0 B10R1.18 CS(=O)Cc1ccccc1 CSC000064350 [0,0,0,0,0,0|2,0,0]=2 1 B11R1.20 CC(=O)Nc1ccc(cc1)Br CSC000153570 [0,1,0,0,0,0|2,0,0]=3 2 B11R1.20 CC(=O)Nc1ccc(cc1)Cl CSC000154020 [0,1,0,0,0,0|2,0,0]=3 3 B11R1.20 CC(=O)Nc1ccc(cn1)Br CSC000193312 [0,1,0,0,0,0|3,0,0]=4 4 B11R1.20 CC(=O)Nc1ccc(cn1)C CSC000016827 [0,1,0,0,0,0|3,0,0]=4 5 B11R1.20 CC(=O)Nc1ccc(cn1)Cl CSC000016797 [0,1,0,0,0,0|3,0,0]=4 6 B11R1.20 CC(=O)Nc1ccc(cn1)F CSC000059403 [0,1,0,0,0,0|3,0,0]=4 7 B11R1.20 CC(=O)Nc1ccc(cn1)I CSC011202855 [0,1,0,0,0,0|3,0,0]=4 8 B11R1.20 CC(=O)Oc1ccc(cc1)Br CSC009811594 [0,1,0,0,0,0|2,0,0]=3 9 B11R1.20 CC(=O)Oc1ccc(cc1)C CSC000001885 [0,1,0,0,0,0|2,0,0]=3 10 B11R1.20 CC(=O)Oc1ccc(cc1)Cl CSC000001863 [0,1,0,0,0,0|2,0,0]=3 11 B11R1.20 CC(=O)Oc1ccc(cc1)F CSC000001924 [0,1,0,0,0,0|2,0,0]=3 12 B11R1.20 CC(C)Nc1ccc(cc1)Br CSC000219625 [0,1,0,0,0,0|1,0,2]=4 13 B11R1.20 CC(C)Sc1ccc(cc1)Br CSC009811894 [0,1,0,0,0,0|1,0,2]=4 14 B11R1.20 CC(C)Sc1ccc(cc1)C CSC000006694 [0,1,0,0,0,0|1,0,2]=4 15 B11R1.20 CC(C)Sc1ccc(cc1)Cl CSC000005997 [0,1,0,0,0,0|1,0,2]=4 16 B11R1.20 CC(C)Sc1ccc(cc1)F CSC000006008 [0,1,0,0,0,0|1,0,2]=4 17 B11R1.20 Cc1ccc(cc1)CC(=O)N CSC000206417 [0,1,0,0,0,0|2,0,0]=3 18 B11R1.20 NC(=O)Cc1ccc(cc1)Br CSC000162331 [0,1,0,0,0,0|2,0,0]=3 19 B11R1.20 NC(=O)Cc1ccc(cc1)F CSC000162278 [0,1,0,0,0,0|2,0,0]=3 20 B11R1.20 NC(=O)Cc1ccc(cc1)O CSC000020825 [0,1,0,0,0,0|2,0,0]=3 21 B11R1.20 NC(=O)Nc1ccc(cc1)Br CSC000198584 [0,1,0,0,0,0|3,0,0]=4 22 B11R1.20 NC(=O)Nc1ccc(cc1)F CSC000222807 [0,1,0,0,0,0|3,0,0]=4 23 B11R1.36 CN(C(=O)C)c1ccccn1 CSC000243587 [0,1,0,0,0,0|3,0,0]=4 24 B11R1.36 CN(C)C(=O)c1ccccc1 CSC000159565 [0,1,0,0,0,0|1,0,2]=4 25 B11R1.36 NC(=O)C(O)c1ccccc1 CSC011200849 [0,1,0,0,0,0|2,0,0]=3 26 B11R1.36 NC(=O)[C@@H](O)c1ccccc1 CSC009816934 [0,1,0,0,0,0|2,0,0]=3 27 B11R1.40 CCC(=O)Nc1ccccc1 CSC000153483 [0,1,0,0,0,0|2,0,0]=3 28 B11R1.40 CCC(=O)Nc1ccccn1 CSC000017115 [0,1,0,0,0,0|3,0,0]=4 29 B11R1.40 CCC(=O)Nc1cccnc1 CSC000159158 [0,1,0,0,0,0|3,0,0]=4 30 B11R1.40 CCC(=O)Oc1ccccc1 CSC000001944 [0,1,0,0,0,0|2,0,0]=3 31 B11R1.40 CCC(C)Sc1ccccc1 CSC009831573 [0,1,0,0,0,0|1,0,2]=4 32 B11R1.40 CCN(C)Cc1ccccc1 CSC000018720 [0,1,0,0,0,0|1,0,1]=3 33 B11R1.40 CNC(=O)Nc1ccccc1 CSC000178567 [0,1,0,0,0,0|2,0,0]=3 34 B11R1.40 CNC(=O)Nc1ccccn1 CSC000024314 [0,1,0,0,0,0|3,0,0]=4 35 B11R1.40 CNC(=O)Nc1cccnc1 CSC000233841 [0,1,0,0,0,0|3,0,0]=4 36 B11R1.40 COC(=O)Oc1ccccc1 CSC000020726 [0,1,0,0,0,0|2,0,0]=3 37 B11R1.40 NCC(=O)Nc1ccccc1 CSC000168422 [0,1,0,0,0,0|2,0,0]=3 38 B11R1.40 NCC(=O)Nc1ccncc1 CSC000238581 [0,1,0,0,0,0|3,0,0]=4 39 B11R1.86 CC(=O)Nc1ccccc1Br CSC000153524 [0,1,0,0,0,0|2,0,0]=3 40 B11R1.86 CC(=O)Nc1ccccc1C CSC000153662 [0,1,0,0,0,0|2,0,0]=3 41 B11R1.86 CC(=O)Nc1ccccc1Cl CSC000153741 [0,1,0,0,0,0|2,0,0]=3 42 B11R1.86 CC(=O)Nc1ccccc1F CSC000154224 [0,1,0,0,0,0|2,0,0]=3 43 B11R1.86 CC(=O)Nc1ccccc1I CSC000154044 [0,1,0,0,0,0|2,0,0]=3 44 B11R1.86 CC(=O)Nc1ccncc1Br CSC012340662 [0,1,0,0,0,0|3,0,0]=4 45 B11R1.86 CC(=O)Nc1ncccc1C CSC000016773 [0,1,0,0,0,0|3,0,0]=4 46 B11R1.86 CC(=O)Nc1ncccc1O CSC000022013 [0,1,0,0,0,0|3,0,0]=4 47 B11R1.86 CC(=O)Oc1ccccc1C CSC000001913 [0,1,0,0,0,0|2,0,0]=3 48 B11R1.86 CC(=O)Oc1ccccc1F CSC000001835 [0,1,0,0,0,0|2,0,0]=3 49 B11R1.86 CC(C)Oc1ccccc1F CSC000173055 [0,1,0,0,0,0|1,0,2]=4 50 B11R1.86 Cc1ccccc1NC(=O)N CSC000181700 [0,1,0,0,0,0|3,0,0]=4 51 B11R1.86 NC(=O)Cc1ccccc1Cl CSC000162363 [0,1,0,0,0,0|2,0,0]=3 52 B11R1.86 NC(=O)Cc1ccccc1F CSC000162305 [0,1,0,0,0,0|2,0,0]=3 53 B11R1.86 NC(=O)Nc1ccccc1Br CSC000742221 [0,1,0,0,0,0|3,0,0]=4 54 B11R1.86 NC(=O)Nc1ccccc1Cl CSC000181701 [0,1,0,0,0,0|3,0,0]=4 55 B11R1.157 CC(=O)Nc1cc(ccn1)Br CSC012362434 [0,1,0,0,0,0|3,0,0]=4 56 B11R1.157 CC(=O)Nc1cc(ccn1)C CSC000016760 [0,1,0,0,0,0|3,0,0]=4 57 B11R1.157 CC(=O)Nc1cc(ccn1)Cl CSC011996789 [0,1,0,0,0,0|3,0,0]=4 58 B11R1.157 CC(=O)Nc1cccc(c1)Br CSC000153616 [0,1,0,0,0,0|2,0,0]=3 59 B11R1.157 CC(=O)Nc1cccc(c1)C CSC000153650 [0,1,0,0,0,0|2,0,0]=3 60 B11R1.157 CC(=O)Nc1cccc(c1)F CSC000153968 [0,1,0,0,0,0|2,0,0]=3 61 B11R1.157 CC(=O)Nc1cccc(n1)F CSC012002399 [0,1,0,0,0,0|3,0,0]=4 62 B11R1.157 CC(=O)Nc1ccnc(c1)C CSC000199137 [0,1,0,0,0,0|3,0,0]=4 63 B11R1.157 CC(=O)Oc1cccc(c1)Br CSC009811612 [0,1,0,0,0,0|2,0,0]=3 64 B11R1.157 CC(=O)Oc1cccc(c1)C CSC000001900 [0,1,0,0,0,0|2,0,0]=3 65 B11R1.157 CC(=O)Oc1cccc(c1)Cl CSC000001977 [0,1,0,0,0,0|2,0,0]=3 66 B11R1.157 CC(=O)Oc1cccc(c1)F CSC000002014 [0,1,0,0,0,0|2,0,0]=3 67 B11R1.157 CC(C)Oc1cccc(c1)F CSC000170039 [0,1,0,0,0,0|1,0,2]=4 68 B11R1.157 CC(C)Sc1cccc(c1)Br CSC009815759 [0,1,0,0,0,0|1,0,2]=4 69 B11R1.157 CC(C)Sc1cccc(c1)Cl CSC000059006 [0,1,0,0,0,0|1,0,2]=4 70 B11R1.157 Cc1cccc(c1)NC(=O)N CSC000181699 [0,1,0,0,0,0|3,0,0]=4 71 B11R1.157 NC(=O)Cc1cccc(c1)Br CSC011586816 [0,1,0,0,0,0|2,0,0]=3 72 B11R1.157 NC(=O)Cc1cccc(c1)Cl CSC011690632 [0,1,0,0,0,0|2,0,0]=3 73 B11R1.157 NC(=O)Cc1cccc(c1)F CSC000162360 [0,1,0,0,0,0|2,0,0]=3 74 B11R1.157 NC(=O)Cc1cccc(c1)N CSC011690101 [0,1,0,0,0,0|2,0,0]=3 75 B11R1.157 NC(=O)Nc1cccc(c1)Br CSC000238923 [0,1,0,0,0,0|3,0,0]=4 76 B11R1.509 CS(=O)(=O)Cc1ccccc1 CSC000034595 [0,1,0,0,0,0|2,0,0]=3 77 B11R1.509 CS(=O)(=O)Nc1ccccc1 CSC000165589 [0,1,0,0,0,0|3,0,0]=4 78 B9R1.6 CS(=O)c1ccccc1 CSC000038873 [0,0,0,0,1,0|2,0,0]=3 79 B9R1.6 CS(=O)c1ccccn1 CSC000064355 [0,0,0,0,1,0|3,0,0]=4 80 B9R1.13 CC(=O)Nc1ccsc1 CSC000755801 [0,0,0,0,1,0|3,0,0]=4 81 B9R1.13 NC(=O)Cc1cccs1 CSC000162174 [0,0,0,0,1,0|3,0,0]=4 82 B9R1.13 NC(=O)Cc1ccsc1 CSC000162286 [0,0,0,0,1,0|3,0,0]=4 83 B11R1.91 CC(=C)COc1ccccc1 CSC000171512 [0,0,0,0,0,1|0,0,0]=1 84 B11R1.91 CC(=C)CSc1ccccc1 CSC000006268 [0,0,0,0,0,1|0,0,0]=1 85 B11R1.91 CC(=O)NCc1cccnc1 CSC000154915 [0,0,0,0,0,1|2,0,0]=3 86 B11R1.91 CC(=O)NCc1ccncc1 CSC000154903 [0,0,0,0,0,1|2,0,0]=3 87 B11R1.91 CC(=O)NNc1ccccc1 CSC000153448 [0,0,0,0,0,1|2,0,0]=3 88 B11R1.91 CC(=O)OCc1ccccc1 CSC000000625 [0,0,0,0,0,1|1,0,0]=2 89 B11R1.91 CC(C)CNc1ccccn1 CSC000156674 [0,0,0,0,0,1|1,0,2]=4 90 B11R1.91 CC(C)NCc1ccccn1 CSC000200191 [0,0,0,0,0,1|1,0,2]=4 91 B11R1.91 CC(C)NCc1cccnc1 CSC000200193 [0,0,0,0,0,1|1,0,2]=4 92 B11R1.91 CC(C)NCc1ccncc1 CSC000200223 [0,0,0,0,0,1|1,0,2]=4 93 B11R1.91 CC(C)SCc1ccccc1 CSC000006445 [0,0,0,0,0,1|0,0,2]=3 94 B11R1.91 CC(N)CNc1ccccn1 CSC011914399 [0,0,0,0,0,1|2,0,1]=4 95 B11R1.91 CC(O)CNc1ccccc1 CSC011364939 [0,0,0,0,0,1|1,0,1]=3 96 B11R1.91 NC(=O)C#Cc1ccccc1 CSC000041776 [0,0,0,0,0,1|2,0,1]=4 97 B11R1.91 NC(=O)COc1ccccc1 CSC000150575 [0,0,0,0,0,1|2,0,0]=3 98 B11R1.91 NC(=O)CSc1ccccn1 CSC000149794 [0,0,0,0,0,1|3,0,0]=4 99 B11R1.91 OC(=O)CSc1ccccn1 CSC000156281 [0,0,0,0,0,1|3,0,0]=4 100 B10R1.1 CCNc1ccc(cc1)Cl CSC000220165 [1,1,0,0,0,0|1,0,1]=4 101 B10R1.1 CCOc1ccc(cc1)Br CSC000169946 [1,1,0,0,0,0|1,0,1]=4 102 B10R1.1 CCOc1ccc(cc1)Cl CSC000169960 [1,1,0,0,0,0|1,0,1]=4 103 B10R1.1 CCOc1ccc(cc1)I CSC000171712 [1,1,0,0,0,0|1,0,1]=4 104 B10R1.1 CCSc1ccc(cc1)Br CSC009811893 [1,1,0,0,0,0|1,0,1]=4 105 B10R1.1 CCSc1ccc(cc1)C CSC000006686 [1,1,0,0,0,0|1,0,1]=4 106 B10R1.1 CCSc1ccc(cc1)Cl CSC000005996 [1,1,0,0,0,0|1,0,1]=4 107 B10R1.1 CCSc1ccc(cc1)F CSC000006007 [1,1,0,0,0,0|1,0,1]=4 108 B10R1.1 CSCc1ccc(cc1)C CSC000051358 [1,1,0,0,0,0|1,0,0]=3 109 B10R1.1 CSCc1ccc(cc1)Cl CSC000000312 [1,1,0,0,0,0|1,0,0]=3 110 B10R1.1 CSCc1ccc(cc1)F CSC000051356 [1,1,0,0,0,0|1,0,0]=3 111 B10R1.4 CCNc1ccccc1Cl CSC000219383 [1,1,0,0,0,0|1,0,1]=4 112 B10R1.4 CCOc1ccccc1Cl CSC000169953 [1,1,0,0,0,0|1,0,1]=4 113 B10R1.4 CCOc1ccccc1F CSC000172994 [1,1,0,0,0,0|1,0,1]=4 114 B10R1.4 CCSc1ccccc1C CSC000053911 [1,1,0,0,0,0|1,0,1]=4 115 B10R1.4 CCSc1ccccc1Cl CSC000006683 [1,1,0,0,0,0|1,0,1]=4 116 B10R1.4 CSCc1ccccc1Br CSC000148299 [1,1,0,0,0,0|1,0,0]=3 117 B10R1.4 CSCc1ccccc1Cl CSC000051354 [1,1,0,0,0,0|1,0,0]=3 118 B10R1.10 CCOc1cccc(c1)Cl CSC000170019 [1,1,0,0,0,0|1,0,1]=4 119 B10R1.10 CCOc1cccc(c1)F CSC000170038 [1,1,0,0,0,0|1,0,1]=4 120 B10R1.10 CCSc1cccc(c1)C CSC000055746 [1,1,0,0,0,0|1,0,1]=4 121 B10R1.10 CCSc1cccc(c1)Cl CSC000059004 [1,1,0,0,0,0|1,0,1]=4 122 B10R1.10 CCSc1cccc(c1)F CSC000106542 [1,1,0,0,0,0|1,0,1]=4 123 B10R1.10 CSCc1cccc(c1)Cl CSC000051353 [1,1,0,0,0,0|1,0,0]=3 124 B10R1.10 CSCc1cccc(c1)F CSC000053058 [1,1,0,0,0,0|1,0,0]=3 125 B10R1.17 C#CCSc1ccccc1 CSC000172648 [1,1,0,0,0,0|0,0,2]=4 126 B10R1.17 C=CCSc1ccccc1 CSC000006400 [1,1,0,0,0,0|0,0,0]=2 127 B10R1.17 CCCSc1ccccc1 CSC000005822 [1,1,0,0,0,0|0,0,1]=3 128 B10R1.17 CCCSc1ccccn1 CSC000006455 [1,1,0,0,0,0|1,0,1]=4 129 B10R1.17 CCSCc1ccccc1 CSC000006444 [1,1,0,0,0,0|0,0,1]=3 130 B10R1.17 COCSc1ccccc1 CSC000000817 [1,1,0,0,0,0|1,0,0]=3 131 B10R1.17 CSCCc1ccncc1 CSC015420737 [1,1,0,0,0,0|1,0,1]=4 132 B10R1.17 OCCSc1ccccc1 CSC000230494 [1,1,0,0,0,0|1,0,1]=4 133 B10R1.13 CS(=O)c1ccc(cc1)Br CSC009816266 [0,1,0,0,1,0|2,0,0]=4 134 B10R1.13 CS(=O)c1ccc(cc1)Cl CSC000064343 [0,1,0,0,1,0|2,0,0]=4 135 B10R1.13 CS(=O)c1ccc(cc1)F CSC011920622 [0,1,0,0,1,0|2,0,0]=4 136 B10R1.13 CS(=O)c1ccc(cc1)O CSC000064373 [0,1,0,0,1,0|2,0,0]=4 137 B10R1.13 Cc1ccc(cc1)S(=O)C CSC000031592 [0,1,0,0,1,0|2,0,0]=4 138 B10R1.13 NC(=O)c1ccc(cc1)Cl CSC000162172 [0,1,0,0,1,0|2,0,0]=4 139 B10R1.13 NC(=O)c1ccc(cc1)I CSC000162191 [0,1,0,0,1,0|2,0,0]=4 140 B10R1.28 CS(=O)(=O)c1ccccc1 CSC000685546 [0,1,0,0,1,0|2,0,0]=4 141 B10R1.61 CS(=O)c1ccccc1F CSC011216808 [0,1,0,0,1,0|2,0,0]=4 142 B10R1.61 NC(=O)c1ccccc1Br CSC000162158 [0,1,0,0,1,0|2,0,0]=4 143 B10R1.61 NC(=O)c1ccccc1Cl CSC000162159 [0,1,0,0,1,0|2,0,0]=4 144 B10R1.61 NC(=O)c1ccccc1I CSC000162227 [0,1,0,0,1,0|2,0,0]=4 145 B10R1.113 NC(=O)c1cccc(c1)Br CSC000162208 [0,1,0,0,1,0|2,0,0]=4 146 B10R1.113 NC(=O)c1cccc(c1)I CSC000162231 [0,1,0,0,1,0|2,0,0]=4 147 B10R1.27 CNC(=O)Cc1cccs1 CSC000159811 [0,1,0,0,1,0|2,0,0]=4 148 B10R1.27 COC(=O)Cc1cccs1 CSC000173319 [0,1,0,0,1,0|2,0,0]=4 149 B10R1.27 COC(=O)Cc1ccsc1 CSC000149161 [0,1,0,0,1,0|2,0,0]=4 150 B12R1.21 CC(=O)COc1ccc(cc1)Cl CSC000150450 [0,1,0,0,0,1|1,0,0]=3 151 B12R1.21 CC(=O)CSc1ccc(cc1)C CSC000172844 [0,1,0,0,0,1|1,0,0]=3 152 B12R1.21 CC(=O)CSc1ccc(cc1)Cl CSC000150472 [0,1,0,0,0,1|1,0,0]=3 153 B12R1.21 CC(=O)CSc1ccc(cc1)F CSC000148136 [0,1,0,0,0,1|1,0,0]=3 154 B12R1.21 CC(=O)NCc1ccc(cc1)C CSC000154265 [0,1,0,0,0,1|1,0,0]=3 155 B12R1.21 CC(=O)NCc1ccc(cc1)Cl CSC000152849 [0,1,0,0,0,1|1,0,0]=3 156 B12R1.21 CC(=O)NCc1ccc(cc1)F CSC000152308 [0,1,0,0,0,1|1,0,0]=3 157 B12R1.21 CC(=O)NNc1ccc(cc1)Br CSC009815283 [0,1,0,0,0,1|2,0,0]=4 158 B12R1.21 CC(=O)NNc1ccc(cc1)C CSC000002330 [0,1,0,0,0,1|2,0,0]=4 159 B12R1.21 CC(C)COc1ccc(cc1)Br CSC000169949 [0,1,0,0,0,1|0,0,2]=4 160 B12R1.21 CC(C)NCc1ccc(cc1)C CSC000195779 [0,1,0,0,0,1|0,0,2]=4 161 B12R1.21 CC(C)NCc1ccc(cc1)Cl CSC000195761 [0,1,0,0,0,1|0,0,2]=4 162 B12R1.21 CC(C)NCc1ccc(cc1)F CSC000195765 [0,1,0,0,0,1|0,0,2]=4 163 B12R1.21 CC(O)CSc1ccc(cc1)Cl CSC011366763 [0,1,0,0,0,1|1,0,1]=4 164 B12R1.21 Cc1ccc(cc1)CNC(=O)N CSC000238954 [0,1,0,0,0,1|2,0,0]=4 165 B12R1.21 Cc1ccc(cc1)SCC(=O)N CSC000149676 [0,1,0,0,0,1|2,0,0]=4 166 B12R1.21 NC(=O)CCc1ccc(cc1)Cl CSC000022186 [0,1,0,0,0,1|2,0,0]=4 167 B12R1.21 NC(=O)COc1ccc(cc1)Br CSC000150415 [0,1,0,0,0,1|2,0,0]=4 168 B12R1.21 NC(=O)COc1ccc(cc1)Cl CSC000150449 [0,1,0,0,0,1|2,0,0]=4 169 B12R1.21 NC(=O)COc1ccc(cc1)F CSC000150549 [0,1,0,0,0,1|2,0,0]=4 170 B12R1.21 NC(=O)CSc1ccc(cc1)Cl CSC000150469 [0,1,0,0,0,1|2,0,0]=4 171 B12R1.21 NC(=O)NCc1ccc(cc1)F CSC000238953 [0,1,0,0,0,1|2,0,0]=4 172 B12R1.21 OC(=O)COc1ccc(cc1)Br CSC000182358 [0,1,0,0,0,1|2,0,0]=4 173 B12R1.27 CC(CO)NCc1ccccc1 CSC000713660 [0,1,0,0,0,1|0,0,2]=4 174 B12R1.27 CCC(=O)NCc1ccccc1 CSC000153145 [0,1,0,0,0,1|1,0,0]=3 175 B12R1.27 CCC(=O)NCc1ccccn1 CSC000154896 [0,1,0,0,0,1|2,0,0]=4 176 B12R1.27 CCC(=O)NCc1cccnc1 CSC000154920 [0,1,0,0,0,1|2,0,0]=4 177 B12R1.27 CCC(=O)NCc1ccncc1 CSC000154908 [0,1,0,0,0,1|2,0,0]=4 178 B12R1.27 CCC(=O)NNc1ccccc1 CSC000001587 [0,1,0,0,0,1|2,0,0]=4 179 B12R1.27 CCC(=O)OCc1ccccc1 CSC000000848 [0,1,0,0,0,1|1,0,0]=3 180 B12R1.27 CCC(C)SCc1ccccc1 CSC000000404 [0,1,0,0,0,1|0,0,2]=4 181 B12R1.27 CNC(=O)CCc1ccccc1 CSC000159837 [0,1,0,0,0,1|1,0,0]=3 182 B12R1.27 CNC(=O)COc1ccccc1 CSC000150564 [0,1,0,0,0,1|1,0,0]=3 183 B12R1.27 CNC(=O)CSc1ccccc1 CSC000150703 [0,1,0,0,0,1|1,0,0]=3 184 B12R1.27 CNC(=O)NCc1ccccc1 CSC000222791 [0,1,0,0,0,1|1,0,0]=3 185 B12R1.27 CNC(=O)NCc1ccccn1 CSC000233842 [0,1,0,0,0,1|2,0,0]=4 186 B12R1.27 CNC(=O)NCc1cccnc1 CSC000233843 [0,1,0,0,0,1|2,0,0]=4 187 B12R1.27 CNC(=O)NCc1ccncc1 CSC000235220 [0,1,0,0,0,1|2,0,0]=4 188 B12R1.27 COC(=O)C#Cc1ccccc1 CSC011216089 [0,1,0,0,0,1|1,0,1]=4 189 B12R1.27 COC(=O)COc1ccccc1 CSC000148705 [0,1,0,0,0,1|1,0,0]=3 190 B12R1.27 COC(=O)CSc1ccccc1 CSC000151200 [0,1,0,0,0,1|1,0,0]=3 191 B12R1.27 COC(=O)CSc1ccccn1 CSC000156013 [0,1,0,0,0,1|2,0,0]=4 192 B12R1.27 COC(=O)NCc1ccccc1 CSC000235978 [0,1,0,0,0,1|1,0,0]=3 193 B12R1.27 NNC(=O)CCc1ccccc1 CSC000189782 [0,1,0,0,0,1|2,0,0]=4 194 B12R1.27 NNC(=O)COc1ccccc1 CSC000186219 [0,1,0,0,0,1|2,0,0]=4 195 B12R1.27 NNC(=O)CSc1ccccc1 CSC000189974 [0,1,0,0,0,1|2,0,0]=4 196 B12R1.27 OCC(=O)NCc1ccccc1 CSC000246335 [0,1,0,0,0,1|1,0,0]=3 197 B12R1.27 OCC(O)CSc1ccccc1 CSC000208506 [0,1,0,0,0,1|1,0,1]=4 198 B12R1.43 CN(Cc1ccccc1)C(=O)C CSC000152884 [0,1,0,0,0,1|1,0,0]=3 199 B12R1.43 CN(Cc1ccccc1)C(=O)N CSC000238888 [0,1,0,0,0,1|2,0,0]=4 200 B12R1.43 N[C@@H](Cc1ccccc1)C(=O)N CSC011423145 [0,1,0,0,0,1|2,0,0]=4 201 B12R1.107 CC(NC(=O)C)c1ccccc1 CSC000158019 [0,1,0,0,0,1|1,0,0]=3 202 B12R1.107 CC(OC(=O)C)c1ccccc1 CSC000000578 [0,1,0,0,0,1|1,0,0]=3 203 B12R1.107 CN(NC(=O)C)c1ccccc1 CSC000017130 [0,1,0,0,0,1|2,0,0]=4 204 B12R1.107 C[C@@H](NC(=O)C)c1ccccc1 CSC011908465 [0,1,0,0,0,1|1,0,0]=3 205 B12R1.107 C[C@H](NC(=O)C)c1ccccc1 CSC011908453 [0,1,0,0,0,1|1,0,0]=3 206 B12R1.107 NC(=O)CS(=O)c1ccccc1 CSC000064346 [0,1,0,0,0,1|2,0,0]=4 207 B12R1.125 CC(=C)COc1ccccc1C CSC000171510 [0,1,0,0,0,1|0,0,0]=2 208 B12R1.125 CC(=C)CSc1ccccc1C CSC000053913 [0,1,0,0,0,1|0,0,0]=2 209 B12R1.125 CC(=O)NCc1ccccc1Br CSC011237613 [0,1,0,0,0,1|1,0,0]=3 210 B12R1.125 CC(=O)NCc1ccccc1C CSC000175807 [0,1,0,0,0,1|1,0,0]=3 211 B12R1.125 CC(=O)NCc1ccccc1Cl CSC000155626 [0,1,0,0,0,1|1,0,0]=3 212 B12R1.125 CC(=O)NCc1cnccc1C CSC013037028 [0,1,0,0,0,1|2,0,0]=4 213 B12R1.125 CC(=O)NNc1ccccc1C CSC015226515 [0,1,0,0,0,1|2,0,0]=4 214 B12R1.125 CC(=O)OCc1ccccc1C CSC000000619 [0,1,0,0,0,1|1,0,0]=3 215 B12R1.125 CC(=O)OCc1ccncc1Cl CSC009843883 [0,1,0,0,0,1|2,0,0]=4 216 B12R1.125 CC(C)CNc1ccccc1Br CSC011231685 [0,1,0,0,0,1|0,0,2]=4 217 B12R1.125 CC(C)COc1ccccc1Br CSC000173973 [0,1,0,0,0,1|0,0,2]=4 218 B12R1.125 CC(C)NCc1ccccc1Br CSC000195800 [0,1,0,0,0,1|0,0,2]=4 219 B12R1.125 CC(C)NCc1ccccc1C CSC000195778 [0,1,0,0,0,1|0,0,2]=4 220 B12R1.125 CC(C)NCc1ccccc1Cl CSC000195757 [0,1,0,0,0,1|0,0,2]=4 221 B12R1.125 Cc1ccccc1OCC(=O)N CSC000150533 [0,1,0,0,0,1|2,0,0]=4 222 B12R1.125 NC(=O)CCc1ccccc1Cl CSC000162028 [0,1,0,0,0,1|2,0,0]=4 223 B12R1.125 NC(=O)CCc1ccccc1F CSC000016472 [0,1,0,0,0,1|2,0,0]=4 224 B12R1.125 NC(=O)COc1ccccc1Cl CSC000150432 [0,1,0,0,0,1|2,0,0]=4 225 B12R1.125 NC(=O)COc1ccccc1F CSC000150391 [0,1,0,0,0,1|2,0,0]=4 226 B12R1.125 NC(=O)COc1ccccc1O CSC000162348 [0,1,0,0,0,1|2,0,0]=4 227 B12R1.125 OC(=O)COc1ccccc1F CSC000182486 [0,1,0,0,0,1|2,0,0]=4 228 B12R1.226 CC(=O)NCc1cccc(c1)C CSC011222369 [0,1,0,0,0,1|1,0,0]=3 229 B12R1.226 NC(=O)COc1cccc(c1)Cl CSC000150646 [0,1,0,0,0,1|2,0,0]=4 230 B12R1.226 NC(=O)NCc1cccc(c1)Cl CSC000238944 [0,1,0,0,0,1|2,0,0]=4 231 B12R1.891 CS(=O)(=O)NCc1ccccc1 CSC000169538 [0,1,0,0,0,1|2,0,0]=4 232 B12R1.4 CCc1ccc(cc1)CC(=O)N CSC009837247 [0,2,0,0,0,0|2,0,0]=4 233 B12R1.4 CCc1ccc(cc1)NC(=O)C CSC000155791 [0,2,0,0,0,0|2,0,0]=4 234 B12R1.4 COc1ccc(cc1)CC(=O)N CSC000162232 [0,2,0,0,0,0|2,0,0]=4 235 B12R1.4 COc1ccc(cc1)OC(=O)C CSC000002274 [0,2,0,0,0,0|2,0,0]=4 236 B12R1.19 CC(=O)Nc1ccc(c(c1)Br)F CSC012348134 [0,2,0,0,0,0|2,0,0]=4 237 B12R1.19 CC(=O)Nc1ccc(c(c1)C)C CSC000153705 [0,2,0,0,0,0|2,0,0]=4 238 B12R1.19 CC(=O)Nc1ccc(c(c1)C)N CSC011203061 [0,2,0,0,0,0|2,0,0]=4 239 B12R1.19 CC(=O)Nc1ccc(c(c1)C)O CSC012186693 [0,2,0,0,0,0|2,0,0]=4 240 B12R1.19 CC(=O)Nc1ccc(c(c1)Cl)Br CSC000187747 [0,2,0,0,0,0|2,0,0]=4 241 B12R1.19 CC(=O)Nc1ccc(c(c1)Cl)F CSC000155749 [0,2,0,0,0,0|2,0,0]=4 242 B12R1.19 CC(=O)Nc1ccc(c(c1)Cl)O CSC011215158 [0,2,0,0,0,0|2,0,0]=4 243 B12R1.19 CC(=O)Nc1ccc(c(c1)F)Br CSC011219590 [0,2,0,0,0,0|2,0,0]=4 244 B12R1.19 CC(=O)Nc1ccc(c(c1)F)F CSC000155707 [0,2,0,0,0,0|2,0,0]=4 245 B12R1.19 CC(=O)Nc1ccc(c(c1)I)C CSC000154840 [0,2,0,0,0,0|2,0,0]=4 246 B12R1.19 CC(=O)Nc1ccc(c(c1)O)C CSC012148147 [0,2,0,0,0,0|2,0,0]=4 247 B12R1.19 CC(=O)Oc1ccc(c(c1)C)C CSC000002428 [0,2,0,0,0,0|2,0,0]=4 248 B12R1.19 CC(=O)Oc1ccc(c(c1)Cl)Cl CSC000002395 [0,2,0,0,0,0|2,0,0]=4 249 B12R1.19 CC(=O)Oc1ccc(c(c1)F)Cl CSC010725880 [0,2,0,0,0,0|2,0,0]=4 250 B12R1.19 Cc1ccc(cc1C)CC(=O)N CSC000162019 [0,2,0,0,0,0|2,0,0]=4 251 B12R1.20 CN(C(=O)C)c1ccc(cc1)O CSC000743460 [0,2,0,0,0,0|2,0,0]=4 252 B12R1.20 NC(=O)C(O)c1ccc(cc1)Cl CSC011626263 [0,2,0,0,0,0|2,0,0]=4 253 B12R1.49 CCC(=O)Nc1ccc(cc1)Br CSC000153582 [0,2,0,0,0,0|2,0,0]=4 254 B12R1.49 CCC(=O)Nc1ccc(cc1)C CSC000153933 [0,2,0,0,0,0|2,0,0]=4 255 B12R1.49 CCC(=O)Nc1ccc(cc1)Cl CSC000154025 [0,2,0,0,0,0|2,0,0]=4 256 B12R1.49 CCC(=O)Nc1ccc(cc1)F CSC000153719 [0,2,0,0,0,0|2,0,0]=4 257 B12R1.49 CCC(=O)Nc1ccc(cc1)O CSC000243810 [0,2,0,0,0,0|2,0,0]=4 258 B12R1.49 CCC(=O)Oc1ccc(cc1)Br CSC009811598 [0,2,0,0,0,0|2,0,0]=4 259 B12R1.49 CCC(=O)Oc1ccc(cc1)Cl CSC000001868 [0,2,0,0,0,0|2,0,0]=4 260 B12R1.49 CNC(=O)Cc1ccc(cc1)Br CSC000155101 [0,2,0,0,0,0|1,0,0]=3 261 B12R1.49 CNC(=O)Cc1ccc(cc1)C CSC000185632 [0,2,0,0,0,0|1,0,0]=3 262 B12R1.49 CNC(=O)Cc1ccc(cc1)Cl CSC000159878 [0,2,0,0,0,0|1,0,0]=3 263 B12R1.49 CNC(=O)Cc1ccc(cc1)F CSC000159896 [0,2,0,0,0,0|1,0,0]=3 264 B12R1.49 CNC(=O)Nc1ccc(cc1)Br CSC000235171 [0,2,0,0,0,0|2,0,0]=4 265 B12R1.49 CNC(=O)Nc1ccc(cc1)F CSC000178572 [0,2,0,0,0,0|2,0,0]=4 266 B12R1.49 COC(=O)Cc1ccc(cc1)Br CSC000149743 [0,2,0,0,0,0|1,0,0]=3 267 B12R1.49 COC(=O)Cc1ccc(cc1)C CSC000204387 [0,2,0,0,0,0|1,0,0]=3 268 B12R1.49 COC(=O)Cc1ccc(cc1)F CSC000148989 [0,2,0,0,0,0|1,0,0]=3 269 B12R1.49 COC(=O)Cc1ccc(cc1)I CSC012356276 [0,2,0,0,0,0|1,0,0]=3 270 B12R1.49 COC(=O)Cc1ccc(cc1)O CSC000211648 [0,2,0,0,0,0|1,0,0]=3 271 B12R1.49 COC(=O)Cc1ccc(nc1)C CSC000050249 [0,2,0,0,0,0|2,0,0]=4 272 B12R1.49 Cc1ccc(cc1)CC(=O)NN CSC000189221 [0,2,0,0,0,0|2,0,0]=4 273 B12R1.49 Cc1ccc(cc1)NC(=O)CN CSC000168395 [0,2,0,0,0,0|2,0,0]=4 274 B12R1.49 Cc1ccc(cc1)NC(=O)CO CSC000246325 [0,2,0,0,0,0|2,0,0]=4 275 B12R1.49 NCC(=O)Nc1ccc(cc1)Br CSC000168324 [0,2,0,0,0,0|2,0,0]=4 276 B12R1.49 NCC(=O)Nc1ccc(cc1)Cl CSC000168449 [0,2,0,0,0,0|2,0,0]=4 277 B12R1.49 NCC(=O)Nc1ccc(cc1)F CSC000168424 [0,2,0,0,0,0|2,0,0]=4 278 B12R1.49 NNC(=O)Cc1ccc(cc1)Br CSC000189848 [0,2,0,0,0,0|2,0,0]=4 279 B12R1.106 CS(=O)(=O)Cc1ccc(cc1)Br CSC009814647 [0,2,0,0,0,0|2,0,0]=4 280 B12R1.106 CS(=O)(=O)Cc1ccc(cc1)F CSC000047437 [0,2,0,0,0,0|2,0,0]=4 281 B12R1.233 CC(=O)Nc1ccc(cc1Br)Br CSC000151919 [0,2,0,0,0,0|2,0,0]=4 282 B12R1.233 CC(=O)Nc1ccc(cc1Br)Cl CSC012022070 [0,2,0,0,0,0|2,0,0]=4 283 B12R1.233 CC(=O)Nc1ccc(cc1Br)F CSC011215554 [0,2,0,0,0,0|2,0,0]=4 284 B12R1.233 CC(=O)Nc1ccc(cc1C)Cl CSC000154214 [0,2,0,0,0,0|2,0,0]=4 285 B12R1.233 CC(=O)Nc1ccc(cc1Cl)Br CSC000154779 [0,2,0,0,0,0|2,0,0]=4 286 B12R1.233 CC(=O)Nc1ccc(cc1Cl)Cl CSC000154243 [0,2,0,0,0,0|2,0,0]=4 287 B12R1.233 CC(=O)Nc1ccc(cc1Cl)F CSC000155642 [0,2,0,0,0,0|2,0,0]=4 288 B12R1.233 CC(=O)Nc1ccc(cc1F)C CSC000152019 [0,2,0,0,0,0|2,0,0]=4 289 B12R1.233 CC(=O)Nc1ccc(cc1F)Cl CSC000155771 [0,2,0,0,0,0|2,0,0]=4 290 B12R1.233 CC(=O)Nc1ccc(cc1F)F CSC000155514 [0,2,0,0,0,0|2,0,0]=4 291 B12R1.233 CC(=O)Nc1ccc(cc1F)I CSC000027682 [0,2,0,0,0,0|2,0,0]=4 292 B12R1.233 CC(=O)Nc1ccc(cc1O)Cl CSC010293595 [0,2,0,0,0,0|2,0,0]=4 293 B12R1.233 NC(=O)Cc1ccc(cc1Br)F CSC010883721 [0,2,0,0,0,0|2,0,0]=4 294 B12R1.233 NC(=O)Cc1ccc(cc1Cl)Cl CSC000162283 [0,2,0,0,0,0|2,0,0]=4 295 B12R1.233 NC(=O)Cc1ccc(cc1Cl)F CSC000034102 [0,2,0,0,0,0|2,0,0]=4 296 B12R1.34 CCC(=O)N(C)c1ccccc1 CSC000158323 [0,2,0,0,0,0|2,0,0]=4 297 B12R1.34 CN(C(=O)CN)c1ccccc1 CSC000174886 [0,2,0,0,0,0|2,0,0]=4 298 B12R1.34 COC(=O)C(O)c1ccccc1 CSC000150732 [0,2,0,0,0,0|1,0,0]=3 299 B12R1.34 COC(=O)[C@@H](O)c1ccccc1 CSC009815906 [0,2,0,0,0,0|1,0,0]=3 300 B12R1.34 COC(=O)[C@H](O)c1ccccc1 CSC009815907 [0,2,0,0,0,0|1,0,0]=3 301 B12R1.34 NNC(=O)C(O)c1ccccc1 CSC011203043 [0,2,0,0,0,0|2,0,0]=4 302 B12R1.124 CN(C(=O)C)c1ccccc1C CSC012109126 [0,2,0,0,0,0|2,0,0]=4 303 B12R1.253 NC(=O)C(F)(F)c1ccccc1 CSC000008717 [0,2,0,0,0,0|2,0,0]=4 304 B12R1.478 CCC(C(=O)N)c1ccccc1 CSC000192809 [0,2,0,0,0,0|2,0,0]=4 305 B12R1.478 CCN(C(=O)C)c1ccccc1 CSC000189716 [0,2,0,0,0,0|2,0,0]=4 306 B12R1.478 COC(C(=O)N)c1ccccc1 CSC011347434 [0,2,0,0,0,0|2,0,0]=4 307 B12R1.32 CCCC(=O)Oc1ccccc1 CSC000001941 [0,2,0,0,0,0|2,0,0]=4 308 B12R1.32 CCNC(=O)Nc1ccccc1 CSC000163281 [0,2,0,0,0,0|2,0,0]=4 309 B12R1.32 CN(CC=C)Cc1ccccc1 CSC000018679 [0,2,0,0,0,0|1,0,0]=3 310 B12R1.32 CNCC(=O)Nc1ccccc1 CSC000168086 [0,2,0,0,0,0|2,0,0]=4 311 B12R1.32 NCCC(=O)Nc1ccccc1 CSC011195676 [0,2,0,0,0,0|2,0,0]=4 312 B12R1.50 CCC(=O)Nc1cccc(c1)Br CSC000153628 [0,2,0,0,0,0|2,0,0]=4 313 B12R1.50 CCC(=O)Nc1cccc(c1)C CSC000153655 [0,2,0,0,0,0|2,0,0]=4 314 B12R1.50 CCC(=O)Nc1cccc(c1)Cl CSC000153961 [0,2,0,0,0,0|2,0,0]=4 315 B12R1.50 CCC(=O)Nc1cccc(c1)F CSC000153973 [0,2,0,0,0,0|2,0,0]=4 316 B12R1.50 CCC(=O)Nc1cccc(c1)O CSC000158609 [0,2,0,0,0,0|2,0,0]=4 317 B12R1.50 CNC(=O)Cc1cccc(c1)Br CSC011714096 [0,2,0,0,0,0|1,0,0]=3 318 B12R1.50 CNC(=O)Cc1cccc(c1)Cl CSC011795159 [0,2,0,0,0,0|1,0,0]=3 319 B12R1.50 CNC(=O)Cc1cccc(c1)F CSC000159957 [0,2,0,0,0,0|1,0,0]=3 320 B12R1.50 CNC(=O)Nc1cccc(c1)Br CSC000235173 [0,2,0,0,0,0|2,0,0]=4 321 B12R1.50 CNC(=O)Nc1cccc(c1)C CSC000178579 [0,2,0,0,0,0|2,0,0]=4 322 B12R1.50 CNC(=O)Nc1cccc(c1)Cl CSC000178564 [0,2,0,0,0,0|2,0,0]=4 323 B12R1.50 CNC(=O)Nc1cccc(c1)F CSC000235183 [0,2,0,0,0,0|2,0,0]=4 324 B12R1.50 COC(=O)Cc1cccc(c1)Br CSC000699549 [0,2,0,0,0,0|1,0,0]=3 325 B12R1.50 COC(=O)Cc1cccc(c1)C CSC011661688 [0,2,0,0,0,0|1,0,0]=3 326 B12R1.50 COC(=O)Cc1cccc(c1)Cl CSC011690634 [0,2,0,0,0,0|1,0,0]=3 327 B12R1.50 COC(=O)Cc1cccc(c1)F CSC000151121 [0,2,0,0,0,0|1,0,0]=3 328 B12R1.50 Cc1cccc(c1)NC(=O)CN CSC000168384 [0,2,0,0,0,0|2,0,0]=4 329 B12R1.50 Cc1cccc(c1)NC(=O)CO CSC000749660 [0,2,0,0,0,0|2,0,0]=4 330 B12R1.50 NCC(=O)Nc1cccc(c1)Br CSC000168392 [0,2,0,0,0,0|2,0,0]=4 331 B12R1.50 NCC(=O)Nc1cccc(c1)Cl CSC000168427 [0,2,0,0,0,0|2,0,0]=4 332 B12R1.50 NCC(=O)Nc1cccc(c1)F CSC000168492 [0,2,0,0,0,0|2,0,0]=4 333 B12R1.50 NNC(=O)Cc1cccc(c1)Cl CSC011203430 [0,2,0,0,0,0|2,0,0]=4 334 B12R1.50 NNC(=O)Cc1cccc(c1)F CSC000189928 [0,2,0,0,0,0|2,0,0]=4 335 B12R1.118 CCN(CC)Cc1ccccc1 CSC000184721 [0,2,0,0,0,0|1,0,1]=4 336 B12R1.194 CCS(=O)(=O)Cc1ccccc1 CSC000047422 [0,2,0,0,0,0|2,0,0]=4 337 B12R1.371 CCC(=O)Nc1ccccc1Br CSC000153536 [0,2,0,0,0,0|2,0,0]=4 338 B12R1.371 CCC(=O)Nc1ccccc1C CSC000153667 [0,2,0,0,0,0|2,0,0]=4 339 B12R1.371 CCC(=O)Nc1ccccc1Cl CSC000153746 [0,2,0,0,0,0|2,0,0]=4 340 B12R1.371 CCC(=O)Nc1ccccc1F CSC000154229 [0,2,0,0,0,0|2,0,0]=4 341 B12R1.371 CCC(=O)Nc1ccccc1I CSC000154056 [0,2,0,0,0,0|2,0,0]=4 342 B12R1.371 CCC(=O)Oc1ccccc1Cl CSC000001856 [0,2,0,0,0,0|2,0,0]=4 343 B12R1.371 CNC(=O)Cc1ccccc1Br CSC009816160 [0,2,0,0,0,0|1,0,0]=3 344 B12R1.371 CNC(=O)Cc1ccccc1C CSC000175625 [0,2,0,0,0,0|1,0,0]=3 345 B12R1.371 CNC(=O)Cc1ccccc1Cl CSC000159959 [0,2,0,0,0,0|1,0,0]=3 346 B12R1.371 CNC(=O)Cc1ccccc1F CSC000159918 [0,2,0,0,0,0|1,0,0]=3 347 B12R1.371 CNC(=O)Cc1ccccc1N CSC000738506 [0,2,0,0,0,0|1,0,0]=3 348 B12R1.371 CNC(=O)Nc1ccccc1C CSC000235315 [0,2,0,0,0,0|2,0,0]=4 349 B12R1.371 CNC(=O)Nc1ccccc1Cl CSC000178583 [0,2,0,0,0,0|2,0,0]=4 350 B12R1.371 COC(=O)Cc1ccccc1Br CSC000699816 [0,2,0,0,0,0|1,0,0]=3 351 B12R1.371 COC(=O)Cc1ccccc1C CSC000175439 [0,2,0,0,0,0|1,0,0]=3 352 B12R1.371 COC(=O)Cc1ccccc1F CSC000149365 [0,2,0,0,0,0|1,0,0]=3 353 B12R1.371 COC(=O)Cc1ccccc1O CSC000758901 [0,2,0,0,0,0|1,0,0]=3 354 B12R1.371 Cc1ccccc1CC(=O)NN CSC000190038 [0,2,0,0,0,0|2,0,0]=4 355 B12R1.371 Cc1ccccc1CC(=O)NO CSC000190267 [0,2,0,0,0,0|2,0,0]=4 356 B12R1.371 Cc1ccccc1NC(=O)CN CSC000168393 [0,2,0,0,0,0|2,0,0]=4 357 B12R1.371 NCC(=O)Nc1ccccc1Cl CSC000168390 [0,2,0,0,0,0|2,0,0]=4 358 B12R1.371 NCC(=O)Nc1ccccc1F CSC000168463 [0,2,0,0,0,0|2,0,0]=4 359 B12R1.371 NNC(=O)Cc1ccccc1Cl CSC000189918 [0,2,0,0,0,0|2,0,0]=4 360 B12R1.371 NNC(=O)Cc1ccccc1F CSC000190036 [0,2,0,0,0,0|2,0,0]=4 361 B12R1.75 CC(=O)Nc1ccccc1C#N CSC000151996 [0,2,0,0,0,0|2,0,0]=4 362 B12R1.75 CC(=O)Oc1ccccc1C#N CSC000001326 [0,2,0,0,0,0|2,0,0]=4 363 B12R1.75 CCc1ccccc1NC(=O)C CSC000154698 [0,2,0,0,0,0|2,0,0]=4 364 B12R1.75 COc1ccccc1CC(=O)N CSC000162009 [0,2,0,0,0,0|2,0,0]=4 365 B12R1.75 COc1ccccc1OC(=O)C CSC000002000 [0,2,0,0,0,0|2,0,0]=4 366 B12R1.127 CC(=O)Nc1cc(ccc1Br)Br CSC011252870 [0,2,0,0,0,0|2,0,0]=4 367 B12R1.127 CC(=O)Nc1cc(ccc1Br)Cl CSC012362533 [0,2,0,0,0,0|2,0,0]=4 368 B12R1.127 CC(=O)Nc1cc(ccc1C)Br CSC011344836 [0,2,0,0,0,0|2,0,0]=4 369 B12R1.127 CC(=O)Nc1cc(ccc1C)C CSC000152684 [0,2,0,0,0,0|2,0,0]=4 370 B12R1.127 CC(=O)Nc1cc(ccc1C)F CSC000155779 [0,2,0,0,0,0|2,0,0]=4 371 B12R1.127 CC(=O)Nc1cc(ccc1C)N CSC000740626 [0,2,0,0,0,0|2,0,0]=4 372 B12R1.127 CC(=O)Nc1cc(ccc1F)Br CSC011951791 [0,2,0,0,0,0|2,0,0]=4 373 B12R1.127 CC(=O)Nc1cc(ccc1F)F CSC000155522 [0,2,0,0,0,0|2,0,0]=4 374 B12R1.127 CC(=O)Nc1cc(ccc1O)Br CSC010005742 [0,2,0,0,0,0|2,0,0]=4 375 B12R1.127 CC(=O)Nc1cc(ccc1O)C CSC000035807 [0,2,0,0,0,0|2,0,0]=4 376 B12R1.127 CC(=O)Nc1cc(ccc1O)Cl CSC000012038 [0,2,0,0,0,0|2,0,0]=4 377 B12R1.127 CC(=O)Oc1cc(ccc1C)C CSC000002421 [0,2,0,0,0,0|2,0,0]=4 378 B12R1.127 Cc1ccc(c(c1)CC(=O)N)C CSC011694954 [0,2,0,0,0,0|2,0,0]=4 379 B12R1.151 CS(=O)(=O)Cc1ccccc1F CSC000047419 [0,2,0,0,0,0|2,0,0]=4 380 B12R1.224 CC(=O)Nc1cccc(c1C)Br CSC011775766 [0,2,0,0,0,0|2,0,0]=4 381 B12R1.224 CC(=O)Nc1cccc(c1C)C CSC000153689 [0,2,0,0,0,0|2,0,0]=4 382 B12R1.224 CC(=O)Nc1cccc(c1C)N CSC000736503 [0,2,0,0,0,0|2,0,0]=4 383 B12R1.224 CC(=O)Nc1cccc(c1Cl)Cl CSC000155691 [0,2,0,0,0,0|2,0,0]=4 384 B12R1.224 CC(=O)Nc1cccc(c1F)Cl CSC000152519 [0,2,0,0,0,0|2,0,0]=4 385 B12R1.224 CC(=O)Nc1cccc(c1O)Cl CSC000117800 [0,2,0,0,0,0|2,0,0]=4 386 B12R1.1009 CC(=O)Nc1c(cccc1C)C CSC000152485 [0,2,0,0,0,0|2,0,0]=4 387 B12R1.1009 CC(=O)Nc1c(cccc1Cl)C CSC011996691 [0,2,0,0,0,0|2,0,0]=4 388 B12R1.1009 CC(=O)Nc1c(cccc1Cl)F CSC012243075 [0,2,0,0,0,0|2,0,0]=4 389 B12R1.1009 CC(=O)Nc1c(cccc1F)F CSC000155699 [0,2,0,0,0,0|2,0,0]=4 390 B12R1.1009 CC(=O)Nc1c(cccc1O)C CSC000103797 [0,2,0,0,0,0|2,0,0]=4 391 B12R1.1009 CC(=O)Oc1c(cccc1C)C CSC000001954 [0,2,0,0,0,0|2,0,0]=4 392 B12R1.1009 CC(=O)Oc1c(cccc1Cl)Cl CSC000002155 [0,2,0,0,0,0|2,0,0]=4 393 B12R1.1009 NC(=O)Cc1c(cccc1Cl)F CSC000162243 [0,2,0,0,0,0|2,0,0]=4 394 B12R1.101 CC(=O)Nc1cc(cc(c1)C)C CSC000155763 [0,2,0,0,0,0|2,0,0]=4 395 B12R1.101 CC(=O)Nc1cc(cc(c1)Cl)Cl CSC000154935 [0,2,0,0,0,0|2,0,0]=4 396 B12R1.101 CC(=O)Nc1cc(cc(c1)F)F CSC000234079 [0,2,0,0,0,0|2,0,0]=4 397 B12R1.101 CC(=O)Oc1cc(cc(c1)C)C CSC000002434 [0,2,0,0,0,0|2,0,0]=4 398 B12R1.119 CS(=O)(=O)Cc1cccc(c1)Br CSC009814643 [0,2,0,0,0,0|2,0,0]=4 399 B12R1.119 CS(=O)(=O)Cc1cccc(c1)F CSC000047429 [0,2,0,0,0,0|2,0,0]=4 400 B12R1.438 CC(=O)Nc1cccc(c1)C#N CSC000152054 [0,2,0,0,0,0|2,0,0]=4 401 B12R1.438 CC(=O)Oc1cccc(c1)C#N CSC000001303 [0,2,0,0,0,0|2,0,0]=4 402 B12R1.438 COc1cccc(c1)CC(=O)N CSC000162345 [0,2,0,0,0,0|2,0,0]=4 403 B12R1.438 COc1cccc(c1)OC(=O)C CSC000001337 [0,2,0,0,0,0|2,0,0]=4 404 B12R1.438 CSc1cccc(c1)NC(=O)C CSC000153993 [0,2,0,0,0,0|2,0,0]=4 405 B12R2.2057 C(NC1CC1)c2ccccc2 CSC000196367 [0,0,0,1,0,1|0,0,2]=4 406 B12R2.2057 C(Nc1ccccc1)C2CC2 CSC011316272 [0,0,0,1,0,1|0,0,2]=4 407 B12R2.18 Cn1c2ccccc2oc1=O CSC000171226 [0,1,0,1,0,0|2,0,0]=4 408 B12R2.32 CCN1Cc2ccccc2C1 CSC016200629 [0,1,0,1,0,0|1,0,1]=4 409 B12R2.32 CSc1nc2ccccc2[nH]1 CSC000169833 [0,1,0,1,0,0|2,0,0]=4 410 B12R2.32 CSc1nc2ccccc2o1 CSC000000691 [0,1,0,1,0,0|2,0,0]=4 411 B12R2.32 CSc1nc2ccccc2s1 CSC000000696 [0,1,0,1,0,0|2,0,0]=4 412 B12R1.252 CC(=C)CNCc1ccccc1 CSC000224140 [0,0,0,0,0,2|0,0,0]=2 413 B12R1.252 CC(=CCOc1ccccc1)C CSC000173691 [0,0,0,0,0,2|0,0,1]=3 414 B12R1.252 CC(=O)CCSc1ccccc1 CSC000208507 [0,0,0,0,0,2|1,0,0]=3 415 B12R1.252 CC(=O)CCSc1ccccn1 CSC000208669 [0,0,0,0,0,2|2,0,0]=4 416 B12R1.252 CC(=O)CSCc1ccccc1 CSC000172147 [0,0,0,0,0,2|1,0,0]=3 417 B12R1.252 CC(=O)NCCc1ccccc1 CSC000153396 [0,0,0,0,0,2|1,0,0]=3 418 B12R1.252 CC(=O)OCCc1ccccc1 CSC000024547 [0,0,0,0,0,2|1,0,0]=3 419 B12R1.252 CC(C)CCNc1ccccc1 CSC000219564 [0,0,0,0,0,2|0,0,2]=4 420 B12R1.252 CC(C)NCCc1ccccc1 CSC000200190 [0,0,0,0,0,2|0,0,2]=4 421 B12R1.252 NC(=O)CCCc1ccccc1 CSC011273634 [0,0,0,0,0,2|2,0,0]=4 422 B12R1.252 NC(=O)CSCc1ccccc1 CSC000149389 [0,0,0,0,0,2|2,0,0]=4 423 B12R1.252 NC(=O)NCCc1ccccc1 CSC000238938 [0,0,0,0,0,2|2,0,0]=4 424 B9R1.1 CNc1ccc(cc1)Br CSC000219623 [2,1,0,0,0,0|1,0,0]=4 425 B9R1.1 CNc1ccc(cc1)Cl CSC000220157 [2,1,0,0,0,0|1,0,0]=4 426 B9R1.1 COc1ccc(cc1)Br CSC000169945 [2,1,0,0,0,0|1,0,0]=4 427 B9R1.1 COc1ccc(cc1)Cl CSC000169959 [2,1,0,0,0,0|1,0,0]=4 428 B9R1.1 COc1ccc(cc1)I CSC000171711 [2,1,0,0,0,0|1,0,0]=4 429 B9R1.1 CSc1ccc(cc1)Br CSC000149455 [2,1,0,0,0,0|1,0,0]=4 430 B9R1.1 CSc1ccc(cc1)Cl CSC000150468 [2,1,0,0,0,0|1,0,0]=4 431 B9R1.1 CSc1ccc(cc1)F CSC000000078 [2,1,0,0,0,0|1,0,0]=4 432 B9R1.1 CSc1ccc(cc1)O CSC000211864 [2,1,0,0,0,0|1,0,0]=4 433 B9R1.2 CNc1cccc(c1)Cl CSC000220044 [2,1,0,0,0,0|1,0,0]=4 434 B9R1.2 CNc1cccc(c1)I CSC000221217 [2,1,0,0,0,0|1,0,0]=4 435 B9R1.2 COc1cccc(c1)Br CSC000170001 [2,1,0,0,0,0|1,0,0]=4 436 B9R1.2 COc1cccc(c1)Cl CSC000170018 [2,1,0,0,0,0|1,0,0]=4 437 B9R1.2 COc1cccc(c1)I CSC000171673 [2,1,0,0,0,0|1,0,0]=4 438 B9R1.2 CSc1cccc(c1)Br CSC011215954 [2,1,0,0,0,0|1,0,0]=4 439 B9R1.2 CSc1cccc(c1)Cl CSC000033908 [2,1,0,0,0,0|1,0,0]=4 440 B9R1.2 CSc1cccc(c1)F CSC000067534 [2,1,0,0,0,0|1,0,0]=4 441 B9R1.15 CNc1ccccc1Cl CSC000219374 [2,1,0,0,0,0|1,0,0]=4 442 B9R1.15 COc1ccccc1Br CSC000174000 [2,1,0,0,0,0|1,0,0]=4 443 B9R1.15 COc1ccccc1Cl CSC000169952 [2,1,0,0,0,0|1,0,0]=4 444 B9R1.15 COc1ccccc1I CSC000210334 [2,1,0,0,0,0|1,0,0]=4 445 B9R1.15 CSc1ccccc1Br CSC000230855 [2,1,0,0,0,0|1,0,0]=4 446 B9R1.15 CSc1ccccc1Cl CSC000000335 [2,1,0,0,0,0|1,0,0]=4 447 B9R1.15 CSc1ccccc1F CSC000000233 [2,1,0,0,0,0|1,0,0]=4 448 B9R1.15 CSc1ccccc1O CSC011216402 [2,1,0,0,0,0|1,0,0]=4 449 B11R1.1 Brc1ccc(cc1)OCC=C CSC000172055 [1,2,0,0,0,0|0,0,0]=3 450 B11R1.1 Brc1ccc(cc1)SCC=C CSC009811901 [1,2,0,0,0,0|0,0,0]=3 451 B11R1.1 CCCOc1ccc(cc1)Br CSC000169948 [1,2,0,0,0,0|0,0,1]=4 452 B11R1.1 CCCOc1ccc(cc1)C CSC000169969 [1,2,0,0,0,0|0,0,1]=4 453 B11R1.1 CCCSc1ccc(cc1)Br CSC009811899 [1,2,0,0,0,0|0,0,1]=4 454 B11R1.1 CCCSc1ccc(cc1)C CSC000006743 [1,2,0,0,0,0|0,0,1]=4 455 B11R1.1 CCCSc1ccc(cc1)Cl CSC000005799 [1,2,0,0,0,0|0,0,1]=4 456 B11R1.1 CCCSc1ccc(cc1)F CSC015531415 [1,2,0,0,0,0|0,0,1]=4 457 B11R1.1 CCNCc1ccc(cc1)Br CSC000187385 [1,2,0,0,0,0|0,0,1]=4 458 B11R1.1 CCNCc1ccc(cc1)C CSC000180869 [1,2,0,0,0,0|0,0,1]=4 459 B11R1.1 CCNCc1ccc(cc1)F CSC000189070 [1,2,0,0,0,0|0,0,1]=4 460 B11R1.1 CCSCc1ccc(cc1)Br CSC000173025 [1,2,0,0,0,0|0,0,1]=4 461 B11R1.1 CCSCc1ccc(cc1)C CSC000029035 [1,2,0,0,0,0|0,0,1]=4 462 B11R1.1 CCSCc1ccc(cc1)Cl CSC000006432 [1,2,0,0,0,0|0,0,1]=4 463 B11R1.1 CCSCc1ccc(cc1)F CSC000044549 [1,2,0,0,0,0|0,0,1]=4 464 B11R1.1 Cc1ccc(cc1)OCC=C CSC000172063 [1,2,0,0,0,0|0,0,0]=3 465 B11R1.1 Cc1ccc(cc1)SCC=C CSC000006760 [1,2,0,0,0,0|0,0,0]=3 466 B11R1.1 Clc1ccc(cc1)SCC=C CSC000006393 [1,2,0,0,0,0|0,0,0]=3 467 B11R1.1 Fc1ccc(cc1)SCC=C CSC000006478 [1,2,0,0,0,0|0,0,0]=3 468 B11R1.81 CSCc1ccc(cc1Cl)F CSC000051359 [1,2,0,0,0,0|1,0,0]=4 469 B11R1.81 CSCc1ccc(cc1F)F CSC010285496 [1,2,0,0,0,0|1,0,0]=4 470 B11R1.83 CCCc1ccc(cc1)OC CSC000034192 [1,2,0,0,0,0|0,0,1]=4 471 B11R1.83 COCc1ccc(cc1)SC CSC010272925 [1,2,0,0,0,0|1,0,0]=4 472 B11R1.83 CSCc1ccc(cc1)SC CSC000051362 [1,2,0,0,0,0|1,0,0]=4 473 B11R1.192 CNCc1ccc(c(c1)Cl)Cl CSC000184578 [1,2,0,0,0,0|1,0,0]=4 474 B11R1.192 CSCc1ccc(c(c1)Cl)Cl CSC000051355 [1,2,0,0,0,0|1,0,0]=4 475 B11R1.192 CSCc1ccc(c(c1)F)F CSC000053065 [1,2,0,0,0,0|1,0,0]=4 476 B11R1.13 CNCc1cccc(c1Cl)Cl CSC000184510 [1,2,0,0,0,0|1,0,0]=4 477 B11R1.17 Brc1ccccc1OCC=C CSC000173964 [1,2,0,0,0,0|0,0,0]=3 478 B11R1.17 CCCOc1ccccc1Br CSC000174042 [1,2,0,0,0,0|0,0,1]=4 479 B11R1.17 CCCOc1ccccc1C CSC000169983 [1,2,0,0,0,0|0,0,1]=4 480 B11R1.17 CCCOc1ccccc1F CSC000173322 [1,2,0,0,0,0|0,0,1]=4 481 B11R1.17 CCCSc1ccccc1Br CSC000230854 [1,2,0,0,0,0|0,0,1]=4 482 B11R1.17 CCCSc1ccccc1Cl CSC000006739 [1,2,0,0,0,0|0,0,1]=4 483 B11R1.17 CCNCc1ccccc1F CSC000201217 [1,2,0,0,0,0|0,0,1]=4 484 B11R1.17 CCSCc1ccccc1Cl CSC000044547 [1,2,0,0,0,0|0,0,1]=4 485 B11R1.17 Cc1ccccc1NCC=C CSC011613358 [1,2,0,0,0,0|0,0,0]=3 486 B11R1.17 Cc1ccccc1OCC=C CSC000172067 [1,2,0,0,0,0|0,0,0]=3 487 B11R1.17 Clc1ccccc1OCC=C CSC000172057 [1,2,0,0,0,0|0,0,0]=3 488 B11R1.17 Fc1ccccc1OCC=C CSC000173442 [1,2,0,0,0,0|0,0,0]=3 489 B11R1.41 COc1ccccc1CSC CSC000053060 [1,2,0,0,0,0|1,0,0]=4 490 B11R1.182 CSCc1cc(ccc1F)F CSC000052045 [1,2,0,0,0,0|1,0,0]=4 491 B11R1.605 CSCc1c(cccc1Cl)F CSC000051357 [1,2,0,0,0,0|1,0,0]=4 492 B11R1.24 CCCOc1cccc(c1)C CSC000169976 [1,2,0,0,0,0|0,0,1]=4 493 B11R1.24 CCCSc1cccc(c1)Br CSC009815762 [1,2,0,0,0,0|0,0,1]=4 494 B11R1.24 CCCSc1cccc(c1)C CSC000055754 [1,2,0,0,0,0|0,0,1]=4 495 B11R1.24 CCCSc1cccc(c1)Cl CSC000059010 [1,2,0,0,0,0|0,0,1]=4 496 B11R1.24 CCNCc1cccc(c1)F CSC000195558 [1,2,0,0,0,0|0,0,1]=4 497 B11R1.24 CCNCc1cccc(c1)O CSC000201218 [1,2,0,0,0,0|0,0,1]=4 498 B11R1.24 CCSCc1cccc(c1)Br CSC000173034 [1,2,0,0,0,0|0,0,1]=4 499 B11R1.24 CCSCc1cccc(c1)Cl CSC000044546 [1,2,0,0,0,0|0,0,1]=4 500 B11R1.24 CCSCc1cccc(c1)F CSC000044556 [1,2,0,0,0,0|0,0,1]=4 501 B11R1.34 CNCc1cc(cc(c1)Cl)Cl CSC000741595 [1,2,0,0,0,0|1,0,0]=4 502 B11R1.189 COc1cccc(c1)CSC CSC000051361 [1,2,0,0,0,0|1,0,0]=4 503 B11R1.12 CCC(NC)c1ccccc1 CSC000737544 [1,2,0,0,0,0|0,0,1]=4 504 B11R1.16 CCNC(C)c1ccccc1 CSC000187283 [1,2,0,0,0,0|0,0,1]=4 505 B11R1.16 CN(CC=C)c1ccccc1 CSC000018674 [1,2,0,0,0,0|0,0,0]=3 506 B11R1.16 CSCC(=O)c1ccccc1 CSC000748581 [1,2,0,0,0,0|1,0,0]=4 507 B11R1.28 CC#CCNc1ccccc1 CSC011641403 [1,2,0,0,0,0|0,0,1]=4 508 B11R1.28 CCCCNc1ccccc1 CSC000211623 [1,2,0,0,0,0|0,0,1]=4 509 B11R1.28 CCCCOc1ccccc1 CSC011212283 [1,2,0,0,0,0|0,0,1]=4 510 B11R1.28 CCCSCc1ccccc1 CSC000006446 [1,2,0,0,0,0|0,0,1]=4 511 B11R1.28 COCCOc1ccccc1 CSC000757042 [1,2,0,0,0,0|0,0,1]=4 512 B11R1.28 COCCSc1ccccc1 CSC025761232 [1,2,0,0,0,0|0,0,1]=4 513 B11R1.28 CSCCCc1ccccc1 CSC000051364 [1,2,0,0,0,0|0,0,1]=4 514 B11R1.28 CSCCOc1ccccc1 CSC000148400 [1,2,0,0,0,0|0,0,1]=4 515 B11R1.28 OCCCOc1ccccc1 CSC011215863 [1,2,0,0,0,0|0,0,1]=4 516 B11R1.28 OCCNCc1ccccc1 CSC000180844 [1,2,0,0,0,0|0,0,1]=4 517 B11R1.28 OCCSCc1ccccc1 CSC011205989 [1,2,0,0,0,0|0,0,1]=4 518 B11R1.3 COc1ccc(cc1)C(=C)C CSC011935109 [0,2,0,0,1,0|0,0,0]=3 519 B13R1.45 CC(=O)COC(=O)c1ccccc1 CSC000000904 [0,1,0,0,0,2|1,0,0]=4 520 B13R1.45 CC(=O)OCC(=O)c1ccccc1 CSC000000662 [0,1,0,0,0,2|1,0,0]=4 521 B13R1.45 CC(CNC(=O)C)c1ccccc1 CSC000154521 [0,1,0,0,0,2|1,0,0]=4 522 B13R1.149 CC(=C)CNCc1cccc(c1)Br CSC011645382 [0,1,0,0,0,2|0,0,0]=3 523 B13R1.149 CC(=O)OCCc1cccc(c1)C CSC009866697 [0,1,0,0,0,2|1,0,0]=4 524 B13R1.158 CC(=C)CNCc1ccccc1Br CSC011645383 [0,1,0,0,0,2|0,0,0]=3 525 B13R1.513 CC(=C)CNCc1ccc(cc1)Br CSC011645308 [0,1,0,0,0,2|0,0,0]=3 526 B13R1.513 CC(=O)CCSc1ccc(cc1)F CSC000208766 [0,1,0,0,0,2|1,0,0]=4 527 B13R1.513 CC(=O)NCCc1ccc(cc1)Cl CSC000151911 [0,1,0,0,0,2|1,0,0]=4 528 B13R1.513 CC(=O)NCCc1ccc(cc1)F CSC000152297 [0,1,0,0,0,2|1,0,0]=4 529 B13R1.513 CC(=O)NCCc1ccc(cc1)O CSC011395907 [0,1,0,0,0,2|1,0,0]=4 530 B13R1.513 CC(=O)OCCc1ccc(cc1)C CSC009829655 [0,1,0,0,0,2|1,0,0]=4 531 B13R1.513 CC(=O)OCCc1ccc(cc1)Cl CSC009851009 [0,1,0,0,0,2|1,0,0]=4 532 B13R1.513 CC(=O)OCCc1ccc(cc1)F CSC000071711 [0,1,0,0,0,2|1,0,0]=4 533 B13R1.718 CCC(=O)OCCc1ccccc1 CSC000024285 [0,1,0,0,0,2|1,0,0]=4 534 B13R1.718 CNC(=O)CCSc1ccccc1 CSC000159960 [0,1,0,0,0,2|1,0,0]=4 535 B13R1.718 CNC(=O)CSCc1ccccc1 CSC000149384 [0,1,0,0,0,2|1,0,0]=4 536 B13R1.718 CNC(=O)NCCc1ccccc1 CSC000235216 [0,1,0,0,0,2|1,0,0]=4 537 B13R1.718 COC(=O)CCCc1ccccc1 CSC011295115 [0,1,0,0,0,2|1,0,0]=4 538 B13R1.718 COC(=O)CCOc1ccccc1 CSC000149921 [0,1,0,0,0,2|1,0,0]=4 539 B13R1.718 COC(=O)CCSc1ccccc1 CSC000149870 [0,1,0,0,0,2|1,0,0]=4 540 B13R1.718 COC(=O)CSCc1ccccc1 CSC000151540 [0,1,0,0,0,2|1,0,0]=4 541 B13R1.718 COC(=O)NCCc1ccccc1 CSC000235985 [0,1,0,0,0,2|1,0,0]=4 542 B13R1.3 CC(=C)COc1ccc(cc1)CO CSC000173090 [0,2,0,0,0,1|0,0,0]=3 543 B13R1.3 CC(=O)COc1ccc(cc1)C#N CSC000150630 [0,2,0,0,0,1|1,0,0]=4 544 B13R1.3 COc1ccc(cc1)CCC(=O)C CSC000170882 [0,2,0,0,0,1|1,0,0]=4 545 B13R1.3 COc1ccc(cc1)CNC(=O)C CSC000155742 [0,2,0,0,0,1|1,0,0]=4 546 B13R1.14 CCC(=O)NCc1ccc(cc1)C CSC000154269 [0,2,0,0,0,1|1,0,0]=4 547 B13R1.14 CCC(=O)NCc1ccc(cc1)Cl CSC000152853 [0,2,0,0,0,1|1,0,0]=4 548 B13R1.14 CCC(=O)NCc1ccc(cc1)F CSC000152312 [0,2,0,0,0,1|1,0,0]=4 549 B13R1.14 CNC(=O)CCc1ccc(cc1)Cl CSC000022063 [0,2,0,0,0,1|1,0,0]=4 550 B13R1.14 CNC(=O)CCc1ccc(cc1)F CSC000198136 [0,2,0,0,0,1|1,0,0]=4 551 B13R1.14 CNC(=O)COc1ccc(cc1)C CSC000150494 [0,2,0,0,0,1|1,0,0]=4 552 B13R1.14 CNC(=O)COc1ccc(cc1)Cl CSC000150441 [0,2,0,0,0,1|1,0,0]=4 553 B13R1.14 CNC(=O)COc1ccc(cc1)F CSC000150542 [0,2,0,0,0,1|1,0,0]=4 554 B13R1.14 CNC(=O)CSc1ccc(cc1)Cl CSC000150459 [0,2,0,0,0,1|1,0,0]=4 555 B13R1.14 CNC(=O)NCc1ccc(cc1)Cl CSC000235214 [0,2,0,0,0,1|1,0,0]=4 556 B13R1.14 CNC(=O)NCc1ccc(cc1)F CSC000235249 [0,2,0,0,0,1|1,0,0]=4 557 B13R1.14 COC(=O)CCc1ccc(cc1)Br CSC012357364 [0,2,0,0,0,1|1,0,0]=4 558 B13R1.14 COC(=O)CCc1ccc(cc1)Cl CSC000240969 [0,2,0,0,0,1|1,0,0]=4 559 B13R1.14 COC(=O)CCc1ccc(cc1)F CSC000198246 [0,2,0,0,0,1|1,0,0]=4 560 B13R1.14 COC(=O)CNc1ccc(cc1)Br CSC000219630 [0,2,0,0,0,1|1,0,0]=4 561 B13R1.14 COC(=O)CNc1ccc(cc1)C CSC000219983 [0,2,0,0,0,1|1,0,0]=4 562 B13R1.14 COC(=O)CNc1ccc(cc1)Cl CSC000220163 [0,2,0,0,0,1|1,0,0]=4 563 B13R1.14 COC(=O)CNc1ccc(cc1)F CSC000219835 [0,2,0,0,0,1|1,0,0]=4 564 B13R1.14 COC(=O)COc1ccc(cc1)C CSC000151163 [0,2,0,0,0,1|1,0,0]=4 565 B13R1.14 COC(=O)COc1ccc(cc1)Cl CSC000148943 [0,2,0,0,0,1|1,0,0]=4 566 B13R1.14 COC(=O)COc1ccc(cc1)I CSC000151492 [0,2,0,0,0,1|1,0,0]=4 567 B13R1.14 COC(=O)CSc1ccc(cc1)C CSC000148271 [0,2,0,0,0,1|1,0,0]=4 568 B13R1.14 COC(=O)CSc1ccc(cc1)Cl CSC000150947 [0,2,0,0,0,1|1,0,0]=4 569 B13R1.14 COC(=O)NCc1ccc(cc1)Br CSC011472957 [0,2,0,0,0,1|1,0,0]=4 570 B13R1.14 COC(=O)NCc1ccc(cc1)Cl CSC000235972 [0,2,0,0,0,1|1,0,0]=4 571 B13R1.14 Cc1ccc(cc1)CNC(=O)CN CSC000168522 [0,2,0,0,0,1|1,0,0]=4 572 B13R1.14 NCC(=O)NCc1ccc(cc1)F CSC000168487 [0,2,0,0,0,1|1,0,0]=4 573 B13R1.132 CC(NC(=O)C)c1ccc(cc1)Br CSC000153805 [0,2,0,0,0,1|1,0,0]=4 574 B13R1.132 CC(NC(=O)C)c1ccc(cc1)C CSC011237556 [0,2,0,0,0,1|1,0,0]=4 575 B13R1.132 CC(NC(=O)C)c1ccc(cc1)Cl CSC000153794 [0,2,0,0,0,1|1,0,0]=4 576 B13R1.133 CN(Cc1ccc(cc1)C)C(=O)C CSC000155497 [0,2,0,0,0,1|1,0,0]=4 577 B13R1.164 CC(=O)COc1ccc(cc1Cl)Cl CSC000150674 [0,2,0,0,0,1|1,0,0]=4 578 B13R1.164 CC(=O)NCc1ccc(cc1Cl)Cl CSC000001290 [0,2,0,0,0,1|1,0,0]=4 579 B13R1.11 CC(NC(=O)CN)c1ccccc1 CSC000168438 [0,2,0,0,0,1|1,0,0]=4 580 B13R1.11 CCC(=O)NC(C)c1ccccc1 CSC000158022 [0,2,0,0,0,1|1,0,0]=4 581 B13R1.11 CCC(=O)N[C@H](C)c1ccccc1 CSC011908461 [0,2,0,0,0,1|1,0,0]=4 582 B13R1.11 CCC(=O)OC(C)c1ccccc1 CSC000000838 [0,2,0,0,0,1|1,0,0]=4 583 B13R1.11 CNC(=O)CC(C)c1ccccc1 CSC000002954 [0,2,0,0,0,1|1,0,0]=4 584 B13R1.11 COC(=O)CC(C)c1ccccc1 CSC000000072 [0,2,0,0,0,1|1,0,0]=4 585 B13R1.11 COC(=O)NC(C)c1ccccc1 CSC000235971 [0,2,0,0,0,1|1,0,0]=4 586 B13R1.15 CCC(=O)NCc1cccc(c1)Br CSC011236840 [0,2,0,0,0,1|1,0,0]=4 587 B13R1.15 CCC(=O)NCc1cccc(c1)C CSC011222327 [0,2,0,0,0,1|1,0,0]=4 588 B13R1.15 CNC(=O)COc1cccc(c1)C CSC000150510 [0,2,0,0,0,1|1,0,0]=4 589 B13R1.15 CNC(=O)COc1cccc(c1)Cl CSC000150638 [0,2,0,0,0,1|1,0,0]=4 590 B13R1.15 CNC(=O)COc1cccc(c1)F CSC000150749 [0,2,0,0,0,1|1,0,0]=4 591 B13R1.15 COC(=O)CCc1cccc(c1)Br CSC000151591 [0,2,0,0,0,1|1,0,0]=4 592 B13R1.15 COC(=O)CCc1cccc(c1)Cl CSC000024355 [0,2,0,0,0,1|1,0,0]=4 593 B13R1.15 COC(=O)CNc1cccc(c1)Br CSC000219654 [0,2,0,0,0,1|1,0,0]=4 594 B13R1.15 COC(=O)CNc1cccc(c1)Cl CSC000220050 [0,2,0,0,0,1|1,0,0]=4 595 B13R1.15 COC(=O)COc1cccc(c1)C CSC000149909 [0,2,0,0,0,1|1,0,0]=4 596 B13R1.15 COC(=O)CSc1cccc(c1)Br CSC011756034 [0,2,0,0,0,1|1,0,0]=4 597 B13R1.15 COC(=O)CSc1cccc(c1)C CSC011431931 [0,2,0,0,0,1|1,0,0]=4 598 B13R1.15 COC(=O)CSc1cccc(c1)Cl CSC011721657 [0,2,0,0,0,1|1,0,0]=4 599 B13R1.15 COC(=O)NCc1cccc(c1)Br CSC011256846 [0,2,0,0,0,1|1,0,0]=4 600 B13R1.15 COC(=O)NCc1cccc(c1)Cl CSC000236059 [0,2,0,0,0,1|1,0,0]=4 601 B13R1.15 Cc1cccc(c1)CNC(=O)CN CSC011368966 [0,2,0,0,0,1|1,0,0]=4 602 B13R1.15 NCC(=O)NCc1cccc(c1)Cl CSC000168498 [0,2,0,0,0,1|1,0,0]=4 603 B13R1.15 NCC(=O)NCc1cccc(c1)F CSC011248369 [0,2,0,0,0,1|1,0,0]=4 604 B13R1.42 CCCC(=O)NCc1ccccc1 CSC000153126 [0,2,0,0,0,1|1,0,0]=4 605 B13R1.42 CCCC(=O)OCc1ccccc1 CSC000000759 [0,2,0,0,0,1|1,0,0]=4 606 B13R1.42 CCNC(=O)CCc1ccccc1 CSC000160125 [0,2,0,0,0,1|1,0,0]=4 607 B13R1.42 CCNC(=O)COc1ccccc1 CSC000150565 [0,2,0,0,0,1|1,0,0]=4 608 B13R1.42 CCNC(=O)CSc1ccccc1 CSC000150704 [0,2,0,0,0,1|1,0,0]=4 609 B13R1.42 CCOC(=O)CCc1ccccc1 CSC000170145 [0,2,0,0,0,1|1,0,0]=4 610 B13R1.42 CCOC(=O)CNc1ccccc1 CSC000219562 [0,2,0,0,0,1|1,0,0]=4 611 B13R1.42 CCOC(=O)COc1ccccc1 CSC000170178 [0,2,0,0,0,1|1,0,0]=4 612 B13R1.42 CCOC(=O)CSc1ccccc1 CSC000170991 [0,2,0,0,0,1|1,0,0]=4 613 B13R1.135 CCC(=O)N(C)Cc1ccccc1 CSC000152899 [0,2,0,0,0,1|1,0,0]=4 614 B13R1.135 CNC(=O)C(C)Oc1ccccc1 CSC000159945 [0,2,0,0,0,1|1,0,0]=4 615 B13R1.135 CNC(=O)[C@@H](N)Cc1ccccc1 CSC011422888 [0,2,0,0,0,1|1,0,0]=4 616 B13R1.135 COC(=O)C(C)Sc1ccccc1 CSC000148442 [0,2,0,0,0,1|1,0,0]=4 617 B13R1.135 COC(=O)[C@@H](O)Cc1ccccc1 CSC009816323 [0,2,0,0,0,1|1,0,0]=4 618 B13R1.528 CCC(=O)NCc1ccccc1Br CSC011236884 [0,2,0,0,0,1|1,0,0]=4 619 B13R1.528 CCC(=O)NCc1ccccc1C CSC000175811 [0,2,0,0,0,1|1,0,0]=4 620 B13R1.528 CCC(=O)NCc1ccccc1Cl CSC000155630 [0,2,0,0,0,1|1,0,0]=4 621 B13R1.528 CNC(=O)CCc1ccccc1Br CSC009814840 [0,2,0,0,0,1|1,0,0]=4 622 B13R1.528 CNC(=O)CCc1ccccc1Cl CSC000159727 [0,2,0,0,0,1|1,0,0]=4 623 B13R1.528 CNC(=O)CCc1ccccc1F CSC015378911 [0,2,0,0,0,1|1,0,0]=4 624 B13R1.528 CNC(=O)CCc1ccccc1N CSC011289560 [0,2,0,0,0,1|1,0,0]=4 625 B13R1.528 CNC(=O)COc1ccccc1C CSC000150526 [0,2,0,0,0,1|1,0,0]=4 626 B13R1.528 CNC(=O)COc1ccccc1Cl CSC000150425 [0,2,0,0,0,1|1,0,0]=4 627 B13R1.528 CNC(=O)COc1ccccc1F CSC000150384 [0,2,0,0,0,1|1,0,0]=4 628 B13R1.528 CNC(=O)NCc1ccccc1Cl CSC000235227 [0,2,0,0,0,1|1,0,0]=4 629 B13R1.528 COC(=O)CCc1ccccc1Br CSC009815308 [0,2,0,0,0,1|1,0,0]=4 630 B13R1.528 COC(=O)CCc1ccccc1Cl CSC000151590 [0,2,0,0,0,1|1,0,0]=4 631 B13R1.528 COC(=O)CCc1ccccc1F CSC000016591 [0,2,0,0,0,1|1,0,0]=4 632 B13R1.528 COC(=O)COc1ccccc1C CSC000149375 [0,2,0,0,0,1|1,0,0]=4 633 B13R1.528 COC(=O)COc1ccccc1Cl CSC000149908 [0,2,0,0,0,1|1,0,0]=4 634 B13R1.528 COC(=O)COc1ccccc1F CSC000149924 [0,2,0,0,0,1|1,0,0]=4 635 B13R1.528 COC(=O)NCc1ccccc1Cl CSC000236058 [0,2,0,0,0,1|1,0,0]=4 636 B13R1.528 Cc1ccccc1CNC(=O)CN CSC000214010 [0,2,0,0,0,1|1,0,0]=4 637 B13R1.528 NCC(=O)NCc1ccccc1Cl CSC000168405 [0,2,0,0,0,1|1,0,0]=4 638 B13R1.528 NCC(=O)NCc1ccccc1F CSC000214032 [0,2,0,0,0,1|1,0,0]=4 639 B13R1.418 CCN(Cc1ccccc1)C(=O)C CSC000155847 [0,2,0,0,0,1|1,0,0]=4 640 B13R1.713 CC(=O)N[C@@H](CO)c1ccccc1 CSC011995718 [0,2,0,0,0,1|1,0,0]=4 641 B13R1.90 CC(=C)COc1ccccc1CO CSC011232748 [0,2,0,0,0,1|0,0,0]=3 642 B13R1.90 CC(=O)COc1ccccc1C#N CSC000171606 [0,2,0,0,0,1|1,0,0]=4 643 B13R1.90 CC(=O)OCc1ccccc1C#N CSC000000590 [0,2,0,0,0,1|1,0,0]=4 644 B13R1.90 COc1ccccc1CNC(=O)C CSC000152208 [0,2,0,0,0,1|1,0,0]=4 645 B13R1.3787 CC(=O)NCc1c(cccc1Cl)F CSC000044876 [0,2,0,0,0,1|1,0,0]=4 646 B13R1.643 CC(=C)COc1cccc(c1)CO CSC011232702 [0,2,0,0,0,1|0,0,0]=3 647 B13R1.3420 CC(=O)COc1cc(cc(c1)Cl)Cl CSC000148508 [0,2,0,0,0,1|1,0,0]=4 648 B13R1.5 CCc1ccc(cc1)CC(=O)NC CSC015209060 [0,3,0,0,0,0|1,0,0]=4 649 B13R1.5 CCc1ccc(cc1)CC(=O)OC CSC011203038 [0,3,0,0,0,0|1,0,0]=4 650 B13R1.5 CNC(=O)Cc1ccc(cc1)OC CSC000159856 [0,3,0,0,0,0|1,0,0]=4 651 B13R1.5 COC(=O)Cc1ccc(cc1)C#N CSC000058082 [0,3,0,0,0,0|1,0,0]=4 652 B13R1.5 COC(=O)Cc1ccc(cc1)OC CSC000148849 [0,3,0,0,0,0|1,0,0]=4 653 B13R1.2879 CNC(=O)Cc1ccc(c(c1)C)C CSC000159723 [0,3,0,0,0,0|1,0,0]=4 654 B13R1.2879 COC(=O)Cc1ccc(c(c1)Br)F CSC011435807 [0,3,0,0,0,0|1,0,0]=4 655 B13R1.2879 COC(=O)Cc1ccc(c(c1)C)C CSC000151499 [0,3,0,0,0,0|1,0,0]=4 656 B13R1.2879 COC(=O)Cc1ccc(c(c1)Cl)Cl CSC000148930 [0,3,0,0,0,0|1,0,0]=4 657 B13R1.2879 COC(=O)Cc1ccc(c(c1)F)Cl CSC012360021 [0,3,0,0,0,0|1,0,0]=4 658 B13R1.2879 COC(=O)Cc1ccc(c(c1)F)F CSC012186392 [0,3,0,0,0,0|1,0,0]=4 659 B13R1.19 CCNC(=O)Cc1ccc(cc1)Br CSC000155194 [0,3,0,0,0,0|1,0,0]=4 660 B13R1.19 CCNC(=O)Cc1ccc(cc1)C CSC000206254 [0,3,0,0,0,0|1,0,0]=4 661 B13R1.19 CCNC(=O)Cc1ccc(cc1)Cl CSC000160162 [0,3,0,0,0,0|1,0,0]=4 662 B13R1.19 CCNC(=O)Cc1ccc(cc1)F CSC000160178 [0,3,0,0,0,0|1,0,0]=4 663 B13R1.19 CCOC(=O)Cc1ccc(cc1)Br CSC000170549 [0,3,0,0,0,0|1,0,0]=4 664 B13R1.19 CCOC(=O)Cc1ccc(cc1)C CSC011212846 [0,3,0,0,0,0|1,0,0]=4 665 B13R1.19 CCOC(=O)Cc1ccc(cc1)Cl CSC000170305 [0,3,0,0,0,0|1,0,0]=4 666 B13R1.19 CCOC(=O)Cc1ccc(cc1)I CSC012353677 [0,3,0,0,0,0|1,0,0]=4 667 B13R1.19 CCOC(=O)Cc1ccc(cc1)O CSC011212766 [0,3,0,0,0,0|1,0,0]=4 668 B13R1.2679 COC(=O)Cc1ccc(cc1Br)F CSC012569216 [0,3,0,0,0,0|1,0,0]=4 669 B13R1.2679 COC(=O)Cc1ccc(cc1Cl)Cl CSC000149119 [0,3,0,0,0,0|1,0,0]=4 670 B13R1.2679 COC(=O)Cc1ccc(cc1Cl)F CSC011934076 [0,3,0,0,0,0|1,0,0]=4 671 B13R1.2679 COC(=O)Cc1ccc(cc1F)Br CSC013023952 [0,3,0,0,0,0|1,0,0]=4 672 B13R1.2679 COC(=O)Cc1ccc(cc1F)F CSC012017320 [0,3,0,0,0,0|1,0,0]=4 673 B13R1.22 COC(=O)C(C)c1cccc(c1)Br CSC010077029 [0,3,0,0,0,0|1,0,0]=4 674 B13R1.47 CCOC(=O)C(C)c1ccccc1 CSC011214903 [0,3,0,0,0,0|1,0,0]=4 675 B13R1.47 CCOC(=O)C(O)c1ccccc1 CSC000174076 [0,3,0,0,0,0|1,0,0]=4 676 B13R1.47 CCOC(=O)[C@@H](O)c1ccccc1 CSC009816355 [0,3,0,0,0,0|1,0,0]=4 677 B13R1.47 CCOC(=O)[C@H](O)c1ccccc1 CSC009816354 [0,3,0,0,0,0|1,0,0]=4 678 B13R1.696 COC(=O)[C@H](O)c1ccccc1Cl CSC010004287 [0,3,0,0,0,0|1,0,0]=4 679 B13R1.708 COC(=O)C(C)(C)c1ccccc1 CSC000148643 [0,3,0,0,0,0|1,0,0]=4 680 B13R1.20 CCNC(=O)Cc1cccc(c1)Br CSC011713800 [0,3,0,0,0,0|1,0,0]=4 681 B13R1.20 CCNC(=O)Cc1cccc(c1)Cl CSC011795137 [0,3,0,0,0,0|1,0,0]=4 682 B13R1.20 CCNC(=O)Cc1cccc(c1)F CSC000160229 [0,3,0,0,0,0|1,0,0]=4 683 B13R1.20 CCNC(=O)Cc1cccc(c1)N CSC011690098 [0,3,0,0,0,0|1,0,0]=4 684 B13R1.20 CCOC(=O)Cc1cccc(c1)Br CSC011586817 [0,3,0,0,0,0|1,0,0]=4 685 B13R1.20 CCOC(=O)Cc1cccc(c1)F CSC000171471 [0,3,0,0,0,0|1,0,0]=4 686 B13R1.20 CCOC(=O)Cc1cccc(c1)O CSC011472689 [0,3,0,0,0,0|1,0,0]=4 687 B13R1.470 CCNC(=O)Cc1ccccc1Cl CSC000160231 [0,3,0,0,0,0|1,0,0]=4 688 B13R1.470 CCNC(=O)Cc1ccccc1F CSC000160198 [0,3,0,0,0,0|1,0,0]=4 689 B13R1.470 CCNC(=O)Cc1ccccc1N CSC011193781 [0,3,0,0,0,0|1,0,0]=4 690 B13R1.470 CCOC(=O)Cc1ccccc1Br CSC011218996 [0,3,0,0,0,0|1,0,0]=4 691 B13R1.470 CCOC(=O)Cc1ccccc1C CSC011212630 [0,3,0,0,0,0|1,0,0]=4 692 B13R1.470 CCOC(=O)Cc1ccccc1Cl CSC000171482 [0,3,0,0,0,0|1,0,0]=4 693 B13R1.40 COC(=O)Cc1cccc(c1Cl)Cl CSC011934355 [0,3,0,0,0,0|1,0,0]=4 694 B13R1.40 COC(=O)Cc1cccc(c1F)Cl CSC012362493 [0,3,0,0,0,0|1,0,0]=4 695 B13R1.81 COC(=O)Cc1cccc(c1)C#N CSC000081101 [0,3,0,0,0,0|1,0,0]=4 696 B13R1.81 COC(=O)Cc1cccc(c1)OC CSC000149792 [0,3,0,0,0,0|1,0,0]=4 697 B13R1.2872 CNC(=O)Cc1cc(ccc1C)C CSC011809056 [0,3,0,0,0,0|1,0,0]=4 698 B13R1.2872 COC(=O)Cc1cc(ccc1C)C CSC011203040 [0,3,0,0,0,0|1,0,0]=4 699 B13R1.2872 COC(=O)Cc1cc(ccc1F)F CSC012179967 [0,3,0,0,0,0|1,0,0]=4 700 B13R1.91 COC(=O)Cc1ccccc1OC CSC000171725 [0,3,0,0,0,0|1,0,0]=4 701 B13R1.4928 CNC(=O)Cc1c(cccc1Cl)F CSC000159865 [0,3,0,0,0,0|1,0,0]=4 702 B13R1.4928 COC(=O)Cc1c(cccc1Cl)Cl CSC000149166 [0,3,0,0,0,0|1,0,0]=4 703 B13R1.4928 COC(=O)Cc1c(cccc1Cl)F CSC000148923 [0,3,0,0,0,0|1,0,0]=4 704 B13R1.4928 COC(=O)Cc1c(cccc1F)F CSC012178862 [0,3,0,0,0,0|1,0,0]=4 705 B13R2.10 Cc1cc([nH]n1)c2ccccc2 CSC000009428 [0,0,0,1,0,2|0,0,1]=4 706 B13R2.72 CC(=O)N1CCc2c1cccc2 CSC000155365 [0,0,0,1,0,2|1,0,0]=4 707 B13R2.57 COc1cnc2ccccc2c1 CSC012187421 [0,1,0,1,0,1|0,0,1]=4 708 B13R2.57 CSc1ccc2ccccc2c1 CSC000000181 [0,1,0,1,0,1|0,0,1]=4 709 B13R1.337 CC(=O)NCCOc1ccccc1 CSC000152567 [0,0,0,0,0,3|1,0,0]=4 710 B13R1.337 CC(=O)OCCCc1ccccc1 CSC000006332 [0,0,0,0,0,3|1,0,0]=4 711 B13R1.337 CC(=O)OCCOc1ccccc1 CSC000000575 [0,0,0,0,0,3|1,0,0]=4 712 B13R1.337 CC(=O)OCCSc1ccccc1 CSC009876666 [0,0,0,0,0,3|1,0,0]=4