0 B8R1.7 C1=C(N=CS1)C(=O)O T119302 [0,0,0,0,0,0|3,0,1]=4 1 B8R1.7 C1=C(N=NS1)C(=O)Cl T345953 [0,0,0,0,0,0|4,0,0]=4 2 B8R1.7 C1=C(SC=N1)C(=O)N T339940 [0,0,0,0,0,0|3,0,1]=4 3 B8R1.7 C1=C(SC=N1)C(=O)O T405006 [0,0,0,0,0,0|3,0,1]=4 4 B8R1.7 C1=CN=C(N1)C(=O)N H191251 [0,0,0,0,0,0|2,0,2]=4 5 B8R1.7 C1=CN=C(N1)C(=O)O H134313 [0,0,0,0,0,0|2,0,2]=4 6 B8R1.7 C1=CON=C1C(=O)O I133309 [0,0,0,0,0,0|3,0,1]=4 7 B8R1.7 C1=CSC(=C1)C(=O)Cl T162807 [0,0,0,0,0,0|2,0,2]=4 8 B8R1.7 C1=CSC(=C1)C(=O)Cl T471243 [0,0,0,0,0,0|2,0,2]=4 9 B8R1.7 C1=CSC(=C1)C(=O)N T162813 [0,0,0,0,0,0|2,0,2]=4 10 B8R1.7 C1=CSC(=C1)C(=O)O T107125 [0,0,0,0,0,0|2,0,2]=4 11 B8R1.7 C1=CSC(=C1)C(=O)[O-] C115572 [0,0,0,0,0,0|2,0,2]=4 12 B8R1.7 C1=CSC(=N1)C(=N)N T175883 [0,0,0,0,0,0|2,0,2]=4 13 B8R1.7 C1=CSC(=N1)C(=O)O T131973 [0,0,0,0,0,0|1,0,2]=3 14 B8R1.7 C1=CSC(=N1)[N+](=O)[O-] N587486 [0,0,0,0,0,0|2,0,2]=4 15 B8R1.7 C1=NNC(=N1)C(=O)N T162266 [0,0,0,0,0,0|3,0,1]=4 16 B8R1.7 C1=NNC(=N1)C(=O)O T170575 [0,0,0,0,0,0|3,0,1]=4 17 B8R1.7 C1=NON=C1C(=O)O O195579 [0,0,0,0,0,0|4,0,0]=4 18 B8R1.7 C1CC(NC1)C(=O)N P105976 [0,0,0,0,0,0|2,0,2]=4 19 B8R1.7 C1CC(NC1)C(=O)N P121653 [0,0,0,0,0,0|2,0,2]=4 20 B8R1.7 C1CC(NC1)C(=O)N S136613 [0,0,0,0,0,0|2,0,2]=4 21 B8R1.7 C1CC(NC1)C(=O)O D423511 [0,0,0,0,0,0|2,0,2]=4 22 B8R1.7 C1CC(NC1)C(=O)O L421729 [0,0,0,0,0,0|2,0,2]=4 23 B8R1.7 C1CC(NC1)C(=O)O P105590 [0,0,0,0,0,0|2,0,2]=4 24 B8R1.7 C1CC(NC1)C(=O)O P108709 [0,0,0,0,0,0|2,0,2]=4 25 B8R1.7 C1CC(NC1)C(=O)O P111001 [0,0,0,0,0,0|2,0,2]=4 26 B8R1.7 C1CC(NC1)C(=O)O P120032 [0,0,0,0,0,0|2,0,2]=4 27 B8R1.7 C1CC(NC1)C(=O)O P140375 [0,0,0,0,0,0|2,0,2]=4 28 B8R1.7 C1CC(NC1)C(=O)O P477766 [0,0,0,0,0,0|2,0,2]=4 29 B8R1.7 C1CC(OC1)C(=O)N S469270 [0,0,0,0,0,0|2,1,1]=4 30 B8R1.7 C1CC(OC1)C(=O)O R160850 [0,0,0,0,0,0|2,1,1]=4 31 B8R1.7 C1CC(OC1)C(=O)O S161338 [0,0,0,0,0,0|2,1,1]=4 32 B8R1.7 C1CC(OC1)C(=O)O T161757 [0,0,0,0,0,0|2,1,1]=4 33 B8R1.7 C1CC=C(C1)C(=O)O C153747 [0,0,0,0,0,0|3,0,0]=3 34 B8R1.7 C1CCC(C1)C(=O)Cl C138861 [0,0,0,0,0,0|3,0,1]=4 35 B8R1.7 C1CCC(C1)C(=O)N C357646 [0,0,0,0,0,0|3,0,1]=4 36 B8R1.7 C1CCC(C1)C(=O)O C104489 [0,0,0,0,0,0|3,0,1]=4 37 B8R1.7 C1CSC(N1)C(=O)O T162356 [0,0,0,0,0,0|1,0,2]=3 38 B8R1.7 CC(=C)C1=NCCO1 I472189 [0,0,0,0,0,0|1,1,0]=2 39 B8R1.7 CC(=O)C1=CC=CN1 A113378 [0,0,0,0,0,0|1,0,3]=4 40 B8R1.7 CC(=O)C1=CC=CO1 F106238 [0,0,0,0,0,0|1,1,2]=4 41 B8R1.7 CC(=O)C1=CC=CS1 A109378 [0,0,0,0,0,0|1,0,2]=3 42 B8R1.7 CC(=O)C1=CC=NN1 H588033 [0,0,0,0,0,0|2,0,2]=4 43 B8R1.7 CC(=O)C1=CN=CN1 A194232 [0,0,0,0,0,0|2,0,2]=4 44 B8R1.7 CC(=O)C1=CNC=C1 A179139 [0,0,0,0,0,0|3,0,1]=4 45 B8R1.7 CC(=O)C1=CNN=C1 H175889 [0,0,0,0,0,0|4,0,0]=4 46 B8R1.7 CC(=O)C1=CSC=C1 A111250 [0,0,0,0,0,0|3,0,1]=4 47 B8R1.7 CC(=O)C1=NC=CS1 A124071 [0,0,0,0,0,0|0,0,2]=2 48 B8R1.7 CC(=O)C1=NCCS1 A118372 [0,0,0,0,0,0|0,0,0]=0 49 B8R1.7 CC(=O)C1CCCC1 C194132 [0,0,0,0,0,0|2,0,1]=3 50 B8R1.7 CC(=O)N1CCCC1 A151303 [0,0,0,0,0,0|3,0,0]=3 51 B7R1.1 C1=C(N=CO1)C=O O159993 [1,0,0,0,0,0|2,0,1]=4 52 B7R1.1 C1=C(N=CS1)C=O T135085 [1,0,0,0,0,0|2,0,1]=4 53 B7R1.1 C1=C(SC=N1)C=O W132585 [1,0,0,0,0,0|2,0,1]=4 54 B7R1.1 C1=CSC(=C1)C=O T107122 [1,0,0,0,0,0|1,0,2]=4 55 B7R1.1 C1=CSC(=N1)C=O T107968 [1,0,0,0,0,0|0,0,2]=3 56 B7R1.1 C1CC(OC1)C=O T479472 [1,0,0,0,0,0|1,1,1]=4 57 B7R1.1 C1CC=C(C1)C=O C304145 [1,0,0,0,0,0|2,0,0]=3 58 B7R1.1 C1CCC(C1)C=O C122650 [1,0,0,0,0,0|2,0,1]=4 59 B7R1.1 C1CCN(C1)C=O F469140 [1,0,0,0,0,0|3,0,0]=4 60 B7R1.1 C1CN=C(N1)CCl C190593 [1,0,0,0,0,0|2,0,1]=4 61 B7R1.1 C1CN=C(N1)NN H157134 [1,0,0,0,0,0|3,0,0]=4 62 B7R1.1 CCC1=NCCN1 E156339 [1,0,0,0,0,0|1,0,1]=3 63 B7R1.1 CCC1=NCCO1 E137961 [1,0,0,0,0,0|0,1,1]=3 64 B7R1.1 CCC1=NCCO1 P303248 [1,0,0,0,0,0|0,1,1]=3 65 B7R1.1 CCC1=NCCO1 P432473 [1,0,0,0,0,0|0,1,1]=3 66 B7R1.1 CCC1=NCCO1 P432474 [1,0,0,0,0,0|0,1,1]=3 67 B7R1.1 COC1=NC=CS1 M158486 [1,0,0,0,0,0|1,0,2]=4 68 B7R1.1 CSC1=NC=CS1 M158485 [1,0,0,0,0,0|1,0,2]=4 69 B7R1.1 CSC1=NCCN1 M135977 [1,0,0,0,0,0|2,0,0]=3 70 B7R1.1 CSC1=NCCS1 M123595 [1,0,0,0,0,0|1,0,0]=2 71 B9R1.11 C1=CSC(=C1)C(=O)CBr B165665 [0,1,0,0,0,0|1,0,2]=4 72 B9R1.11 C1CCN(C1)C(=O)CBr B405233 [0,1,0,0,0,0|3,0,0]=4 73 B9R1.11 C1CCN(C1)C(=O)CCl C153598 [0,1,0,0,0,0|3,0,0]=4 74 B9R1.11 CCC(=O)C1=CC=CS1 P160666 [0,1,0,0,0,0|1,0,2]=4 75 B9R1.11 CCC(=O)C1=NC=CS1 P160318 [0,1,0,0,0,0|0,0,2]=3 76 B9R1.11 COC(=O)C1=CC=CS1 M157944 [0,1,0,0,0,0|1,0,2]=4 77 B9R1.11 COC(=O)C1=CCCC1 M135404 [0,1,0,0,0,0|2,0,0]=3 78 B9R1.11 COC(=O)C1=CCSC1 M157933 [0,1,0,0,0,0|3,0,0]=4 79 B9R1.11 COC(=O)C1=CN=CS1 M181540 [0,1,0,0,0,0|2,0,1]=4 80 B9R1.11 COC(=O)C1=NC=NN1 M111368 [0,1,0,0,0,0|2,0,1]=4 81 B9R1.11 COC(=O)C1=NNN=C1 M589257 [0,1,0,0,0,0|3,0,0]=4 82 B9R1.11 COC(=O)C1CCCC1 M158004 [0,1,0,0,0,0|2,0,1]=4 83 B9R1.11 COC(=O)C1CCCN1 P107637 [0,1,0,0,0,0|1,0,2]=4 84 B9R1.11 COC(=O)C1CCCN1 P109007 [0,1,0,0,0,0|1,0,2]=4 85 B9R1.11 COC(=O)C1CCCO1 M158460 [0,1,0,0,0,0|1,1,1]=4 86 B9R1.11 COC(=O)C1NCCS1 M169641 [0,1,0,0,0,0|0,0,2]=3 87 B9R1.35 C1=C(N=C(S1)C(=O)O)Br B178029 [0,1,0,0,0,0|1,0,2]=4 88 B9R1.35 CC(=O)C1=CC(=CS1)Br B186234 [0,1,0,0,0,0|1,0,2]=4 89 B9R1.35 CC(=O)C1=CC(=CS1)Cl C303501 [0,1,0,0,0,0|1,0,2]=4 90 B9R1.35 CC(=O)C1=CC=C(S1)Br A100556 [0,1,0,0,0,0|1,0,2]=4 91 B9R1.35 CC(=O)C1=CC=C(S1)Cl A151017 [0,1,0,0,0,0|1,0,2]=4 92 B9R1.35 CC(=O)N1CCC(C1)O R160915 [0,1,0,0,0,0|3,0,0]=4 93 B9R1.35 CC1=CC=C(S1)C(=O)C A113376 [0,1,0,0,0,0|1,0,2]=4 94 B9R1.35 CC1=CN=C(S1)C(=O)O M304139 [0,1,0,0,0,0|1,0,2]=4 95 B9R1.35 CC1=CSC(=C1)C(=O)C A167104 [0,1,0,0,0,0|1,0,2]=4 96 B9R1.35 CC1=CSC(=N1)C(=O)C A469639 [0,1,0,0,0,0|0,0,2]=3 97 B9R1.41 CC(=O)C1=C(C=CS1)Br A170327 [0,1,0,0,0,0|1,0,2]=4 98 B9R1.41 CC(=O)C1CCCC1=O A100983 [0,1,0,0,0,0|2,0,1]=4 99 B9R1.41 CC(=O)C1CCCC1=O A489643 [0,1,0,0,0,0|2,0,1]=4 100 B9R1.41 CC(=O)N1CCCC1=O A151305 [0,1,0,0,0,0|3,0,0]=4 101 B9R1.41 CC1=C(SC=C1)C(=O)C A167103 [0,1,0,0,0,0|1,0,2]=4 102 B9R1.41 CC1=C(SC=N1)C(=O)C M170041 [0,1,0,0,0,0|2,0,1]=4 103 B7R0.4 CC(=O)CCCCCl C108058 [0,0,1,0,0,0|2,0,1]=4 104 B7R0.4 CC(=O)OCCCCl C135233 [0,0,1,0,0,0|3,0,0]=4 105 B7R0.4 CC(=O)SCCCBr B333089 [0,0,1,0,0,0|3,0,0]=4 106 B7R0.4 CCCC=CC(=O)C H156932 [0,0,1,0,0,0|2,0,0]=3 107 B7R0.4 CCCC=CC(=O)O H107513 [0,0,1,0,0,0|3,0,0]=4 108 B7R0.4 CCCC=CC(=O)O H400070 [0,0,1,0,0,0|3,0,0]=4 109 B7R0.4 CCCCCC(=O)C H103803 [0,0,1,0,0,0|2,0,1]=4 110 B7R0.4 CCCCCC(=O)C H103827 [0,0,1,0,0,0|2,0,1]=4 111 B7R0.4 CCCCOC(=O)C B116224 [0,0,1,0,0,0|3,0,0]=4 112 B7R0.4 CCCCOC(=O)C B116225 [0,0,1,0,0,0|3,0,0]=4 113 B7R0.4 CCCCOC(=O)C B116227 [0,0,1,0,0,0|3,0,0]=4 114 B7R0.4 CCCCOC(=O)C B116228 [0,0,1,0,0,0|3,0,0]=4 115 B7R0.4 CCCCOC(=O)C B119685 [0,0,1,0,0,0|3,0,0]=4 116 B7R0.5 CCC=C(C)C(=O)O M102542 [0,0,1,0,0,0|3,0,0]=4 117 B7R0.5 CCC=C(C)C(=O)O M107371 [0,0,1,0,0,0|3,0,0]=4 118 B7R0.5 CCCC(=O)C(=O)C H106696 [0,0,1,0,0,0|1,1,0]=3 119 B7R0.5 CCCC(=O)C(=O)O O159954 [0,0,1,0,0,0|2,1,0]=4 120 B7R0.5 CCCC(C)C(=O)C M158798 [0,0,1,0,0,0|2,0,1]=4 121 B7R0.5 CCOC(=O)C(=C)C E103001 [0,0,1,0,0,0|2,1,0]=4 122 B7R0.5 CCOC(=O)C(=C)C E103002 [0,0,1,0,0,0|2,1,0]=4 123 B7R0.5 CCOC(=O)C(=C)C E492609 [0,0,1,0,0,0|2,1,0]=4 124 B7R0.5 CCOC(=O)C(=O)C E113332 [0,0,1,0,0,0|1,1,0]=3 125 B7R0.5 CCOC(=O)C(=O)Cl E109372 [0,0,1,0,0,0|2,1,0]=4 126 B7R0.5 CCOC(=O)C(=O)N E156399 [0,0,1,0,0,0|2,1,0]=4 127 B7R0.5 CCOC(=O)C(=O)[O-] E156500 [0,0,1,0,0,0|2,1,0]=4 128 B7R0.5 CCSC(C)C(=O)O E168418 [0,0,1,0,0,0|2,0,1]=4 129 B7R0.15 CC(=O)C(OC)OC P135662 [0,0,1,0,0,0|1,1,1]=4 130 B7R0.15 CCN(CC)C(=O)C I136012 [0,0,1,0,0,0|3,0,0]=4 131 B9R2.39 C1CC2CC1CC2=O N158897 [0,0,0,1,0,0|2,0,1]=4 132 B7R1.18 C1CC(C1)C(=O)Cl C170618 [0,0,0,0,1,0|2,0,1]=4 133 B7R1.18 C1CC(C1)C(=O)O C120879 [0,0,0,0,1,0|2,0,1]=4 134 B7R1.18 C1CNC1C(=O)O A124088 [0,0,0,0,1,0|1,0,2]=4 135 B7R1.18 C1CNC1C(=O)O A175896 [0,0,0,0,1,0|1,0,2]=4 136 B7R1.18 C1CNC1C(=O)O R177416 [0,0,0,0,1,0|1,0,2]=4 137 B7R1.18 CC(=O)C1CCC1 A151658 [0,0,0,0,1,0|1,0,1]=3 138 B9R1.6 C1CCC(=CC1)C(=O)O C106976 [0,0,0,0,0,1|3,0,0]=4 139 B9R1.6 C1CNCC(=C1)C(=O)O G579450 [0,0,0,0,0,1|2,0,1]=4 140 B9R1.6 CC(=O)C1=CC=CC=N1 A106232 [0,0,0,0,0,1|1,0,2]=4 141 B9R1.6 CC(=O)C1=CC=CC=N1 A106233 [0,0,0,0,0,1|1,0,2]=4 142 B9R1.6 CC(=O)C1=CN=CC=C1 A106235 [0,0,0,0,0,1|1,0,2]=4 143 B9R1.6 CC(=O)C1=CN=CC=C1 A106236 [0,0,0,0,0,1|1,0,2]=4 144 B9R1.6 CC(=O)C1=CN=CN=C1 P171742 [0,0,0,0,0,1|2,0,1]=4 145 B9R1.6 CC(=O)C1=CN=NC=C1 P176647 [0,0,0,0,0,1|2,0,1]=4 146 B9R1.6 CC(=O)C1=NC=CC=N1 P176709 [0,0,0,0,0,1|1,0,2]=4 147 B9R1.6 CC(=O)C1=NC=CN=C1 A100996 [0,0,0,0,0,1|1,0,2]=4 148 B9R1.6 CC(=O)C1CCCCC1 C139296 [0,0,0,0,0,1|2,0,1]=4 149 B9R1.6 CC(=O)N1CCCCC1 A151604 [0,0,0,0,0,1|3,0,0]=4 150 B9R1.6 CC(=O)N1CCNCC1 A111059 [0,0,0,0,0,1|3,0,0]=4 151 B9R1.6 CC(=O)N1CCOCC1 A112972 [0,0,0,0,0,1|3,0,0]=4 152 B9R1.13 CC(=O)NC1=NC=CS1 A151213 [0,0,0,0,0,1|0,0,2]=3 153 B6R0.4 CC(=CCCBr)C B470663 [1,0,1,0,0,0|2,0,0]=4 154 B6R0.4 CC(=O)C=COC M113467 [1,0,1,0,0,0|2,0,0]=4 155 B6R0.4 CC(=O)C=COC M434875 [1,0,1,0,0,0|2,0,0]=4 156 B6R0.4 CC(=O)CCCBr B345087 [1,0,1,0,0,0|1,0,1]=4 157 B6R0.4 CC(=O)CCCCl C108070 [1,0,1,0,0,0|1,0,1]=4 158 B6R0.4 CC(=O)NCCN A117219 [1,0,1,0,0,0|1,0,1]=4 159 B6R0.4 CC(=O)NCCO A112970 [1,0,1,0,0,0|0,1,1]=4 160 B6R0.4 CC(=O)NCCO A112971 [1,0,1,0,0,0|0,1,1]=4 161 B6R0.4 CC(=O)NCCS N347842 [1,0,1,0,0,0|0,0,1]=3 162 B6R0.4 CC(=O)OCCBr B102635 [1,0,1,0,0,0|1,1,0]=4 163 B6R0.4 CC(=O)OCCCl A140396 [1,0,1,0,0,0|1,1,0]=4 164 B6R0.4 CC(=O)OCCN A588049 [1,0,1,0,0,0|0,1,1]=4 165 B6R0.4 CC(=O)OCCO H156959 [1,0,1,0,0,0|1,1,0]=4 166 B6R0.4 CC(=O)SCCN T340735 [1,0,1,0,0,0|0,0,1]=3 167 B6R0.4 CCC=CC(=O)O T162309 [1,0,1,0,0,0|2,0,0]=4 168 B6R0.4 CCCCC(=O)C H105743 [1,0,1,0,0,0|1,0,1]=4 169 B6R0.4 CCCCC(=O)C H105744 [1,0,1,0,0,0|1,0,1]=4 170 B6R0.4 CCCCC(=O)C H111491 [1,0,1,0,0,0|1,0,1]=4 171 B6R0.4 CCCCC(=O)C H141140 [1,0,1,0,0,0|1,0,1]=4 172 B6R0.4 CCCOC(=O)C P103882 [1,0,1,0,0,0|1,1,0]=4 173 B6R0.4 CCCOC(=O)C P103883 [1,0,1,0,0,0|1,1,0]=4 174 B6R0.4 CCCSC(=O)C S161333 [1,0,1,0,0,0|1,0,0]=3 175 B6R0.4 CCSCC(=O)O E300419 [1,0,1,0,0,0|1,0,1]=4 176 B6R0.6 CC=CCCCO H300983 [1,0,1,0,0,0|1,1,0]=4 177 B6R0.6 CCCC=CC=O H107633 [1,0,1,0,0,0|2,0,0]=4 178 B6R0.6 CCCC=CC=O T425385 [1,0,1,0,0,0|2,0,0]=4 179 B6R0.1 CCC(=O)SCC S133123 [1,0,1,0,0,0|1,0,1]=4 180 B6R0.1 CCC=C(C)C=O M102187 [1,0,1,0,0,0|2,0,0]=4 181 B6R0.1 CCOC(=O)C=O E106246 [1,0,1,0,0,0|1,1,0]=4 182 B6R0.3 CC(=NO)C(=O)C D111028 [1,0,1,0,0,0|1,0,0]=3 183 B6R0.3 CC(=NO)C(=O)C D111029 [1,0,1,0,0,0|1,0,0]=3 184 B6R0.3 CC(=O)C(=O)CBr B185016 [1,0,1,0,0,0|1,1,0]=4 185 B6R0.3 CC(=O)C(=O)OC M136953 [1,0,1,0,0,0|1,1,0]=4 186 B6R0.3 CC(=O)N(C)OC N159405 [1,0,1,0,0,0|1,1,0]=4 187 B6R0.3 CC=C(C)C(=O)C M158812 [1,0,1,0,0,0|1,0,0]=3 188 B6R0.3 CC=C(C)C(=O)C M401547 [1,0,1,0,0,0|1,0,0]=3 189 B6R0.3 CC=C(C)C(=O)Cl T161611 [1,0,1,0,0,0|2,0,0]=4 190 B6R0.3 CC=C(C)C(=O)O B137277 [1,0,1,0,0,0|2,0,0]=4 191 B6R0.3 CC=C(C)C(=O)O T107164 [1,0,1,0,0,0|2,0,0]=4 192 B6R0.3 CCC(=C)C(=O)O E477290 [1,0,1,0,0,0|2,0,0]=4 193 B6R0.3 CCC(=O)C(=O)C P106293 [1,0,1,0,0,0|0,1,0]=3 194 B6R0.3 CCC(=O)C(=O)O K106253 [1,0,1,0,0,0|1,1,0]=4 195 B6R0.3 CCC(=O)C(=O)[O-] S161412 [1,0,1,0,0,0|1,1,0]=4 196 B6R0.3 CCC(C(=O)C)S M102973 [1,0,1,0,0,0|0,0,1]=3 197 B6R0.3 CCC(C)C(=O)C M158800 [1,0,1,0,0,0|1,0,1]=4 198 B6R0.3 CCN(C)C(=O)C N193140 [1,0,1,0,0,0|2,0,0]=4 199 B6R0.9 CCC(=CC)CC E156180 [1,0,1,0,0,0|2,0,0]=4 200 B6R1.2 C1C=CC(=O)S1 H472400 [2,0,0,0,0,0|1,0,1]=4 201 B6R1.2 C1CC(=N)SC1 I106793 [2,0,0,0,0,0|2,0,0]=4 202 B6R1.2 C1CC(=N)SC1 I492458 [2,0,0,0,0,0|2,0,0]=4 203 B6R1.2 C1CC(=NC1)N A151483 [2,0,0,0,0,0|2,0,0]=4 204 B6R1.2 C1CC(=O)NC1 P112692 [2,0,0,0,0,0|1,0,1]=4 205 B6R1.2 C1CC(=O)NC1 P468968 [2,0,0,0,0,0|1,0,1]=4 206 B6R1.2 C1CC(=O)SC1 T472178 [2,0,0,0,0,0|1,0,0]=3 207 B6R1.2 C1CCC(=O)C1 C108566 [2,0,0,0,0,0|2,0,0]=4 208 B6R1.2 C1CCC(=O)C1 C108567 [2,0,0,0,0,0|2,0,0]=4 209 B6R1.2 C1CCC(=O)C1 C108568 [2,0,0,0,0,0|2,0,0]=4 210 B6R1.2 C1CCC(=O)C1 C108569 [2,0,0,0,0,0|2,0,0]=4 211 B6R1.2 C1CNC(=O)N1 I157588 [2,0,0,0,0,0|1,0,1]=4 212 B6R1.2 C1CNC(=O)N1 I299072 [2,0,0,0,0,0|1,0,1]=4 213 B6R1.2 C1COC(=O)N1 O133460 [2,0,0,0,0,0|0,1,1]=4 214 B6R1.2 C1COC(=O)O1 E105727 [2,0,0,0,0,0|1,1,0]=4 215 B6R1.2 C1COC(=O)O1 E105728 [2,0,0,0,0,0|1,1,0]=4 216 B6R1.2 C1CSC(=N1)N A305205 [2,0,0,0,0,0|1,0,0]=3 217 B6R1.2 C1CSC(=O)N1 T192435 [2,0,0,0,0,0|0,0,1]=3 218 B6R1.2 C1CSC(=S)N1 T122399 [2,0,0,0,0,0|0,1,1]=4 219 B6R1.2 C1CSC(=S)S1 E124195 [2,0,0,0,0,0|1,1,0]=4 220 B6R1.2 C=C1CCCC1 M158228 [2,0,0,0,0,0|2,0,0]=4 221 B6R1.2 CC1=CCCC1 M158230 [2,0,0,0,0,0|2,0,0]=4 222 B6R1.2 CC1=NC=CS1 M299351 [2,0,0,0,0,0|0,0,2]=4 223 B6R1.2 CC1=NCCC1 M187405 [2,0,0,0,0,0|1,0,0]=3 224 B6R1.2 CC1=NCCN1 M158525 [2,0,0,0,0,0|1,0,0]=3 225 B6R1.2 CC1=NCCO1 M158497 [2,0,0,0,0,0|0,1,0]=3 226 B6R1.2 CC1=NCCS1 M103076 [2,0,0,0,0,0|0,0,0]=2 227 B6R1.2 CC1CCCS1 M138391 [2,0,0,0,0,0|1,0,1]=4 228 B8R0.6 CCCC=CC(=O)OC M134288 [0,1,1,0,0,0|2,0,0]=4 229 B8R0.7 CC(=O)OCCCSC M157982 [0,1,1,0,0,0|2,0,0]=4 230 B8R0.7 CCCCC=CC(=O)C O100829 [0,1,1,0,0,0|2,0,0]=4 231 B8R0.8 CCCCC(=O)C(=O)C H106591 [0,1,1,0,0,0|2,0,0]=4 232 B8R0.3 CCOC(=O)C(=O)CBr E111180 [0,1,1,0,0,0|1,1,0]=4 233 B8R1.1 C1=C(N=C(S1)C=O)Br W137491 [1,1,0,0,0,0|0,0,2]=4 234 B8R1.1 CC1=CSC(=N1)C=O W131880 [1,1,0,0,0,0|0,0,2]=4 235 B8R1.8 C1CSC(=N1)NC#N C192414 [1,1,0,0,0,0|1,0,1]=4 236 B8R1.8 CCCC1=NCCN1 P302987 [1,1,0,0,0,0|1,0,1]=4 237 B8R1.8 CCCC1=NCCO1 P160311 [1,1,0,0,0,0|0,1,1]=4 238 B10R1.15 COC(=O)C1=CCCCC1 M168102 [0,1,0,0,0,1|2,0,0]=4 239 B10R1.15 COC(=O)C1=CCOCC1 M171857 [0,1,0,0,0,1|2,0,0]=4 240 B10R1.54 CC(=O)NC1=NC=C(S1)Cl A168368 [0,1,0,0,0,1|0,0,2]=4 241 B10R1.11 CCOC(=O)C1=NC=CS1 E190966 [0,2,0,0,0,0|0,0,2]=4 242 B10R1.14 CC1=CSC(=N1)C(=O)OC M587284 [0,2,0,0,0,0|0,0,2]=4 243 B8R1.22 C1CCC(=O)C=CC1 C138031 [0,0,1,1,0,0|2,0,0]=4 244 B8R1.5 C1CCC(=O)C(=O)C1 C123365 [0,0,1,1,0,0|1,1,0]=4 245 B6R1.11 C1CC1C(=O)Cl C133840 [0,0,0,0,2,0|1,0,1]=4 246 B6R1.11 C1CC1C(=O)N C134392 [0,0,0,0,2,0|1,0,1]=4 247 B6R1.11 C1CC1C(=O)O C106979 [0,0,0,0,2,0|1,0,1]=4 248 B6R1.11 CC(=O)C1CC1 C108050 [0,0,0,0,2,0|0,0,1]=3 249 B8R1.2 C1CCC(=CC1)C=O C468613 [1,0,0,0,0,1|2,0,0]=4