C(C=C2)[N+](=O)[O-] Z367654542 [0,1,0,0,0,1|0,0,1]=3 95 B17R2.2445 CCC(=O)NC1=CC=C(C=C1)C2=NNC=C2 Z372120384 [0,1,0,0,0,1|2,0,0]=4 96 B17R2.3232 CN1C=CC(=N1)NC2=CC=C(C=C2)C(=O)O Z1343572427 [0,1,0,0,0,1|1,0,1]=4 97 B17R2.3232 CN1C=CC(=N1)NC2=NC=C(C=C2)[N+](=O)[O-] Z238587692 [0,1,0,0,0,1|1,0,0]=3 98 B17R2.5031 CC1=NNC=C1NC2=CC=C(C=C2)[N+](=O)[O-] Z1587218444 [0,1,0,0,0,1|2,0,0]=4 99 B17R2.36753 NC1=C(C=CC(=C1)[N+](=O)[O-])SC2=CC=CS2 Z991541122 [0,1,0,0,0,1|2,0,0]=4 100 B17R2.36753 O=[N+]([O-])C1=CC(=C(C=C1)CN2C=CN=N2)F Z1729210128 [0,1,0,0,0,1|1,0,1]=4 101 B17R2.36753 O=[N+]([O-])C1=CC(=C(C=C1)SC2=NC=CN2)F Z1272577640 [0,1,0,0,0,1|2,0,0]=4 102 B17R2.42372 NC1=C(C=C(C(=C1)N2C=CC=N2)F)[N+](=O)[O-] Z235363155 [0,2,0,0,0,0|2,0,0]=4 103 B17R2.2517 CNC1=NC(=CS1)C2=CC=C(C=C2)[N+](=O)[O-] Z48861048 [0,2,0,0,0,0|2,0,0]=4 104 B17R2.2517 O=CC1=CC=C(O1)C2=CC=C(C=C2)[N+](=O)[O-] Z56785761 [0,2,0,0,0,0|2,0,0]=4 105 B17R2.2517 O=CC1=CC=C(S1)C2=CC=C(C=C2)[N+](=O)[O-] Z57085817 [0,2,0,0,0,0|2,0,0]=4 106 B17R2.2517 O=CC1=CN(N=C1)C2=CC=C(C=C2)[N+](=O)[O-] Z317041716 [0,2,0,0,0,0|2,0,0]=4 107 B17R2.2517 O=CC1=CN(N=N1)C2=CC=C(C=C2)[N+](=O)[O-] Z1270434154 [0,2,0,0,0,0|1,0,1]=4 108 B17R2.2517 O=CC1=NC(=NO1)C2=CC=C(C=C2)[N+](=O)[O-] Z1154601606 [0,2,0,0,0,0|2,0,0]=4 109 B17R2.2517 O=[N+]([O-])C1=CC=C(C=C1)C2=NC=C(O2)CO Z1187834532 [0,2,0,0,0,0|2,0,0]=4 110 B17R2.2517 O=[N+]([O-])C1=CC=C(C=C1)C2=NN=C(O2)CCl Z56817655 [0,2,0,0,0,0|1,0,1]=4 111 B17R2.2517 O=[N+]([O-])C1=CC=C(C=C1)C2=NN=C(O2)CO Z198744722 [0,2,0,0,0,0|1,0,1]=4 112 B17R2.2517 O=[N+]([O-])C1=CC=C(C=C1)C2=NOC(=N2)CCl Z330887764 [0,2,0,0,0,0|2,0,0]=4 113 B17R2.3349 CC1=CC(=NN1C2=CC=C(C=C2)[N+](=O)[O-])C Z55148819 [0,2,0,0,0,0|2,0,0]=4 114 B17R2.3349 CC1=NN(C(=C1)N)C2=CC=C(C=C2)[N+](=O)[O-] Z55148818 [0,2,0,0,0,0|2,0,0]=4 115 B17R2.2828 O=CC1=CNN=C1C2=CC=C(C=C2)[N+](=O)[O-] Z362114626 [0,2,0,0,0,0|0,0,0]=2 116 B15R2.2965 O=CC1=CNC2=C1C=CC(=C2)[N+](=O)[O-] Z414315610 [0,0,1,1,0,0|2,0,0]=4 117 B15R2.13598 NC1=C2C=CC(=CC2=CC=N1)[N+](=O)[O-] Z1222424679 [0,0,1,1,0,0|2,0,0]=4 118 B15R2.13598 O=[N+]([O-])C1=CC2=NC=CC(=C2C=C1)O Z1198180787 [0,0,1,1,0,0|1,0,1]=4 119 B15R2.1 O=CC1=CC=C(C=C1)C2=NC=CC=C2 Z1143356169 [1,0,0,0,0,1|2,0,0]=4 120 B15R2.61 CC(=O)C1=CC(=CC=C1)C2=NNC=C2 Z5014976150 [0,0,0,0,1,1|2,0,0]=4 121 B15R2.61 O=C(O)C1=CC(=CC=C1)C2=NNC=C2 Z2757438242 [0,0,0,0,1,1|1,0,1]=4 122 B15R2.61 O=C(O)C1=CC(=NC=C1)C2=NNC=C2 Z5469360145 [0,0,0,0,1,1|1,0,1]=4 123 B15R2.61 O=[N+]([O-])C1=CC(=CC=C1)C2=CNN=C2 Z1124713255 [0,0,0,0,1,1|2,0,0]=4 124 B15R2.61 O=[N+]([O-])C1=CC(=CC=C1)C2=NC=CN2 Z607822520 [0,0,0,0,1,1|2,0,0]=4 125 B15R2.61 O=[N+]([O-])C1=CC(=CC=C1)C2=NC=CS2 Z497926008 [0,0,0,0,1,1|2,0,0]=4 126 B15R2.61 O=[N+]([O-])C1=CC(=CC=C1)C2=NN=CO2 Z55670793 [0,0,0,0,1,1|1,0,1]=4 127 B15R2.61 O=[N+]([O-])C1=CC(=CC=C1)C2=NNC=N2 Z359387362 [0,0,0,0,1,1|1,0,0]=3 128 B15R2.61 O=[N+]([O-])C1=CC(=CC=C1)C2=NNN=N2 Z1262398365 [0,0,0,0,1,1|2,0,0]=4 129 B15R2.61 O=[N+]([O-])C1=CC(=CC=C1)C2=NOC=N2 Z361894810 [0,0,0,0,1,1|2,0,0]=4 130 B15R2.61 O=[N+]([O-])C1=CC(=CC=C1)N2C=CC=N2 Z431509908 [0,0,0,0,1,1|2,0,0]=4 131 B17R2.141 O=[N+]([O-])C1=CC=C(C=C1)OC2=NC=CC=N2 Z53861200 [0,0,0,0,0,2|1,0,0]=3 132 B17R2.5650 O=[N+]([O-])C1=CN=C(C=C1)NCC2=NNC=C2 Z644912224 [0,0,0,0,0,2|1,0,0]=3