0 B11R1.22 BrCC(Br)C1=CC=C(C=C1)Br S568422 [0,0,0,0,0,0|3,0,1]=4 1 B11R1.22 C/C(=N/O)/C1=CC=C(C=C1)Br PH008404 [0,0,0,0,0,0|2,0,2]=4 2 B11R1.22 C/C(=N\O)/C1=CC=C(C=C1)N PH010926 [0,0,0,0,0,0|2,0,2]=4 3 B11R1.22 C/C(=N\O)/C1=CC=C(C=C1)O PH004057 [0,0,0,0,0,0|2,0,2]=4 4 B11R1.22 C=CC(O)C1=CC=C(C=C1)Cl PH007653 [0,0,0,0,0,0|3,0,0]=3 5 B11R1.22 CC1=CC=C(C=C1)/C(=N/N)/C S323020 [0,0,0,0,0,0|2,0,1]=3 6 B11R1.22 CC1=CC=C(C=C1)/C(=N\O)/C S682802 [0,0,0,0,0,0|1,0,2]=3 7 B11R1.22 CC1=CC=C(C=C1)C(=O)C#N S34623 [0,0,0,0,0,0|2,0,2]=4 8 B11R1.22 CC1=CC=C(C=C1)S(=O)NN R279870 [0,0,0,0,0,0|4,0,0]=4 9 B11R1.22 CCC(Cl)C1=CC=C(C=C1)C S722235 [0,0,0,0,0,0|2,0,1]=3 10 B11R1.22 CCC(N)C1=CC=C(C=C1)C CBR02307 [0,0,0,0,0,0|2,0,1]=3 11 B11R1.22 CCC(N)C1=CC=C(C=C1)F CDS005688 [0,0,0,0,0,0|3,0,1]=4 12 B11R1.22 CCC(N)C1=CC=C(C=C1)O CBR00896 [0,0,0,0,0,0|3,0,1]=4 13 B11R1.22 CCC(O)C1=CC=C(C=C1)Br S434892 [0,0,0,0,0,0|3,0,1]=4 14 B11R1.22 CCC(O)C1=CC=C(C=C1)Cl S434884 [0,0,0,0,0,0|3,0,1]=4 15 B11R1.22 CCC(O)C1=CC=C(C=C1)F S434876 [0,0,0,0,0,0|3,0,1]=4 16 B11R1.22 CC[C@@H](O)C1=CC=C(C=C1)Cl PH018690 [0,0,0,0,0,0|3,0,1]=4 17 B11R1.22 CC[C@H](O)C1=CC=C(C=C1)Cl PH018691 [0,0,0,0,0,0|3,0,1]=4 18 B11R1.22 CN(C=O)C1=CC=C(C=C1)N PH009942 [0,0,0,0,0,0|2,0,0]=2 19 B11R1.22 CNC(=O)C1=CC=C(C=C1)C R580023 [0,0,0,0,0,0|3,0,1]=4 20 B11R1.22 CNC(C)C1=CC=C(C=C1)Cl CBR02474 [0,0,0,0,0,0|3,0,0]=3 21 B11R1.22 N#CC(O)C1=CC=C(C=C1)O PH015025 [0,0,0,0,0,0|3,0,1]=4 22 B11R1.22 NC(CF)C1=CC=C(C=C1)F CVT00026 [0,0,0,0,0,0|3,0,1]=4 23 B11R1.22 NC(CO)C1=CC=C(C=C1)Br CDS023854 [0,0,0,0,0,0|2,0,2]=4 24 B10R1.1 C(=O)NC1=CC=C(C=C1)C S580171 [1,0,0,0,0,0|1,0,0]=2 25 B10R1.1 C(=O)NC1=CC=C(C=C1)O S540560 [1,0,0,0,0,0|2,0,0]=3 26 B10R1.1 C=COC1=CC=C(C=C1)N CDS001792 [1,0,0,0,0,0|3,0,0]=4 27 B10R1.1 CC1=CC=C(C=C1)/C=N/O S907154 [1,0,0,0,0,0|1,0,2]=4 28 B10R1.1 CC1=CC=C(C=C1)C#CI RNI00066 [1,0,0,0,0,0|1,0,2]=4 29 B10R1.1 CC1=CC=C(C=C1)CNN CBR00829 [1,0,0,0,0,0|2,0,0]=3 30 B10R1.1 CC1=CC=C(C=N1)CNN PH019120 [1,0,0,0,0,0|3,0,0]=4 31 B10R1.1 CC1=CN=C(C=C1)CNN PH019260 [1,0,0,0,0,0|3,0,0]=4 32 B10R1.1 CC1=NC=C(C=C1)CCN CDS023206 [1,0,0,0,0,0|2,0,1]=4 33 B10R1.1 CCCC1=CC=C(C=C1)Cl CDS002895 [1,0,0,0,0,0|2,0,1]=4 34 B10R1.1 CCC[N+]1=CC=C(C=C1)C S635588 [1,0,0,0,0,0|2,0,1]=4 35 B10R1.1 CCSC1=CC=C(C=C1)C S832812 [1,0,0,0,0,0|2,0,1]=4 36 B10R1.1 CNCC1=CC=C(C=C1)C CDS014661 [1,0,0,0,0,0|2,0,0]=3 37 B10R1.1 COCC1=CC=C(C=C1)O S392596 [1,0,0,0,0,0|3,0,0]=4 38 B10R1.1 CSCC1=CC=C(C=C1)Br EME00156 [1,0,0,0,0,0|3,0,0]=4 39 B10R1.1 CSCC1=CC=C(C=C1)Cl S637947 [1,0,0,0,0,0|3,0,0]=4 40 B10R1.1 ClC1=CC=C(C=C1)/C=C/Br CDS004058 [1,0,0,0,0,0|2,0,1]=4 41 B10R1.1 FC1=CC=C(C=C1)CCCl CDS020717 [1,0,0,0,0,0|2,0,1]=4 42 B10R1.1 NNCC1=CC=C(C=C1)F CBR00828 [1,0,0,0,0,0|3,0,0]=4 43 B10R1.1 O=CNC1=CC=C(C=C1)F S576530 [1,0,0,0,0,0|2,0,0]=3 44 B10R1.1 [C-]#[N+]CC1=CC=C(C=C1)F PH015018 [1,0,0,0,0,0|3,0,0]=4 45 B10R1.13 C=C(C)C1=CC=C(C=C1)F CDS001211 [1,0,0,0,0,0|1,0,1]=3 46 B10R1.13 CC(=O)C1=CC=C(C=N1)C CBR02273 [1,0,0,0,0,0|1,0,1]=3 47 B10R1.13 CC(=O)C1=CC=C(N=C1)Cl CDS007858 [1,0,0,0,0,0|2,0,1]=4 48 B10R1.13 CC(=O)C1=CC=[N+](C=C1)C R228613 [1,0,0,0,0,0|1,0,1]=3 49 B10R1.13 CC(C)C1=CC=C(C=C1)F S362034 [1,0,0,0,0,0|1,0,1]=3 50 B10R1.13 CC(C)C1=CC=C(C=C1)S R262188 [1,0,0,0,0,0|1,0,1]=3 51 B10R1.13 CC1=CC=C(C=C1)C(=N)N CDS004524 [1,0,0,0,0,0|2,0,1]=4 52 B10R1.13 CC1=CC=C(C=C1)S(=O)O T212016 [1,0,0,0,0,0|2,0,0]=3 53 B10R1.13 CC1=CC=C(C=N1)[N+](=O)[O-] PH010163 [1,0,0,0,0,0|3,0,0]=4 54 B10R1.13 CC1=CC=C(N=C1)C(=O)O CDS015362 [1,0,0,0,0,0|2,0,1]=4 55 B10R1.13 CN(C)C1=CC=C(C=C1)S CDS006116 [1,0,0,0,0,0|2,0,1]=4 56 B10R1.13 C[N+]1=CC=C(C=C1)C(=O)O S407054 [1,0,0,0,0,0|2,0,1]=4 57 B10R1.13 C[N+]1=CC=C(C=C1)[S+](C)C S887838 [1,0,0,0,0,0|2,0,1]=4 58 B10R1.13 NC1=CC=C(C=C1)C(=O)O S820083 [1,0,0,0,0,0|2,0,1]=4 59 B10R1.13 NC1=CC=C(C=C1)C(=O)[O-] S571024 [1,0,0,0,0,0|2,0,1]=4 60 B10R1.13 O=C([O-])C1=CC=C(C=C1)I S840890 [1,0,0,0,0,0|2,0,1]=4 61 B10R1.13 O=S([O-])C1=CC=C(C=C1)Cl S614394 [1,0,0,0,0,0|3,0,0]=4 62 B10R1.13 O=[N+]([O-])C1=CC=C(C=C1)[O-] S592323 [1,0,0,0,0,0|3,0,0]=4 63 B10R1.15 C/C(=C/Br)/C1=CC=CC=C1 S881791 [1,0,0,0,0,0|1,0,1]=3 64 B10R1.15 CC(CBr)C1=CC=CC=C1 S461210 [1,0,0,0,0,0|1,0,1]=3 65 B10R1.15 CC(NN)C1=CC=CC=C1 PH009827 [1,0,0,0,0,0|2,0,0]=3 66 B10R1.15 CCN(C)C1=CC=CC=C1 R750956 [1,0,0,0,0,0|2,0,1]=4 67 B10R1.15 CN(N=O)C1=CC=CC=C1 PH000088 [1,0,0,0,0,0|2,0,0]=3 68 B10R1.15 CNC(C)C1=CC=CC=C1 CDS010605 [1,0,0,0,0,0|2,0,0]=3 69 B10R1.15 CNC(C)C1=CC=CC=C1 T172782 [1,0,0,0,0,0|2,0,0]=3 70 B10R1.15 ClCC(Cl)C1=CC=CC=C1 PH010970 [1,0,0,0,0,0|2,0,1]=4 71 B10R1.15 NC(CO)C1=CC=CC=C1 CDS003505 [1,0,0,0,0,0|1,0,2]=4 72 B10R1.15 NCC(Cl)C1=CC=CC=C1 PH012604 [1,0,0,0,0,0|2,0,1]=4 73 B12R1.5 CCC(O)C1=CC=C(C=C1)OC S434906 [0,1,0,0,0,0|2,0,1]=4 74 B12R1.5 CNC(C)C1=CC=C(C=C1)OC CBR00774 [0,1,0,0,0,0|2,0,0]=3 75 B12R1.5 COC1=CC=C(C=C1)/C(=N/O)/C PH011538 [0,1,0,0,0,0|1,0,2]=4 76 B12R1.5 COC1=CC=C(C=C1)C(N)CF CVT00027 [0,1,0,0,0,0|2,0,1]=4 77 B12R1.5 COC1=CC=C(C=C1)C(O)CN CDS005190 [0,1,0,0,0,0|2,0,1]=4 78 B12R1.9 C=CS(=O)(=O)C1=CC=C(C=C1)C S778230 [0,1,0,0,0,0|3,0,0]=4 79 B12R1.9 CC(C)(CN)C1=CC=C(C=C1)Cl OTV000618 [0,1,0,0,0,0|2,0,1]=4 80 B12R1.9 CC1=CC=C(C=C1)C(C)(C)CBr T332704 [0,1,0,0,0,0|1,0,1]=3 81 B12R1.9 CCC(C)(O)C1=CC=C(C=C1)Br S497274 [0,1,0,0,0,0|2,0,1]=4 82 B12R1.9 CC[Te](C)(I)C1=CC=C(C=C1)C S201103 [0,1,0,0,0,0|2,0,1]=4 83 B12R1.16 C=CCC(N)C1=CC=C(C=C1)F PH014951 [0,1,0,0,0,0|3,0,0]=4 84 B12R1.16 CC1=CC=C(C=C1)/C(=C/C#N)/Cl JRD0378 [0,1,0,0,0,0|2,0,1]=4 85 B12R1.16 CCCC(O)C1=CC=C(C=C1)C S446955 [0,1,0,0,0,0|2,0,1]=4 86 B12R1.16 C[C@@H](N=C=O)C1=CC=C(C=C1)F CDS019968 [0,1,0,0,0,0|1,0,1]=3 87 B12R1.16 C[C@H](N=C=O)C1=CC=C(C=C1)F CDS019969 [0,1,0,0,0,0|1,0,1]=3 88 B12R1.20 CC(=O)N(C)C1=CC=C(C=C1)Br S838691 [0,1,0,0,0,0|2,0,0]=3 89 B12R1.20 CC(=O)N(C)C1=CC=C(C=C1)Cl PH007239 [0,1,0,0,0,0|2,0,0]=3 90 B12R1.20 CC(=O)N(C)C1=CC=C(C=C1)N R750425 [0,1,0,0,0,0|2,0,0]=3 91 B12R1.20 CC(C(=O)O)C1=CC=C(C=C1)F S450359 [0,1,0,0,0,0|1,0,0]=2 92 B12R1.20 NC(C(=O)O)C1=CC=C(C=C1)O PH000116 [0,1,0,0,0,0|2,0,0]=3 93 B12R1.20 NC1=CC=C(C=C1)C(N)C(=O)O PH000028 [0,1,0,0,0,0|2,0,0]=3 94 B12R1.20 O=C(O)C(O)C1=CC=C(C=C1)Cl CDS019939 [0,1,0,0,0,0|2,0,0]=3 95 B12R1.367 CCC(C)C1=CC=C(C(=C1)Br)O PH010070 [0,1,0,0,0,0|2,0,1]=4 96 B12R1.367 CCC(C)C1=CC=C(C(=C1)N)O S626791 [0,1,0,0,0,0|2,0,1]=4 97 B12R1.367 CCC(C)C1=CC=C(C(=C1)O)O PH007367 [0,1,0,0,0,0|2,0,1]=4 98 B12R1.1703 C(=O)C(=O)C1=C(C=C(C=C1)F)F CDS022056 [0,1,0,0,0,0|2,0,1]=4 99 B12R1.1703 CC1=CC(=C(C=C1)/C(=N/O)/C)O L497398 [0,1,0,0,0,0|1,0,2]=4 100 B12R2.290 CC1=CC=C(C=C1)C2(CC2)N CBR00914 [0,0,0,1,0,0|2,0,1]=4 101 B12R2.612 CC1=CC=C2C(=C1)CCC2N CDS003487 [0,0,0,1,0,0|2,0,1]=4 102 B12R2.612 CN1C=CC2=C1C=CC(=C2)N CDS014563 [0,0,0,1,0,0|3,0,0]=4 103 B12R2.612 CN1C=NC2=CC(=CC=C12)Br CDS023161 [0,0,0,1,0,0|3,0,0]=4 104 B12R2.2302 FC1=CC=C(C=C1)C2CNC2 CDS020373 [0,0,0,1,0,0|2,0,1]=4 105 B12R1.49 CC1=CC=C(C=C1)CC(O)CCl S838438 [0,0,0,0,0,1|2,0,1]=4 106 B12R1.49 CNC(C)CC1=CC=C(C=C1)O S411558 [0,0,0,0,0,1|3,0,0]=4 107 B12R1.49 NC(CC1=CC=C(C=C1)O)N=O PH016710 [0,0,0,0,0,1|3,0,0]=4 108 B9R1.1 C(=O)C1=CC=C(C=N1)Cl CDS015696 [2,0,0,0,0,0|2,0,0]=4 109 B9R1.1 C(=O)C1=CC=C(C=N1)Cl SYX00294 [2,0,0,0,0,0|2,0,0]=4 110 B9R1.1 CC1=CC=C(C=C1)CS S369497 [2,0,0,0,0,0|0,1,0]=3 111 B9R1.1 CC1=CC=C(C=C1)S[TlH2] S828378 [2,0,0,0,0,0|2,0,0]=4 112 B9R1.1 CC1=CC=C(C=C1)[Hg]Cl S706736 [2,0,0,0,0,0|2,0,0]=4 113 B9R1.1 CC1=CC=C(N=C1)C=O SYX00325 [2,0,0,0,0,0|1,0,0]=3 114 B9R1.1 CC1=CC=C(N=C1)CN CDS009272 [2,0,0,0,0,0|2,0,0]=4 115 B9R1.1 CCC1=CC=[N+](C=C1)[O-] S869325 [2,0,0,0,0,0|2,0,0]=4 116 B9R1.1 CNC1=CC=C(C=C1)N TMT00162 [2,0,0,0,0,0|2,0,0]=4 117 B9R1.1 CNC1=CC=C(C=C1)[O-] R580708 [2,0,0,0,0,0|2,0,0]=4 118 B9R1.1 COC1=CC=[N+](C=C1)C S523216 [2,0,0,0,0,0|2,0,0]=4 119 B9R1.1 CSC1=CC=C(C=C1)Cl S633658 [2,0,0,0,0,0|2,0,0]=4 120 B9R1.1 CSC1=CC=C(C=C1)N S418595 [2,0,0,0,0,0|2,0,0]=4 121 B9R1.1 NCC1=CC=C(C=C1)F R750263 [2,0,0,0,0,0|2,0,0]=4 122 B9R1.1 NCC1=CC=C(C=C1)I CDS000797 [2,0,0,0,0,0|2,0,0]=4 123 B9R1.1 O=CC1=CC=C(C=N1)F CDS005163 [2,0,0,0,0,0|2,0,0]=4 124 B9R1.1 O=CC1=CC=C(N=C1)O CDS004063 [2,0,0,0,0,0|2,0,0]=4 125 B9R1.1 O=CC1=CNC(=O)C=C1 CDS007603 [2,0,0,0,0,0|2,0,0]=4 126 B9R1.8 C(=O)NC1=CN=CC=C1 S243426 [2,0,0,0,0,0|2,0,0]=4 127 B9R1.8 Cl[Hg]CC1=CC=CC=C1 S810894 [2,0,0,0,0,0|2,0,0]=4 128 B9R1.8 I[Hg]CC1=CC=CC=C1 S838705 [2,0,0,0,0,0|2,0,0]=4 129 B9R1.8 NOCC1=CC=CC=C1 CDS001502 [2,0,0,0,0,0|2,0,0]=4 130 B9R1.6 CC(Br)C1=NC=CC=C1 CDS022641 [2,0,0,0,0,0|2,0,0]=4 131 B9R1.6 CC(C)C1=CC=NC=C1 R751863 [2,0,0,0,0,0|1,0,1]=4 132 B9R1.6 CC(N)C1=CC=CN=C1 BOG00119 [2,0,0,0,0,0|2,0,0]=4 133 B9R1.6 CC(N)C1=CC=CN=C1 CDS005298 [2,0,0,0,0,0|2,0,0]=4 134 B9R1.6 CC(S)C1=CC=CC=C1 CDS000677 [2,0,0,0,0,0|0,1,0]=3 135 B9R1.6 CN(N)C1=CC=CC=C1 S416320 [2,0,0,0,0,0|2,0,0]=4 136 B9R1.6 C[Te+](C)C1=CC=CC=C1 S14878 [2,0,0,0,0,0|1,0,1]=4 137 B9R1.6 O=C([O-])C1=CC=CC=C1 S518174 [2,0,0,0,0,0|1,0,1]=4 138 B9R1.6 O=S(O)C1=CC=CC=C1 S812617 [2,0,0,0,0,0|2,0,0]=4 139 B11R1.1 C(=O)NNC1=CC=C(C=C1)C R751820 [1,1,0,0,0,0|1,0,0]=3 140 B11R1.1 C=CCOC1=CC=C(C=C1)C S433047 [1,1,0,0,0,0|1,0,0]=3 141 B11R1.1 C=CCSC1=CC=C(C=C1)Br S767891 [1,1,0,0,0,0|2,0,0]=4 142 B11R1.1 C=CCSC1=CC=C(C=C1)C S648388 [1,1,0,0,0,0|1,0,0]=3 143 B11R1.1 CC1=CC=C(C=C1)C=CC#N S434132 [1,1,0,0,0,0|1,0,1]=4 144 B11R1.1 CC1=CC=C(C=C1)CCNN PH018986 [1,1,0,0,0,0|1,0,1]=4 145 B11R1.1 CC1=CC=C(C=C1)OCC#N S114081 [1,1,0,0,0,0|1,0,1]=4 146 B11R1.1 CC1=CC=C(C=C1)OCCBr PH000131 [1,1,0,0,0,0|1,0,1]=4 147 B11R1.1 CC1=CC=C(C=C1)OCCN OTV000145 [1,1,0,0,0,0|1,0,1]=4 148 B11R1.1 CC1=CC=C(C=C1)SCCO S550264 [1,1,0,0,0,0|0,0,2]=4 149 B11R1.1 CCCSC1=CC=C(C=C1)C S832839 [1,1,0,0,0,0|1,0,1]=4 150 B11R1.1 CSCSC1=CC=C(C=C1)C S592749 [1,1,0,0,0,0|2,0,0]=4 151 B11R1.1 O=CCCC1=CC=C(C=C1)F CDS022638 [1,1,0,0,0,0|1,0,0]=3 152 B11R1.1 O=CCCC1=CC=C(C=C1)O CDS022892 [1,1,0,0,0,0|1,0,0]=3 153 B11R1.1 O=CNNC1=CC=C(C=C1)Br PH007135 [1,1,0,0,0,0|2,0,0]=4 154 B11R1.20 C=C(C)CC1=CC=C(C=C1)O PH007153 [1,1,0,0,0,0|2,0,0]=4 155 B11R1.20 CC(=O)CC1=CC=C(C=C1)Cl CDS004628 [1,1,0,0,0,0|1,0,0]=3 156 B11R1.20 CC(=O)CC1=CC=C(C=C1)O PH011294 [1,1,0,0,0,0|1,0,0]=3 157 B11R1.20 CC(=O)CC1=CC=C(C=N1)C CBR01484 [1,1,0,0,0,0|1,0,0]=3 158 B11R1.20 CC(=O)NC1=CC=C(C=C1)F S397075 [1,1,0,0,0,0|2,0,0]=4 159 B11R1.20 CC(=O)NC1=CC=C(C=C1)I S872970 [1,1,0,0,0,0|2,0,0]=4 160 B11R1.20 CC(=O)NC1=CC=C(C=C1)[O-] S829218 [1,1,0,0,0,0|2,0,0]=4 161 B11R1.20 CC(=O)NC1=NC=C(C=C1)C S803375 [1,1,0,0,0,0|2,0,0]=4 162 B11R1.20 CC(=O)SC1=CC=C(C=C1)C S836516 [1,1,0,0,0,0|1,0,0]=3 163 B11R1.20 CC1=CC=C(C=C1)CC(=O)Cl CDS008580 [1,1,0,0,0,0|0,0,0]=2 164 B11R1.20 CC1=CC=C(C=C1)CC(=O)N S536768 [1,1,0,0,0,0|0,0,0]=2 165 B11R1.20 CC1=CC=C(C=C1)NC(=N)N S614556 [1,1,0,0,0,0|2,0,0]=4 166 B11R1.20 CC1=CC=C(C=C1)NC(=N)N S862371 [1,1,0,0,0,0|2,0,0]=4 167 B11R1.20 CC1=CC=C(C=C1)NC(=O)N S365149 [1,1,0,0,0,0|1,0,0]=3 168 B11R1.20 CC1=CC=C(C=C1)NC(=S)N R612898 [1,1,0,0,0,0|1,1,0]=4 169 B11R1.20 CC1=CC=C(C=N1)CC(=O)O CDS019833 [1,1,0,0,0,0|1,0,0]=3 170 B11R1.20 CC1=CC=[N+](C=C1)CC(=O)N S242551 [1,1,0,0,0,0|1,0,0]=3 171 B11R1.20 NC(=O)CC1=CC=C(C=C1)Cl CDS011494 [1,1,0,0,0,0|1,0,0]=3 172 B11R1.20 NC(=O)NC1=CC=C(C=C1)Cl S441228 [1,1,0,0,0,0|2,0,0]=4 173 B11R1.20 NC(=O)NC1=CC=C(C=C1)F S601527 [1,1,0,0,0,0|2,0,0]=4 174 B11R1.20 NC(=S)CC1=CC=C(C=C1)Cl PH011776 [1,1,0,0,0,0|1,1,0]=4 175 B11R1.20 NC1=CC=C(C=C1)CC(=S)O R466522 [1,1,0,0,0,0|1,0,1]=4 176 B11R1.20 O=C(Br)NC1=CC=C(C=C1)Br S280003 [1,1,0,0,0,0|2,0,0]=4 177 B11R1.20 O=C(Cl)SC1=CC=C(C=C1)Cl S592773 [1,1,0,0,0,0|2,0,0]=4 178 B11R1.20 O=C(O)CC1=CC=C(N=C1)Cl CDS003355 [1,1,0,0,0,0|2,0,0]=4 179 B11R1.81 C(=O)NC1=C(C=C(C=C1)Cl)Cl S576786 [1,1,0,0,0,0|2,0,0]=4 180 B11R1.81 CC1=C(C=CC(=C1)Br)NC=O S624586 [1,1,0,0,0,0|2,0,0]=4 181 B11R1.81 CC1=C(C=CC(=C1)Cl)NC=O S576395 [1,1,0,0,0,0|2,0,0]=4 182 B11R1.81 CC1=CC(=C(C=C1)CC=O)C PH015341 [1,1,0,0,0,0|0,0,0]=2 183 B11R1.81 O=CNC1=C(C=C(C=C1)Br)Cl S746355 [1,1,0,0,0,0|2,0,0]=4 184 B11R1.83 CCC1=CC=C(C=C1)CC#N PH014677 [1,1,0,0,0,0|1,0,1]=4 185 B11R1.83 CCC1=CC=C(C=C1)CNC CDS016027 [1,1,0,0,0,0|2,0,0]=4 186 B11R1.83 CCC1=CC=C(C=C1)NC=O S623113 [1,1,0,0,0,0|1,0,0]=3 187 B11R1.83 CNCC1=CC=C(C=C1)OC CDS003884 [1,1,0,0,0,0|2,0,0]=4 188 B11R1.83 COC1=CC=C(C=C1)CON CDS015332 [1,1,0,0,0,0|2,0,0]=4 189 B11R1.83 COC1=CC=C(C=C1)CSC S698008 [1,1,0,0,0,0|2,0,0]=4 190 B11R1.83 COCC1=CC=C(C=C1)OC S866288 [1,1,0,0,0,0|2,0,0]=4 191 B11R1.83 CSC1=CC=C(C=C1)CNN PH018710 [1,1,0,0,0,0|2,0,0]=4 192 B11R1.83 [C-]#[N+]CC1=CC=C(C=C1)OC PH014520 [1,1,0,0,0,0|2,0,0]=4 193 B11R1.192 C(=O)NC1=CC(=C(C=C1)C)C S399191 [1,1,0,0,0,0|1,0,0]=3 194 B11R1.192 C(=O)NC1=CC(=C(C=C1)Cl)Cl S580163 [1,1,0,0,0,0|2,0,0]=4 195 B11R1.192 CC1=C(C=C(C=C1)NC=O)Cl S714062 [1,1,0,0,0,0|1,0,0]=3 196 B11R1.192 CC1=CC=C(C=C1C)CCN CDS003135 [1,1,0,0,0,0|1,0,1]=4 197 B11R1.192 CC1=CC=C(C=C1C)CON PH013762 [1,1,0,0,0,0|2,0,0]=4 198 B11R1.3 C#CC1=CC=C(C=C1)C(C)C CDS003828 [1,1,0,0,0,0|0,0,2]=4 199 B11R1.3 CC(C)C1=CC=C(C=C1)CN L481181 [1,1,0,0,0,0|0,0,1]=3 200 B11R1.3 CC(C)C1=CC=C(C=C1)CN S362883 [1,1,0,0,0,0|0,0,1]=3 201 B11R1.3 CCC1=CC=C(C=C1)C(=O)N TMT00666 [1,1,0,0,0,0|1,0,1]=4 202 B11R1.3 CCC1=CC=C(C=C1)C(C)N CBR00761 [1,1,0,0,0,0|1,0,0]=3 203 B11R1.3 CCC1=CC=C(C=C1)C(C)N OTV000097 [1,1,0,0,0,0|1,0,0]=3 204 B11R1.3 CCC1=CC=C(C=C1)[N+](=O)[O-] R750689 [1,1,0,0,0,0|2,0,0]=4 205 B11R1.3 COC1=CC=C(C=C1)[Te](=O)Cl S50289 [1,1,0,0,0,0|2,0,0]=4 206 B11R1.3 ClCC1=CC=C(C=C1)C(Cl)Cl PH007301 [1,1,0,0,0,0|2,0,0]=4 207 B11R1.3 NC(=O)C1=CC=C(C=C1)CBr CDS007483 [1,1,0,0,0,0|1,0,1]=4 208 B11R1.3 O=C(Cl)C1=CC=C(C=C1)CBr S283436 [1,1,0,0,0,0|1,0,1]=4 209 B11R1.3 O=[N+]([O-])C1=CC=C(C=C1)CI S534765 [1,1,0,0,0,0|2,0,0]=4 210 B11R1.19 CC(C)(N)C1=CC=C(C=C1)Cl OTV000619 [1,1,0,0,0,0|1,0,1]=4 211 B11R1.19 CC(C)(N)C1=CC=C(C=C1)F OTV000626 [1,1,0,0,0,0|1,0,1]=4 212 B11R1.19 CC1=CC=C(C=C1)C(C)(C)N PH010321 [1,1,0,0,0,0|0,0,1]=3 213 B11R1.19 CC1=CC=C(C=C1)S(=O)(=O)Br PH010299 [1,1,0,0,0,0|2,0,0]=4 214 B11R1.19 CC1=CC=C(C=C1)S(=O)(=O)O OMC00049 [1,1,0,0,0,0|2,0,0]=4 215 B11R1.19 CC1=CC=C(C=C1)S(=O)(=O)O OMC00050 [1,1,0,0,0,0|2,0,0]=4 216 B11R1.19 CC1=CC=C(C=C1)S(=O)(=O)O PH013111 [1,1,0,0,0,0|2,0,0]=4 217 B11R1.19 CC1=CC=C(C=C1)S(=O)(=O)O PH013337 [1,1,0,0,0,0|2,0,0]=4 218 B11R1.19 CC1=CC=C(C=C1)S(=O)(=O)O PH013753 [1,1,0,0,0,0|2,0,0]=4 219 B11R1.19 CC1=CC=C(C=C1)S(=O)(=O)O R162280 [1,1,0,0,0,0|2,0,0]=4 220 B11R1.19 CC1=CC=C(C=C1)S(=O)(=O)O R466972 [1,1,0,0,0,0|2,0,0]=4 221 B11R1.19 CC1=CC=C(C=C1)S(=O)(=O)O S430110 [1,1,0,0,0,0|2,0,0]=4 222 B11R1.19 CC1=CC=C(C=C1)S(=O)(=O)O S500577 [1,1,0,0,0,0|2,0,0]=4 223 B11R1.19 CC1=CC=C(C=C1)S(=O)(=O)O S500623 [1,1,0,0,0,0|2,0,0]=4 224 B11R1.19 CC1=CC=C(C=C1)S(=O)(=O)O S656747 [1,1,0,0,0,0|2,0,0]=4 225 B11R1.19 CC1=CC=C(C=C1)S(=O)(=O)O S822663 [1,1,0,0,0,0|2,0,0]=4 226 B11R1.19 CC1=CC=C(C=C1)S(=O)(=O)O S862304 [1,1,0,0,0,0|2,0,0]=4 227 B11R1.19 CC1=CC=C(C=C1)S(=O)(=O)O S862495 [1,1,0,0,0,0|2,0,0]=4 228 B11R1.19 CC1=CC=C(C=C1)S(=O)(=O)O S862509 [1,1,0,0,0,0|2,0,0]=4 229 B11R1.19 CC1=CC=C(C=C1)S(=O)(=O)O S862517 [1,1,0,0,0,0|2,0,0]=4 230 B11R1.19 CC1=CC=C(C=C1)S(=O)(=O)O S862541 [1,1,0,0,0,0|2,0,0]=4 231 B11R1.19 CC1=CC=C(C=C1)S(=O)(=O)O S862568 [1,1,0,0,0,0|2,0,0]=4 232 B11R1.19 CC1=CC=C(C=C1)S(=O)(=O)O S896683 [1,1,0,0,0,0|2,0,0]=4 233 B11R1.19 CC1=CC=C(C=C1)S(=O)(=O)O T181021 [1,1,0,0,0,0|2,0,0]=4 234 B11R1.19 CC1=CC=C(C=C1)S(=O)(=O)O T181307 [1,1,0,0,0,0|2,0,0]=4 235 B11R1.19 CC1=CC=C(C=C1)S(=O)(=O)[O-] CDS021472 [1,1,0,0,0,0|2,0,0]=4 236 B11R1.19 CC1=CC=C(C=C1)S(=O)(=O)[O-] R428396 [1,1,0,0,0,0|2,0,0]=4 237 B11R1.19 CC1=CC=C(C=C1)S(=O)(=O)[O-] R461695 [1,1,0,0,0,0|2,0,0]=4 238 B11R1.19 CC1=CC=C(C=C1)S(=O)(=O)[O-] R646989 [1,1,0,0,0,0|2,0,0]=4 239 B11R1.19 CC1=CC=C(C=C1)S(=O)(=O)[O-] R647012 [1,1,0,0,0,0|2,0,0]=4 240 B11R1.19 CC1=CC=C(C=C1)S(=O)(=O)[O-] R662836 [1,1,0,0,0,0|2,0,0]=4 241 B11R1.19 CC1=CC=C(C=C1)S(=O)(=O)[O-] R786624 [1,1,0,0,0,0|2,0,0]=4 242 B11R1.19 CC1=CC=C(C=C1)S(=O)(=O)[O-] S22714 [1,1,0,0,0,0|2,0,0]=4 243 B11R1.19 CC1=CC=C(C=C1)S(=O)(=O)[O-] S241970 [1,1,0,0,0,0|2,0,0]=4 244 B11R1.19 CC1=CC=C(C=C1)S(=O)(=O)[O-] S244112 [1,1,0,0,0,0|2,0,0]=4 245 B11R1.19 CC1=CC=C(C=C1)S(=O)(=O)[O-] S283258 [1,1,0,0,0,0|2,0,0]=4 246 B11R1.19 CC1=CC=C(C=C1)S(=O)(=O)[O-] S283304 [1,1,0,0,0,0|2,0,0]=4 247 B11R1.19 CC1=CC=C(C=C1)S(=O)(=O)[O-] S292257 [1,1,0,0,0,0|2,0,0]=4 248 B11R1.19 CC1=CC=C(C=C1)S(=O)(=O)[O-] S312258 [1,1,0,0,0,0|2,0,0]=4 249 B11R1.19 CC1=CC=C(C=C1)S(=O)(=O)[O-] S384585 [1,1,0,0,0,0|2,0,0]=4 250 B11R1.19 CC1=CC=C(C=C1)S(=O)(=O)[O-] S47512 [1,1,0,0,0,0|2,0,0]=4 251 B11R1.19 CC1=CC=C(C=C1)S(=O)(=O)[O-] S487325 [1,1,0,0,0,0|2,0,0]=4 252 B11R1.19 CC1=CC=C(C=C1)S(=O)(=O)[O-] S638765 [1,1,0,0,0,0|2,0,0]=4 253 B11R1.19 CC1=CC=C(C=C1)S(=O)(=O)[O-] S638862 [1,1,0,0,0,0|2,0,0]=4 254 B11R1.19 CC1=CC=C(C=C1)S(=O)(=O)[O-] S64670 [1,1,0,0,0,0|2,0,0]=4 255 B11R1.19 CC1=CC=C(C=C1)S(=O)(=O)[O-] S922897 [1,1,0,0,0,0|2,0,0]=4 256 B11R1.19 CC1=CC=C(C=C1)S(=O)(=O)[O-] T306266 [1,1,0,0,0,0|2,0,0]=4 257 B11R1.19 CC1=CC=C(C=C1)[Te](C)(Br)Br S200956 [1,1,0,0,0,0|2,0,0]=4 258 B11R1.19 CC1=CC=C(C=C1)[Te](C)(C)I S200972 [1,1,0,0,0,0|1,0,1]=4 259 B11R1.19 CC1=CC=C(C=C1)[Te](C)(Cl)Cl S200948 [1,1,0,0,0,0|2,0,0]=4 260 B11R1.19 CS(=O)(=O)C1=CC=C(C=C1)N CDS012661 [1,1,0,0,0,0|2,0,0]=4 261 B11R1.21 C=C(C)C1=CC=C(C(=C1)Cl)Cl PH007056 [1,1,0,0,0,0|1,0,1]=4 262 B11R1.21 CC(=O)C1=CC(=C(C=C1)C)N CBR02053 [1,1,0,0,0,0|0,0,1]=3 263 B11R1.21 CC(=O)C1=CC(=C(C=C1)O)O R174114 [1,1,0,0,0,0|1,0,1]=4 264 B11R1.21 CC(=O)C1=CC=C(C(=C1)F)O CDS002790 [1,1,0,0,0,0|1,0,1]=4 265 B11R1.21 CC(=O)C1=CC=C(C(=C1)N)Cl JRD0473 [1,1,0,0,0,0|1,0,1]=4 266 B11R1.21 CC(=O)C1=CC=C(C(=C1)N)F JRD0487 [1,1,0,0,0,0|1,0,1]=4 267 B11R1.21 CC(C)C1=CC(=C(C=C1)N)N CDS009515 [1,1,0,0,0,0|1,0,1]=4 268 B11R1.21 CC(C)C1=CC=C(C(=C1)N)O S818887 [1,1,0,0,0,0|1,0,1]=4 269 B11R1.21 CC(N)C1=CC=C(C(=C1)F)F CDS011131 [1,1,0,0,0,0|2,0,0]=4 270 B11R1.21 CC(O)C1=CC=C(C(=C1)Cl)Cl S345539 [1,1,0,0,0,0|1,0,1]=4 271 B11R1.21 CC1=CC=C(C=C1C)C(C)C S412686 [1,1,0,0,0,0|0,0,1]=3 272 B11R1.21 CC1=CC=C(C=C1Cl)C(=O)N S716782 [1,1,0,0,0,0|1,0,1]=4 273 B11R1.21 CC1=CC=C(C=C1I)[N+](=O)[O-] S432938 [1,1,0,0,0,0|2,0,0]=4 274 B11R1.21 CC1=CC=C(C=C1O)N(C)C PH006982 [1,1,0,0,0,0|1,0,1]=4 275 B11R1.166 CC(=O)C1=C(C=C(C=C1)Br)F SYX00307 [1,1,0,0,0,0|1,0,1]=4 276 B11R1.166 CC(=O)C1=CC=C(C=C1O)Br JRD0831 [1,1,0,0,0,0|1,0,1]=4 277 B11R1.166 CC(=O)C1=CC=C(C=C1O)N CDS015316 [1,1,0,0,0,0|1,0,1]=4 278 B11R1.166 CC(N)C1=CC=C(C=C1Cl)Cl CDS000450 [1,1,0,0,0,0|2,0,0]=4 279 B11R1.166 CC(O)C1=CC=C(C=C1Cl)Cl R161403 [1,1,0,0,0,0|1,0,1]=4 280 B11R1.166 CC(O)C1=CC=C(C=C1Cl)Cl S463965 [1,1,0,0,0,0|1,0,1]=4 281 B11R1.166 CC1=CC(=C(C=C1)C(=O)O)F CDS003230 [1,1,0,0,0,0|1,0,1]=4 282 B11R1.166 CC1=CC=C(C(=C1)Br)C(C)C S406864 [1,1,0,0,0,0|0,0,1]=3 283 B11R1.166 CC1=CC=C(C(=C1)Cl)N(C)C S504149 [1,1,0,0,0,0|1,0,1]=4 284 B11R1.166 CC1=CC=C(C(=C1)O)C(=O)N CDS013983 [1,1,0,0,0,0|1,0,1]=4 285 B11R1.166 CC1=CC=C(C(=C1)S)C(C)C PH007971 [1,1,0,0,0,0|0,0,1]=3 286 B11R1.166 C[C@@H](O)C1=CC=C(C=C1Cl)F CDS023126 [1,1,0,0,0,0|1,0,1]=4 287 B11R1.166 C[C@H](O)C1=CC=C(C=C1Cl)F CDS023125 [1,1,0,0,0,0|1,0,1]=4 288 B11R1.7 CCC(C)(N)C1=CC=CC=C1 S333697 [1,1,0,0,0,0|1,0,1]=4 289 B11R1.7 CCC(C)(N)C1=CC=CC=C1 S486078 [1,1,0,0,0,0|1,0,1]=4 290 B11R1.7 CCC(C)(N)C1=CC=CC=C1 S494992 [1,1,0,0,0,0|1,0,1]=4 291 B11R1.7 CCC(C)(N)C1=CC=CC=C1 S497304 [1,1,0,0,0,0|1,0,1]=4 292 B11R1.7 COC(C)(C)C1=CC=CC=C1 S713104 [1,1,0,0,0,0|2,0,0]=4 293 B11R1.12 C(=O)C(C=O)C1=CC=NC=C1 L307416 [1,1,0,0,0,0|1,0,1]=4 294 B11R1.12 CCC(CC)C1=CC=CC=C1 S109592 [1,1,0,0,0,0|1,0,1]=4 295 B11R1.12 CCC(CC)C1=CC=CC=C1 S37940 [1,1,0,0,0,0|1,0,1]=4 296 B11R1.12 CCC(NC)C1=CC=CC=C1 CDS000205 [1,1,0,0,0,0|1,0,1]=4 297 B11R1.12 N#CC(C=O)C1=CC=CC=C1 PH011096 [1,1,0,0,0,0|0,0,1]=3 298 B11R1.16 C(=O)NC(C)C1=CC=CC=C1 S520349 [1,1,0,0,0,0|0,0,0]=2 299 B11R1.16 C=CCN(C)C1=CC=CC=C1 S438677 [1,1,0,0,0,0|2,0,0]=4 300 B11R1.16 CC(/C=N/O)C1=CC=CC=C1 S619094 [1,1,0,0,0,0|0,0,1]=3 301 B11R1.16 CC(N=C=S)C1=CC=CC=C1 S645478 [1,1,0,0,0,0|0,1,1]=4 302 B11R1.16 CC(N=[N+]=[N-])C1=CC=CC=C1 PH018363 [1,1,0,0,0,0|2,0,0]=4 303 B11R1.16 CCCC(C)C1=CC=CC=C1 S570958 [1,1,0,0,0,0|1,0,1]=4 304 B11R1.16 CNCC(C)C1=CC=CC=C1 CDS011312 [1,1,0,0,0,0|1,0,1]=4 305 B11R1.36 C(C)(N)[C@@H](C)C1=CC=CC=C1 S327697 [1,1,0,0,0,0|1,0,1]=4 306 B11R1.36 C(C)(N)[C@H](C)C1=CC=CC=C1 S316911 [1,1,0,0,0,0|1,0,1]=4 307 B11R1.36 C/C(=C(\C)/C1=CC=CC=C1)/Br S877883 [1,1,0,0,0,0|1,0,1]=4 308 B11R1.36 CC(=O)C(C)C1=CC=CC=C1 S881112 [1,1,0,0,0,0|0,0,0]=2 309 B11R1.36 CC(=O)N(C)C1=CC=CC=C1 S392146 [1,1,0,0,0,0|1,0,0]=3 310 B11R1.36 CC(=O)N(C)C1=CC=CN=C1 T309508 [1,1,0,0,0,0|2,0,0]=4 311 B11R1.36 CC(C(=O)N)C1=CC=CC=C1 PH007480 [1,1,0,0,0,0|0,0,0]=2 312 B11R1.36 CC(C)C(C)C1=CC=CC=C1 S316091 [1,1,0,0,0,0|1,0,1]=4 313 B11R1.36 CC(C1=CC=CC=C1)N(C)C CDS001551 [1,1,0,0,0,0|2,0,0]=4 314 B11R1.36 CC(O)C(C)C1=CC=CC=C1 R157589 [1,1,0,0,0,0|0,0,2]=4 315 B11R1.36 CC(O)C(C)C1=CC=CC=C1 S313424 [1,1,0,0,0,0|0,0,2]=4 316 B11R1.36 CC(O)C(C)C1=CC=CC=C1 S313432 [1,1,0,0,0,0|0,0,2]=4 317 B11R1.36 CC(O)C(C)C1=CC=CC=C1 S485527 [1,1,0,0,0,0|0,0,2]=4 318 B11R1.36 CC(O)C(C)C1=CC=CC=C1 S494054 [1,1,0,0,0,0|0,0,2]=4 319 B11R1.36 CC(O)C(C)C1=CC=CC=C1 S494062 [1,1,0,0,0,0|0,0,2]=4 320 B11R1.36 N=C(N)C(O)C1=CC=CC=C1 CBR01201 [1,1,0,0,0,0|2,0,0]=4 321 B11R1.36 NC(=O)[C@H](N)C1=CC=CC=C1 CDS003589 [1,1,0,0,0,0|1,0,0]=3 322 B11R1.36 O=C(O)C(O)C1=CC=CC=C1 S684473 [1,1,0,0,0,0|1,0,0]=3 323 B11R1.36 O=C(O)C(S)C1=CC=CC=C1 TMT00523 [1,1,0,0,0,0|1,0,0]=3 324 B11R1.36 O=P(O)C(O)C1=CC=CC=C1 S576263 [1,1,0,0,0,0|2,0,0]=4 325 B11R1.36 P(=O)([O-])C(O)C1=CC=CC=C1 S359920 [1,1,0,0,0,0|2,0,0]=4 326 B11R1.36 [C@@H](C)(O)[C@@H](C)C1=CC=CC=C1 L157201 [1,1,0,0,0,0|0,0,2]=4 327 B11R1.314 CC1=CN(N=C1)C(C)C(=O)O CDS006848 [0,1,0,0,1,0|2,0,0]=4 328 B13R1.5 C(=O)/C(=C/C1=CC=C(C=C1)OC)/C S941565 [0,1,0,0,0,1|0,0,1]=3 329 B13R1.5 COC1=CC=C(C=C1)CC(C)NO PH012699 [0,1,0,0,0,1|1,0,1]=4 330 B13R1.5 COC1=CC=C(C=C1)OC(C)CN PH015145 [0,1,0,0,0,1|1,0,1]=4 331 B13R1.133 C/C(=C\C1=CC=C(C=C1)Cl)/C(=O)O S808687 [0,1,0,0,0,1|1,0,1]=4 332 B13R1.133 CC(=O)C(Cl)CC1=CC=C(C=C1)Cl S567140 [0,1,0,0,0,1|2,0,0]=4 333 B13R1.133 CC(CC1=CC=C(C=C1)O)C(=O)O PH008203 [0,1,0,0,0,1|1,0,0]=3 334 B13R1.133 CC(OC1=CC=C(C=C1)Br)C(=O)O CDS005545 [0,1,0,0,0,1|1,0,0]=3 335 B13R1.133 CC(OC1=CC=C(C=C1)Cl)C(=O)O R750298 [0,1,0,0,0,1|1,0,0]=3 336 B13R1.133 CC(OC1=CC=C(C=C1)F)C(=O)O PH009975 [0,1,0,0,0,1|1,0,0]=3 337 B13R1.133 CC1=CC=C(C=C1)/C=C(/C)\C(=O)O S280100 [0,1,0,0,0,1|0,0,1]=3 338 B13R1.133 CC1=CC=C(C=C1)/C=C(\C)/[N+](=O)[O-] S620793 [0,1,0,0,0,1|1,0,1]=4 339 B13R1.133 CC1=CC=C(C=C1)CC(C)C(=O)O R245267 [0,1,0,0,0,1|0,0,0]=2 340 B13R1.133 CC1=CC=C(C=C1)CC(N)C(=O)O PH011203 [0,1,0,0,0,1|1,0,0]=3 341 B13R1.133 CC1=CC=C(C=C1)CN(C)C(=N)N PH014484 [0,1,0,0,0,1|2,0,0]=4 342 B13R1.133 C[C@H](CC1=CC=C(C=C1)N)C(=O)O PH001854 [0,1,0,0,0,1|1,0,0]=3 343 B13R1.36 COC1=CC=C(C=C1)C(Br)C(=O)O PH016225 [0,2,0,0,0,0|1,0,0]=3 344 B13R1.36 COC1=CC=C(C=C1)N(C)C(=S)C S512346 [0,2,0,0,0,0|1,1,0]=4 345 B13R1.36 COC1=CC=C(C=C1)[C@@H](N)C(=O)N OMC00018 [0,2,0,0,0,0|1,0,0]=3 346 B13R1.39 CCC(C#N)C1=CC=C(C=C1)OC S879509 [0,2,0,0,0,0|1,0,1]=4 347 B13R1.187 CCC(C)(C)C1=CC=C(C=C1)CCl S521337 [0,2,0,0,0,0|1,0,1]=4 348 B13R1.187 CCC(C)(C)C1=CC=C(C=C1)OC S563390 [0,2,0,0,0,0|1,0,1]=4 349 B13R1.187 COC1=CC=C(C=C1)C(C)(C)C#N S313394 [0,2,0,0,0,0|1,0,1]=4 350 B13R1.187 COC1=CC=C(C=C1)C(C)(C)CN OTV000615 [0,2,0,0,0,0|1,0,1]=4 351 B13R1.187 COC1=CC=C(C=C1)C(C)(O)CN BBO000391 [0,2,0,0,0,0|1,0,1]=4 352 B13R1.452 COC1=CC=C(C=C1)[C@@H](C)N=C=O CDS019610 [0,2,0,0,0,0|0,0,1]=3 353 B13R1.522 CC(O)(C(=O)O)C1=CC=C(C=C1)Cl OTV000770 [0,2,0,0,0,0|1,0,0]=3 354 B13R1.1 COC(CCCl)C1=CC=C(C=C1)C S363294 [0,2,0,0,0,0|1,0,1]=4 355 B13R1.706 CC(=O)C(C#N)C1=CC=C(C=C1)Cl TMT00640 [0,2,0,0,0,0|1,0,1]=4 356 B13R1.706 CC1=CC=C(C=C1)C(CN)N(C)C CBR00265 [0,2,0,0,0,0|1,0,1]=4 357 B13R1.706 CCC(C(=O)O)C1=CC=C(C=C1)Br CDS016280 [0,2,0,0,0,0|1,0,0]=3 358 B13R1.706 COC(C(=O)O)C1=CC=C(C=C1)C PH018590 [0,2,0,0,0,0|0,0,0]=2 359 B13R1.706 COC(C(=O)O)C1=CC=C(C=C1)Cl PH018559 [0,2,0,0,0,0|1,0,0]=3 360 B13R1.17 CC1=CC=C(C=C1)C(C)CCCO T195189 [0,2,0,0,0,0|0,0,2]=4 361 B13R1.132 CC(CC(=O)O)C1=CC=C(C=C1)Br T135860 [0,2,0,0,0,0|1,0,0]=3 362 B13R1.132 CC(CC(=O)O)C1=CC=C(C=C1)Cl PH015633 [0,2,0,0,0,0|1,0,0]=3 363 B13R1.132 CC(CC(=O)O)C1=CC=C(C=C1)O T135879 [0,2,0,0,0,0|1,0,0]=3 364 B13R1.132 CC1=CC=C(C=C1)/C(=C/C(=O)O)/C L128317 [0,2,0,0,0,0|0,0,1]=3 365 B13R1.132 CC1=CC=C(C=C1)C(C)CC(=O)O S326283 [0,2,0,0,0,0|0,0,0]=2 366 B13R1.132 NC(CC(=O)O)C1=CC=C(C=C1)Br BBO000769 [0,2,0,0,0,0|2,0,0]=4 367 B13R1.510 NC(C(=O)O)C1=CC=C(C(=C1)F)F CDS022248 [0,2,0,0,0,0|2,0,0]=4 368 B11R2.1 C[N+]1=CSC2=CC=CC=C12 R785695 [1,0,0,1,0,0|1,1,0]=4 369 B11R2.239 C1=CC=C(C=C1)C2CCN2 CDS019224 [1,0,0,1,0,0|2,0,0]=4 370 B13R2.42 CC1=CC=C(C=C1)[C@@H]2C[C@H]2C=O PH018823 [0,0,0,1,0,1|0,0,0]=2 371 B13R2.2130 CN1C=CC2=CC(=CC=C12)CN CDS018643 [0,1,0,1,0,0|2,0,0]=4 372 B13R2.102 CC1=CC=C(C=C1)C2(CC2)C#N S447943 [0,1,0,1,0,0|1,0,1]=4 373 B13R2.3108 CC1=CC2=C(C=C1)C(C=C2)(C)C S127973 [0,1,0,1,0,0|1,0,0]=3 374 B13R2.12 CC1=CC=C(C=C1)C2NCCS2 T149357 [0,1,0,1,0,0|2,0,0]=4 375 B13R2.5190 CC1=CC=C2C(=O)C(=O)NC2=C1 CDS020596 [0,1,0,1,0,0|1,0,1]=4 376 B13R2.5190 CN1C(=O)CC2=C1C=CC(=C2)Cl PH009430 [0,1,0,1,0,0|2,0,0]=4 377 B13R2.5190 CN1C(=O)CC2=C1C=CC(=C2)O PH010625 [0,1,0,1,0,0|2,0,0]=4 378 B9R1.35 CC(=O)C1=CC=C(S1)C S552038 [1,0,0,0,1,0|1,0,1]=4 379 B9R1.35 CC1=CC=C(S1)C(C)N CDS012543 [1,0,0,0,1,0|2,0,0]=4 380 B11R1.40 CC(CC1=CC=CC=C1)NN PH000293 [1,0,0,0,0,1|2,0,0]=4 381 B11R1.40 CCC(C)NC1=CC=CC=C1 S372293 [1,0,0,0,0,1|1,0,1]=4