0 B12R2.18 O=C1C(C2=CC=CN=C2N1)=O M10078714P [0,0,0,0,0,0|2,0,1]=3 1 B12R2.18 O=C1C(CC2=C1C=CC=C2)=O M10141381P [0,0,0,0,0,0|2,0,1]=3 2 B12R2.18 OC1C(Br)CC2=C1C=CC=C2 M10072804P [0,0,0,0,0,0|3,0,1]=4 3 B12R2.18 O[C@H]1[C@H](Br)CC2=C1C=CC=C2 M10114550P [0,0,0,0,0,0|3,0,1]=4 4 B11R2.1 CC1=COC2=CC=CC=C12 M10170730P [1,0,0,0,0,0|3,0,0]=4 5 B11R2.1 CC1=NNC2=C1C=CC=C2 M10051935P [1,0,0,0,0,0|3,0,0]=4 6 B11R2.1 CN1C2=CC=CC=C2N=C1 M10033964P [1,0,0,0,0,0|1,0,1]=3 7 B11R2.1 CN1N=NC2=CC=CC=C21 M10122945P [1,0,0,0,0,0|2,0,1]=4 8 B11R2.1 IC1=NNC2=C1C=CC=C2 M10420731P [1,0,0,0,0,0|3,0,0]=4 9 B11R2.1 NN1C=CC2=C1C=CC=C2 M10270478P [1,0,0,0,0,0|2,0,0]=3 10 B11R2.1 NN1N=CC2=C1C=CC=C2 M10220074P [1,0,0,0,0,0|3,0,0]=4 11 B11R2.1 OC1=CNC2=C1C=CC=C2 M10011825P [1,0,0,0,0,0|1,0,0]=2 12 B11R2.1 OC1CCC2=C1C=CC=C2 M10090985P [1,0,0,0,0,0|2,0,1]=4 13 B11R2.1 ON1N=NC2=CC=CC=C21 M10045793P [1,0,0,0,0,0|1,0,1]=3 14 B11R2.1 ON1N=NC2=CC=CC=C21 M10477801P [1,0,0,0,0,0|1,0,1]=3 15 B11R2.1 ON1N=NC2=CC=CN=C21 M10241196P [1,0,0,0,0,0|2,0,1]=4 16 B11R2.10 BrC1=CC2=CC=CC=C2S1 M10072498P [1,0,0,0,0,0|3,0,0]=4 17 B11R2.10 BrC1=NC2=CC=CC=C2S1 M10044877P [1,0,0,0,0,0|2,0,1]=4 18 B11R2.10 CC1=CC2=CC=CC=C2O1 M10191752P [1,0,0,0,0,0|3,0,0]=4 19 B11R2.10 CC1=NC2=CC=CC=C2O1 M10002374P [1,0,0,0,0,0|2,0,1]=4 20 B11R2.10 CC=1NC2=C(C1)C=NC=C2 M10692045P [1,0,0,0,0,0|3,0,0]=4 21 B11R2.10 NC1=NC2=CC=CC=C2O1 M10064517P [1,0,0,0,0,0|2,0,1]=4 22 B11R2.10 O=C1NC2=C(C1)C=CN=C2 M10276522P [1,0,0,0,0,0|2,0,0]=3 23 B11R2.10 O=C1NN2C=CC=CC2=C1 M10310770P [1,0,0,0,0,0|2,0,0]=3 24 B11R2.10 S=C1OC2=CC=CN=C2N1 M10268514P [1,0,0,0,0,0|2,1,0]=4 25 B13R2.45 N#CC=1NC2=C(C1C)C=CC=C2 M10119722P [0,1,0,0,0,0|3,0,0]=4 26 B13R2.45 NCC1=NC2=CC=CC=C2N1C M10163952P [0,1,0,0,0,0|2,0,1]=4 27 B13R2.45 O=CC1=NC2=CC=CC=C2N1C M10050166P [0,1,0,0,0,0|1,0,1]=3 28 B13R2.45 O=CC1=NC2=CC=CN=C2N1C M12277224P [0,1,0,0,0,0|2,0,1]=4 29 B13R2.135 N#CC1=C(C)NC2=C1C=CC=C2 M10257436P [0,1,0,0,0,0|3,0,0]=4 30 B13R2.135 O=C1NC2=C(C=CC=C2)\C1=N\O M10015697P [0,1,0,0,0,0|1,0,0]=2 31 B13R2.3028 CC1=C(C)NC2=C1C=C(Br)C=C2 M10064574P [0,1,0,0,0,0|3,0,0]=4 32 B13R2.3028 O=C1NC2=C(C=C(I)C=C2)C1=O M10167416P [0,1,0,0,0,0|1,0,1]=3 33 B13R2.3085 O=C1N(C)C2=C(C=CC=C2)C1=O M10039584P [0,1,0,0,0,0|1,0,1]=3 34 B13R2.4856 O=C1NC2=C(C(Cl)=CC=C2)C1=O M10090821P [0,1,0,0,0,0|1,0,1]=3 35 B11R1.40 C=CC(NC1=CC=CC=C1)=O M10041239P [0,0,1,0,0,0|2,0,0]=3 36 B11R1.40 C=CC(OC1=CC=CC=C1)=O M10023704P [0,0,1,0,0,0|3,0,0]=4 37 B11R1.40 CCC(CC1=CC=CC=C1)=O M10025082P [0,0,1,0,0,0|3,0,0]=4 38 B11R1.40 NCC(NC1=CC=CC=C1)=O M10092528P [0,0,1,0,0,0|2,0,0]=3 39 B11R1.40 O=C(OC1=CC=CC=C1)CBr M10016467P [0,0,1,0,0,0|3,0,0]=4 40 B13R2.369 O=C1NC2=C(C=CC=C2)NC1=O M10138641P [0,0,0,0,0,1|1,0,1]=3 41 B13R2.369 OC1=NC2=CC=CC=C2N=C1C M10128034P [0,0,0,0,0,1|2,0,1]=4 42 B13R2.369 OC1=NC2=CC=CC=C2N=C1Cl M10228171P [0,0,0,0,0,1|2,0,1]=4 43 B10R1.15 CC(C1=CC=CC=C1)C=O M10002231P [1,0,1,0,0,0|2,0,0]=4 44 B10R1.15 NCC(O)C1=CC=CC=C1 M10108745P [1,0,1,0,0,0|1,0,1]=4 45 B10R1.15 O=CC(Br)C1=CC=CC=C1 M10146045P [1,0,1,0,0,0|2,0,0]=4 46 B10R1.15 [O-]N(N=O)C1=CC=CC=C1 M12009619P [1,0,1,0,0,0|1,0,1]=4 47 B10R1.18 NC(NC1=CC=CC=C1)=N M10128144P [1,0,1,0,0,0|1,0,0]=3 48 B10R1.18 O=C([O-])CC1=CC=CC=C1 M10003981P [1,0,1,0,0,0|1,0,1]=4 49 B10R1.18 O=C([O-])CC1=CC=CC=C1 M10119708P [1,0,1,0,0,0|1,0,1]=4 50 B10R1.20 O=CC1=CC=CC=C1C=O M10198856P [1,0,1,0,0,0|1,0,1]=4 51 B10R1.20 O=CC1=CC=CC=C1CC M10177455P [1,0,1,0,0,0|2,0,0]=4 52 B10R1.20 O=CC1=CC=CC=C1OC M10005068P [1,0,1,0,0,0|2,0,0]=4 53 B10R1.61 NC1=CC=CC=C1N(C)C M10048152P [1,0,1,0,0,0|1,0,1]=4 54 B10R1.61 O=C(O)C1=CC=CC=C1I M11206439P [1,0,1,0,0,0|2,0,0]=4 55 B10R1.61 O=C(O)C1=CC=NC=C1N M10108414P [1,0,1,0,0,0|2,0,0]=4 56 B10R2.7 C12=C(NCC1)C=CC=C2 M10012277P [2,0,0,0,0,0|1,0,1]=4 57 B10R2.7 C12=C(NN=C1)C=CC=C2 M10007137P [2,0,0,0,0,0|2,0,0]=4 58 B10R2.7 C12=NC=CC=C1NC=C2 M10007177P [2,0,0,0,0,0|2,0,0]=4 59 B12R1.20 O=C(O)[C@@H](C1=CC=C(Cl)C=C1)O M10216318P [0,1,1,0,0,0|2,0,0]=4 60 B12R1.20 O=C(O)[C@H](C1=CC=C(Cl)C=C1)O M10464100P [0,1,1,0,0,0|2,0,0]=4 61 B12R1.20 OC(C1=CC=C(Cl)C=C1)C(O)=O M10101253P [0,1,1,0,0,0|2,0,0]=4 62 B12R1.34 O=C(OC)C(O)C1=CC=CC=C1 M10062314P [0,1,1,0,0,0|2,0,0]=4 63 B12R1.43 O=C(NC1=CC=CC=C1)N(C)C M10002902P [0,1,1,0,0,0|1,0,0]=3 64 B12R1.50 O=C(OC1=CC=CC(C)=C1)NC M10027599P [0,1,1,0,0,0|2,0,0]=4 65 B12R1.75 CC(NC1=CC=CC=C1OC)=O M11208233P [0,1,1,0,0,0|2,0,0]=4 66 B12R2.1 CCN1C=NC2=CC=CC=C12 M10100362P [1,1,0,0,0,0|1,0,1]=4 67 B12R2.1 OCC1=CNC2=C1C=CC=C2 M12278082P [1,1,0,0,0,0|1,0,0]=3 68 B12R2.132 CC1=CNC2=C1C=C(Br)C=C2 M10111834P [1,1,0,0,0,0|2,0,0]=4 69 B12R2.612 OC1=NNC2=C1C=CC(Br)=C2 M10020627P [1,1,0,0,0,0|2,0,0]=4 70 B12R2.32 CCC1=NC2=CC=CC=C2N1 M10037067P [1,1,0,0,0,0|1,0,1]=4 71 B12R2.32 ClCC1=NC2=CC=CC=C2N1 M10066841P [1,1,0,0,0,0|1,0,1]=4 72 B12R2.32 NCC1=NC2=CC=CC=C2N1 M10080603P [1,1,0,0,0,0|1,0,1]=4 73 B12R2.32 NCC1=NC2=CC=CC=C2N1 M10082648P [1,1,0,0,0,0|1,0,1]=4 74 B12R2.32 O=CC1=NC2=CC=CC=C2S1 M10094911P [1,1,0,0,0,0|1,0,1]=4 75 B12R2.32 O=CC=1NC2=C(C1)C=CC=C2 M10158452P [1,1,0,0,0,0|1,0,0]=3 76 B12R2.32 SCC1=NC2=CC=CC=C2N1 M10062188P [1,1,0,0,0,0|0,1,1]=4 77 B12R2.32 SCC1=NC2=CC=CC=C2N1 M10273945P [1,1,0,0,0,0|0,1,1]=4 78 B12R2.202 CC=1NC2=C(C1)C(=CC=C2)Br M10084067P [1,1,0,0,0,0|2,0,0]=4 79 B12R2.202 CC=1NC2=C(C1)C(=CC=C2)Cl M10084065P [1,1,0,0,0,0|2,0,0]=4 80 B12R2.202 NC1=NC2=C(C)C=CC=C2N1 M10799705P [1,1,0,0,0,0|1,0,1]=4 81 B12R2.202 O=C1CC2=C(C(Br)=CC=C2)C1 M10995921P [1,1,0,0,0,0|2,0,0]=4 82 B12R2.202 O=C1NC2=C(C(F)=CC=C2)C1 M10746032P [1,1,0,0,0,0|1,0,0]=3 83 B12R2.202 O=C1NC2=C(C=CC=C2Cl)C1 M10189161P [1,1,0,0,0,0|1,0,0]=3 84 B12R2.606 CC1=CC2=C(C=C1)C=C(C)N2 M10078600P [1,1,0,0,0,0|2,0,0]=4 85 B12R2.606 CC1=NC2=CC(Br)=CC=C2N1 M10038446P [1,1,0,0,0,0|1,0,1]=4 86 B12R2.606 CC1=NC2=CC(I)=CC=C2N1 M10047976P [1,1,0,0,0,0|1,0,1]=4 87 B12R2.606 CC=1NC2=C(C1)C=CC(=C2)Br M10084068P [1,1,0,0,0,0|2,0,0]=4 88 B12R2.606 CC=1NC2=C(C1)C=CC(=C2)Cl M10084066P [1,1,0,0,0,0|2,0,0]=4 89 B12R2.606 ClC1=NC2=CC(Br)=CC=C2N1 M10940741P [1,1,0,0,0,0|1,0,1]=4 90 B12R2.606 IC1=CC=C2NC(Cl)=NC2=C1 M10846944P [1,1,0,0,0,0|1,0,1]=4 91 B12R2.606 O=C1CC2=C(C=C(Br)C=C2)C1 M10802583P [1,1,0,0,0,0|2,0,0]=4 92 B12R2.606 O=C1CC2=CC(F)=CN=C2N1 M10110426P [1,1,0,0,0,0|2,0,0]=4 93 B12R2.606 O=C1CC2=NC(Cl)=CC=C2N1 M10742372P [1,1,0,0,0,0|2,0,0]=4 94 B12R2.606 O=C1CC2=NC=C(Cl)C=C2N1 M10742373P [1,1,0,0,0,0|2,0,0]=4 95 B12R2.606 O=C1NC2=C(C1)C=C(N=C2)Br M11115618P [1,1,0,0,0,0|2,0,0]=4 96 B12R2.606 O=C1NC2=C(C=C(C)C=C2)C1 M10054926P [1,1,0,0,0,0|1,0,0]=3 97 B12R2.606 O=C1NC2=C(C=C(O)C=C2)C1 M10054253P [1,1,0,0,0,0|1,0,0]=3 98 B12R2.606 O=C1NC2=C(C=CC(F)=C2)C1 M10287841P [1,1,0,0,0,0|1,0,0]=3 99 B12R2.606 O=C1NC2=C(C=CC(I)=C2)C1 M11056287P [1,1,0,0,0,0|1,0,0]=3 100 B12R2.606 O=C1NC2=C(C=CC(O)=C2)C1 M10096751P [1,1,0,0,0,0|1,0,0]=3 101 B12R2.606 O=C1OC2=CC(Br)=CN=C2N1 M10170975P [1,1,0,0,0,0|2,0,0]=4 102 B12R2.606 O=C1OC2=CC(Cl)=CN=C2N1 M10227848P [1,1,0,0,0,0|2,0,0]=4 103 B12R2.606 O=C1SC2=CC=C(Cl)C=C2N1 M10166542P [1,1,0,0,0,0|1,0,0]=3 104 B12R2.606 OC1=CC2=C(NC(C)=C2)C=C1 M10122665P [1,1,0,0,0,0|2,0,0]=4 105 B12R2.606 S=C1OC2=CC(Br)=CC=C2N1 M10184198P [1,1,0,0,0,0|1,1,0]=4 106 B12R2.606 S=C1SC2=CC(F)=CC=C2N1 M10478055P [1,1,0,0,0,0|1,1,0]=4 107 B14R2.8235 O=C1NC2=CC=C(Cl)C=C2C(O1)=O M10065868P [0,1,0,0,0,1|1,0,1]=4 108 B14R2.8235 O=C1OC(NC2=C1C=C(C=C2)F)=O M10008247P [0,1,0,0,0,1|1,0,1]=4 109 B14R2.28480 O=C1NC2=CC=CC(F)=C2C(O1)=O M10472839P [0,1,0,0,0,1|1,0,1]=4 110 B14R2.29365 O=C1NC(C2=C(N1)C=C(C=C2)Br)=O M10695724P [0,1,0,0,0,1|1,0,1]=4 111 B14R2.29365 O=C1NC(C2=C(N1)C=C(C=C2)Cl)=O M10121437P [0,1,0,0,0,1|1,0,1]=4 112 B14R2.29365 O=C1NC2=CC(C)=CC=C2C(O1)=O M10393100P [0,1,0,0,0,1|1,0,1]=4 113 B14R2.29365 O=C1OC(NC2=C1C=CC(=C2)Cl)=O M10244376P [0,1,0,0,0,1|1,0,1]=4 114 B14R2.450 O=C(C=1NC2=C(C1Br)C=CC=C2)O M10203373P [0,2,0,0,0,0|2,0,0]=4 115 B14R2.450 O=C(C=1NC2=C(C1Cl)C=CC=C2)O M10203372P [0,2,0,0,0,0|2,0,0]=4 116 B14R2.517 O=C1OC2=CC=CC=C2\C1=C\OC M10244014P [0,2,0,0,0,0|2,0,0]=4 117 B14R2.642 O=C(C1=C(C)NC2=C1C=CC=C2)O M10389875P [0,2,0,0,0,0|2,0,0]=4 118 B14R2.642 O=C1N(C(C)=C)C2=CC=CC=C2N1 M10263575P [0,2,0,0,0,0|1,0,0]=3 119 B14R2.645 O=C1NC2=C(C=C(Cl)C(Br)=C2)C1=O M10823360P [0,2,0,0,0,0|1,0,1]=4 120 B14R2.4506 O=C1NC2=C(C(Br)=C(C)C=C2)C1=O M10770977P [0,2,0,0,0,0|1,0,1]=4 121 B14R2.9184 O=C1NC2=C(C=C(Br)C=C2C)C1=O M10467615P [0,2,0,0,0,0|1,0,1]=4 122 B14R2.9184 O=C1NC2=C(C=C(C)C=C2C)C1=O M10240019P [0,2,0,0,0,0|1,0,1]=4 123 B14R2.9184 O=C1NC2=C(C=C(Cl)C=C2Cl)C1=O M10091245P [0,2,0,0,0,0|1,0,1]=4 124 B14R2.8620 O=C1NC2=C(C(Cl)=CC=C2Cl)C1=O M10156927P [0,2,0,0,0,0|1,0,1]=4 125 B14R2.27750 O=C1NC2=C(C(Br)=CC(Br)=C2)C1=O M10815979P [0,2,0,0,0,0|1,0,1]=4 126 B14R2.27750 O=C1NC2=C(C(F)=CC(F)=C2)C1=O M10724048P [0,2,0,0,0,0|1,0,1]=4 127 B14R2.1815 O=C1NC2=C(C=CC(OC)=C2)C1=O M10264777P [0,2,0,0,0,0|1,0,1]=4 128 B10R2.320 BrC1=CC2=CC=CC=C12 M10168858P [1,0,0,0,1,0|2,0,0]=4 129 B12R1.107 O=C(O)CN(C)C1=CC=CC=C1 M10172364P [0,0,1,0,0,1|2,0,0]=4 130 B12R1.107 O=C(O)CN(C)C1=CC=CC=C1 M10243459P [0,0,1,0,0,1|2,0,0]=4 131 B12R1.27 C=CC(NCC1=CC=CC=C1)=O M10122590P [0,0,1,0,0,1|2,0,0]=4 132 B12R1.27 O=C(NCC1=CC=CC=C1)CCl M10045433P [0,0,1,0,0,1|2,0,0]=4 133 B12R1.27 O=C(OC)CNC1=CC=CC=C1 M10121939P [0,0,1,0,0,1|2,0,0]=4