0 B9R1.3 BrC1=CC=CC(=C1I)Br S110086 [0,0,0,0,0,0|3,0,1]=4 1 B9R1.3 CC1=C(C(=CC=C1)Cl)S R262153 [0,0,0,0,0,0|2,0,1]=3 2 B9R1.3 CC1=C(C=CC=C1Br)F CDS003017 [0,0,0,0,0,0|3,0,1]=4 3 B9R1.3 CC1=C(C=CC=C1O)Cl CDS003050 [0,0,0,0,0,0|3,0,1]=4 4 B9R1.3 CC1=C([N+](=CC=C1)C)C S619205 [0,0,0,0,0,0|2,0,2]=4 5 B9R1.3 CC1=CC=CC(=C1Br)Cl CDS003391 [0,0,0,0,0,0|2,0,1]=3 6 B9R1.3 CC1=CC=CC(=O)N1C T294608 [0,0,0,0,0,0|3,0,0]=3 7 B9R1.3 CC1=CC=CC(=[N+]1C)C R255319 [0,0,0,0,0,0|2,0,1]=3 8 B9R1.3 CC1=CC=CC(=[N+]1C)C S874248 [0,0,0,0,0,0|2,0,1]=3 9 B9R1.3 CC1=COC=C(C1=O)C T162310 [0,0,0,0,0,0|2,0,2]=4 10 B9R1.3 NC1=C(C=CC=C1Cl)I KOB0053 [0,0,0,0,0,0|2,0,1]=3 11 B9R1.3 NC1=C(C=CC=C1I)O CDS007998 [0,0,0,0,0,0|2,0,1]=3 12 B9R1.3 NC1=C(C=CC=C1O)O CDS003448 [0,0,0,0,0,0|2,0,1]=3 13 B9R1.3 NC1=C(C=CC=C1O)O PH009922 [0,0,0,0,0,0|2,0,1]=3 14 B9R1.3 NC1=C(C=NC=C1I)I VBP00076 [0,0,0,0,0,0|3,0,1]=4 15 B9R1.3 NC1=CC=CC(=C1Br)Cl CDS023345 [0,0,0,0,0,0|3,0,1]=4 16 B9R1.3 NC1=CC=CC(=C1Br)F CDS004255 [0,0,0,0,0,0|3,0,1]=4 17 B9R1.3 NC1=CC=CC(=C1F)Br CDS023142 [0,0,0,0,0,0|3,0,1]=4 18 B9R1.3 NC1=CC=CC(=C1N)Br CDS020072 [0,0,0,0,0,0|2,0,1]=3 19 B9R1.3 NC1=CC=CC(=C1N)F CDS011409 [0,0,0,0,0,0|2,0,1]=3 20 B9R1.3 NC1=CC=CC(=C1N)N S915041 [0,0,0,0,0,0|2,0,1]=3 21 B9R1.3 NC1=CC=CC(=C1O)Br CDS020010 [0,0,0,0,0,0|3,0,1]=4 22 B9R1.3 NC1=CC=CC(=C1O)Cl TMT00393 [0,0,0,0,0,0|3,0,1]=4 23 B9R1.3 OC1=C(C(=CC=C1)Cl)F CDS003101 [0,0,0,0,0,0|3,0,1]=4 24 B9R1.3 SC1=CC=CC(=C1Cl)Cl R239429 [0,0,0,0,0,0|3,0,1]=4 25 B8R1.4 CC1=CC(=O)NC=C1 T162655 [1,0,0,0,0,0|2,0,1]=4 26 B8R1.4 CC1=CC=CC(=C1)N R647047 [1,0,0,0,0,0|1,0,1]=3 27 B8R1.4 CC1=CC=CC(=O)N1 S766364 [1,0,0,0,0,0|2,0,0]=3 28 B8R1.4 CC1=CC=NC(=O)C1 S681601 [1,0,0,0,0,0|2,0,0]=3 29 B8R1.4 CC1=CCCC(=O)C1 PH000095 [1,0,0,0,0,0|1,0,2]=4 30 B8R1.4 CC1=C[N+](=CC=C1)C S619396 [1,0,0,0,0,0|1,0,2]=4 31 B8R1.4 CC1=NC(=CC=N1)Cl PHB00236 [1,0,0,0,0,0|3,0,0]=4 32 B8R1.4 CC1=NC(=CC=N1)N CDS014871 [1,0,0,0,0,0|3,0,0]=4 33 B8R1.4 CC1=NC(=CN=C1)Cl ANV00028 [1,0,0,0,0,0|3,0,0]=4 34 B8R1.4 CC1=NC(=CN=C1)Cl CDS013631 [1,0,0,0,0,0|3,0,0]=4 35 B8R1.4 ClC1=NC(=CC=C1)I ADE000334 [1,0,0,0,0,0|3,0,0]=4 36 B8R1.4 FC1=CC=CC(=N1)Br CDS002875 [1,0,0,0,0,0|3,0,0]=4 37 B8R1.4 NC1=CC=CC(=C1)Cl S642665 [1,0,0,0,0,0|2,0,1]=4 38 B8R1.4 NC1=CC=CC(=N1)O CDS008897 [1,0,0,0,0,0|3,0,0]=4 39 B8R1.4 NC1=NC(=CC=C1)I ADE000340 [1,0,0,0,0,0|3,0,0]=4 40 B8R1.4 OC1=CC=CC(=N1)O S458678 [1,0,0,0,0,0|3,0,0]=4 41 B8R1.5 CC1=C(C=NC=C1)Cl T161152 [1,0,0,0,0,0|2,0,1]=4 42 B8R1.5 CC1=CN=CC=C1N CDS003217 [1,0,0,0,0,0|1,0,1]=3 43 B8R1.5 C[N+]1=CC=CC=C1Cl S765678 [1,0,0,0,0,0|2,0,1]=4 44 B8R1.5 C[N+]1=CC=CN=C1N S142433 [1,0,0,0,0,0|2,0,1]=4 45 B8R1.5 NC1=C(C=CC=C1)[S-] L133574 [1,0,0,0,0,0|1,0,1]=3 46 B8R1.5 NC1=C(C=CN=C1)O CDS004728 [1,0,0,0,0,0|2,0,1]=4 47 B8R1.5 NC1=C(C=NC=C1)O ADE000632 [1,0,0,0,0,0|2,0,1]=4 48 B8R1.5 NC1=CC=CC=C1O S378569 [1,0,0,0,0,0|1,0,1]=3 49 B8R1.5 NC1=CC=CC=[N+]1[O-] CDS014426 [1,0,0,0,0,0|2,0,1]=4 50 B8R1.5 NC1=CC=CN=C1O CDS007860 [1,0,0,0,0,0|2,0,1]=4 51 B8R1.5 NC1=CC=NC=C1Cl CDS010711 [1,0,0,0,0,0|2,0,1]=4 52 B8R1.5 O=C1C=CC=CN1[K] T160997 [1,0,0,0,0,0|3,0,0]=4 53 B10R1.2 CC1=C(C(=CC=C1)C#N)C S445304 [0,1,0,0,0,0|1,0,2]=4 54 B10R1.2 CC1=C(C(=CC=C1)CBr)C CDS022040 [0,1,0,0,0,0|1,0,2]=4 55 B10R1.2 CC1=C(C=CC=C1CO)Cl CDS023048 [0,1,0,0,0,0|2,0,1]=4 56 B10R1.2 CC1=CC=CC(=C1C)NN R436321 [0,1,0,0,0,0|2,0,1]=4 57 B10R1.2 COC1=C(C(=CC=C1)C)O L167932 [0,1,0,0,0,0|1,0,2]=4 58 B10R1.2 COC1=C(C(=NC=C1)N)N PH019206 [0,1,0,0,0,0|2,0,1]=4 59 B10R1.2 COC1=CC=CC(=C1Cl)O CDS004291 [0,1,0,0,0,0|2,0,1]=4 60 B10R1.2 COC1=CC=CC(=C1N)Br CDS022850 [0,1,0,0,0,0|1,0,1]=3 61 B10R1.2 ClC1=C(C(=CC=C1)CBr)Cl CDS003275 [0,1,0,0,0,0|2,0,1]=4 62 B10R1.2 ClCC1=CC=CC(=C1Cl)Cl CDS013551 [0,1,0,0,0,0|2,0,1]=4 63 B10R1.2 FC1=C(C=CC=C1CBr)Cl CDS003049 [0,1,0,0,0,0|2,0,1]=4 64 B10R1.2 O=CC1=C(C(=CC=C1)O)Br CDS004521 [0,1,0,0,0,0|2,0,1]=4 65 B10R1.2 O=CC1=CC=CC(=C1F)Br CDS017326 [0,1,0,0,0,0|2,0,1]=4 66 B10R1.2 O=CC1=CC=CC(=C1F)O PH015405 [0,1,0,0,0,0|2,0,1]=4 67 B10R1.2 OCC1=C(C(=CC=C1)Cl)F CDS021698 [0,1,0,0,0,0|2,0,1]=4 68 B10R1.2 OCC1=CC=CC(=C1F)Br CDS016758 [0,1,0,0,0,0|2,0,1]=4 69 B10R1.22 CC1=C(C(=CC(=C1)Cl)Cl)I R416231 [0,1,0,0,0,0|2,0,1]=4 70 B10R1.22 CC1=C(C(=CC(=C1)Cl)Cl)O S443786 [0,1,0,0,0,0|2,0,1]=4 71 B10R1.22 CC1=CC(=C(C(=C1)Br)N)C S294144 [0,1,0,0,0,0|1,0,1]=3 72 B10R1.22 CC1=CC(=C(C(=C1)C)C)C CDS000400 [0,1,0,0,0,0|1,0,2]=4 73 B10R1.22 CC1=CC(=C(C(=C1)C)Cl)C PH010961 [0,1,0,0,0,0|1,0,2]=4 74 B10R1.22 CC1=CC(=C(C(=C1)C)I)C R258377 [0,1,0,0,0,0|1,0,2]=4 75 B10R1.22 CC1=CC(=C(C(=N1)C)N)C CBR01290 [0,1,0,0,0,0|1,0,2]=4 76 B10R1.22 CC1=CC(=CC(=C1F)C)Br CDS003019 [0,1,0,0,0,0|1,0,2]=4 77 B10R1.22 CC1=CC(=CC(=C1N)C)Cl PH000327 [0,1,0,0,0,0|0,0,2]=3 78 B10R1.22 CC1=CC(=CC(=C1O)C)I S842702 [0,1,0,0,0,0|1,0,2]=4 79 B10R1.22 CC1=CC(=CC(=C1O)N)N S943975 [0,1,0,0,0,0|2,0,1]=4 80 B10R1.22 CC1=CC(=NC(=C1N)C)Br CDS023145 [0,1,0,0,0,0|1,0,2]=4 81 B10R1.22 CC1=CC(=O)C=C(N1C)C S11003 [0,1,0,0,0,0|2,0,1]=4 82 B10R1.22 CC1=CC(=O)N(C(=C1)C)N CBR00430 [0,1,0,0,0,0|2,0,0]=3 83 B10R1.22 CC1=CC(=[N+](C(=C1)C)C)C R255408 [0,1,0,0,0,0|2,0,1]=4 84 B10R1.22 NC1=C(C(=CC(=C1)F)F)N CDS010697 [0,1,0,0,0,0|2,0,1]=4 85 B10R1.22 NC1=C(C=C(C=C1Cl)Br)Br S676926 [0,1,0,0,0,0|2,0,1]=4 86 B10R1.119 CC1=C(C(=C(C=C1)Cl)N)Cl PH011039 [0,1,0,0,0,0|2,0,1]=4 87 B10R1.119 CC1=C(C(=CC=C1Cl)N)Cl CBR00888 [0,1,0,0,0,0|2,0,1]=4 88 B10R1.119 CC1=C(C(=CC=C1F)O)Cl PH017188 [0,1,0,0,0,0|2,0,1]=4 89 B10R1.119 CC1=C(C(=CC=C1N)Br)C CDS022788 [0,1,0,0,0,0|2,0,1]=4 90 B10R1.119 CC1=C(C=CC(=C1Cl)O)Cl R426490 [0,1,0,0,0,0|2,0,1]=4 91 B10R1.119 CC1=CC=C(C(=C1C)Br)C T332577 [0,1,0,0,0,0|1,0,2]=4 92 B10R1.119 CC1=CC=C(C(=C1C)N)N R228389 [0,1,0,0,0,0|1,0,1]=3 93 B10R1.119 CC1=CC=C(C(=C1F)O)F CDS021693 [0,1,0,0,0,0|2,0,1]=4 94 B10R1.119 CC1=CC=C(C(=C1N)C)N R750859 [0,1,0,0,0,0|0,0,2]=3 95 B10R1.245 CC1=C(C(=CC=C1)Br)C=O CDS024325 [0,1,0,0,0,0|2,0,1]=4 96 B10R1.245 CC1=C(C(=CC=C1)Cl)CN CDS000918 [0,1,0,0,0,0|1,0,1]=3 97 B10R1.245 CC1=CC=CC(=C1CBr)C CDS022041 [0,1,0,0,0,0|1,0,2]=4 98 B10R1.245 CC1=CC=CC(=C1CBr)F CDS020960 [0,1,0,0,0,0|2,0,1]=4 99 B10R1.245 CC1=CC=CC(=C1CO)C PH002994 [0,1,0,0,0,0|1,0,2]=4 100 B10R1.245 NCC1=C(C=CC=C1Cl)Cl L480827 [0,1,0,0,0,0|2,0,1]=4 101 B7R0.5 C=CCC(O)C(=C)C S881163 [1,0,1,0,0,0|1,0,1]=4 102 B7R0.10 C=CC(C)C(O)C=C T288918 [1,0,1,0,0,0|1,0,1]=4 103 B7R0.3 C=C/C=C/C(C)C=C S418986 [1,0,1,0,0,0|1,0,0]=3 104 B7R0.4 C/C=C/C=C\C(C)O T211419 [1,0,1,0,0,0|1,0,1]=4 105 B7R1.3 CC1=CC=NC=C1 T256412 [2,0,0,0,0,0|1,0,1]=4 106 B7R1.3 CC1=CC=NC=C1 T330418 [2,0,0,0,0,0|1,0,1]=4 107 B7R1.3 NC1=CC=CC=C1 S698326 [2,0,0,0,0,0|0,0,1]=3 108 B7R1.3 NC1=CC=CC=N1 S822329 [2,0,0,0,0,0|1,0,1]=4 109 B7R1.3 O=C1C=CC=CN1 T160121 [2,0,0,0,0,0|2,0,0]=4 110 B7R1.3 [O-]C1=CC=CC=C1 CDS001581 [2,0,0,0,0,0|1,0,1]=4 111 B7R1.3 [S-]C1=CC=CC=C1 S578991 [2,0,0,0,0,0|1,0,1]=4 112 B9R1.2 BrCC1=CC=CC(=N1)Br CDS022451 [1,1,0,0,0,0|2,0,0]=4 113 B9R1.2 C#CC1=CC=CC(=N1)C CBR02079 [1,1,0,0,0,0|1,0,1]=4 114 B9R1.2 C(=O)C1=CC=CC(=N1)F CDS021920 [1,1,0,0,0,0|2,0,0]=4 115 B9R1.2 CC1=CC(=CC=C1)[IH2]=O T330566 [1,1,0,0,0,0|1,0,1]=4 116 B9R1.2 CC1=CC=CC(=C1)CS PH011231 [1,1,0,0,0,0|0,0,2]=4 117 B9R1.2 CC1=CC=CC(=N1)CCl CBR01903 [1,1,0,0,0,0|1,0,1]=4 118 B9R1.2 CC1=CN=CC(=C1)C=O CDS015706 [1,1,0,0,0,0|1,0,1]=4 119 B9R1.2 CC1=NC(=CC=C1)CCl CDS021719 [1,1,0,0,0,0|1,0,1]=4 120 B9R1.2 CCC1=CC=CC(=C1)Br CDS013673 [1,1,0,0,0,0|1,0,1]=4 121 B9R1.2 CCC1=NC(=CC=C1)C S580031 [1,1,0,0,0,0|1,0,1]=4 122 B9R1.2 CNC1=CC(=CC=C1)N S604097 [1,1,0,0,0,0|1,0,1]=4 123 B9R1.2 COC1=CC=CC(=C1)N CDS000467 [1,1,0,0,0,0|1,0,1]=4 124 B9R1.2 COC1=CC=CC(=N1)N ADE000359 [1,1,0,0,0,0|2,0,0]=4 125 B9R1.2 COC1=NC(=CC=C1)I ADE000332 [1,1,0,0,0,0|2,0,0]=4 126 B9R1.2 CSC1=CC=CC(=C1)O KOB0118 [1,1,0,0,0,0|1,0,1]=4 127 B9R1.2 NCC1=CC(=CC=C1)O CDS016848 [1,1,0,0,0,0|1,0,1]=4 128 B9R1.2 NCC1=CC=CC(=N1)Br CDS015880 [1,1,0,0,0,0|2,0,0]=4 129 B9R1.2 NCC1=NC(=CC=C1)Br CDS009036 [1,1,0,0,0,0|2,0,0]=4 130 B9R1.2 OCC1=NC(=CC=C1)I ADE000341 [1,1,0,0,0,0|2,0,0]=4 131 B9R1.34 CC1=CC(=CC(=C1)Br)F CDS003810 [1,1,0,0,0,0|1,0,1]=4 132 B9R1.34 CC1=CC(=CC(=N1)C)N CDS019979 [1,1,0,0,0,0|1,0,1]=4 133 B9R1.34 CC1=CC(=CC(=N1)C)O PH010817 [1,1,0,0,0,0|1,0,1]=4 134 B9R1.34 CC1=CC(=CC(=N1)O)O PH010608 [1,1,0,0,0,0|2,0,0]=4 135 B9R1.34 CC1=CC(=CC(=O)N1)O L479489 [1,1,0,0,0,0|2,0,0]=4 136 B9R1.34 CC1=CC(=CC(=O)N1)O OTV000023 [1,1,0,0,0,0|2,0,0]=4 137 B9R1.34 CC1=CC(=NC(=C1)C)C SYX00268 [1,1,0,0,0,0|1,0,1]=4 138 B9R1.34 CC1=CC(=S)C=C(O1)C S874272 [1,1,0,0,0,0|1,0,1]=4 139 B9R1.34 CC1=CC(=[O+]C(=C1)C)C S24105 [1,1,0,0,0,0|1,0,1]=4 140 B9R1.34 CC1=CC(=[O+]C(=C1)C)C S626848 [1,1,0,0,0,0|1,0,1]=4 141 B9R1.34 CC1=CC(=[O+]C(=C1)C)C S920134 [1,1,0,0,0,0|1,0,1]=4 142 B9R1.69 CC1=C(C=CC(=C1)Cl)I PH011333 [1,1,0,0,0,0|1,0,1]=4 143 B9R1.69 CC1=C(C=CC(=C1)F)S KOB0166 [1,1,0,0,0,0|1,0,1]=4 144 B9R1.69 CC1=C(C=CC(=C1)O)N S430048 [1,1,0,0,0,0|1,0,1]=4 145 B9R1.69 CC1=C(C=CC(=C1)S)F KOB0143 [1,1,0,0,0,0|1,0,1]=4 146 B9R1.69 CC1=C(C=CC(=N1)N)I ADE000318 [1,1,0,0,0,0|2,0,0]=4 147 B9R1.69 CC1=C(C=CC(=N1)O)I BCH00049 [1,1,0,0,0,0|2,0,0]=4 148 B9R1.69 CC1=C(N=C(C=C1)Br)C CBR01845 [1,1,0,0,0,0|2,0,0]=4 149 B9R1.69 CC1=CC(=C(C=C1)Br)Cl CDS003121 [1,1,0,0,0,0|1,0,1]=4 150 B9R1.69 CC1=CC(=C(C=C1)Cl)C T332828 [1,1,0,0,0,0|0,0,2]=4 151 B9R1.69 CC1=CC(=CC=C1N)N S442275 [1,1,0,0,0,0|1,0,1]=4 152 B9R1.69 CC1=CC=C(C(=C1)Br)N S741949 [1,1,0,0,0,0|1,0,1]=4 153 B9R1.69 CC1=CC=C(C(=C1)Br)N S908630 [1,1,0,0,0,0|1,0,1]=4 154 B9R1.69 CC1=CC=C(C(=C1)F)O CDS010738 [1,1,0,0,0,0|1,0,1]=4 155 B9R1.69 CC1=CC=C(C(=C1)I)I S943894 [1,1,0,0,0,0|1,0,1]=4 156 B9R1.69 CC1=CC=C(C(=C1)N)N S446149 [1,1,0,0,0,0|1,0,1]=4 157 B9R1.69 CC1=NC(=C(C=C1)Br)F CDS021914 [1,1,0,0,0,0|2,0,0]=4 158 B9R1.69 CC1=NC(=C(C=C1)F)Br AGN00010 [1,1,0,0,0,0|2,0,0]=4 159 B9R1.69 CC1=NC(=C(C=C1)O)C S291315 [1,1,0,0,0,0|1,0,1]=4 160 B9R1.69 CC1=NC(=CC=C1F)Br CDS002984 [1,1,0,0,0,0|2,0,0]=4 161 B9R1.15 C(=O)C1=C(C=CC=C1)[O-] S17079 [1,1,0,0,0,0|1,0,1]=4 162 B9R1.15 CC1=C(C=CC=C1)NN R580260 [1,1,0,0,0,0|0,0,1]=3 163 B9R1.15 CC1=C(C=CC=C1)[IH2]=O T330531 [1,1,0,0,0,0|1,0,1]=4 164 B9R1.15 CC1=CC=CN=C1CN CDS004048 [1,1,0,0,0,0|1,0,1]=4 165 B9R1.15 CC1=CC=NC=C1CN CDS013951 [1,1,0,0,0,0|1,0,1]=4 166 B9R1.15 CC[N+]1=CC=CC=C1N S142549 [1,1,0,0,0,0|1,0,1]=4 167 B9R1.15 CNC1=C(C=CC=C1)F CDS000433 [1,1,0,0,0,0|1,0,1]=4 168 B9R1.15 COC1=CC=CC=C1N CDS000192 [1,1,0,0,0,0|0,0,1]=3 169 B9R1.15 COC1=NC=CC=C1N CDS002836 [1,1,0,0,0,0|1,0,1]=4 170 B9R1.15 NC1=C(C=CN=C1)CO ADE000287 [1,1,0,0,0,0|1,0,1]=4 171 B9R1.15 NC1=C(C=NC=C1)C=O ADE000099 [1,1,0,0,0,0|1,0,1]=4 172 B9R1.15 NC1=C(N=CC=C1)C=O CDS022545 [1,1,0,0,0,0|1,0,1]=4 173 B9R1.15 NC1=CC=NC=C1CO ADE000311 [1,1,0,0,0,0|1,0,1]=4 174 B9R1.15 NC1=CN=CC=C1C=O ADE000254 [1,1,0,0,0,0|1,0,1]=4 175 B9R1.15 NC1=NC=CC=C1CO ADE000265 [1,1,0,0,0,0|1,0,1]=4 176 B9R1.15 NCC1=C(C=CC=C1)O CDS008020 [1,1,0,0,0,0|1,0,1]=4 177 B9R1.15 NCC1=CC=CC=C1Br T151114 [1,1,0,0,0,0|1,0,1]=4 178 B9R1.15 OCC1=CC=CC=N1O S459240 [1,1,0,0,0,0|2,0,0]=4 179 B11R1.8 CC1=CC(=C(C(=C1)C=O)O)C CDS009678 [0,2,0,0,0,0|1,0,1]=4 180 B11R1.8 COC1=CC(=CC(=C1N)Br)Cl CDS024289 [0,2,0,0,0,0|1,0,1]=4 181 B11R1.13 CC1=C(C(=CC=C1)NC=O)C PH010206 [0,2,0,0,0,0|1,0,1]=4 182 B11R1.72 CC1=CC=C(C(=C1F)C=O)F CDS001752 [0,2,0,0,0,0|1,0,1]=4 183 B11R1.159 CC(=O)C1=CC=CC(=C1N)O CDS000114 [0,2,0,0,0,0|1,0,1]=4 184 B11R1.159 CC1=CC=CC(=C1C)C(=O)Cl CDS001566 [0,2,0,0,0,0|1,0,1]=4 185 B11R1.159 CC1=CC=CC(=C1C)C(=O)N PH011109 [0,2,0,0,0,0|1,0,1]=4 186 B11R1.159 CC1=CC=CC(=C1Cl)C(=O)O CDS000445 [0,2,0,0,0,0|1,0,1]=4 187 B11R1.159 CC1=[N+](C(=CC=C1)C(=O)O)[O-] PH008188 [0,2,0,0,0,0|2,0,0]=4 188 B11R1.159 NC1=C(C=CC=C1Br)C(=O)O CDS004818 [0,2,0,0,0,0|1,0,1]=4 189 B11R1.159 NC1=C(C=CC=C1F)C(=O)O CDS000074 [0,2,0,0,0,0|1,0,1]=4 190 B11R1.159 NC1=C(C=CC=C1O)C(=O)O CDS000116 [0,2,0,0,0,0|1,0,1]=4 191 B11R1.267 COC1=CC=CC(=C1N)OC CDS017316 [0,2,0,0,0,0|0,0,2]=4 192 B11R1.278 CC1=C(C(=C(C=C1)C=O)O)C ASX00132 [0,2,0,0,0,0|1,0,1]=4 193 B11R1.32 CC1=C(C(=C(C(=C1)Br)C)Br)N R289779 [0,2,0,0,0,0|1,0,1]=4 194 B11R1.32 CC1=CC(=C(C(=C1C)Br)N)C S943614 [0,2,0,0,0,0|1,0,1]=4 195 B11R1.464 CC1=CC(=C(C(=C1)C)CN)C CDS021956 [0,2,0,0,0,0|0,0,2]=4 196 B11R1.605 C(=O)NC1=C(C=CC=C1C)C S396656 [0,2,0,0,0,0|0,0,2]=4 197 B11R1.605 C(=O)NC1=C(C=CC=C1C)Cl S625477 [0,2,0,0,0,0|1,0,1]=4 198 B9R1.11 CCC(N)C1=CC=CS1 T326984 [0,0,1,1,0,0|1,0,1]=4 199 B9R1.50 O=C1C=CC=CC=CC1 T179078 [0,0,1,1,0,0|2,0,0]=4 200 B11R2.106 CC1=C2NN=CC2=CC=C1 CBR00226 [0,1,0,1,0,0|0,0,1]=3 201 B11R2.106 CC1=CN=CC2=C1NN=C2 BLN00046 [0,1,0,1,0,0|1,0,1]=4 202 B11R2.106 OC1=CC=CC2=C1NC=C2 CDS005198 [0,1,0,1,0,0|1,0,1]=4