0 B11R1.13 C=CCC1=CC=CC(=C1O)O Z56778453 [0,0,0,0,0,0|1,0,0]=1 1 B11R1.13 CC1=C(C(=CC=C1)CC#N)F Z1255416252 [0,0,0,0,0,0|2,0,1]=3 2 B11R1.13 CC1=C(C(=CC=C1)CCN)C Z4927171483 [0,0,0,0,0,0|2,0,1]=3 3 B11R1.13 CC1=C(C(=CC=C1)N=C=S)C Z56951196 [0,0,0,0,0,0|3,0,1]=4 4 B11R1.13 CCNC1=C(C(=CC=C1)C)C Z286511134 [0,0,0,0,0,0|2,0,2]=4 5 B11R1.13 CCNC1=C(C(=CC=C1)C)F Z1599211198 [0,0,0,0,0,0|2,0,2]=4 6 B11R1.13 CNCC1=C(C(=CC=C1)Br)O Z4658970144 [0,0,0,0,0,0|2,0,1]=3 7 B11R1.13 CNCC1=C(C(=CC=C1)Cl)F Z3013893037 [0,0,0,0,0,0|3,0,1]=4 8 B11R1.13 CNCC1=C(C(=CC=C1)F)F Z4658970152 [0,0,0,0,0,0|3,0,1]=4 9 B11R1.13 CSCC1=C(C(=CC=C1)N)C Z732207424 [0,0,0,0,0,0|3,0,1]=4 10 B11R1.13 N#CCC1=C(C(=CC=C1)Br)Cl Z1269187155 [0,0,0,0,0,0|3,0,1]=4 11 B11R1.13 N#CCC1=C(C(=CC=C1)Br)O Z1269134802 [0,0,0,0,0,0|2,0,1]=3 12 B11R1.13 N#CCC1=C(C(=CC=C1)Cl)F Z1201621210 [0,0,0,0,0,0|3,0,1]=4 13 B11R1.13 N#CCC1=CC=CC(=C1Cl)F Z1198263827 [0,0,0,0,0,0|3,0,1]=4 14 B11R1.13 NCCC1=C(C(=CC=C1)Br)O Z1953500453 [0,0,0,0,0,0|2,0,1]=3 15 B11R1.13 NCCC1=C(C(=CC=C1)Cl)Cl Z444350066 [0,0,0,0,0,0|3,0,1]=4 16 B11R1.13 NCCC1=C(C(=CC=C1)Cl)F Z3301588304 [0,0,0,0,0,0|3,0,1]=4 17 B11R1.13 NCCC1=C(C(=CC=C1)F)Cl Z4926042702 [0,0,0,0,0,0|3,0,1]=4 18 B11R1.13 NCCC1=C(C(=CC=C1)F)F Z1267773780 [0,0,0,0,0,0|3,0,1]=4 19 B11R1.13 O=CCC1=C(C(=CC=C1)Br)F Z1868320120 [0,0,0,0,0,0|3,0,0]=3 20 B11R1.13 O=CCC1=CC=CC(=C1F)F Z1183458992 [0,0,0,0,0,0|3,0,0]=3 21 B11R1.13 OCCC1=C(C(=CC=C1)F)F Z1183459328 [0,0,0,0,0,0|3,0,1]=4 22 B10R1.2 CC1=C(C(=CC=C1)C=O)Br Z1255464769 [1,0,0,0,0,0|2,0,0]=3 23 B10R1.2 CC1=C(C(=CC=C1)C=O)C Z147641438 [1,0,0,0,0,0|2,0,0]=3 24 B10R1.2 CC1=C(C(=CC=C1)C=O)F Z1255387503 [1,0,0,0,0,0|2,0,0]=3 25 B10R1.2 CC1=C(C(=CC=C1)C=O)N Z1203582628 [1,0,0,0,0,0|2,0,0]=3 26 B10R1.2 CC1=C(C(=CC=C1)C=O)O Z406682006 [1,0,0,0,0,0|1,0,0]=2 27 B10R1.2 CC1=C(C(=CC=C1)CN)Br Z1269115079 [1,0,0,0,0,0|2,0,0]=3 28 B10R1.2 CC1=C(C(=CC=C1)CN)N Z4703758409 [1,0,0,0,0,0|2,0,0]=3 29 B10R1.2 CC1=C(C(=CC=C1)CN)O Z2568737629 [1,0,0,0,0,0|1,0,0]=2 30 B10R1.2 CC1=C(C(=CC=C1)CO)Br Z1269244302 [1,0,0,0,0,0|2,0,0]=3 31 B10R1.2 CC1=C(C(=CC=C1)CO)I Z1269243400 [1,0,0,0,0,0|2,0,0]=3 32 B10R1.2 CC1=C(C(=NC=C1)C=O)Br Z1618009678 [1,0,0,0,0,0|3,0,0]=4 33 B10R1.2 CC1=C(C(=NC=C1)CN)F Z3210504234 [1,0,0,0,0,0|3,0,0]=4 34 B10R1.2 CC1=C(C=CC=C1Br)C=O Z1255373549 [1,0,0,0,0,0|3,0,0]=4 35 B10R1.2 CC1=C(C=CC=C1Br)CO Z1263881346 [1,0,0,0,0,0|3,0,0]=4 36 B10R1.2 CC1=C(C=CC=C1Cl)C=O Z1198308873 [1,0,0,0,0,0|3,0,0]=4 37 B10R1.2 CC1=C(C=CC=C1Cl)CN Z1198307715 [1,0,0,0,0,0|3,0,0]=4 38 B10R1.2 CC1=C(C=CC=C1Cl)CO Z1198223504 [1,0,0,0,0,0|3,0,0]=4 39 B10R1.2 CC1=C(C=CC=C1F)C=O Z1255402882 [1,0,0,0,0,0|3,0,0]=4 40 B10R1.2 CC1=C(C=CC=C1F)CN Z1198307705 [1,0,0,0,0,0|3,0,0]=4 41 B10R1.2 CC1=C(C=CC=C1I)CO Z1269226759 [1,0,0,0,0,0|3,0,0]=4 42 B10R1.2 CC1=C(C=CC=C1N)CO Z425792776 [1,0,0,0,0,0|3,0,0]=4 43 B10R1.2 CC1=C(C=CC=C1O)CN Z4452492342 [1,0,0,0,0,0|3,0,0]=4 44 B10R1.2 CCC1=C(C(=CC=C1)C)N Z104472756 [1,0,0,0,0,0|1,0,1]=3 45 B10R1.2 CCC1=C(C(=CC=C1)F)Br Z2631039917 [1,0,0,0,0,0|2,0,1]=4 46 B10R1.2 CCC1=C(C(=CC=C1)F)N Z4658051452 [1,0,0,0,0,0|2,0,1]=4 47 B10R1.2 CCC1=C(C(=CC=C1)N)O Z2895200771 [1,0,0,0,0,0|1,0,1]=3 48 B10R1.2 CCC1=C(C(=CC=C1)O)C Z1255437459 [1,0,0,0,0,0|2,0,1]=4 49 B10R1.2 CCC1=C(C(=O)C=CO1)O Z1255465165 [1,0,0,0,0,0|2,0,1]=4 50 B10R1.2 CN1C=CC=C(C1=O)C=O Z1416192499 [1,0,0,0,0,0|2,0,1]=4 51 B10R1.2 CNC1=C(C(=CC=C1)C)Br Z4791347502 [1,0,0,0,0,0|2,0,1]=4 52 B10R1.2 CNC1=C(C(=CC=C1)C)C Z752370992 [1,0,0,0,0,0|2,0,1]=4 53 B10R1.2 CNC1=C(C(=CC=C1)C)F Z5023971923 [1,0,0,0,0,0|2,0,1]=4 54 B10R1.2 COC1=C(C(=CC=C1)Br)O Z1269110250 [1,0,0,0,0,0|2,0,1]=4 55 B10R1.2 COC1=C(C(=CC=C1)C)N Z421792238 [1,0,0,0,0,0|2,0,1]=4 56 B10R1.2 COC1=C(C(=CC=C1)F)O Z850124378 [1,0,0,0,0,0|2,0,1]=4 57 B10R1.2 COC1=C(C(=CC=C1)N)O Z1623872003 [1,0,0,0,0,0|2,0,1]=4 58 B10R1.2 CSC1=C(C(=CC=C1)C)N Z1255396897 [1,0,0,0,0,0|2,0,1]=4 59 B10R1.2 N#CC1=CC=CC(=C1O)N Z1203579159 [1,0,0,0,0,0|2,0,1]=4 60 B10R1.2 NC1=C(C(=CC=C1)CO)Cl Z1255363918 [1,0,0,0,0,0|3,0,0]=4 61 B10R1.2 NC1=C(C=CC=C1Cl)C=O Z1255404490 [1,0,0,0,0,0|3,0,0]=4 62 B10R1.2 NC1=C(C=CC=C1F)C=O Z1203586128 [1,0,0,0,0,0|3,0,0]=4 63 B10R1.2 NC1=C(C=CC=C1F)CO Z1203653641 [1,0,0,0,0,0|3,0,0]=4 64 B10R1.2 NCC1=C(C(=CC=C1)Br)F Z1269181418 [1,0,0,0,0,0|3,0,0]=4 65 B10R1.2 NCC1=C(C(=CC=C1)Br)O Z1869802506 [1,0,0,0,0,0|2,0,0]=3 66 B10R1.2 NCC1=C(C(=CC=C1)Cl)Br Z5376599035 [1,0,0,0,0,0|3,0,0]=4 67 B10R1.2 NCC1=C(C(=CC=C1)Cl)O Z2935017011 [1,0,0,0,0,0|2,0,0]=3 68 B10R1.2 NCC1=C(C(=CC=C1)F)Br Z1269109049 [1,0,0,0,0,0|3,0,0]=4 69 B10R1.2 NCC1=C(C(=CC=C1)F)O Z2753740771 [1,0,0,0,0,0|2,0,0]=3 70 B10R1.2 NCC1=C(C(=CC=C1)O)F Z2755008804 [1,0,0,0,0,0|3,0,0]=4 71 B10R1.2 NCC1=C(C(=CC=C1)O)O Z2755766575 [1,0,0,0,0,0|2,0,0]=3 72 B10R1.2 NCC1=C(C(=CC=N1)O)O Z4613630127 [1,0,0,0,0,0|3,0,0]=4 73 B10R1.2 O=C1C=COC(=C1O)CO Z1513596409 [1,0,0,0,0,0|3,0,0]=4 74 B10R1.2 O=CC1=C(C(=CC=C1)Br)Cl Z1269190527 [1,0,0,0,0,0|3,0,0]=4 75 B10R1.2 O=CC1=C(C(=CC=C1)Br)F Z1205757906 [1,0,0,0,0,0|3,0,0]=4 76 B10R1.2 O=CC1=C(C(=CC=C1)Br)O Z354084788 [1,0,0,0,0,0|2,0,0]=3 77 B10R1.2 O=CC1=C(C(=CC=C1)Cl)F Z1203161792 [1,0,0,0,0,0|3,0,0]=4 78 B10R1.2 O=CC1=C(C(=CC=C1)Cl)O Z406682010 [1,0,0,0,0,0|2,0,0]=3 79 B10R1.2 O=CC1=C(C(=CC=C1)F)O Z406682008 [1,0,0,0,0,0|2,0,0]=3 80 B10R1.2 O=CC1=CC=CC(=C1Br)Br Z1269211860 [1,0,0,0,0,0|3,0,0]=4 81 B10R1.2 O=CC1=CC=CC(=C1Br)Cl Z1269133465 [1,0,0,0,0,0|3,0,0]=4 82 B10R1.2 O=CC1=CC=CC(=C1Br)F Z1269200334 [1,0,0,0,0,0|3,0,0]=4 83 B10R1.2 O=CC1=CC=CC(=C1Br)O Z1269217079 [1,0,0,0,0,0|3,0,0]=4 84 B10R1.2 O=CC1=CC=CC(=C1Cl)Cl Z104474602 [1,0,0,0,0,0|3,0,0]=4 85 B10R1.2 O=CC1=CC=CC(=C1Cl)F Z1198174775 [1,0,0,0,0,0|3,0,0]=4 86 B10R1.2 O=CC1=CC=CC(=C1Cl)O Z1255489787 [1,0,0,0,0,0|3,0,0]=4 87 B10R1.2 O=CC1=CC=CC(=C1F)F Z1079442742 [1,0,0,0,0,0|3,0,0]=4 88 B10R1.2 O=CC1=CC=CC(=C1F)O Z1198313363 [1,0,0,0,0,0|3,0,0]=4 89 B10R1.2 O=CC1=CC=CC(=C1I)F Z1269167420 [1,0,0,0,0,0|3,0,0]=4 90 B10R1.2 O=CC1=CC=CC(=C1O)O Z56899185 [1,0,0,0,0,0|2,0,0]=3 91 B10R1.2 OCC1=C(C(=CC=C1)Br)Br Z1269160611 [1,0,0,0,0,0|3,0,0]=4 92 B10R1.2 OCC1=C(C(=CC=C1)Br)Cl Z1269113383 [1,0,0,0,0,0|3,0,0]=4 93 B10R1.2 OCC1=C(C(=CC=C1)Cl)Br Z1269125525 [1,0,0,0,0,0|3,0,0]=4 94 B10R1.2 OCC1=C(C(=CC=C1)F)Br Z1269199218 [1,0,0,0,0,0|3,0,0]=4 95 B10R1.2 OCC1=C(C(=CC=C1)F)Cl Z1198306358 [1,0,0,0,0,0|3,0,0]=4 96 B10R1.2 OCC1=C(C(=CC=C1)F)I Z1269109517 [1,0,0,0,0,0|3,0,0]=4 97 B10R1.4 C=CCC1=C(C=CC=C1)O Z104493210 [1,0,0,0,0,0|0,0,0]=1 98 B10R1.4 CC1=C(C=CC=C1)CC#N Z57039593 [1,0,0,0,0,0|2,0,1]=4 99 B10R1.4 CC1=C(C=CC=C1)CC=O Z993017618 [1,0,0,0,0,0|2,0,0]=3 100 B10R1.4 CC1=C(C=CC=C1)CNN Z336481586 [1,0,0,0,0,0|3,0,0]=4 101 B10R1.4 CCCC1=C(C=CC=C1)Br Z1479686725 [1,0,0,0,0,0|1,0,2]=4 102 B10R1.4 CCCC1=C(C=CC=C1)I Z821158622 [1,0,0,0,0,0|1,0,2]=4 103 B10R1.4 CCCC1=C(C=CC=C1)N Z336087926 [1,0,0,0,0,0|1,0,2]=4 104 B10R1.4 CCNC1=C(C=CC=C1)O Z5185414820 [1,0,0,0,0,0|1,0,2]=4 105 B10R1.4 CCOC1=C(C=CC=C1)O Z104480244 [1,0,0,0,0,0|1,0,2]=4 106 B10R1.4 CCSC1=C(C=CC=C1)O Z905204460 [1,0,0,0,0,0|1,0,2]=4 107 B10R1.4 CNCC1=C(C=CC=C1)C Z56948272 [1,0,0,0,0,0|2,0,1]=4 108 B10R1.4 CNCC1=C(C=CC=C1)Cl Z56955956 [1,0,0,0,0,0|2,0,1]=4 109 B10R1.4 CNCC1=C(C=CC=C1)F Z56953087 [1,0,0,0,0,0|2,0,1]=4 110 B10R1.4 CNCC1=C(C=CC=C1)N Z764242576 [1,0,0,0,0,0|2,0,1]=4 111 B10R1.4 CNCC1=C(C=CC=C1)O Z398513608 [1,0,0,0,0,0|1,0,1]=3 112 B10R1.4 COCC1=C(C=CC=C1)I Z821093342 [1,0,0,0,0,0|2,0,1]=4 113 B10R1.4 COCC1=C(C=CC=C1)O Z821093528 [1,0,0,0,0,0|1,0,1]=3 114 B10R1.4 CSCC1=C(C=CC=C1)N Z732207148 [1,0,0,0,0,0|2,0,1]=4 115 B10R1.4 N#CCC1=C(C=CC=C1)Cl Z56904744 [1,0,0,0,0,0|2,0,1]=4 116 B10R1.4 N#CCC1=C(C=CC=C1)F Z104477228 [1,0,0,0,0,0|2,0,1]=4 117 B10R1.4 NC1=C(C=CC=C1)CCO Z3417485770 [1,0,0,0,0,0|2,0,1]=4 118 B10R1.4 NCCC1=C(C=CC=C1)Br Z295382782 [1,0,0,0,0,0|2,0,1]=4 119 B10R1.4 NCCC1=C(C=CC=C1)Cl Z285143744 [1,0,0,0,0,0|2,0,1]=4 120 B10R1.4 NCCC1=C(C=CC=C1)F Z57051087 [1,0,0,0,0,0|2,0,1]=4 121 B10R1.4 NCCC1=C(C=CC=C1)O Z594038184 [1,0,0,0,0,0|1,0,1]=3 122 B10R1.4 NCCC1=C(N=CC=C1)O Z5862214540 [1,0,0,0,0,0|2,0,1]=4 123 B10R1.4 O/N=C/C1=C(C=CC=C1)O Z49568319 [1,0,0,0,0,0|2,0,1]=4 124 B10R1.4 O=CCC1=C(C=CC=C1)Br Z1183459130 [1,0,0,0,0,0|2,0,0]=3 125 B10R1.4 O=CCC1=C(C=CC=C1)F Z993017796 [1,0,0,0,0,0|2,0,0]=3 126 B10R1.4 OCCC1=C(C=CC=C1)Br Z1183459188 [1,0,0,0,0,0|2,0,1]=4 127 B10R1.4 OCCC1=C(C=CC=C1)F Z397587382 [1,0,0,0,0,0|2,0,1]=4 128 B10R1.10 C=COC1=CC=CC(=C1)C Z1269547004 [1,0,0,0,0,0|1,0,0]=2 129 B10R1.10 CC1=CC(=CC=C1)CC#N Z285131450 [1,0,0,0,0,0|1,0,1]=3 130 B10R1.10 CC1=CC(=CC=C1)CCN Z241056516 [1,0,0,0,0,0|1,0,1]=3 131 B10R1.10 CC1=NC(=CC=C1)CCN Z1098234194 [1,0,0,0,0,0|2,0,1]=4 132 B10R1.10 CCCC1=CC(=CC=C1)Br Z1541586975 [1,0,0,0,0,0|1,0,2]=4 133 B10R1.10 CCNC1=CC(=CC=C1)C Z56785946 [1,0,0,0,0,0|1,0,2]=4 134 B10R1.10 CNCC1=CC(=CC=C1)C Z102766992 [1,0,0,0,0,0|1,0,1]=3 135 B10R1.10 CNCC1=CC(=CC=C1)Cl Z56963343 [1,0,0,0,0,0|2,0,1]=4 136 B10R1.10 CNCC1=CC(=CC=C1)F Z56946085 [1,0,0,0,0,0|2,0,1]=4 137 B10R1.10 CNCC1=CC(=CC=C1)I Z3302798080 [1,0,0,0,0,0|2,0,1]=4 138 B10R1.10 CNCC1=CC(=CC=C1)O Z102766970 [1,0,0,0,0,0|2,0,1]=4 139 B10R1.10 CNCC1=NC(=CC=C1)C Z1255523287 [1,0,0,0,0,0|2,0,1]=4 140 B10R1.10 CNCC1=NC=CC(=C1)C Z5443664854 [1,0,0,0,0,0|2,0,1]=4 141 B10R1.10 COCC1=CC(=CC=C1)N Z285163816 [1,0,0,0,0,0|2,0,1]=4 142 B10R1.10 COCC1=CC(=CC=C1)O Z821093526 [1,0,0,0,0,0|2,0,1]=4 143 B10R1.10 CSCC1=CC(=CC=C1)Br Z17129082 [1,0,0,0,0,0|2,0,1]=4 144 B10R1.10 CSCC1=CC(=CC=C1)N Z732207152 [1,0,0,0,0,0|2,0,1]=4 145 B10R1.10 N#CCC1=CC=CC(=C1)Cl Z57039594 [1,0,0,0,0,0|2,0,1]=4 146 B10R1.10 N#CCC1=CC=CC(=C1)F Z104477994 [1,0,0,0,0,0|2,0,1]=4 147 B10R1.10 N#CCC1=CC=CC(=C1)N Z90120426 [1,0,0,0,0,0|2,0,1]=4 148 B10R1.10 N#CCC1=CC=CC(=C1)O Z1198161712 [1,0,0,0,0,0|2,0,1]=4 149 B10R1.10 NC1=CC(=CC=C1)CCO Z1198160776 [1,0,0,0,0,0|2,0,1]=4 150 B10R1.10 NC1=CC(=CC=C1)NC=O Z1203578959 [1,0,0,0,0,0|3,0,0]=4 151 B10R1.10 NCCC1=CC(=CC=C1)Br Z285143760 [1,0,0,0,0,0|2,0,1]=4 152 B10R1.10 NCCC1=CC(=CC=C1)Cl Z57051063 [1,0,0,0,0,0|2,0,1]=4 153 B10R1.10 NCCC1=CC(=CC=C1)F Z96092963 [1,0,0,0,0,0|2,0,1]=4 154 B10R1.10 NCCC1=CC(=CC=C1)I Z4874662549 [1,0,0,0,0,0|2,0,1]=4 155 B10R1.10 NCCC1=CC(=CC=C1)O Z935140764 [1,0,0,0,0,0|2,0,1]=4 156 B10R1.10 NOCC1=CC(=CC=C1)Cl Z1198339567 [1,0,0,0,0,0|3,0,0]=4 157 B10R1.10 O=CCC1=CC=CC(=C1)Br Z1079442816 [1,0,0,0,0,0|2,0,0]=3 158 B10R1.10 O=CCC1=CC=CC(=C1)Cl Z993017836 [1,0,0,0,0,0|2,0,0]=3 159 B10R1.10 O=CNC1=CC=CC(=C1)O Z56886391 [1,0,0,0,0,0|3,0,0]=4 160 B10R1.10 OCCC1=CC(=CC=C1)Cl Z992289382 [1,0,0,0,0,0|2,0,1]=4 161 B10R1.10 OCCC1=CC(=CC=C1)F Z397587224 [1,0,0,0,0,0|2,0,1]=4 162 B12R1.24 CC1=C(C(=CC=C1)C(=O)NO)O Z90125265 [0,1,0,0,0,0|2,0,1]=4 163 B12R1.40 C=CCN1C=C(C=C(C1=O)C)Br Z1514064359 [0,1,0,0,0,0|1,0,1]=3 164 B12R1.224 CC1=C(C(=CC=C1)CC(=O)O)Br Z1269227300 [0,1,0,0,0,0|2,0,0]=3 165 B12R1.224 CC1=C(C(=CC=C1)CC(=O)O)Cl Z1198264659 [0,1,0,0,0,0|2,0,0]=3 166 B12R1.224 CC1=C(C(=CC=C1)NC(=O)N)C Z107732968 [0,1,0,0,0,0|3,0,0]=4 167 B12R1.224 CC1=C(C=CC=C1Br)CC(=O)O Z1269111906 [0,1,0,0,0,0|3,0,0]=4 168 B12R1.224 CC1=CC=CN(C1=O)CC(=O)O Z1096152374 [0,1,0,0,0,0|2,0,1]=4 169 B12R1.224 NC(=O)CC1=C(C(=CC=C1)Cl)F Z2169650265 [0,1,0,0,0,0|3,0,0]=4 170 B12R1.224 NC1=C(C(=CC=C1)CC(=O)O)N Z1551954875 [0,1,0,0,0,0|3,0,0]=4 171 B12R1.224 O=C(O)CC1=C(C(=CC=C1)Br)Cl Z1269150472 [0,1,0,0,0,0|3,0,0]=4 172 B12R1.224 O=C(O)CC1=C(C(=CC=C1)Br)I Z1269162570 [0,1,0,0,0,0|3,0,0]=4 173 B12R1.224 O=C(O)CC1=C(C(=CC=C1)Cl)Cl Z982129970 [0,1,0,0,0,0|3,0,0]=4 174 B12R1.224 O=C(O)CC1=C(C(=CC=C1)F)F Z445167096 [0,1,0,0,0,0|3,0,0]=4 175 B12R1.224 O=C(O)CC1=C(C(=CC=C1)O)F Z1198218753 [0,1,0,0,0,0|3,0,0]=4 176 B12R1.280 CNCC1=C(C(=CC=C1)OC)Cl Z5594789851 [0,1,0,0,0,0|2,0,1]=4 177 B12R1.280 CNCC1=C(C(=CC=C1)OC)F Z5597731081 [0,1,0,0,0,0|2,0,1]=4 178 B12R1.542 CNCC1=C(C(=CC=C1)Br)OC Z815292202 [0,1,0,0,0,0|2,0,1]=4 179 B12R1.542 CNCC1=C(C(=CC=C1)Cl)OC Z5378131731 [0,1,0,0,0,0|2,0,1]=4 180 B12R2.81 CC1=C(C(=CC=C1)C2CC2)N Z5612828966 [0,0,0,1,0,0|1,0,2]=4 181 B12R2.82 CC1=C(C2=C(C=C1)CCC2)O Z1255490620 [0,0,0,1,0,0|0,0,2]=3 182 B12R2.82 CC1=C(C2=C(C=C1)CNC2)Br Z1681348552 [0,0,0,1,0,0|2,0,1]=4 183 B12R2.82 CC1=C(C2=C(C=C1)N=CN2)N Z1198223772 [0,0,0,1,0,0|3,0,0]=4 184 B12R2.82 CC1=C(C2=C(C=C1)NC=N2)C Z1203731927 [0,0,0,1,0,0|3,0,0]=4 185 B12R2.82 CC1=C(C2=C(C=CN2)C=C1)Br Z1551923928 [0,0,0,1,0,0|2,0,0]=3 186 B12R2.82 CC1=C(C2=C(C=CN2)C=C1)F Z1486007518 [0,0,0,1,0,0|2,0,0]=3 187 B12R2.82 CC1=C(C2=C(C=N1)COC2)O Z1216824433 [0,0,0,1,0,0|2,0,1]=4 188 B12R2.82 CC1=C2NC=CC2=CC=C1Br Z1269148523 [0,0,0,1,0,0|3,0,0]=4 189 B12R2.82 CC1=C2NC=CC2=CC=C1F Z1198182497 [0,0,0,1,0,0|3,0,0]=4 190 B12R2.82 CN1C=CC2=C(C1=O)NC=C2 Z1203734446 [0,0,0,1,0,0|2,0,1]=4 191 B12R2.82 ClC1=C(C2=C(C=CO2)C=C1)Br Z1681348708 [0,0,0,1,0,0|3,0,0]=4 192 B12R2.82 FC1=C2NC=CC2=CC=C1Cl Z1255416961 [0,0,0,1,0,0|3,0,0]=4 193 B12R2.82 NC1=C(C2=C(C=CS2)N=C1)O Z5766618507 [0,0,0,1,0,0|3,0,0]=4 194 B12R2.82 OC1=C2C=CSC2=CC=C1Br Z1269129531 [0,0,0,1,0,0|2,0,1]=4 195 B12R2.202 CC1=C2N=C(NC2=CC=C1)N Z995046466 [0,0,0,1,0,0|3,0,0]=4 196 B12R2.202 CC1=C2N=C(NC2=CC=C1)S Z596250516 [0,0,0,1,0,0|3,0,0]=4 197 B12R2.202 CC1=C2N=C(SC2=CC=C1)N Z56174289 [0,0,0,1,0,0|3,0,0]=4 198 B12R2.202 CC1=C2N=C(SC2=CC=C1)O Z1198163380 [0,0,0,1,0,0|3,0,0]=4 199 B12R2.202 CC1=C2NC(=O)CC2=CC=C1 Z1198159857 [0,0,0,1,0,0|2,0,0]=3 200 B12R2.202 CC1=C2NC(=O)NC2=CC=C1 Z1198176895 [0,0,0,1,0,0|3,0,0]=4 201 B12R2.202 CC1=C2OC(=NC2=CC=C1)N Z1251362841 [0,0,0,1,0,0|2,0,0]=3 202 B12R2.202 CC1=C2OC(=O)NC2=CC=C1 Z1255416550 [0,0,0,1,0,0|2,0,0]=3 203 B12R2.202 CC1=C2SC(=NC2=CC=C1)N Z1262621975 [0,0,0,1,0,0|2,1,0]=4 204 B12R2.202 CC1=C2SC(=O)NC2=CC=C1 Z1198222422 [0,0,0,1,0,0|2,1,0]=4 205 B12R2.202 CC1=CC2=C(N1)C(=CC=C2)C Z1198147838 [0,0,0,1,0,0|1,0,2]=4 206 B12R2.202 CC1=CC2=C(O1)C(=CC=C2)Br Z1269204422 [0,0,0,1,0,0|1,0,2]=4 207 B12R2.202 CC1CC2=C(O1)C(=CC=C2)Cl Z803153168 [0,0,0,1,0,0|1,0,2]=4 208 B12R2.202 NC1=C2NC(=O)CC2=CC=C1 Z1203579747 [0,0,0,1,0,0|3,0,0]=4 209 B12R2.202 NC1=C2OC(=O)NC2=CC=C1 Z1198223473 [0,0,0,1,0,0|3,0,0]=4 210 B12R2.202 NC1=NC2=C(O1)C(=CC=C2)Br Z1269218339 [0,0,0,1,0,0|3,0,0]=4 211 B12R2.202 O=C1CC2=CC=CC(=C2N1)Br Z1269179204 [0,0,0,1,0,0|3,0,0]=4 212 B12R2.202 O=C1CC2=CC=CC(=C2O1)Br Z2489234207 [0,0,0,1,0,0|2,0,0]=3 213 B12R2.202 O=C1NC2=CC=CC(=C2O1)Br Z1269211846 [0,0,0,1,0,0|3,0,0]=4 214 B12R2.202 O=C1NC2=CC=CC(=C2O1)F Z1255387806 [0,0,0,1,0,0|3,0,0]=4 215 B12R2.202 SC1=NC2=C(O1)C(=CC=C2)Cl Z1720684812 [0,0,0,1,0,0|3,0,0]=4 216 B12R2.1081 BrC1=C2N=CC=CC2=CC=C1 Z839152792 [0,0,0,1,0,0|2,0,1]=4 217 B12R2.1081 BrC1=C2N=CC=NC2=CC=C1 Z1269202681 [0,0,0,1,0,0|3,0,0]=4 218 B12R2.1081 BrC1=C2OCCCC2=CC=C1 Z1269242001 [0,0,0,1,0,0|1,0,2]=4 219 B12R2.1081 CC1=C2C=CC=CC2=CC=C1 Z104475342 [0,0,0,1,0,0|1,0,1]=3 220 B12R2.1081 CC1=C2C=CC=CC2=CC=N1 Z1255415440 [0,0,0,1,0,0|2,0,1]=4 221 B12R2.1081 CC1=C2C=CC=CC2=NC=C1 Z104472668 [0,0,0,1,0,0|2,0,1]=4 222 B12R2.1081 CC1=C2CCNCC2=CC=C1 Z1891775029 [0,0,0,1,0,0|2,0,1]=4 223 B12R2.1081 CC1=C2N=CC=CC2=NC=C1 Z1255451101 [0,0,0,1,0,0|2,0,1]=4 224 B12R2.1081 CC1=C2NCCCC2=CC=C1 Z199537268 [0,0,0,1,0,0|1,0,2]=4 225 B12R2.1081 ClC1=C2C=CC=CC2=CC=C1 Z104504716 [0,0,0,1,0,0|2,0,1]=4 226 B12R2.1081 ClC1=C2N=CC=CC2=CC=C1 Z362567890 [0,0,0,1,0,0|2,0,1]=4 227 B12R2.1081 FC1=C2C=CC=CC2=CC=C1 Z1162445957 [0,0,0,1,0,0|2,0,1]=4 228 B12R2.1081 FC1=C2N=CC=CC2=CC=C1 Z243277338 [0,0,0,1,0,0|2,0,1]=4 229 B12R2.1081 FC1=C2N=CC=NC2=CC=C1 Z1198266668 [0,0,0,1,0,0|3,0,0]=4 230 B12R2.1081 IC1=C2C=CC=NC2=CC=C1 Z381540734 [0,0,0,1,0,0|3,0,0]=4 231 B12R2.1081 NC1=C2C=CC=CC2=CC=C1 Z57127984 [0,0,0,1,0,0|2,0,1]=4 232 B12R2.1081 NC1=C2C=CC=NC2=CC=C1 Z56919160 [0,0,0,1,0,0|3,0,0]=4 233 B12R2.1081 NC1=C2N=CC=CC2=CC=C1 Z57032752 [0,0,0,1,0,0|2,0,1]=4 234 B12R2.1081 NC1=C2N=CC=NC2=CC=C1 Z1198157683 [0,0,0,1,0,0|3,0,0]=4 235 B12R2.1081 NC1=C2OCCCC2=CC=C1 Z1723491871 [0,0,0,1,0,0|1,0,2]=4 236 B12R2.1081 OC1=C2C=CC=CC2=CC=C1 Z104474036 [0,0,0,1,0,0|2,0,1]=4 237 B12R2.1081 OC1=C2N=CC=CC2=CC=C1 Z56926518 [0,0,0,1,0,0|2,0,1]=4 238 B12R2.1081 OC1=C2OCCCC2=CC=C1 Z1198726643 [0,0,0,1,0,0|1,0,2]=4 239 B9R1.2 CC1=CC(=CC=C1)C=O Z104478208 [2,0,0,0,0,0|1,0,0]=3 240 B9R1.2 CC1=CC(=CC=C1)NN Z56943685 [2,0,0,0,0,0|2,0,0]=4 241 B9R1.2 CC1=CC(=CN=C1)C=O Z1198176743 [2,0,0,0,0,0|2,0,0]=4 242 B9R1.2 CC1=CC(=CN=C1)CN Z1198167984 [2,0,0,0,0,0|2,0,0]=4 243 B9R1.2 CC1=CC(=CN=C1)CO Z4562296729 [2,0,0,0,0,0|2,0,0]=4 244 B9R1.2 CC1=CC(=NC=C1)C=O Z1201624018 [2,0,0,0,0,0|2,0,0]=4 245 B9R1.2 CC1=NC(=CC=C1)C=O Z1079442396 [2,0,0,0,0,0|2,0,0]=4 246 B9R1.2 CC1=NC(=CC=C1)CN Z291234028 [2,0,0,0,0,0|2,0,0]=4 247 B9R1.2 CC1=NC(=CC=C1)CO Z397587486 [2,0,0,0,0,0|2,0,0]=4 248 B9R1.2 CC1=NC=CC(=C1)C=O Z1198168755 [2,0,0,0,0,0|2,0,0]=4 249 B9R1.2 CC1=NC=CC(=C1)CO Z1198175905 [2,0,0,0,0,0|2,0,0]=4 250 B9R1.2 CCC1=CC(=CC=C1)Br Z1201619408 [2,0,0,0,0,0|1,0,1]=4 251 B9R1.2 CCC1=CC(=CC=C1)N Z104478688 [2,0,0,0,0,0|1,0,1]=4 252 B9R1.2 CCC1=NC(=CC=C1)C Z1255485781 [2,0,0,0,0,0|1,0,1]=4 253 B9R1.2 COC1=CC(=CC=C1)C Z53834440 [2,0,0,0,0,0|1,0,1]=4 254 B9R1.2 NCC1=CC(=CC=C1)Br Z1262246228 [2,0,0,0,0,0|2,0,0]=4 255 B9R1.2 NCC1=CC(=CC=C1)I Z1269220799 [2,0,0,0,0,0|2,0,0]=4 256 B9R1.2 NCC1=CC(=CC=C1)O Z744729056 [2,0,0,0,0,0|2,0,0]=4 257 B9R1.2 O=CC1=CC=CC(=C1)Br Z104472918 [2,0,0,0,0,0|2,0,0]=4 258 B9R1.2 O=CC1=CC=CC(=C1)Cl Z104476504 [2,0,0,0,0,0|2,0,0]=4 259 B9R1.2 O=CC1=CC=CC(=C1)F Z104476574 [2,0,0,0,0,0|2,0,0]=4 260 B9R1.2 O=CC1=CC=CC(=C1)I Z57887683 [2,0,0,0,0,0|2,0,0]=4 261 B9R1.2 O=CC1=CC=CC(=C1)O Z57772446 [2,0,0,0,0,0|2,0,0]=4 262 B9R1.2 O=CC1=CC=CC(=C1)S Z969587160 [2,0,0,0,0,0|2,0,0]=4 263 B9R1.2 OC1=CC(=CC=C1)CCl Z1198169502 [2,0,0,0,0,0|2,0,0]=4 264 B9R1.2 OCC1=CC(=CC=C1)Br Z335244752 [2,0,0,0,0,0|2,0,0]=4 265 B9R1.2 OCC1=CC(=CC=C1)Cl Z212055560 [2,0,0,0,0,0|2,0,0]=4 266 B9R1.2 OCC1=CC(=CC=C1)F Z104477458 [2,0,0,0,0,0|2,0,0]=4 267 B9R1.2 OCC1=CC(=CC=C1)O Z335245000 [2,0,0,0,0,0|2,0,0]=4 268 B9R1.3 CC1=C(C(=CC=C1)Br)C Z165205526 [2,0,0,0,0,0|2,0,0]=4 269 B9R1.3 CC1=C(C(=CC=C1)N)Br Z1255379702 [2,0,0,0,0,0|2,0,0]=4 270 B9R1.3 CC1=C(C(=CC=C1)N)C Z104472546 [2,0,0,0,0,0|2,0,0]=4 271 B9R1.3 CC1=C(C(=CC=C1)N)Cl Z1198316539 [2,0,0,0,0,0|2,0,0]=4 272 B9R1.3 CC1=C(C(=CC=C1)N)N Z104493206 [2,0,0,0,0,0|2,0,0]=4 273 B9R1.3 CC1=C(C(=CC=C1)O)Br Z1198267200 [2,0,0,0,0,0|2,0,0]=4 274 B9R1.3 CC1=C(C(=CC=C1)O)Cl Z1198147985 [2,0,0,0,0,0|2,0,0]=4 275 B9R1.3 CC1=C(C(=CC=C1)O)I Z1269223622 [2,0,0,0,0,0|2,0,0]=4 276 B9R1.3 CC1=C(C(=CC=C1)O)N Z729250490 [2,0,0,0,0,0|2,0,0]=4 277 B9R1.3 CC1=C(C(=CC=C1)O)O Z56347229 [2,0,0,0,0,0|1,0,0]=3 278 B9R1.3 CC1=C(C(=O)C=CO1)O Z1255382969 [2,0,0,0,0,0|2,0,0]=4 279 B9R1.3 CC1=C(C(=S)C=CO1)O Z1198156366 [2,0,0,0,0,0|2,0,0]=4 280 B9R1.3 CC1=CC=CC(=C1N)C Z57127391 [2,0,0,0,0,0|1,0,0]=3 281 B9R1.3 CC1=CC=CC(=C1O)C Z104473832 [2,0,0,0,0,0|0,0,0]=2 282 B9R1.3 CC1=CN=CC(=C1N)C Z1741978315 [2,0,0,0,0,0|2,0,0]=4 283 B9R1.3 CC1=NC=CC(=C1N)C Z1203578937 [2,0,0,0,0,0|2,0,0]=4 284 B9R1.3 CC1=NC=NC(=C1O)C Z1255461596 [2,0,0,0,0,0|2,0,0]=4 285 B9R1.3 NC1=C(C(=CC=C1)Cl)O Z274763124 [2,0,0,0,0,0|2,0,0]=4 286 B9R1.3 NC1=C(C(=CC=C1)F)O Z1203578717 [2,0,0,0,0,0|2,0,0]=4 287 B9R1.3 OC1=C(C(=CC=C1)Br)O Z1255450532 [2,0,0,0,0,0|2,0,0]=4 288 B9R1.3 OC1=C(C(=CC=C1)Cl)O Z1255356375 [2,0,0,0,0,0|2,0,0]=4 289 B9R1.3 OC1=C(C=CC=C1Br)Br Z285522740 [2,0,0,0,0,0|2,0,0]=4 290 B9R1.3 OC1=C(C=CC=C1Cl)Br Z1269200416 [2,0,0,0,0,0|2,0,0]=4 291 B9R1.3 OC1=C(C=CC=C1Cl)I Z1269132398 [2,0,0,0,0,0|2,0,0]=4 292 B9R1.3 OC1=C(C=CC=C1F)F Z147646794 [2,0,0,0,0,0|2,0,0]=4 293 B9R1.3 OC1=CC=CC(=C1O)O Z57127553 [2,0,0,0,0,0|2,0,0]=4 294 B9R1.15 BrCC1=C(C=CC=C1)Br Z56969700 [2,0,0,0,0,0|2,0,0]=4 295 B9R1.15 C=CC1=C(C=CC=C1)Cl Z957339910 [2,0,0,0,0,0|1,0,0]=3 296 B9R1.15 C=CC1=[N+](C=CC=C1)[O-] Z1255451651 [2,0,0,0,0,0|1,0,1]=4 297 B9R1.15 CC1=C(C=CC=C1)C=O Z104478122 [2,0,0,0,0,0|2,0,0]=4 298 B9R1.15 CC1=C(C=CC=C1)CO Z335244790 [2,0,0,0,0,0|2,0,0]=4 299 B9R1.15 CCC1=C(C=CC=C1)Br Z1255457372 [2,0,0,0,0,0|1,0,1]=4 300 B9R1.15 CCC1=C(C=CC=C1)O Z104477226 [2,0,0,0,0,0|0,0,1]=3 301 B9R1.15 CCC1=C(N=CC=C1)O Z1198266674 [2,0,0,0,0,0|1,0,1]=4 302 B9R1.15 COC1=C(C=CC=C1)O Z104474028 [2,0,0,0,0,0|1,0,1]=4 303 B9R1.15 N#CC1=C(C=CC=C1)O Z104477750 [2,0,0,0,0,0|1,0,1]=4 304 B9R1.15 NC1=C(C=CC=C1)C=O Z3034936011 [2,0,0,0,0,0|2,0,0]=4 305 B9R1.15 NC1=C(C=CC=C1)CO Z104495736 [2,0,0,0,0,0|2,0,0]=4 306 B9R1.15 NCC1=C(C=CC=C1)Cl Z55002587 [2,0,0,0,0,0|2,0,0]=4 307 B9R1.15 NCC1=C(C=CC=C1)I Z2574934431 [2,0,0,0,0,0|2,0,0]=4 308 B9R1.15 NCC1=C(C=CC=C1)O Z993991142 [2,0,0,0,0,0|1,0,0]=3 309 B9R1.15 NCC1=C(C=CC=N1)O Z1198156472 [2,0,0,0,0,0|2,0,0]=4 310 B9R1.15 O=CC1=C(C=CC=C1)Br Z104478338 [2,0,0,0,0,0|2,0,0]=4 311 B9R1.15 O=CC1=C(C=CC=C1)Cl Z104472866 [2,0,0,0,0,0|2,0,0]=4 312 B9R1.15 O=CC1=C(C=CC=C1)F Z104476570 [2,0,0,0,0,0|2,0,0]=4 313 B9R1.15 O=CC1=C(C=CC=C1)I Z56899024 [2,0,0,0,0,0|2,0,0]=4 314 B9R1.15 O=CC1=C(C=CC=C1)O Z57127523 [2,0,0,0,0,0|1,0,0]=3 315 B9R1.15 O=CC1=C(C=CC=N1)O Z1201623419 [2,0,0,0,0,0|2,0,0]=4 316 B9R1.15 O=CC1=C(C=CN=C1)O Z1198277591 [2,0,0,0,0,0|2,0,0]=4 317 B9R1.15 OCC1=C(C=CC=C1)Br Z335245004 [2,0,0,0,0,0|2,0,0]=4 318 B9R1.15 OCC1=C(C=CC=C1)Cl Z104476786 [2,0,0,0,0,0|2,0,0]=4 319 B9R1.15 OCC1=C(C=CC=C1)F Z104495204 [2,0,0,0,0,0|2,0,0]=4 320 B9R1.15 OCC1=C(C=CC=C1)I Z57472670 [2,0,0,0,0,0|2,0,0]=4 321 B9R1.15 OCC1=C(C=CC=C1)O Z335244902 [2,0,0,0,0,0|1,0,0]=3 322 B9R1.15 SCC1=C(C=CC=C1)Cl Z55948221 [2,0,0,0,0,0|2,0,0]=4 323 B9R1.8 CCCC1=CC=CC=C1 Z104479154 [2,0,0,0,0,0|0,0,2]=4 324 B9R1.8 NNCC1=CC=CC=C1 Z56969306 [2,0,0,0,0,0|2,0,0]=4 325 B9R1.8 NOCC1=CC=CC=C1 Z90668722 [2,0,0,0,0,0|2,0,0]=4 326 B9R1.8 O=CCC1=CC=CC=C1 Z104472146 [2,0,0,0,0,0|1,0,0]=3 327 B9R1.8 OCCC1=CC=CC=C1 Z104473586 [2,0,0,0,0,0|1,0,1]=4 328 B11R1.8 CC1=C(C(=CC(=C1)Br)C=O)O Z1741962208 [1,1,0,0,0,0|1,0,0]=3 329 B11R1.8 CC1=C(C(=CC(=C1)Cl)C#N)O Z1513912456 [1,1,0,0,0,0|1,0,1]=4 330 B11R1.8 CC1=C(C(=CC(=C1)Cl)C=O)N Z1262625270 [1,1,0,0,0,0|2,0,0]=4 331 B11R1.8 CC1=C(C(=CC(=C1)Cl)C=O)O Z979493232 [1,1,0,0,0,0|1,0,0]=3 332 B11R1.8 CC1=C(C(=CC(=C1)F)C=O)O Z1255403387 [1,1,0,0,0,0|1,0,0]=3 333 B11R1.8 CC1=C(C(=CC(=C1)F)CO)I Z3210509260 [1,1,0,0,0,0|2,0,0]=4 334 B11R1.8 CC1=CC(=C(C(=C1)Br)O)C=O Z979493226 [1,1,0,0,0,0|2,0,0]=4 335 B11R1.8 CC1=CC(=C(C(=C1)C)O)C=O Z336080438 [1,1,0,0,0,0|1,0,0]=3 336 B11R1.8 CC1=CC(=C(C(=C1)C)O)CN Z5590164681 [1,1,0,0,0,0|1,0,0]=3 337 B11R1.8 CC1=CC(=C(C(=C1)Cl)O)C=O Z1198170002 [1,1,0,0,0,0|2,0,0]=4 338 B11R1.8 CC1=CC(=C(C(=C1)F)O)C=O Z1255429826 [1,1,0,0,0,0|2,0,0]=4 339 B11R1.8 NCC1=C(C(=CC(=C1)Cl)Cl)O Z2130642309 [1,1,0,0,0,0|2,0,0]=4 340 B11R1.8 NCC1=C(C(=CC(=C1)F)F)O Z4658317589 [1,1,0,0,0,0|2,0,0]=4 341 B11R1.8 O=CC1=C(C(=CC(=C1)Br)Br)O Z57313905 [1,1,0,0,0,0|2,0,0]=4 342 B11R1.8 O=CC1=C(C(=CC(=C1)Br)Cl)O Z57480607 [1,1,0,0,0,0|2,0,0]=4 343 B11R1.8 O=CC1=C(C(=CC(=C1)Br)F)O Z979493208 [1,1,0,0,0,0|2,0,0]=4 344 B11R1.8 O=CC1=C(C(=CC(=C1)Br)I)O Z57313906 [1,1,0,0,0,0|2,0,0]=4 345 B11R1.8 O=CC1=C(C(=CC(=C1)Cl)Br)O Z979493248 [1,1,0,0,0,0|2,0,0]=4 346 B11R1.8 O=CC1=C(C(=CC(=C1)Cl)Cl)O Z104501828 [1,1,0,0,0,0|2,0,0]=4 347 B11R1.8 O=CC1=C(C(=CC(=C1)Cl)F)O Z1255405290 [1,1,0,0,0,0|2,0,0]=4 348 B11R1.8 O=CC1=C(C(=CC(=C1)F)Br)O Z979493250 [1,1,0,0,0,0|2,0,0]=4 349 B11R1.8 O=CC1=C(C(=CC(=C1)F)F)O Z979493254 [1,1,0,0,0,0|2,0,0]=4 350 B11R1.8 O=CC1=C(C(=CC(=C1)I)I)O Z57313908 [1,1,0,0,0,0|2,0,0]=4 351 B11R1.8 O=CC1=C(C(=CC(=C1)O)Br)O Z317050850 [1,1,0,0,0,0|2,0,0]=4 352 B11R1.8 O=CC1=CC(=CC(=C1O)O)Cl Z1511914486 [1,1,0,0,0,0|2,0,0]=4 353 B11R1.72 CC1=C(C(=C(C=C1)Br)C=O)F Z1269224868 [1,1,0,0,0,0|2,0,0]=4 354 B11R1.72 CC1=C(C(=C(C=C1)Br)O)C=O Z1269242258 [1,1,0,0,0,0|2,0,0]=4 355 B11R1.72 CC1=C(C(=C(C=C1)C)C=O)C Z1216844627 [1,1,0,0,0,0|2,0,0]=4 356 B11R1.72 CC1=C(C(=C(C=C1)C)C=O)O Z1198163822 [1,1,0,0,0,0|1,0,0]=3 357 B11R1.72 CC1=C(C(=C(C=C1)Cl)C=O)N Z1739253846 [1,1,0,0,0,0|2,0,0]=4 358 B11R1.72 CC1=C(C(=C(C=C1)Cl)C=O)O Z1267796572 [1,1,0,0,0,0|1,0,0]=3 359 B11R1.72 CC1=C(C(=C(C=C1)Cl)CO)N Z3074473359 [1,1,0,0,0,0|2,0,0]=4 360 B11R1.72 CC1=C(C(=C(C=C1)Cl)O)C=O Z1255418082 [1,1,0,0,0,0|2,0,0]=4 361 B11R1.72 CC1=C(C(=C(C=C1)F)C=O)Br Z1269163286 [1,1,0,0,0,0|2,0,0]=4 362 B11R1.72 CC1=C(C(=C(C=C1)F)C=O)Cl Z1203161802 [1,1,0,0,0,0|2,0,0]=4 363 B11R1.72 CC1=C(C(=C(C=C1)F)C=O)F Z1201621152 [1,1,0,0,0,0|2,0,0]=4 364 B11R1.72 CC1=C(C(=C(C=C1)F)CN)F Z5485735318 [1,1,0,0,0,0|2,0,0]=4 365 B11R1.72 CC1=C(C(=C(C=C1)F)O)C=O Z1255393204 [1,1,0,0,0,0|2,0,0]=4 366 B11R1.72 O=CC1=C(C(=CC=C1Cl)Cl)O Z1198157441 [1,1,0,0,0,0|2,0,0]=4 367 B11R1.72 O=CC1=C(C(=CC=C1F)Br)O Z1322794675 [1,1,0,0,0,0|2,0,0]=4 368 B11R1.72 O=CC1=C(C(=CC=C1F)Cl)O Z1504674269 [1,1,0,0,0,0|2,0,0]=4 369 B11R1.72 O=CC1=C(C=CC(=C1O)O)F Z1504673060 [1,1,0,0,0,0|2,0,0]=4 370 B11R1.159 CC(=O)C1=C(C(=CC=C1)C)C Z992749248 [1,1,0,0,0,0|1,0,1]=4 371 B11R1.159 CC(=O)C1=C(C(=CC=C1)O)O Z1198162545 [1,1,0,0,0,0|1,0,1]=4 372 B11R1.159 CC1=C(C(=CC=C1)C(=O)N)F Z1198233476 [1,1,0,0,0,0|2,0,0]=4 373 B11R1.159 CC1=C(C(=CC=C1)C(=O)N)N Z135897518 [1,1,0,0,0,0|2,0,0]=4 374 B11R1.159 CC1=C(C(=CC=C1)C(=O)N)O Z68590334 [1,1,0,0,0,0|1,0,0]=3 375 B11R1.159 CC1=C(C(=CC=C1)C(=O)O)Br Z1269235887 [1,1,0,0,0,0|2,0,0]=4 376 B11R1.159 CC1=C(C(=CC=C1)C(=O)O)C Z56899190 [1,1,0,0,0,0|2,0,0]=4 377 B11R1.159 CC1=C(C(=CC=C1)C(=O)O)Cl Z1201618851 [1,1,0,0,0,0|2,0,0]=4 378 B11R1.159 CC1=C(C(=CC=C1)C(=O)O)F Z1201617985 [1,1,0,0,0,0|2,0,0]=4 379 B11R1.159 CC1=C(C(=CC=C1)C(=O)O)I Z239685230 [1,1,0,0,0,0|2,0,0]=4 380 B11R1.159 CC1=C(C(=CC=C1)C(=O)O)N Z94600359 [1,1,0,0,0,0|2,0,0]=4 381 B11R1.159 CC1=C(C(=CC=C1)C(=O)O)O Z56917421 [1,1,0,0,0,0|1,0,0]=3 382 B11R1.159 CC1=C(C(=CC=C1)[N+](=O)[O-])O Z415740554 [1,1,0,0,0,0|2,0,0]=4 383 B11R1.159 CC1=C(C(=CC=N1)C(=O)O)O Z3766096952 [1,1,0,0,0,0|2,0,0]=4 384 B11R1.159 CC1=CC=CC(=C1C)C(C)N Z992749600 [1,1,0,0,0,0|1,0,1]=4 385 B11R1.159 CC1=CC=CC(=C1N)C(C)C Z3676142304 [1,1,0,0,0,0|1,0,1]=4 386 B11R1.159 NC(=O)C1=C(C(=CC=C1)Cl)O Z1255435741 [1,1,0,0,0,0|2,0,0]=4 387 B11R1.159 NC1=C(C(=CC=C1)C(=O)O)O Z1255423499 [1,1,0,0,0,0|2,0,0]=4 388 B11R1.159 O=C(O)C1=C(C(=CC=C1)Br)O Z367679360 [1,1,0,0,0,0|2,0,0]=4 389 B11R1.159 O=C(O)C1=C(C(=CC=C1)Cl)O Z367679194 [1,1,0,0,0,0|2,0,0]=4 390 B11R1.159 O=C(O)C1=C(C(=CC=C1)O)O Z367679198 [1,1,0,0,0,0|2,0,0]=4 391 B11R1.265 COC1=C(C=CC=C1Br)C=O Z815295688 [1,1,0,0,0,0|2,0,0]=4 392 B11R1.265 COC1=C(C=CC=C1Br)CN Z1365534341 [1,1,0,0,0,0|2,0,0]=4 393 B11R1.265 COC1=C(C=CC=C1Br)CO Z815297240 [1,1,0,0,0,0|2,0,0]=4 394 B11R1.265 COC1=C(C=CC=C1C)C=O Z1198174870 [1,1,0,0,0,0|1,0,0]=3 395 B11R1.265 COC1=C(C=CC=C1Cl)C=O Z808662828 [1,1,0,0,0,0|2,0,0]=4 396 B11R1.265 COC1=C(C=CC=C1Cl)CN Z2901974091 [1,1,0,0,0,0|2,0,0]=4 397 B11R1.265 COC1=C(C=CC=C1O)C=O Z199439532 [1,1,0,0,0,0|2,0,0]=4 398 B11R1.267 CCC1=C(C(=CC=C1)C=O)F Z2044808788 [1,1,0,0,0,0|2,0,0]=4 399 B11R1.267 CCC1=C(C(=CC=C1)C=O)O Z1255399776 [1,1,0,0,0,0|1,0,0]=3 400 B11R1.267 CCC1=CC=CC(=C1N)CC Z104479240 [1,1,0,0,0,0|1,0,1]=4 401 B11R1.267 COC1=C(C(=CC=C1)C=O)Br Z1269149587 [1,1,0,0,0,0|2,0,0]=4 402 B11R1.267 COC1=C(C(=CC=C1)C=O)C Z1198307350 [1,1,0,0,0,0|2,0,0]=4 403 B11R1.267 COC1=C(C(=CC=C1)C=O)Cl Z1255387516 [1,1,0,0,0,0|2,0,0]=4 404 B11R1.267 COC1=C(C(=CC=C1)C=O)F Z1255373110 [1,1,0,0,0,0|2,0,0]=4 405 B11R1.267 COC1=C(C(=CC=C1)C=O)O Z57921503 [1,1,0,0,0,0|1,0,0]=3 406 B11R1.267 COC1=C(C(=CC=C1)CN)Cl Z3244608696 [1,1,0,0,0,0|2,0,0]=4 407 B11R1.267 COC1=C(C(=CC=C1)CN)O Z1263529631 [1,1,0,0,0,0|1,0,0]=3 408 B11R1.267 COC1=C(C(=CC=C1)CO)C Z1255443548 [1,1,0,0,0,0|2,0,0]=4 409 B11R1.267 COC1=CC=CC(=C1O)OC Z104477654 [1,1,0,0,0,0|1,0,1]=4 410 B11R1.267 N#CC1=C(C(=CC=C1)C=O)O Z1255460193 [1,1,0,0,0,0|1,0,1]=4 411 B11R1.278 CC1=C(C(=C(C=C1)C=O)C)C Z1216815451 [1,1,0,0,0,0|2,0,0]=4 412 B11R1.278 CC1=C(C(=C(C=C1)C=O)F)C Z1216844647 [1,1,0,0,0,0|2,0,0]=4 413 B11R1.278 CC1=C(C(=C(C=C1)C=O)O)Br Z1269121321 [1,1,0,0,0,0|2,0,0]=4 414 B11R1.278 CC1=C(C(=C(C=C1)C=O)O)C Z1198170007 [1,1,0,0,0,0|1,0,0]=3 415 B11R1.278 CC1=C(C(=C(C=C1)C=O)O)F Z1255397667 [1,1,0,0,0,0|2,0,0]=4 416 B11R1.278 CC1=C(C(=CC=C1Cl)C=O)Cl Z1511822538 [1,1,0,0,0,0|2,0,0]=4 417 B11R1.278 CC1=C(C(=CC=C1F)C=O)Cl Z1255444502 [1,1,0,0,0,0|2,0,0]=4 418 B11R1.278 CC1=C(C(=CC=C1F)C=O)F Z1201624179 [1,1,0,0,0,0|2,0,0]=4 419 B11R1.278 CC1=C(C(=CC=C1O)C=O)O Z1198151439 [1,1,0,0,0,0|1,0,0]=3 420 B11R1.278 CC1=C(C=CC(=C1F)CN)Br Z4381501753 [1,1,0,0,0,0|2,0,0]=4 421 B11R1.278 CC1=C(C=CC(=C1O)C=O)Br Z1513836457 [1,1,0,0,0,0|1,0,0]=3 422 B11R1.278 CC1=C(C=CC(=C1O)C=O)Cl Z1504686379 [1,1,0,0,0,0|1,0,0]=3 423 B11R1.278 CC1=C(C=CC(=C1O)C=O)F Z1216844710 [1,1,0,0,0,0|1,0,0]=3 424 B11R1.278 NCC1=C(C(=C(C=C1)O)O)O Z4780998599 [1,1,0,0,0,0|2,0,0]=4 425 B11R1.278 O=CC1=C(C(=C(C=C1)Br)Cl)O Z1681355510 [1,1,0,0,0,0|2,0,0]=4 426 B11R1.278 O=CC1=C(C(=C(C=C1)Cl)Cl)O Z1255432815 [1,1,0,0,0,0|2,0,0]=4 427 B11R1.278 O=CC1=C(C(=C(C=C1)Cl)F)O Z1504671625 [1,1,0,0,0,0|2,0,0]=4 428 B11R1.278 O=CC1=C(C(=C(C=C1)Cl)I)O Z1322794665 [1,1,0,0,0,0|2,0,0]=4 429 B11R1.278 O=CC1=C(C(=C(C=C1)F)Br)O Z1513876434 [1,1,0,0,0,0|2,0,0]=4 430 B11R1.278 O=CC1=C(C(=C(C=C1)F)F)O Z1201624524 [1,1,0,0,0,0|2,0,0]=4 431 B11R1.278 O=CC1=C(C(=C(C=C1)F)O)O Z1216844708 [1,1,0,0,0,0|2,0,0]=4 432 B11R1.278 O=CC1=C(C(=C(C=C1)O)O)O Z104500110 [1,1,0,0,0,0|2,0,0]=4 433 B11R1.17 C#CCOC1=C(C=CC=C1)O Z381415368 [1,1,0,0,0,0|0,0,2]=4 434 B11R1.17 C=CCSC1=C(C=CC=C1)N Z89272864 [1,1,0,0,0,0|1,0,0]=3 435 B11R1.17 CCCOC1=C(C=CC=C1)O Z55993120 [1,1,0,0,0,0|0,0,2]=4 436 B11R1.17 CNCCC1=C(C=CC=C1)O Z1665033474 [1,1,0,0,0,0|0,0,2]=4 437 B11R1.17 NCCOC1=C(C=CC=C1)O Z3217405430 [1,1,0,0,0,0|1,0,1]=4 438 B11R1.17 O=CCCC1=C(C=CC=C1)F Z993017602 [1,1,0,0,0,0|1,0,1]=4 439 B11R1.17 OCCOC1=C(C=CC=C1)O Z56755902 [1,1,0,0,0,0|1,0,1]=4 440 B11R1.41 C=CCC1=C(C=CC=C1)C=O Z1511741429 [1,1,0,0,0,0|0,0,1]=3 441 B11R1.41 CNCC1=C(C=CC=C1)OC Z56944118 [1,1,0,0,0,0|1,0,1]=4 442 B11R1.41 COC1=C(C=CC=C1)CC=O Z3224150690 [1,1,0,0,0,0|1,0,0]=3 443 B11R1.41 COC1=C(C=CC=C1)CCN Z104493472 [1,1,0,0,0,0|1,0,1]=4 444 B11R1.81 CC1=CC(=C(C=C1)CC=O)C Z1020787114 [1,1,0,0,0,0|2,0,0]=4 445 B11R1.81 NCCC1=C(C=C(C=C1)O)O Z1166113553 [1,1,0,0,0,0|1,0,1]=4 446 B11R1.81 O=CCC1=C(C=C(C=C1)Cl)Cl Z1183459048 [1,1,0,0,0,0|2,0,0]=4 447 B11R1.81 O=CCC1=C(C=C(C=C1)F)Cl Z1183459114 [1,1,0,0,0,0|2,0,0]=4 448 B11R1.81 O=CCC1=C(C=C(C=C1)F)F Z1020790242 [1,1,0,0,0,0|2,0,0]=4 449 B11R1.81 OCCC1=C(C=C(C=C1)O)O Z1513827466 [1,1,0,0,0,0|1,0,1]=4 450 B11R1.86 CC(=O)CC1=C(C=CC=C1)C Z329711570 [1,1,0,0,0,0|1,0,1]=4 451 B11R1.86 CC(=O)CC1=C(C=CC=C1)Cl Z329711556 [1,1,0,0,0,0|1,0,1]=4 452 B11R1.86 CC(=O)CC1=C(C=CC=C1)I Z1335657335 [1,1,0,0,0,0|1,0,1]=4 453 B11R1.86 CC(=O)CC1=C(C=CC=C1)O Z1198152110 [1,1,0,0,0,0|0,0,1]=3 454 B11R1.86 CC(=O)NC1=C(C=CC=C1)O Z57040482 [1,1,0,0,0,0|1,0,1]=4 455 B11R1.86 CC(=O)OC1=C(C=CC=C1)O Z1513803522 [1,1,0,0,0,0|1,0,1]=4 456 B11R1.86 CC1=C(C=CC=C1)CC(=N)N Z1374778803 [1,1,0,0,0,0|2,0,0]=4 457 B11R1.86 CC1=C(C=CC=C1)CC(=O)N Z52214433 [1,1,0,0,0,0|2,0,0]=4 458 B11R1.86 CC1=C(C=CC=C1)CC(=O)O Z104503424 [1,1,0,0,0,0|2,0,0]=4 459 B11R1.86 N=C(N)CC1=C(C=CC=C1)Br Z1742055055 [1,1,0,0,0,0|2,0,0]=4 460 B11R1.86 N=C(N)CC1=C(C=CC=C1)F Z1695738915 [1,1,0,0,0,0|2,0,0]=4 461 B11R1.86 NC(=O)CC1=C(C=CC=C1)Cl Z33547171 [1,1,0,0,0,0|2,0,0]=4 462 B11R1.86 NC(=O)CC1=C(C=CC=C1)F Z33546803 [1,1,0,0,0,0|2,0,0]=4 463 B11R1.86 NC(=O)CC1=C(C=CC=C1)N Z239125326 [1,1,0,0,0,0|2,0,0]=4 464 B11R1.86 NC(=O)CC1=C(C=CC=C1)O Z1255356155 [1,1,0,0,0,0|1,0,0]=3 465 B11R1.86 O=C(O)CC1=C(C=CC=C1)Br Z285184626 [1,1,0,0,0,0|2,0,0]=4 466 B11R1.86 O=C(O)CC1=C(C=CC=C1)Cl Z56911957 [1,1,0,0,0,0|2,0,0]=4 467 B11R1.86 O=C(O)CC1=C(C=CC=C1)F Z104495526 [1,1,0,0,0,0|2,0,0]=4 468 B11R1.86 O=C(O)CC1=C(C=CC=C1)I Z1269196288 [1,1,0,0,0,0|2,0,0]=4 469 B11R1.86 O=C(O)CC1=C(C=CC=C1)O Z608061328 [1,1,0,0,0,0|1,0,0]=3 470 B11R1.86 O=C(O)CC1=C(C=CN=C1)O Z1255444750 [1,1,0,0,0,0|2,0,0]=4 471 B11R1.182 C=CCN1C=C(C=CC1=O)F Z1822535570 [1,1,0,0,0,0|1,0,1]=4 472 B11R1.182 CC1=CC(=C(C=C1)C)CC=O Z993017798 [1,1,0,0,0,0|2,0,0]=4 473 B11R1.182 OCCC1=C(C=CC(=C1)Br)O Z1269218042 [1,1,0,0,0,0|1,0,1]=4 474 B11R1.222 CC(C=O)C1=C(C=CC=C1)Br Z1269159201 [1,1,0,0,0,0|2,0,0]=4 475 B11R1.222 CC(C=O)C1=C(C=CC=C1)Cl Z1222424635 [1,1,0,0,0,0|2,0,0]=4 476 B11R1.222 CC(C=O)C1=C(C=CC=C1)F Z1222424647 [1,1,0,0,0,0|2,0,0]=4 477 B11R1.222 CC1=C(C=CC=C1)C(C)C=O Z1222424657 [1,1,0,0,0,0|2,0,0]=4 478 B11R1.222 CCC(N)C1=C(C=CC=C1)O Z1266854970 [1,1,0,0,0,0|0,0,2]=4 479 B11R1.222 CNC(C)C1=C(C=CC=C1)O Z316170358 [1,1,0,0,0,0|1,0,1]=4 480 B11R1.23 CC(C=O)C1=CC(=CC=C1)Br Z1269224544 [1,1,0,0,0,0|2,0,0]=4 481 B11R1.23 CC(C=O)C1=CC(=CC=C1)Cl Z1222424632 [1,1,0,0,0,0|2,0,0]=4 482 B11R1.23 CC(C=O)C1=CC(=CC=C1)F Z1222424642 [1,1,0,0,0,0|2,0,0]=4 483 B11R1.23 CC1=CC(=CC=C1)C(O)CN Z336086464 [1,1,0,0,0,0|1,0,1]=4 484 B11R1.23 CC1=CC=CC(=C1)C(C)C=O Z1222424653 [1,1,0,0,0,0|1,0,0]=3 485 B11R1.24 C#CCOC1=CC=CC(=C1)C Z54472997 [1,1,0,0,0,0|0,0,2]=4 486 B11R1.24 C=CCCC1=CC=CC(=C1)Br Z1269162615 [1,1,0,0,0,0|1,0,0]=3 487 B11R1.24 C=CCOC1=CC=CC(=C1)N Z274779170 [1,1,0,0,0,0|1,0,0]=3 488 B11R1.24 CC1=CC(=CC=C1)CCCN Z4993130622 [1,1,0,0,0,0|0,0,2]=4 489 B11R1.24 CC1=CC(=CC=C1)CCCO Z979436642 [1,1,0,0,0,0|0,0,2]=4 490 B11R1.24 CC1=CC(=CC=C1)OCCBr Z56886266 [1,1,0,0,0,0|1,0,1]=4 491 B11R1.24 CC1=CC(=CC=C1)OCCN Z85926240 [1,1,0,0,0,0|1,0,1]=4 492 B11R1.24 CC1=CC(=CN=C1)CCC=O Z1492427371 [1,1,0,0,0,0|1,0,1]=4 493 B11R1.24 CCNCC1=CC(=CC=C1)C Z90513252 [1,1,0,0,0,0|0,0,2]=4 494 B11R1.24 O=C/C=C/C1=CC=CC(=C1)F Z1198179803 [1,1,0,0,0,0|1,0,1]=4 495 B11R1.24 O=CCCC1=CC=CC(=C1)Cl Z993017744 [1,1,0,0,0,0|1,0,1]=4 496 B11R1.24 O=CCCC1=CC=CC(=C1)F Z993017622 [1,1,0,0,0,0|1,0,1]=4 497 B11R1.34 CC1=CC(=CC(=C1)CC#N)C Z274447884 [1,1,0,0,0,0|1,0,1]=4 498 B11R1.34 CC1=CC(=CC(=C1)CC=O)C Z993017712 [1,1,0,0,0,0|1,0,0]=3 499 B11R1.34 O=CCC1=CC(=CC(=C1)Cl)Br Z2938772766 [1,1,0,0,0,0|2,0,0]=4 500 B11R1.34 O=CCC1=CC(=CC(=C1)Cl)Cl Z1198160278 [1,1,0,0,0,0|2,0,0]=4 501 B11R1.157 CC(=O)CC1=CC(=CC=C1)Br Z513735382 [1,1,0,0,0,0|1,0,1]=4 502 B11R1.157 CC(=O)CC1=CC(=CC=C1)Cl Z513733552 [1,1,0,0,0,0|1,0,1]=4 503 B11R1.157 CC(=O)CC1=CC(=CC=C1)F Z329711550 [1,1,0,0,0,0|1,0,1]=4 504 B11R1.157 CC1=CC(=CC=C1)NC(=N)N Z979503154 [1,1,0,0,0,0|2,0,0]=4 505 B11R1.157 CC1=CC(=CC=C1)NC(=S)N Z56921365 [1,1,0,0,0,0|2,0,0]=4 506 B11R1.157 CC1=CC(=CN=C1)CC(=O)O Z1889997399 [1,1,0,0,0,0|2,0,0]=4 507 B11R1.157 N=C(N)CC1=CC(=CC=C1)Br Z1636723568 [1,1,0,0,0,0|2,0,0]=4 508 B11R1.157 N=C(N)CC1=CC(=CC=C1)F Z1695709629 [1,1,0,0,0,0|2,0,0]=4 509 B11R1.157 NC(=O)CC1=CC(=CC=C1)Cl Z992289380 [1,1,0,0,0,0|2,0,0]=4 510 B11R1.157 NC(=O)CC1=CC(=CC=C1)I Z1419030795 [1,1,0,0,0,0|2,0,0]=4 511 B11R1.157 NC(=O)CC1=CC(=CC=C1)O Z816010252 [1,1,0,0,0,0|2,0,0]=4 512 B11R1.157 NC1=CC(=CC=C1)CC(=O)O Z992267406 [1,1,0,0,0,0|2,0,0]=4 513 B11R1.157 O=C(O)CC1=CC(=CC=C1)Br Z285131530 [1,1,0,0,0,0|2,0,0]=4 514 B11R1.157 O=C(O)CC1=CC(=CC=C1)Cl Z285184608 [1,1,0,0,0,0|2,0,0]=4 515 B11R1.157 O=C(O)CC1=CC(=CC=C1)F Z104486030 [1,1,0,0,0,0|2,0,0]=4 516 B11R1.157 O=C(O)CC1=CC(=CC=C1)I Z1269113140 [1,1,0,0,0,0|2,0,0]=4 517 B11R1.157 O=C(O)CC1=CC(=CC=C1)O Z816000338 [1,1,0,0,0,0|2,0,0]=4 518 B11R1.189 C=CCC1=CC(=CC=C1)C=O Z1255375343 [1,1,0,0,0,0|0,0,1]=3 519 B11R1.189 CCC1=CC(=CC=C1)CNC Z6010478687 [1,1,0,0,0,0|1,0,1]=4 520 B11R1.189 CNCC1=CC(=CC=C1)OC Z56939284 [1,1,0,0,0,0|1,0,1]=4 521 B11R1.189 COC1=CC(=CC=C1)CC#N Z285184582 [1,1,0,0,0,0|1,0,1]=4 522 B11R1.189 COC1=CC(=CC=C1)CCN Z285143778 [1,1,0,0,0,0|1,0,1]=4 523 B11R1.189 COCC1=CC(=CC=C1)CN Z240084738 [1,1,0,0,0,0|1,0,1]=4 524 B11R1.189 COCC1=CC(=CC=C1)CO Z1266889515 [1,1,0,0,0,0|1,0,1]=4 525 B11R1.189 CSC1=CC(=CC=C1)CCN Z4873760169 [1,1,0,0,0,0|1,0,1]=4 526 B11R1.189 CSCC1=CC(=CC=C1)CN Z732208422 [1,1,0,0,0,0|1,0,1]=4 527 B11R1.189 NCCC1=CC(=CC=C1)CO Z4741652081 [1,1,0,0,0,0|1,0,1]=4 528 B11R1.192 CC1=C(C=C(C=C1)CC=O)C Z993017804 [1,1,0,0,0,0|1,0,0]=3 529 B11R1.192 CC1=C(C=C(C=C1)CCN)C Z2526366647 [1,1,0,0,0,0|1,0,1]=4 530 B11R1.192 CC1=C(C=CC(=C1)CC#N)Br Z1269136507 [1,1,0,0,0,0|1,0,1]=4 531 B11R1.192 CC1=C(C=CC(=C1)CC#N)O Z1255368240 [1,1,0,0,0,0|1,0,1]=4 532 B11R1.192 CC1=C(C=CC(=C1)CC=O)F Z1020779938 [1,1,0,0,0,0|1,0,0]=3 533 B11R1.192 CC1=C(C=CC(=C1)CCN)Br Z1269233616 [1,1,0,0,0,0|1,0,1]=4 534 B11R1.192 CC1=C(C=CC(=C1)CCN)Cl Z1198178622 [1,1,0,0,0,0|1,0,1]=4 535 B11R1.192 CC1=C(C=CC(=C1)CCN)F Z1682072426 [1,1,0,0,0,0|1,0,1]=4 536 B11R1.192 CNCC1=CC(=C(C=C1)C)C Z2238897979 [1,1,0,0,0,0|1,0,1]=4 537 B11R1.192 CNCC1=CC(=C(C=C1)F)C Z1873867371 [1,1,0,0,0,0|1,0,1]=4 538 B11R1.192 O=CCC1=CC(=C(C=C1)Br)F Z1269156049 [1,1,0,0,0,0|2,0,0]=4 539 B11R1.192 O=CCC1=CC(=C(C=C1)F)F Z1020788676 [1,1,0,0,0,0|2,0,0]=4 540 B13R1.3768 CC1=C(C(=CC=C1)C(N)C(=O)O)C Z1744691758 [0,2,0,0,0,0|2,0,0]=4 541 B13R1.150 CC1=C(C(=CC=C1)CNC(=O)N)Br Z1817045294 [0,2,0,0,0,0|2,0,0]=4 542 B13R1.150 CC1=C(C(=CC=C1)OCC(=O)N)C Z24763255 [0,2,0,0,0,0|2,0,0]=4 543 B13R1.150 CC1=C(C(=CC=C1)OCC(=O)O)C Z56911972 [0,2,0,0,0,0|2,0,0]=4 544 B13R1.150 O=C(O)/C=C/C1=C(C(=CC=C1)O)O Z1198161241 [0,2,0,0,0,0|1,0,1]=4 545 B13R1.569 COC1=C(C(=CC=C1)OCCN)O Z3689708124 [0,2,0,0,0,0|1,0,1]=4 546 B13R1.641 COC1=C(C(=CC=C1)CC(=O)O)Cl Z1269111432 [0,2,0,0,0,0|2,0,0]=4 547 B13R1.641 COC1=C(C(=CC=C1)CC(=O)O)F Z1255379726 [0,2,0,0,0,0|2,0,0]=4 548 B13R1.377 CCCC1=C(C(=CC=C1)C(C)C)O Z1255442829 [0,2,0,0,0,0|0,0,2]=4 549 B13R1.3911 CNCC1=C(C(=CC=C1)OC)OC Z56957442 [0,2,0,0,0,0|1,0,1]=4 550 B13R1.3911 COC1=C(C(=CC=C1)CCN)OC Z4322064887 [0,2,0,0,0,0|1,0,1]=4 551 B13R1.1253 COC1=C(C=CC(=C1C)C)CCN Z5033034265 [0,2,0,0,0,0|1,0,1]=4 552 B11R1.83 C=CCC1=CC=C(C=C1)C=O Z1511744017 [0,0,1,1,0,0|2,0,0]=4 553 B11R1.40 C/C(=C\C1=CC=CC=C1)/C=O Z3219847417 [0,0,1,1,0,0|0,0,2]=4 554 B11R2.106 BrC1=C2OC=CC2=CC=C1 Z1201624951 [1,0,0,1,0,0|1,0,0]=3 555 B11R2.106 BrC1=C2OC=NC2=CC=C1 Z1198176459 [1,0,0,1,0,0|2,0,0]=4 556 B11R2.106 BrC1=C2OCCC2=CC=C1 Z1198219525 [1,0,0,1,0,0|1,0,1]=4 557 B11R2.106 BrC1=C2SC=CC2=CC=C1 Z1269180460 [1,0,0,1,0,0|1,1,0]=4 558 B11R2.106 CC1=C2C=CNC2=CC=C1 Z384970526 [1,0,0,1,0,0|2,0,0]=4 559 B11R2.106 CC1=C2CNCC2=CC=C1 Z3244819771 [1,0,0,1,0,0|2,0,0]=4 560 B11R2.106 CC1=C2NC=CC2=CC=C1 Z1171217428 [1,0,0,1,0,0|1,0,0]=3 561 B11R2.106 CC1=C2NCCC2=CC=C1 Z1331055683 [1,0,0,1,0,0|1,0,1]=4 562 B11R2.106 CC1=C2SC=CC2=CC=C1 Z1171716174 [1,0,0,1,0,0|0,1,0]=3 563 B11R2.106 NC1=C2NC=CC2=CC=C1 Z1201621605 [1,0,0,1,0,0|2,0,0]=4 564 B11R2.106 NC1=C2OC=CC2=CC=C1 Z3244747114 [1,0,0,1,0,0|1,0,0]=3 565 B11R2.106 NC1=C2SC=CC2=CC=C1 Z1511495074 [1,0,0,1,0,0|1,1,0]=4 566 B11R2.106 OC1=C2OC=NC2=CC=C1 Z1255385602 [1,0,0,1,0,0|2,0,0]=4 567 B11R2.106 OC1=C2OCCC2=CC=C1 Z1486027488 [1,0,0,1,0,0|1,0,1]=4 568 B11R2.106 OC1=C2ON=CC2=CC=C1 Z1198182558 [1,0,0,1,0,0|2,0,0]=4 569 B11R2.10 BrC1=NC2=C(O1)C=CC=C2 Z733303132 [1,0,0,1,0,0|2,0,0]=4 570 B11R2.10 CC1=CC2=C(O1)C=CC=C2 Z1255386706 [1,0,0,1,0,0|0,0,2]=4 571 B11R2.10 CC1CC2=C(O1)C=CC=C2 Z104378304 [1,0,0,1,0,0|0,0,2]=4 572 B11R2.10 ClC1=NC2=C(O1)C=CC=C2 Z235343929 [1,0,0,1,0,0|2,0,0]=4 573 B11R2.10 NC1=NC2=C(C1)C=CC=C2 Z2692198892 [1,0,0,1,0,0|2,0,0]=4 574 B11R2.10 NC1=NC2=C(O1)C=CC=C2 Z57069972 [1,0,0,1,0,0|2,0,0]=4 575 B11R2.10 O=C1CC2=C(C1)C=CC=C2 Z104486120 [1,0,0,1,0,0|2,0,0]=4 576 B11R2.10 O=C1CC2=C(N1)C=CC=C2 Z104478112 [1,0,0,1,0,0|2,0,0]=4 577 B11R2.10 O=C1NC2=C(O1)C=CC=C2 Z56854468 [1,0,0,1,0,0|2,0,0]=4 578 B11R2.10 SC1=NC2=C(O1)C=CC=C2 Z104499134 [1,0,0,1,0,0|2,0,0]=4 579 B11R2.20 C1=CC2=C(C=C1)C=CC=C2 Z104506008 [1,0,0,1,0,0|1,0,1]=4 580 B11R2.20 C1=CC2=C(C=C1)CCC=C2 Z237493310 [1,0,0,1,0,0|1,0,1]=4 581 B11R2.20 C1=CC2=C(C=C1)N=CC=C2 Z104472852 [1,0,0,1,0,0|1,0,1]=4 582 B11R2.20 C1=CC2=C(C=C1)N=CC=N2 Z104495568 [1,0,0,1,0,0|2,0,0]=4 583 B11R2.20 C1=CC2=C(C=C1)OCCC2 Z728136016 [1,0,0,1,0,0|0,0,2]=4 584 B11R2.35 CC1=CC(=CC=C1)C2CO2 Z802853588 [1,0,0,1,0,0|1,0,1]=4 585 B11R2.36 BrC1=CC2=C(C=CN2)C=C1 Z752239748 [1,0,0,1,0,0|2,0,0]=4 586 B11R2.36 BrC1=CC2=C(C=CO2)C=C1 Z1198180633 [1,0,0,1,0,0|2,0,0]=4 587 B11R2.36 BrC1=CC2=C(C=CS2)C=C1 Z1269160602 [1,0,0,1,0,0|2,0,0]=4 588 B11R2.36 CC1=CC2=C(C=C1)CNC2 Z2238336530 [1,0,0,1,0,0|1,0,1]=4 589 B11R2.36 CC1=CC2=C(C=C1)N=CN2 Z3234957798 [1,0,0,1,0,0|2,0,0]=4 590 B11R2.36 CC1=CC2=C(C=C1)N=CS2 Z1198156828 [1,0,0,1,0,0|2,0,0]=4 591 B11R2.36 CC1=CC2=C(C=C1)NC=C2 Z979311300 [1,0,0,1,0,0|1,0,1]=4 592 B11R2.36 CC1=CC2=C(C=C1)NCC2 Z235539062 [1,0,0,1,0,0|1,0,1]=4 593 B11R2.36 CC1=CC2=C(C=C1)OC=C2 Z1198151070 [1,0,0,1,0,0|1,0,1]=4 594 B11R2.36 CC1=CC2=C(C=CN2)C=C1 Z384970524 [1,0,0,1,0,0|1,0,0]=3 595 B11R2.36 CC1=NC=C2C=CNC2=C1 Z1255420119 [1,0,0,1,0,0|2,0,0]=4 596 B11R2.36 ClC1=CC2=C(C=CN2)C=C1 Z382723678 [1,0,0,1,0,0|2,0,0]=4 597 B11R2.36 FC1=CC2=C(C=CN2)C=C1 Z382723676 [1,0,0,1,0,0|2,0,0]=4 598 B11R2.36 NC1=CC2=C(C=CN2)C=C1 Z752239752 [1,0,0,1,0,0|2,0,0]=4 599 B11R2.36 NC1=CC2=C(C=CO2)C=C1 Z1198313503 [1,0,0,1,0,0|2,0,0]=4 600 B11R2.36 NC1=CC2=C(C=CS2)C=C1 Z2651578500 [1,0,0,1,0,0|2,0,0]=4 601 B11R2.36 OC1=CC2=C(C=CN2)C=C1 Z1203162244 [1,0,0,1,0,0|2,0,0]=4 602 B13R2.342 CC1=C2C=CC=C(C2=CC=C1)Br Z1269139398 [0,1,0,1,0,0|1,0,1]=4 603 B13R2.342 CC1=C2C=CC=C(C2=CC=C1)O Z1198314559 [0,1,0,1,0,0|1,0,1]=4 604 B13R2.342 CC1=C2N=CC=C(C2=CC=C1)Cl Z431511592 [0,1,0,1,0,0|1,0,1]=4 605 B13R2.342 CC1=C2NC=CC(=O)C2=CC=C1 Z431511824 [0,1,0,1,0,0|1,0,1]=4 606 B13R2.342 CC1=C2OCCC(C2=CC=C1)N Z382721020 [0,1,0,1,0,0|0,0,2]=4 607 B13R2.342 O=C1C=COC2=C(C=CC=C12)Cl Z223042536 [0,1,0,1,0,0|1,0,1]=4 608 B13R2.32 CC1=C(C2=C(C=C1)C=NC=C2)N Z1255428312 [0,1,0,1,0,0|1,0,1]=4 609 B13R2.32 CC1=C(C2=C(C=C1)N=CC=C2)Br Z1269157629 [0,1,0,1,0,0|1,0,1]=4 610 B13R2.32 CC1=C(C2=C(C=CC=C2)C=C1)Br Z1251333005 [0,1,0,1,0,0|1,0,1]=4 611 B13R2.32 CC1=C(C2=C(C=CC=C2)C=C1)O Z1255419170 [0,1,0,1,0,0|0,0,1]=3 612 B13R2.32 CC1=C(C2=C(C=CC=C2)N=C1)O Z1198219340 [0,1,0,1,0,0|1,0,1]=4 613 B13R2.32 CC1=C(C2=C(C=CC=N2)C=C1)Br Z1269219117 [0,1,0,1,0,0|1,0,1]=4 614 B13R2.32 CC1=C(C2=C(C=CC=N2)C=C1)C Z1198725580 [0,1,0,1,0,0|1,0,1]=4 615 B13R2.32 CC1=C(C2=C(C=CC=N2)C=C1)Cl Z212170818 [0,1,0,1,0,0|1,0,1]=4 616 B13R2.32 CC1=C(C2=C(C=CC=N2)C=C1)F Z1617987132 [0,1,0,1,0,0|1,0,1]=4 617 B13R2.32 CC1=C2C=CC=CC2=CC=C1Br Z1269169594 [0,1,0,1,0,0|1,0,1]=4 618 B13R2.32 CC1=C2C=CC=NC2=CC=C1O Z3511186693 [0,1,0,1,0,0|2,0,0]=4 619 B13R2.32 CC1=C2N=CC=CC2=CC=C1Br Z1269118350 [0,1,0,1,0,0|1,0,1]=4 620 B13R2.32 CC1=C2N=CC=CC2=CC=C1F Z1255388981 [0,1,0,1,0,0|1,0,1]=4 621 B13R2.32 NC1=C(C2=C(C=CC=C2)C=C1)O Z2689265962 [0,1,0,1,0,0|1,0,1]=4 622 B13R2.32 OC1=C(C2=C(C=C1)N=CC=C2)O Z3490235350 [0,1,0,1,0,0|1,0,1]=4 623 B13R2.32 OC1=C2C=CC=CC2=CC=C1Br Z1269199494 [0,1,0,1,0,0|1,0,1]=4 624 B13R2.32 OC1=C2C=CC=CC2=CC=C1Cl Z1255445829 [0,1,0,1,0,0|1,0,1]=4 625 B13R2.32 OC1=C2C=CC=CC2=CC=C1F Z1198170673 [0,1,0,1,0,0|1,0,1]=4 626 B13R2.32 OC1=C2N=CC=CC2=CC=C1Cl Z3489764435 [0,1,0,1,0,0|1,0,1]=4 627 B13R2.54 CC1=C2C=C(NC2=CC=C1)C=O Z1255420944 [0,1,0,1,0,0|2,0,0]=4 628 B13R2.54 O=CC1=CC2=CC=CC(=C2O1)Br Z1262471405 [0,1,0,1,0,0|1,0,1]=4 629 B13R2.54 O=CC1=CC2=CC=CC(=C2O1)Cl Z1262471208 [0,1,0,1,0,0|1,0,1]=4 630 B13R2.54 O=CC1=CC2=CC=CC(=C2O1)F Z1262471152 [0,1,0,1,0,0|1,0,1]=4 631 B13R2.162 CC1=C2NC(=O)COC2=CC=C1 Z3236229774 [0,1,0,1,0,0|2,0,0]=4 632 B13R2.162 O=C1NCC2=CC=CC(=C2O1)Br Z2751295692 [0,1,0,1,0,0|2,0,0]=4 633 B13R2.162 O=C1NCC2=CC=CC(=C2O1)O Z2894089869 [0,1,0,1,0,0|2,0,0]=4 634 B13R2.4820 CC1=C2OCCNCC2=CC=C1 Z5089066697 [0,1,0,1,0,0|0,0,2]=4 635 B13R2.5180 CC1=C(C2=C(C=C1)C(=O)CC2)Br Z1269199132 [0,1,0,1,0,0|1,0,1]=4 636 B13R2.5180 O=C1CCC2=C1C=CC(=C2O)O Z1198731402 [0,1,0,1,0,0|1,0,1]=4 637 B13R2.328 CC1=C2N=CC=CC2=CC(=C1)Br Z2768171892 [0,1,0,1,0,0|1,0,1]=4 638 B13R2.328 CC1=C2N=CC=CC2=CC(=C1)Cl Z362807152 [0,1,0,1,0,0|1,0,1]=4 639 B13R2.328 CC1=C2N=CC=CC2=CC(=C1)F Z586255762 [0,1,0,1,0,0|1,0,1]=4 640 B13R2.328 CC1=C2N=CC=NC2=CC(=C1)Br Z1269176085 [0,1,0,1,0,0|2,0,0]=4 641 B13R2.5397 CC1=C2NC(=O)CC2=CC(=C1)Br Z1269112518 [0,1,0,1,0,0|2,0,0]=4 642 B13R2.5397 CC1=C2OC(=NC2=CC(=C1)Cl)N Z979487604 [0,1,0,1,0,0|2,0,0]=4 643 B13R2.5397 CC1=C2OC(=NC2=CC(=C1)Cl)S Z979487684 [0,1,0,1,0,0|2,0,0]=4 644 B13R2.5397 CC1=C2OC(=O)NC2=CC(=C1)Br Z1098334149 [0,1,0,1,0,0|2,0,0]=4 645 B13R2.5397 CC1=C2OC(=O)NC2=CC(=C1)Cl Z979487988 [0,1,0,1,0,0|2,0,0]=4 646 B13R2.5397 CC1=C2OC(=O)SC2=CC(=C1)O Z1551943232 [0,1,0,1,0,0|2,0,0]=4 647 B13R2.5397 CC1=CC2=C(OC(=N2)N)C(=C1)C Z979487632 [0,1,0,1,0,0|2,0,0]=4 648 B13R2.3050 CC1=C(C=CC2=C1NC(=O)C2)Br Z1269161601 [0,1,0,1,0,0|2,0,0]=4 649 B13R2.5179 CC1=C2N=CC(=CC2=CC=C1)I Z1723815217 [0,1,0,1,0,0|1,0,1]=4 650 B13R2.5179 CC1=C2N=CC(=CC2=CC=C1)O Z1255393213 [0,1,0,1,0,0|1,0,1]=4 651 B13R2.5179 CC1=C2OCC(CC2=CC=C1)N Z2168541825 [0,1,0,1,0,0|0,0,2]=4 652 B13R2.292 N#CCC1=C2OCOC2=CC=C1 Z1618032356 [0,1,0,1,0,0|1,0,1]=4 653 B13R2.581 CC1=NC2=C(O1)C(=CC=C2)CO Z57102533 [0,1,0,1,0,0|1,0,1]=4 654 B13R2.581 NCC1=C2NC(=O)CC2=CC=C1 Z4741673841 [0,1,0,1,0,0|2,0,0]=4 655 B13R2.581 NCC1=C2OC(=O)NC2=CC=C1 Z4097812132 [0,1,0,1,0,0|2,0,0]=4 656 B13R2.1613 BrCC1=C2N=CC=CC2=CC=C1 Z211318946 [0,1,0,1,0,0|1,0,1]=4 657 B13R2.1613 CCC1=C2N=CC=CC2=CC=C1 Z425327454 [0,1,0,1,0,0|1,0,1]=4 658 B13R2.1613 CNC1=C2C=CC=CC2=CC=C1 Z335254222 [0,1,0,1,0,0|1,0,1]=4 659 B13R2.1613 CNC1=C2C=CC=NC2=CC=C1 Z1082871174 [0,1,0,1,0,0|2,0,0]=4 660 B13R2.1613 COC1=C2C=CC=NC2=CC=C1 Z1198161023 [0,1,0,1,0,0|2,0,0]=4 661 B13R2.1613 COC1=C2N=CC=CC2=CC=C1 Z54849993 [0,1,0,1,0,0|1,0,1]=4 662 B13R2.1613 NCC1=C2C=CC=CC2=CC=C1 Z1263716830 [0,1,0,1,0,0|1,0,1]=4 663 B13R2.1613 OCC1=C2C=CC=NC2=CC=C1 Z1021448144 [0,1,0,1,0,0|2,0,0]=4 664 B13R2.1613 OCC1=C2N=CC=CC2=CC=C1 Z425721938 [0,1,0,1,0,0|1,0,1]=4 665 B13R2.371 CC1=C2C=CC=CC2=C(C=C1)O Z1198149533 [0,1,0,1,0,0|1,0,1]=4 666 B13R2.371 CC1=C2C=CC=NC2=C(C=C1)Br Z1269109056 [0,1,0,1,0,0|2,0,0]=4 667 B13R2.371 CC1=C2C=CC=NC2=C(C=C1)Cl Z1198313808 [0,1,0,1,0,0|2,0,0]=4 668 B13R2.371 CC1=C2N=CC=CC2=C(C=C1)Br Z1269173059 [0,1,0,1,0,0|1,0,1]=4 669 B13R2.371 CC1=C2N=CC=CC2=C(C=C1)Cl Z600615482 [0,1,0,1,0,0|1,0,1]=4 670 B13R2.371 CC1=C2N=CC=CC2=C(C=C1)F Z295461060 [0,1,0,1,0,0|1,0,1]=4 671 B13R2.371 CC1=C2N=CC=CC2=C(C=C1)N Z235363163 [0,1,0,1,0,0|1,0,1]=4 672 B13R2.5139 CC1=C2NC(=O)CC2=C(C=C1)Br Z1269124374 [0,1,0,1,0,0|2,0,0]=4 673 B13R2.5139 CC1=C2NC(=O)CC2=C(C=C1)Cl Z1335028339 [0,1,0,1,0,0|2,0,0]=4 674 B13R2.4818 CC1=C2C(=CC=CC2=CC=C1)Br Z1269205197 [0,1,0,1,0,0|1,0,1]=4 675 B13R2.4818 NC1=C2C(=CC=CC2=CC=C1)O Z1255383411 [0,1,0,1,0,0|1,0,1]=4 676 B13R2.4818 OC1=CC=CC2=CC=CC(=C12)O Z415933894 [0,1,0,1,0,0|1,0,1]=4 677 B13R2.4856 CC1=C2C(=CC=C1)NC(=O)C2O Z2240823115 [0,1,0,1,0,0|2,0,0]=4 678 B9R1.7 CC1=CC=C(S1)CC=O Z1250885326 [1,0,0,0,1,0|2,0,0]=4