0 B10R1.15 C/N=C(\N)/C1=CN=CC=C1 Z2528328215 [0,0,0,0,0,0|4,0,0]=4 1 B10R1.15 C=C(CN)C1=CC=CC=C1 Z2065464323 [0,0,0,0,0,0|1,0,1]=2 2 B10R1.15 C=CC(O)C1=CC=CC=C1 Z1255438717 [0,0,0,0,0,0|2,0,1]=3 3 B10R1.15 CC(C=O)C1=CC=CC=C1 Z104495674 [0,0,0,0,0,0|0,0,2]=2 4 B10R1.15 CC(CBr)C1=CC=CC=C1 Z756118300 [0,0,0,0,0,0|1,0,3]=4 5 B10R1.15 CCC(=O)C1=CC=CC=C1 Z104473068 [0,0,0,0,0,0|2,0,1]=3 6 B10R1.15 CCC(=O)C1=CC=NC=C1 Z513733916 [0,0,0,0,0,0|3,0,1]=4 7 B10R1.15 CCC(N)C1=CC=CC=C1 Z1262252904 [0,0,0,0,0,0|2,0,2]=4 8 B10R1.15 CCC(O)C1=CC=CC=C1 Z335245178 [0,0,0,0,0,0|2,0,2]=4 9 B10R1.15 CN(N=O)C1=CC=CC=C1 Z87001980 [0,0,0,0,0,0|2,0,1]=3 10 B10R1.15 CNC(=N)C1=CC=CC=C1 Z2096088186 [0,0,0,0,0,0|3,0,0]=3 11 B10R1.15 CNC(=N)C1=NC=CC=C1 Z2735598147 [0,0,0,0,0,0|4,0,0]=4 12 B10R1.15 CNC(=O)C1=CC=CC=C1 Z32016410 [0,0,0,0,0,0|3,0,0]=3 13 B10R1.15 CNC(=O)C1=NC=CC=C1 Z32016284 [0,0,0,0,0,0|4,0,0]=4 14 B10R1.15 CNC(C)C1=CC=CC=C1 Z85917524 [0,0,0,0,0,0|2,0,2]=4 15 B10R1.15 COC(=O)C1=CC=CC=C1 Z19825577 [0,0,0,0,0,0|3,0,0]=3 16 B10R1.15 COC(=O)C1=CN=CC=C1 Z57036282 [0,0,0,0,0,0|4,0,0]=4 17 B10R1.15 COC(=O)C1=NC=CC=C1 Z19673259 [0,0,0,0,0,0|4,0,0]=4 18 B10R1.15 C[C@H](CN)C1=CC=CC=C1 Z1203578128 [0,0,0,0,0,0|1,0,3]=4 19 B10R1.15 N#CC(Br)C1=CC=CC=C1 Z1198157485 [0,0,0,0,0,0|2,0,2]=4 20 B10R1.15 N/C(=N\O)/C1=CC=CC=C1 Z56827052 [0,0,0,0,0,0|2,0,1]=3 21 B10R1.15 N/C(=N\O)/C1=CC=NC=C1 Z220383526 [0,0,0,0,0,0|3,0,1]=4 22 B10R1.15 N/C(=N\O)/C1=CN=CC=C1 Z221503662 [0,0,0,0,0,0|3,0,1]=4 23 B10R1.15 N/C(=N\O)/C1=NC=CC=C1 Z228474568 [0,0,0,0,0,0|3,0,1]=4 24 B10R1.15 NC(CO)C1=CC=CC=C1 Z381674942 [0,0,0,0,0,0|1,0,3]=4 25 B10R1.15 NCC(=O)C1=CC=CC=C1 Z600428568 [0,0,0,0,0,0|2,0,1]=3 26 B10R1.15 NCC(=O)C1=CC=NC=C1 Z2677521709 [0,0,0,0,0,0|3,0,1]=4 27 B10R1.15 NCC(N)C1=CC=CC=C1 Z425861034 [0,0,0,0,0,0|2,0,2]=4 28 B10R1.15 NCC(O)C1=CC=CC=C1 Z104476088 [0,0,0,0,0,0|2,0,2]=4 29 B10R1.15 NNC(=O)C1=CC=CC=C1 Z56926669 [0,0,0,0,0,0|3,0,0]=3 30 B10R1.15 NNC(=O)C1=CC=NC=C1 Z58981801 [0,0,0,0,0,0|4,0,0]=4 31 B10R1.15 NNC(=O)C1=CN=CC=C1 Z58981809 [0,0,0,0,0,0|4,0,0]=4 32 B10R1.15 NNC(=O)C1=NC=CC=C1 Z56922131 [0,0,0,0,0,0|4,0,0]=4 33 B10R1.15 N[C@@H](CO)C1=CC=CC=C1 Z1201618614 [0,0,0,0,0,0|1,0,3]=4 34 B10R1.15 N[C@H](CO)C1=CC=CC=C1 Z1101444224 [0,0,0,0,0,0|1,0,3]=4 35 B10R1.15 O=C(CCl)C1=CC=CC=C1 Z57834468 [0,0,0,0,0,0|2,0,1]=3 36 B10R1.15 O=C(CCl)C1=CC=NC=C1 Z1198181039 [0,0,0,0,0,0|3,0,1]=4 37 B10R1.15 O=C(CCl)C1=CN=CC=C1 Z2768198137 [0,0,0,0,0,0|3,0,1]=4 38 B10R1.15 O=C(CCl)C1=NC=CC=C1 Z1205657985 [0,0,0,0,0,0|3,0,1]=4 39 B10R1.15 O=C(CO)C1=CC=CC=C1 Z906206792 [0,0,0,0,0,0|1,0,2]=3 40 B10R1.15 O=C(NO)C1=CC=CC=C1 Z56912029 [0,0,0,0,0,0|2,0,1]=3 41 B10R1.15 O=C(NO)C1=CN=CC=C1 Z59181939 [0,0,0,0,0,0|3,0,1]=4 42 B10R1.15 O=CC(=O)C1=CC=CC=C1 Z1954804411 [0,0,0,0,0,0|1,0,0]=1 43 B9R1.6 CC(=O)C1=CC=CC=C1 Z57127548 [1,0,0,0,0,0|0,0,1]=2 44 B9R1.6 CC(=O)C1=CN=CC=C1 Z104474436 [1,0,0,0,0,0|1,0,1]=3 45 B9R1.6 CC(=O)C1=CN=CN=C1 Z992240312 [1,0,0,0,0,0|2,0,1]=4 46 B9R1.6 CC(=O)C1=NC=CC=C1 Z104474432 [1,0,0,0,0,0|1,0,1]=3 47 B9R1.6 CC(=O)C1=NC=CC=N1 Z513735982 [1,0,0,0,0,0|2,0,1]=4 48 B9R1.6 CC(=O)C1=NC=CN=C1 Z513735920 [1,0,0,0,0,0|2,0,1]=4 49 B9R1.6 CC(=O)C1=NN=CC=C1 Z1255432788 [1,0,0,0,0,0|2,0,1]=4 50 B9R1.6 CC(N)C1=CC=CC=C1 Z57102377 [1,0,0,0,0,0|1,0,2]=4 51 B9R1.6 CC(O)C1=CC=CC=C1 Z104494956 [1,0,0,0,0,0|0,0,3]=4 52 B9R1.6 CN(N)C1=CC=CC=C1 Z57985384 [1,0,0,0,0,0|2,0,1]=4 53 B9R1.6 C[C@@H](N)C1=CC=CC=C1 Z1079183182 [1,0,0,0,0,0|1,0,2]=4 54 B9R1.6 C[C@@H](O)C1=CC=CC=C1 Z360055166 [1,0,0,0,0,0|0,0,3]=4 55 B9R1.6 C[C@H](N)C1=CC=CC=C1 Z1079131570 [1,0,0,0,0,0|1,0,2]=4 56 B9R1.6 C[C@H](O)C1=CC=CC=C1 Z360055168 [1,0,0,0,0,0|0,0,3]=4 57 B9R1.6 N=C(N)C1=CC=CC=C1 Z166624376 [1,0,0,0,0,0|2,0,0]=3 58 B9R1.6 N=C(N)C1=CC=NC=C1 Z444349574 [1,0,0,0,0,0|3,0,0]=4 59 B9R1.6 N=C(N)C1=CN=CC=C1 Z444349586 [1,0,0,0,0,0|3,0,0]=4 60 B9R1.6 N=C(N)C1=NC=CC=C1 Z540728738 [1,0,0,0,0,0|3,0,0]=4 61 B9R1.6 NC(=O)C1=CN=CC=C1 Z33546463 [1,0,0,0,0,0|2,0,0]=3 62 B9R1.6 NC(=O)C1=CN=NC=C1 Z1203579431 [1,0,0,0,0,0|3,0,0]=4 63 B9R1.6 NC(=O)C1=NC=CC=C1 Z33546380 [1,0,0,0,0,0|2,0,0]=3 64 B9R1.6 NC(=O)C1=NC=CC=N1 Z1198151945 [1,0,0,0,0,0|3,0,0]=4 65 B9R1.6 NC(=O)C1=NC=CN=C1 Z33546644 [1,0,0,0,0,0|3,0,0]=4 66 B9R1.6 NC(=O)C1=NC=NC=C1 Z1203579432 [1,0,0,0,0,0|3,0,0]=4 67 B9R1.6 NC(=O)C1=NN=CC=C1 Z1203580134 [1,0,0,0,0,0|3,0,0]=4 68 B9R1.6 NC(=S)C1=CC=CC=C1 Z57070430 [1,0,0,0,0,0|1,1,0]=3 69 B9R1.6 NC(=S)C1=CC=NC=C1 Z317055504 [1,0,0,0,0,0|2,1,0]=4 70 B9R1.6 NC(=S)C1=CN=CC=C1 Z56960184 [1,0,0,0,0,0|2,1,0]=4 71 B9R1.6 NC(=S)C1=NC=CC=C1 Z56956073 [1,0,0,0,0,0|2,1,0]=4 72 B9R1.6 O=C(O)C1=CC=CC=C1 Z57127480 [1,0,0,0,0,0|1,0,0]=2 73 B9R1.6 O=C(O)C1=CC=NC=C1 Z104473016 [1,0,0,0,0,0|2,0,0]=3 74 B9R1.6 O=C(O)C1=CN=CC=C1 Z56755709 [1,0,0,0,0,0|2,0,0]=3 75 B9R1.6 O=C(O)C1=CN=CN=C1 Z336079948 [1,0,0,0,0,0|3,0,0]=4 76 B9R1.6 O=C(O)C1=CN=NC=C1 Z1182328443 [1,0,0,0,0,0|3,0,0]=4 77 B9R1.6 O=C(O)C1=NC=CC=C1 Z57968195 [1,0,0,0,0,0|2,0,0]=3 78 B9R1.6 O=C(O)C1=NC=CC=N1 Z1259341107 [1,0,0,0,0,0|3,0,0]=4 79 B9R1.6 O=C(O)C1=NC=CN=C1 Z104476002 [1,0,0,0,0,0|3,0,0]=4 80 B9R1.6 O=C(O)C1=NC=NC=C1 Z57064900 [1,0,0,0,0,0|3,0,0]=4 81 B9R1.6 O=C(O)C1=NN=CC=C1 Z1201621268 [1,0,0,0,0,0|3,0,0]=4 82 B9R1.6 O=[N+]([O-])C1=NC=CC=C1 Z361899950 [1,0,0,0,0,0|3,0,0]=4 83 B9R1.6 O=[S-](=O)C1=CC=CC=C1 Z104501326 [1,0,0,0,0,0|2,0,0]=3 84 B9R1.6 OB(O)C1=CC=CC=C1 Z111782400 [1,0,0,0,0,0|2,0,1]=4 85 B9R1.8 CCCC1=CC=CC=C1 Z104479154 [1,0,0,0,0,0|1,0,2]=4 86 B9R1.8 CCNC1=CC=CC=C1 Z104472482 [1,0,0,0,0,0|2,0,1]=4 87 B9R1.8 N#COC1=CC=CC=C1 Z1198165353 [1,0,0,0,0,0|2,0,1]=4 88 B9R1.8 NNCC1=CC=CC=C1 Z56969306 [1,0,0,0,0,0|2,0,1]=4 89 B9R1.8 NOCC1=CC=CC=C1 Z90668722 [1,0,0,0,0,0|2,0,1]=4 90 B9R1.8 O=CCC1=CC=CC=C1 Z104472146 [1,0,0,0,0,0|0,0,1]=2 91 B9R1.8 OCCC1=CC=CC=C1 Z104473586 [1,0,0,0,0,0|0,0,3]=4 92 B9R1.8 S=C=NC1=CC=CC=C1 Z56904678 [1,0,0,0,0,0|1,1,1]=4 93 B11R1.7 C=CS(=O)(=O)C1=CC=CC=C1 Z1020737978 [0,1,0,0,0,0|3,0,0]=4 94 B11R1.7 CC(C)(C=O)C1=CC=CC=C1 Z1079442604 [0,1,0,0,0,0|0,0,2]=3 95 B11R1.7 CC(C)(C=O)C1=CC=NC=C1 Z2732458612 [0,1,0,0,0,0|1,0,2]=4 96 B11R1.7 CC(C)(C=O)C1=CN=CC=C1 Z1511889697 [0,1,0,0,0,0|1,0,2]=4 97 B11R1.7 CC(C)(C=O)C1=NC=CC=C1 Z1255506395 [0,1,0,0,0,0|1,0,2]=4 98 B11R1.12 CCC(C=O)C1=CC=CC=C1 Z1079132778 [0,1,0,0,0,0|0,0,2]=3 99 B11R1.12 N#CC(C=O)C1=CC=CC=C1 Z57912400 [0,1,0,0,0,0|0,0,2]=3 100 B11R1.16 C/C=C/C(=O)C1=CC=CC=C1 Z2259130553 [0,1,0,0,0,0|2,0,0]=3 101 B11R1.16 CC(CC=O)C1=CC=CC=C1 Z57921394 [0,1,0,0,0,0|0,0,2]=3 102 B11R1.16 CCCC(=O)C1=CC=CC=C1 Z104477742 [0,1,0,0,0,0|2,0,1]=4 103 B11R1.16 CCOC(=O)C1=CC=CC=C1 Z53835169 [0,1,0,0,0,0|2,0,1]=4 104 B11R1.16 CSCC(=O)C1=CC=CC=C1 Z732208586 [0,1,0,0,0,0|1,1,1]=4 105 B11R1.16 N#C/C=C(\Cl)/C1=CC=CC=C1 Z56912627 [0,1,0,0,0,0|2,0,0]=3 106 B11R1.16 N#C/C=C(\N)/C1=CC=CC=C1 Z2259146567 [0,1,0,0,0,0|2,0,0]=3 107 B11R1.16 N#CCC(=O)C1=CC=CC=C1 Z56899088 [0,1,0,0,0,0|2,0,1]=4 108 B11R1.16 N#CNC(=O)C1=CC=CC=C1 Z276572712 [0,1,0,0,0,0|2,0,1]=4 109 B11R1.16 O=C(CCCl)C1=CC=CC=C1 Z1065610596 [0,1,0,0,0,0|2,0,1]=4 110 B11R1.16 O=C(NCO)C1=CC=CC=C1 Z56799838 [0,1,0,0,0,0|1,0,2]=4 111 B11R1.22 C#CC(=O)C1=CC=C(C=C1)Cl Z1266856320 [0,1,0,0,0,0|2,0,1]=4 112 B11R1.22 C=C(CO)C1=CC=C(C=C1)C Z1896562587 [0,1,0,0,0,0|0,0,2]=3 113 B11R1.22 C=CC(=O)C1=CC=C(C=C1)O Z1416178613 [0,1,0,0,0,0|2,0,0]=3 114 B11R1.22 CC(C=O)C1=CC=C(C=C1)Br Z1269114153 [0,1,0,0,0,0|0,0,2]=3 115 B11R1.22 CC(C=O)C1=CC=C(C=C1)Cl Z1198334992 [0,1,0,0,0,0|0,0,2]=3 116 B11R1.22 CC(C=O)C1=CC=C(C=C1)F Z1255400140 [0,1,0,0,0,0|0,0,2]=3 117 B11R1.22 CC1=CC=C(C=C1)/C(=N/O)/N Z57626985 [0,1,0,0,0,0|2,0,1]=4 118 B11R1.22 CC1=CC=C(C=C1)C(=O)CBr Z104481640 [0,1,0,0,0,0|2,0,1]=4 119 B11R1.22 CC1=CC=C(C=C1)C(=O)CCl Z56886309 [0,1,0,0,0,0|2,0,1]=4 120 B11R1.22 CC1=CC=C(C=C1)C(=O)CN Z275368898 [0,1,0,0,0,0|2,0,1]=4 121 B11R1.22 CC1=CC=C(C=C1)C(=O)CO Z228585628 [0,1,0,0,0,0|1,0,2]=4 122 B11R1.22 CC1=CC=C(C=C1)C(=O)NO Z59182007 [0,1,0,0,0,0|2,0,1]=4 123 B11R1.22 CC1=CC=C(C=C1)C(C)C=O Z1198150045 [0,1,0,0,0,0|0,0,2]=3 124 B11R1.22 CCC(=O)C1=CC=C(C=C1)Br Z104485724 [0,1,0,0,0,0|2,0,1]=4 125 B11R1.22 CCC(=O)C1=CC=C(C=C1)Cl Z104477486 [0,1,0,0,0,0|2,0,1]=4 126 B11R1.22 CCC(=O)C1=CC=C(C=C1)F Z104477898 [0,1,0,0,0,0|2,0,1]=4 127 B11R1.22 CCC(=O)C1=CC=C(C=C1)I Z285137052 [0,1,0,0,0,0|2,0,1]=4 128 B11R1.22 CCC(=O)C1=CC=C(C=C1)N Z1203578051 [0,1,0,0,0,0|2,0,1]=4 129 B11R1.22 CCC(=O)C1=CC=C(C=C1)O Z104499156 [0,1,0,0,0,0|2,0,1]=4 130 B11R1.22 CNC(=O)C1=CC=C(C=C1)Br Z30272262 [0,1,0,0,0,0|3,0,0]=4 131 B11R1.22 CNC(=O)C1=CC=C(C=C1)C Z32016517 [0,1,0,0,0,0|3,0,0]=4 132 B11R1.22 CNC(=O)C1=CC=C(C=C1)Cl Z32016366 [0,1,0,0,0,0|3,0,0]=4 133 B11R1.22 CNC(=O)C1=CC=C(C=C1)I Z30272273 [0,1,0,0,0,0|3,0,0]=4 134 B11R1.22 CNC(=O)C1=CC=C(C=C1)N Z56985799 [0,1,0,0,0,0|3,0,0]=4 135 B11R1.22 CNC(=O)C1=CC=C(C=C1)O Z183855140 [0,1,0,0,0,0|3,0,0]=4 136 B11R1.22 COC(=O)C1=CC=C(C=C1)Br Z19682625 [0,1,0,0,0,0|3,0,0]=4 137 B11R1.22 COC(=O)C1=CC=C(C=C1)I Z19776689 [0,1,0,0,0,0|3,0,0]=4 138 B11R1.22 COC(=O)C1=CC=C(C=C1)N Z54178705 [0,1,0,0,0,0|3,0,0]=4 139 B11R1.22 COC(=O)C1=CC=C(C=C1)O Z19674820 [0,1,0,0,0,0|3,0,0]=4 140 B11R1.22 N/C(=N\O)/C1=CC=C(C=C1)Cl Z57627739 [0,1,0,0,0,0|2,0,1]=4 141 B11R1.22 N/C(=N\O)/C1=CC=C(C=C1)O Z156964722 [0,1,0,0,0,0|2,0,1]=4 142 B11R1.22 NC1=CC=C(C=C1)/C(=N/O)/N Z364003706 [0,1,0,0,0,0|2,0,1]=4 143 B11R1.22 NCC(=O)C1=CC=C(C=C1)Br Z1741980207 [0,1,0,0,0,0|2,0,1]=4 144 B11R1.22 NCC(=O)C1=CC=C(C=C1)Cl Z56928681 [0,1,0,0,0,0|2,0,1]=4 145 B11R1.22 NCC(=O)C1=CC=C(C=C1)F Z275365838 [0,1,0,0,0,0|2,0,1]=4 146 B11R1.22 NCC(=O)C1=CC=C(C=C1)O Z1198177329 [0,1,0,0,0,0|2,0,1]=4 147 B11R1.22 NNC(=O)C1=CC=C(C=C1)Br Z56899079 [0,1,0,0,0,0|3,0,0]=4 148 B11R1.22 NNC(=O)C1=CC=C(C=C1)F Z56862389 [0,1,0,0,0,0|3,0,0]=4 149 B11R1.22 NNC(=O)C1=CC=C(C=C1)N Z57199627 [0,1,0,0,0,0|3,0,0]=4 150 B11R1.22 NNC(=O)C1=CC=C(C=C1)O Z57036327 [0,1,0,0,0,0|3,0,0]=4 151 B11R1.22 O=C(CBr)C1=CC=C(C=C1)Br Z57708731 [0,1,0,0,0,0|2,0,1]=4 152 B11R1.22 O=C(CBr)C1=CC=C(C=C1)Cl Z104484576 [0,1,0,0,0,0|2,0,1]=4 153 B11R1.22 O=C(CBr)C1=CC=C(C=C1)F Z104495742 [0,1,0,0,0,0|2,0,1]=4 154 B11R1.22 O=C(CCl)C1=CC=C(C=C1)Br Z56886257 [0,1,0,0,0,0|2,0,1]=4 155 B11R1.22 O=C(CCl)C1=CC=C(C=C1)Cl Z104477840 [0,1,0,0,0,0|2,0,1]=4 156 B11R1.22 O=C(CCl)C1=CC=C(C=C1)F Z104478978 [0,1,0,0,0,0|2,0,1]=4 157 B11R1.22 O=C(CCl)C1=CC=C(C=C1)I Z57046985 [0,1,0,0,0,0|2,0,1]=4 158 B11R1.22 O=C(CCl)C1=CC=C(C=C1)O Z104378296 [0,1,0,0,0,0|2,0,1]=4 159 B11R1.22 O=C(CO)C1=CC=C(C=C1)Cl Z906206720 [0,1,0,0,0,0|1,0,2]=4 160 B11R1.22 O=C(NO)C1=CC=C(C=C1)Br Z59181930 [0,1,0,0,0,0|2,0,1]=4 161 B11R1.22 O=C(NO)C1=CC=C(C=C1)Cl Z59181938 [0,1,0,0,0,0|2,0,1]=4 162 B11R1.22 O=C(NO)C1=CC=C(C=C1)I Z59181951 [0,1,0,0,0,0|2,0,1]=4 163 B11R1.22 O=CC(=O)C1=CC=C(C=C1)Br Z1269163105 [0,1,0,0,0,0|1,0,0]=2 164 B11R1.23 CC(C=O)C1=CC(=CC=C1)Br Z1269224544 [0,1,0,0,0,0|0,0,2]=3 165 B11R1.23 CC(C=O)C1=CC(=CC=C1)Cl Z1222424632 [0,1,0,0,0,0|0,0,2]=3 166 B11R1.23 CC(C=O)C1=CC(=CC=C1)F Z1222424642 [0,1,0,0,0,0|0,0,2]=3 167 B11R1.23 CC1=CC(=CC=C1)C(=O)CN Z3026469451 [0,1,0,0,0,0|2,0,1]=4 168 B11R1.23 CC1=CC=CC(=C1)C(C)C=O Z1222424653 [0,1,0,0,0,0|0,0,2]=3 169 B11R1.23 CCC(=O)C1=CC(=CC=C1)Br Z104486266 [0,1,0,0,0,0|2,0,1]=4 170 B11R1.23 CCC(=O)C1=CC(=CC=C1)Cl Z104477758 [0,1,0,0,0,0|2,0,1]=4 171 B11R1.23 CCC(=O)C1=CC(=CC=C1)N Z1203578334 [0,1,0,0,0,0|2,0,1]=4 172 B11R1.23 CNC(=O)C1=CC(=CC=C1)Cl Z32016383 [0,1,0,0,0,0|3,0,0]=4 173 B11R1.23 CNC(=O)C1=CC(=CC=C1)F Z32016733 [0,1,0,0,0,0|3,0,0]=4 174 B11R1.23 CNC(=O)C1=CC(=CC=C1)N Z57040519 [0,1,0,0,0,0|3,0,0]=4 175 B11R1.23 CNC(=O)C1=CC(=CC=C1)O Z32016364 [0,1,0,0,0,0|3,0,0]=4 176 B11R1.23 COC(=O)C1=CC(=CC=C1)C Z18750812 [0,1,0,0,0,0|3,0,0]=4 177 B11R1.23 COC(=O)C1=CC(=CC=C1)N Z57032594 [0,1,0,0,0,0|3,0,0]=4 178 B11R1.23 N/C(=N\O)/C1=CC(=CC=C1)Br Z57741780 [0,1,0,0,0,0|2,0,1]=4 179 B11R1.23 N/C(=N\O)/C1=CC(=CC=C1)Cl Z90662858 [0,1,0,0,0,0|2,0,1]=4 180 B11R1.23 N/C(=N\O)/C1=CC(=CC=C1)F Z381355872 [0,1,0,0,0,0|2,0,1]=4 181 B11R1.23 N/C(=N\O)/C1=CC(=CC=C1)O Z359513480 [0,1,0,0,0,0|2,0,1]=4 182 B11R1.23 NC1=CC=CC(=C1)/C(=N/O)/N Z364003720 [0,1,0,0,0,0|2,0,1]=4 183 B11R1.23 NCC(=O)C1=CC(=CC=C1)Br Z275368900 [0,1,0,0,0,0|2,0,1]=4 184 B11R1.23 NCC(=O)C1=CC(=CC=C1)Cl Z1741966377 [0,1,0,0,0,0|2,0,1]=4 185 B11R1.23 NCC(=O)C1=CC(=CC=C1)F Z3025863838 [0,1,0,0,0,0|2,0,1]=4 186 B11R1.23 NNC(=O)C1=CC(=CC=C1)Cl Z56899158 [0,1,0,0,0,0|3,0,0]=4 187 B11R1.23 NNC(=O)C1=CC(=CC=C1)N Z56922179 [0,1,0,0,0,0|3,0,0]=4 188 B11R1.23 NNC(=O)C1=CC(=CC=C1)O Z56930730 [0,1,0,0,0,0|3,0,0]=4 189 B11R1.23 O=C(CBr)C1=CC=CC(=C1)Cl Z104482040 [0,1,0,0,0,0|2,0,1]=4 190 B11R1.23 O=C(CBr)C1=CC=CC(=C1)F Z111411220 [0,1,0,0,0,0|2,0,1]=4 191 B11R1.23 O=C(NO)C1=CC(=CC=C1)Br Z59181977 [0,1,0,0,0,0|2,0,1]=4 192 B11R1.23 O=C(NO)C1=CC(=CC=C1)Cl Z59181969 [0,1,0,0,0,0|2,0,1]=4 193 B11R1.23 O=C(NO)C1=CC(=CC=C1)O Z317038072 [0,1,0,0,0,0|2,0,1]=4 194 B11R1.23 O=CC(=O)C1=CC=CC(=C1)Br Z2472857402 [0,1,0,0,0,0|1,0,0]=2 195 B11R1.23 O=CC(=O)C1=CC=CC(=C1)O Z1255357387 [0,1,0,0,0,0|1,0,0]=2 196 B11R1.36 C=C(C(=O)O)C1=CC=CC=C1 Z1201618094 [0,1,0,0,0,0|0,0,0]=1 197 B11R1.36 CC(=O)C(=O)C1=CC=CC=C1 Z1255485389 [0,1,0,0,0,0|1,0,0]=2 198 B11R1.36 CC(=O)C(C)C1=CC=CC=C1 Z1255383314 [0,1,0,0,0,0|0,0,2]=3 199 B11R1.36 CC(=O)C(N)C1=CC=CC=C1 Z3234810419 [0,1,0,0,0,0|1,0,1]=3 200 B11R1.36 CC(=O)N(C)C1=CC=CC=C1 Z31506242 [0,1,0,0,0,0|1,0,1]=3 201 B11R1.36 CC(=O)N(C)C1=CC=NC=C1 Z1889797965 [0,1,0,0,0,0|2,0,1]=4 202 B11R1.36 CC(=O)N(C)C1=CN=CC=C1 Z1203252645 [0,1,0,0,0,0|2,0,1]=4 203 B11R1.36 CC(=O)N(C)C1=NC=CC=C1 Z223364322 [0,1,0,0,0,0|2,0,1]=4 204 B11R1.36 CC(C(=O)N)C1=CC=CC=C1 Z1255506457 [0,1,0,0,0,0|0,0,2]=3 205 B11R1.36 CC(C(=O)O)C1=CN=CC=C1 Z792377268 [0,1,0,0,0,0|1,0,2]=4 206 B11R1.36 CC(C(=O)[O-])C1=CC=NC=C1 Z2408359395 [0,1,0,0,0,0|1,0,2]=4 207 B11R1.36 CC(Cl)C(=O)C1=CC=CC=C1 Z199509008 [0,1,0,0,0,0|2,0,1]=4 208 B11R1.36 CN(C(=N)N)C1=CC=CC=C1 Z1269638527 [0,1,0,0,0,0|2,0,1]=4 209 B11R1.36 CN(C(=O)N)C1=CN=CC=C1 Z1188339188 [0,1,0,0,0,0|2,0,1]=4 210 B11R1.36 CN(O)C(=O)C1=CC=CC=C1 Z1416187404 [0,1,0,0,0,0|2,0,1]=4 211 B11R1.36 C[C@@H](C(=O)O)C1=CN=CC=C1 Z5462337230 [0,1,0,0,0,0|1,0,2]=4 212 B11R1.36 C[C@H](C(=O)O)C1=CN=CC=C1 Z5462556304 [0,1,0,0,0,0|1,0,2]=4 213 B11R1.36 NC(=O)C(Cl)C1=CC=CC=C1 Z57069256 [0,1,0,0,0,0|1,0,1]=3 214 B11R1.36 NC(=O)C(N)C1=CC=CC=C1 Z57204607 [0,1,0,0,0,0|1,0,1]=3 215 B11R1.36 NC(=O)C(N)C1=NC=CC=C1 Z1251358507 [0,1,0,0,0,0|2,0,1]=4 216 B11R1.36 NC(C(=O)O)C1=CC=CC=C1 Z147647142 [0,1,0,0,0,0|1,0,1]=3 217 B11R1.36 NC(C(=O)O)C1=CN=CC=C1 Z815264186 [0,1,0,0,0,0|2,0,1]=4 218 B11R1.36 N[C@@H](C(=O)O)C1=CC=CC=C1 Z278101784 [0,1,0,0,0,0|1,0,1]=3 219 B11R1.36 N[C@H](C(=O)O)C1=CC=CC=C1 Z957336528 [0,1,0,0,0,0|1,0,1]=3 220 B11R1.36 O=C(O)C(=O)C1=CC=CC=C1 Z381360894 [0,1,0,0,0,0|1,0,0]=2 221 B11R1.36 O=C(O)C(Cl)C1=CC=CC=C1 Z104495824 [0,1,0,0,0,0|1,0,1]=3 222 B11R1.36 O=C(O)C(F)C1=CC=CC=C1 Z1203161992 [0,1,0,0,0,0|1,0,1]=3 223 B11R1.36 O=C(O)C(O)C1=CC=CC=C1 Z104473974 [0,1,0,0,0,0|1,0,1]=3 224 B11R1.36 O=C(O)C(S)C1=CC=CC=C1 Z808230894 [0,1,0,0,0,0|1,0,1]=3 225 B11R1.36 O=C(O)[C@@H](O)C1=CC=CC=C1 Z1201618616 [0,1,0,0,0,0|1,0,1]=3 226 B11R1.36 O=C(O)[C@H](O)C1=CC=CC=C1 Z1255390767 [0,1,0,0,0,0|1,0,1]=3 227 B11R1.36 O=C([O-])C(O)C1=NC=CC=C1 Z2357023524 [0,1,0,0,0,0|2,0,1]=4 228 B11R1.222 CC(C=O)C1=C(C=CC=C1)Br Z1269159201 [0,1,0,0,0,0|0,0,2]=3 229 B11R1.222 CC(C=O)C1=C(C=CC=C1)Cl Z1222424635 [0,1,0,0,0,0|0,0,2]=3 230 B11R1.222 CC(C=O)C1=C(C=CC=C1)F Z1222424647 [0,1,0,0,0,0|0,0,2]=3 231 B11R1.222 CC1=C(C=CC=C1)/C(=N/O)/N Z56881213 [0,1,0,0,0,0|2,0,1]=4 232 B11R1.222 CC1=C(C=CC=C1)C(=O)C=O Z2472857037 [0,1,0,0,0,0|1,0,0]=2 233 B11R1.222 CC1=C(C=CC=C1)C(=O)CN Z1741966378 [0,1,0,0,0,0|2,0,1]=4 234 B11R1.222 CC1=C(C=CC=C1)C(=O)NN Z56347320 [0,1,0,0,0,0|3,0,0]=4 235 B11R1.222 CC1=C(C=CC=C1)C(C)C=O Z1222424657 [0,1,0,0,0,0|0,0,2]=3 236 B11R1.222 CCC(=O)C1=C(C=CC=C1)Br Z851790216 [0,1,0,0,0,0|2,0,1]=4 237 B11R1.222 CCC(=O)C1=C(C=CC=C1)N Z1201617664 [0,1,0,0,0,0|2,0,1]=4 238 B11R1.222 CNC(=N)C1=C(C=CC=C1)Cl Z2065464295 [0,1,0,0,0,0|3,0,0]=4 239 B11R1.222 CNC(=O)C1=C(C=CC=C1)F Z32016402 [0,1,0,0,0,0|3,0,0]=4 240 B11R1.222 CNC(=O)C1=C(C=CC=C1)N Z57124070 [0,1,0,0,0,0|3,0,0]=4 241 B11R1.222 CNC(=O)C1=C(C=CC=C1)O Z57148963 [0,1,0,0,0,0|3,0,0]=4 242 B11R1.222 COC(=O)C1=C(C=CC=C1)Br Z19670137 [0,1,0,0,0,0|3,0,0]=4 243 B11R1.222 COC(=O)C1=C(C=CC=C1)C Z18382338 [0,1,0,0,0,0|3,0,0]=4 244 B11R1.222 COC(=O)C1=C(C=CC=C1)F Z19798265 [0,1,0,0,0,0|3,0,0]=4 245 B11R1.222 COC(=O)C1=C(C=CC=C1)I Z18327644 [0,1,0,0,0,0|3,0,0]=4 246 B11R1.222 COC(=O)C1=C(C=CC=C1)O Z19703590 [0,1,0,0,0,0|3,0,0]=4 247 B11R1.222 N/C(=N\O)/C1=C(C=CC=C1)Cl Z56867911 [0,1,0,0,0,0|2,0,1]=4 248 B11R1.222 N=C\1C=CC=C/C1=C(/N)\NO Z193450698 [0,1,0,0,0,0|2,0,1]=4 249 B11R1.222 NCC(=O)C1=C(C=CC=C1)Br Z1262691661 [0,1,0,0,0,0|2,0,1]=4 250 B11R1.222 NCC(=O)C1=C(C=CC=C1)Cl Z1695906936 [0,1,0,0,0,0|2,0,1]=4 251 B11R1.222 NCC(=O)C1=C(C=CC=C1)F Z1741977084 [0,1,0,0,0,0|2,0,1]=4 252 B11R1.222 NNC(=O)C1=C(C=CC=C1)Br Z56899129 [0,1,0,0,0,0|3,0,0]=4 253 B11R1.222 NNC(=O)C1=C(C=CC=C1)Cl Z57248585 [0,1,0,0,0,0|3,0,0]=4 254 B11R1.222 NNC(=O)C1=C(C=CC=C1)F Z56896291 [0,1,0,0,0,0|3,0,0]=4 255 B11R1.222 NNC(=O)C1=C(C=CC=C1)N Z104472510 [0,1,0,0,0,0|3,0,0]=4 256 B11R1.222 NNC(=O)C1=C(C=CC=C1)O Z57241860 [0,1,0,0,0,0|3,0,0]=4 257 B11R1.222 O=C(CBr)C1=C(C=CC=C1)F Z94602027 [0,1,0,0,0,0|2,0,1]=4 258 B11R1.222 O=C(CCl)C1=C(C=CC=C1)F Z854066970 [0,1,0,0,0,0|2,0,1]=4 259 B11R1.222 O=C(CO)C1=C(C=CC=C1)Cl Z906206760 [0,1,0,0,0,0|1,0,2]=4 260 B11R1.222 O=C(NO)C1=C(C=CC=C1)Br Z59181924 [0,1,0,0,0,0|2,0,1]=4 261 B11R1.222 O=C(NO)C1=C(C=CC=C1)O Z57842350 [0,1,0,0,0,0|2,0,1]=4 262 B11R1.222 O=CC(=O)C1=C(C=CC=C1)Br Z1516173728 [0,1,0,0,0,0|1,0,0]=2 263 B11R2.1 BrC1=C2C=CC=CN2N=C1 Z1198169703 [0,0,0,1,0,0|3,0,0]=4 264 B11R2.1 BrC1=CNC2=C1C=CC=N2 Z1665033561 [0,0,0,1,0,0|3,0,0]=4 265 B11R2.1 BrC1=CNC2=C1C=CN=C2 Z3302856393 [0,0,0,1,0,0|3,0,0]=4 266 B11R2.1 BrC1=NNC2=C1C=CC=C2 Z56791616 [0,0,0,1,0,0|3,0,0]=4 267 B11R2.1 CC1=C2C=CC=CC2=NN1 Z1258992514 [0,0,0,1,0,0|2,0,1]=4 268 B11R2.1 CC1=CNC2=C1C=CC=C2 Z415653134 [0,0,0,1,0,0|1,0,1]=3 269 B11R2.1 CC1=CNC2=C1N=CC=C2 Z1203733882 [0,0,0,1,0,0|2,0,1]=4 270 B11R2.1 CC1=COC2=C1C=CC=C2 Z1203161674 [0,0,0,1,0,0|0,0,2]=3 271 B11R2.1 CC1=NOC2=C1C=CC=C2 Z104341886 [0,0,0,1,0,0|1,0,2]=4 272 B11R2.1 CN1C=NC2=C1C=CC=C2 Z53833303 [0,0,0,1,0,0|2,0,1]=4 273 B11R2.1 C[N+]1=CSC2=C1C=CC=C2 Z56791134 [0,0,0,1,0,0|1,1,1]=4 274 B11R2.1 ClC1=C2C=CC=CC2=NN1 Z1695729006 [0,0,0,1,0,0|3,0,0]=4 275 B11R2.1 ClC1=C2C=CC=CC2=NS1 Z992921742 [0,0,0,1,0,0|3,0,0]=4 276 B11R2.1 ClC1=CNC2=C1C=CC=C2 Z1020823312 [0,0,0,1,0,0|2,0,0]=3 277 B11R2.1 ClC1=CNC2=C1C=CN=C2 Z1618035710 [0,0,0,1,0,0|3,0,0]=4 278 B11R2.1 ClC1=NSC2=C1C=CC=C2 Z57033963 [0,0,0,1,0,0|2,1,0]=4 279 B11R2.1 IC1=C2C=CC=CN2N=C1 Z1416202327 [0,0,0,1,0,0|3,0,0]=4 280 B11R2.1 IC1=CN=C2N1C=CC=C2 Z1262250911 [0,0,0,1,0,0|3,0,0]=4 281 B11R2.1 IC1=CNC2=C1C=CC=N2 Z1269158296 [0,0,0,1,0,0|3,0,0]=4 282 B11R2.1 IC1=CNC2=C1C=CN=C2 Z1269236830 [0,0,0,1,0,0|3,0,0]=4 283 B11R2.1 IC1=CNC2=C1C=NC=C2 Z1154254658 [0,0,0,1,0,0|3,0,0]=4 284 B11R2.1 IC1=CNC2=C1N=CC=C2 Z1269234225 [0,0,0,1,0,0|3,0,0]=4 285 B11R2.1 NC1=C2C=CC=CC2=NS1 Z1198161072 [0,0,0,1,0,0|3,0,0]=4 286 B11R2.1 NC1=CN=C2N1C=CC=C2 Z1203578955 [0,0,0,1,0,0|3,0,0]=4 287 B11R2.1 NC1=NNC2=C1C=CC=C2 Z56820416 [0,0,0,1,0,0|3,0,0]=4 288 B11R2.1 NC1=NOC2=C1C=CC=C2 Z218760918 [0,0,0,1,0,0|2,0,1]=4 289 B11R2.1 NC1=NSC2=C1C=CC=C2 Z56774438 [0,0,0,1,0,0|2,1,0]=4 290 B11R2.1 NN1C=NC2=C1C=CC=C2 Z99599676 [0,0,0,1,0,0|3,0,0]=4 291 B11R2.1 O=C1CCC2=C1C=CC=C2 Z104495974 [0,0,0,1,0,0|2,0,1]=4 292 B11R2.1 O=C1COC2=C1C=CC=C2 Z57101103 [0,0,0,1,0,0|1,0,2]=4 293 B11R2.1 O=C1CSC2=C1C=CC=C2 Z1117911699 [0,0,0,1,0,0|1,1,1]=4 294 B11R2.1 O=C1NCC2=C1C=CC=C2 Z362519344 [0,0,0,1,0,0|3,0,0]=4 295 B11R2.1 O=C1NNC2=C1C=CC=C2 Z586248764 [0,0,0,1,0,0|3,0,0]=4 296 B11R2.1 O=C1NOC2=C1C=CC=C2 Z1592042113 [0,0,0,1,0,0|2,0,1]=4 297 B11R2.1 O=C1NSC2=C1C=CC=C2 Z56983154 [0,0,0,1,0,0|2,1,0]=4 298 B11R2.1 O=C1OCC2=C1C=CC=C2 Z211309000 [0,0,0,1,0,0|3,0,0]=4 299 B11R2.1 O=C1SNC2=C1C=CC=C2 Z992282928 [0,0,0,1,0,0|3,0,0]=4 300 B9R1.11 O=CC(=O)C1=CSC=C1 Z1511750329 [0,0,0,0,1,0|2,0,0]=3 301 B11R1.40 C#CC(=O)CC1=CC=CC=C1 Z1266856334 [0,0,0,0,0,1|2,0,1]=4 302 B11R1.40 C/C(=C\C1=CC=CC=C1)/C=O Z3219847417 [0,0,0,0,0,1|0,0,1]=2 303 B11R1.40 C=CC(=O)NC1=CC=CC=C1 Z440633536 [0,0,0,0,0,1|2,0,0]=3 304 B11R1.40 C=CC(=O)NC1=CN=CC=C1 Z440633590 [0,0,0,0,0,1|3,0,0]=4 305 B11R1.40 C=CC(=O)NC1=NC=CC=C1 Z440633578 [0,0,0,0,0,1|3,0,0]=4 306 B11R1.40 CC(C=O)CC1=CC=CC=C1 Z1198150055 [0,0,0,0,0,1|0,0,2]=3 307 B11R1.40 CN(CC1=CC=CC=C1)N=O Z1198147495 [0,0,0,0,0,1|2,0,1]=4 308 B11R1.40 CNC(=O)NC1=CC=CC=C1 Z55293754 [0,0,0,0,0,1|3,0,0]=4 309 B11R1.40 CNC(=S)NC1=CC=CC=C1 Z45796176 [0,0,0,0,0,1|3,0,0]=4 310 B11R1.40 CS/C(=N/C1=CC=CC=C1)/N Z107728768 [0,0,0,0,0,1|3,0,0]=4 311 B11R1.40 N=C(NN)NC1=CC=CC=C1 Z2768171754 [0,0,0,0,0,1|3,0,0]=4 312 B11R1.40 NCC(=O)CC1=CC=CC=C1 Z1569708978 [0,0,0,0,0,1|2,0,1]=4 313 B11R1.40 NCC(=O)NC1=CC=CC=C1 Z594413794 [0,0,0,0,0,1|2,0,1]=4 314 B11R1.40 NNC(=O)CC1=CC=CC=C1 Z56867310 [0,0,0,0,0,1|3,0,0]=4 315 B11R1.40 NNC(=O)NC1=CC=CC=C1 Z56855648 [0,0,0,0,0,1|3,0,0]=4 316 B11R1.40 NNC(=S)NC1=CC=CC=C1 Z56836896 [0,0,0,0,0,1|3,0,0]=4 317 B11R1.40 O=C(CCl)CC1=CC=CC=C1 Z164706024 [0,0,0,0,0,1|2,0,1]=4 318 B11R1.40 O=C(CCl)NC1=CC=CC=C1 Z56889119 [0,0,0,0,0,1|2,0,1]=4 319 B11R1.40 O=C(CO)NC1=CC=CC=C1 Z228585444 [0,0,0,0,0,1|1,0,2]=4 320 B11R1.40 O=C/C(=C/C1=CC=CC=C1)/Br Z2312942099 [0,0,0,0,0,1|1,0,0]=2 321 B11R1.40 O=C/C(=C/C1=CC=CC=C1)/Cl Z104475950 [0,0,0,0,0,1|1,0,0]=2 322 B8R1.2 C=CC1=CC=CC=C1 Z104474664 [2,0,0,0,0,0|0,0,0]=2 323 B8R1.2 C=CC1=NC=CC=C1 Z104495554 [2,0,0,0,0,0|1,0,0]=3 324 B8R1.2 CCC1=CC=CC=C1 Z104473632 [2,0,0,0,0,0|0,0,2]=4 325 B8R1.2 CNC1=CC=CC=C1 Z104472478 [2,0,0,0,0,0|1,0,1]=4 326 B8R1.2 COC1=CC=CC=C1 Z53833865 [2,0,0,0,0,0|1,0,1]=4 327 B8R1.2 Cl[Se]C1=CC=CC=C1 Z1255485131 [2,0,0,0,0,0|2,0,0]=4 328 B8R1.2 N#CC1=CC=CC=C1 Z104473628 [2,0,0,0,0,0|1,0,1]=4 329 B8R1.2 NCC1=CC=CC=C1 Z54748260 [2,0,0,0,0,0|1,0,1]=4 330 B8R1.2 NNC1=CC=CC=C1 Z104472442 [2,0,0,0,0,0|2,0,0]=4 331 B8R1.2 O=CC1=CC=NC=C1 Z57161993 [2,0,0,0,0,0|1,0,0]=3 332 B8R1.2 O=CC1=CN=CC=C1 Z104472124 [2,0,0,0,0,0|1,0,0]=3 333 B8R1.2 O=CC1=CN=CN=C1 Z1013450426 [2,0,0,0,0,0|2,0,0]=4 334 B8R1.2 O=CC1=CN=NC=C1 Z1255435509 [2,0,0,0,0,0|2,0,0]=4 335 B8R1.2 O=CC1=NC=CC=C1 Z104472152 [2,0,0,0,0,0|1,0,0]=3 336 B8R1.2 O=CC1=NC=CN=C1 Z1013412214 [2,0,0,0,0,0|2,0,0]=4 337 B8R1.2 O=CC1=NN=CC=C1 Z1198165301 [2,0,0,0,0,0|2,0,0]=4 338 B8R1.2 OCC1=CC=CC=C1 Z104476418 [2,0,0,0,0,0|0,0,2]=4 339 B10R1.13 C=C(C)C1=CN=C(C=C1)Br Z1999517490 [1,1,0,0,0,0|1,0,1]=4 340 B10R1.13 CC(=O)C1=CC=C(C=C1)Br Z57127459 [1,1,0,0,0,0|0,0,1]=3 341 B10R1.13 CC(=O)C1=CC=C(C=C1)C Z57127458 [1,1,0,0,0,0|0,0,1]=3 342 B10R1.13 CC(=O)C1=CC=C(C=C1)Cl Z57127462 [1,1,0,0,0,0|0,0,1]=3 343 B10R1.13 CC(=O)C1=CC=C(C=C1)F Z57127466 [1,1,0,0,0,0|0,0,1]=3 344 B10R1.13 CC(=O)C1=CC=C(C=C1)I Z57073725 [1,1,0,0,0,0|0,0,1]=3 345 B10R1.13 CC(=O)C1=CC=C(C=C1)N Z57127377 [1,1,0,0,0,0|0,0,1]=3 346 B10R1.13 CC(=O)C1=CC=C(C=C1)O Z57040434 [1,1,0,0,0,0|0,0,1]=3 347 B10R1.13 CC(=O)C1=CN=C(C=C1)Br Z1269224642 [1,1,0,0,0,0|1,0,1]=4 348 B10R1.13 CC(=O)C1=CN=C(C=C1)Cl Z1201622182 [1,1,0,0,0,0|1,0,1]=4 349 B10R1.13 CC(=O)C1=CN=C(C=C1)F Z1198173101 [1,1,0,0,0,0|1,0,1]=4 350 B10R1.13 CC(=O)C1=NC=C(C=C1)Br Z1945984212 [1,1,0,0,0,0|1,0,1]=4 351 B10R1.13 CC(=O)C1=NC=C(C=C1)Cl Z1198173098 [1,1,0,0,0,0|1,0,1]=4 352 B10R1.13 CC(=O)C1=NC=C(C=C1)F Z1575143877 [1,1,0,0,0,0|1,0,1]=4 353 B10R1.13 CC1=CC=C(C=C1)C(=N)N Z1405445841 [1,1,0,0,0,0|2,0,0]=4 354 B10R1.13 CC1=CC=C(C=C1)C(=O)O Z57902424 [1,1,0,0,0,0|1,0,0]=3 355 B10R1.13 CC1=CC=C(C=C1)C(=S)N Z56939152 [1,1,0,0,0,0|1,1,0]=4 356 B10R1.13 CC1=CC=C(C=C1)[N+](=O)[O-] Z104476692 [1,1,0,0,0,0|2,0,0]=4 357 B10R1.13 CC1=CC=C(C=C1)[S-](=O)=O Z104501328 [1,1,0,0,0,0|2,0,0]=4 358 B10R1.13 CC1=CN=C(C=C1)C(=O)O Z1511494596 [1,1,0,0,0,0|2,0,0]=4 359 B10R1.13 CC1=NC=C(C=C1)C(=O)N Z57493539 [1,1,0,0,0,0|2,0,0]=4 360 B10R1.13 CC1=NC=C(C=C1)C(=O)O Z235485476 [1,1,0,0,0,0|2,0,0]=4 361 B10R1.13 CS(=O)C1=CC=C(C=C1)N Z609944508 [1,1,0,0,0,0|1,0,1]=4 362 B10R1.13 N=C(N)C1=CC=C(C=C1)Br Z1263602346 [1,1,0,0,0,0|2,0,0]=4 363 B10R1.13 N=C(N)C1=CC=C(C=C1)Cl Z56771179 [1,1,0,0,0,0|2,0,0]=4 364 B10R1.13 N=C(N)C1=CC=C(C=C1)F Z2289798423 [1,1,0,0,0,0|2,0,0]=4 365 B10R1.13 N=C(N)C1=CC=C(C=C1)I Z2574914411 [1,1,0,0,0,0|2,0,0]=4 366 B10R1.13 N=C(N)C1=CC=C(C=C1)O Z1262398570 [1,1,0,0,0,0|2,0,0]=4 367 B10R1.13 NC(=O)C1=CC=C(C=C1)Br Z33546526 [1,1,0,0,0,0|1,0,0]=3 368 B10R1.13 NC(=O)C1=CC=C(C=C1)F Z33546459 [1,1,0,0,0,0|1,0,0]=3 369 B10R1.13 NC(=O)C1=CC=C(C=C1)I Z33546486 [1,1,0,0,0,0|1,0,0]=3 370 B10R1.13 NC(=O)C1=CC=C(C=C1)N Z104474782 [1,1,0,0,0,0|1,0,0]=3 371 B10R1.13 NC(=O)C1=CC=C(C=C1)O Z104502228 [1,1,0,0,0,0|1,0,0]=3 372 B10R1.13 NC(=O)C1=CN=C(C=C1)Cl Z33546654 [1,1,0,0,0,0|2,0,0]=4 373 B10R1.13 NC(=O)C1=CN=C(C=C1)F Z1183725924 [1,1,0,0,0,0|2,0,0]=4 374 B10R1.13 NC(=O)C1=CN=C(C=C1)N Z959893184 [1,1,0,0,0,0|2,0,0]=4 375 B10R1.13 NC(=O)C1=CNC(=O)C=C1 Z220564282 [1,1,0,0,0,0|2,0,0]=4 376 B10R1.13 NC(=O)C1=NC=C(C=C1)Br Z1065600734 [1,1,0,0,0,0|2,0,0]=4 377 B10R1.13 NC(=O)C1=NC=C(C=C1)I Z1269145218 [1,1,0,0,0,0|2,0,0]=4 378 B10R1.13 NC(=O)C1=NC=C(C=C1)N Z1116403989 [1,1,0,0,0,0|2,0,0]=4 379 B10R1.13 NC(=S)C1=CC=C(C=C1)Br Z56964597 [1,1,0,0,0,0|1,1,0]=4 380 B10R1.13 NC(=S)C1=CC=C(C=C1)Cl Z57070431 [1,1,0,0,0,0|1,1,0]=4 381 B10R1.13 NC(=S)C1=CC=C(C=C1)N Z234895465 [1,1,0,0,0,0|1,1,0]=4 382 B10R1.13 NC(=S)C1=CC=C(C=C1)O Z90124534 [1,1,0,0,0,0|1,1,0]=4 383 B10R1.13 NC1=CC=C(C=C1)C(=O)O Z57127446 [1,1,0,0,0,0|1,0,0]=3 384 B10R1.13 NC1=CC=C(C=C1)[N+](=O)[O-] Z275127984 [1,1,0,0,0,0|2,0,0]=4 385 B10R1.13 NC1=CN=C(C=C1)C(=O)O Z1649677869 [1,1,0,0,0,0|2,0,0]=4 386 B10R1.13 NC1=NC=C(C=C1)C(=O)O Z90122558 [1,1,0,0,0,0|2,0,0]=4 387 B10R1.13 O=C(Cl)C1=CN=C(C=C1)Cl Z1255461313 [1,1,0,0,0,0|2,0,0]=4 388 B10R1.13 O=C(F)C1=CN=C(C=C1)F Z2471610470 [1,1,0,0,0,0|2,0,0]=4 389 B10R1.13 O=C(O)C1=CC=C(C=C1)Br Z57127530 [1,1,0,0,0,0|1,0,0]=3 390 B10R1.13 O=C(O)C1=CC=C(C=C1)Cl Z104473324 [1,1,0,0,0,0|1,0,0]=3 391 B10R1.13 O=C(O)C1=CC=C(C=C1)F Z57367354 [1,1,0,0,0,0|1,0,0]=3 392 B10R1.13 O=C(O)C1=CC=C(C=C1)I Z57636572 [1,1,0,0,0,0|1,0,0]=3 393 B10R1.13 O=C(O)C1=CC=C(C=C1)O Z104498098 [1,1,0,0,0,0|1,0,0]=3 394 B10R1.13 O=C(O)C1=CC=C(C=C1)S Z223639246 [1,1,0,0,0,0|1,0,0]=3 395 B10R1.13 O=C(O)C1=CN=C(C=C1)Br Z1258919772 [1,1,0,0,0,0|2,0,0]=4 396 B10R1.13 O=C(O)C1=CN=C(C=C1)Cl Z104476110 [1,1,0,0,0,0|2,0,0]=4 397 B10R1.13 O=C(O)C1=CN=C(C=C1)F Z1182395505 [1,1,0,0,0,0|2,0,0]=4 398 B10R1.13 O=C(O)C1=CN=C(C=C1)O Z104500708 [1,1,0,0,0,0|2,0,0]=4 399 B10R1.13 O=C(O)C1=NC=C(C=C1)Br Z972791012 [1,1,0,0,0,0|2,0,0]=4 400 B10R1.13 O=C(O)C1=NC=C(C=C1)Cl Z1201622823 [1,1,0,0,0,0|2,0,0]=4 401 B10R1.13 O=C(O)C1=NC=C(C=C1)I Z1069125846 [1,1,0,0,0,0|2,0,0]=4 402 B10R1.13 O=C1C=CC(=CO1)C(=O)O Z104472302 [1,1,0,0,0,0|2,0,0]=4 403 B10R1.13 O=P(O)C1=CC=C(C=C1)Cl Z56798029 [1,1,0,0,0,0|2,0,0]=4 404 B10R1.13 O=[N+]([O-])C1=CC=C(C=C1)Br Z104474532 [1,1,0,0,0,0|2,0,0]=4 405 B10R1.13 O=[N+]([O-])C1=CC=C(C=C1)Cl Z104474568 [1,1,0,0,0,0|2,0,0]=4 406 B10R1.13 O=[N+]([O-])C1=CC=C(C=C1)I Z56924538 [1,1,0,0,0,0|2,0,0]=4 407 B10R1.13 O=[N+]([O-])C1=CC=C(C=C1)O Z57127483 [1,1,0,0,0,0|2,0,0]=4 408 B10R1.28 NS(=O)(=O)C1=CC=CC=C1 Z45415554 [1,1,0,0,0,0|2,0,0]=4 409 B10R1.28 O=S(=O)(F)C1=CC=CC=C1 Z1255364683 [1,1,0,0,0,0|2,0,0]=4 410 B10R1.61 C=C(C)C1=C(C=CC=C1)Br Z1238836250 [1,1,0,0,0,0|0,0,1]=3 411 B10R1.61 CC(=O)C1=C(C=CC=C1)Br Z219997444 [1,1,0,0,0,0|0,0,1]=3 412 B10R1.61 CC(=O)C1=C(C=CC=C1)Cl Z104473116 [1,1,0,0,0,0|0,0,1]=3 413 B10R1.61 CC(=O)C1=C(C=CC=C1)F Z104475574 [1,1,0,0,0,0|0,0,1]=3 414 B10R1.61 CC(=O)C1=C(C=CC=C1)I Z1080378952 [1,1,0,0,0,0|0,0,1]=3 415 B10R1.61 CC(=O)C1=C(C=CC=C1)O Z57101014 [1,1,0,0,0,0|0,0,1]=3 416 B10R1.61 CC(=O)C1=C(C=CC=N1)O Z1198175942 [1,1,0,0,0,0|1,0,1]=4 417 B10R1.61 CC(=O)C1=C(C=CN=C1)C Z1198178359 [1,1,0,0,0,0|1,0,1]=4 418 B10R1.61 CC(=O)C1=C(C=CN=C1)N Z1192043585 [1,1,0,0,0,0|1,0,1]=4 419 B10R1.61 CC(=O)C1=C(C=NC=C1)O Z1255445560 [1,1,0,0,0,0|1,0,1]=4 420 B10R1.61 CC(=O)C1=C(N=CC=C1)Br Z1269140470 [1,1,0,0,0,0|1,0,1]=4 421 B10R1.61 CC(=O)C1=C(N=CC=C1)Cl Z1154360549 [1,1,0,0,0,0|1,0,1]=4 422 B10R1.61 CC1=C(C=CC=C1)C(=N)N Z1483957011 [1,1,0,0,0,0|2,0,0]=4 423 B10R1.61 CC1=C(C=CC=C1)C(=O)O Z104495626 [1,1,0,0,0,0|1,0,0]=3 424 B10R1.61 CC1=C(C=CC=C1)C(=S)N Z57046956 [1,1,0,0,0,0|1,1,0]=4 425 B10R1.61 CC1=C(C=CC=C1)[N+](=O)[O-] Z104473652 [1,1,0,0,0,0|2,0,0]=4 426 B10R1.61 CC1=C(C=CC=N1)C(=O)O Z1276602308 [1,1,0,0,0,0|2,0,0]=4 427 B10R1.61 CC1=C(C=CN=C1)C(=O)N Z1198162078 [1,1,0,0,0,0|2,0,0]=4 428 B10R1.61 CC1=C(C=CN=C1)C(=O)O Z1708090074 [1,1,0,0,0,0|2,0,0]=4 429 B10R1.61 CC1=C(C=NC=C1)C(=O)O Z199468010 [1,1,0,0,0,0|2,0,0]=4 430 B10R1.61 CC1=C(N=CC=C1)C(=O)O Z976634736 [1,1,0,0,0,0|2,0,0]=4 431 B10R1.61 CS(=O)C1=C(C=CC=C1)N Z609980396 [1,1,0,0,0,0|1,0,1]=4 432 B10R1.61 N=C(N)C1=C(C=CC=C1)Br Z1266823189 [1,1,0,0,0,0|2,0,0]=4 433 B10R1.61 N=C(N)C1=C(C=CC=C1)Cl Z1695669929 [1,1,0,0,0,0|2,0,0]=4 434 B10R1.61 N=C(N)C1=C(C=CC=C1)F Z2442104317 [1,1,0,0,0,0|2,0,0]=4 435 B10R1.61 N=C(N)C1=C(C=CC=C1)N Z199055442 [1,1,0,0,0,0|2,0,0]=4 436 B10R1.61 N=C(N)C1=C(C=CC=C1)O Z1431002716 [1,1,0,0,0,0|2,0,0]=4 437 B10R1.61 NC(=O)C1=C(C=CC=C1)Cl Z33546379 [1,1,0,0,0,0|1,0,0]=3 438 B10R1.61 NC(=O)C1=C(C=CC=C1)F Z33546498 [1,1,0,0,0,0|1,0,0]=3 439 B10R1.61 NC(=O)C1=C(C=CC=C1)I Z33546623 [1,1,0,0,0,0|1,0,0]=3 440 B10R1.61 NC(=O)C1=C(C=CC=C1)N Z57036632 [1,1,0,0,0,0|1,0,0]=3 441 B10R1.61 NC(=O)C1=C(C=CC=C1)O Z68590124 [1,1,0,0,0,0|1,0,0]=3 442 B10R1.61 NC(=O)C1=C(C=CC=N1)N Z1083218598 [1,1,0,0,0,0|2,0,0]=4 443 B10R1.61 NC(=O)C1=C(C=CN=C1)Cl Z1198275382 [1,1,0,0,0,0|2,0,0]=4 444 B10R1.61 NC(=O)C1=C(C=CN=C1)O Z1198177193 [1,1,0,0,0,0|2,0,0]=4 445 B10R1.61 NC(=O)C1=C(C=NC=C1)Br Z1269114039 [1,1,0,0,0,0|2,0,0]=4 446 B10R1.61 NC(=O)C1=C(C=NC=C1)Cl Z1198237797 [1,1,0,0,0,0|2,0,0]=4 447 B10R1.61 NC(=O)C1=C(N=CC=C1)Cl Z33546502 [1,1,0,0,0,0|2,0,0]=4 448 B10R1.61 NC(=S)C1=C(C=CC=C1)N Z99601360 [1,1,0,0,0,0|1,1,0]=4 449 B10R1.61 NC1=C(C=CC=C1)[N+](=O)[O-] Z56924541 [1,1,0,0,0,0|2,0,0]=4 450 B10R1.61 NC1=C(C=CC=N1)C(=O)O Z104475724 [1,1,0,0,0,0|2,0,0]=4 451 B10R1.61 NC1=C(C=CN=C1)C(=O)O Z414314668 [1,1,0,0,0,0|2,0,0]=4 452 B10R1.61 NC1=C(C=NC=C1)C(=O)O Z1167043563 [1,1,0,0,0,0|2,0,0]=4 453 B10R1.61 NC1=C(N=CC=C1)C(=O)O Z1201619040 [1,1,0,0,0,0|2,0,0]=4 454 B10R1.61 O=C(O)C1=C(C=CC=C1)Br Z57825381 [1,1,0,0,0,0|1,0,0]=3 455 B10R1.61 O=C(O)C1=C(C=CC=C1)Cl Z57127537 [1,1,0,0,0,0|1,0,0]=3 456 B10R1.61 O=C(O)C1=C(C=CC=C1)F Z57914061 [1,1,0,0,0,0|1,0,0]=3 457 B10R1.61 O=C(O)C1=C(C=CC=C1)I Z57637028 [1,1,0,0,0,0|1,0,0]=3 458 B10R1.61 O=C(O)C1=C(C=CC=C1)O Z56757226 [1,1,0,0,0,0|1,0,0]=3 459 B10R1.61 O=C(O)C1=C(C=CC=C1)S Z104477754 [1,1,0,0,0,0|1,0,0]=3 460 B10R1.61 O=C(O)C1=C(C=CC=N1)Cl Z1203161828 [1,1,0,0,0,0|2,0,0]=4 461 B10R1.61 O=C(O)C1=C(C=CC=N1)O Z608353738 [1,1,0,0,0,0|2,0,0]=4 462 B10R1.61 O=C(O)C1=C(C=NC=C1)Br Z1238800040 [1,1,0,0,0,0|2,0,0]=4 463 B10R1.61 O=C(O)C1=C(C=NC=C1)Cl Z1255387391 [1,1,0,0,0,0|2,0,0]=4 464 B10R1.61 O=C(O)C1=C(C=NC=C1)F Z1270326283 [1,1,0,0,0,0|2,0,0]=4 465 B10R1.61 O=C(O)C1=C(C=NC=C1)I Z1269217659 [1,1,0,0,0,0|2,0,0]=4 466 B10R1.61 O=C(O)C1=C(N=CC=C1)Br Z926900218 [1,1,0,0,0,0|2,0,0]=4 467 B10R1.61 O=C(O)C1=C(N=CC=C1)Cl Z104474538 [1,1,0,0,0,0|2,0,0]=4 468 B10R1.61 O=C(O)C1=C(N=CC=C1)F Z1203161997 [1,1,0,0,0,0|2,0,0]=4 469 B10R1.61 O=C(O)C1=C(N=CC=C1)I Z1269167145 [1,1,0,0,0,0|2,0,0]=4 470 B10R1.61 O=C(O)C1=C(N=CC=C1)S Z203045100 [1,1,0,0,0,0|2,0,0]=4 471 B10R1.61 O=C(O)C1=CC=CNC1=O Z57012260 [1,1,0,0,0,0|2,0,0]=4 472 B10R1.61 O=C(O)C1=CNC=CC1=O Z1869802012 [1,1,0,0,0,0|2,0,0]=4 473 B10R1.61 O=C(O)C1=[N+](C=CC=C1)[O-] Z147642478 [1,1,0,0,0,0|2,0,0]=4 474 B10R1.61 O=[N+]([O-])C1=C(C=CC=C1)Cl Z104473258 [1,1,0,0,0,0|2,0,0]=4 475 B10R1.61 O=[N+]([O-])C1=C(C=CC=C1)I Z56926515 [1,1,0,0,0,0|2,0,0]=4 476 B10R1.113 C=C(C)C1=CC(=CC=C1)N Z1203585283 [1,1,0,0,0,0|0,0,1]=3 477 B10R1.113 CC(=O)C1=CC(=CC=C1)Br Z104472956 [1,1,0,0,0,0|0,0,1]=3 478 B10R1.113 CC(=O)C1=CC(=CC=C1)C Z104482920 [1,1,0,0,0,0|0,0,1]=3 479 B10R1.113 CC(=O)C1=CC(=CC=C1)Cl Z104477350 [1,1,0,0,0,0|0,0,1]=3 480 B10R1.113 CC(=O)C1=CC(=CC=C1)N Z57127443 [1,1,0,0,0,0|0,0,1]=3 481 B10R1.113 CC(=O)C1=CC(=CN=C1)C Z1198331406 [1,1,0,0,0,0|1,0,1]=4 482 B10R1.113 CC(=O)C1=CC(=CN=C1)Cl Z1255491584 [1,1,0,0,0,0|1,0,1]=4 483 B10R1.113 CC(=O)C1=CC(=NC=C1)Br Z3234972143 [1,1,0,0,0,0|1,0,1]=4 484 B10R1.113 CC(=O)C1=CC(=NC=C1)Cl Z1201624144 [1,1,0,0,0,0|1,0,1]=4 485 B10R1.113 CC(=O)C1=CC(=NC=C1)F Z1198219263 [1,1,0,0,0,0|1,0,1]=4 486 B10R1.113 CC(=O)C1=CC(=O)NC=C1 Z1216849381 [1,1,0,0,0,0|1,0,1]=4 487 B10R1.113 CC(=O)C1=NC(=CC=C1)Br Z1269164937 [1,1,0,0,0,0|1,0,1]=4 488 B10R1.113 CC(=O)C1=NC(=CC=C1)Cl Z1198173097 [1,1,0,0,0,0|1,0,1]=4 489 B10R1.113 CC(=O)C1=NC(=CC=C1)F Z1198219245 [1,1,0,0,0,0|1,0,1]=4 490 B10R1.113 CC(=O)C1=NC=CC(=C1)Br Z1269133346 [1,1,0,0,0,0|1,0,1]=4 491 B10R1.113 CC1=CC(=CC=C1)C(=N)N Z2471262589 [1,1,0,0,0,0|2,0,0]=4 492 B10R1.113 CC1=CC(=CC=C1)C(=O)N Z33546925 [1,1,0,0,0,0|1,0,0]=3 493 B10R1.113 CC1=CC(=CC=C1)C(=O)O Z57913535 [1,1,0,0,0,0|1,0,0]=3 494 B10R1.113 CC1=CC(=CC=C1)C(=S)N Z90122768 [1,1,0,0,0,0|1,1,0]=4 495 B10R1.113 CC1=CC(=CC=C1)[N+](=O)[O-] Z104508722 [1,1,0,0,0,0|2,0,0]=4 496 B10R1.113 CC1=CC(=CN=C1)C(=O)N Z1203579033 [1,1,0,0,0,0|2,0,0]=4 497 B10R1.113 CC1=CC(=CN=C1)C(=O)O Z825019000 [1,1,0,0,0,0|2,0,0]=4 498 B10R1.113 CC1=NC(=CC=C1)C(=O)N Z287485516 [1,1,0,0,0,0|2,0,0]=4 499 B10R1.113 CC1=NC(=CC=C1)C(=O)O Z278017928 [1,1,0,0,0,0|2,0,0]=4 500 B10R1.113 CC1=NC=CC(=C1)C(=O)N Z1203579723 [1,1,0,0,0,0|2,0,0]=4 501 B10R1.113 CC1=NC=CC(=C1)C(=O)O Z1205493663 [1,1,0,0,0,0|2,0,0]=4 502 B10R1.113 CS(=O)C1=CC(=CC=C1)N Z609980392 [1,1,0,0,0,0|1,0,1]=4 503 B10R1.113 N=C(N)C1=CC(=CC=C1)Br Z1741973354 [1,1,0,0,0,0|2,0,0]=4 504 B10R1.113 N=C(N)C1=CC(=CC=C1)Cl Z1362754541 [1,1,0,0,0,0|2,0,0]=4 505 B10R1.113 N=C(N)C1=CC(=CC=C1)F Z1263714076 [1,1,0,0,0,0|2,0,0]=4 506 B10R1.113 N=C(N)C1=CC(=CC=C1)O Z1592024758 [1,1,0,0,0,0|2,0,0]=4 507 B10R1.113 NC(=O)C1=CC(=CC=C1)Br Z33546517 [1,1,0,0,0,0|1,0,0]=3 508 B10R1.113 NC(=O)C1=CC(=CC=C1)Cl Z33546479 [1,1,0,0,0,0|1,0,0]=3 509 B10R1.113 NC(=O)C1=CC(=CC=C1)I Z33546647 [1,1,0,0,0,0|1,0,0]=3 510 B10R1.113 NC(=O)C1=CC(=CC=C1)N Z118530082 [1,1,0,0,0,0|1,0,0]=3 511 B10R1.113 NC(=O)C1=CC(=CC=C1)O Z33546460 [1,1,0,0,0,0|1,0,0]=3 512 B10R1.113 NC(=O)C1=CC(=CC=C1)S Z1255359534 [1,1,0,0,0,0|1,0,0]=3 513 B10R1.113 NC(=O)C1=CC(=CN=C1)Br Z33546660 [1,1,0,0,0,0|2,0,0]=4 514 B10R1.113 NC(=O)C1=CC(=CN=C1)N Z1198184520 [1,1,0,0,0,0|2,0,0]=4 515 B10R1.113 NC(=O)C1=CC(=CN=C1)O Z1160905298 [1,1,0,0,0,0|2,0,0]=4 516 B10R1.113 NC(=O)C1=CC(=NC=C1)Br Z1269224952 [1,1,0,0,0,0|2,0,0]=4 517 B10R1.113 NC(=O)C1=CC(=NC=C1)Cl Z147129672 [1,1,0,0,0,0|2,0,0]=4 518 B10R1.113 NC(=O)C1=CC(=NC=C1)F Z802658956 [1,1,0,0,0,0|2,0,0]=4 519 B10R1.113 NC(=O)C1=CC(=NC=C1)N Z733874990 [1,1,0,0,0,0|2,0,0]=4 520 B10R1.113 NC(=O)C1=NC(=CC=C1)Br Z1116315117 [1,1,0,0,0,0|2,0,0]=4 521 B10R1.113 NC(=O)C1=NC(=CC=C1)Cl Z969100498 [1,1,0,0,0,0|2,0,0]=4 522 B10R1.113 NC(=O)C1=NC(=CC=C1)N Z969101552 [1,1,0,0,0,0|2,0,0]=4 523 B10R1.113 NC(=O)C1=NC=CC(=C1)N Z425851730 [1,1,0,0,0,0|2,0,0]=4 524 B10R1.113 NC(=S)C1=CC(=CC=C1)Br Z56985752 [1,1,0,0,0,0|1,1,0]=4 525 B10R1.113 NC(=S)C1=CC(=CC=C1)Cl Z56979368 [1,1,0,0,0,0|1,1,0]=4 526 B10R1.113 NC(=S)C1=CC(=CC=C1)F Z56979300 [1,1,0,0,0,0|1,1,0]=4 527 B10R1.113 NC1=CC(=CC=C1)C(=O)O Z57127542 [1,1,0,0,0,0|1,0,0]=3 528 B10R1.113 NC1=CC(=CC=C1)[N+](=O)[O-] Z56924547 [1,1,0,0,0,0|2,0,0]=4 529 B10R1.113 NC1=CC(=CN=C1)C(=O)O Z1095353978 [1,1,0,0,0,0|2,0,0]=4 530 B10R1.113 NC1=CC(=NC=C1)C(=O)O Z381413014 [1,1,0,0,0,0|2,0,0]=4 531 B10R1.113 NC1=NC(=CC=C1)C(=O)O Z220336222 [1,1,0,0,0,0|2,0,0]=4 532 B10R1.113 O=C(Cl)C1=CC(=NC=C1)Cl Z1255450413 [1,1,0,0,0,0|2,0,0]=4 533 B10R1.113 O=C(Cl)C1=CC(=NC=C1)F Z1198320906 [1,1,0,0,0,0|2,0,0]=4 534 B10R1.113 O=C(O)C1=CC(=CC=C1)Br Z104475790 [1,1,0,0,0,0|1,0,0]=3 535 B10R1.113 O=C(O)C1=CC(=CC=C1)Cl Z104474062 [1,1,0,0,0,0|1,0,0]=3 536 B10R1.113 O=C(O)C1=CC(=CC=C1)F Z104477304 [1,1,0,0,0,0|1,0,0]=3 537 B10R1.113 O=C(O)C1=CC(=CC=C1)I Z56924537 [1,1,0,0,0,0|1,0,0]=3 538 B10R1.113 O=C(O)C1=CC(=CC=C1)O Z56919254 [1,1,0,0,0,0|1,0,0]=3 539 B10R1.113 O=C(O)C1=CC(=CC=C1)S Z1201630948 [1,1,0,0,0,0|1,0,0]=3 540 B10R1.113 O=C(O)C1=CC(=CN=C1)Br Z104476582 [1,1,0,0,0,0|2,0,0]=4 541 B10R1.113 O=C(O)C1=CC(=CN=C1)Cl Z972756276 [1,1,0,0,0,0|2,0,0]=4 542 B10R1.113 O=C(O)C1=CC(=CN=C1)F Z1192357288 [1,1,0,0,0,0|2,0,0]=4 543 B10R1.113 O=C(O)C1=CC(=CN=C1)O Z57124104 [1,1,0,0,0,0|2,0,0]=4 544 B10R1.113 O=C(O)C1=CC(=CN=C1)S Z2238935068 [1,1,0,0,0,0|2,0,0]=4 545 B10R1.113 O=C(O)C1=CC(=NC=C1)Br Z1259086653 [1,1,0,0,0,0|2,0,0]=4 546 B10R1.113 O=C(O)C1=CC(=NC=C1)Cl Z135302154 [1,1,0,0,0,0|2,0,0]=4 547 B10R1.113 O=C(O)C1=CC(=NC=C1)F Z234896331 [1,1,0,0,0,0|2,0,0]=4 548 B10R1.113 O=C(O)C1=CC(=NC=C1)S Z800150220 [1,1,0,0,0,0|2,0,0]=4 549 B10R1.113 O=C(O)C1=C[N+](=CC=C1)[O-] Z104477974 [1,1,0,0,0,0|2,0,0]=4 550 B10R1.113 O=C(O)C1=NC(=CC=C1)Br Z415628156 [1,1,0,0,0,0|2,0,0]=4 551 B10R1.113 O=C(O)C1=NC(=CC=C1)Cl Z56771183 [1,1,0,0,0,0|2,0,0]=4 552 B10R1.113 O=C(O)C1=NC(=CC=C1)F Z1203162000 [1,1,0,0,0,0|2,0,0]=4 553 B10R1.113 O=C(O)C1=NC=CC(=C1)Br Z802558860 [1,1,0,0,0,0|2,0,0]=4 554 B10R1.113 O=C(O)C1=NC=CC(=C1)Cl Z57990012 [1,1,0,0,0,0|2,0,0]=4 555 B10R1.113 O=C(O)C1=NC=CC(=C1)O Z385458378 [1,1,0,0,0,0|2,0,0]=4 556 B10R1.113 O=C1C=C(C=CN1)C(=O)O Z1416200909 [1,1,0,0,0,0|2,0,0]=4 557 B10R1.113 O=C1C=CC=C(N1)C(=O)O Z359371306 [1,1,0,0,0,0|2,0,0]=4 558 B10R1.113 O=C1C=CC=C(O1)C(=O)O Z1198151696 [1,1,0,0,0,0|2,0,0]=4 559 B10R1.113 O=[N+]([O-])C1=CC=CC(=C1)O Z57160187 [1,1,0,0,0,0|2,0,0]=4 560 B10R1.1 CC1=CC=C(C=C1)/C=N/O Z49568558 [1,1,0,0,0,0|1,0,1]=4 561 B10R1.1 CC1=CC=C(C=C1)CC=O Z993017610 [1,1,0,0,0,0|0,0,1]=3 562 B10R1.1 O/N=C/C1=CC=C(C=C1)Br Z49568330 [1,1,0,0,0,0|1,0,1]=4 563 B10R1.1 O/N=C/C1=CC=C(C=C1)Cl Z49568332 [1,1,0,0,0,0|1,0,1]=4 564 B10R1.1 O/N=C/C1=CC=C(C=C1)F Z49568341 [1,1,0,0,0,0|1,0,1]=4 565 B10R1.1 O/N=C/C1=CC=C(C=C1)O Z49568314 [1,1,0,0,0,0|1,0,1]=4 566 B10R1.1 O=C=NC1=CC=C(C=C1)Br Z316172584 [1,1,0,0,0,0|1,0,1]=4 567 B10R1.1 O=C=NC1=CC=C(C=C1)Cl Z104472166 [1,1,0,0,0,0|1,0,1]=4 568 B10R1.1 O=CCC1=CC=C(C=C1)Br Z1079442512 [1,1,0,0,0,0|0,0,1]=3 569 B10R1.1 O=CCC1=CC=C(C=C1)Cl Z993017718 [1,1,0,0,0,0|0,0,1]=3 570 B10R1.1 O=CCC1=CC=C(C=C1)F Z993017752 [1,1,0,0,0,0|0,0,1]=3 571 B10R1.1 O=CNC1=CC=C(C=C1)O Z87002541 [1,1,0,0,0,0|1,0,0]=3 572 B10R1.4 C=CCC1=C(C=CC=C1)O Z104493210 [1,1,0,0,0,0|1,0,1]=4 573 B10R1.4 CC1=C(C=CC=C1)/C=N/O Z49568554 [1,1,0,0,0,0|1,0,1]=4 574 B10R1.4 CC1=C(C=CC=C1)CC=O Z993017618 [1,1,0,0,0,0|0,0,1]=3 575 B10R1.4 O/N=C/C1=C(C=CC=C1)Br Z49568618 [1,1,0,0,0,0|1,0,1]=4 576 B10R1.4 O/N=C/C1=C(C=CC=C1)F Z49568531 [1,1,0,0,0,0|1,0,1]=4 577 B10R1.4 O/N=C/C1=C(C=CC=C1)O Z49568319 [1,1,0,0,0,0|1,0,1]=4 578 B10R1.4 O=CCC1=C(C=CC=C1)Br Z1183459130 [1,1,0,0,0,0|0,0,1]=3 579 B10R1.4 O=CCC1=C(C=CC=C1)F Z993017796 [1,1,0,0,0,0|0,0,1]=3 580 B10R1.10 C=COC1=CC=CC(=C1)C Z1269547004 [1,1,0,0,0,0|2,0,0]=4 581 B10R1.10 NC1=CC(=CC=C1)NC=O Z1203578959 [1,1,0,0,0,0|1,0,0]=3 582 B10R1.10 O=CCC1=CC=CC(=C1)Br Z1079442816 [1,1,0,0,0,0|0,0,1]=3 583 B10R1.10 O=CCC1=CC=CC(=C1)Cl Z993017836 [1,1,0,0,0,0|0,0,1]=3 584 B10R1.10 O=CNC1=CC=CC(=C1)O Z56886391 [1,1,0,0,0,0|1,0,0]=3 585 B10R1.17 NC/C=C/C1=CC=CC=C1 Z2953771905 [1,1,0,0,0,0|1,0,0]=3 586 B10R1.17 NC/C=C/C1=CN=CC=C1 Z2216303151 [1,1,0,0,0,0|2,0,0]=4 587 B10R1.17 O=C/C=C/C1=CC=CC=C1 Z3219847383 [1,1,0,0,0,0|0,0,0]=2 588 B10R1.17 O=C/C=C/C1=CC=NC=C1 Z2417822722 [1,1,0,0,0,0|1,0,0]=3 589 B10R1.17 O=C/C=C/C1=NC=CC=C1 Z1255366309 [1,1,0,0,0,0|1,0,0]=3 590 B10R1.17 O=CC#CC1=CC=CC=C1 Z1255485337 [1,1,0,0,0,0|0,0,1]=3 591 B10R1.17 O=CCCC1=CC=CC=C1 Z87002472 [1,1,0,0,0,0|0,0,1]=3 592 B10R1.17 O=CCCC1=CC=NC=C1 Z1070006438 [1,1,0,0,0,0|1,0,1]=4 593 B10R1.17 O=CCCC1=CN=CC=C1 Z1198276578 [1,1,0,0,0,0|1,0,1]=4 594 B10R1.17 O=CCCC1=NC=CC=C1 Z1079158816 [1,1,0,0,0,0|1,0,1]=4 595 B10R1.17 O=CCOC1=CC=CC=C1 Z854102570 [1,1,0,0,0,0|0,0,1]=3 596 B10R1.17 O=CCOC1=NC=CC=C1 Z1255434510 [1,1,0,0,0,0|1,0,1]=4 597 B10R1.17 O=CNCC1=CC=CC=C1 Z1203730748 [1,1,0,0,0,0|0,0,1]=3 598 B10R1.17 O=CNNC1=CC=CC=C1 Z1198148433 [1,1,0,0,0,0|1,0,0]=3 599 B10R1.17 OC/C=C/C1=CC=CC=C1 Z104473562 [1,1,0,0,0,0|0,0,1]=3 600 B10R1.18 CC(=O)CC1=CC=NC=C1 Z992409812 [1,1,0,0,0,0|1,0,1]=4 601 B10R1.18 CC(=O)NC1=CC=CC=C1 Z27782600 [1,1,0,0,0,0|1,0,0]=3 602 B10R1.18 CC(=O)NC1=CN=CC=C1 Z31791378 [1,1,0,0,0,0|2,0,0]=4 603 B10R1.18 N=C(N)CC1=CC=CC=C1 Z600428462 [1,1,0,0,0,0|1,0,1]=4 604 B10R1.18 NC(=O)CC1=CC=CC=C1 Z33546508 [1,1,0,0,0,0|0,0,1]=3 605 B10R1.18 NC(=O)CC1=CC=NC=C1 Z234895093 [1,1,0,0,0,0|1,0,1]=4 606 B10R1.18 NC(=O)NC1=NC=CC=C1 Z208358454 [1,1,0,0,0,0|2,0,0]=4 607 B10R1.18 NC(=O)OC1=CC=CC=C1 Z33547080 [1,1,0,0,0,0|1,0,0]=3 608 B10R1.18 NC(=S)CC1=CC=CC=C1 Z56928578 [1,1,0,0,0,0|0,1,1]=4 609 B10R1.18 NC(=S)NC1=CC=CC=C1 Z57474172 [1,1,0,0,0,0|1,1,0]=4 610 B10R1.18 O=C(O)CC1=CC=NC=C1 Z271099418 [1,1,0,0,0,0|1,0,1]=4 611 B10R1.18 O=C(O)CC1=CN=CC=C1 Z285131558 [1,1,0,0,0,0|1,0,1]=4 612 B10R1.18 O=S(O)CC1=CC=CC=C1 Z3211806022 [1,1,0,0,0,0|1,0,1]=4 613 B10R1.18 O=[N+]([O-])CC1=CC=CC=C1 Z995236210 [1,1,0,0,0,0|1,0,1]=4 614 B12R1.32 O=C(/C=N/O)NC1=CC=CC=C1 Z56871811 [0,1,0,0,0,1|1,0,1]=4 615 B12R1.34 C=C(C#N)C(O)C1=CC=CC=C1 Z320966940 [0,1,0,0,0,1|1,0,1]=4 616 B12R1.34 C=CC(=O)N(C)C1=CC=CC=C1 Z440633576 [0,1,0,0,0,1|2,0,0]=4 617 B12R1.43 C/C(=C\C1=CC=CC=C1)/C(=O)O Z2980228149 [0,1,0,0,0,1|0,0,1]=3 618 B12R1.43 C/C(=C\C1=CC=NC=C1)/C(=O)O Z2466682039 [0,1,0,0,0,1|1,0,1]=4 619 B12R1.43 C/C(=C\C1=CN=CC=C1)/C(=O)O Z2467131746 [0,1,0,0,0,1|1,0,1]=4 620 B12R1.43 C/C(=C\C1=NC=CC=C1)/C(=O)O Z2467234655 [0,1,0,0,0,1|1,0,1]=4 621 B12R1.43 CC(=O)C(N)CC1=CC=CC=C1 Z90124995 [0,1,0,0,0,1|1,0,1]=4 622 B12R1.43 CC(CC1=CC=CC=C1)C(=O)O Z513624710 [0,1,0,0,0,1|0,0,2]=4 623 B12R1.43 CC(NC1=CC=CC=C1)C(=O)O Z57982184 [0,1,0,0,0,1|0,0,2]=4 624 B12R1.43 CC(OC1=CC=CC=C1)C(=O)O Z57825333 [0,1,0,0,0,1|0,0,2]=4 625 B12R1.43 CC(SC1=CC=CC=C1)C(=O)N Z19751098 [0,1,0,0,0,1|0,0,2]=4 626 B12R1.43 CC(SC1=CC=CC=C1)C(=O)O Z90122656 [0,1,0,0,0,1|0,0,2]=4 627 B12R1.43 CN(CC1=CC=CC=C1)C(=O)N Z198194348 [0,1,0,0,0,1|1,0,1]=4 628 B12R1.43 C[C@@H](CC1=CC=CC=C1)C(=O)O Z1262510261 [0,1,0,0,0,1|0,0,2]=4 629 B12R1.43 NC(=O)C(N)CC1=CC=CC=C1 Z317075516 [0,1,0,0,0,1|1,0,1]=4 630 B12R1.43 NC(=O)[C@@H](N)CC1=CC=CC=C1 Z760046820 [0,1,0,0,0,1|1,0,1]=4 631 B12R1.43 NC(=O)[C@H](N)CC1=CC=CC=C1 Z933616656 [0,1,0,0,0,1|1,0,1]=4 632 B12R1.43 NC(CC1=CC=CC=C1)C(=O)O Z57127433 [0,1,0,0,0,1|1,0,1]=4 633 B12R1.43 N[C@@H](CC1=CC=CC=C1)C(=O)O Z756430566 [0,1,0,0,0,1|1,0,1]=4 634 B12R1.43 N[C@H](CC1=CC=CC=C1)C(=O)O Z933646062 [0,1,0,0,0,1|1,0,1]=4 635 B12R1.43 O=C(O)/C(=C/C1=CN=CC=C1)/F Z2081677235 [0,1,0,0,0,1|2,0,0]=4 636 B12R1.43 O=C(O)C(=O)CC1=CC=CC=C1 Z285151774 [0,1,0,0,0,1|1,0,0]=3 637 B12R1.43 O=C(O)C(=O)NC1=CC=CC=C1 Z362848468 [0,1,0,0,0,1|1,0,0]=3 638 B12R1.43 O=C(O)C(O)CC1=CC=CC=C1 Z788000648 [0,1,0,0,0,1|1,0,1]=4 639 B12R1.43 O=C(O)[C@@H](O)CC1=CC=CC=C1 Z1255386695 [0,1,0,0,0,1|1,0,1]=4 640 B12R1.43 O=C(O)[C@H](O)CC1=CC=CC=C1 Z1255364914 [0,1,0,0,0,1|1,0,1]=4 641 B12R1.49 C/C(=C\C1=CC=C(C=C1)Cl)/C=O Z1251359146 [0,1,0,0,0,1|0,0,1]=3 642 B12R1.49 C=CC(=O)NC1=CC=C(C=C1)Br Z381016676 [0,1,0,0,0,1|2,0,0]=4 643 B12R1.49 C=CC(=O)NC1=CC=C(C=C1)C Z440633654 [0,1,0,0,0,1|2,0,0]=4 644 B12R1.49 C=CC(=O)NC1=CC=C(C=C1)Cl Z440633664 [0,1,0,0,0,1|2,0,0]=4 645 B12R1.49 C=CC(=O)NC1=CC=C(C=C1)F Z424770410 [0,1,0,0,0,1|2,0,0]=4 646 B12R1.49 CC1=CC=C(C=C1)CC(Cl)C=O Z982126370 [0,1,0,0,0,1|1,0,1]=4 647 B12R1.50 C=CC(=O)NC1=CC=CC(=C1)Br Z381016842 [0,1,0,0,0,1|2,0,0]=4 648 B12R1.50 C=CC(=O)NC1=CC=CC(=C1)C Z440633644 [0,1,0,0,0,1|2,0,0]=4 649 B12R1.50 C=CC(=O)NC1=CC=CC(=C1)Cl Z440633660 [0,1,0,0,0,1|2,0,0]=4 650 B12R1.50 C=CC(=O)NC1=CC=CC(=C1)F Z440633662 [0,1,0,0,0,1|2,0,0]=4 651 B12R1.118 CC/C(=C\C1=CN=CC=C1)/C=O Z2680496861 [0,1,0,0,0,1|1,0,1]=4 652 B12R1.118 COC(C=O)CC1=CC=CC=C1 Z1511872212 [0,1,0,0,0,1|0,0,2]=4 653 B12R1.194 CC(C)(C=O)CC1=CC=CC=C1 Z1188488760 [0,1,0,0,0,1|0,0,2]=4 654 B12R1.194 CC(C)(C=O)OC1=CC=CC=C1 Z1511766557 [0,1,0,0,0,1|0,0,2]=4 655 B12R1.371 C=CC(=O)NC1=C(C=CC=C1)C Z440633758 [0,1,0,0,0,1|2,0,0]=4 656 B12R1.371 C=CC(=O)NC1=C(C=CC=C1)Cl Z440633680 [0,1,0,0,0,1|2,0,0]=4 657 B12R1.371 C=CC(=O)NC1=C(C=CC=C1)F Z295390598 [0,1,0,0,0,1|2,0,0]=4 658 B12R1.371 O=CC(Cl)CC1=C(C=CC=C1)Cl Z982126354 [0,1,0,0,0,1|1,0,1]=4 659 B12R1.9 CC(C)(C=O)C1=CC=C(C=C1)Br Z1269186802 [0,2,0,0,0,0|0,0,2]=4 660 B12R1.9 CC1=CC=C(C=C1)C(C)(C)C=O Z1255385343 [0,2,0,0,0,0|0,0,2]=4 661 B12R1.253 CC(=O)C(C)(C)C1=CC=CC=C1 Z406676998 [0,2,0,0,0,0|0,0,2]=4 662 B12R1.253 CC(C)(C(=O)O)C1=CC=CC=C1 Z104493600 [0,2,0,0,0,0|0,0,2]=4 663 B12R1.253 CC(N)(C(=O)N)C1=CC=CC=C1 Z1211228973 [0,2,0,0,0,0|0,0,2]=4 664 B12R1.253 CC(N)(C(=O)O)C1=CC=CC=C1 Z600397716 [0,2,0,0,0,0|0,0,2]=4 665 B12R1.253 CC(O)(C(=O)O)C1=CC=CC=C1 Z336127660 [0,2,0,0,0,0|0,0,2]=4 666 B12R1.253 C[C@@](O)(C(=O)O)C1=CC=CC=C1 Z1154245575 [0,2,0,0,0,0|0,0,2]=4 667 B12R1.253 C[C@](O)(C(=O)O)C1=CC=CC=C1 Z1119104455 [0,2,0,0,0,0|0,0,2]=4 668 B12R1.253 NC(=O)C(F)(F)C1=CC=CC=C1 Z56757372 [0,2,0,0,0,0|1,0,1]=4 669 B12R1.253 O=C(O)C(F)(F)C1=CC=CC=C1 Z56770330 [0,2,0,0,0,0|1,0,1]=4 670 B12R1.3 C=CCC(C=O)C1=CC=CC=C1 Z1416169093 [0,2,0,0,0,0|0,0,1]=3 671 B12R1.3 CCCC(C=O)C1=CC=CC=C1 Z1251357295 [0,2,0,0,0,0|0,0,2]=4 672 B12R1.12 CC1=CC=C(C=C1)C(C#N)C=O Z1020843756 [0,2,0,0,0,0|0,0,2]=4 673 B12R1.12 CC1=CC=C(C=C1)C(C=O)C=O Z955014002 [0,2,0,0,0,0|0,0,1]=3 674 B12R1.13 O=C/C(=C\O)/C1=CC(=CC=C1)O Z3278355634 [0,2,0,0,0,0|0,0,0]=2 675 B12R1.478 CC(=O)/C(=C\1/C=CC=CN1)/C#N Z1262581996 [0,2,0,0,0,0|1,0,1]=4 676 B12R1.478 CC(C)C(C=O)C1=CC=CC=C1 Z1255439670 [0,2,0,0,0,0|0,0,2]=4 677 B12R1.478 CCC(C(=O)O)C1=CC=CC=C1 Z104479150 [0,2,0,0,0,0|0,0,2]=4 678 B12R1.478 CCN(C(=O)C)C1=CC=CC=C1 Z58324632 [0,2,0,0,0,0|1,0,1]=4 679 B12R1.478 CNC(C(=O)O)C1=CC=CC=C1 Z1259273212 [0,2,0,0,0,0|0,0,2]=4 680 B12R1.478 COC(C(=O)C)C1=CC=CC=C1 Z1513595127 [0,2,0,0,0,0|0,0,2]=4 681 B12R1.478 COC(C(=O)O)C1=CC=CC=C1 Z316258914 [0,2,0,0,0,0|0,0,2]=4 682 B12R1.478 CSC(C(=O)O)C1=CC=CC=C1 Z732206604 [0,2,0,0,0,0|0,0,2]=4 683 B12R1.478 NCC(C(=O)O)C1=CC=CC=C1 Z1913661007 [0,2,0,0,0,0|0,0,2]=4 684 B12R1.478 O=C(O)C(CO)C1=CC=CC=C1 Z1080722424 [0,2,0,0,0,0|0,0,2]=4 685 B12R1.478 O=C(O)[C@H](CO)C1=CC=CC=C1 Z1262510670 [0,2,0,0,0,0|0,0,2]=4 686 B12R1.16 C=CCC(=O)C1=CC=C(C=C1)F Z808661950 [0,2,0,0,0,0|2,0,0]=4 687 B12R1.16 CC1=CC=C(C=C1)C(=O)/C=C/[O-] Z199534162 [0,2,0,0,0,0|1,0,1]=4 688 B12R1.16 N#C/C=C(\Cl)/C1=CC=C(C=C1)F Z56943822 [0,2,0,0,0,0|2,0,0]=4 689 B12R1.16 O=C(/C=C/[O-])C1=CC=C(C=C1)Cl Z56943452 [0,2,0,0,0,0|1,0,1]=4 690 B12R1.30 C/C(=N\NC=O)/C1=CN=CC=C1 Z49645707 [0,2,0,0,0,0|1,0,1]=4 691 B12R1.30 C/C(=N\NC=O)/C1=NC=CC=C1 Z49645705 [0,2,0,0,0,0|1,0,1]=4 692 B12R1.30 C=CCCC(=O)C1=CC=CC=C1 Z406376458 [0,2,0,0,0,0|2,0,0]=4 693 B12R1.107 C/C(=C\C(=O)O)/C1=CC=CC=C1 Z352748396 [0,2,0,0,0,0|0,0,1]=3 694 B12R1.107 C/C(=C\C(=O)O)/C1=CC=NC=C1 Z352748124 [0,2,0,0,0,0|1,0,1]=4 695 B12R1.107 C/C(=C\C(=O)O)/C1=CN=CC=C1 Z352748104 [0,2,0,0,0,0|1,0,1]=4 696 B12R1.107 CC(=O)CC(=O)C1=CC=NC=C1 Z359504772 [0,2,0,0,0,0|2,0,0]=4 697 B12R1.107 CC(=O)CC(=O)C1=CN=CC=C1 Z57157128 [0,2,0,0,0,0|2,0,0]=4 698 B12R1.107 CC(CC(=O)N)C1=CC=CC=C1 Z33546734 [0,2,0,0,0,0|0,0,2]=4 699 B12R1.107 CC(CC(=O)O)C1=CC=CC=C1 Z56899204 [0,2,0,0,0,0|0,0,2]=4 700 B12R1.107 CC(NC(=O)N)C1=CC=CC=C1 Z198194342 [0,2,0,0,0,0|0,0,2]=4 701 B12R1.107 CN(CC(=O)N)C1=CC=CC=C1 Z54747686 [0,2,0,0,0,0|1,0,1]=4 702 B12R1.107 CN(CC(=O)O)C1=CC=CC=C1 Z1162448842 [0,2,0,0,0,0|1,0,1]=4 703 B12R1.107 N=C(N)NC(=O)C1=CC=CC=C1 Z1198149259 [0,2,0,0,0,0|2,0,0]=4 704 B12R1.107 NC(CC(=O)O)C1=CC=CC=C1 Z94601171 [0,2,0,0,0,0|1,0,1]=4 705 B12R1.107 N[C@@H](CC(=O)O)C1=CC=CC=C1 Z756925772 [0,2,0,0,0,0|1,0,1]=4 706 B12R1.107 N[C@H](CC(=O)O)C1=CC=CC=C1 Z1696091779 [0,2,0,0,0,0|1,0,1]=4 707 B12R1.107 O=C(O)/C=C(\F)/C1=CN=CC=C1 Z4602486084 [0,2,0,0,0,0|2,0,0]=4 708 B12R1.107 O=C(O)/C=C(\I)/C1=CC=CC=C1 Z3379426714 [0,2,0,0,0,0|1,0,0]=3 709 B12R1.107 O=C(O)CC(O)C1=CC=CC=C1 Z982132010 [0,2,0,0,0,0|1,0,1]=4 710 B12R1.107 O=C(O)NC(=O)C1=CC=CC=C1 Z56928966 [0,2,0,0,0,0|1,0,0]=3 711 B12R1.308 C=CCC(=O)C1=C(C=CC=C1)F Z1082405332 [0,2,0,0,0,0|2,0,0]=4 712 B12R1.5 C=C(CO)C1=CC=C(C=C1)OC Z1896425058 [0,2,0,0,0,0|0,0,2]=4 713 B12R1.5 CCC1=CC=C(C=C1)C(C)C=O Z1255424702 [0,2,0,0,0,0|0,0,2]=4 714 B12R1.5 COC1=CC=C(C=C1)C(C)C=O Z1255380175 [0,2,0,0,0,0|0,0,2]=4 715 B12R1.5 COC1=CC=C(C=C1)[C@H](C)C=O Z1511751525 [0,2,0,0,0,0|0,0,2]=4 716 B12R1.5 CSC1=CC=C(C=C1)C(=O)C=O Z2289798581 [0,2,0,0,0,0|1,0,0]=3 717 B12R1.5 CSC1=CC=C(C=C1)C(C)C=O Z1511826610 [0,2,0,0,0,0|0,0,2]=4 718 B12R1.20 C=C(C(=O)O)C1=CC=C(C=C1)Cl Z1255421681 [0,2,0,0,0,0|0,0,0]=2 719 B12R1.20 C=C(C)C(=O)C1=CC=C(C=C1)O Z1513599636 [0,2,0,0,0,0|2,0,0]=4 720 B12R1.20 CC(=O)C(C)C1=CC=C(C=C1)Cl Z1276728135 [0,2,0,0,0,0|0,0,2]=4 721 B12R1.20 CC(=O)C(Cl)C1=CC=C(C=C1)F Z1255439681 [0,2,0,0,0,0|1,0,1]=4 722 B12R1.20 CC(=O)N(C)C1=CC=C(C=C1)N Z147641478 [0,2,0,0,0,0|1,0,1]=4 723 B12R1.20 CC(=O)N(C)C1=CC=C(C=C1)O Z335806634 [0,2,0,0,0,0|1,0,1]=4 724 B12R1.20 CC(C(=O)O)C1=CC=C(C=C1)Br Z1259342200 [0,2,0,0,0,0|0,0,2]=4 725 B12R1.20 CC(C(=O)O)C1=CC=C(C=C1)Cl Z982129848 [0,2,0,0,0,0|0,0,2]=4 726 B12R1.20 CC(C(=O)O)C1=CC=C(C=C1)F Z792377290 [0,2,0,0,0,0|0,0,2]=4 727 B12R1.20 CC(C(=O)O)C1=CC=C(C=C1)I Z1269218602 [0,2,0,0,0,0|0,0,2]=4 728 B12R1.20 CC(C(=O)O)C1=CC=C(C=C1)N Z2935001159 [0,2,0,0,0,0|0,0,2]=4 729 B12R1.20 CC1=CC=C(C=C1)C(=O)C(=O)O Z118430526 [0,2,0,0,0,0|1,0,0]=3 730 B12R1.20 CC1=CC=C(C=C1)C(C)C(=O)O Z792377274 [0,2,0,0,0,0|0,0,2]=4 731 B12R1.20 CC1=CC=C(C=C1)C(N)C(=O)O Z317024662 [0,2,0,0,0,0|1,0,1]=4 732 B12R1.20 CN(C(=O)N)C1=CC=C(C=C1)O Z285211056 [0,2,0,0,0,0|1,0,1]=4 733 B12R1.20 NC(=O)C(Br)C1=CC=C(C=C1)F Z198750878 [0,2,0,0,0,0|1,0,1]=4 734 B12R1.20 NC(=O)C(Cl)C1=CC=C(C=C1)Br Z56791849 [0,2,0,0,0,0|1,0,1]=4 735 B12R1.20 NC(=O)C(N)C1=CC=C(C=C1)Br Z57069227 [0,2,0,0,0,0|1,0,1]=4 736 B12R1.20 NC(=O)C(N)C1=CC=C(C=C1)Cl Z1255523404 [0,2,0,0,0,0|1,0,1]=4 737 B12R1.20 NC(=O)C(N)C1=CC=C(C=C1)F Z220512688 [0,2,0,0,0,0|1,0,1]=4 738 B12R1.20 NC(C(=O)O)C1=CC=C(C=C1)Br Z317024668 [0,2,0,0,0,0|1,0,1]=4 739 B12R1.20 NC(C(=O)O)C1=CC=C(C=C1)Cl Z317024646 [0,2,0,0,0,0|1,0,1]=4 740 B12R1.20 NC(C(=O)O)C1=CC=C(C=C1)F Z317024670 [0,2,0,0,0,0|1,0,1]=4 741 B12R1.20 N[C@@H](C(=O)O)C1=CC=C(C=C1)O Z1198149764 [0,2,0,0,0,0|1,0,1]=4 742 B12R1.20 N[C@H](C(=O)O)C1=CC=C(C=C1)F Z1255390982 [0,2,0,0,0,0|1,0,1]=4 743 B12R1.20 N[C@H](C(=O)O)C1=CC=C(C=C1)O Z1255364887 [0,2,0,0,0,0|1,0,1]=4 744 B12R1.20 O=C(O)C(=O)C1=CC=C(C=C1)Cl Z381360896 [0,2,0,0,0,0|1,0,0]=3 745 B12R1.20 O=C(O)C(=O)C1=CC=C(C=C1)F Z381360860 [0,2,0,0,0,0|1,0,0]=3 746 B12R1.20 O=C(O)C(=O)C1=CC=C(C=C1)O Z2472464309 [0,2,0,0,0,0|1,0,0]=3 747 B12R1.20 O=C(O)C(F)C1=CC=C(C=C1)F Z1318255176 [0,2,0,0,0,0|1,0,1]=4 748 B12R1.20 O=C(O)C(O)C1=CC=C(C=C1)Br Z788000726 [0,2,0,0,0,0|1,0,1]=4 749 B12R1.367 CC(C=O)C1=CC(=C(C=C1)Br)Cl Z2733489170 [0,2,0,0,0,0|0,0,2]=4 750 B12R1.367 CC1=C(C=CC(=C1)C(=O)C=O)F Z1198178432 [0,2,0,0,0,0|1,0,0]=3 751 B12R1.367 O=CC(=O)C1=CC(=C(C=C1)F)F Z1741975141 [0,2,0,0,0,0|1,0,0]=3 752 B12R1.1703 CC(C=O)C1=C(C=C(C=C1)F)F Z1268606334 [0,2,0,0,0,0|0,0,2]=4 753 B12R1.225 CC(=O)C(O)C1=CC(=CC=C1)Cl Z1255467340 [0,2,0,0,0,0|1,0,1]=4 754 B12R1.225 CC(=O)N(C)C1=CC(=CC=C1)N Z802628524 [0,2,0,0,0,0|1,0,1]=4 755 B12R1.225 CC(C(=O)O)C1=CC(=CC=C1)F Z792377330 [0,2,0,0,0,0|0,0,2]=4 756 B12R1.225 CC1=CC(=CC=C1)C(=O)C(=O)O Z1255379743 [0,2,0,0,0,0|1,0,0]=3 757 B12R1.225 CC1=CC(=CC=C1)C(N)C(=O)O Z317024596 [0,2,0,0,0,0|1,0,1]=4 758 B12R1.225 CC1=CC(=CC=C1)C(O)C(=O)O Z788000614 [0,2,0,0,0,0|1,0,1]=4 759 B12R1.225 CC1=CC=CC(=C1)C(C)C(=O)O Z802854000 [0,2,0,0,0,0|0,0,2]=4 760 B12R1.225 CN(C(=O)N)C1=CC(=CC=C1)N Z802629090 [0,2,0,0,0,0|1,0,1]=4 761 B12R1.225 NC(=O)C(N)C1=CC(=CC=C1)Br Z477338262 [0,2,0,0,0,0|1,0,1]=4 762 B12R1.225 NC(C(=O)O)C1=CC(=CC=C1)Br Z317024672 [0,2,0,0,0,0|1,0,1]=4 763 B12R1.225 NC(C(=O)O)C1=CC(=CC=C1)Cl Z317024654 [0,2,0,0,0,0|1,0,1]=4 764 B12R1.225 NC(C(=O)O)C1=CC(=CC=C1)F Z317024592 [0,2,0,0,0,0|1,0,1]=4 765 B12R1.225 NC(C(=O)O)C1=CC(=CC=C1)I Z3477438782 [0,2,0,0,0,0|1,0,1]=4 766 B12R1.225 NC(C(=O)O)C1=CC(=CC=C1)O Z1532541074 [0,2,0,0,0,0|1,0,1]=4 767 B12R1.225 NC1=CC(=CC=C1)C(O)C(=O)O Z1262512603 [0,2,0,0,0,0|1,0,1]=4 768 B12R1.225 O=C(O)C(O)C1=CC(=CC=C1)Br Z788000730 [0,2,0,0,0,0|1,0,1]=4 769 B12R1.225 O=C(O)C(O)C1=CC(=CC=C1)Cl Z788000712 [0,2,0,0,0,0|1,0,1]=4 770 B12R1.225 O=C(O)C(O)C1=CC(=CC=C1)F Z788000610 [0,2,0,0,0,0|1,0,1]=4 771 B12R1.225 O=C(O)C(O)C1=CC(=CC=C1)I Z1269151011 [0,2,0,0,0,0|1,0,1]=4 772 B12R1.358 CC(C=O)C1=CC(=CC(=C1)F)F Z1391936337 [0,2,0,0,0,0|0,0,2]=4 773 B12R1.358 CC1=CC(=CC(=C1)C(=O)C=O)C Z2472857051 [0,2,0,0,0,0|1,0,0]=3 774 B12R1.358 O=CC(=O)C1=CC(=CC(=C1)F)F Z1511770901 [0,2,0,0,0,0|1,0,0]=3 775 B12R1.435 COC1=CC(=CC=C1)C(C)C=O Z1255385344 [0,2,0,0,0,0|0,0,2]=4 776 B12R1.124 C=C(C(=O)O)C1=C(C=CC=C1)F Z1255374937 [0,2,0,0,0,0|0,0,0]=2 777 B12R1.124 CC(=O)C(N)C1=C(C=CC=C1)F Z2312540924 [0,2,0,0,0,0|1,0,1]=4 778 B12R1.124 CC(C(=O)O)C1=C(C=CC=C1)Cl Z982130746 [0,2,0,0,0,0|0,0,2]=4 779 B12R1.124 CC(C(=O)O)C1=C(C=CC=C1)F Z792377276 [0,2,0,0,0,0|0,0,2]=4 780 B12R1.124 CC1=C(C=CC=C1)C(C)C(=O)O Z792377258 [0,2,0,0,0,0|0,0,2]=4 781 B12R1.124 CC1=C(C=CC=C1)C(N)C(=O)O Z317024660 [0,2,0,0,0,0|1,0,1]=4 782 B12R1.124 NC(C(=O)O)C1=C(C=CC=C1)Br Z317024716 [0,2,0,0,0,0|1,0,1]=4 783 B12R1.124 NC(C(=O)O)C1=C(C=CC=C1)F Z317024726 [0,2,0,0,0,0|1,0,1]=4 784 B12R1.124 NC(C(=O)O)C1=C(C=CC=C1)I Z2941400819 [0,2,0,0,0,0|1,0,1]=4 785 B12R1.124 O=C(O)C(O)C1=C(C=CC=C1)Br Z788000812 [0,2,0,0,0,0|1,0,1]=4 786 B12R1.124 O=C(O)C(O)C1=C(C=CC=C1)I Z1269111466 [0,2,0,0,0,0|1,0,1]=4 787 B12R1.124 O=C(O)[C@H](O)C1=C(C=CC=C1)Cl Z1255488133 [0,2,0,0,0,0|1,0,1]=4 788 B12R1.77 COC1=C(C=CC=C1)C(C)C=O Z1255384224 [0,2,0,0,0,0|0,0,2]=4 789 B12R1.3441 CC1=CC=CC(=C1C(=O)C=O)C Z1255493007 [0,2,0,0,0,0|1,0,0]=3 790 B10R1.30 CC1=C(C=C(C=C1)Br)C=O Z871801782 [0,0,1,1,0,0|1,0,1]=4 791 B10R1.30 CC1=C(C=C(C=C1)Cl)C=O Z871801780 [0,0,1,1,0,0|1,0,1]=4 792 B10R1.30 CC1=C(C=C(C=C1)F)C=O Z1080470282 [0,0,1,1,0,0|1,0,1]=4 793 B10R1.30 CC1=CC(=C(C=C1)Br)C=O Z871833034 [0,0,1,1,0,0|1,0,1]=4 794 B10R1.30 CC1=CC(=C(C=C1)C)C=O Z104479610 [0,0,1,1,0,0|0,0,2]=4 795 B10R1.30 CC1=CC(=C(C=C1)Cl)C=O Z871801784 [0,0,1,1,0,0|1,0,1]=4 796 B10R1.30 CC1=CC(=C(C=C1)F)C=O Z732814056 [0,0,1,1,0,0|1,0,1]=4 797 B10R1.30 CC1=CC(=C(C=C1)O)C=O Z274774390 [0,0,1,1,0,0|1,0,1]=4 798 B10R1.30 NC1=C(C=C(C=C1)Br)C=O Z1269131915 [0,0,1,1,0,0|2,0,0]=4 799 B10R1.30 O=CC1=C(C=CC(=C1)Br)Br Z385370000 [0,0,1,1,0,0|2,0,0]=4 800 B10R1.30 O=CC1=C(C=CC(=C1)Br)Cl Z871801788 [0,0,1,1,0,0|2,0,0]=4 801 B10R1.30 O=CC1=C(C=CC(=C1)Br)F Z104482596 [0,0,1,1,0,0|2,0,0]=4 802 B10R1.30 O=CC1=C(C=CC(=C1)Br)I Z1269213434 [0,0,1,1,0,0|2,0,0]=4 803 B10R1.30 O=CC1=C(C=CC(=C1)Br)O Z57313901 [0,0,1,1,0,0|2,0,0]=4 804 B10R1.30 O=CC1=C(C=CC(=C1)Cl)Br Z871833038 [0,0,1,1,0,0|2,0,0]=4 805 B10R1.30 O=CC1=C(C=CC(=C1)Cl)Cl Z871801786 [0,0,1,1,0,0|2,0,0]=4 806 B10R1.30 O=CC1=C(C=CC(=C1)Cl)F Z819785594 [0,0,1,1,0,0|2,0,0]=4 807 B10R1.30 O=CC1=C(C=CC(=C1)Cl)I Z1269163931 [0,0,1,1,0,0|2,0,0]=4 808 B10R1.30 O=CC1=C(C=CC(=C1)Cl)O Z57772439 [0,0,1,1,0,0|2,0,0]=4 809 B10R1.30 O=CC1=C(C=CC(=C1)F)Br Z1079442476 [0,0,1,1,0,0|2,0,0]=4 810 B10R1.30 O=CC1=C(C=CC(=C1)F)Cl Z1201622451 [0,0,1,1,0,0|2,0,0]=4 811 B10R1.30 O=CC1=C(C=CC(=C1)F)F Z385369882 [0,0,1,1,0,0|2,0,0]=4 812 B10R1.30 O=CC1=C(C=CC(=C1)F)O Z415638796 [0,0,1,1,0,0|2,0,0]=4 813 B10R1.30 O=CC1=C(C=CC(=C1)I)Br Z1269223795 [0,0,1,1,0,0|2,0,0]=4 814 B10R1.30 O=CC1=C(C=CC(=C1)I)Cl Z1269146293 [0,0,1,1,0,0|2,0,0]=4 815 B10R1.30 O=CC1=C(C=CC(=C1)O)Br Z1269171271 [0,0,1,1,0,0|2,0,0]=4 816 B10R1.30 O=CC1=C(C=CC(=C1)O)Cl Z1198174868 [0,0,1,1,0,0|2,0,0]=4 817 B10R1.30 O=CC1=C(C=CC(=C1)O)O Z586251264 [0,0,1,1,0,0|2,0,0]=4 818 B10R1.5 C=CCC1=C(C=CO1)C=O Z1511896697 [0,0,1,1,0,0|1,0,1]=4 819 B10R1.20 C#CC1=C(C=CC=C1)C=O Z1255373145 [0,0,1,1,0,0|0,0,2]=4 820 B10R1.20 C=CC1=C(C=CC=N1)C=O Z1198169175 [0,0,1,1,0,0|1,0,0]=3 821 B10R1.20 CCC1=C(C=CC=C1)C=O Z979776466 [0,0,1,1,0,0|0,0,2]=4 822 B10R1.20 CNC1=C(C=CC=C1)C=O Z1203730947 [0,0,1,1,0,0|1,0,1]=4 823 B10R1.20 COC1=C(C=CC=C1)C=O Z53833342 [0,0,1,1,0,0|1,0,1]=4 824 B10R1.20 N#CC1=C(C=CC=C1)C=O Z147641756 [0,0,1,1,0,0|1,0,1]=4 825 B10R1.20 O=CC1=C(C=CC=C1)C=O Z104494958 [0,0,1,1,0,0|1,0,0]=3 826 B10R1.20 O=CC1=C(C=CC=C1)CO Z1216844620 [0,0,1,1,0,0|1,0,1]=4 827 B10R1.27 C/C(=C\C1=CC=CO1)/C=O Z3061414163 [0,0,1,1,0,0|1,0,1]=4 828 B10R1.172 C#CC1=CC=CC(=C1)C=O Z1201623414 [0,0,1,1,0,0|0,0,2]=4 829 B10R1.172 C=CC1=CC(=CN=C1)C=O Z4958191467 [0,0,1,1,0,0|1,0,0]=3 830 B10R1.172 C=CC1=NC=CC(=C1)C=O Z1618142690 [0,0,1,1,0,0|1,0,0]=3 831 B10R1.172 CCC1=CC(=CC=C1)C=O Z1198218859 [0,0,1,1,0,0|0,0,2]=4 832 B10R1.172 CNC1=CC(=CC=C1)C=O Z1203829743 [0,0,1,1,0,0|1,0,1]=4 833 B10R1.172 COC1=CC(=CC=C1)C=O Z53836050 [0,0,1,1,0,0|1,0,1]=4 834 B10R1.172 CSC1=CC(=CC=C1)C=O Z1198235179 [0,0,1,1,0,0|1,0,1]=4 835 B10R1.172 N#CC1=CC=CC(=C1)C=O Z210802450 [0,0,1,1,0,0|1,0,1]=4 836 B10R1.172 NCC1=CC(=CC=C1)C=O Z3481427925 [0,0,1,1,0,0|1,0,1]=4 837 B10R1.172 O=CC1=CC=CC(=C1)CBr Z1201623840 [0,0,1,1,0,0|1,0,1]=4 838 B10R1.172 O=CC1=CC=CC(=C1)CCl Z1205658947 [0,0,1,1,0,0|1,0,1]=4 839 B10R1.172 O=CC1=CC=CC(=C1)CF Z1511848007 [0,0,1,1,0,0|1,0,1]=4 840 B10R2.7 C1=CC2=C(C=C1)CC=C2 Z104476162 [1,0,0,1,0,0|1,0,0]=3 841 B10R2.7 C1=CC2=C(C=C1)NC=C2 Z57833933 [1,0,0,1,0,0|1,0,0]=3 842 B10R2.7 C1=CC2=C(C=C1)NC=N2 Z57069879 [1,0,0,1,0,0|2,0,0]=4 843 B10R2.7 C1=CC2=C(C=C1)NN=C2 Z276614452 [1,0,0,1,0,0|2,0,0]=4 844 B10R2.7 C1=CC2=C(C=C1)OC=C2 Z56347207 [1,0,0,1,0,0|0,0,1]=3 845 B10R2.7 C1=CC2=C(C=C1)ON=C2 Z220335556 [1,0,0,1,0,0|1,0,1]=4 846 B10R2.7 C1=CC2=C(C=C1)SC=C2 Z370711590 [1,0,0,1,0,0|0,1,0]=3 847 B10R2.7 C1=CC2=C(C=C1)SC=N2 Z104472964 [1,0,0,1,0,0|1,1,0]=4 848 B10R2.7 C1=CC2=C(C=CN2)C=N1 Z1079456082 [1,0,0,1,0,0|2,0,0]=4 849 B10R2.7 C1=CC2=C(C=CO2)N=C1 Z2831987589 [1,0,0,1,0,0|1,0,1]=4 850 B10R2.7 C1=CC2=C(C=CS2)C=N1 Z810507710 [1,0,0,1,0,0|1,1,0]=4 851 B10R2.7 C1=CC2=C(C=N1)NC=C2 Z871773918 [1,0,0,1,0,0|2,0,0]=4 852 B10R2.7 C1=CC2=C(N=C1)NC=C2 Z271099378 [1,0,0,1,0,0|2,0,0]=4 853 B10R2.7 C1=CC2=NC=CN2C=C1 Z838912682 [1,0,0,1,0,0|2,0,0]=4 854 B10R2.7 C1=CNC2=CC=NC2=C1 Z1925930568 [1,0,0,1,0,0|2,0,0]=4 855 B12R2.18 CC1=C(C2=C(N1)C=CC=C2)Br Z361892264 [0,0,0,1,0,1|1,0,1]=4 856 B12R2.18 CC1=C(C2=C(N1)C=CC=C2)C Z56867202 [0,0,0,1,0,1|1,0,1]=4 857 B12R2.18 CC1=C(C2=C(S1)C=CC=C2)Br Z1269212248 [0,0,0,1,0,1|1,0,1]=4 858 B12R2.18 CC1CC2=C(C1=O)C=CC=C2 Z854042930 [0,0,0,1,0,1|0,0,2]=4 859 B12R2.18 CN1NC2=C(C1=O)C=CC=C2 Z1255429786 [0,0,0,1,0,1|1,0,1]=4 860 B12R2.18 ClC1=C(C2=C(S1)C=CC=C2)Cl Z1269130316 [0,0,0,1,0,1|2,0,0]=4 861 B12R2.18 NC1CC2=C(C1=O)C=CC=C2 Z1551475987 [0,0,0,1,0,1|1,0,1]=4 862 B12R2.18 NN1CC2=C(C1=O)C=CC=C2 Z1953500024 [0,0,0,1,0,1|2,0,0]=4 863 B12R2.18 O=C1C2=C(C=CC=C2)CC1Cl Z854067258 [0,0,0,1,0,1|1,0,1]=4 864 B12R2.18 O=C1NC2=C(C1=O)C=CC=C2 Z57127903 [0,0,0,1,0,1|1,0,0]=3 865 B12R2.18 O=C1SC2=C(C1=O)C=CC=C2 Z1198153623 [0,0,0,1,0,1|1,0,0]=3 866 B12R2.24 BrC1=CC2=C(C=CC=C2)C=C1 Z166622678 [0,0,0,1,0,1|2,0,0]=4 867 B12R2.24 BrC1=CC2=C(C=CC=C2)N=C1 Z337707764 [0,0,0,1,0,1|2,0,0]=4 868 B12R2.24 BrC1=NC2=C(C=CC=C2)N=C1 Z979455958 [0,0,0,1,0,1|2,0,0]=4 869 B12R2.24 CC1=CC2=C(C=CC=C2)C=C1 Z104476894 [0,0,0,1,0,1|1,0,1]=4 870 B12R2.24 CC1=CC2=C(C=CC=C2)N=C1 Z1217215047 [0,0,0,1,0,1|1,0,1]=4 871 B12R2.24 CC1=NC2=C(C=CC=C2)C=C1 Z56926563 [0,0,0,1,0,1|1,0,1]=4 872 B12R2.24 CC1=NC2=C(C=CC=C2)N=C1 Z1255423472 [0,0,0,1,0,1|1,0,1]=4 873 B12R2.24 ClC1=CC2=C(C=CC=C2)C=C1 Z1255485910 [0,0,0,1,0,1|2,0,0]=4 874 B12R2.24 ClC1=NC2=C(C=CC=C2)N=C1 Z240126804 [0,0,0,1,0,1|2,0,0]=4 875 B12R2.24 FC1=NC2=C(C=CC=C2)N=C1 Z1255428916 [0,0,0,1,0,1|2,0,0]=4 876 B12R2.24 IC1=CC2=C(C=CC=C2)N=C1 Z1172379319 [0,0,0,1,0,1|2,0,0]=4 877 B12R2.24 NC1=CC2=C(C=CC=C2)C=C1 Z104494980 [0,0,0,1,0,1|2,0,0]=4 878 B12R2.24 NC1=CC2=C(C=CC=C2)N=C1 Z234895085 [0,0,0,1,0,1|2,0,0]=4 879 B12R2.24 NC1=NC2=C(C=CC=C2)C=C1 Z56347237 [0,0,0,1,0,1|2,0,0]=4 880 B12R2.24 NC1=NC2=C(C=CC=C2)N=C1 Z979455432 [0,0,0,1,0,1|2,0,0]=4 881 B12R2.24 O=C1C=CC2=C(N1)C=CC=C2 Z57473020 [0,0,0,1,0,1|2,0,0]=4 882 B12R2.24 O=C1C=CC2=C(O1)C=CC=C2 Z57169486 [0,0,0,1,0,1|2,0,0]=4 883 B12R2.24 O=C1C=NC2=C(N1)C=CC=C2 Z56824051 [0,0,0,1,0,1|2,0,0]=4 884 B12R2.24 OC1=CC2=C(C=CC=C2)C=C1 Z57127515 [0,0,0,1,0,1|2,0,0]=4 885 B12R2.24 OC1=CC2=C(C=CC=C2)N=C1 Z1255419538 [0,0,0,1,0,1|2,0,0]=4 886 B12R2.24 SC1=NC2=C(C=CC=C2)C=C1 Z203045038 [0,0,0,1,0,1|2,0,0]=4 887 B12R2.24 SC1=NC2=C(C=CC=C2)N=C1 Z119989150 [0,0,0,1,0,1|2,0,0]=4 888 B12R2.27 O=C[C@@H]1C[C@H]1C2=CC=CC=C2 Z2298064271 [0,0,0,1,0,1|0,0,2]=4 889 B12R2.32 N#CC1=CC2=C(N1)C=CC=C2 Z1255419551 [0,0,0,1,0,1|1,0,1]=4 890 B12R2.32 N#CC1=CC2=C(O1)C=CC=C2 Z381355152 [0,0,0,1,0,1|1,0,1]=4 891 B12R2.32 NCC1=CC2=C(N1)C=CC=C2 Z2106601624 [0,0,0,1,0,1|1,0,1]=4 892 B12R2.32 NCC1=CC2=C(S1)C=CC=C2 Z57206121 [0,0,0,1,0,1|1,0,1]=4 893 B12R2.32 O=CC1=CC2=C(N1)C=CC=C2 Z1203160203 [0,0,0,1,0,1|0,0,0]=2 894 B12R2.32 O=CC1=CC2=C(N1)C=CC=N2 Z1198177421 [0,0,0,1,0,1|1,0,0]=3 895 B12R2.32 O=CC1=CC2=C(N1)C=CN=C2 Z3305262316 [0,0,0,1,0,1|1,0,0]=3 896 B12R2.32 O=CC1=CC2=C(N1)N=CC=C2 Z1198177420 [0,0,0,1,0,1|1,0,0]=3 897 B12R2.32 O=CC1=CC2=C(O1)C=CC=C2 Z147641868 [0,0,0,1,0,1|0,0,0]=2 898 B12R2.32 O=CC1=CC2=C(O1)C=CC=N2 Z1198330026 [0,0,0,1,0,1|1,0,0]=3 899 B12R2.32 O=CC1=CC2=C(O1)C=CN=C2 Z1255417643 [0,0,0,1,0,1|1,0,0]=3 900 B12R2.32 O=CC1=CC2=C(O1)N=CC=C2 Z1255505540 [0,0,0,1,0,1|1,0,0]=3 901 B12R2.32 O=CC1=CC2=C(S1)C=CC=C2 Z1741961424 [0,0,0,1,0,1|0,0,0]=2 902 B12R2.32 O=CC1=CC2=C(S1)C=CC=N2 Z1216823029 [0,0,0,1,0,1|1,0,0]=3 903 B12R2.32 O=CC1=CC2=C(S1)C=NC=C2 Z1198309374 [0,0,0,1,0,1|1,0,0]=3 904 B12R2.32 O=CC1=CC2=C(S1)N=CC=C2 Z1160905957 [0,0,0,1,0,1|1,0,0]=3 905 B12R2.32 O=CC1=CN2C=CC=CC2=N1 Z622445034 [0,0,0,1,0,1|1,0,0]=3 906 B12R2.32 O=CC1=CN2C=CC=NC2=N1 Z1190323952 [0,0,0,1,0,1|2,0,0]=4 907 B12R2.32 O=CC1=NC2=C(N1)C=CC=C2 Z57114985 [0,0,0,1,0,1|1,0,0]=3 908 B12R2.32 O=CC1=NC2=C(O1)C=CC=C2 Z1198162173 [0,0,0,1,0,1|1,0,0]=3 909 B12R2.32 O=CC1=NC2=C(S1)C=CC=C2 Z276151160 [0,0,0,1,0,1|1,0,0]=3 910 B12R2.32 O=CC1=NC2=C(S1)C=CN=C2 Z1352941603 [0,0,0,1,0,1|2,0,0]=4 911 B12R2.32 O=CC1=NC2=C(S1)N=CC=C2 Z1352941599 [0,0,0,1,0,1|2,0,0]=4 912 B12R2.32 O=CC1=NN2C=CC=CC2=C1 Z1171753365 [0,0,0,1,0,1|1,0,0]=3 913 B12R2.32 O=CC1CC2=C(C1)C=CC=C2 Z1255436588 [0,0,0,1,0,1|0,0,2]=4 914 B12R2.32 O=CN1CC2=C(C1)C=CC=C2 Z1216818057 [0,0,0,1,0,1|1,0,1]=4 915 B12R2.32 OCC1=CC2=C(O1)C=CC=C2 Z164677912 [0,0,0,1,0,1|0,0,2]=4 916 B12R2.32 OCC1=CC2=C(S1)C=CC=C2 Z816841922 [0,0,0,1,0,1|0,0,2]=4 917 B12R2.48 O=CC1(CC1)C2=CC=CC=C2 Z1079097808 [0,1,0,1,0,0|0,0,2]=4 918 B12R2.1 C=CN1C=NC2=C1C=CC=C2 Z87001578 [0,1,0,1,0,0|2,0,0]=4 919 B12R2.1 CCC1=CNC2=C1C=CC=C2 Z1198159100 [0,1,0,1,0,0|1,0,1]=4 920 B12R2.1 CSC1=CNC2=C1C=CC=C2 Z1262562193 [0,1,0,1,0,0|1,0,1]=4 921 B12R2.1 N#CC1=CNC2=C1C=CC=C2 Z57204989 [0,1,0,1,0,0|1,0,1]=4 922 B12R2.1 N#CC1=COC2=C1C=CC=C2 Z1188275503 [0,1,0,1,0,0|0,0,2]=4 923 B12R2.1 NCC1=CSC2=C1C=CC=C2 Z425459986 [0,1,0,1,0,0|0,1,1]=4 924 B12R2.1 O=CC1=C2C=CC=CC2=NS1 Z1504687602 [0,1,0,1,0,0|1,0,0]=3 925 B12R2.1 O=CC1=C2C=CC=CN2N=C1 Z1123806715 [0,1,0,1,0,0|1,0,0]=3 926 B12R2.1 O=CC1=C2C=CC=CN2N=N1 Z1416158255 [0,1,0,1,0,0|2,0,0]=4 927 B12R2.1 O=CC1=C2C=CC=NN2N=C1 Z1216857648 [0,1,0,1,0,0|2,0,0]=4 928 B12R2.1 O=CC1=C2N=CC=CN2N=C1 Z1079441388 [0,1,0,1,0,0|2,0,0]=4 929 B12R2.1 O=CC1=CN=C2N1C=CC=C2 Z727564760 [0,1,0,1,0,0|1,0,0]=3 930 B12R2.1 O=CC1=CN=C2N1C=CC=N2 Z1079126304 [0,1,0,1,0,0|2,0,0]=4 931 B12R2.1 O=CC1=CN=C2N1C=CN=C2 Z1198182560 [0,1,0,1,0,0|2,0,0]=4 932 B12R2.1 O=CC1=CNC2=C1C=CC=C2 Z56785575 [0,1,0,1,0,0|0,0,0]=2 933 B12R2.1 O=CC1=CNC2=C1C=CC=N2 Z57337365 [0,1,0,1,0,0|1,0,0]=3 934 B12R2.1 O=CC1=CNC2=C1C=CN=C2 Z1198176790 [0,1,0,1,0,0|1,0,0]=3 935 B12R2.1 O=CC1=CNC2=C1C=NC=C2 Z1079456084 [0,1,0,1,0,0|1,0,0]=3 936 B12R2.1 O=CC1=CNC2=C1C=NC=N2 Z1255425239 [0,1,0,1,0,0|2,0,0]=4 937 B12R2.1 O=CC1=CNC2=C1N=CC=C2 Z1203747933 [0,1,0,1,0,0|1,0,0]=3 938 B12R2.1 O=CC1=CNC2=C1N=CC=N2 Z1198277987 [0,1,0,1,0,0|2,0,0]=4 939 B12R2.1 O=CC1=COC2=C1C=CC=C2 Z1197879644 [0,1,0,1,0,0|0,0,0]=2 940 B12R2.1 O=CC1=CSC2=C1C=CC=C2 Z199535912 [0,1,0,1,0,0|0,0,0]=2 941 B12R2.1 O=CC1=NC=C2N1C=CC=C2 Z1162448252 [0,1,0,1,0,0|1,0,0]=3 942 B12R2.1 O=CC1=NNC2=C1C=CC=C2 Z1065726010 [0,1,0,1,0,0|1,0,0]=3 943 B12R2.1 O=CC1CCC2=C1C=CC=C2 Z1070003774 [0,1,0,1,0,0|0,0,2]=4 944 B12R2.1 OCC1=CNC2=C1C=CC=C2 Z85923165 [0,1,0,1,0,0|0,0,2]=4 945 B12R2.1 OCC1=CSC2=C1C=CC=C2 Z385370244 [0,1,0,1,0,0|0,0,2]=4 946 B12R2.2 C1=CC(=CC=N1)C2=CN=CO2 Z1201618990 [0,1,0,1,0,0|2,0,0]=4 947 B12R2.2 C1=CC(=CC=N1)C2=CNC=N2 Z1126749700 [0,1,0,1,0,0|2,0,0]=4 948 B12R2.2 C1=CC(=CC=N1)C2=CSC=N2 Z1255497812 [0,1,0,1,0,0|1,1,0]=4 949 B12R2.2 C1=CC(=CN=C1)C2=CNC=N2 Z2574925769 [0,1,0,1,0,0|2,0,0]=4 950 B12R2.2 C1=CC(=CN=C1)C2=CNN=C2 Z2867273019 [0,1,0,1,0,0|2,0,0]=4 951 B12R2.2 C1=CC(=CN=C1)C2=CSC=C2 Z1198170949 [0,1,0,1,0,0|1,1,0]=4 952 B12R2.2 C1=CC=C(C=C1)C2=CC=CN2 Z1198155817 [0,1,0,1,0,0|1,0,0]=3 953 B12R2.2 C1=CC=C(C=C1)C2=CC=CS2 Z57040506 [0,1,0,1,0,0|1,0,0]=3 954 B12R2.2 C1=CC=C(C=C1)C2=CC=NN2 Z1224534135 [0,1,0,1,0,0|2,0,0]=4 955 B12R2.2 C1=CC=C(C=C1)C2=CCNC2 Z1574940564 [0,1,0,1,0,0|1,0,1]=4 956 B12R2.2 C1=CC=C(C=C1)C2=CN=CO2 Z1201618668 [0,1,0,1,0,0|1,0,0]=3 957 B12R2.2 C1=CC=C(C=C1)C2=CN=NN2 Z2798585249 [0,1,0,1,0,0|2,0,0]=4 958 B12R2.2 C1=CC=C(C=C1)C2=CN=NS2 Z1198147414 [0,1,0,1,0,0|2,0,0]=4 959 B12R2.2 C1=CC=C(C=C1)C2=CNN=C2 Z56940955 [0,1,0,1,0,0|1,0,0]=3 960 B12R2.2 C1=CC=C(C=C1)C2=NC=CN2 Z104492164 [0,1,0,1,0,0|2,0,0]=4 961 B12R2.2 C1=CC=C(C=C1)C2=NC=CS2 Z1198153051 [0,1,0,1,0,0|2,0,0]=4 962 B12R2.2 C1=CC=C(C=C1)C2=NN=CO2 Z55670800 [0,1,0,1,0,0|2,0,0]=4 963 B12R2.2 C1=CC=C(C=C1)C2=NNC=N2 Z804949032 [0,1,0,1,0,0|2,0,0]=4 964 B12R2.2 C1=CC=C(C=C1)N2C=CC=C2 Z55669104 [0,1,0,1,0,0|2,0,0]=4 965 B12R2.2 C1=CC=C(C=C1)N2C=CC=N2 Z188745060 [0,1,0,1,0,0|2,0,0]=4 966 B12R2.2 C1=CC=C(C=C1)N2C=CN=C2 Z440825046 [0,1,0,1,0,0|2,0,0]=4 967 B12R2.2 C1=CC=C(C=C1)N2C=NC=N2 Z1198156169 [0,1,0,1,0,0|2,0,0]=4 968 B12R2.2 C1=CN=C(C=C1)C2=CNC=C2 Z575764746 [0,1,0,1,0,0|2,0,0]=4 969 B12R2.2 C1=CN=C(C=C1)C2=CNC=N2 Z1198180370 [0,1,0,1,0,0|2,0,0]=4 970 B12R2.2 C1=CN=C(C=C1)C2=CNN=C2 Z5388738634 [0,1,0,1,0,0|2,0,0]=4 971 B12R2.22 O=C1CC(C1)C2=CC=CC=C2 Z336080338 [0,1,0,1,0,0|0,0,2]=4 972 B12R2.22 O=C1CC(N1)C2=CC=CC=C2 Z367677412 [0,1,0,1,0,0|0,0,2]=4 973 B12R2.1081 BrC1=C2C=CC=CC2=CN=C1 Z57474193 [0,1,0,1,0,0|2,0,0]=4 974 B12R2.1081 BrC1=C2C=CC=CC2=NC=N1 Z600501698 [0,1,0,1,0,0|2,0,0]=4 975 B12R2.1081 CC1=C2C=CC=CC2=CC=C1 Z104475342 [0,1,0,1,0,0|1,0,1]=4 976 B12R2.1081 CC1=C2C=CC=CC2=CC=N1 Z1255415440 [0,1,0,1,0,0|1,0,1]=4 977 B12R2.1081 CC1=C2C=CC=CC2=NC=C1 Z104472668 [0,1,0,1,0,0|1,0,1]=4 978 B12R2.1081 ClC1=C2C=CC=CC2=CC=C1 Z104504716 [0,1,0,1,0,0|2,0,0]=4 979 B12R2.1081 ClC1=C2C=CC=CC2=NC=C1 Z431511604 [0,1,0,1,0,0|2,0,0]=4 980 B12R2.1081 ClC1=C2C=CC=CC2=NC=N1 Z119990038 [0,1,0,1,0,0|2,0,0]=4 981 B12R2.1081 FC1=C2C=CC=CC2=CC=C1 Z1162445957 [0,1,0,1,0,0|2,0,0]=4 982 B12R2.1081 NC1=C2C=CC=CC2=CC=C1 Z57127984 [0,1,0,1,0,0|2,0,0]=4 983 B12R2.1081 NC1=C2C=CC=CC2=CC=N1 Z1203162487 [0,1,0,1,0,0|2,0,0]=4 984 B12R2.1081 NC1=C2C=CC=CC2=CN=C1 Z1524694515 [0,1,0,1,0,0|2,0,0]=4 985 B12R2.1081 NC1=C2C=CC=CC2=NC=C1 Z381037214 [0,1,0,1,0,0|2,0,0]=4 986 B12R2.1081 NC1=C2C=CC=CC2=NC=N1 Z99599970 [0,1,0,1,0,0|2,0,0]=4 987 B12R2.1081 O=C1C=COC2=C1C=CC=C2 Z1218937140 [0,1,0,1,0,0|1,0,1]=4 988 B12R2.1081 O=C1NC=CC2=C1C=CC=C2 Z56960237 [0,1,0,1,0,0|2,0,0]=4 989 B12R2.1081 O=C1NC=NC2=C1C=CC=C2 Z56862715 [0,1,0,1,0,0|2,0,0]=4 990 B12R2.1081 O=C1OC=CC2=C1C=CC=C2 Z1198175817 [0,1,0,1,0,0|2,0,0]=4 991 B12R2.1081 OC1=C2C=CC=CC2=CC=C1 Z104474036 [0,1,0,1,0,0|2,0,0]=4 992 B12R2.1081 OC1=C2C=CC=CC2=CN=C1 Z1198152661 [0,1,0,1,0,0|2,0,0]=4 993 B12R2.1081 OC1=C2C=CC=CC2=NC=C1 Z818727120 [0,1,0,1,0,0|2,0,0]=4 994 B12R2.1081 OC1=C2C=CC=CC2=NN=C1 Z104495104 [0,1,0,1,0,0|2,0,0]=4 995 B12R2.1081 S=C1C=CNC2=C1C=CC=C2 Z1258992692 [0,1,0,1,0,0|2,0,0]=4 996 B12R2.1081 S=C1C=NNC2=C1C=CC=C2 Z126932680 [0,1,0,1,0,0|2,0,0]=4 997 B12R2.1081 SC1=C2C=CC=CC2=NC=N1 Z203045188 [0,1,0,1,0,0|2,0,0]=4 998 B12R2.2028 CC1CC(=O)C2=C1C=CC=C2 Z335243948 [0,1,0,1,0,0|0,0,2]=4 999 B12R2.2028 CN1C=C(C2=C1C=CC=C2)N Z2787455551 [0,1,0,1,0,0|2,0,0]=4 1000 B12R2.2028 CN1NC(=O)C2=C1C=CC=C2 Z1255452290 [0,1,0,1,0,0|1,0,1]=4 1001 B12R2.2028 NC1=NC(=O)C2=C1C=CC=C2 Z316121514 [0,1,0,1,0,0|1,0,0]=3 1002 B12R2.2028 O=C1CC(=O)C2=C1C=CC=C2 Z57131040 [0,1,0,1,0,0|1,0,0]=3 1003 B12R2.2028 O=C1NC(=O)C2=C1C=CC=C2 Z57127356 [0,1,0,1,0,0|1,0,0]=3 1004 B12R2.2028 O=C1NC(=O)C2=C1C=CC=N2 Z275364976 [0,1,0,1,0,0|2,0,0]=4 1005 B12R2.2028 O=C1NC(=O)C2=C1C=CN=C2 Z1123701770 [0,1,0,1,0,0|2,0,0]=4 1006 B12R2.2028 O=C1OC(=O)C2=C1C=CC=N2 Z235344909 [0,1,0,1,0,0|2,0,0]=4 1007 B12R2.2028 O=C1OC(C2=C1C=CC=C2)O Z104507040 [0,1,0,1,0,0|1,0,1]=4 1008 B12R2.612 CC1=CC2=C(C=C1)C(=CN2)C Z1203732482 [0,1,0,1,0,0|1,0,1]=4 1009 B12R2.612 CC1=CNC2=C1C=CC(=C2)Cl Z1255439930 [0,1,0,1,0,0|1,0,1]=4 1010 B12R2.612 CC1=CNC2=C1C=CC(=C2)O Z1203731448 [0,1,0,1,0,0|1,0,1]=4 1011 B12R2.612 ClC1=CC2=C(C=C1)C(=CN2)I Z1269185626 [0,1,0,1,0,0|2,0,0]=4 1012 B12R2.612 NC1=CC2=C(C=C1)C(=CS2)Cl Z4135016645 [0,1,0,1,0,0|1,1,0]=4 1013 B12R2.612 OC1=CSC2=C1C=CC(=C2)Br Z3300768645 [0,1,0,1,0,0|1,1,0]=4 1014 B12R2.132 CC1=COC2=C1C=C(C=C2)Br Z1269218033 [0,1,0,1,0,0|0,0,2]=4 1015 B12R2.132 CC1=COC2=C1C=C(C=C2)Cl Z1198170631 [0,1,0,1,0,0|0,0,2]=4 1016 B12R2.132 CC1=COC2=C1C=C(C=C2)F Z1255384789 [0,1,0,1,0,0|0,0,2]=4 1017 B12R2.132 CC1=COC2=C1C=C(C=C2)N Z1203586519 [0,1,0,1,0,0|0,0,2]=4 1018 B12R2.132 CC1=CSC2=C1C=C(C=C2)Br Z1269161739 [0,1,0,1,0,0|0,1,1]=4 1019 B12R2.132 CC1=CSC2=C1C=C(C=C2)Cl Z1201618278 [0,1,0,1,0,0|0,1,1]=4 1020 B12R2.132 ClC1=CC2=C(C=C1)SC=C2Br Z1269194561 [0,1,0,1,0,0|1,1,0]=4 1021 B12R2.132 FC1=CC2=C(C=C1)OC=C2Br Z1551949935 [0,1,0,1,0,0|1,0,1]=4 1022 B12R2.132 NC1=CNC2=C1C=C(C=C2)Cl Z3397208193 [0,1,0,1,0,0|2,0,0]=4 1023 B12R2.132 NC1=CNC2=C1C=C(C=C2)F Z4946628390 [0,1,0,1,0,0|2,0,0]=4 1024 B12R2.132 OC1=CC2=C(C=C1)OC=C2O Z1216838816 [0,1,0,1,0,0|1,0,1]=4 1025 B12R2.132 OC1=CC2=C(C=C1)SC=C2Br Z1269146168 [0,1,0,1,0,0|1,1,0]=4 1026 B12R2.196 CC1=CSC2=C1C=CC=C2Br Z1269175775 [0,1,0,1,0,0|0,1,1]=4 1027 B12R2.196 CC1=CSC2=C1C=CC=C2N Z4952832526 [0,1,0,1,0,0|0,1,1]=4 1028 B12R2.196 ClC1=C2NC=C(C2=CC=C1)Br Z1269127355 [0,1,0,1,0,0|2,0,0]=4 1029 B12R2.196 FC1=C2SC=C(C2=CC=C1)Br Z3244825551 [0,1,0,1,0,0|1,1,0]=4 1030 B12R2.203 BrC1=CC=CC2=C1C(=CS2)Br Z3300762315 [0,1,0,1,0,0|1,1,0]=4 1031 B12R2.203 CC1=CSC2=C1C(=CC=C2)Br Z1862000479 [0,1,0,1,0,0|0,1,1]=4 1032 B12R2.203 FC1=C2C(=CNC2=CC=C1)Br Z1544675659 [0,1,0,1,0,0|2,0,0]=4 1033 B12R2.203 OC1=C2C(=CSC2=CC=C1)Br Z1862026502 [0,1,0,1,0,0|1,1,0]=4 1034 B8R1.7 CC(=O)C1=CC=CN1 Z56899162 [1,0,0,0,1,0|1,0,1]=4 1035 B8R1.7 CC(=O)C1=CC=CS1 Z57127896 [1,0,0,0,1,0|1,0,1]=4 1036 B8R1.7 CC(=O)C1=CNC=C1 Z1154253452 [1,0,0,0,1,0|1,0,1]=4 1037 B8R1.7 CC(=O)C1=COC=C1 Z1137167495 [1,0,0,0,1,0|1,0,1]=4 1038 B8R1.7 CC(=O)C1=CSC=C1 Z513734012 [1,0,0,0,1,0|1,0,1]=4 1039 B8R1.7 NC(=O)C1=CC=CN1 Z135897752 [1,0,0,0,1,0|2,0,0]=4 1040 B8R1.7 NC(=O)C1=CC=CO1 Z33546471 [1,0,0,0,1,0|2,0,0]=4 1041 B8R1.7 NC(=O)C1=CC=CS1 Z33546758 [1,0,0,0,1,0|2,0,0]=4 1042 B8R1.7 NC(=O)C1=CNC=C1 Z1167406084 [1,0,0,0,1,0|2,0,0]=4 1043 B8R1.7 NC(=O)C1=COC=C1 Z168362720 [1,0,0,0,1,0|2,0,0]=4 1044 B8R1.7 NC(=O)C1=CSC=C1 Z82670330 [1,0,0,0,1,0|2,0,0]=4 1045 B8R1.7 O=C(Cl)C1=CC=CS1 Z168827498 [1,0,0,0,1,0|2,0,0]=4 1046 B8R1.7 O=C(O)C1=CC=CN1 Z94599900 [1,0,0,0,1,0|2,0,0]=4 1047 B8R1.7 O=C(O)C1=CC=CO1 Z104473462 [1,0,0,0,1,0|2,0,0]=4 1048 B8R1.7 O=C(O)C1=CNC=C1 Z1154253207 [1,0,0,0,1,0|2,0,0]=4 1049 B8R1.7 O=C(O)C1=COC=C1 Z164706016 [1,0,0,0,1,0|2,0,0]=4 1050 B8R1.7 O=C(O)C1=CSC=C1 Z147647094 [1,0,0,0,1,0|2,0,0]=4 1051 B8R1.8 O=CCC1=CC=CO1 Z1179944709 [1,0,0,0,1,0|1,0,1]=4 1052 B8R1.8 O=CCC1=CC=CS1 Z993017816 [1,0,0,0,1,0|1,0,1]=4 1053 B8R1.8 O=CCC1=CSC=C1 Z1079442684 [1,0,0,0,1,0|1,0,1]=4 1054 B12R1.27 C=C(C=O)OCC1=CC=CC=C1 Z1198183530 [0,0,0,0,0,2|0,0,0]=2 1055 B12R1.27 C=CC(=O)NCC1=CC=CC=C1 Z56757233 [0,0,0,0,0,2|2,0,0]=4 1056 B12R1.27 CC(C=O)CCC1=CC=CC=C1 Z1238838034 [0,0,0,0,0,2|0,0,2]=4