0 B11R1.40 CCC(CC1=CC=CC=C1)=O M10025082P [0,0,0,0,0,0|2,0,1]=3 1 B10R1.17 C=CCCC1=CC=CC=C1 M10020323P [1,0,0,0,0,0|1,0,1]=3 2 B10R1.17 CCNCC1=CC=NC=C1 M10220282P [1,0,0,0,0,0|3,0,0]=4 3 B10R1.17 CNCCC1=CC=CC=C1 M10060073P [1,0,0,0,0,0|0,0,0]=1 4 B10R1.17 CNCCC1=NC=CC=C1 M10024739P [1,0,0,0,0,0|1,0,0]=2 5 B10R1.17 N#CCNC1=CC=CC=C1 M10050129P [1,0,0,0,0,0|3,0,0]=4 6 B10R1.17 NCCNC1=CC=CC=C1 M10034407P [1,0,0,0,0,0|3,0,0]=4 7 B10R1.17 S=C=NCC1=CC=CC=C1 M10016600P [1,0,0,0,0,0|3,0,0]=4 8 B10R1.17 [C-]#[N+]CCC1=CC=CC=C1 M10309731P [1,0,0,0,0,0|0,0,2]=3 9 B10R1.18 CC(CC1=NC=CC=C1)=O M10087968P [1,0,0,0,0,0|2,0,1]=4 10 B10R1.18 CC(O)CC1=CC=CC=C1 M10018807P [1,0,0,0,0,0|1,0,0]=2 11 B10R1.18 CC(O)CC1=CC=CC=C1 M10133834P [1,0,0,0,0,0|1,0,0]=2 12 B10R1.18 CC(OC1=CC=CC=C1)C M10047209P [1,0,0,0,0,0|1,0,0]=2 13 B10R1.18 C[C@@H](O)CC1=CC=CC=C1 M10032962P [1,0,0,0,0,0|1,0,0]=2 14 B10R1.18 C[C@H](O)CC1=CC=CC=C1 M10032105P [1,0,0,0,0,0|1,0,0]=2 15 B10R1.18 NC(NC1=CC=CC=C1)=N M10128144P [1,0,0,0,0,0|2,0,1]=4 16 B10R1.18 O=C([O-])CC1=CC=CC=C1 M10003981P [1,0,0,0,0,0|2,0,1]=4 17 B10R1.18 O=C([O-])CC1=CC=CC=C1 M10119708P [1,0,0,0,0,0|2,0,1]=4 18 B12R1.32 C#CCN(CC1=CC=CC=C1)C M10007888P [0,1,0,0,0,0|2,0,1]=4 19 B12R1.32 CN(CCO)CC1=CC=CC=C1 M10002949P [0,1,0,0,0,0|2,0,0]=3 20 B12R1.34 O=C(OC)C(Br)C1=CC=CC=C1 M10050484P [0,1,0,0,0,0|2,0,1]=4 21 B12R1.34 O=C(OC)C(O)C1=CC=CC=C1 M10062314P [0,1,0,0,0,0|2,0,1]=4 22 B12R1.43 N[C@@H](CC1=CC=CC=C1)C(N)=O M10415967P [0,1,0,0,0,0|3,0,0]=4 23 B12R1.43 O=C(NC1=CC=CC=C1)N(C)C M10002902P [0,1,0,0,0,0|2,0,1]=4 24 B12R1.49 O=C(OC)CC1=CC=C(Br)C=C1 M10247030P [0,1,0,0,0,0|2,0,1]=4 25 B12R1.49 O=C(OC)CC1=CC=C(Cl)C=C1 M10265259P [0,1,0,0,0,0|2,0,1]=4 26 B12R1.49 OCC(N)CC1=CC=C(Cl)C=C1 M10227193P [0,1,0,0,0,0|3,0,0]=4 27 B12R1.50 O=C(OC)CC1=CC=CC(Cl)=C1 M10268727P [0,1,0,0,0,0|2,0,1]=4 28 B12R1.50 O=C(OC)CC1=CC=CC(N)=C1 M10267790P [0,1,0,0,0,0|2,0,1]=4 29 B12R1.50 O=C(OC)CC1=CC=CC(N)=C1 M10775534P [0,1,0,0,0,0|2,0,1]=4 30 B12R1.50 O=C(OC1=CC=CC(C)=C1)NC M10027599P [0,1,0,0,0,0|2,0,1]=4 31 B12R1.50 OCC(N)CC1=CC=CC(Cl)=C1 M10234610P [0,1,0,0,0,0|3,0,0]=4 32 B12R1.118 CCN(CC1=CC=CC=C1)CC M10020469P [0,1,0,0,0,0|2,0,0]=3 33 B12R1.118 OC[C@@H](NC)CC1=CC=CC=C1 M10499013P [0,1,0,0,0,0|0,0,0]=1 34 B12R1.371 O=C(OC)CC1=CC=CC=C1Br M10295408P [0,1,0,0,0,0|2,0,1]=4 35 B12R1.371 O=C(OC)CC1=CC=CC=C1Cl M10295407P [0,1,0,0,0,0|2,0,1]=4 36 B12R1.371 OCC(N)CC1=CC=CC=C1Cl M10234611P [0,1,0,0,0,0|3,0,0]=4 37 B12R2.18 OC1C(Br)CC2=C1C=CC=C2 M10072804P [0,0,0,1,0,0|3,0,0]=4 38 B12R2.18 O[C@@H]1[C@H](N)C2=C(C=CC=C2)C1 M10107049P [0,0,0,1,0,0|3,0,0]=4 39 B12R2.18 O[C@H]1[C@H](Br)CC2=C1C=CC=C2 M10114550P [0,0,0,1,0,0|3,0,0]=4 40 B12R2.24 CC1NC2=C(C=CC=C2)CC1 M10036158P [0,0,0,1,0,0|2,0,0]=3 41 B12R2.24 NC1CC2=C(C=CC=C2)CC1 M10049516P [0,0,0,1,0,0|2,0,0]=3 42 B12R2.24 NC1CNC2=C(C=CC=C2)C1 M10243335P [0,0,0,1,0,0|3,0,0]=4 43 B12R2.24 O=C1OCC2=C(C=CC=C2)C1 M10062650P [0,0,0,1,0,0|2,0,1]=4 44 B12R2.32 CNC1=NC2=CC=CC=C2S1 M10146211P [0,0,0,1,0,0|2,0,1]=4 45 B10R1.15 BrC(C#N)C1=CC=CC=C1 M10080535P [0,0,0,0,1,0|3,0,0]=4 46 B10R1.15 BrCC(O)C1=CC=CC=C1 M10828430P [0,0,0,0,1,0|3,0,0]=4 47 B10R1.15 C=CC(Cl)C1=CC=CC=C1 M10295196P [0,0,0,0,1,0|2,0,1]=4 48 B10R1.15 CC(C1=CC=CC=C1)C=O M10002231P [0,0,0,0,1,0|2,0,0]=3 49 B10R1.15 CC(C1=CC=CC=C1)CBr M10031082P [0,0,0,0,1,0|2,0,0]=3 50 B10R1.15 CC(C1=CC=CC=C1)CN M10165660P [0,0,0,0,1,0|2,0,0]=3 51 B10R1.15 CC(C1=CC=CC=C1)CO M10027348P [0,0,0,0,1,0|2,0,0]=3 52 B10R1.15 C[C@@H](NC)C1=CC=CC=C1 M10082047P [0,0,0,0,1,0|0,0,0]=1 53 B10R1.15 NC(CC)C1=CC=CC=C1 M10388570P [0,0,0,0,1,0|2,0,0]=3 54 B10R1.15 NCC(C)C1=CC=CC=C1 M10223405P [0,0,0,0,1,0|2,0,0]=3 55 B10R1.15 NCC(O)C1=CC=CC=C1 M10108745P [0,0,0,0,1,0|3,0,0]=4 56 B10R1.15 N[C@@H](C1=CC=CC=C1)CO M10168325P [0,0,0,0,1,0|3,0,0]=4 57 B10R1.15 O=CC(Br)C1=CC=CC=C1 M10146045P [0,0,0,0,1,0|3,0,0]=4 58 B10R1.27 CC(NC)CC1=CC=CS1 M10106016P [0,0,0,0,1,0|1,0,0]=2 59 B12R1.27 CCC(OCC1=CC=CC=C1)=O M10004505P [0,0,0,0,0,1|2,0,1]=4 60 B12R1.27 O=C(OC)CNC1=CC=CC=C1 M10121939P [0,0,0,0,0,1|2,0,1]=4 61 B12R1.27 O=C(OC)COC1=CC=CC=C1 M10039630P [0,0,0,0,0,1|2,0,1]=4 62 B12R1.27 OC(COC1=CC=CC=C1)CCl M12278730P [0,0,0,0,0,1|3,0,0]=4 63 B9R0.45 CCCC\C=C\C=C\C=O M10081789P [1,0,1,0,0,0|2,0,0]=4 64 B9R1.8 Br[Mg]CC1=CC=CC=C1 M10033223P [2,0,0,0,0,0|2,0,0]=4 65 B9R1.8 CCNC1=CC=CN=C1 M10217063P [2,0,0,0,0,0|2,0,0]=4 66 B9R1.8 COCC1=CC=CC=C1 M10013562P [2,0,0,0,0,0|1,0,0]=3 67 B9R1.8 Cl[Mg]CC1=CC=CC=C1 M10097238P [2,0,0,0,0,0|2,0,0]=4 68 B9R1.8 NCCC1=CC=CC=C1 M10005773P [2,0,0,0,0,0|0,0,0]=2 69 B9R1.8 NNCC1=CC=CC=C1 M10014053P [2,0,0,0,0,0|1,0,0]=3 70 B9R1.8 NOCC1=CC=CC=C1 M10016568P [2,0,0,0,0,0|1,0,0]=3 71 B9R1.8 NOCC1=CC=CC=C1 M10046733P [2,0,0,0,0,0|1,0,0]=3 72 B9R1.8 OCCC1=CC=NC=C1 M10071683P [2,0,0,0,0,0|2,0,0]=4 73 B9R1.8 ONCC1=CC=CC=C1 M10016566P [2,0,0,0,0,0|1,0,0]=3 74 B9R1.8 SCCC1=CC=CC=C1 M10062928P [2,0,0,0,0,0|1,0,0]=3 75 B9R1.8 [C-]#[N+]CC1=CC=CC=C1 M10114263P [2,0,0,0,0,0|0,0,2]=4 76 B11R1.1 CCCOC1=CC=C(Br)C=C1 M10241209P [1,1,0,0,0,0|2,0,0]=4 77 B11R1.1 OC1=CC=C(CCNC)C=C1 M10120289P [1,1,0,0,0,0|0,0,0]=2 78 B11R1.1 OC1=CC=C(OCCC)C=C1 M10158296P [1,1,0,0,0,0|2,0,0]=4 79 B11R1.1 OCCCC1=CC=C(Cl)C=C1 M10086861P [1,1,0,0,0,0|2,0,0]=4 80 B11R1.1 OCCCC1=CC=C(O)C=C1 M10113021P [1,1,0,0,0,0|2,0,0]=4 81 B11R1.16 CC(C1=CC=CC=C1)CNC M12025375P [1,1,0,0,0,0|0,0,0]=2 82 B11R1.16 N#CCC(O)C1=CC=CC=C1 M10147841P [1,1,0,0,0,0|2,0,0]=4 83 B11R1.16 OC(C1=CC=CC=C1)CCCl M10157240P [1,1,0,0,0,0|2,0,0]=4 84 B11R1.16 OCCC(N)C1=CC=CC=C1 M10132113P [1,1,0,0,0,0|2,0,0]=4 85 B11R1.17 OC1=CC=CC=C1OCCC M10086738P [1,1,0,0,0,0|2,0,0]=4 86 B11R1.17 OCCCC1=CC=CC=C1Br M10264247P [1,1,0,0,0,0|2,0,0]=4 87 B11R1.28 C=CCNCC1=CC=CC=C1 M10062629P [1,1,0,0,0,0|1,0,1]=4 88 B11R1.28 CCCCNC1=CC=CC=C1 M10027499P [1,1,0,0,0,0|1,0,0]=3 89 B11R1.28 ClCCCCC1=CC=NC=C1 M10070101P [1,1,0,0,0,0|2,0,0]=4 90 B11R1.28 ClCCCCC1=CC=NC=C1 M10774068P [1,1,0,0,0,0|2,0,0]=4 91 B11R1.28 ClCCOCC1=CC=CC=C1 M10148097P [1,1,0,0,0,0|2,0,0]=4 92 B11R1.28 NCCNCC1=CC=CC=C1 M10060507P [1,1,0,0,0,0|2,0,0]=4 93 B11R1.28 OCCCCC1=CC=NC=C1 M10070100P [1,1,0,0,0,0|2,0,0]=4 94 B11R1.28 OCCCOC1=CC=CC=C1 M10084703P [1,1,0,0,0,0|2,0,0]=4 95 B11R1.28 OCCOCC1=CC=CC=C1 M10016555P [1,1,0,0,0,0|2,0,0]=4 96 B11R1.91 CN(C)CCC1=CC=CC=C1 M10113667P [1,1,0,0,0,0|0,0,0]=2 97 B11R1.91 O=[N+](CCC1=CC=CC=C1)[O-] M10084031P [1,1,0,0,0,0|1,0,1]=4 98 B11R1.20 CC(CC1=CC=C(Br)C=C1)=O M10084753P [1,1,0,0,0,0|1,0,1]=4 99 B11R1.20 CC(CC1=CC=C(C)C=C1)=O M10039930P [1,1,0,0,0,0|1,0,1]=4 100 B11R1.20 CC(CC1=CC=C(Cl)C=C1)=O M10077945P [1,1,0,0,0,0|1,0,1]=4 101 B11R1.20 NC1=CC=C(OC(C)C)C=C1 M10109575P [1,1,0,0,0,0|1,0,0]=3 102 B11R1.36 CC(C)C(C1=CC=CC=C1)=O M10015939P [1,1,0,0,0,0|0,0,1]=3 103 B11R1.36 CC(F)C(C1=CC=CC=C1)=O M10168847P [1,1,0,0,0,0|1,0,1]=4 104 B11R1.36 O=C(N(C)C)C1=CC=CC=C1 M10015943P [1,1,0,0,0,0|1,0,1]=4 105 B11R1.86 CC(CC1=CC=CC=C1Br)=O M10172330P [1,1,0,0,0,0|1,0,1]=4 106 B11R1.86 CC(CC1=CC=CC=C1C)=O M10257313P [1,1,0,0,0,0|1,0,1]=4 107 B11R1.86 CC(CC1=CC=CC=C1Cl)=O M10088231P [1,1,0,0,0,0|1,0,1]=4 108 B11R1.86 CC(CC1=CC=CC=C1F)=O M10048160P [1,1,0,0,0,0|1,0,1]=4 109 B11R1.86 CC(CC1=CC=CC=C1O)=O M12278736P [1,1,0,0,0,0|1,0,1]=4 110 B11R1.86 OC1=CC=CC=C1CN(C)C M10188986P [1,1,0,0,0,0|1,0,0]=3 111 B11R1.86 OC1=CC=CC=C1OC(C)C M10192368P [1,1,0,0,0,0|1,0,0]=3 112 B11R1.157 CC(CC1=CC=CC(C)=C1)=O M10157550P [1,1,0,0,0,0|1,0,1]=4 113 B11R1.157 CC(CC1=CC=CC(Cl)=C1)=O M10128920P [1,1,0,0,0,0|1,0,1]=4 114 B11R1.157 CC(CC1=CC=CC(F)=C1)=O M10035565P [1,1,0,0,0,0|1,0,1]=4 115 B11R1.157 CC(OC1=CC(Br)=CC=C1)C M10733724P [1,1,0,0,0,0|1,0,0]=3 116 B11R1.509 C[N+](C)(C)CC1=CC=CC=C1 M10725831P [1,1,0,0,0,0|1,0,0]=3 117 B11R1.509 C[Si](C)(C)OC1=CC=CC=C1 M10032295P [1,1,0,0,0,0|1,1,0]=4 118 B11R1.7 OC(C)(C#C)C1=CC=CC=C1 M10004775P [0,1,0,0,1,0|1,0,1]=4 119 B11R1.12 CO[C@H](C1=CC=CC=C1)CO M10150609P [0,1,0,0,1,0|1,0,0]=3 120 B11R1.222 NC1=CC=CC=C1C(C)CC M10284438P [0,1,0,0,1,0|1,0,0]=3 121 B11R1.222 O=C(NC)C1=CC=CC=C1N M10060394P [0,1,0,0,1,0|1,0,1]=4 122 B11R1.222 O=C(NC)C1=CC=CC=C1S M10164094P [0,1,0,0,1,0|1,0,1]=4 123 B13R1.417 OCC(OCC1=CC=CC=C1)CO M10132769P [0,1,0,0,0,1|2,0,0]=4 124 B13R1.21 OC1=CC=C([C@H](O)[C@H](NC)C)C=C1 M10009323P [0,2,0,0,0,0|0,0,0]=2 125 B13R1.86 CC(C1=CC=CC=C1)C(OC)OC M10002015P [0,2,0,0,0,0|1,0,0]=3 126 B13R1.1073 O=C(O)[C@@](C)(N)CC1=CC=CC=C1 M10179012P [0,2,0,0,0,0|2,0,0]=4 127 B13R1.1073 O=C(O)[C@](C)(N)CC1=CC=CC=C1 M10148974P [0,2,0,0,0,0|2,0,0]=4 128 B13R1.249 O=S(CC1=CC=C(N)C=C1)(NC)=O M10672707P [0,2,0,0,0,0|2,0,0]=4 129 B13R1.250 OCC(C)(C)CC1=CC=CC(C)=C1 M10651866P [0,2,0,0,0,0|2,0,0]=4 130 B13R1.3080 O=P(CC1=CC=CC=C1)(OC)OC M10020489P [0,2,0,0,0,0|2,0,0]=4 131 B13R1.275 CC[N+](C)(CC1=CC=CC=C1Br)C M10000556P [0,2,0,0,0,0|2,0,0]=4 132 B11R2.1 CN1C2=CC=CC=C2N=C1 M10033964P [1,0,0,1,0,0|1,0,1]=4 133 B11R2.1 CN1N=NC2=CC=CC=C21 M10122945P [1,0,0,1,0,0|2,0,0]=4 134 B11R2.1 ClC1CCC2=C1C=CC=C2 M10226780P [1,0,0,1,0,0|2,0,0]=4 135 B11R2.1 NC1CCC2=C1C=CC=C2 M10437387P [1,0,0,1,0,0|2,0,0]=4 136 B11R2.1 N[C@H]1CCC2=C1C=CC=C2 M10217266P [1,0,0,1,0,0|2,0,0]=4 137 B11R2.1 N[C@H]1CCC2=C1C=CC=C2 M10330454P [1,0,0,1,0,0|2,0,0]=4 138 B11R2.1 OC1CCC2=C1C=CC=C2 M10090985P [1,0,0,1,0,0|2,0,0]=4 139 B11R2.238 [C@@H]1(CC2=CC=CC=C2)NC1 M10449917P [1,0,0,1,0,0|0,0,0]=2 140 B11R2.239 C1(C2=CC=CC=C2)CNC1 M10109190P [1,0,0,1,0,0|0,0,0]=2 141 B11R2.239 C1(C2=CC=CC=C2)COC1 M10114041P [1,0,0,1,0,0|1,0,0]=3 142 B11R2.239 C1(C2=CC=CC=C2)NCC1 M10175940P [1,0,0,1,0,0|2,0,0]=4 143 B13R2.57 OC[C@@H]1NCC2=C(C=CC=C2)C1 M10385612P [0,0,0,1,0,1|2,0,0]=4 144 B13R2.64 C1(CC2=CC=CC=C2)=NCCN1 M10000494P [0,1,0,1,0,0|0,0,1]=3 145 B13R2.64 C1(O[C@H]2CNCC2)=NC=CC=C1 M10124362P [0,1,0,1,0,0|2,0,0]=4 146 B13R2.45 NCC1=NC2=CC=CC=C2N1C M10163952P [0,1,0,1,0,0|1,0,1]=4 147 B13R2.435 O=C(C1CC2=C(C=CC=C2)C1)O M10188186P [0,1,0,1,0,0|2,0,0]=4 148 B13R2.3028 O=C1C(C)CC2=C1C=C(F)C=C2 M10234443P [0,1,0,1,0,0|2,0,0]=4 149 B13R2.3683 OC1=CC2=C(CN(C)CC2)C=C1 M10128765P [0,1,0,1,0,0|2,0,0]=4 150 B13R2.4825 O=C1C(C)CC2=C1C=CC=C2Br M10803012P [0,1,0,1,0,0|2,0,0]=4 151 B9R1.12 CCCCC1=CC=CS1 M10031024P [1,0,0,0,1,0|2,0,0]=4 152 B9R1.12 CCCCC1C=CC=C1 M10596335P [1,0,0,0,1,0|1,0,1]=4 153 B9R1.6 CC(N)C1=NC=CC=C1 M10247824P [1,0,0,0,1,0|1,0,0]=3 154 B9R1.6 CC(N)C1=NC=CN=C1 M10807558P [1,0,0,0,1,0|2,0,0]=4 155 B9R1.6 CC(O)C1=CC=CN=C1 M10066006P [1,0,0,0,1,0|2,0,0]=4 156 B9R1.6 C[C@@H](N)C1=NC=CC=C1 M10251364P [1,0,0,0,1,0|1,0,0]=3 157 B9R1.6 C[C@H](N)C1=NC=CC=C1 M10199865P [1,0,0,0,1,0|1,0,0]=3 158 B9R1.6 C[SiH](C)C1=CC=CC=C1 M10020227P [1,0,0,0,1,0|0,1,0]=3 159 B9R1.6 NC(C)C1=CC=CC=C1 M10209842P [1,0,0,0,1,0|0,0,0]=2 160 B9R1.13 CC(N)CC1=CC=CO1 M10295935P [1,0,0,0,1,0|1,0,0]=3 161 B13R1.718 CC(CBr)COCC1=CC=CC=C1 M12277792P [0,0,0,0,0,2|2,0,0]=4