0 B11R1.23 C#CC(N)C1=CC(=CC=C1)Br Z4120296552 [0,0,0,0,0,0|3,0,1]=4 1 B11R1.23 CC(C#N)C1=CC(=CC=C1)F Z415654674 [0,0,0,0,0,0|2,0,2]=4 2 B11R1.23 CC(C=O)C1=CC(=CC=C1)Br Z1269224544 [0,0,0,0,0,0|3,0,1]=4 3 B11R1.23 CC(C=O)C1=CC(=CC=C1)Cl Z1222424632 [0,0,0,0,0,0|3,0,1]=4 4 B11R1.23 CC(C=O)C1=CC(=CC=C1)F Z1222424642 [0,0,0,0,0,0|3,0,1]=4 5 B11R1.23 CC(CN)C1=CC(=CC=C1)Br Z5094147873 [0,0,0,0,0,0|2,0,0]=2 6 B11R1.23 CC(CN)C1=CC(=CC=C1)F Z415654914 [0,0,0,0,0,0|2,0,0]=2 7 B11R1.23 CC(CN)C1=CC=CC(=O)N1 Z4656721256 [0,0,0,0,0,0|2,0,1]=3 8 B11R1.23 CC(CO)C1=CC(=CC=C1)Br Z1269177166 [0,0,0,0,0,0|3,0,0]=3 9 B11R1.23 CC(CO)C1=CC(=CC=C1)Cl Z1222424631 [0,0,0,0,0,0|3,0,0]=3 10 B11R1.23 CC1=CC(=CC=C1)C(=O)CN Z3026469451 [0,0,0,0,0,0|1,0,2]=3 11 B11R1.23 CC1=CC(=CC=C1)C(O)CN Z336086464 [0,0,0,0,0,0|1,0,0]=1 12 B11R1.23 CC1=CC=CC(=C1)C(C)C=O Z1222424653 [0,0,0,0,0,0|3,0,1]=4 13 B11R1.23 CCC(=O)C1=CC(=CC=C1)Br Z104486266 [0,0,0,0,0,0|2,0,2]=4 14 B11R1.23 CCC(=O)C1=CC(=CC=C1)Cl Z104477758 [0,0,0,0,0,0|2,0,2]=4 15 B11R1.23 CCC(=O)C1=CC(=CC=C1)N Z1203578334 [0,0,0,0,0,0|2,0,2]=4 16 B11R1.23 CCC(N)C1=CC(=CC=C1)Cl Z239627026 [0,0,0,0,0,0|3,0,0]=3 17 B11R1.23 CCC(N)C1=CC(=CC=C1)O Z4164634595 [0,0,0,0,0,0|2,0,0]=2 18 B11R1.23 CCC(N)C1=NC(=CC=C1)C Z4457910024 [0,0,0,0,0,0|4,0,0]=4 19 B11R1.23 CCC(O)C1=CC(=CC=C1)Br Z228586280 [0,0,0,0,0,0|2,0,0]=2 20 B11R1.23 CCC(O)C1=CC(=CC=C1)Cl Z335245132 [0,0,0,0,0,0|2,0,0]=2 21 B11R1.23 CCC(O)C1=CC(=CC=C1)N Z1262626036 [0,0,0,0,0,0|2,0,0]=2 22 B11R1.23 CNC(=O)C1=CC(=CC=C1)O Z32016364 [0,0,0,0,0,0|2,0,2]=4 23 B11R1.23 CNC(C)C1=CC(=CC=C1)Cl Z159528162 [0,0,0,0,0,0|4,0,0]=4 24 B11R1.23 CNC(C)C1=CC(=CC=C1)O Z1266854844 [0,0,0,0,0,0|3,0,0]=3 25 B11R1.23 COC(C)C1=CC(=CC=C1)N Z801781454 [0,0,0,0,0,0|4,0,0]=4 26 B11R1.23 CSC(C)C1=CC(=CC=C1)N Z801781922 [0,0,0,0,0,0|4,0,0]=4 27 B11R1.23 N#CC(N)C1=CC(=CC=C1)Cl Z398556966 [0,0,0,0,0,0|2,0,2]=4 28 B11R1.23 N/C(=N\O)/C1=CC(=CC=C1)O Z359513480 [0,0,0,0,0,0|3,0,1]=4 29 B11R1.23 NC(CF)C1=CC(=CC=C1)Br Z3210128314 [0,0,0,0,0,0|3,0,0]=3 30 B11R1.23 NC(CF)C1=CC(=CC=C1)Cl Z3445798142 [0,0,0,0,0,0|3,0,0]=3 31 B11R1.23 NC(CF)C1=CC(=CC=C1)F Z3681214901 [0,0,0,0,0,0|3,0,0]=3 32 B11R1.23 NC(CO)C1=CC(=CC=C1)Br Z1438483917 [0,0,0,0,0,0|3,0,0]=3 33 B11R1.23 NC(CO)C1=CC(=CC=C1)Cl Z1695784092 [0,0,0,0,0,0|3,0,0]=3 34 B11R1.23 NC(CO)C1=CC(=CC=C1)F Z1268152384 [0,0,0,0,0,0|3,0,0]=3 35 B11R1.23 NC(CO)C1=CC(=CC=C1)I Z3605387233 [0,0,0,0,0,0|3,0,0]=3 36 B11R1.23 NC(CO)C1=CC(=CC=C1)O Z3247611804 [0,0,0,0,0,0|2,0,0]=2 37 B11R1.23 NC1=CC(=CC=C1)C(O)CO Z970072128 [0,0,0,0,0,0|2,0,0]=2 38 B11R1.23 NCC(=O)C1=CC(=CC=C1)Br Z275368900 [0,0,0,0,0,0|1,0,2]=3 39 B11R1.23 NCC(=O)C1=CC(=CC=C1)Cl Z1741966377 [0,0,0,0,0,0|1,0,2]=3 40 B11R1.23 NCC(=O)C1=CC(=CC=C1)F Z3025863838 [0,0,0,0,0,0|1,0,2]=3 41 B11R1.23 NCC(=O)C1=CC(=CN=C1)Br Z2696739932 [0,0,0,0,0,0|2,0,2]=4 42 B11R1.23 NCC(O)C1=CC(=CC=C1)Cl Z330910384 [0,0,0,0,0,0|1,0,0]=1 43 B11R1.23 NCC(O)C1=CC(=CC=C1)O Z3041501762 [0,0,0,0,0,0|0,0,0]=0 44 B11R1.23 NNC(=O)C1=CC(=CC=C1)Cl Z56899158 [0,0,0,0,0,0|2,0,2]=4 45 B11R1.23 NNC(=O)C1=CC(=CC=C1)N Z56922179 [0,0,0,0,0,0|2,0,2]=4 46 B11R1.23 NNC(=O)C1=CC(=CC=C1)O Z56930730 [0,0,0,0,0,0|1,0,2]=3 47 B11R1.23 O=C(CBr)C1=CC=CC(=C1)Cl Z104482040 [0,0,0,0,0,0|2,0,2]=4 48 B11R1.23 O=C(CBr)C1=CC=CC(=C1)F Z111411220 [0,0,0,0,0,0|2,0,2]=4 49 B11R1.23 O=C(NO)C1=CC(=CC=C1)O Z317038072 [0,0,0,0,0,0|2,0,2]=4 50 B11R1.23 O=CC(=O)C1=CC=CC(=C1)O Z1255357387 [0,0,0,0,0,0|1,0,3]=4 51 B10R1.10 CC1=CC(=CC=C1)CC#N Z285131450 [1,0,0,0,0,0|1,0,2]=4 52 B10R1.10 CC1=CC(=CC=C1)CCN Z241056516 [1,0,0,0,0,0|1,0,0]=2 53 B10R1.10 CC1=NC(=CC=C1)CCN Z1098234194 [1,0,0,0,0,0|2,0,0]=3 54 B10R1.10 CCCC1=CC(=CC=C1)Br Z1541586975 [1,0,0,0,0,0|2,0,0]=3 55 B10R1.10 CCNC1=CC(=CC=C1)Br Z1217910559 [1,0,0,0,0,0|3,0,0]=4 56 B10R1.10 CCNC1=CC(=CC=C1)C Z56785946 [1,0,0,0,0,0|3,0,0]=4 57 B10R1.10 CCNC1=CC(=CC=C1)Cl Z286371690 [1,0,0,0,0,0|3,0,0]=4 58 B10R1.10 CCOC1=CC(=CC=C1)Br Z53833934 [1,0,0,0,0,0|3,0,0]=4 59 B10R1.10 CCOC1=CC(=CC=C1)I Z54181578 [1,0,0,0,0,0|3,0,0]=4 60 B10R1.10 CCSC1=CC(=CC=C1)Br Z1090207966 [1,0,0,0,0,0|3,0,0]=4 61 B10R1.10 CCSC1=CC(=CC=C1)N Z600393424 [1,0,0,0,0,0|3,0,0]=4 62 B10R1.10 CNCC1=CC(=CC=C1)C Z102766992 [1,0,0,0,0,0|3,0,0]=4 63 B10R1.10 CNCC1=CC(=CC=C1)Cl Z56963343 [1,0,0,0,0,0|3,0,0]=4 64 B10R1.10 CNCC1=CC(=CC=C1)F Z56946085 [1,0,0,0,0,0|3,0,0]=4 65 B10R1.10 CNCC1=CC(=CC=C1)I Z3302798080 [1,0,0,0,0,0|3,0,0]=4 66 B10R1.10 CNCC1=CC(=CC=C1)O Z102766970 [1,0,0,0,0,0|2,0,0]=3 67 B10R1.10 COCC1=CC(=CC=C1)N Z285163816 [1,0,0,0,0,0|3,0,0]=4 68 B10R1.10 COCC1=CC(=CC=C1)O Z821093526 [1,0,0,0,0,0|2,0,0]=3 69 B10R1.10 CSCC1=CC(=CC=C1)Br Z17129082 [1,0,0,0,0,0|3,0,0]=4 70 B10R1.10 CSCC1=CC(=CC=C1)N Z732207152 [1,0,0,0,0,0|3,0,0]=4 71 B10R1.10 N#CCC1=CC=CC(=C1)Cl Z57039594 [1,0,0,0,0,0|1,0,2]=4 72 B10R1.10 N#CCC1=CC=CC(=C1)F Z104477994 [1,0,0,0,0,0|1,0,2]=4 73 B10R1.10 N#CCC1=CC=CC(=C1)N Z90120426 [1,0,0,0,0,0|1,0,2]=4 74 B10R1.10 N#CCC1=CC=CC(=C1)O Z1198161712 [1,0,0,0,0,0|0,0,2]=3 75 B10R1.10 NC1=CC(=CC=C1)CCO Z1198160776 [1,0,0,0,0,0|2,0,0]=3 76 B10R1.10 NC1=NC=CC(=C1)CCO Z1197888440 [1,0,0,0,0,0|3,0,0]=4 77 B10R1.10 NCCC1=CC(=CC=C1)Br Z285143760 [1,0,0,0,0,0|1,0,0]=2 78 B10R1.10 NCCC1=CC(=CC=C1)Cl Z57051063 [1,0,0,0,0,0|1,0,0]=2 79 B10R1.10 NCCC1=CC(=CC=C1)F Z96092963 [1,0,0,0,0,0|1,0,0]=2 80 B10R1.10 NCCC1=CC(=CC=C1)I Z4874662549 [1,0,0,0,0,0|1,0,0]=2 81 B10R1.10 NCCC1=CC(=CC=C1)O Z935140764 [1,0,0,0,0,0|0,0,0]=1 82 B10R1.10 NCCC1=CC(=CN=C1)O Z1504671788 [1,0,0,0,0,0|1,0,0]=2 83 B10R1.10 NCCC1=CC(=NC=C1)N Z2310698980 [1,0,0,0,0,0|2,0,0]=3 84 B10R1.10 NCCC1=NC(=NC=C1)N Z5619121124 [1,0,0,0,0,0|3,0,0]=4 85 B10R1.10 NCCC1=NC=NC(=C1)Br Z4513781102 [1,0,0,0,0,0|3,0,0]=4 86 B10R1.10 NCCC1=NC=NC(=C1)O Z2310716008 [1,0,0,0,0,0|2,0,0]=3 87 B10R1.10 NOCC1=CC(=CC=C1)Cl Z1198339567 [1,0,0,0,0,0|2,0,0]=3 88 B10R1.10 O=CCC1=CC=CC(=C1)Br Z1079442816 [1,0,0,0,0,0|2,0,1]=4 89 B10R1.10 O=CCC1=CC=CC(=C1)Cl Z993017836 [1,0,0,0,0,0|2,0,1]=4 90 B10R1.10 O=CNC1=CC=CC(=C1)O Z56886391 [1,0,0,0,0,0|2,0,1]=4 91 B10R1.10 OCCC1=CC(=CC=C1)Cl Z992289382 [1,0,0,0,0,0|2,0,0]=3 92 B10R1.10 OCCC1=CC(=CC=C1)F Z397587224 [1,0,0,0,0,0|2,0,0]=3 93 B10R1.15 C=C(CN)C1=CC=CC=C1 Z2065464323 [1,0,0,0,0,0|1,0,1]=3 94 B10R1.15 C=CC(O)C1=CC=CC=C1 Z1255438717 [1,0,0,0,0,0|1,0,1]=3 95 B10R1.15 CC(C=O)C1=CC=CC=C1 Z104495674 [1,0,0,0,0,0|2,0,1]=4 96 B10R1.15 CC(CBr)C1=CC=CC=C1 Z756118300 [1,0,0,0,0,0|2,0,0]=3 97 B10R1.15 CC(CN)C1=CC=NC=C1 Z415654978 [1,0,0,0,0,0|2,0,0]=3 98 B10R1.15 CCC(=O)C1=CC=CC=C1 Z104473068 [1,0,0,0,0,0|1,0,2]=4 99 B10R1.15 CCC(N)C1=CC=CC=C1 Z1262252904 [1,0,0,0,0,0|2,0,0]=3 100 B10R1.15 CCC(N)C1=CC=NC=C1 Z228583312 [1,0,0,0,0,0|3,0,0]=4 101 B10R1.15 CCC(O)C1=CC=CC=C1 Z335245178 [1,0,0,0,0,0|1,0,0]=2 102 B10R1.15 CCC(O)C1=CC=NC=C1 Z513749638 [1,0,0,0,0,0|2,0,0]=3 103 B10R1.15 CNC(C)C1=CC=CC=C1 Z85917524 [1,0,0,0,0,0|3,0,0]=4 104 B10R1.15 C[C@H](CN)C1=CC=CC=C1 Z1203578128 [1,0,0,0,0,0|1,0,0]=2 105 B10R1.15 N#CC(Br)C1=CC=CC=C1 Z1198157485 [1,0,0,0,0,0|1,0,2]=4 106 B10R1.15 NC(CO)C1=CC=CC=C1 Z381674942 [1,0,0,0,0,0|2,0,0]=3 107 B10R1.15 NC(CO)C1=CN=CC=C1 Z2350903961 [1,0,0,0,0,0|3,0,0]=4 108 B10R1.15 NCC(=O)C1=CC=CC=C1 Z600428568 [1,0,0,0,0,0|0,0,2]=3 109 B10R1.15 NCC(=O)C1=CC=NC=C1 Z2677521709 [1,0,0,0,0,0|1,0,2]=4 110 B10R1.15 NCC(N)C1=CC=CC=C1 Z425861034 [1,0,0,0,0,0|1,0,0]=2 111 B10R1.15 NCC(O)C1=CC=CC=C1 Z104476088 [1,0,0,0,0,0|0,0,0]=1 112 B10R1.15 NCC(O)C1=CN=CC=C1 Z336086578 [1,0,0,0,0,0|1,0,0]=2 113 B10R1.15 NCC(O)C1=NC=CC=C1 Z802671456 [1,0,0,0,0,0|1,0,0]=2 114 B10R1.15 NNC(=O)C1=CC=CC=C1 Z56926669 [1,0,0,0,0,0|1,0,2]=4 115 B10R1.15 N[C@@H](CO)C1=CC=CC=C1 Z1201618614 [1,0,0,0,0,0|2,0,0]=3 116 B10R1.15 N[C@H](CO)C1=CC=CC=C1 Z1101444224 [1,0,0,0,0,0|2,0,0]=3 117 B10R1.15 O=C(CCl)C1=CC=CC=C1 Z57834468 [1,0,0,0,0,0|1,0,2]=4 118 B10R1.15 O=C(CO)C1=CC=CC=C1 Z906206792 [1,0,0,0,0,0|1,0,2]=4 119 B10R1.15 OCC(O)C1=CC=NC=C1 Z2736474279 [1,0,0,0,0,0|2,0,0]=3 120 B10R1.15 OCC(O)C1=NC=CC=C1 Z4985119178 [1,0,0,0,0,0|2,0,0]=3 121 B10R1.113 C=C(C)C1=CC(=CC=C1)N Z1203585283 [1,0,0,0,0,0|2,0,1]=4 122 B10R1.113 CC(=O)C1=CC(=CC=C1)Br Z104472956 [1,0,0,0,0,0|1,0,2]=4 123 B10R1.113 CC(=O)C1=CC(=CC=C1)C Z104482920 [1,0,0,0,0,0|1,0,2]=4 124 B10R1.113 CC(=O)C1=CC(=CC=C1)Cl Z104477350 [1,0,0,0,0,0|1,0,2]=4 125 B10R1.113 CC(=O)C1=CC(=CC=C1)N Z57127443 [1,0,0,0,0,0|1,0,2]=4 126 B10R1.113 CC(C)C1=CC(=CC=C1)O Z104492878 [1,0,0,0,0,0|1,0,0]=2 127 B10R1.113 CC(C)C1=CC(=NC=C1)N Z1203581683 [1,0,0,0,0,0|3,0,0]=4 128 B10R1.113 CC(C)C1=NC(=CC=N1)O Z1259335793 [1,0,0,0,0,0|3,0,0]=4 129 B10R1.113 CC(C)C1=NC=CC(=C1)N Z4438672474 [1,0,0,0,0,0|3,0,0]=4 130 B10R1.113 CC(C)C1=NC=CC(=C1)O Z1255384308 [1,0,0,0,0,0|2,0,0]=3 131 B10R1.113 CC(C)C1=NC=NC(=C1)O Z798484912 [1,0,0,0,0,0|3,0,0]=4 132 B10R1.113 CC(N)C1=CC(=CC=C1)Br Z239626864 [1,0,0,0,0,0|2,0,0]=3 133 B10R1.113 CC(N)C1=CC(=CC=C1)Cl Z56347061 [1,0,0,0,0,0|2,0,0]=3 134 B10R1.113 CC(N)C1=CC(=CC=C1)F Z56347483 [1,0,0,0,0,0|2,0,0]=3 135 B10R1.113 CC(N)C1=CC(=CC=C1)O Z426041632 [1,0,0,0,0,0|1,0,0]=2 136 B10R1.113 CC(N)C1=NC=CC(=C1)Br Z4573023597 [1,0,0,0,0,0|3,0,0]=4 137 B10R1.113 CC(O)C1=CC(=CC=C1)Cl Z335244960 [1,0,0,0,0,0|1,0,0]=2 138 B10R1.113 CC(O)C1=CC(=CC=C1)F Z335245218 [1,0,0,0,0,0|1,0,0]=2 139 B10R1.113 CC(O)C1=CC(=CC=C1)O Z335245176 [1,0,0,0,0,0|0,0,0]=1 140 B10R1.113 CC(O)C1=CC(=CN=C1)F Z823275188 [1,0,0,0,0,0|2,0,0]=3 141 B10R1.113 CC1=CC(=CC=C1)B(O)O Z336079540 [1,0,0,0,0,0|3,0,0]=4 142 B10R1.113 CC1=CC(=CC=C1)C(=N)N Z2471262589 [1,0,0,0,0,0|2,0,1]=4 143 B10R1.113 CC1=CC(=CC=C1)C(=O)N Z33546925 [1,0,0,0,0,0|1,0,2]=4 144 B10R1.113 CC1=CC(=CC=C1)C(=O)O Z57913535 [1,0,0,0,0,0|2,0,1]=4 145 B10R1.113 CC1=CC(=CC=C1)C(=S)N Z90122768 [1,0,0,0,0,0|1,1,1]=4 146 B10R1.113 CC1=CC=CC(=C1)C(C)N Z2284390656 [1,0,0,0,0,0|2,0,0]=3 147 B10R1.113 CC1=CC=CC(=C1)C(C)O Z445987122 [1,0,0,0,0,0|1,0,0]=2 148 B10R1.113 CC1=CC=CC(=C1)[C@@H](C)N Z1626921284 [1,0,0,0,0,0|2,0,0]=3 149 B10R1.113 CC1=CC=CC(=C1)[C@@H](C)O Z1127664487 [1,0,0,0,0,0|1,0,0]=2 150 B10R1.113 CC1=CC=CC(=C1)[C@H](C)N Z1626921239 [1,0,0,0,0,0|2,0,0]=3 151 B10R1.113 CC1=CC=CC(=C1)[C@H](C)O Z1127664373 [1,0,0,0,0,0|1,0,0]=2 152 B10R1.113 CC1=CC=CC(=N1)[C@@H](C)N Z1492797078 [1,0,0,0,0,0|3,0,0]=4 153 B10R1.113 CN(C)C1=CC(=CC=C1)F Z1201621444 [1,0,0,0,0,0|3,0,0]=4 154 B10R1.113 CS(=O)C1=CC(=CC=C1)N Z609980392 [1,0,0,0,0,0|2,0,1]=4 155 B10R1.113 C[C@@H](O)C1=CC(=CC=C1)Br Z803153182 [1,0,0,0,0,0|1,0,0]=2 156 B10R1.113 C[C@@H](O)C1=CC(=CC=C1)Cl Z360055382 [1,0,0,0,0,0|1,0,0]=2 157 B10R1.113 C[C@@H](O)C1=CC(=CC=C1)O Z959151708 [1,0,0,0,0,0|0,0,0]=1 158 B10R1.113 C[C@H](O)C1=CC(=CC=C1)Br Z803153180 [1,0,0,0,0,0|1,0,0]=2 159 B10R1.113 C[C@H](O)C1=CC(=CC=C1)Cl Z360055386 [1,0,0,0,0,0|1,0,0]=2 160 B10R1.113 C[C@H](O)C1=CC(=CC=C1)O Z959151706 [1,0,0,0,0,0|0,0,0]=1 161 B10R1.113 N=C(N)C1=CC(=CC=C1)Br Z1741973354 [1,0,0,0,0,0|2,0,1]=4 162 B10R1.113 N=C(N)C1=CC(=CC=C1)Cl Z1362754541 [1,0,0,0,0,0|2,0,1]=4 163 B10R1.113 N=C(N)C1=CC(=CC=C1)F Z1263714076 [1,0,0,0,0,0|2,0,1]=4 164 B10R1.113 N=C(N)C1=CC(=CC=C1)O Z1592024758 [1,0,0,0,0,0|1,0,1]=3 165 B10R1.113 NC(=O)C1=CC(=CC=C1)Br Z33546517 [1,0,0,0,0,0|1,0,2]=4 166 B10R1.113 NC(=O)C1=CC(=CC=C1)Cl Z33546479 [1,0,0,0,0,0|1,0,2]=4 167 B10R1.113 NC(=O)C1=CC(=CC=C1)I Z33546647 [1,0,0,0,0,0|1,0,2]=4 168 B10R1.113 NC(=O)C1=CC(=CC=C1)N Z118530082 [1,0,0,0,0,0|1,0,2]=4 169 B10R1.113 NC(=O)C1=CC(=CC=C1)O Z33546460 [1,0,0,0,0,0|0,0,2]=3 170 B10R1.113 NC(=O)C1=CC(=CC=C1)S Z1255359534 [1,0,0,0,0,0|0,1,2]=4 171 B10R1.113 NC(=O)C1=CC(=CN=C1)O Z1160905298 [1,0,0,0,0,0|1,0,2]=4 172 B10R1.113 NC(=S)C1=CC(=CC=C1)Br Z56985752 [1,0,0,0,0,0|1,1,1]=4 173 B10R1.113 NC(=S)C1=CC(=CC=C1)Cl Z56979368 [1,0,0,0,0,0|1,1,1]=4 174 B10R1.113 NC(=S)C1=CC(=CC=C1)F Z56979300 [1,0,0,0,0,0|1,1,1]=4 175 B10R1.113 NC1=CC(=CC=C1)B(O)O Z1201617111 [1,0,0,0,0,0|3,0,0]=4 176 B10R1.113 NC1=CC(=CC=C1)C(=O)O Z57127542 [1,0,0,0,0,0|2,0,1]=4 177 B10R1.113 NC1=CC(=CC=C1)C(F)F Z991556368 [1,0,0,0,0,0|3,0,0]=4 178 B10R1.113 O=C(O)C1=CC(=CC=C1)Br Z104475790 [1,0,0,0,0,0|2,0,1]=4 179 B10R1.113 O=C(O)C1=CC(=CC=C1)Cl Z104474062 [1,0,0,0,0,0|2,0,1]=4 180 B10R1.113 O=C(O)C1=CC(=CC=C1)F Z104477304 [1,0,0,0,0,0|2,0,1]=4 181 B10R1.113 O=C(O)C1=CC(=CC=C1)I Z56924537 [1,0,0,0,0,0|2,0,1]=4 182 B10R1.113 O=C(O)C1=CC(=CC=C1)O Z56919254 [1,0,0,0,0,0|1,0,1]=3 183 B10R1.113 O=C(O)C1=CC(=CC=C1)S Z1201630948 [1,0,0,0,0,0|1,1,1]=4 184 B10R1.113 O=C(O)C1=CC(=CN=C1)O Z57124104 [1,0,0,0,0,0|2,0,1]=4 185 B10R1.113 O=C(O)C1=NC=CC(=C1)O Z385458378 [1,0,0,0,0,0|2,0,1]=4 186 B10R1.113 O=[N+]([O-])C1=CC=CC(=C1)O Z57160187 [1,0,0,0,0,0|2,0,1]=4 187 B10R1.113 OB(O)C1=CC(=CC=C1)Br Z1269164934 [1,0,0,0,0,0|3,0,0]=4 188 B10R1.113 OB(O)C1=CC(=CC=C1)Cl Z381540932 [1,0,0,0,0,0|3,0,0]=4 189 B10R1.113 OB(O)C1=CC(=CC=C1)F Z381540934 [1,0,0,0,0,0|3,0,0]=4 190 B10R1.113 OB(O)C1=CC(=CC=C1)O Z336080002 [1,0,0,0,0,0|2,0,0]=3 191 B10R1.113 OC1=CC(=CN=C1)C(F)F Z1551924687 [1,0,0,0,0,0|3,0,0]=4 192 B10R1.113 OC1=NC(=CC=C1)C(F)F Z3243590355 [1,0,0,0,0,0|3,0,0]=4 193 B12R1.10 CC(C)(CN)C1=CC(=CC=C1)Br Z725146618 [0,1,0,0,0,0|2,0,0]=3 194 B12R1.10 CC(C)(CN)C1=CC(=CC=C1)Cl Z725146492 [0,1,0,0,0,0|2,0,0]=3 195 B12R1.10 CC(C)(CN)C1=CC(=CC=C1)F Z725146550 [0,1,0,0,0,0|2,0,0]=3 196 B12R1.10 CC(C)(CN)C1=CC(=O)C=CN1 Z4923389973 [0,1,0,0,0,0|2,0,1]=4 197 B12R1.10 CC(C)(CN)C1=CC(=O)NC=C1 Z4926861924 [0,1,0,0,0,0|2,0,1]=4 198 B12R1.10 CC(C)(CN)C1=CC=CC(=O)N1 Z4657939558 [0,1,0,0,0,0|2,0,1]=4 199 B12R1.10 CC(C)(CO)C1=CC(=CC=C1)N Z1416169387 [0,1,0,0,0,0|3,0,0]=4 200 B12R1.10 CC(N)(CO)C1=CC(=CC=C1)Br Z2939851870 [0,1,0,0,0,0|3,0,0]=4 201 B12R1.10 CC(N)(CO)C1=CC(=CC=C1)N Z2752202173 [0,1,0,0,0,0|3,0,0]=4 202 B12R1.10 CC(N)(CO)C1=CC(=CC=C1)O Z2111443115 [0,1,0,0,0,0|2,0,0]=3 203 B12R1.10 CC1=CC(=CC=C1)C(C)(C)CN Z725146606 [0,1,0,0,0,0|2,0,0]=3 204 B12R1.10 NCC(F)(F)C1=CC(=CC=C1)F Z2515207618 [0,1,0,0,0,0|2,0,0]=3 205 B12R1.13 CCN(CC)C1=CC(=CC=C1)O Z104473836 [0,1,0,0,0,0|3,0,0]=4 206 B12R1.13 CNC(CO)C1=CC(=CC=C1)Br Z734147362 [0,1,0,0,0,0|3,0,0]=4 207 B12R1.13 CNC(CO)C1=CC(=CC=C1)F Z734147282 [0,1,0,0,0,0|3,0,0]=4 208 B12R1.13 COC(C#N)C1=CC(=CC=C1)Cl Z1262475067 [0,1,0,0,0,0|1,0,2]=4 209 B12R1.13 COC(CN)C1=CC(=CC=C1)Cl Z1270462953 [0,1,0,0,0,0|1,0,0]=2 210 B12R1.13 COC(CN)C1=CC(=CC=C1)F Z4182331225 [0,1,0,0,0,0|1,0,0]=2 211 B12R1.13 CSC(CN)C1=CC(=CC=C1)Cl Z838201342 [0,1,0,0,0,0|1,1,0]=3 212 B12R1.13 O=C/C(=C\O)/C1=CC(=CC=C1)O Z3278355634 [0,1,0,0,0,0|1,0,2]=4 213 B12R1.13 OCC(CO)C1=CC(=CC=C1)F Z1259339659 [0,1,0,0,0,0|2,0,0]=3 214 B12R1.17 CCNC(=O)C1=CC(=CC=C1)O Z32024396 [0,1,0,0,0,0|1,0,2]=4 215 B12R1.17 CCNC(C)C1=CC(=CC=C1)O Z3479644552 [0,1,0,0,0,0|2,0,0]=3 216 B12R1.17 CNC[C@H](O)C1=CC(=CC=C1)O Z1198723489 [0,1,0,0,0,0|0,0,0]=1 217 B12R1.17 COCC(O)C1=CC(=CC=C1)N Z970071366 [0,1,0,0,0,0|2,0,0]=3 218 B12R1.17 N#CCC(O)C1=CC(=CC=C1)Cl Z1255429594 [0,1,0,0,0,0|1,0,1]=3 219 B12R1.24 CCC(O)C1=C(C(=CC=C1)Cl)F Z1245781804 [0,1,0,0,0,0|2,0,0]=3 220 B12R1.24 NC(CO)C1=C(C(=CC=C1)Cl)Cl Z2582143665 [0,1,0,0,0,0|3,0,0]=4 221 B12R1.24 NC(CO)C1=C(C(=CC=C1)Cl)F Z1982493965 [0,1,0,0,0,0|3,0,0]=4 222 B12R1.24 NC(CO)C1=C(C(=CC=C1)F)F Z4928208183 [0,1,0,0,0,0|3,0,0]=4 223 B12R1.24 NCC(=O)C1=C(C(=CC=C1)F)Cl Z2687203715 [0,1,0,0,0,0|1,0,2]=4 224 B12R1.24 NCC(=O)C1=C(C(=CC=C1)F)F Z2719319780 [0,1,0,0,0,0|1,0,2]=4 225 B12R1.24 OCC(O)C1=C(C(=CC=C1)Cl)Cl Z1537123320 [0,1,0,0,0,0|2,0,0]=3 226 B12R1.225 CC(=O)C(O)C1=CC(=CC=C1)Cl Z1255467340 [0,1,0,0,0,0|2,0,1]=4 227 B12R1.225 CC(C1=CC(=CC=C1)O)N(C)C Z1176485649 [0,1,0,0,0,0|3,0,0]=4 228 B12R1.225 CC(N)C(=O)C1=CC(=CC=C1)O Z3015076235 [0,1,0,0,0,0|0,0,2]=3 229 B12R1.225 CC(N)C(O)C1=CC(=CC=C1)F Z1695740794 [0,1,0,0,0,0|1,0,0]=2 230 B12R1.225 CC1=CC(=CC=C1)C(O)C(=O)O Z788000614 [0,1,0,0,0,0|2,0,1]=4 231 B12R1.225 C[C@@H](C1=CC(=CC=C1)O)N(C)C Z1198169241 [0,1,0,0,0,0|3,0,0]=4 232 B12R1.225 C[C@H](N)[C@H](O)C1=CC(=CC=C1)O Z2050038784 [0,1,0,0,0,0|0,0,0]=1 233 B12R1.225 NC(=O)C(N)C1=CC(=CC=C1)Br Z477338262 [0,1,0,0,0,0|2,0,1]=4 234 B12R1.225 NC(C(=O)O)C1=CC(=CC=C1)O Z1532541074 [0,1,0,0,0,0|2,0,1]=4 235 B12R1.225 NC1=CC(=CC=C1)C(O)C(=O)O Z1262512603 [0,1,0,0,0,0|2,0,1]=4 236 B12R1.225 O=C(O)C(O)C1=CC(=CC=C1)Br Z788000730 [0,1,0,0,0,0|2,0,1]=4 237 B12R1.225 O=C(O)C(O)C1=CC(=CC=C1)Cl Z788000712 [0,1,0,0,0,0|2,0,1]=4 238 B12R1.225 O=C(O)C(O)C1=CC(=CC=C1)F Z788000610 [0,1,0,0,0,0|2,0,1]=4 239 B12R1.225 O=C(O)C(O)C1=CC(=CC=C1)I Z1269151011 [0,1,0,0,0,0|2,0,1]=4 240 B12R1.354 CCC(N)C1=C(C=CC(=C1)F)F Z1250208681 [0,1,0,0,0,0|3,0,0]=4 241 B12R1.354 NC(CO)C1=C(C=CC(=C1)F)F Z752989148 [0,1,0,0,0,0|3,0,0]=4 242 B12R1.358 CC1=CC(=CC(=C1)C(C)CN)C Z5233394619 [0,1,0,0,0,0|2,0,0]=3 243 B12R1.358 CC1=CC(=CC(=C1)C(N)CO)C Z3213149799 [0,1,0,0,0,0|3,0,0]=4 244 B12R1.358 CC1=CC(=CC(=C1)C(O)CN)C Z838973992 [0,1,0,0,0,0|1,0,0]=2 245 B12R1.358 CCC(N)C1=CC(=CC(=C1)F)Br Z1269119489 [0,1,0,0,0,0|3,0,0]=4 246 B12R1.358 NCC(=O)C1=CC(=CC(=C1)Cl)Br Z3301405086 [0,1,0,0,0,0|1,0,2]=4 247 B12R1.358 NCC(=O)C1=CC(=CC(=C1)F)F Z2931619215 [0,1,0,0,0,0|1,0,2]=4 248 B12R1.358 NCC(O)C1=CC(=CC(=C1)Cl)Cl Z452431482 [0,1,0,0,0,0|1,0,0]=2 249 B12R1.358 NCC(O)C1=CC(=CC(=C1)F)Cl Z1918018376 [0,1,0,0,0,0|1,0,0]=2 250 B12R1.358 NCC(O)C1=CC(=CC(=C1)F)F Z6095531368 [0,1,0,0,0,0|1,0,0]=2 251 B12R1.367 CC(CN)C1=CC(=C(C=C1)Cl)Cl Z4937190097 [0,1,0,0,0,0|2,0,0]=3 252 B12R1.367 CC(CN)C1=CC(=C(C=C1)F)Cl Z4937045907 [0,1,0,0,0,0|2,0,0]=3 253 B12R1.367 CC(CN)C1=CC(=C(C=C1)F)F Z415655058 [0,1,0,0,0,0|2,0,0]=3 254 B12R1.367 CC1=C(C=C(C=C1)C(=O)CN)Br Z3689015562 [0,1,0,0,0,0|1,0,2]=4 255 B12R1.367 CCC(C)C1=CC(=C(C=C1)O)N Z57441610 [0,1,0,0,0,0|3,0,0]=4 256 B12R1.367 CCC(N)C1=CC(=C(C=C1)Br)F Z5368653956 [0,1,0,0,0,0|3,0,0]=4 257 B12R1.367 CCC(O)C1=CC(=C(C=C1)Cl)Cl Z235447502 [0,1,0,0,0,0|2,0,0]=3 258 B12R1.367 CC[C@@H](O)C1=CC(=C(C=C1)Cl)Cl Z1483951050 [0,1,0,0,0,0|2,0,0]=3 259 B12R1.367 CC[C@H](O)C1=CC(=C(C=C1)C)F Z1255444475 [0,1,0,0,0,0|2,0,0]=3 260 B12R1.367 NC(CO)C1=CC(=C(C=C1)Br)F Z2205958451 [0,1,0,0,0,0|3,0,0]=4 261 B12R1.367 NC(CO)C1=CC(=C(C=C1)F)Cl Z3398351125 [0,1,0,0,0,0|3,0,0]=4 262 B12R1.367 NCC(=O)C1=CC(=C(C=C1)Br)F Z2719320982 [0,1,0,0,0,0|1,0,2]=4 263 B12R1.367 NCC(=O)C1=CC(=C(C=C1)Cl)Cl Z1269180328 [0,1,0,0,0,0|1,0,2]=4 264 B12R1.367 NCC(O)C1=CC(=C(C=C1)F)F Z330910382 [0,1,0,0,0,0|1,0,0]=2 265 B12R1.367 O=C(CCl)C1=CC(=C(C=C1)O)O Z56912624 [0,1,0,0,0,0|1,0,2]=4 266 B12R1.367 OCC(O)C1=CC(=C(C=C1)Cl)F Z1537124099 [0,1,0,0,0,0|2,0,0]=3 267 B12R1.435 CCC(=O)C1=CC(=CC=C1)OC Z513732528 [0,1,0,0,0,0|1,0,2]=4 268 B12R1.435 CCC(O)C1=CC(=CC=C1)OC Z513748112 [0,1,0,0,0,0|1,0,0]=2 269 B12R1.435 COC1=CC(=CC=C1)C(=O)CBr Z104482198 [0,1,0,0,0,0|1,0,2]=4 270 B12R1.435 COC1=CC(=CC=C1)C(=O)CCl Z440619268 [0,1,0,0,0,0|1,0,2]=4 271 B12R1.435 COC1=CC(=CC=C1)C(=O)CN Z2242140910 [0,1,0,0,0,0|0,0,2]=3 272 B12R1.435 COC1=CC(=CC=C1)C(=O)NN Z58981865 [0,1,0,0,0,0|1,0,2]=4 273 B12R1.435 COC1=CC(=CC=C1)C(C)C#N Z415654698 [0,1,0,0,0,0|1,0,2]=4 274 B12R1.435 COC1=CC(=CC=C1)C(C)C=O Z1255385344 [0,1,0,0,0,0|2,0,1]=4 275 B12R1.435 COC1=CC(=CC=C1)C(N)CO Z385458538 [0,1,0,0,0,0|2,0,0]=3 276 B12R1.435 COC1=CC(=CC=C1)C(O)CO Z1416170023 [0,1,0,0,0,0|1,0,0]=2 277 B12R1.435 N#CC1=CC=CC(=C1)C(N)CF Z3066830149 [0,1,0,0,0,0|3,0,0]=4 278 B12R1.435 N#CC1=CC=CC(=C1)[C@@H](O)CN Z2238129707 [0,1,0,0,0,0|1,0,0]=2 279 B12R2.80 C[C@@H]1O[C@H]1C2=CC(=CC=C2)Cl Z2525216417 [0,0,0,1,0,0|2,0,0]=3 280 B12R2.80 NC1CC1C2=CC(=CC=C2)Br Z1266823142 [0,0,0,1,0,0|2,0,0]=3 281 B12R2.80 N[C@@H]1C[C@H]1C2=CC(=CC=C2)Cl Z2298098009 [0,0,0,1,0,0|2,0,0]=3 282 B12R2.132 CC1=CC2=C(C=C1)CCC2N Z1259339087 [0,0,0,1,0,0|3,0,0]=4 283 B12R2.132 CC1=CC2=C(C=C1)OCC2N Z1431002725 [0,0,0,1,0,0|3,0,0]=4 284 B12R2.132 NC1=CC2=C(C=C1)CCC2O Z1203584428 [0,0,0,1,0,0|2,0,0]=3 285 B12R2.132 NC1=CC2=C(C=C1)NN=C2O Z1198174712 [0,0,0,1,0,0|2,0,1]=4 286 B12R2.132 NC1CCC2=C1C=C(C=C2)Cl Z2692095081 [0,0,0,1,0,0|3,0,0]=4 287 B12R2.132 NC1CCC2=C1C=C(C=C2)F Z1263820321 [0,0,0,1,0,0|3,0,0]=4 288 B12R2.132 NC1CCC2=C1C=C(C=C2)O Z1198165276 [0,0,0,1,0,0|2,0,0]=3 289 B12R2.132 NC1COC2=C1C=C(C=C2)Br Z3241275758 [0,0,0,1,0,0|3,0,0]=4 290 B12R2.132 NC1COC2=C1C=C(C=C2)Cl Z1431002566 [0,0,0,1,0,0|3,0,0]=4 291 B12R2.132 NC1COC2=C1C=C(C=C2)F Z1698549696 [0,0,0,1,0,0|3,0,0]=4 292 B12R2.132 NC1CSC2=C1C=C(C=C2)Br Z431545436 [0,0,0,1,0,0|3,0,0]=4 293 B12R2.132 OB1OCC2=C1C=C(C=C2)O Z1513809260 [0,0,0,1,0,0|3,0,0]=4 294 B12R2.132 OC1=CC2=C(C=C1)OC=C2O Z1216838816 [0,0,0,1,0,0|1,0,2]=4 295 B12R2.132 OC1=NNC2=C1C=C(C=C2)Br Z1269130677 [0,0,0,1,0,0|2,0,1]=4 296 B12R2.132 OC1CCC2=C1C=C(C=C2)F Z815114600 [0,0,0,1,0,0|2,0,0]=3 297 B12R2.196 NC1=C2CCC(C2=CC=C1)N Z4404079635 [0,0,0,1,0,0|3,0,0]=4 298 B12R2.196 NC1CCC2=C(C=CC=C12)Br Z1263529547 [0,0,0,1,0,0|3,0,0]=4 299 B12R2.196 NC1CCC2=C(C=CC=C12)Cl Z802671646 [0,0,0,1,0,0|3,0,0]=4 300 B12R2.196 NC1CCC2=C(C=CC=C12)F Z802665924 [0,0,0,1,0,0|3,0,0]=4 301 B12R2.196 NC1CCC2=C(C=CC=C12)O Z317054124 [0,0,0,1,0,0|2,0,0]=3 302 B12R2.196 NC1COC2=C(C=CC=C12)Cl Z1416282556 [0,0,0,1,0,0|3,0,0]=4 303 B12R2.196 NC1COC2=C(C=CC=C12)F Z4574897577 [0,0,0,1,0,0|3,0,0]=4 304 B12R2.196 O=C1CCC2=C(C=CC=C12)O Z203881856 [0,0,0,1,0,0|1,0,2]=4 305 B12R2.196 OB1OCC2=C(C=CC=C12)O Z1513908647 [0,0,0,1,0,0|3,0,0]=4 306 B12R2.196 OC1=NNC2=C1C=CC=C2Br Z2757551695 [0,0,0,1,0,0|2,0,1]=4 307 B12R2.196 OC1CCC2=C(C=CC=C12)Cl Z815114596 [0,0,0,1,0,0|2,0,0]=3 308 B12R2.196 OC1CCC2=C(C=NC=C12)Br Z1813120127 [0,0,0,1,0,0|3,0,0]=4 309 B12R2.1282 CC1(CC1)C2=CC(=CC=C2)N Z3016341162 [0,0,0,1,0,0|3,0,0]=4 310 B12R2.1282 CC1=CC(=CC=C1)C2(CC2)N Z3235027684 [0,0,0,1,0,0|3,0,0]=4 311 B12R2.1282 NC1(CC1)C2=CC(=CC=C2)Br Z1250132660 [0,0,0,1,0,0|3,0,0]=4 312 B12R2.1282 NC1(CC1)C2=CC(=CC=C2)Cl Z1272949049 [0,0,0,1,0,0|3,0,0]=4 313 B12R2.1282 NC1(CC1)C2=CC(=CC=C2)F Z1250132685 [0,0,0,1,0,0|3,0,0]=4 314 B12R2.2313 FC1=CC(=CC=C1)C2CCN2 Z1696844460 [0,0,0,1,0,0|3,0,0]=4 315 B12R2.2313 FC1=CC(=CC=C1)C2CNC2 Z1436185316 [0,0,0,1,0,0|2,0,0]=3 316 B12R2.2313 NC1=CC(=CC=C1)C2CCC2 Z1486032780 [0,0,0,1,0,0|3,0,0]=4 317 B12R2.2313 OC1=NC(=NC=C1)C2CNC2 Z3023573098 [0,0,0,1,0,0|3,0,0]=4 318 B10R1.14 CC1=CC=C(O1)C(O)CN Z363991860 [0,0,0,0,1,0|2,0,0]=3 319 B10R1.14 CN1C=C(C=N1)C(O)CN Z336086446 [0,0,0,0,1,0|3,0,0]=4 320 B10R1.14 NCC(O)C1=CC=C(S1)Cl Z838891514 [0,0,0,0,1,0|2,0,0]=3 321 B10R1.149 CN1C=CC=C1C(O)CN Z363990702 [0,0,0,0,1,0|2,0,0]=3 322 B12R1.50 CC(CN)OC1=CC(=CC=C1)Br Z844632504 [0,0,0,0,0,1|2,0,0]=3 323 B12R1.50 CC(CN)OC1=CC(=CC=C1)Cl Z1263820268 [0,0,0,0,0,1|2,0,0]=3 324 B12R1.50 CC(CN)OC1=CC(=CC=C1)F Z844631990 [0,0,0,0,0,1|2,0,0]=3 325 B12R1.50 CC1=CC(=CC=C1)CC(N)CO Z1801307645 [0,0,0,0,0,1|3,0,0]=4 326 B12R1.50 CC1=CC=CC(=C1)OC(C)CN Z844631960 [0,0,0,0,0,1|2,0,0]=3 327 B12R1.50 CCC(C)OC1=CC(=CC=C1)N Z331149114 [0,0,0,0,0,1|3,0,0]=4 328 B12R1.50 NC(CO)CC1=CC(=CC=C1)F Z1198222234 [0,0,0,0,0,1|3,0,0]=4 329 B12R1.50 NCC(=O)CC1=CC(=CC=C1)Br Z1981870420 [0,0,0,0,0,1|1,0,2]=4 330 B12R1.50 NCC(=O)NC1=CC(=CC=C1)Br Z46280185 [0,0,0,0,0,1|1,0,2]=4 331 B12R1.50 NCC(=O)NC1=CC(=CC=C1)F Z46280394 [0,0,0,0,0,1|1,0,2]=4 332 B12R1.50 NCC(O)CC1=CC(=CC=C1)Br Z4981222469 [0,0,0,0,0,1|1,0,0]=2 333 B9R1.2 CC1=CC(=CC=C1)NN Z56943685 [2,0,0,0,0,0|2,0,0]=4 334 B9R1.2 CC1=CC(=CN=C1)CN Z1198167984 [2,0,0,0,0,0|2,0,0]=4 335 B9R1.2 CC1=CC(=CN=C1)CO Z4562296729 [2,0,0,0,0,0|2,0,0]=4 336 B9R1.2 CC1=NC(=CC=C1)CN Z291234028 [2,0,0,0,0,0|2,0,0]=4 337 B9R1.2 CC1=NC(=CC=C1)CO Z397587486 [2,0,0,0,0,0|2,0,0]=4 338 B9R1.2 CC1=NC=CC(=C1)CO Z1198175905 [2,0,0,0,0,0|2,0,0]=4 339 B9R1.2 CCC1=CC(=CC=C1)Br Z1201619408 [2,0,0,0,0,0|1,0,0]=3 340 B9R1.2 CCC1=CC(=CC=C1)N Z104478688 [2,0,0,0,0,0|1,0,0]=3 341 B9R1.2 CCC1=NC(=CC=C1)C Z1255485781 [2,0,0,0,0,0|2,0,0]=4 342 B9R1.2 CCC1=NC=NC(=C1)O Z798251110 [2,0,0,0,0,0|2,0,0]=4 343 B9R1.2 CC[N+]1=CC(=CC=C1)O Z2168499555 [2,0,0,0,0,0|1,0,0]=3 344 B9R1.2 CNC1=CC(=CC=C1)F Z335274194 [2,0,0,0,0,0|2,0,0]=4 345 B9R1.2 CNC1=CC(=CC=C1)I Z4085232023 [2,0,0,0,0,0|2,0,0]=4 346 B9R1.2 CNC1=CC(=CC=C1)N Z376447548 [2,0,0,0,0,0|2,0,0]=4 347 B9R1.2 CNC1=CC(=CC=C1)O Z1082872246 [2,0,0,0,0,0|1,0,0]=3 348 B9R1.2 COC1=CC(=CC=C1)C Z53834440 [2,0,0,0,0,0|2,0,0]=4 349 B9R1.2 COC1=CC(=CC=C1)N Z104472536 [2,0,0,0,0,0|2,0,0]=4 350 B9R1.2 COC1=CC(=CC=C1)O Z104478798 [2,0,0,0,0,0|1,0,0]=3 351 B9R1.2 COC1=NC(=CC=C1)O Z1198172138 [2,0,0,0,0,0|2,0,0]=4 352 B9R1.2 CSC1=CC(=CC=C1)N Z104472758 [2,0,0,0,0,0|2,0,0]=4 353 B9R1.2 CSC1=NC=CC(=C1)O Z1255421960 [2,0,0,0,0,0|2,0,0]=4 354 B9R1.2 N#CC1=CC=CC(=C1)O Z56969327 [2,0,0,0,0,0|0,0,2]=4 355 B9R1.2 NC1=CC(=NC=C1)CO Z1198310848 [2,0,0,0,0,0|2,0,0]=4 356 B9R1.2 NC1=NC(=CC=C1)CO Z154209994 [2,0,0,0,0,0|2,0,0]=4 357 B9R1.2 NC1=NC=CC(=C1)CO Z991492364 [2,0,0,0,0,0|2,0,0]=4 358 B9R1.2 NCC1=CC(=CC=C1)Br Z1262246228 [2,0,0,0,0,0|1,0,0]=3 359 B9R1.2 NCC1=CC(=CC=C1)I Z1269220799 [2,0,0,0,0,0|1,0,0]=3 360 B9R1.2 NCC1=CC(=CC=C1)O Z744729056 [2,0,0,0,0,0|0,0,0]=2 361 B9R1.2 NCC1=CC(=CN=C1)Br Z2692250391 [2,0,0,0,0,0|2,0,0]=4 362 B9R1.2 NCC1=CC(=CN=C1)Cl Z3244925674 [2,0,0,0,0,0|2,0,0]=4 363 B9R1.2 NCC1=CC(=CN=C1)O Z2310701794 [2,0,0,0,0,0|1,0,0]=3 364 B9R1.2 NCC1=NC(=CC=C1)N Z2310698959 [2,0,0,0,0,0|2,0,0]=4 365 B9R1.2 NCC1=NC=CC(=C1)Cl Z1198173013 [2,0,0,0,0,0|2,0,0]=4 366 B9R1.2 NCC1=NC=CC(=C1)N Z2310678270 [2,0,0,0,0,0|2,0,0]=4 367 B9R1.2 NCC1=NC=NC(=C1)O Z2511806596 [2,0,0,0,0,0|2,0,0]=4 368 B9R1.2 NNC1=CC(=CC=C1)Br Z118530090 [2,0,0,0,0,0|2,0,0]=4 369 B9R1.2 NNC1=CC(=CC=C1)Cl Z56940998 [2,0,0,0,0,0|2,0,0]=4 370 B9R1.2 O=C1C=C(C=CN1)CO Z1203733303 [2,0,0,0,0,0|1,0,1]=4 371 B9R1.2 O=CC1=CC=CC(=C1)O Z57772446 [2,0,0,0,0,0|0,0,2]=4 372 B9R1.2 OC1=CC(=CC=C1)CCl Z1198169502 [2,0,0,0,0,0|1,0,0]=3 373 B9R1.2 OCC1=CC(=CC=C1)Br Z335244752 [2,0,0,0,0,0|1,0,0]=3 374 B9R1.2 OCC1=CC(=CC=C1)Cl Z212055560 [2,0,0,0,0,0|1,0,0]=3 375 B9R1.2 OCC1=CC(=CC=C1)F Z104477458 [2,0,0,0,0,0|1,0,0]=3 376 B9R1.2 OCC1=CC(=CC=C1)O Z335245000 [2,0,0,0,0,0|0,0,0]=2 377 B9R1.2 OCC1=CC(=CN=C1)Br Z381037198 [2,0,0,0,0,0|2,0,0]=4 378 B9R1.2 OCC1=CC(=NC=C1)Cl Z979439344 [2,0,0,0,0,0|2,0,0]=4 379 B9R1.2 OCC1=NC(=CC=C1)O Z1198343459 [2,0,0,0,0,0|1,0,0]=3 380 B9R1.2 OCC1=NC=CC(=C1)Cl Z979714554 [2,0,0,0,0,0|2,0,0]=4 381 B9R1.8 CCCC1=CC=CC=C1 Z104479154 [2,0,0,0,0,0|1,0,0]=3 382 B9R1.8 CCCC1=NC=CC=C1 Z1255434741 [2,0,0,0,0,0|2,0,0]=4 383 B9R1.8 CCNC1=CC=CC=C1 Z104472482 [2,0,0,0,0,0|2,0,0]=4 384 B9R1.8 NCCC1=CC=NC=C1 Z241056520 [2,0,0,0,0,0|1,0,0]=3 385 B9R1.8 NCCC1=CN=CC=C1 Z241056524 [2,0,0,0,0,0|1,0,0]=3 386 B9R1.8 NCCC1=CN=NC=C1 Z3070743015 [2,0,0,0,0,0|2,0,0]=4 387 B9R1.8 NCCC1=NC=CC=C1 Z104478200 [2,0,0,0,0,0|1,0,0]=3 388 B9R1.8 NCCC1=NC=CN=C1 Z1925930460 [2,0,0,0,0,0|2,0,0]=4 389 B9R1.8 NCCC1=NC=NC=C1 Z2935002210 [2,0,0,0,0,0|2,0,0]=4 390 B9R1.8 NNCC1=CC=CC=C1 Z56969306 [2,0,0,0,0,0|1,0,0]=3 391 B9R1.8 NNCC1=CN=CC=C1 Z370706826 [2,0,0,0,0,0|2,0,0]=4 392 B9R1.8 NOCC1=CC=CC=C1 Z90668722 [2,0,0,0,0,0|1,0,0]=3 393 B9R1.8 O=CCC1=CC=CC=C1 Z104472146 [2,0,0,0,0,0|1,0,1]=4 394 B9R1.8 OCCC1=CC=CC=C1 Z104473586 [2,0,0,0,0,0|1,0,0]=3 395 B9R1.8 OCCC1=CN=CC=C1 Z992949518 [2,0,0,0,0,0|2,0,0]=4 396 B9R1.8 OCCC1=NC=CC=C1 Z104473592 [2,0,0,0,0,0|2,0,0]=4 397 B9R1.6 CC(=O)C1=CC=CC=C1 Z57127548 [2,0,0,0,0,0|0,0,2]=4 398 B9R1.6 CC(C)C1=NC=CC=C1 Z1198148831 [2,0,0,0,0,0|2,0,0]=4 399 B9R1.6 CC(N)C1=CC=CC=C1 Z57102377 [2,0,0,0,0,0|1,0,0]=3 400 B9R1.6 CC(N)C1=CN=CC=C1 Z85921957 [2,0,0,0,0,0|2,0,0]=4 401 B9R1.6 CC(N)C1=NC=CC=C1 Z56347059 [2,0,0,0,0,0|2,0,0]=4 402 B9R1.6 CC(O)C1=CC=CC=C1 Z104494956 [2,0,0,0,0,0|0,0,0]=2 403 B9R1.6 CC(O)C1=CC=NC=C1 Z335245082 [2,0,0,0,0,0|1,0,0]=3 404 B9R1.6 CC(O)C1=CN=CC=C1 Z335245084 [2,0,0,0,0,0|1,0,0]=3 405 B9R1.6 CC(O)C1=NC=CC=C1 Z335244914 [2,0,0,0,0,0|1,0,0]=3 406 B9R1.6 CC(O)C1=NC=CN=C1 Z513751834 [2,0,0,0,0,0|2,0,0]=4 407 B9R1.6 CN(N)C1=CC=CC=C1 Z57985384 [2,0,0,0,0,0|2,0,0]=4 408 B9R1.6 C[C@@H](N)C1=CC=CC=C1 Z1079183182 [2,0,0,0,0,0|1,0,0]=3 409 B9R1.6 C[C@@H](N)C1=CC=NC=C1 Z1197994836 [2,0,0,0,0,0|2,0,0]=4 410 B9R1.6 C[C@@H](O)C1=CC=CC=C1 Z360055166 [2,0,0,0,0,0|0,0,0]=2 411 B9R1.6 C[C@H](N)C1=CC=CC=C1 Z1079131570 [2,0,0,0,0,0|1,0,0]=3 412 B9R1.6 C[C@H](N)C1=CC=NC=C1 Z1492781304 [2,0,0,0,0,0|2,0,0]=4 413 B9R1.6 C[C@H](O)C1=CC=CC=C1 Z360055168 [2,0,0,0,0,0|0,0,0]=2 414 B9R1.6 N=C(N)C1=CC=CC=C1 Z166624376 [2,0,0,0,0,0|1,0,1]=4 415 B9R1.6 NC(=S)C1=CC=CC=C1 Z57070430 [2,0,0,0,0,0|0,1,1]=4 416 B9R1.6 O=C(O)C1=CC=CC=C1 Z57127480 [2,0,0,0,0,0|1,0,1]=4 417 B9R1.6 OB(O)C1=CC=CC=C1 Z111782400 [2,0,0,0,0,0|2,0,0]=4 418 B11R1.13 C=CCC1=CC=CC(=C1O)O Z56778453 [1,1,0,0,0,0|1,0,1]=4 419 B11R1.13 CC1=C(C(=CC=C1)CCN)C Z4927171483 [1,1,0,0,0,0|1,0,0]=3 420 B11R1.13 NCCC1=C(C(=CC=C1)Br)O Z1953500453 [1,1,0,0,0,0|1,0,0]=3 421 B11R1.13 NCCC1=C(C(=CC=C1)Cl)Cl Z444350066 [1,1,0,0,0,0|1,0,0]=3 422 B11R1.13 NCCC1=C(C(=CC=C1)Cl)F Z3301588304 [1,1,0,0,0,0|1,0,0]=3 423 B11R1.13 NCCC1=C(C(=CC=C1)F)Cl Z4926042702 [1,1,0,0,0,0|1,0,0]=3 424 B11R1.13 NCCC1=C(C(=CC=C1)F)F Z1267773780 [1,1,0,0,0,0|1,0,0]=3 425 B11R1.13 OCCC1=C(C(=CC=C1)F)F Z1183459328 [1,1,0,0,0,0|2,0,0]=4 426 B11R1.24 BrCCOC1=CC(=CC=C1)Br Z56886268 [1,1,0,0,0,0|2,0,0]=4 427 B11R1.24 C#CCOC1=CC=CC(=C1)O Z381415784 [1,1,0,0,0,0|1,0,1]=4 428 B11R1.24 C=CCCC1=CC=CC(=C1)Br Z1269162615 [1,1,0,0,0,0|2,0,0]=4 429 B11R1.24 CC1=CC(=CC=C1)CCCN Z4993130622 [1,1,0,0,0,0|1,0,0]=3 430 B11R1.24 CC1=CC(=CC=C1)CCCO Z979436642 [1,1,0,0,0,0|2,0,0]=4 431 B11R1.24 CC1=CC(=CC=C1)OCCBr Z56886266 [1,1,0,0,0,0|2,0,0]=4 432 B11R1.24 CC1=CC(=CC=C1)OCCN Z85926240 [1,1,0,0,0,0|1,0,0]=3 433 B11R1.24 CC1=NC(=CC=C1)NCCN Z1267773738 [1,1,0,0,0,0|2,0,0]=4 434 B11R1.24 CCCOC1=CC(=CC=C1)Br Z54848718 [1,1,0,0,0,0|2,0,0]=4 435 B11R1.24 CCCOC1=CC(=CC=C1)N Z239604770 [1,1,0,0,0,0|2,0,0]=4 436 B11R1.24 CCCOC1=CC(=CC=C1)O Z381415572 [1,1,0,0,0,0|1,0,0]=3 437 B11R1.24 CCNCC1=CC(=CC=C1)Br Z1138763375 [1,1,0,0,0,0|2,0,0]=4 438 B11R1.24 CCNCC1=CC(=CC=C1)C Z90513252 [1,1,0,0,0,0|2,0,0]=4 439 B11R1.24 CCNCC1=CC(=CC=C1)Cl Z90513201 [1,1,0,0,0,0|2,0,0]=4 440 B11R1.24 CCNCC1=CC(=CC=C1)F Z85935746 [1,1,0,0,0,0|2,0,0]=4 441 B11R1.24 CCOCC1=CC(=CC=C1)N Z285163820 [1,1,0,0,0,0|2,0,0]=4 442 B11R1.24 CCSCC1=CC(=CC=C1)N Z332378038 [1,1,0,0,0,0|2,0,0]=4 443 B11R1.24 CNCCC1=CC(=CC=C1)Br Z2168282744 [1,1,0,0,0,0|1,0,0]=3 444 B11R1.24 CNCCC1=CC(=CC=C1)O Z4924737523 [1,1,0,0,0,0|0,0,0]=2 445 B11R1.24 CNCCC1=NC(=CC=N1)O Z3023572741 [1,1,0,0,0,0|2,0,0]=4 446 B11R1.24 COCCC1=CC(=CC=C1)O Z1513911027 [1,1,0,0,0,0|1,0,0]=3 447 B11R1.24 N#CCOC1=CC=CC(=C1)O Z381415714 [1,1,0,0,0,0|0,0,2]=4 448 B11R1.24 NC1=CC(=CC=C1)CCCO Z1198265859 [1,1,0,0,0,0|2,0,0]=4 449 B11R1.24 NC1=CC(=CC=C1)OCCF Z1262657442 [1,1,0,0,0,0|2,0,0]=4 450 B11R1.24 NCC#CC1=CC(=CC=C1)F Z2004547701 [1,1,0,0,0,0|1,0,1]=4 451 B11R1.24 NCCCC1=CC(=CC=C1)Br Z1266823414 [1,1,0,0,0,0|1,0,0]=3 452 B11R1.24 NCCCC1=CC(=CC=C1)Cl Z1262246154 [1,1,0,0,0,0|1,0,0]=3 453 B11R1.24 NCCCC1=CC(=CC=C1)F Z424782946 [1,1,0,0,0,0|1,0,0]=3 454 B11R1.24 NCCCC1=CC(=CC=C1)O Z1895582955 [1,1,0,0,0,0|0,0,0]=2 455 B11R1.24 NCCCC1=CC(=CN=C1)F Z4446765955 [1,1,0,0,0,0|2,0,0]=4 456 B11R1.24 NCCOC1=CC(=CC=C1)Br Z744843646 [1,1,0,0,0,0|1,0,0]=3 457 B11R1.24 NCCOC1=CC(=CC=C1)Cl Z425484860 [1,1,0,0,0,0|1,0,0]=3 458 B11R1.24 NCCOC1=CC(=CC=C1)F Z381785786 [1,1,0,0,0,0|1,0,0]=3 459 B11R1.24 O=CCCC1=CC=CC(=C1)Cl Z993017744 [1,1,0,0,0,0|2,0,0]=4 460 B11R1.24 O=CCCC1=CC=CC(=C1)F Z993017622 [1,1,0,0,0,0|2,0,0]=4 461 B11R1.24 OCCNC1=CC(=CC=C1)F Z335274246 [1,1,0,0,0,0|2,0,0]=4 462 B11R1.24 OCCOC1=CC(=CC=C1)Br Z335092356 [1,1,0,0,0,0|2,0,0]=4 463 B11R1.24 OCCOC1=CC(=CC=C1)Cl Z149166432 [1,1,0,0,0,0|2,0,0]=4 464 B11R1.34 CC1=NC(=CC(=C1)CCN)O Z4705455739 [1,1,0,0,0,0|1,0,0]=3 465 B11R1.34 CC1=NC(=CC(=N1)O)CCN Z5085493722 [1,1,0,0,0,0|2,0,0]=4 466 B11R1.34 CCCC1=CC(=CC(=C1)O)O Z367653796 [1,1,0,0,0,0|1,0,0]=3 467 B11R1.34 N#CCC1=CC(=CC(=C1)O)Br Z1269231080 [1,1,0,0,0,0|0,0,2]=4 468 B11R1.34 NCCC1=CC(=CC(=C1)Cl)Br Z2792040945 [1,1,0,0,0,0|1,0,0]=3 469 B11R1.34 NCCC1=CC(=CC(=C1)Cl)Cl Z452428348 [1,1,0,0,0,0|1,0,0]=3 470 B11R1.34 NCCC1=CC(=CC(=C1)F)Br Z4607596589 [1,1,0,0,0,0|1,0,0]=3 471 B11R1.34 NCCC1=CC(=CC(=C1)F)F Z905065808 [1,1,0,0,0,0|1,0,0]=3 472 B11R1.34 NCCC1=CC(=CC(=C1)O)F Z2902196615 [1,1,0,0,0,0|0,0,0]=2 473 B11R1.34 NCCC1=NC(=NC(=C1)O)N Z5385150450 [1,1,0,0,0,0|2,0,0]=4 474 B11R1.34 NCCC1=NC(=NC(=C1)O)S Z5262227277 [1,1,0,0,0,0|2,0,0]=4 475 B11R1.34 OCCC1=CC(=CC(=C1)Br)Br Z1269184216 [1,1,0,0,0,0|2,0,0]=4 476 B11R1.34 OCCC1=CC(=CC(=C1)Cl)Cl Z1201623278 [1,1,0,0,0,0|2,0,0]=4 477 B11R1.34 OCCC1=CC(=CC(=C1)O)Cl Z2237647506 [1,1,0,0,0,0|1,0,0]=3 478 B11R1.157 CC(C)CC1=CC(=CC=C1)I Z1618143122 [1,1,0,0,0,0|2,0,0]=4 479 B11R1.157 CC(C)NC1=CC(=CC=C1)O Z335562192 [1,1,0,0,0,0|2,0,0]=4 480 B11R1.157 CC(C)OC1=CC(=CC=C1)O Z381415570 [1,1,0,0,0,0|2,0,0]=4 481 B11R1.157 CC(N)CC1=CC(=CC=C1)Br Z1259341031 [1,1,0,0,0,0|1,0,0]=3 482 B11R1.157 CC(N)CC1=CC(=CC=C1)Cl Z425389644 [1,1,0,0,0,0|1,0,0]=3 483 B11R1.157 CC(N)CC1=CC(=CC=C1)O Z285144026 [1,1,0,0,0,0|0,0,0]=2 484 B11R1.157 CC(O)CC1=CC(=CC=C1)F Z513751286 [1,1,0,0,0,0|2,0,0]=4 485 B11R1.157 N=C(N)CC1=CC(=CC=C1)Br Z1636723568 [1,1,0,0,0,0|1,0,1]=4 486 B11R1.157 N=C(N)CC1=CC(=CC=C1)F Z1695709629 [1,1,0,0,0,0|1,0,1]=4 487 B11R1.157 NC(=O)CC1=CC(=CC=C1)Cl Z992289380 [1,1,0,0,0,0|1,0,1]=4 488 B11R1.157 NC(=O)CC1=CC(=CC=C1)I Z1419030795 [1,1,0,0,0,0|1,0,1]=4 489 B11R1.157 NC(=O)CC1=CC(=CC=C1)O Z816010252 [1,1,0,0,0,0|0,0,1]=3 490 B11R1.157 NC(=O)NC1=CC(=CC=C1)O Z335810106 [1,1,0,0,0,0|1,0,1]=4 491 B11R1.157 NC(=S)NC1=CC(=CC=C1)O Z199466960 [1,1,0,0,0,0|1,0,1]=4 492 B11R1.157 NC1=CC(=CC=C1)CC(F)F Z4075414750 [1,1,0,0,0,0|2,0,0]=4 493 B11R1.157 O=C(O)CC1=CC(=CC=C1)O Z816000338 [1,1,0,0,0,0|1,0,1]=4 494 B11R1.182 CC1=C(C=C(C=C1)F)CCN Z4751180899 [1,1,0,0,0,0|1,0,0]=3 495 B11R1.182 CCOC1=C(C=CC(=C1)O)N Z1837073495 [1,1,0,0,0,0|2,0,0]=4 496 B11R1.182 COCC1=C(C=CC(=C1)O)N Z1262683212 [1,1,0,0,0,0|2,0,0]=4 497 B11R1.182 NCCC1=C(C=CC(=C1)Br)F Z285143732 [1,1,0,0,0,0|1,0,0]=3 498 B11R1.182 NCCC1=C(C=CC(=C1)Cl)Br Z1474026680 [1,1,0,0,0,0|1,0,0]=3 499 B11R1.182 NCCC1=C(C=CC(=C1)Cl)Cl Z1268152320 [1,1,0,0,0,0|1,0,0]=3 500 B11R1.182 NCCC1=C(C=CC(=C1)F)Br Z3681530426 [1,1,0,0,0,0|1,0,0]=3 501 B11R1.182 NCCC1=C(C=CC(=C1)F)Cl Z4668068102 [1,1,0,0,0,0|1,0,0]=3 502 B11R1.182 NCCC1=C(C=CC(=C1)F)F Z415635654 [1,1,0,0,0,0|1,0,0]=3 503 B11R1.182 NCCC1=C(C=CC(=C1)O)Br Z3376089277 [1,1,0,0,0,0|0,0,0]=2 504 B11R1.182 NCCN1C=C(C=CC1=O)Br Z2235330324 [1,1,0,0,0,0|2,0,0]=4 505 B11R1.182 OCCC1=C(C=CC(=C1)Br)O Z1269218042 [1,1,0,0,0,0|2,0,0]=4 506 B11R1.189 CCCC1=CC(=CC=C1)C=O Z1216844686 [1,1,0,0,0,0|1,0,1]=4 507 B11R1.189 CCNC1=CC(=CC=C1)CO Z234896397 [1,1,0,0,0,0|2,0,0]=4 508 B11R1.189 CCNC1=CC(=CC=C1)OC Z286367386 [1,1,0,0,0,0|2,0,0]=4 509 B11R1.189 CNCC1=CC(=CC=C1)OC Z56939284 [1,1,0,0,0,0|2,0,0]=4 510 B11R1.189 COC1=CC(=CC=C1)CC#N Z285184582 [1,1,0,0,0,0|0,0,2]=4 511 B11R1.189 COC1=CC(=CC=C1)CCN Z285143778 [1,1,0,0,0,0|0,0,0]=2 512 B11R1.189 COC1=NC(=CC=C1)CCN Z1139189688 [1,1,0,0,0,0|1,0,0]=3 513 B11R1.189 COC1=NC(=NC=C1)CCN Z3678332979 [1,1,0,0,0,0|2,0,0]=4 514 B11R1.189 COC1=NC=CC(=C1)CCN Z2298160753 [1,1,0,0,0,0|1,0,0]=3 515 B11R1.189 COCC1=CC(=CC=C1)CO Z1266889515 [1,1,0,0,0,0|2,0,0]=4 516 B11R1.189 CSC1=CC(=CC=C1)CCN Z4873760169 [1,1,0,0,0,0|0,1,0]=3 517 B11R1.189 N#CC1=CC=CC(=C1)CCN Z1983080032 [1,1,0,0,0,0|1,0,0]=3 518 B11R1.189 N#CC1=CC=CC(=N1)CCN Z5211343009 [1,1,0,0,0,0|2,0,0]=4 519 B11R1.189 NCCC1=CC(=CC=C1)CO Z4741652081 [1,1,0,0,0,0|0,0,0]=2 520 B11R1.192 CC1=C(C=C(C=C1)CCN)C Z2526366647 [1,1,0,0,0,0|1,0,0]=3 521 B11R1.192 CC1=C(C=C(C=C1)CCN)Cl Z4330614334 [1,1,0,0,0,0|1,0,0]=3 522 B11R1.192 CC1=C(C=CC(=C1)CCN)Br Z1269233616 [1,1,0,0,0,0|1,0,0]=3 523 B11R1.192 CC1=C(C=CC(=C1)CCN)Cl Z1198178622 [1,1,0,0,0,0|1,0,0]=3 524 B11R1.192 CC1=C(C=CC(=C1)CCN)F Z1682072426 [1,1,0,0,0,0|1,0,0]=3 525 B11R1.192 NCCC1=CC(=C(C=C1)Br)Cl Z5222342336 [1,1,0,0,0,0|1,0,0]=3 526 B11R1.192 NCCC1=CC(=C(C=C1)Cl)Cl Z285143770 [1,1,0,0,0,0|1,0,0]=3 527 B11R1.192 NCCC1=CC(=C(C=C1)Cl)F Z2681241887 [1,1,0,0,0,0|1,0,0]=3 528 B11R1.192 NCCC1=CC(=C(C=C1)F)Br Z752370708 [1,1,0,0,0,0|1,0,0]=3 529 B11R1.192 NCCC1=CC(=C(C=C1)F)Cl Z4607148848 [1,1,0,0,0,0|1,0,0]=3 530 B11R1.192 NCCC1=CC(=C(C=C1)F)F Z1695670002 [1,1,0,0,0,0|1,0,0]=3 531 B11R1.192 NCCC1=CC(=C(C=C1)O)O Z104474032 [1,1,0,0,0,0|0,0,0]=2 532 B11R1.192 OCCC1=CC(=C(C=C1)Br)F Z1450935429 [1,1,0,0,0,0|2,0,0]=4 533 B11R1.192 OCCC1=CC(=C(C=C1)F)F Z1020788674 [1,1,0,0,0,0|2,0,0]=4 534 B11R1.192 OCCC1=CC(=C(C=C1)O)Cl Z1250886915 [1,1,0,0,0,0|2,0,0]=4 535 B11R1.7 CC(C)(CN)C1=CC=CC=C1 Z291234238 [1,1,0,0,0,0|1,0,0]=3 536 B11R1.7 CC(C)(CN)C1=CN=CC=C1 Z1255424681 [1,1,0,0,0,0|2,0,0]=4 537 B11R1.7 CC(C)(CO)C1=CC=CC=C1 Z397587218 [1,1,0,0,0,0|2,0,0]=4 538 B11R1.7 CC(F)(CN)C1=CC=CC=C1 Z2768234774 [1,1,0,0,0,0|1,0,0]=3 539 B11R1.7 CC(N)(CO)C1=CC=CC=C1 Z734150992 [1,1,0,0,0,0|2,0,0]=4 540 B11R1.7 CC(O)(CN)C1=CC=CC=C1 Z979721628 [1,1,0,0,0,0|0,0,0]=2 541 B11R1.7 CCC(C)(N)C1=CC=CC=C1 Z449373366 [1,1,0,0,0,0|2,0,0]=4 542 B11R1.7 CCC(C)(O)C1=CC=CC=C1 Z449373348 [1,1,0,0,0,0|1,0,0]=3 543 B11R1.7 NCC(F)(F)C1=CC=CC=C1 Z2168499583 [1,1,0,0,0,0|1,0,0]=3 544 B11R1.7 NCC(F)(F)C1=NC=CC=C1 Z1198184449 [1,1,0,0,0,0|2,0,0]=4 545 B11R1.12 CCC(C=O)C1=CC=CC=C1 Z1079132778 [1,1,0,0,0,0|1,0,1]=4 546 B11R1.12 CCC(CN)C1=CC=CC=C1 Z85956799 [1,1,0,0,0,0|1,0,0]=3 547 B11R1.12 CCC(CO)C1=CC=CC=C1 Z397587442 [1,1,0,0,0,0|1,0,0]=3 548 B11R1.12 CNC(CO)C1=CC=CC=C1 Z734147276 [1,1,0,0,0,0|2,0,0]=4 549 B11R1.12 COC(CN)C1=CC=CC=C1 Z285139084 [1,1,0,0,0,0|0,0,0]=2 550 B11R1.12 NCC(CO)C1=CC=CC=C1 Z1198168251 [1,1,0,0,0,0|0,0,0]=2 551 B11R1.12 OCC(CO)C1=CC=CC=C1 Z1255395467 [1,1,0,0,0,0|1,0,0]=3 552 B11R1.16 C#CCC(O)C1=CC=CC=C1 Z932373338 [1,1,0,0,0,0|1,0,0]=3 553 B11R1.16 CC(CC#N)C1=CC=CC=C1 Z1251357056 [1,1,0,0,0,0|1,0,1]=4 554 B11R1.16 CC(CC=O)C1=CC=CC=C1 Z57921394 [1,1,0,0,0,0|2,0,0]=4 555 B11R1.16 CCCC(O)C1=CC=CC=C1 Z335244704 [1,1,0,0,0,0|1,0,0]=3 556 B11R1.16 CN(CCN)C1=CC=CC=C1 Z154669318 [1,1,0,0,0,0|2,0,0]=4 557 B11R1.16 CNCC(C)C1=CC=CC=C1 Z57797325 [1,1,0,0,0,0|1,0,0]=3 558 B11R1.16 COCC(N)C1=CC=CC=C1 Z271013088 [1,1,0,0,0,0|2,0,0]=4 559 B11R1.16 CSCC(N)C1=CC=CC=C1 Z995116260 [1,1,0,0,0,0|2,0,0]=4 560 B11R1.16 N#CCC(N)C1=CC=CC=C1 Z1415893991 [1,1,0,0,0,0|1,0,1]=4 561 B11R1.16 NC(CCO)C1=CC=CC=C1 Z382816560 [1,1,0,0,0,0|2,0,0]=4 562 B11R1.16 NCCC(O)C1=CC=CC=C1 Z1020673398 [1,1,0,0,0,0|0,0,0]=2 563 B11R1.16 NCCS(=O)C1=CC=CC=C1 Z1266854955 [1,1,0,0,0,0|1,0,1]=4 564 B11R1.16 O[C@@H](CCCl)C1=CC=CC=C1 Z1255427232 [1,1,0,0,0,0|1,0,0]=3 565 B11R1.16 O[C@H](CCCl)C1=CC=CC=C1 Z1255356297 [1,1,0,0,0,0|1,0,0]=3 566 B11R1.22 CC(CN)C1=CC=C(C=C1)Br Z2906280360 [1,1,0,0,0,0|1,0,0]=3 567 B11R1.22 CC(CN)C1=CC=C(C=C1)F Z415654954 [1,1,0,0,0,0|1,0,0]=3 568 B11R1.22 CC(CO)C1=CC=C(C=C1)F Z1255440783 [1,1,0,0,0,0|2,0,0]=4 569 B11R1.22 CC1=CC=C(C=C1)C(=O)CN Z275368898 [1,1,0,0,0,0|0,0,2]=4 570 B11R1.22 CC1=CC=C(C=C1)C(C)CN Z415654970 [1,1,0,0,0,0|1,0,0]=3 571 B11R1.22 CC1=CC=C(C=C1)C(N)CF Z2474474695 [1,1,0,0,0,0|2,0,0]=4 572 B11R1.22 CC1=CC=C(C=C1)C(N)CO Z5087131901 [1,1,0,0,0,0|2,0,0]=4 573 B11R1.22 CC1=CC=C(C=C1)C(O)CN Z336086536 [1,1,0,0,0,0|0,0,0]=2 574 B11R1.22 CC1=CC=C(C=C1)[C@@H](O)CN Z1895741843 [1,1,0,0,0,0|0,0,0]=2 575 B11R1.22 CCC(C)C1=CC=C(C=C1)O Z104484172 [1,1,0,0,0,0|2,0,0]=4 576 B11R1.22 CCC(N)C1=CC=C(C=C1)Br Z90662172 [1,1,0,0,0,0|2,0,0]=4 577 B11R1.22 CCC(N)C1=CC=C(C=C1)C Z90662186 [1,1,0,0,0,0|2,0,0]=4 578 B11R1.22 CCC(N)C1=CC=C(C=C1)Cl Z221421644 [1,1,0,0,0,0|2,0,0]=4 579 B11R1.22 CCC(O)C1=CC=C(C=C1)C Z228586316 [1,1,0,0,0,0|1,0,0]=3 580 B11R1.22 CCC(O)C1=CC=C(C=C1)Cl Z228586168 [1,1,0,0,0,0|1,0,0]=3 581 B11R1.22 CCC(O)C1=CC=C(C=C1)F Z228586174 [1,1,0,0,0,0|1,0,0]=3 582 B11R1.22 CCC(O)C1=CC=C(C=C1)O Z228586170 [1,1,0,0,0,0|1,0,0]=3 583 B11R1.22 CCC(O)C1=NC=C(C=C1)F Z1341678257 [1,1,0,0,0,0|2,0,0]=4 584 B11R1.22 CC[C@@H](N)C1=CC=C(C=C1)F Z1626921240 [1,1,0,0,0,0|2,0,0]=4 585 B11R1.22 CC[C@H](N)C1=CC=C(C=C1)F Z1625822291 [1,1,0,0,0,0|2,0,0]=4 586 B11R1.22 NC(CF)C1=CC=C(C=C1)Cl Z1510155807 [1,1,0,0,0,0|2,0,0]=4 587 B11R1.22 NC(CO)C1=CC=C(C=C1)Br Z2188171600 [1,1,0,0,0,0|2,0,0]=4 588 B11R1.22 NC(CO)C1=CC=C(C=C1)F Z1268152327 [1,1,0,0,0,0|2,0,0]=4 589 B11R1.22 NCC(=O)C1=CC=C(C=C1)Br Z1741980207 [1,1,0,0,0,0|0,0,2]=4 590 B11R1.22 NCC(=O)C1=CC=C(C=C1)Cl Z56928681 [1,1,0,0,0,0|0,0,2]=4 591 B11R1.22 NCC(=O)C1=CC=C(C=C1)F Z275365838 [1,1,0,0,0,0|0,0,2]=4 592 B11R1.22 NCC(=O)C1=CC=C(C=C1)O Z1198177329 [1,1,0,0,0,0|0,0,2]=4 593 B11R1.22 NCC(O)C1=CC=C(C=C1)Cl Z295878600 [1,1,0,0,0,0|0,0,0]=2 594 B11R1.36 CC(C(=O)N)C1=CC=CC=C1 Z1255506457 [1,1,0,0,0,0|1,0,1]=4 595 B11R1.36 CC(C)C(O)C1=NC=CC=C1 Z513749462 [1,1,0,0,0,0|2,0,0]=4 596 B11R1.36 CC(N)C(C)C1=CC=CC=C1 Z1203578901 [1,1,0,0,0,0|1,0,0]=3 597 B11R1.36 CC(N)C(O)C1=CC=NC=C1 Z1263602353 [1,1,0,0,0,0|1,0,0]=3 598 B11R1.36 CC(O)C(N)C1=CC=CC=C1 Z2588063686 [1,1,0,0,0,0|2,0,0]=4 599 B11R1.36 NC(=O)C(Cl)C1=CC=CC=C1 Z57069256 [1,1,0,0,0,0|1,0,1]=4 600 B11R1.36 NC(=O)C(N)C1=CC=CC=C1 Z57204607 [1,1,0,0,0,0|1,0,1]=4 601 B11R1.36 NC(C1=CC=CC=C1)C(F)F Z2211231766 [1,1,0,0,0,0|2,0,0]=4 602 B11R1.36 O=C(O)C(O)C1=CC=CC=C1 Z104473974 [1,1,0,0,0,0|1,0,1]=4 603 B11R1.36 O=C(O)[C@@H](O)C1=CC=CC=C1 Z1201618616 [1,1,0,0,0,0|1,0,1]=4 604 B11R1.36 O=C(O)[C@H](O)C1=CC=CC=C1 Z1255390767 [1,1,0,0,0,0|1,0,1]=4 605 B11R1.222 CC1=C(C=CC=C1)C(=O)CN Z1741966378 [1,1,0,0,0,0|0,0,2]=4 606 B11R1.222 CC1=C(C=CC=C1)C(N)CF Z3092528504 [1,1,0,0,0,0|2,0,0]=4 607 B11R1.222 CC1=C(C=CC=C1)C(N)CO Z385458414 [1,1,0,0,0,0|2,0,0]=4 608 B11R1.222 CC1=C(C=CC=C1)C(O)CN Z336086534 [1,1,0,0,0,0|0,0,0]=2 609 B11R1.222 CCC(N)C1=C(C=CC=C1)Br Z851790482 [1,1,0,0,0,0|2,0,0]=4 610 B11R1.222 CCC(N)C1=C(C=CC=C1)O Z1266854970 [1,1,0,0,0,0|2,0,0]=4 611 B11R1.222 NC(CF)C1=C(C=CC=C1)Br Z4444282330 [1,1,0,0,0,0|2,0,0]=4 612 B11R1.222 NC(CO)C1=C(C=CC=C1)F Z1268152413 [1,1,0,0,0,0|2,0,0]=4 613 B11R1.222 NC(CO)C1=C(C=CC=C1)I Z2941400807 [1,1,0,0,0,0|2,0,0]=4 614 B11R1.222 NCC(=O)C1=C(C=CC=C1)Br Z1262691661 [1,1,0,0,0,0|0,0,2]=4 615 B11R1.222 NCC(=O)C1=C(C=CC=C1)Cl Z1695906936 [1,1,0,0,0,0|0,0,2]=4 616 B11R1.222 NCC(=O)C1=C(C=CC=C1)F Z1741977084 [1,1,0,0,0,0|0,0,2]=4 617 B11R1.222 NCC(O)C1=C(C=CC=C1)Cl Z1255523275 [1,1,0,0,0,0|0,0,0]=2 618 B11R1.21 CC(=O)C1=CC(=C(C=C1)C)O Z1198169413 [1,1,0,0,0,0|0,0,2]=4 619 B11R1.21 CC(=O)C1=CC(=C(C=C1)F)O Z1201626572 [1,1,0,0,0,0|0,0,2]=4 620 B11R1.21 CC(=O)C1=CC(=C(C=C1)N)O Z1198158301 [1,1,0,0,0,0|0,0,2]=4 621 B11R1.21 CC(Br)C1=CC(=C(C=C1)Cl)Cl Z381392948 [1,1,0,0,0,0|2,0,0]=4 622 B11R1.21 CC(Br)C1=CC(=C(C=C1)F)Cl Z381393046 [1,1,0,0,0,0|2,0,0]=4 623 B11R1.21 CC(C)C1=CC(=C(C=C1)F)N Z4722235861 [1,1,0,0,0,0|2,0,0]=4 624 B11R1.21 CC(C)C1=CC(=C(C=C1)N)Cl Z1262643307 [1,1,0,0,0,0|2,0,0]=4 625 B11R1.21 CC(C)C1=CC(=C(C=C1)N)N Z1198154332 [1,1,0,0,0,0|2,0,0]=4 626 B11R1.21 CC(C)C1=CC(=C(C=C1)O)N Z57441596 [1,1,0,0,0,0|2,0,0]=4 627 B11R1.21 CC(N)C1=CC(=C(C=C1)Br)F Z3213740225 [1,1,0,0,0,0|2,0,0]=4 628 B11R1.21 CC(N)C1=CC(=C(C=C1)Br)O Z1551939587 [1,1,0,0,0,0|1,0,0]=3 629 B11R1.21 CC(N)C1=CC(=C(C=C1)Cl)Cl Z56347253 [1,1,0,0,0,0|2,0,0]=4 630 B11R1.21 CC(N)C1=CC(=C(C=C1)Cl)F Z1198724032 [1,1,0,0,0,0|2,0,0]=4 631 B11R1.21 CC(N)C1=CC(=C(C=C1)F)Cl Z335437988 [1,1,0,0,0,0|2,0,0]=4 632 B11R1.21 CC(N)C1=CC(=C(C=C1)O)O Z4958589100 [1,1,0,0,0,0|1,0,0]=3 633 B11R1.21 CC(O)C1=CC(=C(C=C1)Br)F Z1436188584 [1,1,0,0,0,0|1,0,0]=3 634 B11R1.21 CC(O)C1=CC(=C(C=C1)Cl)Cl Z335245002 [1,1,0,0,0,0|1,0,0]=3 635 B11R1.21 CC(O)C1=CC(=C(C=C1)F)Cl Z335438560 [1,1,0,0,0,0|1,0,0]=3 636 B11R1.21 CC(O)C1=CC(=C(C=C1)F)F Z228586306 [1,1,0,0,0,0|1,0,0]=3 637 B11R1.21 CC1=C(C=C(C=C1)C(=O)N)O Z323032498 [1,1,0,0,0,0|0,0,2]=4 638 B11R1.21 CC1=C(C=C(C=C1)C(=O)O)O Z166652050 [1,1,0,0,0,0|1,0,1]=4 639 B11R1.21 CC1=C(C=C(C=C1)C(C)C)O Z104496566 [1,1,0,0,0,0|1,0,0]=3 640 B11R1.21 CC1=C(C=C(C=C1)C(C)N)C Z285186052 [1,1,0,0,0,0|2,0,0]=4 641 B11R1.21 CC1=C(C=C(C=C1)C(C)N)F Z363990474 [1,1,0,0,0,0|2,0,0]=4 642 B11R1.21 CC1=C(C=C(C=C1)[C@@H](C)O)C Z360055396 [1,1,0,0,0,0|1,0,0]=3 643 B11R1.21 CC1=C(C=C(C=C1)[C@H](C)O)C Z360055400 [1,1,0,0,0,0|1,0,0]=3 644 B11R1.21 CC1=C(C=CC(=C1)C(C)N)F Z1359429587 [1,1,0,0,0,0|2,0,0]=4 645 B11R1.21 C[C@@H](N)C1=CC(=C(C=C1)F)Br Z1696091701 [1,1,0,0,0,0|2,0,0]=4 646 B11R1.21 C[C@@H](N)C1=CC(=C(C=C1)F)Cl Z1127664214 [1,1,0,0,0,0|2,0,0]=4 647 B11R1.21 C[C@@H](O)C1=CC(=C(C=C1)Cl)Cl Z360055342 [1,1,0,0,0,0|1,0,0]=3 648 B11R1.21 C[C@@H](O)C1=CC(=C(C=C1)F)Cl Z1127664454 [1,1,0,0,0,0|1,0,0]=3 649 B11R1.21 C[C@@H](O)C1=CC(=C(C=C1)F)F Z360055916 [1,1,0,0,0,0|1,0,0]=3 650 B11R1.21 C[C@H](N)C1=CC(=C(C=C1)Cl)Cl Z1962166972 [1,1,0,0,0,0|2,0,0]=4 651 B11R1.21 C[C@H](N)C1=CC(=C(C=C1)F)Br Z360056272 [1,1,0,0,0,0|2,0,0]=4 652 B11R1.21 C[C@H](O)C1=CC(=C(C=C1)Cl)Cl Z360055344 [1,1,0,0,0,0|1,0,0]=3 653 B11R1.21 C[C@H](O)C1=CC(=C(C=C1)F)Br Z360056260 [1,1,0,0,0,0|1,0,0]=3 654 B11R1.21 C[C@H](O)C1=CC(=C(C=C1)F)Cl Z1127664340 [1,1,0,0,0,0|1,0,0]=3 655 B11R1.21 C[C@H](O)C1=CC(=C(C=C1)F)F Z360055912 [1,1,0,0,0,0|1,0,0]=3 656 B11R1.21 NC(=O)C1=CC(=C(C=C1)Br)O Z1269119521 [1,1,0,0,0,0|0,0,2]=4 657 B11R1.21 NC(=O)C1=CC(=C(C=C1)N)O Z1126161217 [1,1,0,0,0,0|0,0,2]=4 658 B11R1.21 NC(=O)C1=CC(=C(C=C1)O)O Z1198152898 [1,1,0,0,0,0|0,0,2]=4 659 B11R1.21 NC1=C(C=C(C=C1)C(=O)O)O Z431554234 [1,1,0,0,0,0|1,0,1]=4 660 B11R1.21 O=C(O)C1=CC(=C(C=C1)Br)O Z1269234103 [1,1,0,0,0,0|1,0,1]=4 661 B11R1.21 O=C(O)C1=CC(=C(C=C1)Cl)O Z1201619372 [1,1,0,0,0,0|1,0,1]=4 662 B11R1.21 O=C(O)C1=CC(=C(C=C1)F)O Z1203161962 [1,1,0,0,0,0|1,0,1]=4 663 B11R1.21 O=C(O)C1=CC(=C(C=C1)I)O Z1269202149 [1,1,0,0,0,0|1,0,1]=4 664 B11R1.21 O=C(O)C1=CC(=C(C=C1)O)O Z104501142 [1,1,0,0,0,0|1,0,1]=4 665 B11R1.74 CC(=O)C1=CC(=CC(=C1)O)F Z1255392410 [1,1,0,0,0,0|0,0,2]=4 666 B11R1.74 CC(=O)C1=CC(=CC(=C1)O)O Z1696862457 [1,1,0,0,0,0|0,0,2]=4 667 B11R1.74 CC(C)C1=CC(=CC(=C1)N)F Z4946679480 [1,1,0,0,0,0|2,0,0]=4 668 B11R1.74 CC(C)C1=CC(=CC(=O)O1)O Z1198170475 [1,1,0,0,0,0|2,0,0]=4 669 B11R1.74 CC(O)C1=CC(=CC(=C1)F)F Z838968736 [1,1,0,0,0,0|1,0,0]=3 670 B11R1.74 CC1=CC(=CC(=C1)Br)C(C)N Z3083106287 [1,1,0,0,0,0|2,0,0]=4 671 B11R1.74 CC1=CC(=CC(=C1)C(C)N)C Z608067962 [1,1,0,0,0,0|2,0,0]=4 672 B11R1.74 CC1=CC(=CC(=C1)O)C(=O)O Z1198232670 [1,1,0,0,0,0|1,0,1]=4 673 B11R1.74 CC1=CC(=CC(=C1)O)C(C)C Z104479096 [1,1,0,0,0,0|1,0,0]=3 674 B11R1.74 NC(=O)C1=CC(=CC(=C1)O)Br Z1269113277 [1,1,0,0,0,0|0,0,2]=4 675 B11R1.74 NC1=CC(=CC(=C1)O)C(=O)O Z1198170625 [1,1,0,0,0,0|1,0,1]=4 676 B11R1.74 O=C(O)C1=CC(=CC(=C1)O)Cl Z1198164258 [1,1,0,0,0,0|1,0,1]=4 677 B11R1.74 O=C(O)C1=CC(=CC(=C1)O)O Z1255485190 [1,1,0,0,0,0|1,0,1]=4 678 B11R1.74 OB(O)C1=CC(=CC(=C1)O)F Z1201623977 [1,1,0,0,0,0|2,0,0]=4 679 B11R1.155 CC(C)(C)C1=NC(=CC=C1)O Z1255380255 [1,1,0,0,0,0|2,0,0]=4 680 B11R1.155 CC(C)(N)C1=CC(=CC=C1)Br Z3037488222 [1,1,0,0,0,0|2,0,0]=4 681 B11R1.155 CC(C)(N)C1=CC(=CC=C1)Cl Z449374238 [1,1,0,0,0,0|2,0,0]=4 682 B11R1.155 CC(C)(N)C1=CC(=CC=C1)F Z449374128 [1,1,0,0,0,0|2,0,0]=4 683 B11R1.155 CC(C)(O)C1=CC(=CC=C1)Cl Z449374152 [1,1,0,0,0,0|1,0,0]=3 684 B11R1.155 CC(C)(O)C1=CC(=CC=C1)N Z1262641436 [1,1,0,0,0,0|1,0,0]=3 685 B11R1.155 CC(F)(F)C1=CC(=CC=C1)N Z1753013071 [1,1,0,0,0,0|2,0,0]=4 686 B11R1.155 CS(=O)(=O)C1=CC(=CC=C1)O Z415743792 [1,1,0,0,0,0|1,0,1]=4 687 B11R1.155 NS(=O)(=O)C1=CC(=CC=C1)O Z1255464009 [1,1,0,0,0,0|1,0,1]=4 688 B11R1.155 OC1=CC(=CC=C1)C(F)(F)F Z104476676 [1,1,0,0,0,0|2,0,0]=4 689 B11R1.159 CC(=O)C1=C(C(=CC=C1)O)F Z1255400699 [1,1,0,0,0,0|0,0,2]=4 690 B11R1.159 CC(=O)C1=C(C(=CC=C1)O)O Z1198162545 [1,1,0,0,0,0|0,0,2]=4 691 B11R1.159 CC(C)C1=C(C(=CC=C1)F)N Z4997400271 [1,1,0,0,0,0|2,0,0]=4 692 B11R1.159 CC(N)C1=C(C(=CC=C1)Cl)Cl Z1020772524 [1,1,0,0,0,0|2,0,0]=4 693 B11R1.159 CC(N)C1=C(C(=CC=C1)F)F Z1713595336 [1,1,0,0,0,0|2,0,0]=4 694 B11R1.159 CC1=C(C=CC=C1Br)C(C)N Z4950451632 [1,1,0,0,0,0|2,0,0]=4 695 B11R1.159 CC1=C(C=CC=C1Cl)C(C)N Z4554633933 [1,1,0,0,0,0|2,0,0]=4 696 B11R1.159 CC1=C(C=CC=C1N)C(C)C Z2740750367 [1,1,0,0,0,0|2,0,0]=4 697 B11R1.159 CC1=C(C=CC=C1O)C(=O)O Z1201620461 [1,1,0,0,0,0|1,0,1]=4 698 B11R1.159 CC1=CC=CC(=C1C)C(C)N Z992749600 [1,1,0,0,0,0|2,0,0]=4 699 B11R1.159 CC1=CC=CC(=C1N)C(C)C Z3676142304 [1,1,0,0,0,0|2,0,0]=4 700 B11R1.159 NC(=O)C1=C(C(=CC=C1)O)N Z1255418231 [1,1,0,0,0,0|0,0,2]=4 701 B11R1.159 NC1=C(C=CC=C1O)C(=O)O Z1255485352 [1,1,0,0,0,0|1,0,1]=4 702 B11R1.159 O=C(O)C1=C(C(=CC=C1)O)Cl Z1198219365 [1,1,0,0,0,0|1,0,1]=4 703 B11R1.159 O=C(O)C1=C(C(=CC=C1)O)F Z1201621446 [1,1,0,0,0,0|1,0,1]=4 704 B11R1.159 O=C(O)C1=C(C(=CC=C1)O)O Z367679198 [1,1,0,0,0,0|1,0,1]=4 705 B11R1.159 OB(O)C1=C(C(=CC=C1)O)Cl Z1255426136 [1,1,0,0,0,0|2,0,0]=4 706 B11R1.159 OB(O)C1=C(C(=CC=C1)O)F Z1198170548 [1,1,0,0,0,0|2,0,0]=4 707 B11R1.167 CC(=O)C1=C(C=CC(=C1)O)F Z1198184516 [1,1,0,0,0,0|0,0,2]=4 708 B11R1.167 CC(=O)C1=C(C=CC(=C1)O)N Z1255417279 [1,1,0,0,0,0|0,0,2]=4 709 B11R1.167 CC(=O)C1=C(C=CC(=C1)O)O Z56889030 [1,1,0,0,0,0|0,0,2]=4 710 B11R1.167 CC(C)C1=C(C=CC(=C1)Br)O Z1269143433 [1,1,0,0,0,0|2,0,0]=4 711 B11R1.167 CC(C)C1=C(C=CC(=C1)Cl)N Z2679866520 [1,1,0,0,0,0|2,0,0]=4 712 B11R1.167 CC(C)C1=C(C=CC(=C1)N)F Z5052153913 [1,1,0,0,0,0|2,0,0]=4 713 B11R1.167 CC(C)C1=C(C=CC(=C1)N)O Z1255375171 [1,1,0,0,0,0|2,0,0]=4 714 B11R1.167 CC(N)C1=C(C=CC(=C1)Br)F Z4604865350 [1,1,0,0,0,0|2,0,0]=4 715 B11R1.167 CC(N)C1=C(C=CC(=C1)Cl)Cl Z239627076 [1,1,0,0,0,0|2,0,0]=4 716 B11R1.167 CC(N)C1=C(C=CC(=C1)O)O Z4607148493 [1,1,0,0,0,0|1,0,0]=3 717 B11R1.167 CC(O)C1=C(C=CC(=C1)Br)N Z1509409907 [1,1,0,0,0,0|1,0,0]=3 718 B11R1.167 CC(O)C1=C(C=CC(=C1)Cl)Cl Z335244918 [1,1,0,0,0,0|1,0,0]=3 719 B11R1.167 CC(O)C1=C(C=CC(=C1)F)F Z228586372 [1,1,0,0,0,0|1,0,0]=3 720 B11R1.167 CC(O)C1=C(C=CC(=C1)I)Br Z1947410581 [1,1,0,0,0,0|1,0,0]=3 721 B11R1.167 CC1=C(C=C(C=C1)O)C(=O)N Z1255405404 [1,1,0,0,0,0|0,0,2]=4 722 B11R1.167 CC1=C(C=C(C=C1)O)C(=O)O Z1255379858 [1,1,0,0,0,0|1,0,1]=4 723 B11R1.167 CC1=CC(=C(C=C1)C)C(C)N Z56347427 [1,1,0,0,0,0|2,0,0]=4 724 B11R1.167 CC1=CC(=C(C=C1)C)[C@@H](C)O Z360055836 [1,1,0,0,0,0|1,0,0]=3 725 B11R1.167 CC1=CC(=C(C=C1)C)[C@H](C)O Z360055834 [1,1,0,0,0,0|1,0,0]=3 726 B11R1.167 C[C@@H](N)C1=C(C=CC(=C1)F)F Z360056102 [1,1,0,0,0,0|2,0,0]=4 727 B11R1.167 C[C@@H](O)C1=C(C=CC(=C1)Cl)Cl Z360055424 [1,1,0,0,0,0|1,0,0]=3 728 B11R1.167 C[C@@H](O)C1=C(C=CC(=C1)Cl)F Z1245781311 [1,1,0,0,0,0|1,0,0]=3 729 B11R1.167 C[C@H](O)C1=C(C=CC(=C1)Cl)Cl Z360055428 [1,1,0,0,0,0|1,0,0]=3 730 B11R1.167 C[C@H](O)C1=C(C=CC(=C1)Cl)F Z1245781230 [1,1,0,0,0,0|1,0,0]=3 731 B11R1.167 C[C@H](O)C1=C(C=CC(=C1)F)F Z360056062 [1,1,0,0,0,0|1,0,0]=3 732 B11R1.167 NC1=C(C=C(C=C1)O)C(=O)O Z104474092 [1,1,0,0,0,0|1,0,1]=4 733 B11R1.167 O=C(O)C1=C(C=CC(=C1)O)Cl Z1201622697 [1,1,0,0,0,0|1,0,1]=4 734 B11R1.167 O=C(O)C1=C(C=CC(=C1)O)O Z275164274 [1,1,0,0,0,0|1,0,1]=4 735 B11R1.167 OC1=CC(=C(C=C1)Br)C(F)F Z1269214404 [1,1,0,0,0,0|2,0,0]=4 736 B11R1.266 CC(=O)C1=CC(=CC=C1)CO Z1255384632 [1,1,0,0,0,0|0,0,2]=4 737 B11R1.266 CC(C)C1=CC(=CC=C1)C=O Z1162448800 [1,1,0,0,0,0|1,0,1]=4 738 B11R1.266 CC(C)C1=NC(=CC=C1)CO Z1216820960 [1,1,0,0,0,0|2,0,0]=4 739 B11R1.266 CC(O)C1=CC(=CC=C1)C#N Z445987342 [1,1,0,0,0,0|1,0,0]=3 740 B11R1.266 CNC1=CC(=CC=C1)C(C)C Z362639302 [1,1,0,0,0,0|2,0,0]=4 741 B11R1.266 COC1=CC(=CC=C1)B(O)O Z381513356 [1,1,0,0,0,0|2,0,0]=4 742 B11R1.266 COC1=CC(=CC=C1)C(=N)N Z1263714060 [1,1,0,0,0,0|1,0,1]=4 743 B11R1.266 COC1=CC(=CC=C1)C(=O)C Z54179675 [1,1,0,0,0,0|0,0,2]=4 744 B11R1.266 COC1=CC(=CC=C1)C(=O)O Z57127526 [1,1,0,0,0,0|1,0,1]=4 745 B11R1.266 COC1=CC(=CC=C1)C(=S)N Z56950570 [1,1,0,0,0,0|0,1,1]=4 746 B11R1.266 COC1=CC(=CC=C1)C(C)O Z228586154 [1,1,0,0,0,0|0,0,0]=2 747 B11R1.266 COC1=CC(=CC=C1)[C@@H](C)O Z360055364 [1,1,0,0,0,0|0,0,0]=2 748 B11R1.266 COC1=CC(=CC=C1)[C@H](C)O Z360055368 [1,1,0,0,0,0|0,0,0]=2 749 B11R1.266 COC1=NC(=CC=C1)C(C)O Z1216820543 [1,1,0,0,0,0|1,0,0]=3 750 B11R1.266 C[C@@H](O)C1=CC(=CC=C1)C#N Z1127664498 [1,1,0,0,0,0|1,0,0]=3 751 B11R1.266 C[C@@H](O)C1=CC(=CC=C1)C=O Z1511906513 [1,1,0,0,0,0|0,0,1]=3 752 B11R1.266 C[C@H](O)C1=CC(=CC=C1)C#N Z1127664384 [1,1,0,0,0,0|1,0,0]=3 753 B11R1.266 NC(=O)C1=CC(=CC=C1)CO Z431951860 [1,1,0,0,0,0|0,0,2]=4 754 B11R1.266 O=C(O)C1=CC=CC(=C1)CO Z385458084 [1,1,0,0,0,0|1,0,1]=4 755 B11R1.266 OCC1=CC(=CC=C1)B(O)O Z381040332 [1,1,0,0,0,0|2,0,0]=4 756 B11R1.6 CC1=CC=C(O1)C(C)(O)CN Z1251333047 [0,1,0,0,1,0|2,0,0]=4 757 B13R1.81 COC1=CC(=CC=C1)NC(=O)CN Z1449747347 [0,1,0,0,0,1|0,0,2]=4 758 B13R1.81 COC1=CC(=CC=C1)OC(C)CN Z844631912 [0,1,0,0,0,1|1,0,0]=3 759 B13R1.146 CC1=CC(=CC=C1)CC(CN)CO Z285055118 [0,1,0,0,0,1|1,0,0]=3 760 B13R1.146 CCC(CN)CC1=CC(=CC=C1)Br Z992310008 [0,1,0,0,0,1|2,0,0]=4 761 B13R1.146 CCC(CN)OC1=CC(=CC=C1)C Z1696822317 [0,1,0,0,0,1|2,0,0]=4 762 B13R1.146 CCC(CN)OC1=CC(=CC=C1)Cl Z1381260607 [0,1,0,0,0,1|2,0,0]=4 763 B13R1.146 CCC(CN)OC1=CC(=CC=C1)F Z851005008 [0,1,0,0,0,1|2,0,0]=4 764 B13R1.146 NCC(CO)CC1=CC(=CC=C1)F Z285055090 [0,1,0,0,0,1|1,0,0]=3 765 B13R1.148 CC(OC1=CC(=CC=C1)O)C(=O)N Z381415416 [0,1,0,0,0,1|1,0,1]=4 766 B13R1.250 CC(C)(CN)CC1=CC(=CC=C1)Br Z2235409208 [0,1,0,0,0,1|2,0,0]=4 767 B13R1.250 CC(C)(CN)CC1=CC(=CC=C1)Cl Z995183126 [0,1,0,0,0,1|2,0,0]=4 768 B13R1.250 NCC(F)(F)OC1=CC(=CC=C1)Br Z4201275137 [0,1,0,0,0,1|2,0,0]=4 769 B13R1.7 CC(C)(CN)C1=C(C(=CC=C1)Cl)F Z1708090075 [0,2,0,0,0,0|2,0,0]=4 770 B13R1.260 NCC(F)(F)C1=CC(=CC(=C1)F)F Z2784090230 [0,2,0,0,0,0|2,0,0]=4 771 B13R1.272 CC(C)(CN)C1=CC(=C(C=C1)Cl)Cl Z725146602 [0,2,0,0,0,0|2,0,0]=4 772 B13R1.272 NCC(F)(F)C1=CC(=C(C=C1)Cl)Cl Z3786926754 [0,2,0,0,0,0|2,0,0]=4 773 B13R1.3040 COC1=CC(=CC=C1)C(C)(C)CN Z801752006 [0,2,0,0,0,0|1,0,0]=3 774 B13R1.3040 COC1=CC(=CC=C1)C(F)(F)CN Z4188715617 [0,2,0,0,0,0|1,0,0]=3 775 B13R1.3040 COC1=NC(=CC=C1)C(F)(F)CN Z4079425337 [0,2,0,0,0,0|2,0,0]=4 776 B13R1.331 COC(CO)C1=CC(=C(C=C1)O)O Z1278927336 [0,2,0,0,0,0|1,0,0]=3 777 B13R1.646 CCC(NC)C1=CC(=CC=C1)OC Z513792210 [0,2,0,0,0,0|2,0,0]=4 778 B13R1.646 COC1=CC=CC(=C1)C(CN)OC Z2670815973 [0,2,0,0,0,0|0,0,0]=2 779 B13R1.716 CCC(C(=O)O)C1=CC(=CC=C1)Cl Z982130900 [0,2,0,0,0,0|2,0,0]=4 780 B13R1.716 CN(C)C(CN)C1=CC(=CC=C1)F Z56347489 [0,2,0,0,0,0|2,0,0]=4 781 B13R1.18 CCNCC(C)C1=CC(=CC=C1)Br Z3196419994 [0,2,0,0,0,0|2,0,0]=4 782 B13R1.18 CCNCC(O)C1=CC(=CC=C1)O Z56836691 [0,2,0,0,0,0|0,0,0]=2 783 B13R1.147 CC1=CC=CC(=C1)C(N)CN(C)C Z802853060 [0,2,0,0,0,0|2,0,0]=4 784 B13R1.147 NC(=O)C[C@@H](N)C1=CC(=CC=C1)Cl Z1346385500 [0,2,0,0,0,0|2,0,0]=4 785 B13R1.147 NC(=O)C[C@H](N)C1=CC(=CC=C1)Cl Z756926892 [0,2,0,0,0,0|2,0,0]=4 786 B13R1.147 NC(CC(=O)O)C1=CC(=CC=C1)O Z352252742 [0,2,0,0,0,0|2,0,0]=4 787 B13R1.147 O=C(O)CC(O)C1=CC(=CC=C1)F Z982132016 [0,2,0,0,0,0|2,0,0]=4 788 B13R1.446 NCCC(=O)C1=C(C=CC(=C1)O)N Z5003485462 [0,2,0,0,0,0|0,0,2]=4 789 B13R1.460 CCNC(C)C1=CC(=CC=C1)OC Z398513626 [0,2,0,0,0,0|2,0,0]=4 790 B13R1.466 CNCC(O)C1=CC(=C(C=C1)O)C Z1262591397 [0,2,0,0,0,0|1,0,0]=3 791 B13R1.466 CNC[C@@H](O)C1=CC(=C(C=C1)O)O Z1198154207 [0,2,0,0,0,0|0,0,0]=2 792 B13R1.466 CNC[C@H](O)C1=CC(=C(C=C1)O)O Z1255449978 [0,2,0,0,0,0|0,0,0]=2 793 B13R1.466 NCCC(O)C1=CC(=C(C=C1)Cl)Cl Z1258890570 [0,2,0,0,0,0|1,0,0]=3 794 B13R1.510 CC(N)C(O)C1=CC(=C(C=C1)F)F Z1342208384 [0,2,0,0,0,0|1,0,0]=3 795 B13R1.510 CC1=C(C=CC(=C1)C(O)C(C)N)F Z4133752082 [0,2,0,0,0,0|1,0,0]=3 796 B13R1.3492 CC1=CC(=CC=C1)C(O)C(F)(F)F Z1603855707 [0,2,0,0,0,0|2,0,0]=4 797 B13R1.3492 OC(C1=CC(=CC=C1)Br)C(F)(F)F Z838950512 [0,2,0,0,0,0|2,0,0]=4 798 B13R1.3492 OC(C1=CC(=CC=C1)Cl)C(F)(F)F Z838950482 [0,2,0,0,0,0|2,0,0]=4 799 B13R1.2209 COC1=C(C=C(C=C1)Cl)C(O)CN Z1269169332 [0,2,0,0,0,0|1,0,0]=3 800 B13R1.314 COC1=CC(=CC(=C1)Cl)C(=O)CN Z3301405085 [0,2,0,0,0,0|0,0,2]=4 801 B13R1.2678 NCC(N)C1=CC(=C(C(=C1)F)F)F Z1820079345 [0,2,0,0,0,0|2,0,0]=4 802 B13R1.49 COC1=C(C=CC(=C1)C(=O)CN)O Z4654934301 [0,2,0,0,0,0|0,0,2]=4 803 B13R1.49 COC1=C(C=CC(=C1)C(O)CN)O Z2574937385 [0,2,0,0,0,0|0,0,0]=2 804 B13R1.374 CCOC1=CC(=CC=C1)C(O)CC Z513748204 [0,2,0,0,0,0|1,0,0]=3 805 B13R1.543 CC[C@H](O)C1=CC(=CC=C1)[N+](=O)[O-] Z1127664358 [0,2,0,0,0,0|1,0,1]=4 806 B11R2.35 BrC1=CC(=CC=C1)C2CO2 Z278165168 [1,0,0,1,0,0|2,0,0]=4 807 B11R2.35 BrC1=CC(=CC=C1)[C@@H]2CO2 Z1575341746 [1,0,0,1,0,0|2,0,0]=4 808 B11R2.35 BrC1=CC(=CC=C1)[C@H]2CO2 Z1575341859 [1,0,0,1,0,0|2,0,0]=4 809 B11R2.35 CC1=CC(=CC=C1)C2CO2 Z802853588 [1,0,0,1,0,0|2,0,0]=4 810 B11R2.35 ClC1=CC(=CC=C1)C2CO2 Z278165232 [1,0,0,1,0,0|2,0,0]=4 811 B11R2.35 ClC1=CC(=CC=C1)[C@@H]2CO2 Z1255457905 [1,0,0,1,0,0|2,0,0]=4 812 B11R2.35 FC1=CC(=CC=C1)C2CO2 Z283685748 [1,0,0,1,0,0|2,0,0]=4 813 B11R2.35 NC1=CC(=CC=C1)C2CC2 Z992239700 [1,0,0,1,0,0|2,0,0]=4 814 B11R2.35 OC1=CC(=CC=C1)C2CC2 Z1198170922 [1,0,0,1,0,0|1,0,0]=3 815 B11R2.35 OC1=CC(=NC=C1)C2CC2 Z1255493056 [1,0,0,1,0,0|2,0,0]=4 816 B11R2.36 BrC1=CC2=C(C=C1)CCC2 Z359513410 [1,0,0,1,0,0|2,0,0]=4 817 B11R2.36 BrC1=CC2=C(C=C1)OCC2 Z299596228 [1,0,0,1,0,0|2,0,0]=4 818 B11R2.36 BrC1=CC2=C(N=C1)NCC2 Z1198169618 [1,0,0,1,0,0|2,0,0]=4 819 B11R2.36 CC1=CC2=C(C=C1)NCC2 Z235539062 [1,0,0,1,0,0|1,0,0]=3 820 B11R2.36 ClC1=CC2=C(C=C1)CCC2 Z1198234594 [1,0,0,1,0,0|2,0,0]=4 821 B11R2.36 ClC1=CC2=C(C=C1)NCC2 Z235537274 [1,0,0,1,0,0|1,0,0]=3 822 B11R2.36 FC1=CC2=C(N=C1)NCC2 Z2757597421 [1,0,0,1,0,0|2,0,0]=4 823 B11R2.36 IC1=CC2=C(C=C1)CCC2 Z381540774 [1,0,0,1,0,0|2,0,0]=4 824 B11R2.36 OC1=CC2=C(C=C1)CCN2 Z3241260546 [1,0,0,1,0,0|2,0,0]=4 825 B11R2.36 OC1=CC2=C(C=C1)CNC2 Z2489383861 [1,0,0,1,0,0|2,0,0]=4 826 B11R2.36 OC1=CC2=C(C=C1)NC=C2 Z1203162319 [1,0,0,1,0,0|0,0,2]=4 827 B11R2.36 OC1=CC2=C(C=C1)NC=N2 Z1042386518 [1,0,0,1,0,0|1,0,1]=4 828 B11R2.36 OC1=CC2=C(C=C1)NN=C2 Z1209763128 [1,0,0,1,0,0|1,0,1]=4 829 B11R2.36 OC1=CC2=C(C=C1)OCC2 Z1198182902 [1,0,0,1,0,0|1,0,0]=3 830 B11R2.36 OC1=CC2=C(C=C1)OCO2 Z104473678 [1,0,0,1,0,0|2,0,0]=4 831 B11R2.36 OC1=CC2=C(CCC2)N=C1 Z1255498919 [1,0,0,1,0,0|2,0,0]=4 832 B11R2.36 OC1=CC2=C(N=C1)NCC2 Z2310677431 [1,0,0,1,0,0|1,0,0]=3 833 B11R2.36 SC1=CC2=C(C=C1)OCC2 Z361891428 [1,0,0,1,0,0|1,1,0]=4 834 B11R2.106 BrC1=C2NCCC2=CC=C1 Z2739025449 [1,0,0,1,0,0|1,0,0]=3 835 B11R2.106 BrC1=C2NCCC2=CN=C1 Z4898391975 [1,0,0,1,0,0|2,0,0]=4 836 B11R2.106 BrC1=C2OCCC2=CC=C1 Z1198219525 [1,0,0,1,0,0|2,0,0]=4 837 B11R2.106 CC1=C2NCCC2=CC=C1 Z1331055683 [1,0,0,1,0,0|1,0,0]=3 838 B11R2.106 ClC1=C2NCCC2=CC=C1 Z235537094 [1,0,0,1,0,0|1,0,0]=3 839 B11R2.106 FC1=C2NCCC2=CC=C1 Z235538802 [1,0,0,1,0,0|1,0,0]=3 840 B11R2.106 NC1=C2NCCC2=CC=C1 Z1203580163 [1,0,0,1,0,0|1,0,0]=3 841 B11R2.106 OC1=C2CCCC2=CC=C1 Z1198149277 [1,0,0,1,0,0|1,0,0]=3 842 B11R2.106 OC1=C2CCNC2=CC=C1 Z1715153863 [1,0,0,1,0,0|2,0,0]=4 843 B11R2.106 OC1=C2CCOC2=CC=C1 Z1198181637 [1,0,0,1,0,0|2,0,0]=4 844 B11R2.106 OC1=C2CNCC2=CC=C1 Z1198279842 [1,0,0,1,0,0|2,0,0]=4 845 B11R2.106 OC1=C2NN=NC2=CC=C1 Z1198168465 [1,0,0,1,0,0|2,0,0]=4 846 B11R2.106 OC1=C2OCCC2=CC=C1 Z1486027488 [1,0,0,1,0,0|1,0,0]=3 847 B11R2.106 OC1=C2OCOC2=CC=C1 Z409065236 [1,0,0,1,0,0|2,0,0]=4 848 B11R2.1 CC1CNC2=C1C=CC=C2 Z415739264 [1,0,0,1,0,0|1,0,0]=3 849 B11R2.1 CC1CNC2=C1C=CN=C2 Z3400245703 [1,0,0,1,0,0|2,0,0]=4 850 B11R2.1 CC1CNC2=C1N=CC=C2 Z3464420345 [1,0,0,1,0,0|2,0,0]=4 851 B11R2.1 NC1CCC2=C1C=CC=C2 Z168884748 [1,0,0,1,0,0|2,0,0]=4 852 B11R2.1 NC1CSC2=C1C=CC=C2 Z431544668 [1,0,0,1,0,0|2,0,0]=4 853 B11R2.1 N[C@@H]1CCC2=C1C=CC=C2 Z1741972748 [1,0,0,1,0,0|2,0,0]=4 854 B11R2.1 OC1COC2=C1C=CC=C2 Z1267884639 [1,0,0,1,0,0|1,0,0]=3 855 B11R2.1 O[C@@H]1CSC2=C1C=CC=C2 Z1438326029 [1,0,0,1,0,0|1,0,0]=3 856 B11R2.4 N[C@@H]1C[C@@H]1C2=CC=CC=C2 Z2309888982 [1,0,0,1,0,0|1,0,0]=3 857 B11R2.4 N[C@@H]1C[C@H]1C2=CC=CC=C2 Z2296167800 [1,0,0,1,0,0|1,0,0]=3 858 B11R2.4 N[C@H]1C[C@@H]1C2=CC=CC=C2 Z2517097696 [1,0,0,1,0,0|1,0,0]=3 859 B11R2.40 CC1(CO1)C2=CC=CC=C2 Z813010616 [1,0,0,1,0,0|2,0,0]=4 860 B11R2.40 NC1(CC1)C2=CC=CC=C2 Z1262398449 [1,0,0,1,0,0|2,0,0]=4 861 B11R2.239 C1=CC=C(C=C1)C2CCN2 Z359510120 [1,0,0,1,0,0|2,0,0]=4 862 B11R2.988 NCC1CC2=C1C=CC=C2 Z234895091 [1,0,0,1,0,0|1,0,0]=3 863 B13R2.43 NCC1=CC2=C(O1)C=CC(=C2)Br Z2768165691 [0,0,0,1,0,1|1,0,1]=4 864 B13R2.43 NCC1=CC2=C(O1)C=CC(=C2)Cl Z2583434933 [0,0,0,1,0,1|1,0,1]=4 865 B13R2.43 NCC1=NC2=C(N1)C=CC(=C2)O Z5004215696 [0,0,0,1,0,1|1,0,1]=4 866 B13R2.43 NCC1=NC2=C(O1)C=CC(=C2)Br Z2096088220 [0,0,0,1,0,1|1,0,1]=4 867 B13R2.43 NCC1CC2=C(O1)C=CC(=C2)Br Z1269117858 [0,0,0,1,0,1|1,0,0]=3 868 B13R2.43 OCC1CC2=C(O1)C=CC(=C2)Br Z1269186761 [0,0,0,1,0,1|2,0,0]=4 869 B13R2.43 OCC1CC2=C(O1)C=CC(=C2)F Z1198725007 [0,0,0,1,0,1|2,0,0]=4 870 B13R2.155 CC1=CC2=C(C=C1)NCC(O2)C Z1198339750 [0,0,0,1,0,1|2,0,0]=4 871 B13R2.155 CC1CNC2=C(C1)C=C(C=C2)F Z5085288248 [0,0,0,1,0,1|2,0,0]=4 872 B13R2.155 CC1CNC2=C(O1)C=C(C=C2)Br Z1269181301 [0,0,0,1,0,1|2,0,0]=4 873 B13R2.155 CC1CNC2=C(O1)C=C(C=C2)F Z1258990936 [0,0,0,1,0,1|2,0,0]=4 874 B13R2.155 OC1=CC2=C(C=C1)CCC(C2)O Z1513811314 [0,0,0,1,0,1|1,0,0]=3 875 B13R2.155 OC1CNC2=C(C1)C=C(C=C2)Br Z2733593416 [0,0,0,1,0,1|1,0,0]=3 876 B13R2.155 OC1CNC2=C(C1)C=C(C=C2)F Z1813139692 [0,0,0,1,0,1|1,0,0]=3 877 B13R2.3021 BrC1=CC(=CC=C1)OC2CNC2 Z3251708429 [0,0,0,1,0,1|2,0,0]=4 878 B13R2.3021 FC1=CC(=CC=C1)CC2CNC2 Z1695669957 [0,0,0,1,0,1|2,0,0]=4 879 B13R2.3021 FC1=CC(=CC=C1)OC2CNC2 Z1269178445 [0,0,0,1,0,1|2,0,0]=4 880 B13R2.5179 CC1CCC2=C(N1)C=CC=C2O Z1262576864 [0,0,0,1,0,1|2,0,0]=4 881 B13R2.5179 CC1CNC2=C(C1)C=CC=C2F Z2739831837 [0,0,0,1,0,1|2,0,0]=4 882 B13R2.5179 OC1=CC=CC2=C1NCC(C2)O Z2737445967 [0,0,0,1,0,1|0,0,0]=2 883 B13R2.5190 CC1CC2=C(C1C)C=CC(=C2)O Z1513871470 [0,0,0,1,0,1|2,0,0]=4 884 B13R2.5190 CC1CC2=C(C1N)C=CC(=C2)Br Z5129562645 [0,0,0,1,0,1|2,0,0]=4 885 B13R2.5190 CC1OC2=C(C1N)C=CC(=C2)Br Z5090873656 [0,0,0,1,0,1|2,0,0]=4 886 B13R2.100 NC1=CC(=CC=C1)C2(CC2)CO Z1416184930 [0,1,0,1,0,0|2,0,0]=4 887 B13R2.100 NCC1(CC1)C2=CC(=CC=C2)Br Z390130896 [0,1,0,1,0,0|2,0,0]=4 888 B13R2.100 NCC1(CC1)C2=CC(=CC=C2)Cl Z361883782 [0,1,0,1,0,0|2,0,0]=4 889 B13R2.100 NCC1(CC1)C2=CC(=CC=C2)F Z361883914 [0,1,0,1,0,0|2,0,0]=4 890 B13R2.3018 OC1(CNC1)C2=CC(=CC=C2)Br Z1551923504 [0,1,0,1,0,0|1,0,0]=3 891 B13R2.3018 OC1(CNC1)C2=CC(=CC=C2)F Z3487915997 [0,1,0,1,0,0|1,0,0]=3 892 B13R2.3019 CC1(CC1N)C2=CC(=CC=C2)F Z1695926124 [0,1,0,1,0,0|2,0,0]=4 893 B13R2.3791 CC1(CNC2=C1C=C(C=C2)Br)C Z2065464292 [0,1,0,1,0,0|2,0,0]=4 894 B13R2.3791 CC1(COC2=C1C=C(C=C2)O)C Z1513829476 [0,1,0,1,0,0|2,0,0]=4 895 B13R2.9 NCC1CCC2=C(C=CC=C12)Br Z4953320788 [0,1,0,1,0,0|2,0,0]=4 896 B13R2.13 BrC1=CC(=CC=C1)C2CCNC2 Z1269121156 [0,1,0,1,0,0|2,0,0]=4 897 B13R2.13 CC1=CC(=CC=C1)C2CCNC2 Z940902750 [0,1,0,1,0,0|2,0,0]=4 898 B13R2.13 ClC1=CC(=CC=C1)C2CCNC2 Z2213893356 [0,1,0,1,0,0|2,0,0]=4 899 B13R2.13 ClC1=CC(=CC=C1)[C@@H]2CCNC2 Z3490779832 [0,1,0,1,0,0|2,0,0]=4 900 B13R2.13 ClC1=CC(=CC=C1)[C@H]2CCNC2 Z3492371639 [0,1,0,1,0,0|2,0,0]=4 901 B13R2.13 FC1=CC(=CC=C1)C2CCNC2 Z940902748 [0,1,0,1,0,0|2,0,0]=4 902 B13R2.13 OC1=CC(=CC=C1)C2CCCC2 Z1485998351 [0,1,0,1,0,0|2,0,0]=4 903 B13R2.13 OC1=CC(=CC=C1)C2CCNC2 Z2489057895 [0,1,0,1,0,0|1,0,0]=3 904 B13R2.2136 NCC1=NOC2=C1C=C(C=C2)F Z2738925069 [0,1,0,1,0,0|1,0,1]=4 905 B13R2.151 CC1=CC(=CC=C1)[C@H]2C[C@@H](C2)N Z1954242338 [0,1,0,1,0,0|2,0,0]=4 906 B13R2.151 NC1CC(C1)C2=CC(=CC=C2)Cl Z1262327397 [0,1,0,1,0,0|2,0,0]=4 907 B13R2.151 N[C@H]1C[C@@H](C1)C2=CC(=CC=C2)Br Z3088779932 [0,1,0,1,0,0|2,0,0]=4 908 B13R2.151 O=C1CC(N1)C2=CC=CC(=C2)O Z3227055565 [0,1,0,1,0,0|2,0,0]=4 909 B13R2.162 CN1CCNC2=C1C=C(C=C2)O Z4669450352 [0,1,0,1,0,0|2,0,0]=4 910 B13R2.162 N[C@@H]1CCOC2=C1C=C(C=C2)O Z3353639073 [0,1,0,1,0,0|2,0,0]=4 911 B13R2.162 OC1CCCC2=C1C=C(C=C2)Cl Z1008483484 [0,1,0,1,0,0|2,0,0]=4 912 B13R2.162 OC1CCOC2=C1C=C(C=C2)Br Z235448344 [0,1,0,1,0,0|2,0,0]=4 913 B13R2.342 CC1=CC=CC2=C1NCCC2C Z1198183889 [0,1,0,1,0,0|2,0,0]=4 914 B13R2.342 CC1CCNC2=C1C=CC=C2O Z1718362003 [0,1,0,1,0,0|1,0,0]=3 915 B13R2.342 NC1=C2OCCC(C2=CC=C1)O Z1463271034 [0,1,0,1,0,0|2,0,0]=4 916 B13R2.342 NC1CCCC2=C1C=CC=C2O Z1262626223 [0,1,0,1,0,0|2,0,0]=4 917 B13R2.342 OC1=CC=CC2=C1CCCC2O Z104511134 [0,1,0,1,0,0|1,0,0]=3 918 B13R2.342 OC1CCOC2=C1C=CC=C2Cl Z1255439653 [0,1,0,1,0,0|2,0,0]=4 919 B13R2.342 O[C@@H]1CCOC2=C1C=CC=C2F Z959151608 [0,1,0,1,0,0|2,0,0]=4 920 B13R2.342 O[C@H]1CCOC2=C1C=CC=C2F Z959151606 [0,1,0,1,0,0|2,0,0]=4 921 B13R2.4857 CC1=CC=CC2=C1C(CC2O)C Z1157838209 [0,1,0,1,0,0|2,0,0]=4 922 B13R2.154 N[C@@H]1C[C@H]1C2=C(C(=CC=C2)Cl)Cl Z2298098020 [0,1,0,1,0,0|2,0,0]=4 923 B13R2.154 N[C@@H]1C[C@H]1C2=C(C(=CC=C2)F)F Z2298098033 [0,1,0,1,0,0|2,0,0]=4 924 B13R2.3790 CC1=C(C2=C(C=C1)CCC2O)C Z4883452164 [0,1,0,1,0,0|2,0,0]=4 925 B13R2.3028 CC1C(=O)NC2=C1C=C(C=C2)O Z1198169095 [0,1,0,1,0,0|1,0,1]=4 926 B13R2.3028 O=C1NC2=C(C1O)C=C(C=C2)Br Z235447292 [0,1,0,1,0,0|1,0,1]=4 927 B13R2.3028 O=C1NC2=C(C1O)C=C(C=C2)F Z335244996 [0,1,0,1,0,0|1,0,1]=4 928 B13R2.3127 N[C@@H]1C[C@H]1C2=C(C=CC(=C2)F)F Z2298098032 [0,1,0,1,0,0|2,0,0]=4 929 B13R2.5151 OC1CCC2=C(C=CC(=C12)F)F Z815114674 [0,1,0,1,0,0|2,0,0]=4 930 B13R2.2964 N[C@@H]1C[C@H]1C2=CC(=CC(=C2)Br)Br Z4750771031 [0,1,0,1,0,0|2,0,0]=4 931 B13R2.2964 N[C@@H]1C[C@H]1C2=CC(=CC(=C2)Cl)Cl Z3317292635 [0,1,0,1,0,0|2,0,0]=4 932 B13R2.3742 CC1=CC(=C2OCC(C2=C1)O)Br Z1267884892 [0,1,0,1,0,0|2,0,0]=4 933 B13R2.522 CC1=C(C=C(C=C1)C2CC2N)C Z234897043 [0,1,0,1,0,0|2,0,0]=4 934 B13R2.522 N[C@@H]1C[C@H]1C2=CC(=C(C=C2)Cl)Cl Z2298098026 [0,1,0,1,0,0|2,0,0]=4 935 B13R2.522 N[C@@H]1C[C@H]1C2=CC(=C(C=C2)Cl)F Z2298098037 [0,1,0,1,0,0|2,0,0]=4 936 B13R2.522 N[C@@H]1C[C@H]1C2=CC(=C(C=C2)F)F Z2298098006 [0,1,0,1,0,0|2,0,0]=4 937 B13R2.81 COC1=CC(=CC=C1)[C@@H]2C[C@H]2N Z2236704792 [0,1,0,1,0,0|1,0,0]=3 938 B13R2.573 COC1=C2CCC(C2=CC=C1)N Z334686352 [0,1,0,1,0,0|2,0,0]=4 939 B13R2.573 COC1=C2OCC(C2=CC=C1)N Z3244827605 [0,1,0,1,0,0|2,0,0]=4 940 B13R2.669 COC1=CC2=C(C=C1)CCC2N Z3234887230 [0,1,0,1,0,0|2,0,0]=4 941 B13R2.2033 COC1=CC(=CC=C1)C2(CC2)N Z2039477462 [0,1,0,1,0,0|2,0,0]=4 942 B13R3.213 ClC1=CC2=C(C=C1)CC3C2O3 Z1198182425 [0,0,0,2,0,0|2,0,0]=4 943 B9R1.7 CC1=CC=C(S1)CCN Z3038322398 [1,0,0,0,1,0|2,0,0]=4 944 B9R1.7 NCCC1=CC=C(O1)Br Z1442016604 [1,0,0,0,1,0|2,0,0]=4 945 B9R1.7 NCCC1=CC=C(S1)Cl Z432066930 [1,0,0,0,1,0|2,0,0]=4 946 B9R1.7 NCCC1=CC=C(S1)I Z1262398458 [1,0,0,0,1,0|2,0,0]=4 947 B9R1.7 NCCC1=CSC(=C1)Br Z4125344523 [1,0,0,0,1,0|2,0,0]=4 948 B9R1.33 NCCC1=C(SC=C1)Cl Z4606142914 [1,0,0,0,1,0|2,0,0]=4 949 B9R1.33 NCCC1=CNN=C1O Z4623367325 [1,0,0,0,1,0|2,0,0]=4 950 B9R1.11 CC(CN)C1=CC=CS1 Z803101386 [1,0,0,0,1,0|2,0,0]=4 951 B9R1.11 NCC(O)C1=CN=CS1 Z2310732372 [1,0,0,0,1,0|2,0,0]=4 952 B9R1.11 NCC(O)C1=CNC=N1 Z2310707384 [1,0,0,0,1,0|2,0,0]=4 953 B9R1.11 NCC(O)C1=COC=C1 Z1198261509 [1,0,0,0,1,0|1,0,0]=3 954 B9R1.11 NCC(O)C1=CSC=C1 Z330910460 [1,0,0,0,1,0|1,0,0]=3 955 B9R1.35 CC(O)C1=CC=C(S1)Cl Z228586148 [1,0,0,0,1,0|2,0,0]=4 956 B9R1.41 CC1=C(SC=C1)C(C)O Z837065414 [1,0,0,0,1,0|2,0,0]=4 957 B11R1.40 CC(CC1=CC=CC=C1)NN Z3033545382 [1,0,0,0,0,1|2,0,0]=4 958 B11R1.40 CC(CN)NC1=CC=CC=C1 Z1198235985 [1,0,0,0,0,1|1,0,0]=3 959 B11R1.40 CC(CN)OC1=CC=CC=C1 Z1245635737 [1,0,0,0,0,1|1,0,0]=3 960 B11R1.40 CC(CN)SC1=CC=CC=C1 Z844632804 [1,0,0,0,0,1|1,0,0]=3 961 B11R1.40 CCC(N)CC1=CC=CC=C1 Z431980016 [1,0,0,0,0,1|2,0,0]=4 962 B11R1.40 CCC(O)CC1=CC=CC=C1 Z513749284 [1,0,0,0,0,1|1,0,0]=3 963 B11R1.40 CCC(O)CC1=CC=NC=C1 Z992409862 [1,0,0,0,0,1|2,0,0]=4 964 B11R1.40 CC[C@@H](O)CC1=CC=CC=C1 Z1262397064 [1,0,0,0,0,1|1,0,0]=3 965 B11R1.40 CC[C@H](O)CC1=CC=CC=C1 Z1262397065 [1,0,0,0,0,1|1,0,0]=3 966 B11R1.40 NC(CO)CC1=CC=CC=C1 Z234898263 [1,0,0,0,0,1|2,0,0]=4 967 B11R1.40 NCC(=O)CC1=CC=CC=C1 Z1569708978 [1,0,0,0,0,1|0,0,2]=4 968 B11R1.40 NCC(=O)NC1=CC=CC=C1 Z594413794 [1,0,0,0,0,1|0,0,2]=4 969 B11R1.40 NCC(F)CC1=CC=CC=C1 Z2740416678 [1,0,0,0,0,1|1,0,0]=3 970 B11R1.40 NCC(N)CC1=CC=CC=C1 Z425861056 [1,0,0,0,0,1|1,0,0]=3 971 B11R1.40 NCC(O)CC1=CC=CC=C1 Z419084966 [1,0,0,0,0,1|0,0,0]=2 972 B11R1.40 N[C@@H](CO)CC1=CC=CC=C1 Z1157651018 [1,0,0,0,0,1|2,0,0]=4 973 B11R1.40 N[C@H](CO)CC1=CC=CC=C1 Z1741982891 [1,0,0,0,0,1|2,0,0]=4 974 B13R1.15 CC1=CC(=CC=C1)OCC(O)CN Z271072304 [0,0,0,0,0,2|1,0,0]=3 975 B13R1.15 NCC(O)COC1=CC(=CC=C1)F Z271072324 [0,0,0,0,0,2|1,0,0]=3 976 B13R1.15 OCC(O)CSC1=CC(=CC=C1)Br Z1346696335 [0,0,0,0,0,2|2,0,0]=4 977 B13R1.15 OCC(O)CSC1=CC(=CC=C1)Cl Z1346696059 [0,0,0,0,0,2|2,0,0]=4