0 B10R1.15 CNC(=O)c1ccccc1 WXVL_AK00442SD0001 [0,0,0,0,0,0|2,0,0]=2 1 B10R1.15 CNC(=O)c1ccccc1 WXVL_AK00442SD0001 [0,0,0,0,0,0|2,0,0]=2 2 B10R1.15 CNC(=O)c1ccccn1 WXVL_AK00442SC0058 [0,0,0,0,0,0|3,0,0]=3 3 B10R1.15 CNC(=O)c1ccccn1 WXVL_AK00442SC0058 [0,0,0,0,0,0|3,0,0]=3 4 B10R1.15 CNC(=O)c1cccnc1 WXVL_AK00442SC0061 [0,0,0,0,0,0|1,0,0]=1 5 B10R1.15 CNC(=O)c1cccnc1 WXVL_AK00442SC0061 [0,0,0,0,0,0|1,0,0]=1 6 B10R1.15 CNC(=O)c1cccnn1 WXVL_AK00442SC0374 [0,0,0,0,0,0|2,0,0]=2 7 B10R1.15 CNC(=O)c1cccnn1 WXVL_AK00442SC0374 [0,0,0,0,0,0|2,0,0]=2 8 B10R1.15 CNC(=O)c1ccncc1 WXVL_AK00442SC0062 [0,0,0,0,0,0|3,0,0]=3 9 B10R1.15 CNC(=O)c1ccncc1 WXVL_AK00442SC0062 [0,0,0,0,0,0|3,0,0]=3 10 B10R1.15 CNC(=O)c1ccncn1 WXVL_AK00442SC0231 [0,0,0,0,0,0|4,0,0]=4 11 B10R1.15 CNC(=O)c1ccncn1 WXVL_AK00442SC0231 [0,0,0,0,0,0|4,0,0]=4 12 B10R1.15 CNC(=O)c1ccnnc1 WXVL_AK00442SC0064 [0,0,0,0,0,0|2,0,0]=2 13 B10R1.15 CNC(=O)c1ccnnc1 WXVL_AK00442SC0064 [0,0,0,0,0,0|2,0,0]=2 14 B10R1.15 CNC(=O)c1cncnc1 WXVL_AK00442SC0097 [0,0,0,0,0,0|2,0,0]=2 15 B10R1.15 CNC(=O)c1cncnc1 WXVL_AK00442SC0097 [0,0,0,0,0,0|2,0,0]=2 16 B10R1.15 CNC(=O)c1ncccn1 WXVL_AK00442SC0096 [0,0,0,0,0,0|4,0,0]=4 17 B10R1.15 CNC(=O)c1ncccn1 WXVL_AK00442SC0096 [0,0,0,0,0,0|4,0,0]=4 18 B9R1.6 NC(=O)c1ccccc1 WXVL_AK0084SD0001 [1,0,0,0,0,0|2,0,0]=3 19 B9R1.6 NC(=O)c1ccccc1 WXVL_AK0084SD0001 [1,0,0,0,0,0|2,0,0]=3 20 B9R1.6 NC(=O)c1ccccn1 WXVL_AK0084SC0058 [1,0,0,0,0,0|3,0,0]=4 21 B9R1.6 NC(=O)c1ccccn1 WXVL_AK0084SC0058 [1,0,0,0,0,0|3,0,0]=4 22 B9R1.6 NC(=O)c1cccnc1 WXVL_AK0084SC0061 [1,0,0,0,0,0|1,0,0]=2 23 B9R1.6 NC(=O)c1cccnc1 WXVL_AK0084SC0061 [1,0,0,0,0,0|1,0,0]=2 24 B9R1.6 NC(=O)c1cccnn1 WXVL_AK0084SC0374 [1,0,0,0,0,0|2,0,0]=3 25 B9R1.6 NC(=O)c1cccnn1 WXVL_AK0084SC0374 [1,0,0,0,0,0|2,0,0]=3 26 B9R1.6 NC(=O)c1ccncc1 WXVL_AK0084SC0062 [1,0,0,0,0,0|3,0,0]=4 27 B9R1.6 NC(=O)c1ccncc1 WXVL_AK0084SC0062 [1,0,0,0,0,0|3,0,0]=4 28 B9R1.6 NC(=O)c1ccnnc1 WXVL_AK0084SC0064 [1,0,0,0,0,0|2,0,0]=3 29 B9R1.6 NC(=O)c1ccnnc1 WXVL_AK0084SC0064 [1,0,0,0,0,0|2,0,0]=3 30 B9R1.6 NC(=O)c1cncnc1 WXVL_AK0084SC0097 [1,0,0,0,0,0|2,0,0]=3 31 B9R1.6 NC(=O)c1cncnc1 WXVL_AK0084SC0097 [1,0,0,0,0,0|2,0,0]=3 32 B11R1.7 CNS(=O)(=O)c1cccnc1 WXVL_AK00442HU0127 [0,1,0,0,0,0|2,0,0]=3 33 B11R1.7 CNS(=O)(=O)c1cccnc1 WXVL_AK00442HU0127 [0,1,0,0,0,0|2,0,0]=3 34 B11R1.16 CCNC(=O)c1ccccc1 WXVL_AK00476SD0001 [0,1,0,0,0,0|2,0,0]=3 35 B11R1.16 CCNC(=O)c1ccccc1 WXVL_AK00476SD0001 [0,1,0,0,0,0|2,0,0]=3 36 B11R1.16 CCNC(=O)c1ccccn1 WXVL_AK00476SC0058 [0,1,0,0,0,0|3,0,0]=4 37 B11R1.16 CCNC(=O)c1ccccn1 WXVL_AK00476SC0058 [0,1,0,0,0,0|3,0,0]=4 38 B11R1.16 CCNC(=O)c1cccnc1 WXVL_AK00476SC0061 [0,1,0,0,0,0|1,0,0]=2 39 B11R1.16 CCNC(=O)c1cccnc1 WXVL_AK00476SC0061 [0,1,0,0,0,0|1,0,0]=2 40 B11R1.16 CCNC(=O)c1cccnn1 WXVL_AK00476SC0374 [0,1,0,0,0,0|2,0,0]=3 41 B11R1.16 CCNC(=O)c1cccnn1 WXVL_AK00476SC0374 [0,1,0,0,0,0|2,0,0]=3 42 B11R1.16 CCNC(=O)c1ccncc1 WXVL_AK00476SC0062 [0,1,0,0,0,0|3,0,0]=4 43 B11R1.16 CCNC(=O)c1ccncc1 WXVL_AK00476SC0062 [0,1,0,0,0,0|3,0,0]=4 44 B11R1.16 CCNC(=O)c1ccnnc1 WXVL_AK00476SC0064 [0,1,0,0,0,0|2,0,0]=3 45 B11R1.16 CCNC(=O)c1ccnnc1 WXVL_AK00476SC0064 [0,1,0,0,0,0|2,0,0]=3 46 B11R1.16 CCNC(=O)c1cncnc1 WXVL_AK00476SC0097 [0,1,0,0,0,0|2,0,0]=3 47 B11R1.16 CCNC(=O)c1cncnc1 WXVL_AK00476SC0097 [0,1,0,0,0,0|2,0,0]=3 48 B11R1.22 CNC(=O)C1C=CC(=O)N=N1 WXVL_AK00442SB5455 [0,1,0,0,0,0|2,0,1]=4 49 B11R1.22 CNC(=O)C1C=CC(=O)N=N1 WXVL_AK00442SB5455 [0,1,0,0,0,0|2,0,1]=4 50 B11R1.22 CNC(=O)c1cc[n+](cc1)[O-] WXVL_AK00442SC0858 [0,1,0,0,0,0|3,0,0]=4 51 B11R1.22 CNC(=O)c1cc[n+](cc1)[O-] WXVL_AK00442SC0858 [0,1,0,0,0,0|3,0,0]=4 52 B11R1.22 CNC(=O)c1ccc(=O)[nH]c1 WXVL_AK00442SC2212 [0,1,0,0,0,0|1,0,1]=3 53 B11R1.22 CNC(=O)c1ccc(=O)[nH]c1 WXVL_AK00442SC2212 [0,1,0,0,0,0|1,0,1]=3 54 B11R1.22 CNC(=O)c1ccc(=O)oc1 WXVL_AK00442SC0132 [0,1,0,0,0,0|2,0,0]=3 55 B11R1.22 CNC(=O)c1ccc(=O)oc1 WXVL_AK00442SC0132 [0,1,0,0,0,0|2,0,0]=3 56 B11R1.22 CNC(=O)c1ccc(cc1)Br WXVL_AK00442SD0060 [0,1,0,0,0,0|2,0,0]=3 57 B11R1.22 CNC(=O)c1ccc(cc1)Br WXVL_AK00442SD0060 [0,1,0,0,0,0|2,0,0]=3 58 B11R1.22 CNC(=O)c1ccc(cc1)C WXVL_AK00442SD0078 [0,1,0,0,0,0|2,0,0]=3 59 B11R1.22 CNC(=O)c1ccc(cc1)C WXVL_AK00442SD0078 [0,1,0,0,0,0|2,0,0]=3 60 B11R1.22 CNC(=O)c1ccc(cc1)Cl WXVL_AK00442SD0062 [0,1,0,0,0,0|2,0,0]=3 61 B11R1.22 CNC(=O)c1ccc(cc1)Cl WXVL_AK00442SD0062 [0,1,0,0,0,0|2,0,0]=3 62 B11R1.22 CNC(=O)c1ccc(cc1)F WXVL_AK00442SD0061 [0,1,0,0,0,0|2,0,0]=3 63 B11R1.22 CNC(=O)c1ccc(cc1)F WXVL_AK00442SD0061 [0,1,0,0,0,0|2,0,0]=3 64 B11R1.22 CNC(=O)c1ccc(cc1)I WXVL_AK00442SD0421 [0,1,0,0,0,0|2,0,0]=3 65 B11R1.22 CNC(=O)c1ccc(cc1)I WXVL_AK00442SD0421 [0,1,0,0,0,0|2,0,0]=3 66 B11R1.22 CNC(=O)c1ccc(cc1)O WXVL_AK00442SD0069 [0,1,0,0,0,0|2,0,0]=3 67 B11R1.22 CNC(=O)c1ccc(cc1)O WXVL_AK00442SD0069 [0,1,0,0,0,0|2,0,0]=3 68 B11R1.22 CNC(=O)c1ccc(cc1)S WXVL_AK00442SD0154 [0,1,0,0,0,0|2,0,0]=3 69 B11R1.22 CNC(=O)c1ccc(cc1)S WXVL_AK00442SD0154 [0,1,0,0,0,0|2,0,0]=3 70 B11R1.22 CNC(=O)c1ccc(cn1)Br WXVL_AK00442SC0363 [0,1,0,0,0,0|3,0,0]=4 71 B11R1.22 CNC(=O)c1ccc(cn1)Br WXVL_AK00442SC0363 [0,1,0,0,0,0|3,0,0]=4 72 B11R1.22 CNC(=O)c1ccc(cn1)C WXVL_AK00442SC0104 [0,1,0,0,0,0|3,0,0]=4 73 B11R1.22 CNC(=O)c1ccc(cn1)C WXVL_AK00442SC0104 [0,1,0,0,0,0|3,0,0]=4 74 B11R1.22 CNC(=O)c1ccc(cn1)Cl WXVL_AK00442SC0381 [0,1,0,0,0,0|3,0,0]=4 75 B11R1.22 CNC(=O)c1ccc(cn1)Cl WXVL_AK00442SC0381 [0,1,0,0,0,0|3,0,0]=4 76 B11R1.22 CNC(=O)c1ccc(cn1)F WXVL_AK00442SC0114 [0,1,0,0,0,0|3,0,0]=4 77 B11R1.22 CNC(=O)c1ccc(cn1)F WXVL_AK00442SC0114 [0,1,0,0,0,0|3,0,0]=4 78 B11R1.22 CNC(=O)c1ccc(cn1)O WXVL_AK00442SC0130 [0,1,0,0,0,0|3,0,0]=4 79 B11R1.22 CNC(=O)c1ccc(cn1)O WXVL_AK00442SC0130 [0,1,0,0,0,0|3,0,0]=4 80 B11R1.22 CNC(=O)c1ccc(nc1)Br WXVL_AK00442SC0352 [0,1,0,0,0,0|1,0,0]=2 81 B11R1.22 CNC(=O)c1ccc(nc1)Br WXVL_AK00442SC0352 [0,1,0,0,0,0|1,0,0]=2 82 B11R1.22 CNC(=O)c1ccc(nc1)C WXVL_AK00442SC0060 [0,1,0,0,0,0|1,0,0]=2 83 B11R1.22 CNC(=O)c1ccc(nc1)C WXVL_AK00442SC0060 [0,1,0,0,0,0|1,0,0]=2 84 B11R1.22 CNC(=O)c1ccc(nc1)Cl WXVL_AK00442SC0147 [0,1,0,0,0,0|1,0,0]=2 85 B11R1.22 CNC(=O)c1ccc(nc1)Cl WXVL_AK00442SC0147 [0,1,0,0,0,0|1,0,0]=2 86 B11R1.22 CNC(=O)c1ccc(nc1)F WXVL_AK00442SC0370 [0,1,0,0,0,0|1,0,0]=2 87 B11R1.22 CNC(=O)c1ccc(nc1)F WXVL_AK00442SC0370 [0,1,0,0,0,0|1,0,0]=2 88 B11R1.22 CNC(=O)c1ccc(nc1)O WXVL_AK00442SC0057 [0,1,0,0,0,0|1,0,0]=2 89 B11R1.22 CNC(=O)c1ccc(nc1)O WXVL_AK00442SC0057 [0,1,0,0,0,0|1,0,0]=2 90 B11R1.22 CNC(=O)c1cnc(cn1)C WXVL_AK00442SC0072 [0,1,0,0,0,0|2,0,0]=3 91 B11R1.22 CNC(=O)c1cnc(cn1)C WXVL_AK00442SC0072 [0,1,0,0,0,0|2,0,0]=3 92 B11R1.22 CNC(=O)c1cnc(cn1)Cl WXVL_AK00442SC0383 [0,1,0,0,0,0|2,0,0]=3 93 B11R1.22 CNC(=O)c1cnc(cn1)Cl WXVL_AK00442SC0383 [0,1,0,0,0,0|2,0,0]=3 94 B11R1.22 CNC(=O)c1cnc(nc1)C WXVL_AK00442SC0032 [0,1,0,0,0,0|2,0,0]=3 95 B11R1.22 CNC(=O)c1cnc(nc1)C WXVL_AK00442SC0032 [0,1,0,0,0,0|2,0,0]=3 96 B11R1.22 CNC(=O)c1cnc(nc1)Cl WXVL_AK00442SC0148 [0,1,0,0,0,0|2,0,0]=3 97 B11R1.22 CNC(=O)c1cnc(nc1)Cl WXVL_AK00442SC0148 [0,1,0,0,0,0|2,0,0]=3 98 B11R1.23 CNC(=O)c1cc(=O)cco1 WXVL_AK00442SC0133 [0,1,0,0,0,0|3,0,0]=4 99 B11R1.23 CNC(=O)c1cc(=O)cco1 WXVL_AK00442SC0133 [0,1,0,0,0,0|3,0,0]=4 100 B11R1.23 CNC(=O)c1cc(ccn1)Br WXVL_AK00442SC0243 [0,1,0,0,0,0|3,0,0]=4 101 B11R1.23 CNC(=O)c1cc(ccn1)Br WXVL_AK00442SC0243 [0,1,0,0,0,0|3,0,0]=4 102 B11R1.23 CNC(=O)c1cc(ccn1)C WXVL_AK00442SC0235 [0,1,0,0,0,0|3,0,0]=4 103 B11R1.23 CNC(=O)c1cc(ccn1)C WXVL_AK00442SC0235 [0,1,0,0,0,0|3,0,0]=4 104 B11R1.23 CNC(=O)c1cc(ccn1)Cl WXVL_AK00442SC0373 [0,1,0,0,0,0|3,0,0]=4 105 B11R1.23 CNC(=O)c1cc(ccn1)Cl WXVL_AK00442SC0373 [0,1,0,0,0,0|3,0,0]=4 106 B11R1.23 CNC(=O)c1ccc[n+](c1)[O-] WXVL_AK00442SC1039 [0,1,0,0,0,0|1,0,1]=3 107 B11R1.23 CNC(=O)c1ccc[n+](c1)[O-] WXVL_AK00442SC1039 [0,1,0,0,0,0|1,0,1]=3 108 B11R1.23 CNC(=O)c1cccc(c1)Br WXVL_AK00442SD0041 [0,1,0,0,0,0|2,0,0]=3 109 B11R1.23 CNC(=O)c1cccc(c1)Br WXVL_AK00442SD0041 [0,1,0,0,0,0|2,0,0]=3 110 B11R1.23 CNC(=O)c1cccc(c1)C WXVL_AK00442SD0056 [0,1,0,0,0,0|2,0,0]=3 111 B11R1.23 CNC(=O)c1cccc(c1)C WXVL_AK00442SD0056 [0,1,0,0,0,0|2,0,0]=3 112 B11R1.23 CNC(=O)c1cccc(c1)Cl WXVL_AK00442SD0045 [0,1,0,0,0,0|2,0,0]=3 113 B11R1.23 CNC(=O)c1cccc(c1)Cl WXVL_AK00442SD0045 [0,1,0,0,0,0|2,0,0]=3 114 B11R1.23 CNC(=O)c1cccc(c1)F WXVL_AK00442SD0043 [0,1,0,0,0,0|2,0,0]=3 115 B11R1.23 CNC(=O)c1cccc(c1)F WXVL_AK00442SD0043 [0,1,0,0,0,0|2,0,0]=3 116 B11R1.23 CNC(=O)c1cccc(c1)I WXVL_AK00442SD0405 [0,1,0,0,0,0|2,0,0]=3 117 B11R1.23 CNC(=O)c1cccc(c1)I WXVL_AK00442SD0405 [0,1,0,0,0,0|2,0,0]=3 118 B11R1.23 CNC(=O)c1cccc(c1)O WXVL_AK00442SD1724 [0,1,0,0,0,0|2,0,0]=3 119 B11R1.23 CNC(=O)c1cccc(c1)O WXVL_AK00442SD1724 [0,1,0,0,0,0|2,0,0]=3 120 B11R1.23 CNC(=O)c1cccc(n1)Br WXVL_AK00442SC0366 [0,1,0,0,0,0|3,0,0]=4 121 B11R1.23 CNC(=O)c1cccc(n1)Br WXVL_AK00442SC0366 [0,1,0,0,0,0|3,0,0]=4 122 B11R1.23 CNC(=O)c1cccc(n1)F WXVL_AK00442SC0386 [0,1,0,0,0,0|3,0,0]=4 123 B11R1.23 CNC(=O)c1cccc(n1)F WXVL_AK00442SC0386 [0,1,0,0,0,0|3,0,0]=4 124 B11R1.23 CNC(=O)c1cccc(n1)O WXVL_AK00442SC0084 [0,1,0,0,0,0|3,0,0]=4 125 B11R1.23 CNC(=O)c1cccc(n1)O WXVL_AK00442SC0084 [0,1,0,0,0,0|3,0,0]=4 126 B11R1.23 CNC(=O)c1ccnc(c1)Br WXVL_AK00442SC0349 [0,1,0,0,0,0|3,0,0]=4 127 B11R1.23 CNC(=O)c1ccnc(c1)Br WXVL_AK00442SC0349 [0,1,0,0,0,0|3,0,0]=4 128 B11R1.23 CNC(=O)c1ccnc(c1)C WXVL_AK00442SC0400 [0,1,0,0,0,0|3,0,0]=4 129 B11R1.23 CNC(=O)c1ccnc(c1)C WXVL_AK00442SC0400 [0,1,0,0,0,0|3,0,0]=4 130 B11R1.23 CNC(=O)c1ccnc(c1)Cl WXVL_AK00442SC0083 [0,1,0,0,0,0|3,0,0]=4 131 B11R1.23 CNC(=O)c1ccnc(c1)Cl WXVL_AK00442SC0083 [0,1,0,0,0,0|3,0,0]=4 132 B11R1.23 CNC(=O)c1ccnc(c1)F WXVL_AK00442SC0015 [0,1,0,0,0,0|3,0,0]=4 133 B11R1.23 CNC(=O)c1ccnc(c1)F WXVL_AK00442SC0015 [0,1,0,0,0,0|3,0,0]=4 134 B11R1.23 CNC(=O)c1ccnc(c1)O WXVL_AK00442SC0131 [0,1,0,0,0,0|3,0,0]=4 135 B11R1.23 CNC(=O)c1ccnc(c1)O WXVL_AK00442SC0131 [0,1,0,0,0,0|3,0,0]=4 136 B11R1.23 CNC(=O)c1cncc(c1)Br WXVL_AK00442SC0369 [0,1,0,0,0,0|1,0,0]=2 137 B11R1.23 CNC(=O)c1cncc(c1)Br WXVL_AK00442SC0369 [0,1,0,0,0,0|1,0,0]=2 138 B11R1.23 CNC(=O)c1cncc(c1)C WXVL_AK00442SC0095 [0,1,0,0,0,0|1,0,0]=2 139 B11R1.23 CNC(=O)c1cncc(c1)C WXVL_AK00442SC0095 [0,1,0,0,0,0|1,0,0]=2 140 B11R1.23 CNC(=O)c1cncc(c1)Cl WXVL_AK00442SC0291 [0,1,0,0,0,0|1,0,0]=2 141 B11R1.23 CNC(=O)c1cncc(c1)Cl WXVL_AK00442SC0291 [0,1,0,0,0,0|1,0,0]=2 142 B11R1.23 CNC(=O)c1cncc(c1)F WXVL_AK00442SC0102 [0,1,0,0,0,0|1,0,0]=2 143 B11R1.23 CNC(=O)c1cncc(c1)F WXVL_AK00442SC0102 [0,1,0,0,0,0|1,0,0]=2 144 B11R1.23 CNC(=O)c1cncc(c1)O WXVL_AK00442SC0333 [0,1,0,0,0,0|1,0,0]=2 145 B11R1.23 CNC(=O)c1cncc(c1)O WXVL_AK00442SC0333 [0,1,0,0,0,0|1,0,0]=2 146 B11R1.23 CNC(=O)c1cncc(n1)C WXVL_AK00442SC0391 [0,1,0,0,0,0|2,0,0]=3 147 B11R1.23 CNC(=O)c1cncc(n1)C WXVL_AK00442SC0391 [0,1,0,0,0,0|2,0,0]=3 148 B11R1.23 CNC(=O)c1cnnc(c1)Cl WXVL_AK00442SC0966 [0,1,0,0,0,0|2,0,0]=3 149 B11R1.23 CNC(=O)c1cnnc(c1)Cl WXVL_AK00442SC0966 [0,1,0,0,0,0|2,0,0]=3 150 B11R1.23 CNC(=O)c1cnnc(c1)O WXVL_AK00442SC0795 [0,1,0,0,0,0|2,0,0]=3 151 B11R1.23 CNC(=O)c1cnnc(c1)O WXVL_AK00442SC0795 [0,1,0,0,0,0|2,0,0]=3 152 B11R1.36 CN(C)C(=O)c1ccccc1 WXVL_AN0032SD0001 [0,1,0,0,0,0|2,0,0]=3 153 B11R1.36 CN(C)C(=O)c1ccccc1 WXVL_AN0032SD0001 [0,1,0,0,0,0|2,0,0]=3 154 B11R1.36 CN(C)C(=O)c1ccccn1 WXVL_AN0032SC0058 [0,1,0,0,0,0|3,0,0]=4 155 B11R1.36 CN(C)C(=O)c1ccccn1 WXVL_AN0032SC0058 [0,1,0,0,0,0|3,0,0]=4 156 B11R1.36 CN(C)C(=O)c1cccnc1 WXVL_AN0032SC0061 [0,1,0,0,0,0|1,0,0]=2 157 B11R1.36 CN(C)C(=O)c1cccnc1 WXVL_AN0032SC0061 [0,1,0,0,0,0|1,0,0]=2 158 B11R1.36 CN(C)C(=O)c1cccnn1 WXVL_AN0032SC0374 [0,1,0,0,0,0|2,0,0]=3 159 B11R1.36 CN(C)C(=O)c1cccnn1 WXVL_AN0032SC0374 [0,1,0,0,0,0|2,0,0]=3 160 B11R1.36 CN(C)C(=O)c1ccncc1 WXVL_AN0032SC0062 [0,1,0,0,0,0|3,0,0]=4 161 B11R1.36 CN(C)C(=O)c1ccncc1 WXVL_AN0032SC0062 [0,1,0,0,0,0|3,0,0]=4 162 B11R1.36 CN(C)C(=O)c1ccnnc1 WXVL_AN0032SC0064 [0,1,0,0,0,0|2,0,0]=3 163 B11R1.36 CN(C)C(=O)c1ccnnc1 WXVL_AN0032SC0064 [0,1,0,0,0,0|2,0,0]=3 164 B11R1.36 CN(C)C(=O)c1cncnc1 WXVL_AN0032SC0097 [0,1,0,0,0,0|2,0,0]=3 165 B11R1.36 CN(C)C(=O)c1cncnc1 WXVL_AN0032SC0097 [0,1,0,0,0,0|2,0,0]=3 166 B11R1.36 NC(=O)C(=O)c1ccccc1 WXVL_AK0084SB0050 [0,1,0,0,0,0|3,0,0]=4 167 B11R1.36 NC(=O)C(=O)c1ccccc1 WXVL_AK0084SB0050 [0,1,0,0,0,0|3,0,0]=4 168 B11R1.222 CNC(=O)c1ccccc1Br WXVL_AK00442SD0002 [0,1,0,0,0,0|2,0,0]=3 169 B11R1.222 CNC(=O)c1ccccc1Br WXVL_AK00442SD0002 [0,1,0,0,0,0|2,0,0]=3 170 B11R1.222 CNC(=O)c1ccccc1C WXVL_AK00442SD0037 [0,1,0,0,0,0|2,0,0]=3 171 B11R1.222 CNC(=O)c1ccccc1C WXVL_AK00442SD0037 [0,1,0,0,0,0|2,0,0]=3 172 B11R1.222 CNC(=O)c1ccccc1Cl WXVL_AK00442SD0006 [0,1,0,0,0,0|2,0,0]=3 173 B11R1.222 CNC(=O)c1ccccc1Cl WXVL_AK00442SD0006 [0,1,0,0,0,0|2,0,0]=3 174 B11R1.222 CNC(=O)c1ccccc1F WXVL_AK00442SD0003 [0,1,0,0,0,0|2,0,0]=3 175 B11R1.222 CNC(=O)c1ccccc1F WXVL_AK00442SD0003 [0,1,0,0,0,0|2,0,0]=3 176 B11R1.222 CNC(=O)c1ccccc1I WXVL_AK00442SD0303 [0,1,0,0,0,0|2,0,0]=3 177 B11R1.222 CNC(=O)c1ccccc1I WXVL_AK00442SD0303 [0,1,0,0,0,0|2,0,0]=3 178 B11R1.222 CNC(=O)c1ccccc1O WXVL_AK00442SD00056 [0,1,0,0,0,0|2,0,0]=3 179 B11R1.222 CNC(=O)c1ccccc1O WXVL_AK00442SD00056 [0,1,0,0,0,0|2,0,0]=3 180 B11R1.222 CNC(=O)c1ccccc1S WXVL_AK00442SD0153 [0,1,0,0,0,0|2,0,0]=3 181 B11R1.222 CNC(=O)c1ccccc1S WXVL_AK00442SD0153 [0,1,0,0,0,0|2,0,0]=3 182 B11R1.222 CNC(=O)c1cccnc1Br WXVL_AK00442SC0367 [0,1,0,0,0,0|1,0,0]=2 183 B11R1.222 CNC(=O)c1cccnc1Br WXVL_AK00442SC0367 [0,1,0,0,0,0|1,0,0]=2 184 B11R1.222 CNC(=O)c1cccnc1C WXVL_AK00442SC0065 [0,1,0,0,0,0|1,0,0]=2 185 B11R1.222 CNC(=O)c1cccnc1C WXVL_AK00442SC0065 [0,1,0,0,0,0|1,0,0]=2 186 B11R1.222 CNC(=O)c1cccnc1Cl WXVL_AK00442SC0146 [0,1,0,0,0,0|1,0,0]=2 187 B11R1.222 CNC(=O)c1cccnc1Cl WXVL_AK00442SC0146 [0,1,0,0,0,0|1,0,0]=2 188 B11R1.222 CNC(=O)c1cccnc1F WXVL_AK00442SC0350 [0,1,0,0,0,0|1,0,0]=2 189 B11R1.222 CNC(=O)c1cccnc1F WXVL_AK00442SC0350 [0,1,0,0,0,0|1,0,0]=2 190 B11R1.222 CNC(=O)c1cccnc1O WXVL_AK00442SC0063 [0,1,0,0,0,0|1,0,0]=2 191 B11R1.222 CNC(=O)c1cccnc1O WXVL_AK00442SC0063 [0,1,0,0,0,0|1,0,0]=2 192 B11R1.222 CNC(=O)c1ccncc1Br WXVL_AK00442SC0365 [0,1,0,0,0,0|3,0,0]=4 193 B11R1.222 CNC(=O)c1ccncc1Br WXVL_AK00442SC0365 [0,1,0,0,0,0|3,0,0]=4 194 B11R1.222 CNC(=O)c1ccncc1Cl WXVL_AK00442SC0375 [0,1,0,0,0,0|3,0,0]=4 195 B11R1.222 CNC(=O)c1ccncc1Cl WXVL_AK00442SC0375 [0,1,0,0,0,0|3,0,0]=4 196 B11R1.222 CNC(=O)c1ccncc1F WXVL_AK00442SC0320 [0,1,0,0,0,0|3,0,0]=4 197 B11R1.222 CNC(=O)c1ccncc1F WXVL_AK00442SC0320 [0,1,0,0,0,0|3,0,0]=4 198 B11R1.222 CNC(=O)c1ccncc1O WXVL_AK00442SC0354 [0,1,0,0,0,0|3,0,0]=4 199 B11R1.222 CNC(=O)c1ccncc1O WXVL_AK00442SC0354 [0,1,0,0,0,0|3,0,0]=4 200 B11R1.222 CNC(=O)c1ccnnc1O WXVL_AK00442SC0899 [0,1,0,0,0,0|2,0,0]=3 201 B11R1.222 CNC(=O)c1ccnnc1O WXVL_AK00442SC0899 [0,1,0,0,0,0|2,0,0]=3 202 B11R1.222 CNC(=O)c1cnccc1Br WXVL_AK00442SC0500 [0,1,0,0,0,0|1,0,0]=2 203 B11R1.222 CNC(=O)c1cnccc1Br WXVL_AK00442SC0500 [0,1,0,0,0,0|1,0,0]=2 204 B11R1.222 CNC(=O)c1cnccc1C WXVL_AK00442SC0301 [0,1,0,0,0,0|1,0,0]=2 205 B11R1.222 CNC(=O)c1cnccc1C WXVL_AK00442SC0301 [0,1,0,0,0,0|1,0,0]=2 206 B11R1.222 CNC(=O)c1cnccc1Cl WXVL_AK00442SC0340 [0,1,0,0,0,0|1,0,0]=2 207 B11R1.222 CNC(=O)c1cnccc1Cl WXVL_AK00442SC0340 [0,1,0,0,0,0|1,0,0]=2 208 B11R1.222 CNC(=O)c1cncnc1C WXVL_AK00442SC0515 [0,1,0,0,0,0|2,0,0]=3 209 B11R1.222 CNC(=O)c1cncnc1C WXVL_AK00442SC0515 [0,1,0,0,0,0|2,0,0]=3 210 B11R1.222 CNC(=O)c1cnncc1C WXVL_AK00442SC0973 [0,1,0,0,0,0|2,0,0]=3 211 B11R1.222 CNC(=O)c1cnncc1C WXVL_AK00442SC0973 [0,1,0,0,0,0|2,0,0]=3 212 B11R1.222 CNC(=O)c1ncccc1Br WXVL_AK00442SC0501 [0,1,0,0,0,0|3,0,0]=4 213 B11R1.222 CNC(=O)c1ncccc1Br WXVL_AK00442SC0501 [0,1,0,0,0,0|3,0,0]=4 214 B11R1.222 CNC(=O)c1ncccc1C WXVL_AK00442SC0008 [0,1,0,0,0,0|3,0,0]=4 215 B11R1.222 CNC(=O)c1ncccc1C WXVL_AK00442SC0008 [0,1,0,0,0,0|3,0,0]=4 216 B11R1.222 CNC(=O)c1ncccc1Cl WXVL_AK00442SC0609 [0,1,0,0,0,0|3,0,0]=4 217 B11R1.222 CNC(=O)c1ncccc1Cl WXVL_AK00442SC0609 [0,1,0,0,0,0|3,0,0]=4 218 B11R1.222 CNC(=O)c1ncccc1F WXVL_AK00442SC0773 [0,1,0,0,0,0|3,0,0]=4 219 B11R1.222 CNC(=O)c1ncccc1F WXVL_AK00442SC0773 [0,1,0,0,0,0|3,0,0]=4 220 B11R1.222 CNC(=O)c1nccnc1Br WXVL_AK00442SC0785 [0,1,0,0,0,0|2,0,0]=3 221 B11R1.222 CNC(=O)c1nccnc1Br WXVL_AK00442SC0785 [0,1,0,0,0,0|2,0,0]=3 222 B11R1.222 CNC(=O)c1nccnc1Cl WXVL_AK00442SC0361 [0,1,0,0,0,0|2,0,0]=3 223 B11R1.222 CNC(=O)c1nccnc1Cl WXVL_AK00442SC0361 [0,1,0,0,0,0|2,0,0]=3 224 B9R1.11 CNC(=O)c1c[nH]cn1 WXVL_AK00442SC0074 [0,0,0,0,1,0|2,0,0]=3 225 B9R1.11 CNC(=O)c1c[nH]cn1 WXVL_AK00442SC0074 [0,0,0,0,1,0|2,0,0]=3 226 B9R1.11 CNC(=O)c1cc[nH]c1 WXVL_AK00442SC0013 [0,0,0,0,1,0|1,0,1]=3 227 B9R1.11 CNC(=O)c1cc[nH]c1 WXVL_AK00442SC0013 [0,0,0,0,1,0|1,0,1]=3 228 B9R1.11 CNC(=O)c1cc[nH]n1 WXVL_AK00442SC0003 [0,0,0,0,1,0|2,0,0]=3 229 B9R1.11 CNC(=O)c1cc[nH]n1 WXVL_AK00442SC0003 [0,0,0,0,1,0|2,0,0]=3 230 B9R1.11 CNC(=O)c1ccco1 WXVL_AK00442SC0049 [0,0,0,0,1,0|2,0,0]=3 231 B9R1.11 CNC(=O)c1ccco1 WXVL_AK00442SC0049 [0,0,0,0,1,0|2,0,0]=3 232 B9R1.11 CNC(=O)c1cccs1 WXVL_AK00442SC0051 [0,0,0,0,1,0|2,0,0]=3 233 B9R1.11 CNC(=O)c1cccs1 WXVL_AK00442SC0051 [0,0,0,0,1,0|2,0,0]=3 234 B9R1.11 CNC(=O)c1ccno1 WXVL_AK00442SC0080 [0,0,0,0,1,0|2,0,0]=3 235 B9R1.11 CNC(=O)c1ccno1 WXVL_AK00442SC0080 [0,0,0,0,1,0|2,0,0]=3 236 B9R1.11 CNC(=O)c1ccns1 WXVL_AK00442SC0027 [0,0,0,0,1,0|2,0,0]=3 237 B9R1.11 CNC(=O)c1ccns1 WXVL_AK00442SC0027 [0,0,0,0,1,0|2,0,0]=3 238 B9R1.11 CNC(=O)c1ccoc1 WXVL_AK00442SC0050 [0,0,0,0,1,0|2,0,0]=3 239 B9R1.11 CNC(=O)c1ccoc1 WXVL_AK00442SC0050 [0,0,0,0,1,0|2,0,0]=3 240 B9R1.11 CNC(=O)c1ccon1 WXVL_AK00442SC0116 [0,0,0,0,1,0|2,0,0]=3 241 B9R1.11 CNC(=O)c1ccon1 WXVL_AK00442SC0116 [0,0,0,0,1,0|2,0,0]=3 242 B9R1.11 CNC(=O)c1ccsc1 WXVL_AK00442SC0054 [0,0,0,0,1,0|2,0,0]=3 243 B9R1.11 CNC(=O)c1ccsc1 WXVL_AK00442SC0054 [0,0,0,0,1,0|2,0,0]=3 244 B9R1.11 CNC(=O)c1ccsn1 WXVL_AK00442SC0764 [0,0,0,0,1,0|2,0,0]=3 245 B9R1.11 CNC(=O)c1ccsn1 WXVL_AK00442SC0764 [0,0,0,0,1,0|2,0,0]=3 246 B9R1.11 CNC(=O)c1cn[nH]c1 WXVL_AK00442SC0254 [0,0,0,0,1,0|2,0,0]=3 247 B9R1.11 CNC(=O)c1cn[nH]c1 WXVL_AK00442SC0254 [0,0,0,0,1,0|2,0,0]=3 248 B9R1.11 CNC(=O)c1cnc[nH]1 WXVL_AK00442SC0247 [0,0,0,0,1,0|2,0,0]=3 249 B9R1.11 CNC(=O)c1cnc[nH]1 WXVL_AK00442SC0247 [0,0,0,0,1,0|2,0,0]=3 250 B9R1.11 CNC(=O)c1cnco1 WXVL_AK00442SC0018 [0,0,0,0,1,0|2,0,0]=3 251 B9R1.11 CNC(=O)c1cnco1 WXVL_AK00442SC0018 [0,0,0,0,1,0|2,0,0]=3 252 B9R1.11 CNC(=O)c1cncs1 WXVL_AK00442SC0113 [0,0,0,0,1,0|2,0,0]=3 253 B9R1.11 CNC(=O)c1cncs1 WXVL_AK00442SC0113 [0,0,0,0,1,0|2,0,0]=3 254 B9R1.11 CNC(=O)c1cnon1 WXVL_AK00442SC0777 [0,0,0,0,1,0|3,0,0]=4 255 B9R1.11 CNC(=O)c1cnon1 WXVL_AK00442SC0777 [0,0,0,0,1,0|3,0,0]=4 256 B9R1.11 CNC(=O)c1cnsn1 WXVL_AK00442SC1291 [0,0,0,0,1,0|3,0,0]=4 257 B9R1.11 CNC(=O)c1cnsn1 WXVL_AK00442SC1291 [0,0,0,0,1,0|3,0,0]=4 258 B9R1.11 CNC(=O)c1cocn1 WXVL_AK00442SC0118 [0,0,0,0,1,0|2,0,0]=3 259 B9R1.11 CNC(=O)c1cocn1 WXVL_AK00442SC0118 [0,0,0,0,1,0|2,0,0]=3 260 B9R1.11 CNC(=O)c1cscn1 WXVL_AK00442SC0092 [0,0,0,0,1,0|2,0,0]=3 261 B9R1.11 CNC(=O)c1cscn1 WXVL_AK00442SC0092 [0,0,0,0,1,0|2,0,0]=3 262 B9R1.11 CNC(=O)c1csnn1 WXVL_AK00442SC0002 [0,0,0,0,1,0|3,0,0]=4 263 B9R1.11 CNC(=O)c1csnn1 WXVL_AK00442SC0002 [0,0,0,0,1,0|3,0,0]=4 264 B9R1.11 CNC(=O)c1nc[nH]n1 WXVL_AK00442SC0376 [0,0,0,0,1,0|3,0,0]=4 265 B9R1.11 CNC(=O)c1nc[nH]n1 WXVL_AK00442SC0376 [0,0,0,0,1,0|3,0,0]=4 266 B9R1.11 CNC(=O)c1nccs1 WXVL_AK00442SC0110 [0,0,0,0,1,0|2,0,0]=3 267 B9R1.11 CNC(=O)c1nccs1 WXVL_AK00442SC0110 [0,0,0,0,1,0|2,0,0]=3 268 B9R1.11 CNC(=O)c1nnc[nH]1 WXVL_AK00442SC00053 [0,0,0,0,1,0|3,0,0]=4 269 B9R1.11 CNC(=O)c1nnc[nH]1 WXVL_AK00442SC00053 [0,0,0,0,1,0|3,0,0]=4 270 B11R1.40 C#CC(=O)Nc1ccccc1 WXVL_AG00183SB0338 [0,0,0,0,0,1|2,0,1]=4 271 B11R1.40 C#CC(=O)Nc1ccccc1 WXVL_AG00183SB0338 [0,0,0,0,0,1|2,0,1]=4 272 B11R1.40 C#CC(=O)Nc1cccnn1 WXVL_AF0151SB0338 [0,0,0,0,0,1|2,0,1]=4 273 B11R1.40 C#CC(=O)Nc1cccnn1 WXVL_AF0151SB0338 [0,0,0,0,0,1|2,0,1]=4 274 B11R1.40 C#CC(=O)Nc1ccnnc1 WXVL_AF0624SB0338 [0,0,0,0,0,1|2,0,1]=4 275 B11R1.40 C#CC(=O)Nc1ccnnc1 WXVL_AF0624SB0338 [0,0,0,0,0,1|2,0,1]=4 276 B11R1.40 C#CC(=O)Nc1cnccn1 WXVL_AF0120SB0338 [0,0,0,0,0,1|2,0,1]=4 277 B11R1.40 C#CC(=O)Nc1cnccn1 WXVL_AF0120SB0338 [0,0,0,0,0,1|2,0,1]=4 278 B11R1.40 C#CC(=O)Nc1cncnc1 WXVL_AF0085SB0338 [0,0,0,0,0,1|2,0,1]=4 279 B11R1.40 C#CC(=O)Nc1cncnc1 WXVL_AF0085SB0338 [0,0,0,0,0,1|2,0,1]=4 280 B11R1.40 CCC(=O)Nc1ccccc1 WXVL_AG00183SB0064 [0,0,0,0,0,1|2,0,0]=3 281 B11R1.40 CCC(=O)Nc1ccccc1 WXVL_AG00183SB0064 [0,0,0,0,0,1|2,0,0]=3 282 B11R1.40 CCC(=O)Nc1ccccn1 WXVL_AF00298SB0064 [0,0,0,0,0,1|3,0,0]=4 283 B11R1.40 CCC(=O)Nc1ccccn1 WXVL_AF00298SB0064 [0,0,0,0,0,1|3,0,0]=4 284 B11R1.40 CCC(=O)Nc1cccnn1 WXVL_AF0151SB0064 [0,0,0,0,0,1|2,0,0]=3 285 B11R1.40 CCC(=O)Nc1cccnn1 WXVL_AF0151SB0064 [0,0,0,0,0,1|2,0,0]=3 286 B11R1.40 CCC(=O)Nc1ccnnc1 WXVL_AF0624SB0064 [0,0,0,0,0,1|2,0,0]=3 287 B11R1.40 CCC(=O)Nc1ccnnc1 WXVL_AF0624SB0064 [0,0,0,0,0,1|2,0,0]=3 288 B11R1.40 CCC(=O)Nc1cnccn1 WXVL_AF0120SB0064 [0,0,0,0,0,1|2,0,0]=3 289 B11R1.40 CCC(=O)Nc1cnccn1 WXVL_AF0120SB0064 [0,0,0,0,0,1|2,0,0]=3 290 B11R1.40 CCC(=O)Nc1cncnc1 WXVL_AF0085SB0064 [0,0,0,0,0,1|2,0,0]=3 291 B11R1.40 CCC(=O)Nc1cncnc1 WXVL_AF0085SB0064 [0,0,0,0,0,1|2,0,0]=3 292 B11R1.40 CNC(=O)Cc1ccccc1 WXVL_AK00442SB0092 [0,0,0,0,0,1|2,0,0]=3 293 B11R1.40 CNC(=O)Cc1ccccc1 WXVL_AK00442SB0092 [0,0,0,0,0,1|2,0,0]=3 294 B11R1.40 CNC(=O)Cc1ccccn1 WXVL_AK00442SA0032 [0,0,0,0,0,1|3,0,0]=4 295 B11R1.40 CNC(=O)Cc1ccccn1 WXVL_AK00442SA0032 [0,0,0,0,0,1|3,0,0]=4 296 B11R1.40 CNC(=O)Cc1cccnc1 WXVL_AK00442SA0029 [0,0,0,0,0,1|1,0,0]=2 297 B11R1.40 CNC(=O)Cc1cccnc1 WXVL_AK00442SA0029 [0,0,0,0,0,1|1,0,0]=2 298 B11R1.40 CNC(=O)Cc1cccnc1 WXVL_AK00442SB00049 [0,0,0,0,0,1|1,0,0]=2 299 B11R1.40 CNC(=O)Cc1cccnc1 WXVL_AK00442SB00049 [0,0,0,0,0,1|1,0,0]=2 300 B11R1.40 CNC(=O)Cc1ccncc1 WXVL_AK00442SA00106 [0,0,0,0,0,1|3,0,0]=4 301 B11R1.40 CNC(=O)Cc1ccncc1 WXVL_AK00442SA00106 [0,0,0,0,0,1|3,0,0]=4 302 B11R1.40 CNC(=O)Cc1cncnc1 WXVL_AK00442SA0242 [0,0,0,0,0,1|2,0,0]=3 303 B11R1.40 CNC(=O)Cc1cncnc1 WXVL_AK00442SA0242 [0,0,0,0,0,1|2,0,0]=3 304 B11R1.40 CNC(=O)Nc1ccccn1 WXVL_AK00442YV0189 [0,0,0,0,0,1|3,0,0]=4 305 B11R1.40 CNC(=O)Nc1ccccn1 WXVL_AK00442YV0189 [0,0,0,0,0,1|3,0,0]=4 306 B11R1.40 O=C(CO)Nc1ccccc1 WXVL_AG00183SB2706 [0,0,0,0,0,1|3,0,0]=4 307 B11R1.40 O=C(CO)Nc1ccccc1 WXVL_AG00183SB2706 [0,0,0,0,0,1|3,0,0]=4 308 B11R1.40 O=C(CO)Nc1cccnn1 WXVL_AF0151SB2706 [0,0,0,0,0,1|3,0,0]=4 309 B11R1.40 O=C(CO)Nc1cccnn1 WXVL_AF0151SB2706 [0,0,0,0,0,1|3,0,0]=4 310 B11R1.40 O=C(CO)Nc1ccnnc1 WXVL_AF0624SB2706 [0,0,0,0,0,1|3,0,0]=4 311 B11R1.40 O=C(CO)Nc1ccnnc1 WXVL_AF0624SB2706 [0,0,0,0,0,1|3,0,0]=4 312 B11R1.40 O=C(CO)Nc1cnccn1 WXVL_AF0120SB2706 [0,0,0,0,0,1|3,0,0]=4 313 B11R1.40 O=C(CO)Nc1cnccn1 WXVL_AF0120SB2706 [0,0,0,0,0,1|3,0,0]=4 314 B11R1.40 O=C(CO)Nc1cncnc1 WXVL_AF0085SB2706 [0,0,0,0,0,1|3,0,0]=4 315 B11R1.40 O=C(CO)Nc1cncnc1 WXVL_AF0085SB2706 [0,0,0,0,0,1|3,0,0]=4 316 B8R0.6 C/C=C/C=C/C(=O)NC WXVL_AK00442SB0348 [1,0,1,0,0,0|1,0,1]=4 317 B8R0.6 C/C=C/C=C/C(=O)NC WXVL_AK00442SB0348 [1,0,1,0,0,0|1,0,1]=4 318 B10R1.13 Cc1ccc(cc1)C(=O)N WXVL_AK0084SD0078 [1,1,0,0,0,0|2,0,0]=4 319 B10R1.13 Cc1ccc(cc1)C(=O)N WXVL_AK0084SD0078 [1,1,0,0,0,0|2,0,0]=4 320 B10R1.13 Cc1ccc(cn1)C(=O)N WXVL_AK0084SC0060 [1,1,0,0,0,0|1,0,0]=3 321 B10R1.13 Cc1ccc(cn1)C(=O)N WXVL_AK0084SC0060 [1,1,0,0,0,0|1,0,0]=3 322 B10R1.13 Cc1cnc(cn1)C(=O)N WXVL_AK0084SC0072 [1,1,0,0,0,0|2,0,0]=4 323 B10R1.13 Cc1cnc(cn1)C(=O)N WXVL_AK0084SC0072 [1,1,0,0,0,0|2,0,0]=4 324 B10R1.13 Cc1ncc(cn1)C(=O)N WXVL_AK0084SC0032 [1,1,0,0,0,0|2,0,0]=4 325 B10R1.13 Cc1ncc(cn1)C(=O)N WXVL_AK0084SC0032 [1,1,0,0,0,0|2,0,0]=4 326 B10R1.13 NC(=O)c1ccc(=O)[nH]c1 WXVL_AK0084SC2212 [1,1,0,0,0,0|1,0,1]=4 327 B10R1.13 NC(=O)c1ccc(=O)[nH]c1 WXVL_AK0084SC2212 [1,1,0,0,0,0|1,0,1]=4 328 B10R1.13 NC(=O)c1ccc(=O)oc1 WXVL_AK0084SC0132 [1,1,0,0,0,0|2,0,0]=4 329 B10R1.13 NC(=O)c1ccc(=O)oc1 WXVL_AK0084SC0132 [1,1,0,0,0,0|2,0,0]=4 330 B10R1.13 NC(=O)c1ccc(cc1)Br WXVL_AK0084SD0060 [1,1,0,0,0,0|2,0,0]=4 331 B10R1.13 NC(=O)c1ccc(cc1)Br WXVL_AK0084SD0060 [1,1,0,0,0,0|2,0,0]=4 332 B10R1.13 NC(=O)c1ccc(cc1)Cl WXVL_AK0084SD0062 [1,1,0,0,0,0|2,0,0]=4 333 B10R1.13 NC(=O)c1ccc(cc1)Cl WXVL_AK0084SD0062 [1,1,0,0,0,0|2,0,0]=4 334 B10R1.13 NC(=O)c1ccc(cc1)F WXVL_AK0084SD0061 [1,1,0,0,0,0|2,0,0]=4 335 B10R1.13 NC(=O)c1ccc(cc1)F WXVL_AK0084SD0061 [1,1,0,0,0,0|2,0,0]=4 336 B10R1.13 NC(=O)c1ccc(cc1)I WXVL_AK0084SD0421 [1,1,0,0,0,0|2,0,0]=4 337 B10R1.13 NC(=O)c1ccc(cc1)I WXVL_AK0084SD0421 [1,1,0,0,0,0|2,0,0]=4 338 B10R1.13 NC(=O)c1ccc(cc1)O WXVL_AK0084SD0069 [1,1,0,0,0,0|2,0,0]=4 339 B10R1.13 NC(=O)c1ccc(cc1)O WXVL_AK0084SD0069 [1,1,0,0,0,0|2,0,0]=4 340 B10R1.13 NC(=O)c1ccc(cc1)S WXVL_AK0084SD0154 [1,1,0,0,0,0|2,0,0]=4 341 B10R1.13 NC(=O)c1ccc(cc1)S WXVL_AK0084SD0154 [1,1,0,0,0,0|2,0,0]=4 342 B10R1.13 NC(=O)c1ccc(nc1)Br WXVL_AK0084SC0352 [1,1,0,0,0,0|1,0,0]=3 343 B10R1.13 NC(=O)c1ccc(nc1)Br WXVL_AK0084SC0352 [1,1,0,0,0,0|1,0,0]=3 344 B10R1.13 NC(=O)c1ccc(nc1)Cl WXVL_AK0084SC0147 [1,1,0,0,0,0|1,0,0]=3 345 B10R1.13 NC(=O)c1ccc(nc1)Cl WXVL_AK0084SC0147 [1,1,0,0,0,0|1,0,0]=3 346 B10R1.13 NC(=O)c1ccc(nc1)F WXVL_AK0084SC0370 [1,1,0,0,0,0|1,0,0]=3 347 B10R1.13 NC(=O)c1ccc(nc1)F WXVL_AK0084SC0370 [1,1,0,0,0,0|1,0,0]=3 348 B10R1.13 NC(=O)c1ccc(nc1)O WXVL_AK0084SC0057 [1,1,0,0,0,0|1,0,0]=3 349 B10R1.13 NC(=O)c1ccc(nc1)O WXVL_AK0084SC0057 [1,1,0,0,0,0|1,0,0]=3 350 B10R1.13 NC(=O)c1cnc(cn1)Cl WXVL_AK0084SC0383 [1,1,0,0,0,0|2,0,0]=4 351 B10R1.13 NC(=O)c1cnc(cn1)Cl WXVL_AK0084SC0383 [1,1,0,0,0,0|2,0,0]=4 352 B10R1.13 NC(=O)c1cnc(nc1)Cl WXVL_AK0084SC0148 [1,1,0,0,0,0|2,0,0]=4 353 B10R1.13 NC(=O)c1cnc(nc1)Cl WXVL_AK0084SC0148 [1,1,0,0,0,0|2,0,0]=4 354 B10R1.28 NS(=O)(=O)c1cccnc1 WXVL_AK0084HU0127 [1,1,0,0,0,0|1,0,1]=4 355 B10R1.28 NS(=O)(=O)c1cccnc1 WXVL_AK0084HU0127 [1,1,0,0,0,0|1,0,1]=4 356 B10R1.61 Cc1ccccc1C(=O)N WXVL_AK0084SD0037 [1,1,0,0,0,0|2,0,0]=4 357 B10R1.61 Cc1ccccc1C(=O)N WXVL_AK0084SD0037 [1,1,0,0,0,0|2,0,0]=4 358 B10R1.61 Cc1ccncc1C(=O)N WXVL_AK0084SC0301 [1,1,0,0,0,0|1,0,0]=3 359 B10R1.61 Cc1ccncc1C(=O)N WXVL_AK0084SC0301 [1,1,0,0,0,0|1,0,0]=3 360 B10R1.61 Cc1cnncc1C(=O)N WXVL_AK0084SC0973 [1,1,0,0,0,0|2,0,0]=4 361 B10R1.61 Cc1cnncc1C(=O)N WXVL_AK0084SC0973 [1,1,0,0,0,0|2,0,0]=4 362 B10R1.61 Cc1ncccc1C(=O)N WXVL_AK0084SC0065 [1,1,0,0,0,0|1,0,0]=3 363 B10R1.61 Cc1ncccc1C(=O)N WXVL_AK0084SC0065 [1,1,0,0,0,0|1,0,0]=3 364 B10R1.61 Cc1ncncc1C(=O)N WXVL_AK0084SC0515 [1,1,0,0,0,0|2,0,0]=4 365 B10R1.61 Cc1ncncc1C(=O)N WXVL_AK0084SC0515 [1,1,0,0,0,0|2,0,0]=4 366 B10R1.61 NC(=O)c1ccccc1Br WXVL_AK0084SD0002 [1,1,0,0,0,0|2,0,0]=4 367 B10R1.61 NC(=O)c1ccccc1Br WXVL_AK0084SD0002 [1,1,0,0,0,0|2,0,0]=4 368 B10R1.61 NC(=O)c1ccccc1Cl WXVL_AK0084SD0006 [1,1,0,0,0,0|2,0,0]=4 369 B10R1.61 NC(=O)c1ccccc1Cl WXVL_AK0084SD0006 [1,1,0,0,0,0|2,0,0]=4 370 B10R1.61 NC(=O)c1ccccc1F WXVL_AK0084SD0003 [1,1,0,0,0,0|2,0,0]=4 371 B10R1.61 NC(=O)c1ccccc1F WXVL_AK0084SD0003 [1,1,0,0,0,0|2,0,0]=4 372 B10R1.61 NC(=O)c1ccccc1I WXVL_AK0084SD0303 [1,1,0,0,0,0|2,0,0]=4 373 B10R1.61 NC(=O)c1ccccc1I WXVL_AK0084SD0303 [1,1,0,0,0,0|2,0,0]=4 374 B10R1.61 NC(=O)c1ccccc1O WXVL_AK0084SD00056 [1,1,0,0,0,0|2,0,0]=4 375 B10R1.61 NC(=O)c1ccccc1O WXVL_AK0084SD00056 [1,1,0,0,0,0|2,0,0]=4 376 B10R1.61 NC(=O)c1ccccc1S WXVL_AK0084SD0153 [1,1,0,0,0,0|2,0,0]=4 377 B10R1.61 NC(=O)c1ccccc1S WXVL_AK0084SD0153 [1,1,0,0,0,0|2,0,0]=4 378 B10R1.61 NC(=O)c1cccnc1Br WXVL_AK0084SC0367 [1,1,0,0,0,0|1,0,0]=3 379 B10R1.61 NC(=O)c1cccnc1Br WXVL_AK0084SC0367 [1,1,0,0,0,0|1,0,0]=3 380 B10R1.61 NC(=O)c1cccnc1Cl WXVL_AK0084SC0146 [1,1,0,0,0,0|1,0,0]=3 381 B10R1.61 NC(=O)c1cccnc1Cl WXVL_AK0084SC0146 [1,1,0,0,0,0|1,0,0]=3 382 B10R1.61 NC(=O)c1cccnc1F WXVL_AK0084SC0350 [1,1,0,0,0,0|1,0,0]=3 383 B10R1.61 NC(=O)c1cccnc1F WXVL_AK0084SC0350 [1,1,0,0,0,0|1,0,0]=3 384 B10R1.61 NC(=O)c1cccnc1O WXVL_AK0084SC0063 [1,1,0,0,0,0|1,0,0]=3 385 B10R1.61 NC(=O)c1cccnc1O WXVL_AK0084SC0063 [1,1,0,0,0,0|1,0,0]=3 386 B10R1.61 NC(=O)c1ccnnc1O WXVL_AK0084SC0899 [1,1,0,0,0,0|2,0,0]=4 387 B10R1.61 NC(=O)c1ccnnc1O WXVL_AK0084SC0899 [1,1,0,0,0,0|2,0,0]=4 388 B10R1.61 NC(=O)c1cnccc1Br WXVL_AK0084SC0500 [1,1,0,0,0,0|1,0,0]=3 389 B10R1.61 NC(=O)c1cnccc1Br WXVL_AK0084SC0500 [1,1,0,0,0,0|1,0,0]=3 390 B10R1.61 NC(=O)c1cnccc1Cl WXVL_AK0084SC0340 [1,1,0,0,0,0|1,0,0]=3 391 B10R1.61 NC(=O)c1cnccc1Cl WXVL_AK0084SC0340 [1,1,0,0,0,0|1,0,0]=3 392 B10R1.61 NC(=O)c1nccnc1Br WXVL_AK0084SC0785 [1,1,0,0,0,0|2,0,0]=4 393 B10R1.61 NC(=O)c1nccnc1Br WXVL_AK0084SC0785 [1,1,0,0,0,0|2,0,0]=4 394 B10R1.61 NC(=O)c1nccnc1Cl WXVL_AK0084SC0361 [1,1,0,0,0,0|2,0,0]=4 395 B10R1.61 NC(=O)c1nccnc1Cl WXVL_AK0084SC0361 [1,1,0,0,0,0|2,0,0]=4 396 B10R1.113 Cc1cccc(c1)C(=O)N WXVL_AK0084SD0056 [1,1,0,0,0,0|2,0,0]=4 397 B10R1.113 Cc1cccc(c1)C(=O)N WXVL_AK0084SD0056 [1,1,0,0,0,0|2,0,0]=4 398 B10R1.113 Cc1cncc(c1)C(=O)N WXVL_AK0084SC0095 [1,1,0,0,0,0|1,0,0]=3 399 B10R1.113 Cc1cncc(c1)C(=O)N WXVL_AK0084SC0095 [1,1,0,0,0,0|1,0,0]=3 400 B10R1.113 Cc1cncc(n1)C(=O)N WXVL_AK0084SC0391 [1,1,0,0,0,0|2,0,0]=4 401 B10R1.113 Cc1cncc(n1)C(=O)N WXVL_AK0084SC0391 [1,1,0,0,0,0|2,0,0]=4 402 B10R1.113 NC(=O)c1ccc[n+](c1)[O-] WXVL_AK0084SC1039 [1,1,0,0,0,0|1,0,1]=4 403 B10R1.113 NC(=O)c1ccc[n+](c1)[O-] WXVL_AK0084SC1039 [1,1,0,0,0,0|1,0,1]=4 404 B10R1.113 NC(=O)c1cccc(c1)Br WXVL_AK0084SD0041 [1,1,0,0,0,0|2,0,0]=4 405 B10R1.113 NC(=O)c1cccc(c1)Br WXVL_AK0084SD0041 [1,1,0,0,0,0|2,0,0]=4 406 B10R1.113 NC(=O)c1cccc(c1)Cl WXVL_AK0084SD0045 [1,1,0,0,0,0|2,0,0]=4 407 B10R1.113 NC(=O)c1cccc(c1)Cl WXVL_AK0084SD0045 [1,1,0,0,0,0|2,0,0]=4 408 B10R1.113 NC(=O)c1cccc(c1)F WXVL_AK0084SD0043 [1,1,0,0,0,0|2,0,0]=4 409 B10R1.113 NC(=O)c1cccc(c1)F WXVL_AK0084SD0043 [1,1,0,0,0,0|2,0,0]=4 410 B10R1.113 NC(=O)c1cccc(c1)I WXVL_AK0084SD0405 [1,1,0,0,0,0|2,0,0]=4 411 B10R1.113 NC(=O)c1cccc(c1)I WXVL_AK0084SD0405 [1,1,0,0,0,0|2,0,0]=4 412 B10R1.113 NC(=O)c1cccc(c1)O WXVL_AK0084SD1724 [1,1,0,0,0,0|2,0,0]=4 413 B10R1.113 NC(=O)c1cccc(c1)O WXVL_AK0084SD1724 [1,1,0,0,0,0|2,0,0]=4 414 B10R1.113 NC(=O)c1cncc(c1)Br WXVL_AK0084SC0369 [1,1,0,0,0,0|1,0,0]=3 415 B10R1.113 NC(=O)c1cncc(c1)Br WXVL_AK0084SC0369 [1,1,0,0,0,0|1,0,0]=3 416 B10R1.113 NC(=O)c1cncc(c1)Cl WXVL_AK0084SC0291 [1,1,0,0,0,0|1,0,0]=3 417 B10R1.113 NC(=O)c1cncc(c1)Cl WXVL_AK0084SC0291 [1,1,0,0,0,0|1,0,0]=3 418 B10R1.113 NC(=O)c1cncc(c1)F WXVL_AK0084SC0102 [1,1,0,0,0,0|1,0,0]=3 419 B10R1.113 NC(=O)c1cncc(c1)F WXVL_AK0084SC0102 [1,1,0,0,0,0|1,0,0]=3 420 B10R1.113 NC(=O)c1cncc(c1)O WXVL_AK0084SC0333 [1,1,0,0,0,0|1,0,0]=3 421 B10R1.113 NC(=O)c1cncc(c1)O WXVL_AK0084SC0333 [1,1,0,0,0,0|1,0,0]=3 422 B10R1.113 NC(=O)c1cnnc(c1)Cl WXVL_AK0084SC0966 [1,1,0,0,0,0|2,0,0]=4 423 B10R1.113 NC(=O)c1cnnc(c1)Cl WXVL_AK0084SC0966 [1,1,0,0,0,0|2,0,0]=4 424 B10R1.113 NC(=O)c1cnnc(c1)O WXVL_AK0084SC0795 [1,1,0,0,0,0|2,0,0]=4 425 B10R1.113 NC(=O)c1cnnc(c1)O WXVL_AK0084SC0795 [1,1,0,0,0,0|2,0,0]=4 426 B10R1.11 CCNC(=O)c1c[nH]cn1 WXVL_AK00476SC0074 [0,1,0,0,1,0|2,0,0]=4 427 B10R1.11 CCNC(=O)c1c[nH]cn1 WXVL_AK00476SC0074 [0,1,0,0,1,0|2,0,0]=4 428 B10R1.11 CCNC(=O)c1cc[nH]c1 WXVL_AK00476SC0013 [0,1,0,0,1,0|1,0,1]=4 429 B10R1.11 CCNC(=O)c1cc[nH]c1 WXVL_AK00476SC0013 [0,1,0,0,1,0|1,0,1]=4 430 B10R1.11 CCNC(=O)c1cc[nH]n1 WXVL_AK00476SC0003 [0,1,0,0,1,0|2,0,0]=4 431 B10R1.11 CCNC(=O)c1cc[nH]n1 WXVL_AK00476SC0003 [0,1,0,0,1,0|2,0,0]=4 432 B10R1.11 CCNC(=O)c1ccco1 WXVL_AK00476SC0049 [0,1,0,0,1,0|2,0,0]=4 433 B10R1.11 CCNC(=O)c1ccco1 WXVL_AK00476SC0049 [0,1,0,0,1,0|2,0,0]=4 434 B10R1.11 CCNC(=O)c1cccs1 WXVL_AK00476SC0051 [0,1,0,0,1,0|2,0,0]=4 435 B10R1.11 CCNC(=O)c1cccs1 WXVL_AK00476SC0051 [0,1,0,0,1,0|2,0,0]=4 436 B10R1.11 CCNC(=O)c1ccno1 WXVL_AK00476SC0080 [0,1,0,0,1,0|2,0,0]=4 437 B10R1.11 CCNC(=O)c1ccno1 WXVL_AK00476SC0080 [0,1,0,0,1,0|2,0,0]=4 438 B10R1.11 CCNC(=O)c1ccns1 WXVL_AK00476SC0027 [0,1,0,0,1,0|2,0,0]=4 439 B10R1.11 CCNC(=O)c1ccns1 WXVL_AK00476SC0027 [0,1,0,0,1,0|2,0,0]=4 440 B10R1.11 CCNC(=O)c1ccoc1 WXVL_AK00476SC0050 [0,1,0,0,1,0|2,0,0]=4 441 B10R1.11 CCNC(=O)c1ccoc1 WXVL_AK00476SC0050 [0,1,0,0,1,0|2,0,0]=4 442 B10R1.11 CCNC(=O)c1ccon1 WXVL_AK00476SC0116 [0,1,0,0,1,0|2,0,0]=4 443 B10R1.11 CCNC(=O)c1ccon1 WXVL_AK00476SC0116 [0,1,0,0,1,0|2,0,0]=4 444 B10R1.11 CCNC(=O)c1ccsc1 WXVL_AK00476SC0054 [0,1,0,0,1,0|2,0,0]=4 445 B10R1.11 CCNC(=O)c1ccsc1 WXVL_AK00476SC0054 [0,1,0,0,1,0|2,0,0]=4 446 B10R1.11 CCNC(=O)c1ccsn1 WXVL_AK00476SC0764 [0,1,0,0,1,0|2,0,0]=4 447 B10R1.11 CCNC(=O)c1ccsn1 WXVL_AK00476SC0764 [0,1,0,0,1,0|2,0,0]=4 448 B10R1.11 CCNC(=O)c1cn[nH]c1 WXVL_AK00476SC0254 [0,1,0,0,1,0|2,0,0]=4 449 B10R1.11 CCNC(=O)c1cn[nH]c1 WXVL_AK00476SC0254 [0,1,0,0,1,0|2,0,0]=4 450 B10R1.11 CCNC(=O)c1cnc[nH]1 WXVL_AK00476SC0247 [0,1,0,0,1,0|2,0,0]=4 451 B10R1.11 CCNC(=O)c1cnc[nH]1 WXVL_AK00476SC0247 [0,1,0,0,1,0|2,0,0]=4 452 B10R1.11 CCNC(=O)c1cnco1 WXVL_AK00476SC0018 [0,1,0,0,1,0|2,0,0]=4 453 B10R1.11 CCNC(=O)c1cnco1 WXVL_AK00476SC0018 [0,1,0,0,1,0|2,0,0]=4 454 B10R1.11 CCNC(=O)c1cncs1 WXVL_AK00476SC0113 [0,1,0,0,1,0|2,0,0]=4 455 B10R1.11 CCNC(=O)c1cncs1 WXVL_AK00476SC0113 [0,1,0,0,1,0|2,0,0]=4 456 B10R1.11 CCNC(=O)c1cocn1 WXVL_AK00476SC0118 [0,1,0,0,1,0|2,0,0]=4 457 B10R1.11 CCNC(=O)c1cocn1 WXVL_AK00476SC0118 [0,1,0,0,1,0|2,0,0]=4 458 B10R1.11 CCNC(=O)c1cscn1 WXVL_AK00476SC0092 [0,1,0,0,1,0|2,0,0]=4 459 B10R1.11 CCNC(=O)c1cscn1 WXVL_AK00476SC0092 [0,1,0,0,1,0|2,0,0]=4 460 B10R1.11 CCNC(=O)c1nccs1 WXVL_AK00476SC0110 [0,1,0,0,1,0|2,0,0]=4 461 B10R1.11 CCNC(=O)c1nccs1 WXVL_AK00476SC0110 [0,1,0,0,1,0|2,0,0]=4 462 B10R1.14 CNC(=O)c1c[nH]c(c1)C WXVL_AK00442SC0298 [0,1,0,0,1,0|1,0,1]=4 463 B10R1.14 CNC(=O)c1c[nH]c(c1)C WXVL_AK00442SC0298 [0,1,0,0,1,0|1,0,1]=4 464 B10R1.14 CNC(=O)c1c[nH]c(n1)C WXVL_AK00442SC0009 [0,1,0,0,1,0|2,0,0]=4 465 B10R1.14 CNC(=O)c1c[nH]c(n1)C WXVL_AK00442SC0009 [0,1,0,0,1,0|2,0,0]=4 466 B10R1.14 CNC(=O)c1cc([nH]n1)C WXVL_AK00442SC0267 [0,1,0,0,1,0|2,0,0]=4 467 B10R1.14 CNC(=O)c1cc([nH]n1)C WXVL_AK00442SC0267 [0,1,0,0,1,0|2,0,0]=4 468 B10R1.14 CNC(=O)c1cc(c[nH]1)Br WXVL_AK00442SC0644 [0,1,0,0,1,0|1,0,1]=4 469 B10R1.14 CNC(=O)c1cc(c[nH]1)Br WXVL_AK00442SC0644 [0,1,0,0,1,0|1,0,1]=4 470 B10R1.14 CNC(=O)c1cc(c[nH]1)C WXVL_AK00442SC0830 [0,1,0,0,1,0|1,0,1]=4 471 B10R1.14 CNC(=O)c1cc(c[nH]1)C WXVL_AK00442SC0830 [0,1,0,0,1,0|1,0,1]=4 472 B10R1.14 CNC(=O)c1cc(c[nH]1)F WXVL_AK00442SC0334 [0,1,0,0,1,0|1,0,1]=4 473 B10R1.14 CNC(=O)c1cc(c[nH]1)F WXVL_AK00442SC0334 [0,1,0,0,1,0|1,0,1]=4 474 B10R1.14 CNC(=O)c1cc(cs1)Br WXVL_AK00442SC0188 [0,1,0,0,1,0|2,0,0]=4 475 B10R1.14 CNC(=O)c1cc(cs1)Br WXVL_AK00442SC0188 [0,1,0,0,1,0|2,0,0]=4 476 B10R1.14 CNC(=O)c1cc(cs1)C WXVL_AK00442SC0004 [0,1,0,0,1,0|2,0,0]=4 477 B10R1.14 CNC(=O)c1cc(cs1)C WXVL_AK00442SC0004 [0,1,0,0,1,0|2,0,0]=4 478 B10R1.14 CNC(=O)c1cc(n[nH]1)C WXVL_AK00442SC2215 [0,1,0,0,1,0|2,0,0]=4 479 B10R1.14 CNC(=O)c1cc(n[nH]1)C WXVL_AK00442SC2215 [0,1,0,0,1,0|2,0,0]=4 480 B10R1.14 CNC(=O)c1cc(no1)C WXVL_AK00442SC0089 [0,1,0,0,1,0|2,0,0]=4 481 B10R1.14 CNC(=O)c1cc(no1)C WXVL_AK00442SC0089 [0,1,0,0,1,0|2,0,0]=4 482 B10R1.14 CNC(=O)c1cc(no1)O WXVL_AK00442SC0522 [0,1,0,0,1,0|2,0,0]=4 483 B10R1.14 CNC(=O)c1cc(no1)O WXVL_AK00442SC0522 [0,1,0,0,1,0|2,0,0]=4 484 B10R1.14 CNC(=O)c1cc(on1)C WXVL_AK00442SC0101 [0,1,0,0,1,0|2,0,0]=4 485 B10R1.14 CNC(=O)c1cc(on1)C WXVL_AK00442SC0101 [0,1,0,0,1,0|2,0,0]=4 486 B10R1.14 CNC(=O)c1ccc(o1)C WXVL_AK00442SC0005 [0,1,0,0,1,0|2,0,0]=4 487 B10R1.14 CNC(=O)c1ccc(o1)C WXVL_AK00442SC0005 [0,1,0,0,1,0|2,0,0]=4 488 B10R1.14 CNC(=O)c1ccc(o1)Cl WXVL_AK00442SC0926 [0,1,0,0,1,0|2,0,0]=4 489 B10R1.14 CNC(=O)c1ccc(o1)Cl WXVL_AK00442SC0926 [0,1,0,0,1,0|2,0,0]=4 490 B10R1.14 CNC(=O)c1ccc(s1)Br WXVL_AK00442SC0359 [0,1,0,0,1,0|2,0,0]=4 491 B10R1.14 CNC(=O)c1ccc(s1)Br WXVL_AK00442SC0359 [0,1,0,0,1,0|2,0,0]=4 492 B10R1.14 CNC(=O)c1ccc(s1)C WXVL_AK00442SC0053 [0,1,0,0,1,0|2,0,0]=4 493 B10R1.14 CNC(=O)c1ccc(s1)C WXVL_AK00442SC0053 [0,1,0,0,1,0|2,0,0]=4 494 B10R1.14 CNC(=O)c1ccc(s1)Cl WXVL_AK00442SC0067 [0,1,0,0,1,0|2,0,0]=4 495 B10R1.14 CNC(=O)c1ccc(s1)Cl WXVL_AK00442SC0067 [0,1,0,0,1,0|2,0,0]=4 496 B10R1.14 CNC(=O)c1ccn(c1)C WXVL_AK00442SC0038 [0,1,0,0,1,0|1,0,1]=4 497 B10R1.14 CNC(=O)c1ccn(c1)C WXVL_AK00442SC0038 [0,1,0,0,1,0|1,0,1]=4 498 B10R1.14 CNC(=O)c1ccn(n1)C WXVL_AK00442SC0091 [0,1,0,0,1,0|2,0,0]=4 499 B10R1.14 CNC(=O)c1ccn(n1)C WXVL_AK00442SC0091 [0,1,0,0,1,0|2,0,0]=4 500 B10R1.14 CNC(=O)c1cn(cn1)C WXVL_AK00442SC0111 [0,1,0,0,1,0|2,0,0]=4 501 B10R1.14 CNC(=O)c1cn(cn1)C WXVL_AK00442SC0111 [0,1,0,0,1,0|2,0,0]=4 502 B10R1.14 CNC(=O)c1cnc([nH]1)O WXVL_AK00442SC0498 [0,1,0,0,1,0|2,0,0]=4 503 B10R1.14 CNC(=O)c1cnc([nH]1)O WXVL_AK00442SC0498 [0,1,0,0,1,0|2,0,0]=4 504 B10R1.14 CNC(=O)c1cnc(o1)Br WXVL_AK00442SC0815 [0,1,0,0,1,0|2,0,0]=4 505 B10R1.14 CNC(=O)c1cnc(o1)Br WXVL_AK00442SC0815 [0,1,0,0,1,0|2,0,0]=4 506 B10R1.14 CNC(=O)c1cnc(s1)Br WXVL_AK00442SC0723 [0,1,0,0,1,0|2,0,0]=4 507 B10R1.14 CNC(=O)c1cnc(s1)Br WXVL_AK00442SC0723 [0,1,0,0,1,0|2,0,0]=4 508 B10R1.14 CNC(=O)c1cnc(s1)C WXVL_AK00442SC0326 [0,1,0,0,1,0|2,0,0]=4 509 B10R1.14 CNC(=O)c1cnc(s1)C WXVL_AK00442SC0326 [0,1,0,0,1,0|2,0,0]=4 510 B10R1.14 CNC(=O)c1cnc(s1)Cl WXVL_AK00442SC0638 [0,1,0,0,1,0|2,0,0]=4 511 B10R1.14 CNC(=O)c1cnc(s1)Cl WXVL_AK00442SC0638 [0,1,0,0,1,0|2,0,0]=4 512 B10R1.14 CNC(=O)c1cnn(c1)C WXVL_AK00442SC0082 [0,1,0,0,1,0|2,0,0]=4 513 B10R1.14 CNC(=O)c1cnn(c1)C WXVL_AK00442SC0082 [0,1,0,0,1,0|2,0,0]=4 514 B10R1.14 CNC(=O)c1coc(n1)C WXVL_AK00442SC0086 [0,1,0,0,1,0|2,0,0]=4 515 B10R1.14 CNC(=O)c1coc(n1)C WXVL_AK00442SC0086 [0,1,0,0,1,0|2,0,0]=4 516 B10R1.14 CNC(=O)c1coc(n1)Cl WXVL_AK00442SC1341 [0,1,0,0,1,0|2,0,0]=4 517 B10R1.14 CNC(=O)c1coc(n1)Cl WXVL_AK00442SC1341 [0,1,0,0,1,0|2,0,0]=4 518 B10R1.14 CNC(=O)c1csc(c1)Br WXVL_AK00442SC0189 [0,1,0,0,1,0|2,0,0]=4 519 B10R1.14 CNC(=O)c1csc(c1)Br WXVL_AK00442SC0189 [0,1,0,0,1,0|2,0,0]=4 520 B10R1.14 CNC(=O)c1csc(n1)C WXVL_AK00442SC0112 [0,1,0,0,1,0|2,0,0]=4 521 B10R1.14 CNC(=O)c1csc(n1)C WXVL_AK00442SC0112 [0,1,0,0,1,0|2,0,0]=4 522 B10R1.14 CNC(=O)c1csc(n1)Cl WXVL_AK00442SC0688 [0,1,0,0,1,0|2,0,0]=4 523 B10R1.14 CNC(=O)c1csc(n1)Cl WXVL_AK00442SC0688 [0,1,0,0,1,0|2,0,0]=4 524 B10R1.14 CNC(=O)c1nc(cs1)Br WXVL_AK00442SC0687 [0,1,0,0,1,0|2,0,0]=4 525 B10R1.14 CNC(=O)c1nc(cs1)Br WXVL_AK00442SC0687 [0,1,0,0,1,0|2,0,0]=4 526 B10R1.14 CNC(=O)c1nc(cs1)C WXVL_AK00442SC0538 [0,1,0,0,1,0|2,0,0]=4 527 B10R1.14 CNC(=O)c1nc(cs1)C WXVL_AK00442SC0538 [0,1,0,0,1,0|2,0,0]=4 528 B10R1.14 CNC(=O)c1ncc(s1)C WXVL_AK00442SC0031 [0,1,0,0,1,0|2,0,0]=4 529 B10R1.14 CNC(=O)c1ncc(s1)C WXVL_AK00442SC0031 [0,1,0,0,1,0|2,0,0]=4 530 B10R1.23 CN(C)C(=O)c1c[nH]cn1 WXVL_AN0032SC0074 [0,1,0,0,1,0|2,0,0]=4 531 B10R1.23 CN(C)C(=O)c1c[nH]cn1 WXVL_AN0032SC0074 [0,1,0,0,1,0|2,0,0]=4 532 B10R1.23 CN(C)C(=O)c1cc[nH]c1 WXVL_AN0032SC0013 [0,1,0,0,1,0|1,0,1]=4 533 B10R1.23 CN(C)C(=O)c1cc[nH]c1 WXVL_AN0032SC0013 [0,1,0,0,1,0|1,0,1]=4 534 B10R1.23 CN(C)C(=O)c1cc[nH]n1 WXVL_AN0032SC0003 [0,1,0,0,1,0|2,0,0]=4 535 B10R1.23 CN(C)C(=O)c1cc[nH]n1 WXVL_AN0032SC0003 [0,1,0,0,1,0|2,0,0]=4 536 B10R1.23 CN(C)C(=O)c1ccco1 WXVL_AN0032SC0049 [0,1,0,0,1,0|2,0,0]=4 537 B10R1.23 CN(C)C(=O)c1ccco1 WXVL_AN0032SC0049 [0,1,0,0,1,0|2,0,0]=4 538 B10R1.23 CN(C)C(=O)c1cccs1 WXVL_AN0032SC0051 [0,1,0,0,1,0|2,0,0]=4 539 B10R1.23 CN(C)C(=O)c1cccs1 WXVL_AN0032SC0051 [0,1,0,0,1,0|2,0,0]=4 540 B10R1.23 CN(C)C(=O)c1ccno1 WXVL_AN0032SC0080 [0,1,0,0,1,0|2,0,0]=4 541 B10R1.23 CN(C)C(=O)c1ccno1 WXVL_AN0032SC0080 [0,1,0,0,1,0|2,0,0]=4 542 B10R1.23 CN(C)C(=O)c1ccns1 WXVL_AN0032SC0027 [0,1,0,0,1,0|2,0,0]=4 543 B10R1.23 CN(C)C(=O)c1ccns1 WXVL_AN0032SC0027 [0,1,0,0,1,0|2,0,0]=4 544 B10R1.23 CN(C)C(=O)c1ccoc1 WXVL_AN0032SC0050 [0,1,0,0,1,0|2,0,0]=4 545 B10R1.23 CN(C)C(=O)c1ccoc1 WXVL_AN0032SC0050 [0,1,0,0,1,0|2,0,0]=4 546 B10R1.23 CN(C)C(=O)c1ccon1 WXVL_AN0032SC0116 [0,1,0,0,1,0|2,0,0]=4 547 B10R1.23 CN(C)C(=O)c1ccon1 WXVL_AN0032SC0116 [0,1,0,0,1,0|2,0,0]=4 548 B10R1.23 CN(C)C(=O)c1ccsc1 WXVL_AN0032SC0054 [0,1,0,0,1,0|2,0,0]=4 549 B10R1.23 CN(C)C(=O)c1ccsc1 WXVL_AN0032SC0054 [0,1,0,0,1,0|2,0,0]=4 550 B10R1.23 CN(C)C(=O)c1ccsn1 WXVL_AN0032SC0764 [0,1,0,0,1,0|2,0,0]=4 551 B10R1.23 CN(C)C(=O)c1ccsn1 WXVL_AN0032SC0764 [0,1,0,0,1,0|2,0,0]=4 552 B10R1.23 CN(C)C(=O)c1cn[nH]c1 WXVL_AN0032SC0254 [0,1,0,0,1,0|2,0,0]=4 553 B10R1.23 CN(C)C(=O)c1cn[nH]c1 WXVL_AN0032SC0254 [0,1,0,0,1,0|2,0,0]=4 554 B10R1.23 CN(C)C(=O)c1cnc[nH]1 WXVL_AN0032SC0247 [0,1,0,0,1,0|2,0,0]=4 555 B10R1.23 CN(C)C(=O)c1cnc[nH]1 WXVL_AN0032SC0247 [0,1,0,0,1,0|2,0,0]=4 556 B10R1.23 CN(C)C(=O)c1cnco1 WXVL_AN0032SC0018 [0,1,0,0,1,0|2,0,0]=4 557 B10R1.23 CN(C)C(=O)c1cnco1 WXVL_AN0032SC0018 [0,1,0,0,1,0|2,0,0]=4 558 B10R1.23 CN(C)C(=O)c1cncs1 WXVL_AN0032SC0113 [0,1,0,0,1,0|2,0,0]=4 559 B10R1.23 CN(C)C(=O)c1cncs1 WXVL_AN0032SC0113 [0,1,0,0,1,0|2,0,0]=4 560 B10R1.23 CN(C)C(=O)c1cocn1 WXVL_AN0032SC0118 [0,1,0,0,1,0|2,0,0]=4 561 B10R1.23 CN(C)C(=O)c1cocn1 WXVL_AN0032SC0118 [0,1,0,0,1,0|2,0,0]=4 562 B10R1.23 CN(C)C(=O)c1cscn1 WXVL_AN0032SC0092 [0,1,0,0,1,0|2,0,0]=4 563 B10R1.23 CN(C)C(=O)c1cscn1 WXVL_AN0032SC0092 [0,1,0,0,1,0|2,0,0]=4 564 B10R1.23 CN(C)C(=O)c1nccs1 WXVL_AN0032SC0110 [0,1,0,0,1,0|2,0,0]=4 565 B10R1.23 CN(C)C(=O)c1nccs1 WXVL_AN0032SC0110 [0,1,0,0,1,0|2,0,0]=4 566 B10R1.149 CNC(=O)c1[nH]ccc1C WXVL_AK00442SC1315 [0,1,0,0,1,0|1,0,1]=4 567 B10R1.149 CNC(=O)c1[nH]ccc1C WXVL_AK00442SC1315 [0,1,0,0,1,0|1,0,1]=4 568 B10R1.149 CNC(=O)c1[nH]cnc1C WXVL_AK00442SC0269 [0,1,0,0,1,0|2,0,0]=4 569 B10R1.149 CNC(=O)c1[nH]cnc1C WXVL_AK00442SC0269 [0,1,0,0,1,0|2,0,0]=4 570 B10R1.149 CNC(=O)c1c[nH]cc1C WXVL_AK00442SC0251 [0,1,0,0,1,0|1,0,1]=4 571 B10R1.149 CNC(=O)c1c[nH]cc1C WXVL_AK00442SC0251 [0,1,0,0,1,0|1,0,1]=4 572 B10R1.149 CNC(=O)c1c[nH]nc1C WXVL_AK00442SC2225 [0,1,0,0,1,0|2,0,0]=4 573 B10R1.149 CNC(=O)c1c[nH]nc1C WXVL_AK00442SC2225 [0,1,0,0,1,0|2,0,0]=4 574 B10R1.149 CNC(=O)c1ccnn1C WXVL_AK00442SC0090 [0,1,0,0,1,0|2,0,0]=4 575 B10R1.149 CNC(=O)c1ccnn1C WXVL_AK00442SC0090 [0,1,0,0,1,0|2,0,0]=4 576 B10R1.149 CNC(=O)c1ccsc1C WXVL_AK00442SC1037 [0,1,0,0,1,0|2,0,0]=4 577 B10R1.149 CNC(=O)c1ccsc1C WXVL_AK00442SC1037 [0,1,0,0,1,0|2,0,0]=4 578 B10R1.149 CNC(=O)c1ccsc1Cl WXVL_AK00442SC0794 [0,1,0,0,1,0|2,0,0]=4 579 B10R1.149 CNC(=O)c1ccsc1Cl WXVL_AK00442SC0794 [0,1,0,0,1,0|2,0,0]=4 580 B10R1.149 CNC(=O)c1cncn1C WXVL_AK00442SC0099 [0,1,0,0,1,0|2,0,0]=4 581 B10R1.149 CNC(=O)c1cncn1C WXVL_AK00442SC0099 [0,1,0,0,1,0|2,0,0]=4 582 B10R1.149 CNC(=O)c1conc1C WXVL_AK00442SC0100 [0,1,0,0,1,0|2,0,0]=4 583 B10R1.149 CNC(=O)c1conc1C WXVL_AK00442SC0100 [0,1,0,0,1,0|2,0,0]=4 584 B10R1.149 CNC(=O)c1cscc1Br WXVL_AK00442SC1024 [0,1,0,0,1,0|2,0,0]=4 585 B10R1.149 CNC(=O)c1cscc1Br WXVL_AK00442SC1024 [0,1,0,0,1,0|2,0,0]=4 586 B10R1.149 CNC(=O)c1cscc1C WXVL_AK00442SC0257 [0,1,0,0,1,0|2,0,0]=4 587 B10R1.149 CNC(=O)c1cscc1C WXVL_AK00442SC0257 [0,1,0,0,1,0|2,0,0]=4 588 B10R1.149 CNC(=O)c1csnc1C WXVL_AK00442SC2175 [0,1,0,0,1,0|2,0,0]=4 589 B10R1.149 CNC(=O)c1csnc1C WXVL_AK00442SC2175 [0,1,0,0,1,0|2,0,0]=4 590 B10R1.149 CNC(=O)c1n[nH]cc1I WXVL_AK00442SC0442 [0,1,0,0,1,0|2,0,0]=4 591 B10R1.149 CNC(=O)c1n[nH]cc1I WXVL_AK00442SC0442 [0,1,0,0,1,0|2,0,0]=4 592 B10R1.149 CNC(=O)c1nccn1C WXVL_AK00442SC0106 [0,1,0,0,1,0|2,0,0]=4 593 B10R1.149 CNC(=O)c1nccn1C WXVL_AK00442SC0106 [0,1,0,0,1,0|2,0,0]=4 594 B10R1.149 CNC(=O)c1ncoc1C WXVL_AK00442SC0732 [0,1,0,0,1,0|2,0,0]=4 595 B10R1.149 CNC(=O)c1ncoc1C WXVL_AK00442SC0732 [0,1,0,0,1,0|2,0,0]=4 596 B10R1.149 CNC(=O)c1ncsc1Br WXVL_AK00442SC0192 [0,1,0,0,1,0|2,0,0]=4 597 B10R1.149 CNC(=O)c1ncsc1Br WXVL_AK00442SC0192 [0,1,0,0,1,0|2,0,0]=4 598 B10R1.149 CNC(=O)c1ncsc1C WXVL_AK00442SC0722 [0,1,0,0,1,0|2,0,0]=4 599 B10R1.149 CNC(=O)c1ncsc1C WXVL_AK00442SC0722 [0,1,0,0,1,0|2,0,0]=4 600 B10R1.149 CNC(=O)c1occc1Br WXVL_AK00442SC0241 [0,1,0,0,1,0|2,0,0]=4 601 B10R1.149 CNC(=O)c1occc1Br WXVL_AK00442SC0241 [0,1,0,0,1,0|2,0,0]=4 602 B10R1.149 CNC(=O)c1occc1C WXVL_AK00442SC0230 [0,1,0,0,1,0|2,0,0]=4 603 B10R1.149 CNC(=O)c1occc1C WXVL_AK00442SC0230 [0,1,0,0,1,0|2,0,0]=4 604 B10R1.149 CNC(=O)c1ocnc1C WXVL_AK00442SC0103 [0,1,0,0,1,0|2,0,0]=4 605 B10R1.149 CNC(=O)c1ocnc1C WXVL_AK00442SC0103 [0,1,0,0,1,0|2,0,0]=4 606 B10R1.149 CNC(=O)c1oncc1C WXVL_AK00442SC0912 [0,1,0,0,1,0|2,0,0]=4 607 B10R1.149 CNC(=O)c1oncc1C WXVL_AK00442SC0912 [0,1,0,0,1,0|2,0,0]=4 608 B10R1.149 CNC(=O)c1sccc1Br WXVL_AK00442SC0364 [0,1,0,0,1,0|2,0,0]=4 609 B10R1.149 CNC(=O)c1sccc1Br WXVL_AK00442SC0364 [0,1,0,0,1,0|2,0,0]=4 610 B10R1.149 CNC(=O)c1sccc1C WXVL_AK00442SC0052 [0,1,0,0,1,0|2,0,0]=4 611 B10R1.149 CNC(=O)c1sccc1C WXVL_AK00442SC0052 [0,1,0,0,1,0|2,0,0]=4 612 B10R1.149 CNC(=O)c1sccc1Cl WXVL_AK00442SC0756 [0,1,0,0,1,0|2,0,0]=4 613 B10R1.149 CNC(=O)c1sccc1Cl WXVL_AK00442SC0756 [0,1,0,0,1,0|2,0,0]=4 614 B10R1.149 CNC(=O)c1sccc1F WXVL_AK00442SC0017 [0,1,0,0,1,0|2,0,0]=4 615 B10R1.149 CNC(=O)c1sccc1F WXVL_AK00442SC0017 [0,1,0,0,1,0|2,0,0]=4 616 B10R1.149 CNC(=O)c1sccc1I WXVL_AK00442SC1579 [0,1,0,0,1,0|2,0,0]=4 617 B10R1.149 CNC(=O)c1sccc1I WXVL_AK00442SC1579 [0,1,0,0,1,0|2,0,0]=4 618 B10R1.149 CNC(=O)c1scnc1C WXVL_AK00442SC0093 [0,1,0,0,1,0|2,0,0]=4 619 B10R1.149 CNC(=O)c1scnc1C WXVL_AK00442SC0093 [0,1,0,0,1,0|2,0,0]=4 620 B12R1.32 C/C=C/C(=O)Nc1ccccc1 WXVL_AG00183SB0340 [0,1,0,0,0,1|2,0,0]=4 621 B12R1.32 C/C=C/C(=O)Nc1ccccc1 WXVL_AG00183SB0340 [0,1,0,0,0,1|2,0,0]=4 622 B12R1.32 C/C=C/C(=O)Nc1cccnn1 WXVL_AF0151SB0340 [0,1,0,0,0,1|2,0,0]=4 623 B12R1.32 C/C=C/C(=O)Nc1cccnn1 WXVL_AF0151SB0340 [0,1,0,0,0,1|2,0,0]=4 624 B12R1.32 C/C=C/C(=O)Nc1ccnnc1 WXVL_AF0624SB0340 [0,1,0,0,0,1|2,0,0]=4 625 B12R1.32 C/C=C/C(=O)Nc1ccnnc1 WXVL_AF0624SB0340 [0,1,0,0,0,1|2,0,0]=4 626 B12R1.32 C/C=C/C(=O)Nc1cnccn1 WXVL_AF0120SB0340 [0,1,0,0,0,1|2,0,0]=4 627 B12R1.32 C/C=C/C(=O)Nc1cnccn1 WXVL_AF0120SB0340 [0,1,0,0,0,1|2,0,0]=4 628 B12R1.32 C/C=C/C(=O)Nc1cncnc1 WXVL_AF0085SB0340 [0,1,0,0,0,1|2,0,0]=4 629 B12R1.32 C/C=C/C(=O)Nc1cncnc1 WXVL_AF0085SB0340 [0,1,0,0,0,1|2,0,0]=4 630 B12R1.32 CC#CC(=O)Nc1ccccc1 WXVL_AG00183SB1240 [0,1,0,0,0,1|2,0,0]=4 631 B12R1.32 CC#CC(=O)Nc1ccccc1 WXVL_AG00183SB1240 [0,1,0,0,0,1|2,0,0]=4 632 B12R1.32 CC#CC(=O)Nc1cccnn1 WXVL_AF0151SB1240 [0,1,0,0,0,1|2,0,0]=4 633 B12R1.32 CC#CC(=O)Nc1cccnn1 WXVL_AF0151SB1240 [0,1,0,0,0,1|2,0,0]=4 634 B12R1.32 CC#CC(=O)Nc1ccnnc1 WXVL_AF0624SB1240 [0,1,0,0,0,1|2,0,0]=4 635 B12R1.32 CC#CC(=O)Nc1ccnnc1 WXVL_AF0624SB1240 [0,1,0,0,0,1|2,0,0]=4 636 B12R1.32 CC#CC(=O)Nc1cnccn1 WXVL_AF0120SB1240 [0,1,0,0,0,1|2,0,0]=4 637 B12R1.32 CC#CC(=O)Nc1cnccn1 WXVL_AF0120SB1240 [0,1,0,0,0,1|2,0,0]=4 638 B12R1.32 CC#CC(=O)Nc1cncnc1 WXVL_AF0085SB1240 [0,1,0,0,0,1|2,0,0]=4 639 B12R1.32 CC#CC(=O)Nc1cncnc1 WXVL_AF0085SB1240 [0,1,0,0,0,1|2,0,0]=4 640 B12R1.32 CCCC(=O)Nc1ccccc1 WXVL_AG00183SB0073 [0,1,0,0,0,1|2,0,0]=4 641 B12R1.32 CCCC(=O)Nc1ccccc1 WXVL_AG00183SB0073 [0,1,0,0,0,1|2,0,0]=4 642 B12R1.32 CCCC(=O)Nc1cccnn1 WXVL_AF0151SB0073 [0,1,0,0,0,1|2,0,0]=4 643 B12R1.32 CCCC(=O)Nc1cccnn1 WXVL_AF0151SB0073 [0,1,0,0,0,1|2,0,0]=4 644 B12R1.32 CCCC(=O)Nc1ccnnc1 WXVL_AF0624SB0073 [0,1,0,0,0,1|2,0,0]=4 645 B12R1.32 CCCC(=O)Nc1ccnnc1 WXVL_AF0624SB0073 [0,1,0,0,0,1|2,0,0]=4 646 B12R1.32 CCCC(=O)Nc1cnccn1 WXVL_AF0120SB0073 [0,1,0,0,0,1|2,0,0]=4 647 B12R1.32 CCCC(=O)Nc1cnccn1 WXVL_AF0120SB0073 [0,1,0,0,0,1|2,0,0]=4 648 B12R1.32 CCCC(=O)Nc1cncnc1 WXVL_AF0085SB0073 [0,1,0,0,0,1|2,0,0]=4 649 B12R1.32 CCCC(=O)Nc1cncnc1 WXVL_AF0085SB0073 [0,1,0,0,0,1|2,0,0]=4 650 B12R1.32 CCNC(=O)Cc1ccccc1 WXVL_AK00476SB0092 [0,1,0,0,0,1|2,0,0]=4 651 B12R1.32 CCNC(=O)Cc1ccccc1 WXVL_AK00476SB0092 [0,1,0,0,0,1|2,0,0]=4 652 B12R1.32 CCNC(=O)Cc1cccnc1 WXVL_AK00476SA0029 [0,1,0,0,0,1|1,0,0]=3 653 B12R1.32 CCNC(=O)Cc1cccnc1 WXVL_AK00476SA0029 [0,1,0,0,0,1|1,0,0]=3 654 B12R1.32 CCNC(=O)Cc1cccnc1 WXVL_AK00476SB00049 [0,1,0,0,0,1|1,0,0]=3 655 B12R1.32 CCNC(=O)Cc1cccnc1 WXVL_AK00476SB00049 [0,1,0,0,0,1|1,0,0]=3 656 B12R1.32 CCNC(=O)Cc1cncnc1 WXVL_AK00476SA0242 [0,1,0,0,0,1|2,0,0]=4 657 B12R1.32 CCNC(=O)Cc1cncnc1 WXVL_AK00476SA0242 [0,1,0,0,0,1|2,0,0]=4 658 B12R1.32 COCC(=O)Nc1ccccc1 WXVL_AG00183SB0090 [0,1,0,0,0,1|1,0,0]=3 659 B12R1.32 COCC(=O)Nc1ccccc1 WXVL_AG00183SB0090 [0,1,0,0,0,1|1,0,0]=3 660 B12R1.32 COCC(=O)Nc1ccccn1 WXVL_AF00298SB0090 [0,1,0,0,0,1|2,0,0]=4 661 B12R1.32 COCC(=O)Nc1ccccn1 WXVL_AF00298SB0090 [0,1,0,0,0,1|2,0,0]=4 662 B12R1.32 COCC(=O)Nc1cccnn1 WXVL_AF0151SB0090 [0,1,0,0,0,1|1,0,0]=3 663 B12R1.32 COCC(=O)Nc1cccnn1 WXVL_AF0151SB0090 [0,1,0,0,0,1|1,0,0]=3 664 B12R1.32 COCC(=O)Nc1ccnnc1 WXVL_AF0624SB0090 [0,1,0,0,0,1|1,0,0]=3 665 B12R1.32 COCC(=O)Nc1ccnnc1 WXVL_AF0624SB0090 [0,1,0,0,0,1|1,0,0]=3 666 B12R1.32 COCC(=O)Nc1cnccn1 WXVL_AF0120SB0090 [0,1,0,0,0,1|1,0,0]=3 667 B12R1.32 COCC(=O)Nc1cnccn1 WXVL_AF0120SB0090 [0,1,0,0,0,1|1,0,0]=3 668 B12R1.32 COCC(=O)Nc1cncnc1 WXVL_AF0085SB0090 [0,1,0,0,0,1|1,0,0]=3 669 B12R1.32 COCC(=O)Nc1cncnc1 WXVL_AF0085SB0090 [0,1,0,0,0,1|1,0,0]=3 670 B12R1.32 CSCC(=O)Nc1ccccc1 WXVL_AG00183SB1267 [0,1,0,0,0,1|1,1,0]=4 671 B12R1.32 CSCC(=O)Nc1ccccc1 WXVL_AG00183SB1267 [0,1,0,0,0,1|1,1,0]=4 672 B12R1.32 CSCC(=O)Nc1cccnn1 WXVL_AF0151SB1267 [0,1,0,0,0,1|1,1,0]=4 673 B12R1.32 CSCC(=O)Nc1cccnn1 WXVL_AF0151SB1267 [0,1,0,0,0,1|1,1,0]=4 674 B12R1.32 CSCC(=O)Nc1ccnnc1 WXVL_AF0624SB1267 [0,1,0,0,0,1|1,1,0]=4 675 B12R1.32 CSCC(=O)Nc1ccnnc1 WXVL_AF0624SB1267 [0,1,0,0,0,1|1,1,0]=4 676 B12R1.32 CSCC(=O)Nc1cnccn1 WXVL_AF0120SB1267 [0,1,0,0,0,1|1,1,0]=4 677 B12R1.32 CSCC(=O)Nc1cnccn1 WXVL_AF0120SB1267 [0,1,0,0,0,1|1,1,0]=4 678 B12R1.32 CSCC(=O)Nc1cncnc1 WXVL_AF0085SB1267 [0,1,0,0,0,1|1,1,0]=4 679 B12R1.32 CSCC(=O)Nc1cncnc1 WXVL_AF0085SB1267 [0,1,0,0,0,1|1,1,0]=4 680 B12R1.34 CNC(=O)C(=O)c1ccccc1 WXVL_AK00442SB0050 [0,1,0,0,0,1|2,0,0]=4 681 B12R1.34 CNC(=O)C(=O)c1ccccc1 WXVL_AK00442SB0050 [0,1,0,0,0,1|2,0,0]=4 682 B12R1.34 CNC(=O)C(C)c1ccccc1 WXVL_AK00442SB2326 [0,1,0,0,0,1|2,0,0]=4 683 B12R1.34 CNC(=O)C(C)c1ccccc1 WXVL_AK00442SB2326 [0,1,0,0,0,1|2,0,0]=4 684 B12R1.34 CNC(=O)C(O)c1ccccc1 WXVL_AK00442SB0168 [0,1,0,0,0,1|2,0,0]=4 685 B12R1.34 CNC(=O)C(O)c1ccccc1 WXVL_AK00442SB0168 [0,1,0,0,0,1|2,0,0]=4 686 B12R1.43 CC(=O)C(=O)Nc1ccccc1 WXVL_AG00183SB0051 [0,1,0,0,0,1|2,0,0]=4 687 B12R1.43 CC(=O)C(=O)Nc1ccccc1 WXVL_AG00183SB0051 [0,1,0,0,0,1|2,0,0]=4 688 B12R1.43 CC(=O)C(=O)Nc1cccnn1 WXVL_AF0151SB0051 [0,1,0,0,0,1|2,0,0]=4 689 B12R1.43 CC(=O)C(=O)Nc1cccnn1 WXVL_AF0151SB0051 [0,1,0,0,0,1|2,0,0]=4 690 B12R1.43 CC(=O)C(=O)Nc1ccnnc1 WXVL_AF0624SB0051 [0,1,0,0,0,1|2,0,0]=4 691 B12R1.43 CC(=O)C(=O)Nc1ccnnc1 WXVL_AF0624SB0051 [0,1,0,0,0,1|2,0,0]=4 692 B12R1.43 CC(=O)C(=O)Nc1cnccn1 WXVL_AF0120SB0051 [0,1,0,0,0,1|2,0,0]=4 693 B12R1.43 CC(=O)C(=O)Nc1cnccn1 WXVL_AF0120SB0051 [0,1,0,0,0,1|2,0,0]=4 694 B12R1.43 CC(=O)C(=O)Nc1cncnc1 WXVL_AF0085SB0051 [0,1,0,0,0,1|2,0,0]=4 695 B12R1.43 CC(=O)C(=O)Nc1cncnc1 WXVL_AF0085SB0051 [0,1,0,0,0,1|2,0,0]=4 696 B12R1.43 CC(C)C(=O)Nc1ccccc1 WXVL_AG00183SB0052 [0,1,0,0,0,1|2,0,0]=4 697 B12R1.43 CC(C)C(=O)Nc1ccccc1 WXVL_AG00183SB0052 [0,1,0,0,0,1|2,0,0]=4 698 B12R1.43 CC(C)C(=O)Nc1cccnn1 WXVL_AF0151SB0052 [0,1,0,0,0,1|2,0,0]=4 699 B12R1.43 CC(C)C(=O)Nc1cccnn1 WXVL_AF0151SB0052 [0,1,0,0,0,1|2,0,0]=4 700 B12R1.43 CC(C)C(=O)Nc1ccnnc1 WXVL_AF0624SB0052 [0,1,0,0,0,1|2,0,0]=4 701 B12R1.43 CC(C)C(=O)Nc1ccnnc1 WXVL_AF0624SB0052 [0,1,0,0,0,1|2,0,0]=4 702 B12R1.43 CC(C)C(=O)Nc1cnccn1 WXVL_AF0120SB0052 [0,1,0,0,0,1|2,0,0]=4 703 B12R1.43 CC(C)C(=O)Nc1cnccn1 WXVL_AF0120SB0052 [0,1,0,0,0,1|2,0,0]=4 704 B12R1.43 CC(C)C(=O)Nc1cncnc1 WXVL_AF0085SB0052 [0,1,0,0,0,1|2,0,0]=4 705 B12R1.43 CC(C)C(=O)Nc1cncnc1 WXVL_AF0085SB0052 [0,1,0,0,0,1|2,0,0]=4 706 B12R1.43 CC(S)C(=O)Nc1ccccc1 WXVL_AG00183SB2708 [0,1,0,0,0,1|2,0,0]=4 707 B12R1.43 CC(S)C(=O)Nc1ccccc1 WXVL_AG00183SB2708 [0,1,0,0,0,1|2,0,0]=4 708 B12R1.43 CC(S)C(=O)Nc1cccnn1 WXVL_AF0151SB2708 [0,1,0,0,0,1|2,0,0]=4 709 B12R1.43 CC(S)C(=O)Nc1cccnn1 WXVL_AF0151SB2708 [0,1,0,0,0,1|2,0,0]=4 710 B12R1.43 CC(S)C(=O)Nc1ccnnc1 WXVL_AF0624SB2708 [0,1,0,0,0,1|2,0,0]=4 711 B12R1.43 CC(S)C(=O)Nc1ccnnc1 WXVL_AF0624SB2708 [0,1,0,0,0,1|2,0,0]=4 712 B12R1.43 CC(S)C(=O)Nc1cnccn1 WXVL_AF0120SB2708 [0,1,0,0,0,1|2,0,0]=4 713 B12R1.43 CC(S)C(=O)Nc1cnccn1 WXVL_AF0120SB2708 [0,1,0,0,0,1|2,0,0]=4 714 B12R1.43 CC(S)C(=O)Nc1cncnc1 WXVL_AF0085SB2708 [0,1,0,0,0,1|2,0,0]=4 715 B12R1.43 CC(S)C(=O)Nc1cncnc1 WXVL_AF0085SB2708 [0,1,0,0,0,1|2,0,0]=4 716 B12R1.43 CN(C)C(=O)Cc1ccccc1 WXVL_AN0032SB0092 [0,1,0,0,0,1|2,0,0]=4 717 B12R1.43 CN(C)C(=O)Cc1ccccc1 WXVL_AN0032SB0092 [0,1,0,0,0,1|2,0,0]=4 718 B12R1.43 CN(C)C(=O)Cc1cccnc1 WXVL_AN0032SA0029 [0,1,0,0,0,1|1,0,0]=3 719 B12R1.43 CN(C)C(=O)Cc1cccnc1 WXVL_AN0032SA0029 [0,1,0,0,0,1|1,0,0]=3 720 B12R1.43 CN(C)C(=O)Cc1cccnc1 WXVL_AN0032SB00049 [0,1,0,0,0,1|1,0,0]=3 721 B12R1.43 CN(C)C(=O)Cc1cccnc1 WXVL_AN0032SB00049 [0,1,0,0,0,1|1,0,0]=3 722 B12R1.43 CN(C)C(=O)Cc1cncnc1 WXVL_AN0032SA0242 [0,1,0,0,0,1|2,0,0]=4 723 B12R1.43 CN(C)C(=O)Cc1cncnc1 WXVL_AN0032SA0242 [0,1,0,0,0,1|2,0,0]=4 724 B12R1.43 C[C@@H](O)C(=O)Nc1ccccc1 WXVL_AG00183SB1085 [0,1,0,0,0,1|2,0,0]=4 725 B12R1.43 C[C@@H](O)C(=O)Nc1ccccc1 WXVL_AG00183SB1085 [0,1,0,0,0,1|2,0,0]=4 726 B12R1.43 C[C@@H](O)C(=O)Nc1cccnn1 WXVL_AF0151SB1085 [0,1,0,0,0,1|2,0,0]=4 727 B12R1.43 C[C@@H](O)C(=O)Nc1cccnn1 WXVL_AF0151SB1085 [0,1,0,0,0,1|2,0,0]=4 728 B12R1.43 C[C@@H](O)C(=O)Nc1ccnnc1 WXVL_AF0624SB1085 [0,1,0,0,0,1|2,0,0]=4 729 B12R1.43 C[C@@H](O)C(=O)Nc1ccnnc1 WXVL_AF0624SB1085 [0,1,0,0,0,1|2,0,0]=4 730 B12R1.43 C[C@@H](O)C(=O)Nc1cnccn1 WXVL_AF0120SB1085 [0,1,0,0,0,1|2,0,0]=4 731 B12R1.43 C[C@@H](O)C(=O)Nc1cnccn1 WXVL_AF0120SB1085 [0,1,0,0,0,1|2,0,0]=4 732 B12R1.43 C[C@@H](O)C(=O)Nc1cncnc1 WXVL_AF0085SB1085 [0,1,0,0,0,1|2,0,0]=4 733 B12R1.43 C[C@@H](O)C(=O)Nc1cncnc1 WXVL_AF0085SB1085 [0,1,0,0,0,1|2,0,0]=4 734 B12R1.49 C#CC(=O)Nc1ccc(nc1)Br WXVL_AF0320SB0338 [0,1,0,0,0,1|1,0,1]=4 735 B12R1.49 C#CC(=O)Nc1ccc(nc1)Br WXVL_AF0320SB0338 [0,1,0,0,0,1|1,0,1]=4 736 B12R1.49 C#CC(=O)Nc1ccc(nc1)C WXVL_AF0076SB0338 [0,1,0,0,0,1|1,0,1]=4 737 B12R1.49 C#CC(=O)Nc1ccc(nc1)C WXVL_AF0076SB0338 [0,1,0,0,0,1|1,0,1]=4 738 B12R1.49 C#CC(=O)Nc1ccc(nc1)Cl WXVL_AF0323SB0338 [0,1,0,0,0,1|1,0,1]=4 739 B12R1.49 C#CC(=O)Nc1ccc(nc1)Cl WXVL_AF0323SB0338 [0,1,0,0,0,1|1,0,1]=4 740 B12R1.49 C#CC(=O)Nc1ccc(nc1)F WXVL_AF0400SB0338 [0,1,0,0,0,1|1,0,1]=4 741 B12R1.49 C#CC(=O)Nc1ccc(nc1)F WXVL_AF0400SB0338 [0,1,0,0,0,1|1,0,1]=4 742 B12R1.49 C#CC(=O)Nc1ccc(nc1)I WXVL_AF1228SB0338 [0,1,0,0,0,1|1,0,1]=4 743 B12R1.49 C#CC(=O)Nc1ccc(nc1)I WXVL_AF1228SB0338 [0,1,0,0,0,1|1,0,1]=4 744 B12R1.49 C#CC(=O)Nc1ccc(nc1)O WXVL_AF0322SB0338 [0,1,0,0,0,1|1,0,1]=4 745 B12R1.49 C#CC(=O)Nc1ccc(nc1)O WXVL_AF0322SB0338 [0,1,0,0,0,1|1,0,1]=4 746 B12R1.49 CCC(=O)Nc1ccc(cc1)Cl WXVL_AG0062SB0064 [0,1,0,0,0,1|2,0,0]=4 747 B12R1.49 CCC(=O)Nc1ccc(cc1)Cl WXVL_AG0062SB0064 [0,1,0,0,0,1|2,0,0]=4 748 B12R1.49 CCC(=O)Nc1ccc(cc1)I WXVL_AG1742SB0064 [0,1,0,0,0,1|2,0,0]=4 749 B12R1.49 CCC(=O)Nc1ccc(cc1)I WXVL_AG1742SB0064 [0,1,0,0,0,1|2,0,0]=4 750 B12R1.49 CCC(=O)Nc1ccc(nc1)Br WXVL_AF0320SB0064 [0,1,0,0,0,1|1,0,0]=3 751 B12R1.49 CCC(=O)Nc1ccc(nc1)Br WXVL_AF0320SB0064 [0,1,0,0,0,1|1,0,0]=3 752 B12R1.49 CCC(=O)Nc1ccc(nc1)C WXVL_AF0076SB0064 [0,1,0,0,0,1|1,0,0]=3 753 B12R1.49 CCC(=O)Nc1ccc(nc1)C WXVL_AF0076SB0064 [0,1,0,0,0,1|1,0,0]=3 754 B12R1.49 CCC(=O)Nc1ccc(nc1)Cl WXVL_AF0323SB0064 [0,1,0,0,0,1|1,0,0]=3 755 B12R1.49 CCC(=O)Nc1ccc(nc1)Cl WXVL_AF0323SB0064 [0,1,0,0,0,1|1,0,0]=3 756 B12R1.49 CCC(=O)Nc1ccc(nc1)F WXVL_AF0400SB0064 [0,1,0,0,0,1|1,0,0]=3 757 B12R1.49 CCC(=O)Nc1ccc(nc1)F WXVL_AF0400SB0064 [0,1,0,0,0,1|1,0,0]=3 758 B12R1.49 CCC(=O)Nc1ccc(nc1)I WXVL_AF1228SB0064 [0,1,0,0,0,1|1,0,0]=3 759 B12R1.49 CCC(=O)Nc1ccc(nc1)I WXVL_AF1228SB0064 [0,1,0,0,0,1|1,0,0]=3 760 B12R1.49 CCC(=O)Nc1ccc(nc1)O WXVL_AF0322SB0064 [0,1,0,0,0,1|1,0,0]=3 761 B12R1.49 CCC(=O)Nc1ccc(nc1)O WXVL_AF0322SB0064 [0,1,0,0,0,1|1,0,0]=3 762 B12R1.49 CCC(=O)Nc1ccc(nn1)Cl WXVL_AF0134SB0064 [0,1,0,0,0,1|2,0,0]=4 763 B12R1.49 CCC(=O)Nc1ccc(nn1)Cl WXVL_AF0134SB0064 [0,1,0,0,0,1|2,0,0]=4 764 B12R1.49 CCC(=O)Nc1cnc(cn1)Br WXVL_AF1109SB0064 [0,1,0,0,0,1|2,0,0]=4 765 B12R1.49 CCC(=O)Nc1cnc(cn1)Br WXVL_AF1109SB0064 [0,1,0,0,0,1|2,0,0]=4 766 B12R1.49 CCC(=O)Nc1cnc(cn1)C WXVL_AF0099SB0064 [0,1,0,0,0,1|2,0,0]=4 767 B12R1.49 CCC(=O)Nc1cnc(cn1)C WXVL_AF0099SB0064 [0,1,0,0,0,1|2,0,0]=4 768 B12R1.49 CCC(=O)Nc1cnc(cn1)Cl WXVL_AF0338SB0064 [0,1,0,0,0,1|2,0,0]=4 769 B12R1.49 CCC(=O)Nc1cnc(cn1)Cl WXVL_AF0338SB0064 [0,1,0,0,0,1|2,0,0]=4 770 B12R1.49 CCC(=O)Nc1cnc(cn1)I WXVL_AF0666SB0064 [0,1,0,0,0,1|2,0,0]=4 771 B12R1.49 CCC(=O)Nc1cnc(cn1)I WXVL_AF0666SB0064 [0,1,0,0,0,1|2,0,0]=4 772 B12R1.49 CCC(=O)Nc1cnc(nc1)Br WXVL_AF0628SB0064 [0,1,0,0,0,1|2,0,0]=4 773 B12R1.49 CCC(=O)Nc1cnc(nc1)Br WXVL_AF0628SB0064 [0,1,0,0,0,1|2,0,0]=4 774 B12R1.49 CCC(=O)Nc1cnc(nc1)C WXVL_AF0697SB0064 [0,1,0,0,0,1|2,0,0]=4 775 B12R1.49 CCC(=O)Nc1cnc(nc1)C WXVL_AF0697SB0064 [0,1,0,0,0,1|2,0,0]=4 776 B12R1.49 CCC(=O)Nc1cnc(nc1)Cl WXVL_AF0236SB0064 [0,1,0,0,0,1|2,0,0]=4 777 B12R1.49 CCC(=O)Nc1cnc(nc1)Cl WXVL_AF0236SB0064 [0,1,0,0,0,1|2,0,0]=4 778 B12R1.49 CNC(=O)Cc1ccc(cc1)Br WXVL_AK00442SB0926 [0,1,0,0,0,1|2,0,0]=4 779 B12R1.49 CNC(=O)Cc1ccc(cc1)Br WXVL_AK00442SB0926 [0,1,0,0,0,1|2,0,0]=4 780 B12R1.49 CNC(=O)Cc1ccc(cc1)C WXVL_AK00442SB0112 [0,1,0,0,0,1|2,0,0]=4 781 B12R1.49 CNC(=O)Cc1ccc(cc1)C WXVL_AK00442SB0112 [0,1,0,0,0,1|2,0,0]=4 782 B12R1.49 CNC(=O)Cc1ccc(cc1)Cl WXVL_AK00442SB0107 [0,1,0,0,0,1|2,0,0]=4 783 B12R1.49 CNC(=O)Cc1ccc(cc1)Cl WXVL_AK00442SB0107 [0,1,0,0,0,1|2,0,0]=4 784 B12R1.49 CNC(=O)Cc1ccc(cc1)F WXVL_AK00442SB0106 [0,1,0,0,0,1|2,0,0]=4 785 B12R1.49 CNC(=O)Cc1ccc(cc1)F WXVL_AK00442SB0106 [0,1,0,0,0,1|2,0,0]=4 786 B12R1.49 CNC(=O)Cc1ccc(cc1)O WXVL_AK00442SB0110 [0,1,0,0,0,1|2,0,0]=4 787 B12R1.49 CNC(=O)Cc1ccc(cc1)O WXVL_AK00442SB0110 [0,1,0,0,0,1|2,0,0]=4 788 B12R1.49 CNC(=O)Cc1ccc(nc1)Br WXVL_AK00442SA00056 [0,1,0,0,0,1|1,0,0]=3 789 B12R1.49 CNC(=O)Cc1ccc(nc1)Br WXVL_AK00442SA00056 [0,1,0,0,0,1|1,0,0]=3 790 B12R1.49 CNC(=O)Cc1ccc(nc1)C WXVL_AK00442SA0250 [0,1,0,0,0,1|1,0,0]=3 791 B12R1.49 CNC(=O)Cc1ccc(nc1)C WXVL_AK00442SA0250 [0,1,0,0,0,1|1,0,0]=3 792 B12R1.49 CNC(=O)Nc1ccc(cc1)C WXVL_AK00442YV0026 [0,1,0,0,0,1|2,0,0]=4 793 B12R1.49 CNC(=O)Nc1ccc(cc1)C WXVL_AK00442YV0026 [0,1,0,0,0,1|2,0,0]=4 794 B12R1.49 CNC(=O)Nc1ccc(cc1)Cl WXVL_AK00442YV0023 [0,1,0,0,0,1|2,0,0]=4 795 B12R1.49 CNC(=O)Nc1ccc(cc1)Cl WXVL_AK00442YV0023 [0,1,0,0,0,1|2,0,0]=4 796 B12R1.49 Cc1ccc(cn1)NC(=O)CO WXVL_AF0076SB2706 [0,1,0,0,0,1|2,0,0]=4 797 B12R1.49 Cc1ccc(cn1)NC(=O)CO WXVL_AF0076SB2706 [0,1,0,0,0,1|2,0,0]=4 798 B12R1.49 O=C(CO)Nc1ccc(nc1)Br WXVL_AF0320SB2706 [0,1,0,0,0,1|2,0,0]=4 799 B12R1.49 O=C(CO)Nc1ccc(nc1)Br WXVL_AF0320SB2706 [0,1,0,0,0,1|2,0,0]=4 800 B12R1.49 O=C(CO)Nc1ccc(nc1)Cl WXVL_AF0323SB2706 [0,1,0,0,0,1|2,0,0]=4 801 B12R1.49 O=C(CO)Nc1ccc(nc1)Cl WXVL_AF0323SB2706 [0,1,0,0,0,1|2,0,0]=4 802 B12R1.49 O=C(CO)Nc1ccc(nc1)F WXVL_AF0400SB2706 [0,1,0,0,0,1|2,0,0]=4 803 B12R1.49 O=C(CO)Nc1ccc(nc1)F WXVL_AF0400SB2706 [0,1,0,0,0,1|2,0,0]=4 804 B12R1.49 O=C(CO)Nc1ccc(nc1)I WXVL_AF1228SB2706 [0,1,0,0,0,1|2,0,0]=4 805 B12R1.49 O=C(CO)Nc1ccc(nc1)I WXVL_AF1228SB2706 [0,1,0,0,0,1|2,0,0]=4 806 B12R1.49 O=C(CO)Nc1ccc(nc1)O WXVL_AF0322SB2706 [0,1,0,0,0,1|2,0,0]=4 807 B12R1.49 O=C(CO)Nc1ccc(nc1)O WXVL_AF0322SB2706 [0,1,0,0,0,1|2,0,0]=4 808 B12R1.50 C#CC(=O)Nc1cncc(c1)Br WXVL_AF0318SB0338 [0,1,0,0,0,1|1,0,1]=4 809 B12R1.50 C#CC(=O)Nc1cncc(c1)Br WXVL_AF0318SB0338 [0,1,0,0,0,1|1,0,1]=4 810 B12R1.50 C#CC(=O)Nc1cncc(c1)C WXVL_AF0136SB0338 [0,1,0,0,0,1|1,0,1]=4 811 B12R1.50 C#CC(=O)Nc1cncc(c1)C WXVL_AF0136SB0338 [0,1,0,0,0,1|1,0,1]=4 812 B12R1.50 C#CC(=O)Nc1cncc(c1)Cl WXVL_AF0629SB0338 [0,1,0,0,0,1|1,0,1]=4 813 B12R1.50 C#CC(=O)Nc1cncc(c1)Cl WXVL_AF0629SB0338 [0,1,0,0,0,1|1,0,1]=4 814 B12R1.50 C#CC(=O)Nc1cncc(c1)F WXVL_AF0342SB0338 [0,1,0,0,0,1|1,0,1]=4 815 B12R1.50 C#CC(=O)Nc1cncc(c1)F WXVL_AF0342SB0338 [0,1,0,0,0,1|1,0,1]=4 816 B12R1.50 C#CC(=O)Nc1cncc(c1)O WXVL_AF0659SB0338 [0,1,0,0,0,1|1,0,1]=4 817 B12R1.50 C#CC(=O)Nc1cncc(c1)O WXVL_AF0659SB0338 [0,1,0,0,0,1|1,0,1]=4 818 B12R1.50 CCC(=O)Nc1cc(cnn1)C WXVL_AF4009SB0064 [0,1,0,0,0,1|2,0,0]=4 819 B12R1.50 CCC(=O)Nc1cc(cnn1)C WXVL_AF4009SB0064 [0,1,0,0,0,1|2,0,0]=4 820 B12R1.50 CCC(=O)Nc1cc(cnn1)Cl WXVL_AF9282SB0064 [0,1,0,0,0,1|2,0,0]=4 821 B12R1.50 CCC(=O)Nc1cc(cnn1)Cl WXVL_AF9282SB0064 [0,1,0,0,0,1|2,0,0]=4 822 B12R1.50 CCC(=O)Nc1cccc(c1)C WXVL_AG0052SB0064 [0,1,0,0,0,1|2,0,0]=4 823 B12R1.50 CCC(=O)Nc1cccc(c1)C WXVL_AG0052SB0064 [0,1,0,0,0,1|2,0,0]=4 824 B12R1.50 CCC(=O)Nc1cccc(c1)I WXVL_AG0649SB0064 [0,1,0,0,0,1|2,0,0]=4 825 B12R1.50 CCC(=O)Nc1cccc(c1)I WXVL_AG0649SB0064 [0,1,0,0,0,1|2,0,0]=4 826 B12R1.50 CCC(=O)Nc1cccc(c1)O WXVL_AG00200SB0064 [0,1,0,0,0,1|2,0,0]=4 827 B12R1.50 CCC(=O)Nc1cccc(c1)O WXVL_AG00200SB0064 [0,1,0,0,0,1|2,0,0]=4 828 B12R1.50 CCC(=O)Nc1cncc(c1)Br WXVL_AF0318SB0064 [0,1,0,0,0,1|1,0,0]=3 829 B12R1.50 CCC(=O)Nc1cncc(c1)Br WXVL_AF0318SB0064 [0,1,0,0,0,1|1,0,0]=3 830 B12R1.50 CCC(=O)Nc1cncc(c1)C WXVL_AF0136SB0064 [0,1,0,0,0,1|1,0,0]=3 831 B12R1.50 CCC(=O)Nc1cncc(c1)C WXVL_AF0136SB0064 [0,1,0,0,0,1|1,0,0]=3 832 B12R1.50 CCC(=O)Nc1cncc(c1)Cl WXVL_AF0629SB0064 [0,1,0,0,0,1|1,0,0]=3 833 B12R1.50 CCC(=O)Nc1cncc(c1)Cl WXVL_AF0629SB0064 [0,1,0,0,0,1|1,0,0]=3 834 B12R1.50 CCC(=O)Nc1cncc(c1)F WXVL_AF0342SB0064 [0,1,0,0,0,1|1,0,0]=3 835 B12R1.50 CCC(=O)Nc1cncc(c1)F WXVL_AF0342SB0064 [0,1,0,0,0,1|1,0,0]=3 836 B12R1.50 CCC(=O)Nc1cncc(c1)O WXVL_AF0659SB0064 [0,1,0,0,0,1|1,0,0]=3 837 B12R1.50 CCC(=O)Nc1cncc(c1)O WXVL_AF0659SB0064 [0,1,0,0,0,1|1,0,0]=3 838 B12R1.50 CCC(=O)Nc1cncc(n1)Br WXVL_AF0737SB0064 [0,1,0,0,0,1|2,0,0]=4 839 B12R1.50 CCC(=O)Nc1cncc(n1)Br WXVL_AF0737SB0064 [0,1,0,0,0,1|2,0,0]=4 840 B12R1.50 CCC(=O)Nc1cncc(n1)C WXVL_AF0077SB0064 [0,1,0,0,0,1|2,0,0]=4 841 B12R1.50 CCC(=O)Nc1cncc(n1)C WXVL_AF0077SB0064 [0,1,0,0,0,1|2,0,0]=4 842 B12R1.50 CCC(=O)Nc1cncc(n1)Cl WXVL_AF0366SB0064 [0,1,0,0,0,1|2,0,0]=4 843 B12R1.50 CCC(=O)Nc1cncc(n1)Cl WXVL_AF0366SB0064 [0,1,0,0,0,1|2,0,0]=4 844 B12R1.50 CCC(=O)Nc1cnnc(c1)Cl WXVL_AF0119SB0064 [0,1,0,0,0,1|2,0,0]=4 845 B12R1.50 CCC(=O)Nc1cnnc(c1)Cl WXVL_AF0119SB0064 [0,1,0,0,0,1|2,0,0]=4 846 B12R1.50 CNC(=O)Cc1cccc(c1)Br WXVL_AK00442SB0099 [0,1,0,0,0,1|2,0,0]=4 847 B12R1.50 CNC(=O)Cc1cccc(c1)Br WXVL_AK00442SB0099 [0,1,0,0,0,1|2,0,0]=4 848 B12R1.50 CNC(=O)Cc1cccc(c1)C WXVL_AK00442SB0105 [0,1,0,0,0,1|2,0,0]=4 849 B12R1.50 CNC(=O)Cc1cccc(c1)C WXVL_AK00442SB0105 [0,1,0,0,0,1|2,0,0]=4 850 B12R1.50 CNC(=O)Cc1cccc(c1)Cl WXVL_AK00442SB0101 [0,1,0,0,0,1|2,0,0]=4 851 B12R1.50 CNC(=O)Cc1cccc(c1)Cl WXVL_AK00442SB0101 [0,1,0,0,0,1|2,0,0]=4 852 B12R1.50 CNC(=O)Cc1cccc(c1)F WXVL_AK00442SB0100 [0,1,0,0,0,1|2,0,0]=4 853 B12R1.50 CNC(=O)Cc1cccc(c1)F WXVL_AK00442SB0100 [0,1,0,0,0,1|2,0,0]=4 854 B12R1.50 CNC(=O)Cc1cccc(c1)O WXVL_AK00442SB0104 [0,1,0,0,0,1|2,0,0]=4 855 B12R1.50 CNC(=O)Cc1cccc(c1)O WXVL_AK00442SB0104 [0,1,0,0,0,1|2,0,0]=4 856 B12R1.50 CNC(=O)Nc1cccc(c1)Br WXVL_AK00442YV0098 [0,1,0,0,0,1|2,0,0]=4 857 B12R1.50 CNC(=O)Nc1cccc(c1)Br WXVL_AK00442YV0098 [0,1,0,0,0,1|2,0,0]=4 858 B12R1.50 CNC(=O)Nc1cccc(c1)C WXVL_AK00442YV0020 [0,1,0,0,0,1|2,0,0]=4 859 B12R1.50 CNC(=O)Nc1cccc(c1)C WXVL_AK00442YV0020 [0,1,0,0,0,1|2,0,0]=4 860 B12R1.50 CNC(=O)Nc1cccc(c1)Cl WXVL_AK00442YV0016 [0,1,0,0,0,1|2,0,0]=4 861 B12R1.50 CNC(=O)Nc1cccc(c1)Cl WXVL_AK00442YV0016 [0,1,0,0,0,1|2,0,0]=4 862 B12R1.50 Cc1cncc(c1)NC(=O)CO WXVL_AF0136SB2706 [0,1,0,0,0,1|2,0,0]=4 863 B12R1.50 Cc1cncc(c1)NC(=O)CO WXVL_AF0136SB2706 [0,1,0,0,0,1|2,0,0]=4 864 B12R1.50 O=C(CO)Nc1cncc(c1)Br WXVL_AF0318SB2706 [0,1,0,0,0,1|2,0,0]=4 865 B12R1.50 O=C(CO)Nc1cncc(c1)Br WXVL_AF0318SB2706 [0,1,0,0,0,1|2,0,0]=4 866 B12R1.50 O=C(CO)Nc1cncc(c1)Cl WXVL_AF0629SB2706 [0,1,0,0,0,1|2,0,0]=4 867 B12R1.50 O=C(CO)Nc1cncc(c1)Cl WXVL_AF0629SB2706 [0,1,0,0,0,1|2,0,0]=4 868 B12R1.50 O=C(CO)Nc1cncc(c1)F WXVL_AF0342SB2706 [0,1,0,0,0,1|2,0,0]=4 869 B12R1.50 O=C(CO)Nc1cncc(c1)F WXVL_AF0342SB2706 [0,1,0,0,0,1|2,0,0]=4 870 B12R1.50 O=C(CO)Nc1cncc(c1)O WXVL_AF0659SB2706 [0,1,0,0,0,1|2,0,0]=4 871 B12R1.50 O=C(CO)Nc1cncc(c1)O WXVL_AF0659SB2706 [0,1,0,0,0,1|2,0,0]=4 872 B12R1.371 C#CC(=O)Nc1cccnc1Br WXVL_AF0399SB0338 [0,1,0,0,0,1|1,0,1]=4 873 B12R1.371 C#CC(=O)Nc1cccnc1Br WXVL_AF0399SB0338 [0,1,0,0,0,1|1,0,1]=4 874 B12R1.371 C#CC(=O)Nc1cccnc1C WXVL_AF0055SB0338 [0,1,0,0,0,1|1,0,1]=4 875 B12R1.371 C#CC(=O)Nc1cccnc1C WXVL_AF0055SB0338 [0,1,0,0,0,1|1,0,1]=4 876 B12R1.371 C#CC(=O)Nc1cccnc1Cl WXVL_AF0009SB0338 [0,1,0,0,0,1|1,0,1]=4 877 B12R1.371 C#CC(=O)Nc1cccnc1Cl WXVL_AF0009SB0338 [0,1,0,0,0,1|1,0,1]=4 878 B12R1.371 C#CC(=O)Nc1cccnc1F WXVL_AF0419SB0338 [0,1,0,0,0,1|1,0,1]=4 879 B12R1.371 C#CC(=O)Nc1cccnc1F WXVL_AF0419SB0338 [0,1,0,0,0,1|1,0,1]=4 880 B12R1.371 C#CC(=O)Nc1cccnc1I WXVL_AF0681SB0338 [0,1,0,0,0,1|1,0,1]=4 881 B12R1.371 C#CC(=O)Nc1cccnc1I WXVL_AF0681SB0338 [0,1,0,0,0,1|1,0,1]=4 882 B12R1.371 C#CC(=O)Nc1cccnc1O WXVL_AF0440SB0338 [0,1,0,0,0,1|1,0,1]=4 883 B12R1.371 C#CC(=O)Nc1cccnc1O WXVL_AF0440SB0338 [0,1,0,0,0,1|1,0,1]=4 884 B12R1.371 C#CC(=O)Nc1cnccc1Br WXVL_AF1085SB0338 [0,1,0,0,0,1|1,0,1]=4 885 B12R1.371 C#CC(=O)Nc1cnccc1Br WXVL_AF1085SB0338 [0,1,0,0,0,1|1,0,1]=4 886 B12R1.371 C#CC(=O)Nc1cnccc1C WXVL_AF0075SB0338 [0,1,0,0,0,1|1,0,1]=4 887 B12R1.371 C#CC(=O)Nc1cnccc1C WXVL_AF0075SB0338 [0,1,0,0,0,1|1,0,1]=4 888 B12R1.371 C#CC(=O)Nc1cnccc1Cl WXVL_AF0294SB0338 [0,1,0,0,0,1|1,0,1]=4 889 B12R1.371 C#CC(=O)Nc1cnccc1Cl WXVL_AF0294SB0338 [0,1,0,0,0,1|1,0,1]=4 890 B12R1.371 C#CC(=O)Nc1cnccc1I WXVL_AF0133SB0338 [0,1,0,0,0,1|1,0,1]=4 891 B12R1.371 C#CC(=O)Nc1cnccc1I WXVL_AF0133SB0338 [0,1,0,0,0,1|1,0,1]=4 892 B12R1.371 CCC(=O)Nc1ccccc1Br WXVL_AG00180SB0064 [0,1,0,0,0,1|2,0,0]=4 893 B12R1.371 CCC(=O)Nc1ccccc1Br WXVL_AG00180SB0064 [0,1,0,0,0,1|2,0,0]=4 894 B12R1.371 CCC(=O)Nc1ccccc1C WXVL_AG0027SB0064 [0,1,0,0,0,1|2,0,0]=4 895 B12R1.371 CCC(=O)Nc1ccccc1C WXVL_AG0027SB0064 [0,1,0,0,0,1|2,0,0]=4 896 B12R1.371 CCC(=O)Nc1ccccc1Cl WXVL_AG00129SB0064 [0,1,0,0,0,1|2,0,0]=4 897 B12R1.371 CCC(=O)Nc1ccccc1Cl WXVL_AG00129SB0064 [0,1,0,0,0,1|2,0,0]=4 898 B12R1.371 CCC(=O)Nc1ccccc1I WXVL_AG0385SB0064 [0,1,0,0,0,1|2,0,0]=4 899 B12R1.371 CCC(=O)Nc1ccccc1I WXVL_AG0385SB0064 [0,1,0,0,0,1|2,0,0]=4 900 B12R1.371 CCC(=O)Nc1cccnc1Br WXVL_AF0399SB0064 [0,1,0,0,0,1|1,0,0]=3 901 B12R1.371 CCC(=O)Nc1cccnc1Br WXVL_AF0399SB0064 [0,1,0,0,0,1|1,0,0]=3 902 B12R1.371 CCC(=O)Nc1cccnc1C WXVL_AF0055SB0064 [0,1,0,0,0,1|1,0,0]=3 903 B12R1.371 CCC(=O)Nc1cccnc1C WXVL_AF0055SB0064 [0,1,0,0,0,1|1,0,0]=3 904 B12R1.371 CCC(=O)Nc1cccnc1Cl WXVL_AF0009SB0064 [0,1,0,0,0,1|1,0,0]=3 905 B12R1.371 CCC(=O)Nc1cccnc1Cl WXVL_AF0009SB0064 [0,1,0,0,0,1|1,0,0]=3 906 B12R1.371 CCC(=O)Nc1cccnc1F WXVL_AF0419SB0064 [0,1,0,0,0,1|1,0,0]=3 907 B12R1.371 CCC(=O)Nc1cccnc1F WXVL_AF0419SB0064 [0,1,0,0,0,1|1,0,0]=3 908 B12R1.371 CCC(=O)Nc1cccnc1I WXVL_AF0681SB0064 [0,1,0,0,0,1|1,0,0]=3 909 B12R1.371 CCC(=O)Nc1cccnc1I WXVL_AF0681SB0064 [0,1,0,0,0,1|1,0,0]=3 910 B12R1.371 CCC(=O)Nc1cccnc1O WXVL_AF0440SB0064 [0,1,0,0,0,1|1,0,0]=3 911 B12R1.371 CCC(=O)Nc1cccnc1O WXVL_AF0440SB0064 [0,1,0,0,0,1|1,0,0]=3 912 B12R1.371 CCC(=O)Nc1ccnnc1O WXVL_AF1433SB0064 [0,1,0,0,0,1|2,0,0]=4 913 B12R1.371 CCC(=O)Nc1ccnnc1O WXVL_AF1433SB0064 [0,1,0,0,0,1|2,0,0]=4 914 B12R1.371 CCC(=O)Nc1cnccc1Br WXVL_AF1085SB0064 [0,1,0,0,0,1|1,0,0]=3 915 B12R1.371 CCC(=O)Nc1cnccc1Br WXVL_AF1085SB0064 [0,1,0,0,0,1|1,0,0]=3 916 B12R1.371 CCC(=O)Nc1cnccc1C WXVL_AF0075SB0064 [0,1,0,0,0,1|1,0,0]=3 917 B12R1.371 CCC(=O)Nc1cnccc1C WXVL_AF0075SB0064 [0,1,0,0,0,1|1,0,0]=3 918 B12R1.371 CCC(=O)Nc1cnccc1Cl WXVL_AF0294SB0064 [0,1,0,0,0,1|1,0,0]=3 919 B12R1.371 CCC(=O)Nc1cnccc1Cl WXVL_AF0294SB0064 [0,1,0,0,0,1|1,0,0]=3 920 B12R1.371 CCC(=O)Nc1cnccc1I WXVL_AF0133SB0064 [0,1,0,0,0,1|1,0,0]=3 921 B12R1.371 CCC(=O)Nc1cnccc1I WXVL_AF0133SB0064 [0,1,0,0,0,1|1,0,0]=3 922 B12R1.371 CCC(=O)Nc1cncnc1Br WXVL_AF0648SB0064 [0,1,0,0,0,1|2,0,0]=4 923 B12R1.371 CCC(=O)Nc1cncnc1Br WXVL_AF0648SB0064 [0,1,0,0,0,1|2,0,0]=4 924 B12R1.371 CCC(=O)Nc1cncnc1C WXVL_AF0738SB0064 [0,1,0,0,0,1|2,0,0]=4 925 B12R1.371 CCC(=O)Nc1cncnc1C WXVL_AF0738SB0064 [0,1,0,0,0,1|2,0,0]=4 926 B12R1.371 CCC(=O)Nc1cncnc1Cl WXVL_AF0353SB0064 [0,1,0,0,0,1|2,0,0]=4 927 B12R1.371 CCC(=O)Nc1cncnc1Cl WXVL_AF0353SB0064 [0,1,0,0,0,1|2,0,0]=4 928 B12R1.371 CCC(=O)Nc1cncnc1I WXVL_AF1297SB0064 [0,1,0,0,0,1|2,0,0]=4 929 B12R1.371 CCC(=O)Nc1cncnc1I WXVL_AF1297SB0064 [0,1,0,0,0,1|2,0,0]=4 930 B12R1.371 CCC(=O)Nc1cncnc1O WXVL_AF1656SB0064 [0,1,0,0,0,1|2,0,0]=4 931 B12R1.371 CCC(=O)Nc1cncnc1O WXVL_AF1656SB0064 [0,1,0,0,0,1|2,0,0]=4 932 B12R1.371 CCC(=O)Nc1cnncc1Br WXVL_AF1355SB0064 [0,1,0,0,0,1|2,0,0]=4 933 B12R1.371 CCC(=O)Nc1cnncc1Br WXVL_AF1355SB0064 [0,1,0,0,0,1|2,0,0]=4 934 B12R1.371 CCC(=O)Nc1cnncc1Cl WXVL_AF1037SB0064 [0,1,0,0,0,1|2,0,0]=4 935 B12R1.371 CCC(=O)Nc1cnncc1Cl WXVL_AF1037SB0064 [0,1,0,0,0,1|2,0,0]=4 936 B12R1.371 CCC(=O)Nc1nccnc1Br WXVL_AF0708SB0064 [0,1,0,0,0,1|2,0,0]=4 937 B12R1.371 CCC(=O)Nc1nccnc1Br WXVL_AF0708SB0064 [0,1,0,0,0,1|2,0,0]=4 938 B12R1.371 CCC(=O)Nc1nccnc1C WXVL_AF0295SB0064 [0,1,0,0,0,1|2,0,0]=4 939 B12R1.371 CCC(=O)Nc1nccnc1C WXVL_AF0295SB0064 [0,1,0,0,0,1|2,0,0]=4 940 B12R1.371 CCC(=O)Nc1nccnc1Cl WXVL_AF0102SB0064 [0,1,0,0,0,1|2,0,0]=4 941 B12R1.371 CCC(=O)Nc1nccnc1Cl WXVL_AF0102SB0064 [0,1,0,0,0,1|2,0,0]=4 942 B12R1.371 CNC(=O)Cc1ccccc1Br WXVL_AK00442SB0093 [0,1,0,0,0,1|2,0,0]=4 943 B12R1.371 CNC(=O)Cc1ccccc1Br WXVL_AK00442SB0093 [0,1,0,0,0,1|2,0,0]=4 944 B12R1.371 CNC(=O)Cc1ccccc1C WXVL_AK00442SB0098 [0,1,0,0,0,1|2,0,0]=4 945 B12R1.371 CNC(=O)Cc1ccccc1C WXVL_AK00442SB0098 [0,1,0,0,0,1|2,0,0]=4 946 B12R1.371 CNC(=O)Cc1ccccc1Cl WXVL_AK00442SB0095 [0,1,0,0,0,1|2,0,0]=4 947 B12R1.371 CNC(=O)Cc1ccccc1Cl WXVL_AK00442SB0095 [0,1,0,0,0,1|2,0,0]=4 948 B12R1.371 CNC(=O)Cc1ccccc1F WXVL_AK00442SB0094 [0,1,0,0,0,1|2,0,0]=4 949 B12R1.371 CNC(=O)Cc1ccccc1F WXVL_AK00442SB0094 [0,1,0,0,0,1|2,0,0]=4 950 B12R1.371 CNC(=O)Cc1ccccc1I WXVL_AK00442SB1145 [0,1,0,0,0,1|2,0,0]=4 951 B12R1.371 CNC(=O)Cc1ccccc1I WXVL_AK00442SB1145 [0,1,0,0,0,1|2,0,0]=4 952 B12R1.371 CNC(=O)Cc1ccccc1O WXVL_AK00442SB0400 [0,1,0,0,0,1|2,0,0]=4 953 B12R1.371 CNC(=O)Cc1ccccc1O WXVL_AK00442SB0400 [0,1,0,0,0,1|2,0,0]=4 954 B12R1.371 CNC(=O)Cc1cccnc1Cl WXVL_AK00442SA0056 [0,1,0,0,0,1|1,0,0]=3 955 B12R1.371 CNC(=O)Cc1cccnc1Cl WXVL_AK00442SA0056 [0,1,0,0,0,1|1,0,0]=3 956 B12R1.371 CNC(=O)Nc1ccccc1Br WXVL_AK00442YV0003 [0,1,0,0,0,1|2,0,0]=4 957 B12R1.371 CNC(=O)Nc1ccccc1Br WXVL_AK00442YV0003 [0,1,0,0,0,1|2,0,0]=4 958 B12R1.371 CNC(=O)Nc1ccccc1C WXVL_AK00442YV0013 [0,1,0,0,0,1|2,0,0]=4 959 B12R1.371 CNC(=O)Nc1ccccc1C WXVL_AK00442YV0013 [0,1,0,0,0,1|2,0,0]=4 960 B12R1.371 CNC(=O)Nc1ccccc1Cl WXVL_AK00442YV0007 [0,1,0,0,0,1|2,0,0]=4 961 B12R1.371 CNC(=O)Nc1ccccc1Cl WXVL_AK00442YV0007 [0,1,0,0,0,1|2,0,0]=4 962 B12R1.371 Cc1ccncc1NC(=O)CO WXVL_AF0075SB2706 [0,1,0,0,0,1|2,0,0]=4 963 B12R1.371 Cc1ccncc1NC(=O)CO WXVL_AF0075SB2706 [0,1,0,0,0,1|2,0,0]=4 964 B12R1.371 Cc1ncccc1NC(=O)CO WXVL_AF0055SB2706 [0,1,0,0,0,1|2,0,0]=4 965 B12R1.371 Cc1ncccc1NC(=O)CO WXVL_AF0055SB2706 [0,1,0,0,0,1|2,0,0]=4 966 B12R1.371 O=C(CO)Nc1cccnc1Br WXVL_AF0399SB2706 [0,1,0,0,0,1|2,0,0]=4 967 B12R1.371 O=C(CO)Nc1cccnc1Br WXVL_AF0399SB2706 [0,1,0,0,0,1|2,0,0]=4 968 B12R1.371 O=C(CO)Nc1cccnc1Cl WXVL_AF0009SB2706 [0,1,0,0,0,1|2,0,0]=4 969 B12R1.371 O=C(CO)Nc1cccnc1Cl WXVL_AF0009SB2706 [0,1,0,0,0,1|2,0,0]=4 970 B12R1.371 O=C(CO)Nc1cccnc1F WXVL_AF0419SB2706 [0,1,0,0,0,1|2,0,0]=4 971 B12R1.371 O=C(CO)Nc1cccnc1F WXVL_AF0419SB2706 [0,1,0,0,0,1|2,0,0]=4 972 B12R1.371 O=C(CO)Nc1cccnc1I WXVL_AF0681SB2706 [0,1,0,0,0,1|2,0,0]=4 973 B12R1.371 O=C(CO)Nc1cccnc1I WXVL_AF0681SB2706 [0,1,0,0,0,1|2,0,0]=4 974 B12R1.371 O=C(CO)Nc1cccnc1O WXVL_AF0440SB2706 [0,1,0,0,0,1|2,0,0]=4 975 B12R1.371 O=C(CO)Nc1cccnc1O WXVL_AF0440SB2706 [0,1,0,0,0,1|2,0,0]=4 976 B12R1.371 O=C(CO)Nc1cnccc1Br WXVL_AF1085SB2706 [0,1,0,0,0,1|2,0,0]=4 977 B12R1.371 O=C(CO)Nc1cnccc1Br WXVL_AF1085SB2706 [0,1,0,0,0,1|2,0,0]=4 978 B12R1.371 O=C(CO)Nc1cnccc1Cl WXVL_AF0294SB2706 [0,1,0,0,0,1|2,0,0]=4 979 B12R1.371 O=C(CO)Nc1cnccc1Cl WXVL_AF0294SB2706 [0,1,0,0,0,1|2,0,0]=4 980 B12R1.371 O=C(CO)Nc1cnccc1I WXVL_AF0133SB2706 [0,1,0,0,0,1|2,0,0]=4 981 B12R1.371 O=C(CO)Nc1cnccc1I WXVL_AF0133SB2706 [0,1,0,0,0,1|2,0,0]=4 982 B12R1.9 CNS(=O)(=O)c1ccc(nc1)C WXVL_AK00442HU0506 [0,2,0,0,0,0|2,0,0]=4 983 B12R1.9 CNS(=O)(=O)c1ccc(nc1)C WXVL_AK00442HU0506 [0,2,0,0,0,0|2,0,0]=4 984 B12R1.9 CNS(=O)(=O)c1ccc(nc1)Cl WXVL_AK00442HU0290 [0,2,0,0,0,0|2,0,0]=4 985 B12R1.9 CNS(=O)(=O)c1ccc(nc1)Cl WXVL_AK00442HU0290 [0,2,0,0,0,0|2,0,0]=4 986 B12R1.10 CNS(=O)(=O)c1cncc(c1)Br WXVL_AK00442HU0301 [0,2,0,0,0,0|2,0,0]=4 987 B12R1.10 CNS(=O)(=O)c1cncc(c1)Br WXVL_AK00442HU0301 [0,2,0,0,0,0|2,0,0]=4 988 B12R1.39 CCNS(=O)(=O)c1cccnc1 WXVL_AK00476HU0127 [0,2,0,0,0,0|2,0,0]=4 989 B12R1.39 CCNS(=O)(=O)c1cccnc1 WXVL_AK00476HU0127 [0,2,0,0,0,0|2,0,0]=4 990 B12R1.195 CNS(=O)(=O)c1cccnc1Cl WXVL_AK00442HU0278 [0,2,0,0,0,0|2,0,0]=4 991 B12R1.195 CNS(=O)(=O)c1cccnc1Cl WXVL_AK00442HU0278 [0,2,0,0,0,0|2,0,0]=4 992 B12R1.253 CN(C)S(=O)(=O)c1cccnc1 WXVL_AN0032HU0127 [0,2,0,0,0,0|2,0,0]=4 993 B12R1.253 CN(C)S(=O)(=O)c1cccnc1 WXVL_AN0032HU0127 [0,2,0,0,0,0|2,0,0]=4 994 B12R1.478 CO[C@@H](C(=O)N)c1ccccc1 WXVL_AK0084SB0081 [0,2,0,0,0,0|1,0,1]=4 995 B12R1.478 CO[C@@H](C(=O)N)c1ccccc1 WXVL_AK0084SB0081 [0,2,0,0,0,0|1,0,1]=4 996 B12R1.16 CCNC(=O)c1ccc(=O)[nH]c1 WXVL_AK00476SC2212 [0,2,0,0,0,0|1,0,1]=4 997 B12R1.16 CCNC(=O)c1ccc(=O)[nH]c1 WXVL_AK00476SC2212 [0,2,0,0,0,0|1,0,1]=4 998 B12R1.16 CCNC(=O)c1ccc(=O)oc1 WXVL_AK00476SC0132 [0,2,0,0,0,0|2,0,0]=4 999 B12R1.16 CCNC(=O)c1ccc(=O)oc1 WXVL_AK00476SC0132 [0,2,0,0,0,0|2,0,0]=4 1000 B12R1.16 CCNC(=O)c1ccc(cc1)Br WXVL_AK00476SD0060 [0,2,0,0,0,0|2,0,0]=4 1001 B12R1.16 CCNC(=O)c1ccc(cc1)Br WXVL_AK00476SD0060 [0,2,0,0,0,0|2,0,0]=4 1002 B12R1.16 CCNC(=O)c1ccc(cc1)C WXVL_AK00476SD0078 [0,2,0,0,0,0|2,0,0]=4 1003 B12R1.16 CCNC(=O)c1ccc(cc1)C WXVL_AK00476SD0078 [0,2,0,0,0,0|2,0,0]=4 1004 B12R1.16 CCNC(=O)c1ccc(cc1)Cl WXVL_AK00476SD0062 [0,2,0,0,0,0|2,0,0]=4 1005 B12R1.16 CCNC(=O)c1ccc(cc1)Cl WXVL_AK00476SD0062 [0,2,0,0,0,0|2,0,0]=4 1006 B12R1.16 CCNC(=O)c1ccc(cc1)F WXVL_AK00476SD0061 [0,2,0,0,0,0|2,0,0]=4 1007 B12R1.16 CCNC(=O)c1ccc(cc1)F WXVL_AK00476SD0061 [0,2,0,0,0,0|2,0,0]=4 1008 B12R1.16 CCNC(=O)c1ccc(cc1)I WXVL_AK00476SD0421 [0,2,0,0,0,0|2,0,0]=4 1009 B12R1.16 CCNC(=O)c1ccc(cc1)I WXVL_AK00476SD0421 [0,2,0,0,0,0|2,0,0]=4 1010 B12R1.16 CCNC(=O)c1ccc(cc1)O WXVL_AK00476SD0069 [0,2,0,0,0,0|2,0,0]=4 1011 B12R1.16 CCNC(=O)c1ccc(cc1)O WXVL_AK00476SD0069 [0,2,0,0,0,0|2,0,0]=4 1012 B12R1.16 CCNC(=O)c1ccc(cc1)S WXVL_AK00476SD0154 [0,2,0,0,0,0|2,0,0]=4 1013 B12R1.16 CCNC(=O)c1ccc(cc1)S WXVL_AK00476SD0154 [0,2,0,0,0,0|2,0,0]=4 1014 B12R1.16 CCNC(=O)c1ccc(nc1)Br WXVL_AK00476SC0352 [0,2,0,0,0,0|1,0,0]=3 1015 B12R1.16 CCNC(=O)c1ccc(nc1)Br WXVL_AK00476SC0352 [0,2,0,0,0,0|1,0,0]=3 1016 B12R1.16 CCNC(=O)c1ccc(nc1)C WXVL_AK00476SC0060 [0,2,0,0,0,0|1,0,0]=3 1017 B12R1.16 CCNC(=O)c1ccc(nc1)C WXVL_AK00476SC0060 [0,2,0,0,0,0|1,0,0]=3 1018 B12R1.16 CCNC(=O)c1ccc(nc1)Cl WXVL_AK00476SC0147 [0,2,0,0,0,0|1,0,0]=3 1019 B12R1.16 CCNC(=O)c1ccc(nc1)Cl WXVL_AK00476SC0147 [0,2,0,0,0,0|1,0,0]=3 1020 B12R1.16 CCNC(=O)c1ccc(nc1)F WXVL_AK00476SC0370 [0,2,0,0,0,0|1,0,0]=3 1021 B12R1.16 CCNC(=O)c1ccc(nc1)F WXVL_AK00476SC0370 [0,2,0,0,0,0|1,0,0]=3 1022 B12R1.16 CCNC(=O)c1ccc(nc1)O WXVL_AK00476SC0057 [0,2,0,0,0,0|1,0,0]=3 1023 B12R1.16 CCNC(=O)c1ccc(nc1)O WXVL_AK00476SC0057 [0,2,0,0,0,0|1,0,0]=3 1024 B12R1.16 CCNC(=O)c1cnc(cn1)C WXVL_AK00476SC0072 [0,2,0,0,0,0|2,0,0]=4 1025 B12R1.16 CCNC(=O)c1cnc(cn1)C WXVL_AK00476SC0072 [0,2,0,0,0,0|2,0,0]=4 1026 B12R1.16 CCNC(=O)c1cnc(cn1)Cl WXVL_AK00476SC0383 [0,2,0,0,0,0|2,0,0]=4 1027 B12R1.16 CCNC(=O)c1cnc(cn1)Cl WXVL_AK00476SC0383 [0,2,0,0,0,0|2,0,0]=4 1028 B12R1.16 CCNC(=O)c1cnc(nc1)C WXVL_AK00476SC0032 [0,2,0,0,0,0|2,0,0]=4 1029 B12R1.16 CCNC(=O)c1cnc(nc1)C WXVL_AK00476SC0032 [0,2,0,0,0,0|2,0,0]=4 1030 B12R1.16 CCNC(=O)c1cnc(nc1)Cl WXVL_AK00476SC0148 [0,2,0,0,0,0|2,0,0]=4 1031 B12R1.16 CCNC(=O)c1cnc(nc1)Cl WXVL_AK00476SC0148 [0,2,0,0,0,0|2,0,0]=4 1032 B12R1.17 CCNC(=O)c1ccc[n+](c1)[O-] WXVL_AK00476SC1039 [0,2,0,0,0,0|1,0,1]=4 1033 B12R1.17 CCNC(=O)c1ccc[n+](c1)[O-] WXVL_AK00476SC1039 [0,2,0,0,0,0|1,0,1]=4 1034 B12R1.17 CCNC(=O)c1cccc(c1)Br WXVL_AK00476SD0041 [0,2,0,0,0,0|2,0,0]=4 1035 B12R1.17 CCNC(=O)c1cccc(c1)Br WXVL_AK00476SD0041 [0,2,0,0,0,0|2,0,0]=4 1036 B12R1.17 CCNC(=O)c1cccc(c1)C WXVL_AK00476SD0056 [0,2,0,0,0,0|2,0,0]=4 1037 B12R1.17 CCNC(=O)c1cccc(c1)C WXVL_AK00476SD0056 [0,2,0,0,0,0|2,0,0]=4 1038 B12R1.17 CCNC(=O)c1cccc(c1)Cl WXVL_AK00476SD0045 [0,2,0,0,0,0|2,0,0]=4 1039 B12R1.17 CCNC(=O)c1cccc(c1)Cl WXVL_AK00476SD0045 [0,2,0,0,0,0|2,0,0]=4 1040 B12R1.17 CCNC(=O)c1cccc(c1)F WXVL_AK00476SD0043 [0,2,0,0,0,0|2,0,0]=4 1041 B12R1.17 CCNC(=O)c1cccc(c1)F WXVL_AK00476SD0043 [0,2,0,0,0,0|2,0,0]=4 1042 B12R1.17 CCNC(=O)c1cccc(c1)I WXVL_AK00476SD0405 [0,2,0,0,0,0|2,0,0]=4 1043 B12R1.17 CCNC(=O)c1cccc(c1)I WXVL_AK00476SD0405 [0,2,0,0,0,0|2,0,0]=4 1044 B12R1.17 CCNC(=O)c1cccc(c1)O WXVL_AK00476SD1724 [0,2,0,0,0,0|2,0,0]=4 1045 B12R1.17 CCNC(=O)c1cccc(c1)O WXVL_AK00476SD1724 [0,2,0,0,0,0|2,0,0]=4 1046 B12R1.17 CCNC(=O)c1cncc(c1)Br WXVL_AK00476SC0369 [0,2,0,0,0,0|1,0,0]=3 1047 B12R1.17 CCNC(=O)c1cncc(c1)Br WXVL_AK00476SC0369 [0,2,0,0,0,0|1,0,0]=3 1048 B12R1.17 CCNC(=O)c1cncc(c1)C WXVL_AK00476SC0095 [0,2,0,0,0,0|1,0,0]=3 1049 B12R1.17 CCNC(=O)c1cncc(c1)C WXVL_AK00476SC0095 [0,2,0,0,0,0|1,0,0]=3 1050 B12R1.17 CCNC(=O)c1cncc(c1)Cl WXVL_AK00476SC0291 [0,2,0,0,0,0|1,0,0]=3 1051 B12R1.17 CCNC(=O)c1cncc(c1)Cl WXVL_AK00476SC0291 [0,2,0,0,0,0|1,0,0]=3 1052 B12R1.17 CCNC(=O)c1cncc(c1)F WXVL_AK00476SC0102 [0,2,0,0,0,0|1,0,0]=3 1053 B12R1.17 CCNC(=O)c1cncc(c1)F WXVL_AK00476SC0102 [0,2,0,0,0,0|1,0,0]=3 1054 B12R1.17 CCNC(=O)c1cncc(c1)O WXVL_AK00476SC0333 [0,2,0,0,0,0|1,0,0]=3 1055 B12R1.17 CCNC(=O)c1cncc(c1)O WXVL_AK00476SC0333 [0,2,0,0,0,0|1,0,0]=3 1056 B12R1.17 CCNC(=O)c1cncc(n1)C WXVL_AK00476SC0391 [0,2,0,0,0,0|2,0,0]=4 1057 B12R1.17 CCNC(=O)c1cncc(n1)C WXVL_AK00476SC0391 [0,2,0,0,0,0|2,0,0]=4 1058 B12R1.17 CCNC(=O)c1cnnc(c1)Cl WXVL_AK00476SC0966 [0,2,0,0,0,0|2,0,0]=4 1059 B12R1.17 CCNC(=O)c1cnnc(c1)Cl WXVL_AK00476SC0966 [0,2,0,0,0,0|2,0,0]=4 1060 B12R1.17 CCNC(=O)c1cnnc(c1)O WXVL_AK00476SC0795 [0,2,0,0,0,0|2,0,0]=4 1061 B12R1.17 CCNC(=O)c1cnnc(c1)O WXVL_AK00476SC0795 [0,2,0,0,0,0|2,0,0]=4 1062 B12R1.30 C=CCNC(=O)c1ccccc1 WXVL_AK00561SD0001 [0,2,0,0,0,0|2,0,0]=4 1063 B12R1.30 C=CCNC(=O)c1ccccc1 WXVL_AK00561SD0001 [0,2,0,0,0,0|2,0,0]=4 1064 B12R1.30 C=CCNC(=O)c1cccnc1 WXVL_AK00561SC0061 [0,2,0,0,0,0|1,0,0]=3 1065 B12R1.30 C=CCNC(=O)c1cccnc1 WXVL_AK00561SC0061 [0,2,0,0,0,0|1,0,0]=3 1066 B12R1.30 C=CCNC(=O)c1cccnn1 WXVL_AK00561SC0374 [0,2,0,0,0,0|2,0,0]=4 1067 B12R1.30 C=CCNC(=O)c1cccnn1 WXVL_AK00561SC0374 [0,2,0,0,0,0|2,0,0]=4 1068 B12R1.30 C=CCNC(=O)c1ccnnc1 WXVL_AK00561SC0064 [0,2,0,0,0,0|2,0,0]=4 1069 B12R1.30 C=CCNC(=O)c1ccnnc1 WXVL_AK00561SC0064 [0,2,0,0,0,0|2,0,0]=4 1070 B12R1.30 C=CCNC(=O)c1cncnc1 WXVL_AK00561SC0097 [0,2,0,0,0,0|2,0,0]=4 1071 B12R1.30 C=CCNC(=O)c1cncnc1 WXVL_AK00561SC0097 [0,2,0,0,0,0|2,0,0]=4 1072 B12R1.30 CCCNC(=O)c1ccccc1 WXVL_AK00504SD0001 [0,2,0,0,0,0|2,0,0]=4 1073 B12R1.30 CCCNC(=O)c1ccccc1 WXVL_AK00504SD0001 [0,2,0,0,0,0|2,0,0]=4 1074 B12R1.30 CCCNC(=O)c1cccnc1 WXVL_AK00504SC0061 [0,2,0,0,0,0|1,0,0]=3 1075 B12R1.30 CCCNC(=O)c1cccnc1 WXVL_AK00504SC0061 [0,2,0,0,0,0|1,0,0]=3 1076 B12R1.30 CCCNC(=O)c1cccnn1 WXVL_AK00504SC0374 [0,2,0,0,0,0|2,0,0]=4 1077 B12R1.30 CCCNC(=O)c1cccnn1 WXVL_AK00504SC0374 [0,2,0,0,0,0|2,0,0]=4 1078 B12R1.30 CCCNC(=O)c1ccnnc1 WXVL_AK00504SC0064 [0,2,0,0,0,0|2,0,0]=4 1079 B12R1.30 CCCNC(=O)c1ccnnc1 WXVL_AK00504SC0064 [0,2,0,0,0,0|2,0,0]=4 1080 B12R1.30 CCCNC(=O)c1cncnc1 WXVL_AK00504SC0097 [0,2,0,0,0,0|2,0,0]=4 1081 B12R1.30 CCCNC(=O)c1cncnc1 WXVL_AK00504SC0097 [0,2,0,0,0,0|2,0,0]=4 1082 B12R1.30 N#CCNC(=O)c1ccccc1 WXVL_AK0683SD0001 [0,2,0,0,0,0|2,0,0]=4 1083 B12R1.30 N#CCNC(=O)c1ccccc1 WXVL_AK0683SD0001 [0,2,0,0,0,0|2,0,0]=4 1084 B12R1.30 N#CCNC(=O)c1cccnc1 WXVL_AK0683SC0061 [0,2,0,0,0,0|1,0,0]=3 1085 B12R1.30 N#CCNC(=O)c1cccnc1 WXVL_AK0683SC0061 [0,2,0,0,0,0|1,0,0]=3 1086 B12R1.30 N#CCNC(=O)c1cccnn1 WXVL_AK0683SC0374 [0,2,0,0,0,0|2,0,0]=4 1087 B12R1.30 N#CCNC(=O)c1cccnn1 WXVL_AK0683SC0374 [0,2,0,0,0,0|2,0,0]=4 1088 B12R1.30 N#CCNC(=O)c1ccnnc1 WXVL_AK0683SC0064 [0,2,0,0,0,0|2,0,0]=4 1089 B12R1.30 N#CCNC(=O)c1ccnnc1 WXVL_AK0683SC0064 [0,2,0,0,0,0|2,0,0]=4 1090 B12R1.30 N#CCNC(=O)c1cncnc1 WXVL_AK0683SC0097 [0,2,0,0,0,0|2,0,0]=4 1091 B12R1.30 N#CCNC(=O)c1cncnc1 WXVL_AK0683SC0097 [0,2,0,0,0,0|2,0,0]=4 1092 B12R1.30 O=C(NCCF)c1ccccc1 WXVL_AK00466SD0001 [0,2,0,0,0,0|2,0,0]=4 1093 B12R1.30 O=C(NCCF)c1ccccc1 WXVL_AK00466SD0001 [0,2,0,0,0,0|2,0,0]=4 1094 B12R1.30 O=C(NCCF)c1cccnc1 WXVL_AK00466SC0061 [0,2,0,0,0,0|1,0,0]=3 1095 B12R1.30 O=C(NCCF)c1cccnc1 WXVL_AK00466SC0061 [0,2,0,0,0,0|1,0,0]=3 1096 B12R1.30 O=C(NCCF)c1cccnn1 WXVL_AK00466SC0374 [0,2,0,0,0,0|2,0,0]=4 1097 B12R1.30 O=C(NCCF)c1cccnn1 WXVL_AK00466SC0374 [0,2,0,0,0,0|2,0,0]=4 1098 B12R1.30 O=C(NCCF)c1ccnnc1 WXVL_AK00466SC0064 [0,2,0,0,0,0|2,0,0]=4 1099 B12R1.30 O=C(NCCF)c1ccnnc1 WXVL_AK00466SC0064 [0,2,0,0,0,0|2,0,0]=4 1100 B12R1.30 O=C(NCCF)c1cncnc1 WXVL_AK00466SC0097 [0,2,0,0,0,0|2,0,0]=4 1101 B12R1.30 O=C(NCCF)c1cncnc1 WXVL_AK00466SC0097 [0,2,0,0,0,0|2,0,0]=4 1102 B12R1.107 CC(C)NC(=O)c1ccccc1 WXVL_AK0030SD0001 [0,2,0,0,0,0|2,0,0]=4 1103 B12R1.107 CC(C)NC(=O)c1ccccc1 WXVL_AK0030SD0001 [0,2,0,0,0,0|2,0,0]=4 1104 B12R1.107 CC(C)NC(=O)c1cccnc1 WXVL_AK0030SC0061 [0,2,0,0,0,0|1,0,0]=3 1105 B12R1.107 CC(C)NC(=O)c1cccnc1 WXVL_AK0030SC0061 [0,2,0,0,0,0|1,0,0]=3 1106 B12R1.107 CC(C)NC(=O)c1cccnn1 WXVL_AK0030SC0374 [0,2,0,0,0,0|2,0,0]=4 1107 B12R1.107 CC(C)NC(=O)c1cccnn1 WXVL_AK0030SC0374 [0,2,0,0,0,0|2,0,0]=4 1108 B12R1.107 CC(C)NC(=O)c1ccnnc1 WXVL_AK0030SC0064 [0,2,0,0,0,0|2,0,0]=4 1109 B12R1.107 CC(C)NC(=O)c1ccnnc1 WXVL_AK0030SC0064 [0,2,0,0,0,0|2,0,0]=4 1110 B12R1.107 CC(C)NC(=O)c1cncnc1 WXVL_AK0030SC0097 [0,2,0,0,0,0|2,0,0]=4 1111 B12R1.107 CC(C)NC(=O)c1cncnc1 WXVL_AK0030SC0097 [0,2,0,0,0,0|2,0,0]=4 1112 B12R1.308 CCNC(=O)c1ccccc1Br WXVL_AK00476SD0002 [0,2,0,0,0,0|2,0,0]=4 1113 B12R1.308 CCNC(=O)c1ccccc1Br WXVL_AK00476SD0002 [0,2,0,0,0,0|2,0,0]=4 1114 B12R1.308 CCNC(=O)c1ccccc1C WXVL_AK00476SD0037 [0,2,0,0,0,0|2,0,0]=4 1115 B12R1.308 CCNC(=O)c1ccccc1C WXVL_AK00476SD0037 [0,2,0,0,0,0|2,0,0]=4 1116 B12R1.308 CCNC(=O)c1ccccc1Cl WXVL_AK00476SD0006 [0,2,0,0,0,0|2,0,0]=4 1117 B12R1.308 CCNC(=O)c1ccccc1Cl WXVL_AK00476SD0006 [0,2,0,0,0,0|2,0,0]=4 1118 B12R1.308 CCNC(=O)c1ccccc1F WXVL_AK00476SD0003 [0,2,0,0,0,0|2,0,0]=4 1119 B12R1.308 CCNC(=O)c1ccccc1F WXVL_AK00476SD0003 [0,2,0,0,0,0|2,0,0]=4 1120 B12R1.308 CCNC(=O)c1ccccc1I WXVL_AK00476SD0303 [0,2,0,0,0,0|2,0,0]=4 1121 B12R1.308 CCNC(=O)c1ccccc1I WXVL_AK00476SD0303 [0,2,0,0,0,0|2,0,0]=4 1122 B12R1.308 CCNC(=O)c1ccccc1O WXVL_AK00476SD00056 [0,2,0,0,0,0|2,0,0]=4 1123 B12R1.308 CCNC(=O)c1ccccc1O WXVL_AK00476SD00056 [0,2,0,0,0,0|2,0,0]=4 1124 B12R1.308 CCNC(=O)c1ccccc1S WXVL_AK00476SD0153 [0,2,0,0,0,0|2,0,0]=4 1125 B12R1.308 CCNC(=O)c1ccccc1S WXVL_AK00476SD0153 [0,2,0,0,0,0|2,0,0]=4 1126 B12R1.308 CCNC(=O)c1cccnc1Br WXVL_AK00476SC0367 [0,2,0,0,0,0|1,0,0]=3 1127 B12R1.308 CCNC(=O)c1cccnc1Br WXVL_AK00476SC0367 [0,2,0,0,0,0|1,0,0]=3 1128 B12R1.308 CCNC(=O)c1cccnc1C WXVL_AK00476SC0065 [0,2,0,0,0,0|1,0,0]=3 1129 B12R1.308 CCNC(=O)c1cccnc1C WXVL_AK00476SC0065 [0,2,0,0,0,0|1,0,0]=3 1130 B12R1.308 CCNC(=O)c1cccnc1Cl WXVL_AK00476SC0146 [0,2,0,0,0,0|1,0,0]=3 1131 B12R1.308 CCNC(=O)c1cccnc1Cl WXVL_AK00476SC0146 [0,2,0,0,0,0|1,0,0]=3 1132 B12R1.308 CCNC(=O)c1cccnc1F WXVL_AK00476SC0350 [0,2,0,0,0,0|1,0,0]=3 1133 B12R1.308 CCNC(=O)c1cccnc1F WXVL_AK00476SC0350 [0,2,0,0,0,0|1,0,0]=3 1134 B12R1.308 CCNC(=O)c1cccnc1O WXVL_AK00476SC0063 [0,2,0,0,0,0|1,0,0]=3 1135 B12R1.308 CCNC(=O)c1cccnc1O WXVL_AK00476SC0063 [0,2,0,0,0,0|1,0,0]=3 1136 B12R1.308 CCNC(=O)c1ccnnc1O WXVL_AK00476SC0899 [0,2,0,0,0,0|2,0,0]=4 1137 B12R1.308 CCNC(=O)c1ccnnc1O WXVL_AK00476SC0899 [0,2,0,0,0,0|2,0,0]=4 1138 B12R1.308 CCNC(=O)c1cnccc1Br WXVL_AK00476SC0500 [0,2,0,0,0,0|1,0,0]=3 1139 B12R1.308 CCNC(=O)c1cnccc1Br WXVL_AK00476SC0500 [0,2,0,0,0,0|1,0,0]=3 1140 B12R1.308 CCNC(=O)c1cnccc1C WXVL_AK00476SC0301 [0,2,0,0,0,0|1,0,0]=3 1141 B12R1.308 CCNC(=O)c1cnccc1C WXVL_AK00476SC0301 [0,2,0,0,0,0|1,0,0]=3 1142 B12R1.308 CCNC(=O)c1cnccc1Cl WXVL_AK00476SC0340 [0,2,0,0,0,0|1,0,0]=3 1143 B12R1.308 CCNC(=O)c1cnccc1Cl WXVL_AK00476SC0340 [0,2,0,0,0,0|1,0,0]=3 1144 B12R1.308 CCNC(=O)c1cncnc1C WXVL_AK00476SC0515 [0,2,0,0,0,0|2,0,0]=4 1145 B12R1.308 CCNC(=O)c1cncnc1C WXVL_AK00476SC0515 [0,2,0,0,0,0|2,0,0]=4 1146 B12R1.308 CCNC(=O)c1cnncc1C WXVL_AK00476SC0973 [0,2,0,0,0,0|2,0,0]=4 1147 B12R1.308 CCNC(=O)c1cnncc1C WXVL_AK00476SC0973 [0,2,0,0,0,0|2,0,0]=4 1148 B12R1.308 CCNC(=O)c1nccnc1Br WXVL_AK00476SC0785 [0,2,0,0,0,0|2,0,0]=4 1149 B12R1.308 CCNC(=O)c1nccnc1Br WXVL_AK00476SC0785 [0,2,0,0,0,0|2,0,0]=4 1150 B12R1.308 CCNC(=O)c1nccnc1Cl WXVL_AK00476SC0361 [0,2,0,0,0,0|2,0,0]=4 1151 B12R1.308 CCNC(=O)c1nccnc1Cl WXVL_AK00476SC0361 [0,2,0,0,0,0|2,0,0]=4 1152 B12R1.5 C#Cc1ccc(cc1)C(=O)NC WXVL_AK00442SD0813 [0,2,0,0,0,0|2,0,0]=4 1153 B12R1.5 C#Cc1ccc(cc1)C(=O)NC WXVL_AK00442SD0813 [0,2,0,0,0,0|2,0,0]=4 1154 B12R1.5 C=Cc1ccc(cc1)C(=O)NC WXVL_AK00442SD0529 [0,2,0,0,0,0|2,0,0]=4 1155 B12R1.5 C=Cc1ccc(cc1)C(=O)NC WXVL_AK00442SD0529 [0,2,0,0,0,0|2,0,0]=4 1156 B12R1.5 CCc1ccc(cc1)C(=O)NC WXVL_AK00442SD0080 [0,2,0,0,0,0|2,0,0]=4 1157 B12R1.5 CCc1ccc(cc1)C(=O)NC WXVL_AK00442SD0080 [0,2,0,0,0,0|2,0,0]=4 1158 B12R1.5 CCc1ccc(cn1)C(=O)NC WXVL_AK00442SC0043 [0,2,0,0,0,0|1,0,0]=3 1159 B12R1.5 CCc1ccc(cn1)C(=O)NC WXVL_AK00442SC0043 [0,2,0,0,0,0|1,0,0]=3 1160 B12R1.5 CNC(=O)c1ccc(cc1)CO WXVL_AK00442SD0451 [0,2,0,0,0,0|2,0,0]=4 1161 B12R1.5 CNC(=O)c1ccc(cc1)CO WXVL_AK00442SD0451 [0,2,0,0,0,0|2,0,0]=4 1162 B12R1.5 CNC(=O)c1ccc(cc1)OC WXVL_AK00442SD0066 [0,2,0,0,0,0|2,0,0]=4 1163 B12R1.5 CNC(=O)c1ccc(cc1)OC WXVL_AK00442SD0066 [0,2,0,0,0,0|2,0,0]=4 1164 B12R1.5 CNC(=O)c1ccc(cc1)SC WXVL_AK00442SD0072 [0,2,0,0,0,0|2,0,0]=4 1165 B12R1.5 CNC(=O)c1ccc(cc1)SC WXVL_AK00442SD0072 [0,2,0,0,0,0|2,0,0]=4 1166 B12R1.5 CNC(=O)c1ccc(nc1)OC WXVL_AK00442SC0019 [0,2,0,0,0,0|1,0,0]=3 1167 B12R1.5 CNC(=O)c1ccc(nc1)OC WXVL_AK00442SC0019 [0,2,0,0,0,0|1,0,0]=3 1168 B12R1.5 CNC(=O)c1ccc(nn1)OC WXVL_AK00442SC0883 [0,2,0,0,0,0|2,0,0]=4 1169 B12R1.5 CNC(=O)c1ccc(nn1)OC WXVL_AK00442SC0883 [0,2,0,0,0,0|2,0,0]=4 1170 B12R1.5 CNC(=O)c1cnc(cn1)OC WXVL_AK00442SC0120 [0,2,0,0,0,0|2,0,0]=4 1171 B12R1.5 CNC(=O)c1cnc(cn1)OC WXVL_AK00442SC0120 [0,2,0,0,0,0|2,0,0]=4 1172 B12R1.5 CNC(=O)c1cnc(nc1)OC WXVL_AK00442SC0509 [0,2,0,0,0,0|2,0,0]=4 1173 B12R1.5 CNC(=O)c1cnc(nc1)OC WXVL_AK00442SC0509 [0,2,0,0,0,0|2,0,0]=4 1174 B12R1.5 CNC(=O)c1cnc(nc1)SC WXVL_AK00442SC0770 [0,2,0,0,0,0|2,0,0]=4 1175 B12R1.5 CNC(=O)c1cnc(nc1)SC WXVL_AK00442SC0770 [0,2,0,0,0,0|2,0,0]=4 1176 B12R1.20 CN(C)C(=O)c1ccc(=O)[nH]c1 WXVL_AN0032SC2212 [0,2,0,0,0,0|1,0,1]=4 1177 B12R1.20 CN(C)C(=O)c1ccc(=O)[nH]c1 WXVL_AN0032SC2212 [0,2,0,0,0,0|1,0,1]=4 1178 B12R1.20 CN(C)C(=O)c1ccc(=O)oc1 WXVL_AN0032SC0132 [0,2,0,0,0,0|2,0,0]=4 1179 B12R1.20 CN(C)C(=O)c1ccc(=O)oc1 WXVL_AN0032SC0132 [0,2,0,0,0,0|2,0,0]=4 1180 B12R1.20 CN(C)C(=O)c1ccc(cc1)Br WXVL_AN0032SD0060 [0,2,0,0,0,0|2,0,0]=4 1181 B12R1.20 CN(C)C(=O)c1ccc(cc1)Br WXVL_AN0032SD0060 [0,2,0,0,0,0|2,0,0]=4 1182 B12R1.20 CN(C)C(=O)c1ccc(cc1)Cl WXVL_AN0032SD0062 [0,2,0,0,0,0|2,0,0]=4 1183 B12R1.20 CN(C)C(=O)c1ccc(cc1)Cl WXVL_AN0032SD0062 [0,2,0,0,0,0|2,0,0]=4 1184 B12R1.20 CN(C)C(=O)c1ccc(cc1)F WXVL_AN0032SD0061 [0,2,0,0,0,0|2,0,0]=4 1185 B12R1.20 CN(C)C(=O)c1ccc(cc1)F WXVL_AN0032SD0061 [0,2,0,0,0,0|2,0,0]=4 1186 B12R1.20 CN(C)C(=O)c1ccc(cc1)I WXVL_AN0032SD0421 [0,2,0,0,0,0|2,0,0]=4 1187 B12R1.20 CN(C)C(=O)c1ccc(cc1)I WXVL_AN0032SD0421 [0,2,0,0,0,0|2,0,0]=4 1188 B12R1.20 CN(C)C(=O)c1ccc(cc1)O WXVL_AN0032SD0069 [0,2,0,0,0,0|2,0,0]=4 1189 B12R1.20 CN(C)C(=O)c1ccc(cc1)O WXVL_AN0032SD0069 [0,2,0,0,0,0|2,0,0]=4 1190 B12R1.20 CN(C)C(=O)c1ccc(cc1)S WXVL_AN0032SD0154 [0,2,0,0,0,0|2,0,0]=4 1191 B12R1.20 CN(C)C(=O)c1ccc(cc1)S WXVL_AN0032SD0154 [0,2,0,0,0,0|2,0,0]=4 1192 B12R1.20 CN(C)C(=O)c1ccc(nc1)Br WXVL_AN0032SC0352 [0,2,0,0,0,0|1,0,0]=3 1193 B12R1.20 CN(C)C(=O)c1ccc(nc1)Br WXVL_AN0032SC0352 [0,2,0,0,0,0|1,0,0]=3 1194 B12R1.20 CN(C)C(=O)c1ccc(nc1)Cl WXVL_AN0032SC0147 [0,2,0,0,0,0|1,0,0]=3 1195 B12R1.20 CN(C)C(=O)c1ccc(nc1)Cl WXVL_AN0032SC0147 [0,2,0,0,0,0|1,0,0]=3 1196 B12R1.20 CN(C)C(=O)c1ccc(nc1)F WXVL_AN0032SC0370 [0,2,0,0,0,0|1,0,0]=3 1197 B12R1.20 CN(C)C(=O)c1ccc(nc1)F WXVL_AN0032SC0370 [0,2,0,0,0,0|1,0,0]=3 1198 B12R1.20 CN(C)C(=O)c1ccc(nc1)O WXVL_AN0032SC0057 [0,2,0,0,0,0|1,0,0]=3 1199 B12R1.20 CN(C)C(=O)c1ccc(nc1)O WXVL_AN0032SC0057 [0,2,0,0,0,0|1,0,0]=3 1200 B12R1.20 CN(C)C(=O)c1cnc(cn1)Cl WXVL_AN0032SC0383 [0,2,0,0,0,0|2,0,0]=4 1201 B12R1.20 CN(C)C(=O)c1cnc(cn1)Cl WXVL_AN0032SC0383 [0,2,0,0,0,0|2,0,0]=4 1202 B12R1.20 CN(C)C(=O)c1cnc(nc1)Cl WXVL_AN0032SC0148 [0,2,0,0,0,0|2,0,0]=4 1203 B12R1.20 CN(C)C(=O)c1cnc(nc1)Cl WXVL_AN0032SC0148 [0,2,0,0,0,0|2,0,0]=4 1204 B12R1.20 Cc1ccc(cc1)C(=O)N(C)C WXVL_AN0032SD0078 [0,2,0,0,0,0|2,0,0]=4 1205 B12R1.20 Cc1ccc(cc1)C(=O)N(C)C WXVL_AN0032SD0078 [0,2,0,0,0,0|2,0,0]=4 1206 B12R1.20 Cc1ccc(cn1)C(=O)N(C)C WXVL_AN0032SC0060 [0,2,0,0,0,0|1,0,0]=3 1207 B12R1.20 Cc1ccc(cn1)C(=O)N(C)C WXVL_AN0032SC0060 [0,2,0,0,0,0|1,0,0]=3 1208 B12R1.20 Cc1cnc(cn1)C(=O)N(C)C WXVL_AN0032SC0072 [0,2,0,0,0,0|2,0,0]=4 1209 B12R1.20 Cc1cnc(cn1)C(=O)N(C)C WXVL_AN0032SC0072 [0,2,0,0,0,0|2,0,0]=4 1210 B12R1.20 Cc1ncc(cn1)C(=O)N(C)C WXVL_AN0032SC0032 [0,2,0,0,0,0|2,0,0]=4 1211 B12R1.20 Cc1ncc(cn1)C(=O)N(C)C WXVL_AN0032SC0032 [0,2,0,0,0,0|2,0,0]=4 1212 B12R1.367 CNC(=O)c1ccc(c(c1)Br)Br WXVL_AK00442SD1271 [0,2,0,0,0,0|2,0,0]=4 1213 B12R1.367 CNC(=O)c1ccc(c(c1)Br)Br WXVL_AK00442SD1271 [0,2,0,0,0,0|2,0,0]=4 1214 B12R1.367 CNC(=O)c1ccc(c(c1)Br)C WXVL_AK00442SD0042 [0,2,0,0,0,0|2,0,0]=4 1215 B12R1.367 CNC(=O)c1ccc(c(c1)Br)C WXVL_AK00442SD0042 [0,2,0,0,0,0|2,0,0]=4 1216 B12R1.367 CNC(=O)c1ccc(c(c1)Br)Cl WXVL_AK00442SD0496 [0,2,0,0,0,0|2,0,0]=4 1217 B12R1.367 CNC(=O)c1ccc(c(c1)Br)Cl WXVL_AK00442SD0496 [0,2,0,0,0,0|2,0,0]=4 1218 B12R1.367 CNC(=O)c1ccc(c(c1)Br)F WXVL_AK00442SD0435 [0,2,0,0,0,0|2,0,0]=4 1219 B12R1.367 CNC(=O)c1ccc(c(c1)Br)F WXVL_AK00442SD0435 [0,2,0,0,0,0|2,0,0]=4 1220 B12R1.367 CNC(=O)c1ccc(c(c1)Br)I WXVL_AK00442SD0333 [0,2,0,0,0,0|2,0,0]=4 1221 B12R1.367 CNC(=O)c1ccc(c(c1)Br)I WXVL_AK00442SD0333 [0,2,0,0,0,0|2,0,0]=4 1222 B12R1.367 CNC(=O)c1ccc(c(c1)Br)O WXVL_AK00442SD0263 [0,2,0,0,0,0|2,0,0]=4 1223 B12R1.367 CNC(=O)c1ccc(c(c1)Br)O WXVL_AK00442SD0263 [0,2,0,0,0,0|2,0,0]=4 1224 B12R1.367 CNC(=O)c1ccc(c(c1)C)Br WXVL_AK00442SD0103 [0,2,0,0,0,0|2,0,0]=4 1225 B12R1.367 CNC(=O)c1ccc(c(c1)C)Br WXVL_AK00442SD0103 [0,2,0,0,0,0|2,0,0]=4 1226 B12R1.367 CNC(=O)c1ccc(c(c1)C)C WXVL_AK00442SD0057 [0,2,0,0,0,0|2,0,0]=4 1227 B12R1.367 CNC(=O)c1ccc(c(c1)C)C WXVL_AK00442SD0057 [0,2,0,0,0,0|2,0,0]=4 1228 B12R1.367 CNC(=O)c1ccc(c(c1)C)Cl WXVL_AK00442SD0115 [0,2,0,0,0,0|2,0,0]=4 1229 B12R1.367 CNC(=O)c1ccc(c(c1)C)Cl WXVL_AK00442SD0115 [0,2,0,0,0,0|2,0,0]=4 1230 B12R1.367 CNC(=O)c1ccc(c(c1)C)F WXVL_AK00442SD0507 [0,2,0,0,0,0|2,0,0]=4 1231 B12R1.367 CNC(=O)c1ccc(c(c1)C)F WXVL_AK00442SD0507 [0,2,0,0,0,0|2,0,0]=4 1232 B12R1.367 CNC(=O)c1ccc(c(c1)C)I WXVL_AK00442SD0536 [0,2,0,0,0,0|2,0,0]=4 1233 B12R1.367 CNC(=O)c1ccc(c(c1)C)I WXVL_AK00442SD0536 [0,2,0,0,0,0|2,0,0]=4 1234 B12R1.367 CNC(=O)c1ccc(c(c1)C)O WXVL_AK00442SD0489 [0,2,0,0,0,0|2,0,0]=4 1235 B12R1.367 CNC(=O)c1ccc(c(c1)C)O WXVL_AK00442SD0489 [0,2,0,0,0,0|2,0,0]=4 1236 B12R1.367 CNC(=O)c1ccc(c(c1)Cl)Br WXVL_AK00442SD0457 [0,2,0,0,0,0|2,0,0]=4 1237 B12R1.367 CNC(=O)c1ccc(c(c1)Cl)Br WXVL_AK00442SD0457 [0,2,0,0,0,0|2,0,0]=4 1238 B12R1.367 CNC(=O)c1ccc(c(c1)Cl)C WXVL_AK00442SD0113 [0,2,0,0,0,0|2,0,0]=4 1239 B12R1.367 CNC(=O)c1ccc(c(c1)Cl)C WXVL_AK00442SD0113 [0,2,0,0,0,0|2,0,0]=4 1240 B12R1.367 CNC(=O)c1ccc(c(c1)Cl)Cl WXVL_AK00442SD0046 [0,2,0,0,0,0|2,0,0]=4 1241 B12R1.367 CNC(=O)c1ccc(c(c1)Cl)Cl WXVL_AK00442SD0046 [0,2,0,0,0,0|2,0,0]=4 1242 B12R1.367 CNC(=O)c1ccc(c(c1)Cl)F WXVL_AK00442SD0107 [0,2,0,0,0,0|2,0,0]=4 1243 B12R1.367 CNC(=O)c1ccc(c(c1)Cl)F WXVL_AK00442SD0107 [0,2,0,0,0,0|2,0,0]=4 1244 B12R1.367 CNC(=O)c1ccc(c(c1)Cl)I WXVL_AK00442SD1017 [0,2,0,0,0,0|2,0,0]=4 1245 B12R1.367 CNC(=O)c1ccc(c(c1)Cl)I WXVL_AK00442SD1017 [0,2,0,0,0,0|2,0,0]=4 1246 B12R1.367 CNC(=O)c1ccc(c(c1)Cl)O WXVL_AK00442SD0177 [0,2,0,0,0,0|2,0,0]=4 1247 B12R1.367 CNC(=O)c1ccc(c(c1)Cl)O WXVL_AK00442SD0177 [0,2,0,0,0,0|2,0,0]=4 1248 B12R1.367 CNC(=O)c1ccc(c(c1)F)Br WXVL_AK00442SD0440 [0,2,0,0,0,0|2,0,0]=4 1249 B12R1.367 CNC(=O)c1ccc(c(c1)F)Br WXVL_AK00442SD0440 [0,2,0,0,0,0|2,0,0]=4 1250 B12R1.367 CNC(=O)c1ccc(c(c1)F)C WXVL_AK00442SD0044 [0,2,0,0,0,0|2,0,0]=4 1251 B12R1.367 CNC(=O)c1ccc(c(c1)F)C WXVL_AK00442SD0044 [0,2,0,0,0,0|2,0,0]=4 1252 B12R1.367 CNC(=O)c1ccc(c(c1)F)Cl WXVL_AK00442SD0414 [0,2,0,0,0,0|2,0,0]=4 1253 B12R1.367 CNC(=O)c1ccc(c(c1)F)Cl WXVL_AK00442SD0414 [0,2,0,0,0,0|2,0,0]=4 1254 B12R1.367 CNC(=O)c1ccc(c(c1)F)F WXVL_AK00442SD0093 [0,2,0,0,0,0|2,0,0]=4 1255 B12R1.367 CNC(=O)c1ccc(c(c1)F)F WXVL_AK00442SD0093 [0,2,0,0,0,0|2,0,0]=4 1256 B12R1.367 CNC(=O)c1ccc(c(c1)F)I WXVL_AK00442SD0316 [0,2,0,0,0,0|2,0,0]=4 1257 B12R1.367 CNC(=O)c1ccc(c(c1)F)I WXVL_AK00442SD0316 [0,2,0,0,0,0|2,0,0]=4 1258 B12R1.367 CNC(=O)c1ccc(c(c1)F)O WXVL_AK00442SD0481 [0,2,0,0,0,0|2,0,0]=4 1259 B12R1.367 CNC(=O)c1ccc(c(c1)F)O WXVL_AK00442SD0481 [0,2,0,0,0,0|2,0,0]=4 1260 B12R1.367 CNC(=O)c1ccc(c(c1)I)C WXVL_AK00442SD0450 [0,2,0,0,0,0|2,0,0]=4 1261 B12R1.367 CNC(=O)c1ccc(c(c1)I)C WXVL_AK00442SD0450 [0,2,0,0,0,0|2,0,0]=4 1262 B12R1.367 CNC(=O)c1ccc(c(c1)I)Cl WXVL_AK00442SD0532 [0,2,0,0,0,0|2,0,0]=4 1263 B12R1.367 CNC(=O)c1ccc(c(c1)I)Cl WXVL_AK00442SD0532 [0,2,0,0,0,0|2,0,0]=4 1264 B12R1.367 CNC(=O)c1ccc(c(c1)I)F WXVL_AK00442SD0814 [0,2,0,0,0,0|2,0,0]=4 1265 B12R1.367 CNC(=O)c1ccc(c(c1)I)F WXVL_AK00442SD0814 [0,2,0,0,0,0|2,0,0]=4 1266 B12R1.367 CNC(=O)c1ccc(c(c1)I)O WXVL_AK00442SD2189 [0,2,0,0,0,0|2,0,0]=4 1267 B12R1.367 CNC(=O)c1ccc(c(c1)I)O WXVL_AK00442SD2189 [0,2,0,0,0,0|2,0,0]=4 1268 B12R1.367 CNC(=O)c1ccc(c(c1)O)Br WXVL_AK00442SD0565 [0,2,0,0,0,0|2,0,0]=4 1269 B12R1.367 CNC(=O)c1ccc(c(c1)O)Br WXVL_AK00442SD0565 [0,2,0,0,0,0|2,0,0]=4 1270 B12R1.367 CNC(=O)c1ccc(c(c1)O)C WXVL_AK00442SD0404 [0,2,0,0,0,0|2,0,0]=4 1271 B12R1.367 CNC(=O)c1ccc(c(c1)O)C WXVL_AK00442SD0404 [0,2,0,0,0,0|2,0,0]=4 1272 B12R1.367 CNC(=O)c1ccc(c(c1)O)Cl WXVL_AK00442SD0487 [0,2,0,0,0,0|2,0,0]=4 1273 B12R1.367 CNC(=O)c1ccc(c(c1)O)Cl WXVL_AK00442SD0487 [0,2,0,0,0,0|2,0,0]=4 1274 B12R1.367 CNC(=O)c1ccc(c(c1)O)F WXVL_AK00442SD0505 [0,2,0,0,0,0|2,0,0]=4 1275 B12R1.367 CNC(=O)c1ccc(c(c1)O)F WXVL_AK00442SD0505 [0,2,0,0,0,0|2,0,0]=4 1276 B12R1.367 CNC(=O)c1ccc(c(c1)O)I WXVL_AK00442SD0354 [0,2,0,0,0,0|2,0,0]=4 1277 B12R1.367 CNC(=O)c1ccc(c(c1)O)I WXVL_AK00442SD0354 [0,2,0,0,0,0|2,0,0]=4 1278 B12R1.367 CNC(=O)c1ccc(c(c1)O)O WXVL_AK00442SD0979 [0,2,0,0,0,0|2,0,0]=4 1279 B12R1.367 CNC(=O)c1ccc(c(c1)O)O WXVL_AK00442SD0979 [0,2,0,0,0,0|2,0,0]=4 1280 B12R1.367 CNC(=O)c1cnc(c(c1)Br)Cl WXVL_AK00442SC0390 [0,2,0,0,0,0|1,0,0]=3 1281 B12R1.367 CNC(=O)c1cnc(c(c1)Br)Cl WXVL_AK00442SC0390 [0,2,0,0,0,0|1,0,0]=3 1282 B12R1.367 CNC(=O)c1cnc(c(c1)Br)O WXVL_AK00442SC0626 [0,2,0,0,0,0|1,0,0]=3 1283 B12R1.367 CNC(=O)c1cnc(c(c1)Br)O WXVL_AK00442SC0626 [0,2,0,0,0,0|1,0,0]=3 1284 B12R1.367 CNC(=O)c1cnc(c(c1)C)C WXVL_AK00442SC1055 [0,2,0,0,0,0|1,0,0]=3 1285 B12R1.367 CNC(=O)c1cnc(c(c1)C)C WXVL_AK00442SC1055 [0,2,0,0,0,0|1,0,0]=3 1286 B12R1.367 CNC(=O)c1cnc(c(c1)C)Cl WXVL_AK00442SC0962 [0,2,0,0,0,0|1,0,0]=3 1287 B12R1.367 CNC(=O)c1cnc(c(c1)C)Cl WXVL_AK00442SC0962 [0,2,0,0,0,0|1,0,0]=3 1288 B12R1.367 CNC(=O)c1cnc(c(c1)C)F WXVL_AK00442SC1078 [0,2,0,0,0,0|1,0,0]=3 1289 B12R1.367 CNC(=O)c1cnc(c(c1)C)F WXVL_AK00442SC1078 [0,2,0,0,0,0|1,0,0]=3 1290 B12R1.367 CNC(=O)c1cnc(c(c1)Cl)Cl WXVL_AK00442SC0389 [0,2,0,0,0,0|1,0,0]=3 1291 B12R1.367 CNC(=O)c1cnc(c(c1)Cl)Cl WXVL_AK00442SC0389 [0,2,0,0,0,0|1,0,0]=3 1292 B12R1.367 CNC(=O)c1cnc(c(c1)Cl)O WXVL_AK00442SC0424 [0,2,0,0,0,0|1,0,0]=3 1293 B12R1.367 CNC(=O)c1cnc(c(c1)Cl)O WXVL_AK00442SC0424 [0,2,0,0,0,0|1,0,0]=3 1294 B12R1.367 CNC(=O)c1cnc(c(c1)F)Cl WXVL_AK00442SC0952 [0,2,0,0,0,0|1,0,0]=3 1295 B12R1.367 CNC(=O)c1cnc(c(c1)F)Cl WXVL_AK00442SC0952 [0,2,0,0,0,0|1,0,0]=3 1296 B12R1.367 CNC(=O)c1cnc(c(c1)I)Cl WXVL_AK00442SC0650 [0,2,0,0,0,0|1,0,0]=3 1297 B12R1.367 CNC(=O)c1cnc(c(c1)I)Cl WXVL_AK00442SC0650 [0,2,0,0,0,0|1,0,0]=3 1298 B12R1.1703 CNC(=O)c1ccc([nH]c1=O)C WXVL_AK00442SC2217 [0,2,0,0,0,0|1,0,1]=4 1299 B12R1.1703 CNC(=O)c1ccc([nH]c1=O)C WXVL_AK00442SC2217 [0,2,0,0,0,0|1,0,1]=4 1300 B12R1.1703 CNC(=O)c1ccc(cc1Br)Br WXVL_AK00442SD0488 [0,2,0,0,0,0|2,0,0]=4 1301 B12R1.1703 CNC(=O)c1ccc(cc1Br)Br WXVL_AK00442SD0488 [0,2,0,0,0,0|2,0,0]=4 1302 B12R1.1703 CNC(=O)c1ccc(cc1Br)C WXVL_AK00442SD1112 [0,2,0,0,0,0|2,0,0]=4 1303 B12R1.1703 CNC(=O)c1ccc(cc1Br)C WXVL_AK00442SD1112 [0,2,0,0,0,0|2,0,0]=4 1304 B12R1.1703 CNC(=O)c1ccc(cc1Br)Cl WXVL_AK00442SD0436 [0,2,0,0,0,0|2,0,0]=4 1305 B12R1.1703 CNC(=O)c1ccc(cc1Br)Cl WXVL_AK00442SD0436 [0,2,0,0,0,0|2,0,0]=4 1306 B12R1.1703 CNC(=O)c1ccc(cc1Br)F WXVL_AK00442SD0119 [0,2,0,0,0,0|2,0,0]=4 1307 B12R1.1703 CNC(=O)c1ccc(cc1Br)F WXVL_AK00442SD0119 [0,2,0,0,0,0|2,0,0]=4 1308 B12R1.1703 CNC(=O)c1ccc(cc1Br)I WXVL_AK00442SD1097 [0,2,0,0,0,0|2,0,0]=4 1309 B12R1.1703 CNC(=O)c1ccc(cc1Br)I WXVL_AK00442SD1097 [0,2,0,0,0,0|2,0,0]=4 1310 B12R1.1703 CNC(=O)c1ccc(cc1Br)O WXVL_AK00442SD1328 [0,2,0,0,0,0|2,0,0]=4 1311 B12R1.1703 CNC(=O)c1ccc(cc1Br)O WXVL_AK00442SD1328 [0,2,0,0,0,0|2,0,0]=4 1312 B12R1.1703 CNC(=O)c1ccc(cc1C)Br WXVL_AK00442SD0441 [0,2,0,0,0,0|2,0,0]=4 1313 B12R1.1703 CNC(=O)c1ccc(cc1C)Br WXVL_AK00442SD0441 [0,2,0,0,0,0|2,0,0]=4 1314 B12R1.1703 CNC(=O)c1ccc(cc1C)C WXVL_AK00442SD0038 [0,2,0,0,0,0|2,0,0]=4 1315 B12R1.1703 CNC(=O)c1ccc(cc1C)C WXVL_AK00442SD0038 [0,2,0,0,0,0|2,0,0]=4 1316 B12R1.1703 CNC(=O)c1ccc(cc1C)Cl WXVL_AK00442SD0114 [0,2,0,0,0,0|2,0,0]=4 1317 B12R1.1703 CNC(=O)c1ccc(cc1C)Cl WXVL_AK00442SD0114 [0,2,0,0,0,0|2,0,0]=4 1318 B12R1.1703 CNC(=O)c1ccc(cc1C)F WXVL_AK00442SD0338 [0,2,0,0,0,0|2,0,0]=4 1319 B12R1.1703 CNC(=O)c1ccc(cc1C)F WXVL_AK00442SD0338 [0,2,0,0,0,0|2,0,0]=4 1320 B12R1.1703 CNC(=O)c1ccc(cc1C)I WXVL_AK00442SD1541 [0,2,0,0,0,0|2,0,0]=4 1321 B12R1.1703 CNC(=O)c1ccc(cc1C)I WXVL_AK00442SD1541 [0,2,0,0,0,0|2,0,0]=4 1322 B12R1.1703 CNC(=O)c1ccc(cc1C)O WXVL_AK00442SD0475 [0,2,0,0,0,0|2,0,0]=4 1323 B12R1.1703 CNC(=O)c1ccc(cc1C)O WXVL_AK00442SD0475 [0,2,0,0,0,0|2,0,0]=4 1324 B12R1.1703 CNC(=O)c1ccc(cc1Cl)Br WXVL_AK00442SD0104 [0,2,0,0,0,0|2,0,0]=4 1325 B12R1.1703 CNC(=O)c1ccc(cc1Cl)Br WXVL_AK00442SD0104 [0,2,0,0,0,0|2,0,0]=4 1326 B12R1.1703 CNC(=O)c1ccc(cc1Cl)C WXVL_AK00442SD0171 [0,2,0,0,0,0|2,0,0]=4 1327 B12R1.1703 CNC(=O)c1ccc(cc1Cl)C WXVL_AK00442SD0171 [0,2,0,0,0,0|2,0,0]=4 1328 B12R1.1703 CNC(=O)c1ccc(cc1Cl)Cl WXVL_AK00442SD0008 [0,2,0,0,0,0|2,0,0]=4 1329 B12R1.1703 CNC(=O)c1ccc(cc1Cl)Cl WXVL_AK00442SD0008 [0,2,0,0,0,0|2,0,0]=4 1330 B12R1.1703 CNC(=O)c1ccc(cc1Cl)F WXVL_AK00442SD0091 [0,2,0,0,0,0|2,0,0]=4 1331 B12R1.1703 CNC(=O)c1ccc(cc1Cl)F WXVL_AK00442SD0091 [0,2,0,0,0,0|2,0,0]=4 1332 B12R1.1703 CNC(=O)c1ccc(cc1Cl)I WXVL_AK00442SD0324 [0,2,0,0,0,0|2,0,0]=4 1333 B12R1.1703 CNC(=O)c1ccc(cc1Cl)I WXVL_AK00442SD0324 [0,2,0,0,0,0|2,0,0]=4 1334 B12R1.1703 CNC(=O)c1ccc(cc1Cl)O WXVL_AK00442SD0179 [0,2,0,0,0,0|2,0,0]=4 1335 B12R1.1703 CNC(=O)c1ccc(cc1Cl)O WXVL_AK00442SD0179 [0,2,0,0,0,0|2,0,0]=4 1336 B12R1.1703 CNC(=O)c1ccc(cc1F)Br WXVL_AK00442SD0127 [0,2,0,0,0,0|2,0,0]=4 1337 B12R1.1703 CNC(=O)c1ccc(cc1F)Br WXVL_AK00442SD0127 [0,2,0,0,0,0|2,0,0]=4 1338 B12R1.1703 CNC(=O)c1ccc(cc1F)C WXVL_AK00442SD0394 [0,2,0,0,0,0|2,0,0]=4 1339 B12R1.1703 CNC(=O)c1ccc(cc1F)C WXVL_AK00442SD0394 [0,2,0,0,0,0|2,0,0]=4 1340 B12R1.1703 CNC(=O)c1ccc(cc1F)Cl WXVL_AK00442SD0106 [0,2,0,0,0,0|2,0,0]=4 1341 B12R1.1703 CNC(=O)c1ccc(cc1F)Cl WXVL_AK00442SD0106 [0,2,0,0,0,0|2,0,0]=4 1342 B12R1.1703 CNC(=O)c1ccc(cc1F)F WXVL_AK00442SD0092 [0,2,0,0,0,0|2,0,0]=4 1343 B12R1.1703 CNC(=O)c1ccc(cc1F)F WXVL_AK00442SD0092 [0,2,0,0,0,0|2,0,0]=4 1344 B12R1.1703 CNC(=O)c1ccc(cc1F)I WXVL_AK00442SD0313 [0,2,0,0,0,0|2,0,0]=4 1345 B12R1.1703 CNC(=O)c1ccc(cc1F)I WXVL_AK00442SD0313 [0,2,0,0,0,0|2,0,0]=4 1346 B12R1.1703 CNC(=O)c1ccc(cc1F)O WXVL_AK00442SD0499 [0,2,0,0,0,0|2,0,0]=4 1347 B12R1.1703 CNC(=O)c1ccc(cc1F)O WXVL_AK00442SD0499 [0,2,0,0,0,0|2,0,0]=4 1348 B12R1.1703 CNC(=O)c1ccc(cc1I)Br WXVL_AK00442SD1410 [0,2,0,0,0,0|2,0,0]=4 1349 B12R1.1703 CNC(=O)c1ccc(cc1I)Br WXVL_AK00442SD1410 [0,2,0,0,0,0|2,0,0]=4 1350 B12R1.1703 CNC(=O)c1ccc(cc1I)C WXVL_AK00442SD1846 [0,2,0,0,0,0|2,0,0]=4 1351 B12R1.1703 CNC(=O)c1ccc(cc1I)C WXVL_AK00442SD1846 [0,2,0,0,0,0|2,0,0]=4 1352 B12R1.1703 CNC(=O)c1ccc(cc1I)Cl WXVL_AK00442SD0323 [0,2,0,0,0,0|2,0,0]=4 1353 B12R1.1703 CNC(=O)c1ccc(cc1I)Cl WXVL_AK00442SD0323 [0,2,0,0,0,0|2,0,0]=4 1354 B12R1.1703 CNC(=O)c1ccc(cc1I)F WXVL_AK00442SD0315 [0,2,0,0,0,0|2,0,0]=4 1355 B12R1.1703 CNC(=O)c1ccc(cc1I)F WXVL_AK00442SD0315 [0,2,0,0,0,0|2,0,0]=4 1356 B12R1.1703 CNC(=O)c1ccc(cc1O)Br WXVL_AK00442SD0411 [0,2,0,0,0,0|2,0,0]=4 1357 B12R1.1703 CNC(=O)c1ccc(cc1O)Br WXVL_AK00442SD0411 [0,2,0,0,0,0|2,0,0]=4 1358 B12R1.1703 CNC(=O)c1ccc(cc1O)C WXVL_AK00442SD0148 [0,2,0,0,0,0|2,0,0]=4 1359 B12R1.1703 CNC(=O)c1ccc(cc1O)C WXVL_AK00442SD0148 [0,2,0,0,0,0|2,0,0]=4 1360 B12R1.1703 CNC(=O)c1ccc(cc1O)Cl WXVL_AK00442SD0550 [0,2,0,0,0,0|2,0,0]=4 1361 B12R1.1703 CNC(=O)c1ccc(cc1O)Cl WXVL_AK00442SD0550 [0,2,0,0,0,0|2,0,0]=4 1362 B12R1.1703 CNC(=O)c1ccc(cc1O)F WXVL_AK00442SD0561 [0,2,0,0,0,0|2,0,0]=4 1363 B12R1.1703 CNC(=O)c1ccc(cc1O)F WXVL_AK00442SD0561 [0,2,0,0,0,0|2,0,0]=4 1364 B12R1.1703 CNC(=O)c1ccc(cc1O)I WXVL_AK00442SD0717 [0,2,0,0,0,0|2,0,0]=4 1365 B12R1.1703 CNC(=O)c1ccc(cc1O)I WXVL_AK00442SD0717 [0,2,0,0,0,0|2,0,0]=4 1366 B12R1.1703 CNC(=O)c1ccc(cc1O)O WXVL_AK00442SD0149 [0,2,0,0,0,0|2,0,0]=4 1367 B12R1.1703 CNC(=O)c1ccc(cc1O)O WXVL_AK00442SD0149 [0,2,0,0,0,0|2,0,0]=4 1368 B12R1.1703 CNC(=O)c1ccc(nc1Br)Br WXVL_AK00442SC0673 [0,2,0,0,0,0|1,0,0]=3 1369 B12R1.1703 CNC(=O)c1ccc(nc1Br)Br WXVL_AK00442SC0673 [0,2,0,0,0,0|1,0,0]=3 1370 B12R1.1703 CNC(=O)c1ccc(nc1C)Br WXVL_AK00442SC0965 [0,2,0,0,0,0|1,0,0]=3 1371 B12R1.1703 CNC(=O)c1ccc(nc1C)Br WXVL_AK00442SC0965 [0,2,0,0,0,0|1,0,0]=3 1372 B12R1.1703 CNC(=O)c1ccc(nc1C)C WXVL_AK00442SC0897 [0,2,0,0,0,0|1,0,0]=3 1373 B12R1.1703 CNC(=O)c1ccc(nc1C)C WXVL_AK00442SC0897 [0,2,0,0,0,0|1,0,0]=3 1374 B12R1.1703 CNC(=O)c1ccc(nc1C)Cl WXVL_AK00442SC0240 [0,2,0,0,0,0|1,0,0]=3 1375 B12R1.1703 CNC(=O)c1ccc(nc1C)Cl WXVL_AK00442SC0240 [0,2,0,0,0,0|1,0,0]=3 1376 B12R1.1703 CNC(=O)c1ccc(nc1C)F WXVL_AK00442SC0792 [0,2,0,0,0,0|1,0,0]=3 1377 B12R1.1703 CNC(=O)c1ccc(nc1C)F WXVL_AK00442SC0792 [0,2,0,0,0,0|1,0,0]=3 1378 B12R1.1703 CNC(=O)c1ccc(nc1Cl)Cl WXVL_AK00442SC0357 [0,2,0,0,0,0|1,0,0]=3 1379 B12R1.1703 CNC(=O)c1ccc(nc1Cl)Cl WXVL_AK00442SC0357 [0,2,0,0,0,0|1,0,0]=3 1380 B12R1.1703 CNC(=O)c1ccc(nc1Cl)O WXVL_AK00442SC0689 [0,2,0,0,0,0|1,0,0]=3 1381 B12R1.1703 CNC(=O)c1ccc(nc1Cl)O WXVL_AK00442SC0689 [0,2,0,0,0,0|1,0,0]=3 1382 B12R1.1703 CNC(=O)c1ccc(nc1F)Br WXVL_AK00442SC1029 [0,2,0,0,0,0|1,0,0]=3 1383 B12R1.1703 CNC(=O)c1ccc(nc1F)Br WXVL_AK00442SC1029 [0,2,0,0,0,0|1,0,0]=3 1384 B12R1.1703 CNC(=O)c1ccc(nc1F)Cl WXVL_AK00442SC1033 [0,2,0,0,0,0|1,0,0]=3 1385 B12R1.1703 CNC(=O)c1ccc(nc1F)Cl WXVL_AK00442SC1033 [0,2,0,0,0,0|1,0,0]=3 1386 B12R1.1703 CNC(=O)c1ccc(nc1F)F WXVL_AK00442SC0149 [0,2,0,0,0,0|1,0,0]=3 1387 B12R1.1703 CNC(=O)c1ccc(nc1F)F WXVL_AK00442SC0149 [0,2,0,0,0,0|1,0,0]=3 1388 B12R1.1703 CNC(=O)c1cnc(cc1C)Cl WXVL_AK00442SC0997 [0,2,0,0,0,0|1,0,0]=3 1389 B12R1.1703 CNC(=O)c1cnc(cc1C)Cl WXVL_AK00442SC0997 [0,2,0,0,0,0|1,0,0]=3 1390 B12R1.1703 CNC(=O)c1cnc(cc1C)F WXVL_AK00442SC1066 [0,2,0,0,0,0|1,0,0]=3 1391 B12R1.1703 CNC(=O)c1cnc(cc1C)F WXVL_AK00442SC1066 [0,2,0,0,0,0|1,0,0]=3 1392 B12R1.1703 CNC(=O)c1cnc(cc1Cl)Cl WXVL_AK00442SC0010 [0,2,0,0,0,0|1,0,0]=3 1393 B12R1.1703 CNC(=O)c1cnc(cc1Cl)Cl WXVL_AK00442SC0010 [0,2,0,0,0,0|1,0,0]=3 1394 B12R1.1703 CNC(=O)c1cnc(cc1I)Cl WXVL_AK00442SC2048 [0,2,0,0,0,0|1,0,0]=3 1395 B12R1.1703 CNC(=O)c1cnc(cc1I)Cl WXVL_AK00442SC2048 [0,2,0,0,0,0|1,0,0]=3 1396 B12R1.1703 CNC(=O)c1cnc(cc1O)O WXVL_AK00442SC0656 [0,2,0,0,0,0|1,0,0]=3 1397 B12R1.1703 CNC(=O)c1cnc(cc1O)O WXVL_AK00442SC0656 [0,2,0,0,0,0|1,0,0]=3 1398 B12R1.1703 CNC(=O)c1cnc(nc1C)C WXVL_AK00442SC0028 [0,2,0,0,0,0|2,0,0]=4 1399 B12R1.1703 CNC(=O)c1cnc(nc1C)C WXVL_AK00442SC0028 [0,2,0,0,0,0|2,0,0]=4 1400 B12R1.1703 CNC(=O)c1cnc(nc1O)O WXVL_AK00442SC0142 [0,2,0,0,0,0|2,0,0]=4 1401 B12R1.1703 CNC(=O)c1cnc(nc1O)O WXVL_AK00442SC0142 [0,2,0,0,0,0|2,0,0]=4 1402 B12R1.24 CNC(=O)c1cccc(c1Br)Br WXVL_AK00442SD1269 [0,2,0,0,0,0|2,0,0]=4 1403 B12R1.24 CNC(=O)c1cccc(c1Br)Br WXVL_AK00442SD1269 [0,2,0,0,0,0|2,0,0]=4 1404 B12R1.24 CNC(=O)c1cccc(c1Br)C WXVL_AK00442SD0617 [0,2,0,0,0,0|2,0,0]=4 1405 B12R1.24 CNC(=O)c1cccc(c1Br)C WXVL_AK00442SD0617 [0,2,0,0,0,0|2,0,0]=4 1406 B12R1.24 CNC(=O)c1cccc(c1Br)Cl WXVL_AK00442SD0290 [0,2,0,0,0,0|2,0,0]=4 1407 B12R1.24 CNC(=O)c1cccc(c1Br)Cl WXVL_AK00442SD0290 [0,2,0,0,0,0|2,0,0]=4 1408 B12R1.24 CNC(=O)c1cccc(c1Br)F WXVL_AK00442SD1450 [0,2,0,0,0,0|2,0,0]=4 1409 B12R1.24 CNC(=O)c1cccc(c1Br)F WXVL_AK00442SD1450 [0,2,0,0,0,0|2,0,0]=4 1410 B12R1.24 CNC(=O)c1cccc(c1C)Br WXVL_AK00442SD0415 [0,2,0,0,0,0|2,0,0]=4 1411 B12R1.24 CNC(=O)c1cccc(c1C)Br WXVL_AK00442SD0415 [0,2,0,0,0,0|2,0,0]=4 1412 B12R1.24 CNC(=O)c1cccc(c1C)C WXVL_AK00442SD0552 [0,2,0,0,0,0|2,0,0]=4 1413 B12R1.24 CNC(=O)c1cccc(c1C)C WXVL_AK00442SD0552 [0,2,0,0,0,0|2,0,0]=4 1414 B12R1.24 CNC(=O)c1cccc(c1C)Cl WXVL_AK00442SD0117 [0,2,0,0,0,0|2,0,0]=4 1415 B12R1.24 CNC(=O)c1cccc(c1C)Cl WXVL_AK00442SD0117 [0,2,0,0,0,0|2,0,0]=4 1416 B12R1.24 CNC(=O)c1cccc(c1C)F WXVL_AK00442SD0123 [0,2,0,0,0,0|2,0,0]=4 1417 B12R1.24 CNC(=O)c1cccc(c1C)F WXVL_AK00442SD0123 [0,2,0,0,0,0|2,0,0]=4 1418 B12R1.24 CNC(=O)c1cccc(c1C)I WXVL_AK00442SD0312 [0,2,0,0,0,0|2,0,0]=4 1419 B12R1.24 CNC(=O)c1cccc(c1C)I WXVL_AK00442SD0312 [0,2,0,0,0,0|2,0,0]=4 1420 B12R1.24 CNC(=O)c1cccc(c1C)O WXVL_AK00442SD0711 [0,2,0,0,0,0|2,0,0]=4 1421 B12R1.24 CNC(=O)c1cccc(c1C)O WXVL_AK00442SD0711 [0,2,0,0,0,0|2,0,0]=4 1422 B12R1.24 CNC(=O)c1cccc(c1Cl)Br WXVL_AK00442SD0291 [0,2,0,0,0,0|2,0,0]=4 1423 B12R1.24 CNC(=O)c1cccc(c1Cl)Br WXVL_AK00442SD0291 [0,2,0,0,0,0|2,0,0]=4 1424 B12R1.24 CNC(=O)c1cccc(c1Cl)C WXVL_AK00442SD0170 [0,2,0,0,0,0|2,0,0]=4 1425 B12R1.24 CNC(=O)c1cccc(c1Cl)C WXVL_AK00442SD0170 [0,2,0,0,0,0|2,0,0]=4 1426 B12R1.24 CNC(=O)c1cccc(c1Cl)Cl WXVL_AK00442SD0007 [0,2,0,0,0,0|2,0,0]=4 1427 B12R1.24 CNC(=O)c1cccc(c1Cl)Cl WXVL_AK00442SD0007 [0,2,0,0,0,0|2,0,0]=4 1428 B12R1.24 CNC(=O)c1cccc(c1Cl)F WXVL_AK00442SD0533 [0,2,0,0,0,0|2,0,0]=4 1429 B12R1.24 CNC(=O)c1cccc(c1Cl)F WXVL_AK00442SD0533 [0,2,0,0,0,0|2,0,0]=4 1430 B12R1.24 CNC(=O)c1cccc(c1Cl)I WXVL_AK00442SD2528 [0,2,0,0,0,0|2,0,0]=4 1431 B12R1.24 CNC(=O)c1cccc(c1Cl)I WXVL_AK00442SD2528 [0,2,0,0,0,0|2,0,0]=4 1432 B12R1.24 CNC(=O)c1cccc(c1Cl)O WXVL_AK00442SD1045 [0,2,0,0,0,0|2,0,0]=4 1433 B12R1.24 CNC(=O)c1cccc(c1Cl)O WXVL_AK00442SD1045 [0,2,0,0,0,0|2,0,0]=4 1434 B12R1.24 CNC(=O)c1cccc(c1F)Br WXVL_AK00442SD0434 [0,2,0,0,0,0|2,0,0]=4 1435 B12R1.24 CNC(=O)c1cccc(c1F)Br WXVL_AK00442SD0434 [0,2,0,0,0,0|2,0,0]=4 1436 B12R1.24 CNC(=O)c1cccc(c1F)C WXVL_AK00442SD0108 [0,2,0,0,0,0|2,0,0]=4 1437 B12R1.24 CNC(=O)c1cccc(c1F)C WXVL_AK00442SD0108 [0,2,0,0,0,0|2,0,0]=4 1438 B12R1.24 CNC(=O)c1cccc(c1F)Cl WXVL_AK00442SD0498 [0,2,0,0,0,0|2,0,0]=4 1439 B12R1.24 CNC(=O)c1cccc(c1F)Cl WXVL_AK00442SD0498 [0,2,0,0,0,0|2,0,0]=4 1440 B12R1.24 CNC(=O)c1cccc(c1F)F WXVL_AK00442SD0089 [0,2,0,0,0,0|2,0,0]=4 1441 B12R1.24 CNC(=O)c1cccc(c1F)F WXVL_AK00442SD0089 [0,2,0,0,0,0|2,0,0]=4 1442 B12R1.24 CNC(=O)c1cccc(c1F)I WXVL_AK00442SD0783 [0,2,0,0,0,0|2,0,0]=4 1443 B12R1.24 CNC(=O)c1cccc(c1F)I WXVL_AK00442SD0783 [0,2,0,0,0,0|2,0,0]=4 1444 B12R1.24 CNC(=O)c1cccc(c1F)O WXVL_AK00442SD0583 [0,2,0,0,0,0|2,0,0]=4 1445 B12R1.24 CNC(=O)c1cccc(c1F)O WXVL_AK00442SD0583 [0,2,0,0,0,0|2,0,0]=4 1446 B12R1.24 CNC(=O)c1cccc(c1I)C WXVL_AK00442SD0540 [0,2,0,0,0,0|2,0,0]=4 1447 B12R1.24 CNC(=O)c1cccc(c1I)C WXVL_AK00442SD0540 [0,2,0,0,0,0|2,0,0]=4 1448 B12R1.24 CNC(=O)c1cccc(c1I)Cl WXVL_AK00442SD1616 [0,2,0,0,0,0|2,0,0]=4 1449 B12R1.24 CNC(=O)c1cccc(c1I)Cl WXVL_AK00442SD1616 [0,2,0,0,0,0|2,0,0]=4 1450 B12R1.24 CNC(=O)c1cccc(c1I)F WXVL_AK00442SD0816 [0,2,0,0,0,0|2,0,0]=4 1451 B12R1.24 CNC(=O)c1cccc(c1I)F WXVL_AK00442SD0816 [0,2,0,0,0,0|2,0,0]=4 1452 B12R1.24 CNC(=O)c1cccc(c1O)Br WXVL_AK00442SD0745 [0,2,0,0,0,0|2,0,0]=4 1453 B12R1.24 CNC(=O)c1cccc(c1O)Br WXVL_AK00442SD0745 [0,2,0,0,0,0|2,0,0]=4 1454 B12R1.24 CNC(=O)c1cccc(c1O)C WXVL_AK00442SD1710 [0,2,0,0,0,0|2,0,0]=4 1455 B12R1.24 CNC(=O)c1cccc(c1O)C WXVL_AK00442SD1710 [0,2,0,0,0,0|2,0,0]=4 1456 B12R1.24 CNC(=O)c1cccc(c1O)Cl WXVL_AK00442SD0178 [0,2,0,0,0,0|2,0,0]=4 1457 B12R1.24 CNC(=O)c1cccc(c1O)Cl WXVL_AK00442SD0178 [0,2,0,0,0,0|2,0,0]=4 1458 B12R1.24 CNC(=O)c1cccc(c1O)F WXVL_AK00442SD0514 [0,2,0,0,0,0|2,0,0]=4 1459 B12R1.24 CNC(=O)c1cccc(c1O)F WXVL_AK00442SD0514 [0,2,0,0,0,0|2,0,0]=4 1460 B12R1.24 CNC(=O)c1cccc(c1O)O WXVL_AK00442SD0025 [0,2,0,0,0,0|2,0,0]=4 1461 B12R1.24 CNC(=O)c1cccc(c1O)O WXVL_AK00442SD0025 [0,2,0,0,0,0|2,0,0]=4 1462 B12R1.24 CNC(=O)c1cccn(c1=O)C WXVL_AK00442SC0012 [0,2,0,0,0,0|1,0,1]=4 1463 B12R1.24 CNC(=O)c1cccn(c1=O)C WXVL_AK00442SC0012 [0,2,0,0,0,0|1,0,1]=4 1464 B12R1.24 CNC(=O)c1cncc(c1C)Br WXVL_AK00442SC1094 [0,2,0,0,0,0|1,0,0]=3 1465 B12R1.24 CNC(=O)c1cncc(c1C)Br WXVL_AK00442SC1094 [0,2,0,0,0,0|1,0,0]=3 1466 B12R1.225 CN(C)C(=O)c1ccc[n+](c1)[O-] WXVL_AN0032SC1039 [0,2,0,0,0,0|1,0,1]=4 1467 B12R1.225 CN(C)C(=O)c1ccc[n+](c1)[O-] WXVL_AN0032SC1039 [0,2,0,0,0,0|1,0,1]=4 1468 B12R1.225 CN(C)C(=O)c1cccc(c1)Br WXVL_AN0032SD0041 [0,2,0,0,0,0|2,0,0]=4 1469 B12R1.225 CN(C)C(=O)c1cccc(c1)Br WXVL_AN0032SD0041 [0,2,0,0,0,0|2,0,0]=4 1470 B12R1.225 CN(C)C(=O)c1cccc(c1)Cl WXVL_AN0032SD0045 [0,2,0,0,0,0|2,0,0]=4 1471 B12R1.225 CN(C)C(=O)c1cccc(c1)Cl WXVL_AN0032SD0045 [0,2,0,0,0,0|2,0,0]=4 1472 B12R1.225 CN(C)C(=O)c1cccc(c1)F WXVL_AN0032SD0043 [0,2,0,0,0,0|2,0,0]=4 1473 B12R1.225 CN(C)C(=O)c1cccc(c1)F WXVL_AN0032SD0043 [0,2,0,0,0,0|2,0,0]=4 1474 B12R1.225 CN(C)C(=O)c1cccc(c1)I WXVL_AN0032SD0405 [0,2,0,0,0,0|2,0,0]=4 1475 B12R1.225 CN(C)C(=O)c1cccc(c1)I WXVL_AN0032SD0405 [0,2,0,0,0,0|2,0,0]=4 1476 B12R1.225 CN(C)C(=O)c1cccc(c1)O WXVL_AN0032SD1724 [0,2,0,0,0,0|2,0,0]=4 1477 B12R1.225 CN(C)C(=O)c1cccc(c1)O WXVL_AN0032SD1724 [0,2,0,0,0,0|2,0,0]=4 1478 B12R1.225 CN(C)C(=O)c1cncc(c1)Br WXVL_AN0032SC0369 [0,2,0,0,0,0|1,0,0]=3 1479 B12R1.225 CN(C)C(=O)c1cncc(c1)Br WXVL_AN0032SC0369 [0,2,0,0,0,0|1,0,0]=3 1480 B12R1.225 CN(C)C(=O)c1cncc(c1)Cl WXVL_AN0032SC0291 [0,2,0,0,0,0|1,0,0]=3 1481 B12R1.225 CN(C)C(=O)c1cncc(c1)Cl WXVL_AN0032SC0291 [0,2,0,0,0,0|1,0,0]=3 1482 B12R1.225 CN(C)C(=O)c1cncc(c1)F WXVL_AN0032SC0102 [0,2,0,0,0,0|1,0,0]=3 1483 B12R1.225 CN(C)C(=O)c1cncc(c1)F WXVL_AN0032SC0102 [0,2,0,0,0,0|1,0,0]=3 1484 B12R1.225 CN(C)C(=O)c1cncc(c1)O WXVL_AN0032SC0333 [0,2,0,0,0,0|1,0,0]=3 1485 B12R1.225 CN(C)C(=O)c1cncc(c1)O WXVL_AN0032SC0333 [0,2,0,0,0,0|1,0,0]=3 1486 B12R1.225 CN(C)C(=O)c1cnnc(c1)Cl WXVL_AN0032SC0966 [0,2,0,0,0,0|2,0,0]=4 1487 B12R1.225 CN(C)C(=O)c1cnnc(c1)Cl WXVL_AN0032SC0966 [0,2,0,0,0,0|2,0,0]=4 1488 B12R1.225 CN(C)C(=O)c1cnnc(c1)O WXVL_AN0032SC0795 [0,2,0,0,0,0|2,0,0]=4 1489 B12R1.225 CN(C)C(=O)c1cnnc(c1)O WXVL_AN0032SC0795 [0,2,0,0,0,0|2,0,0]=4 1490 B12R1.225 Cc1cccc(c1)C(=O)N(C)C WXVL_AN0032SD0056 [0,2,0,0,0,0|2,0,0]=4 1491 B12R1.225 Cc1cccc(c1)C(=O)N(C)C WXVL_AN0032SD0056 [0,2,0,0,0,0|2,0,0]=4 1492 B12R1.225 Cc1cncc(c1)C(=O)N(C)C WXVL_AN0032SC0095 [0,2,0,0,0,0|1,0,0]=3 1493 B12R1.225 Cc1cncc(c1)C(=O)N(C)C WXVL_AN0032SC0095 [0,2,0,0,0,0|1,0,0]=3 1494 B12R1.225 Cc1cncc(n1)C(=O)N(C)C WXVL_AN0032SC0391 [0,2,0,0,0,0|2,0,0]=4 1495 B12R1.225 Cc1cncc(n1)C(=O)N(C)C WXVL_AN0032SC0391 [0,2,0,0,0,0|2,0,0]=4 1496 B12R1.354 CNC(=O)c1cc(ccc1Br)Br WXVL_AK00442SD0449 [0,2,0,0,0,0|2,0,0]=4 1497 B12R1.354 CNC(=O)c1cc(ccc1Br)Br WXVL_AK00442SD0449 [0,2,0,0,0,0|2,0,0]=4 1498 B12R1.354 CNC(=O)c1cc(ccc1Br)C WXVL_AK00442SD0598 [0,2,0,0,0,0|2,0,0]=4 1499 B12R1.354 CNC(=O)c1cc(ccc1Br)C WXVL_AK00442SD0598 [0,2,0,0,0,0|2,0,0]=4 1500 B12R1.354 CNC(=O)c1cc(ccc1Br)Cl WXVL_AK00442SD0426 [0,2,0,0,0,0|2,0,0]=4 1501 B12R1.354 CNC(=O)c1cc(ccc1Br)Cl WXVL_AK00442SD0426 [0,2,0,0,0,0|2,0,0]=4 1502 B12R1.354 CNC(=O)c1cc(ccc1Br)F WXVL_AK00442SD0126 [0,2,0,0,0,0|2,0,0]=4 1503 B12R1.354 CNC(=O)c1cc(ccc1Br)F WXVL_AK00442SD0126 [0,2,0,0,0,0|2,0,0]=4 1504 B12R1.354 CNC(=O)c1cc(ccc1Br)I WXVL_AK00442SD0332 [0,2,0,0,0,0|2,0,0]=4 1505 B12R1.354 CNC(=O)c1cc(ccc1Br)I WXVL_AK00442SD0332 [0,2,0,0,0,0|2,0,0]=4 1506 B12R1.354 CNC(=O)c1cc(ccc1Br)O WXVL_AK00442SD1131 [0,2,0,0,0,0|2,0,0]=4 1507 B12R1.354 CNC(=O)c1cc(ccc1Br)O WXVL_AK00442SD1131 [0,2,0,0,0,0|2,0,0]=4 1508 B12R1.354 CNC(=O)c1cc(ccc1C)Br WXVL_AK00442SD0407 [0,2,0,0,0,0|2,0,0]=4 1509 B12R1.354 CNC(=O)c1cc(ccc1C)Br WXVL_AK00442SD0407 [0,2,0,0,0,0|2,0,0]=4 1510 B12R1.354 CNC(=O)c1cc(ccc1C)C WXVL_AK00442SD0146 [0,2,0,0,0,0|2,0,0]=4 1511 B12R1.354 CNC(=O)c1cc(ccc1C)C WXVL_AK00442SD0146 [0,2,0,0,0,0|2,0,0]=4 1512 B12R1.354 CNC(=O)c1cc(ccc1C)Cl WXVL_AK00442SD0169 [0,2,0,0,0,0|2,0,0]=4 1513 B12R1.354 CNC(=O)c1cc(ccc1C)Cl WXVL_AK00442SD0169 [0,2,0,0,0,0|2,0,0]=4 1514 B12R1.354 CNC(=O)c1cc(ccc1C)F WXVL_AK00442SD0105 [0,2,0,0,0,0|2,0,0]=4 1515 B12R1.354 CNC(=O)c1cc(ccc1C)F WXVL_AK00442SD0105 [0,2,0,0,0,0|2,0,0]=4 1516 B12R1.354 CNC(=O)c1cc(ccc1C)I WXVL_AK00442SD0430 [0,2,0,0,0,0|2,0,0]=4 1517 B12R1.354 CNC(=O)c1cc(ccc1C)I WXVL_AK00442SD0430 [0,2,0,0,0,0|2,0,0]=4 1518 B12R1.354 CNC(=O)c1cc(ccc1C)O WXVL_AK00442SD0424 [0,2,0,0,0,0|2,0,0]=4 1519 B12R1.354 CNC(=O)c1cc(ccc1C)O WXVL_AK00442SD0424 [0,2,0,0,0,0|2,0,0]=4 1520 B12R1.354 CNC(=O)c1cc(ccc1Cl)Br WXVL_AK00442SD0009 [0,2,0,0,0,0|2,0,0]=4 1521 B12R1.354 CNC(=O)c1cc(ccc1Cl)Br WXVL_AK00442SD0009 [0,2,0,0,0,0|2,0,0]=4 1522 B12R1.354 CNC(=O)c1cc(ccc1Cl)C WXVL_AK00442SD0473 [0,2,0,0,0,0|2,0,0]=4 1523 B12R1.354 CNC(=O)c1cc(ccc1Cl)C WXVL_AK00442SD0473 [0,2,0,0,0,0|2,0,0]=4 1524 B12R1.354 CNC(=O)c1cc(ccc1Cl)Cl WXVL_AK00442SD0010 [0,2,0,0,0,0|2,0,0]=4 1525 B12R1.354 CNC(=O)c1cc(ccc1Cl)Cl WXVL_AK00442SD0010 [0,2,0,0,0,0|2,0,0]=4 1526 B12R1.354 CNC(=O)c1cc(ccc1Cl)F WXVL_AK00442SD0537 [0,2,0,0,0,0|2,0,0]=4 1527 B12R1.354 CNC(=O)c1cc(ccc1Cl)F WXVL_AK00442SD0537 [0,2,0,0,0,0|2,0,0]=4 1528 B12R1.354 CNC(=O)c1cc(ccc1Cl)I WXVL_AK00442SD0410 [0,2,0,0,0,0|2,0,0]=4 1529 B12R1.354 CNC(=O)c1cc(ccc1Cl)I WXVL_AK00442SD0410 [0,2,0,0,0,0|2,0,0]=4 1530 B12R1.354 CNC(=O)c1cc(ccc1Cl)O WXVL_AK00442SD0180 [0,2,0,0,0,0|2,0,0]=4 1531 B12R1.354 CNC(=O)c1cc(ccc1Cl)O WXVL_AK00442SD0180 [0,2,0,0,0,0|2,0,0]=4 1532 B12R1.354 CNC(=O)c1cc(ccc1F)Br WXVL_AK00442SD0128 [0,2,0,0,0,0|2,0,0]=4 1533 B12R1.354 CNC(=O)c1cc(ccc1F)Br WXVL_AK00442SD0128 [0,2,0,0,0,0|2,0,0]=4 1534 B12R1.354 CNC(=O)c1cc(ccc1F)C WXVL_AK00442SD0492 [0,2,0,0,0,0|2,0,0]=4 1535 B12R1.354 CNC(=O)c1cc(ccc1F)C WXVL_AK00442SD0492 [0,2,0,0,0,0|2,0,0]=4 1536 B12R1.354 CNC(=O)c1cc(ccc1F)Cl WXVL_AK00442SD0130 [0,2,0,0,0,0|2,0,0]=4 1537 B12R1.354 CNC(=O)c1cc(ccc1F)Cl WXVL_AK00442SD0130 [0,2,0,0,0,0|2,0,0]=4 1538 B12R1.354 CNC(=O)c1cc(ccc1F)F WXVL_AK00442SD0004 [0,2,0,0,0,0|2,0,0]=4 1539 B12R1.354 CNC(=O)c1cc(ccc1F)F WXVL_AK00442SD0004 [0,2,0,0,0,0|2,0,0]=4 1540 B12R1.354 CNC(=O)c1cc(ccc1F)I WXVL_AK00442SD0314 [0,2,0,0,0,0|2,0,0]=4 1541 B12R1.354 CNC(=O)c1cc(ccc1F)I WXVL_AK00442SD0314 [0,2,0,0,0,0|2,0,0]=4 1542 B12R1.354 CNC(=O)c1cc(ccc1F)O WXVL_AK00442SD0462 [0,2,0,0,0,0|2,0,0]=4 1543 B12R1.354 CNC(=O)c1cc(ccc1F)O WXVL_AK00442SD0462 [0,2,0,0,0,0|2,0,0]=4 1544 B12R1.354 CNC(=O)c1cc(ccc1I)Br WXVL_AK00442SD0546 [0,2,0,0,0,0|2,0,0]=4 1545 B12R1.354 CNC(=O)c1cc(ccc1I)Br WXVL_AK00442SD0546 [0,2,0,0,0,0|2,0,0]=4 1546 B12R1.354 CNC(=O)c1cc(ccc1I)C WXVL_AK00442SD0554 [0,2,0,0,0,0|2,0,0]=4 1547 B12R1.354 CNC(=O)c1cc(ccc1I)C WXVL_AK00442SD0554 [0,2,0,0,0,0|2,0,0]=4 1548 B12R1.354 CNC(=O)c1cc(ccc1I)Cl WXVL_AK00442SD0461 [0,2,0,0,0,0|2,0,0]=4 1549 B12R1.354 CNC(=O)c1cc(ccc1I)Cl WXVL_AK00442SD0461 [0,2,0,0,0,0|2,0,0]=4 1550 B12R1.354 CNC(=O)c1cc(ccc1I)F WXVL_AK00442SD0454 [0,2,0,0,0,0|2,0,0]=4 1551 B12R1.354 CNC(=O)c1cc(ccc1I)F WXVL_AK00442SD0454 [0,2,0,0,0,0|2,0,0]=4 1552 B12R1.354 CNC(=O)c1cc(ccc1I)O WXVL_AK00442SD1452 [0,2,0,0,0,0|2,0,0]=4 1553 B12R1.354 CNC(=O)c1cc(ccc1I)O WXVL_AK00442SD1452 [0,2,0,0,0,0|2,0,0]=4 1554 B12R1.354 CNC(=O)c1cc(ccc1O)Br WXVL_AK00442SD0028 [0,2,0,0,0,0|2,0,0]=4 1555 B12R1.354 CNC(=O)c1cc(ccc1O)Br WXVL_AK00442SD0028 [0,2,0,0,0,0|2,0,0]=4 1556 B12R1.354 CNC(=O)c1cc(ccc1O)C WXVL_AK00442SD0032 [0,2,0,0,0,0|2,0,0]=4 1557 B12R1.354 CNC(=O)c1cc(ccc1O)C WXVL_AK00442SD0032 [0,2,0,0,0,0|2,0,0]=4 1558 B12R1.354 CNC(=O)c1cc(ccc1O)Cl WXVL_AK00442SD0029 [0,2,0,0,0,0|2,0,0]=4 1559 B12R1.354 CNC(=O)c1cc(ccc1O)Cl WXVL_AK00442SD0029 [0,2,0,0,0,0|2,0,0]=4 1560 B12R1.354 CNC(=O)c1cc(ccc1O)F WXVL_AK00442SD0469 [0,2,0,0,0,0|2,0,0]=4 1561 B12R1.354 CNC(=O)c1cc(ccc1O)F WXVL_AK00442SD0469 [0,2,0,0,0,0|2,0,0]=4 1562 B12R1.354 CNC(=O)c1cc(ccc1O)I WXVL_AK00442SD0030 [0,2,0,0,0,0|2,0,0]=4 1563 B12R1.354 CNC(=O)c1cc(ccc1O)I WXVL_AK00442SD0030 [0,2,0,0,0,0|2,0,0]=4 1564 B12R1.354 CNC(=O)c1cc(ccc1O)O WXVL_AK00442SD1721 [0,2,0,0,0,0|2,0,0]=4 1565 B12R1.354 CNC(=O)c1cc(ccc1O)O WXVL_AK00442SD1721 [0,2,0,0,0,0|2,0,0]=4 1566 B12R1.354 CNC(=O)c1cc(cnc1Br)Br WXVL_AK00442SC0221 [0,2,0,0,0,0|1,0,0]=3 1567 B12R1.354 CNC(=O)c1cc(cnc1Br)Br WXVL_AK00442SC0221 [0,2,0,0,0,0|1,0,0]=3 1568 B12R1.354 CNC(=O)c1cc(cnc1Br)Cl WXVL_AK00442SC1019 [0,2,0,0,0,0|1,0,0]=3 1569 B12R1.354 CNC(=O)c1cc(cnc1Br)Cl WXVL_AK00442SC1019 [0,2,0,0,0,0|1,0,0]=3 1570 B12R1.354 CNC(=O)c1cc(cnc1C)Br WXVL_AK00442SC1114 [0,2,0,0,0,0|1,0,0]=3 1571 B12R1.354 CNC(=O)c1cc(cnc1C)Br WXVL_AK00442SC1114 [0,2,0,0,0,0|1,0,0]=3 1572 B12R1.354 CNC(=O)c1cc(cnc1Cl)Br WXVL_AK00442SC0342 [0,2,0,0,0,0|1,0,0]=3 1573 B12R1.354 CNC(=O)c1cc(cnc1Cl)Br WXVL_AK00442SC0342 [0,2,0,0,0,0|1,0,0]=3 1574 B12R1.354 CNC(=O)c1cc(cnc1Cl)C WXVL_AK00442SC0124 [0,2,0,0,0,0|1,0,0]=3 1575 B12R1.354 CNC(=O)c1cc(cnc1Cl)C WXVL_AK00442SC0124 [0,2,0,0,0,0|1,0,0]=3 1576 B12R1.354 CNC(=O)c1cc(cnc1Cl)Cl WXVL_AK00442SC0377 [0,2,0,0,0,0|1,0,0]=3 1577 B12R1.354 CNC(=O)c1cc(cnc1Cl)Cl WXVL_AK00442SC0377 [0,2,0,0,0,0|1,0,0]=3 1578 B12R1.354 CNC(=O)c1cc(cnc1Cl)F WXVL_AK00442SC0372 [0,2,0,0,0,0|1,0,0]=3 1579 B12R1.354 CNC(=O)c1cc(cnc1Cl)F WXVL_AK00442SC0372 [0,2,0,0,0,0|1,0,0]=3 1580 B12R1.354 CNC(=O)c1cc(cnc1Cl)I WXVL_AK00442SC00133 [0,2,0,0,0,0|1,0,0]=3 1581 B12R1.354 CNC(=O)c1cc(cnc1Cl)I WXVL_AK00442SC00133 [0,2,0,0,0,0|1,0,0]=3 1582 B12R1.354 CNC(=O)c1cc(cnc1F)Br WXVL_AK00442SC0712 [0,2,0,0,0,0|1,0,0]=3 1583 B12R1.354 CNC(=O)c1cc(cnc1F)Br WXVL_AK00442SC0712 [0,2,0,0,0,0|1,0,0]=3 1584 B12R1.354 CNC(=O)c1cc(cnc1F)Cl WXVL_AK00442SC0575 [0,2,0,0,0,0|1,0,0]=3 1585 B12R1.354 CNC(=O)c1cc(cnc1F)Cl WXVL_AK00442SC0575 [0,2,0,0,0,0|1,0,0]=3 1586 B12R1.354 CNC(=O)c1cc(cnc1O)Br WXVL_AK00442SC0671 [0,2,0,0,0,0|1,0,0]=3 1587 B12R1.354 CNC(=O)c1cc(cnc1O)Br WXVL_AK00442SC0671 [0,2,0,0,0,0|1,0,0]=3 1588 B12R1.354 CNC(=O)c1cc(cnc1O)Cl WXVL_AK00442SC0161 [0,2,0,0,0,0|1,0,0]=3 1589 B12R1.354 CNC(=O)c1cc(cnc1O)Cl WXVL_AK00442SC0161 [0,2,0,0,0,0|1,0,0]=3 1590 B12R1.354 CNC(=O)c1nc(cnc1C)C WXVL_AK00442SC1225 [0,2,0,0,0,0|2,0,0]=4 1591 B12R1.354 CNC(=O)c1nc(cnc1C)C WXVL_AK00442SC1225 [0,2,0,0,0,0|2,0,0]=4 1592 B12R1.358 CNC(=O)c1cc(cc(c1)Br)Br WXVL_AK00442SD0322 [0,2,0,0,0,0|2,0,0]=4 1593 B12R1.358 CNC(=O)c1cc(cc(c1)Br)Br WXVL_AK00442SD0322 [0,2,0,0,0,0|2,0,0]=4 1594 B12R1.358 CNC(=O)c1cc(cc(c1)Br)C WXVL_AK00442SD0805 [0,2,0,0,0,0|2,0,0]=4 1595 B12R1.358 CNC(=O)c1cc(cc(c1)Br)C WXVL_AK00442SD0805 [0,2,0,0,0,0|2,0,0]=4 1596 B12R1.358 CNC(=O)c1cc(cc(c1)Br)Cl WXVL_AK00442SD0292 [0,2,0,0,0,0|2,0,0]=4 1597 B12R1.358 CNC(=O)c1cc(cc(c1)Br)Cl WXVL_AK00442SD0292 [0,2,0,0,0,0|2,0,0]=4 1598 B12R1.358 CNC(=O)c1cc(cc(c1)Br)F WXVL_AK00442SD0494 [0,2,0,0,0,0|2,0,0]=4 1599 B12R1.358 CNC(=O)c1cc(cc(c1)Br)F WXVL_AK00442SD0494 [0,2,0,0,0,0|2,0,0]=4 1600 B12R1.358 CNC(=O)c1cc(cc(c1)Br)O WXVL_AK00442SD0742 [0,2,0,0,0,0|2,0,0]=4 1601 B12R1.358 CNC(=O)c1cc(cc(c1)Br)O WXVL_AK00442SD0742 [0,2,0,0,0,0|2,0,0]=4 1602 B12R1.358 CNC(=O)c1cc(cc(c1)C)C WXVL_AK00442SD0058 [0,2,0,0,0,0|2,0,0]=4 1603 B12R1.358 CNC(=O)c1cc(cc(c1)C)C WXVL_AK00442SD0058 [0,2,0,0,0,0|2,0,0]=4 1604 B12R1.358 CNC(=O)c1cc(cc(c1)Cl)C WXVL_AK00442SD0173 [0,2,0,0,0,0|2,0,0]=4 1605 B12R1.358 CNC(=O)c1cc(cc(c1)Cl)C WXVL_AK00442SD0173 [0,2,0,0,0,0|2,0,0]=4 1606 B12R1.358 CNC(=O)c1cc(cc(c1)Cl)Cl WXVL_AK00442SD0214 [0,2,0,0,0,0|2,0,0]=4 1607 B12R1.358 CNC(=O)c1cc(cc(c1)Cl)Cl WXVL_AK00442SD0214 [0,2,0,0,0,0|2,0,0]=4 1608 B12R1.358 CNC(=O)c1cc(cc(c1)Cl)F WXVL_AK00442SD0182 [0,2,0,0,0,0|2,0,0]=4 1609 B12R1.358 CNC(=O)c1cc(cc(c1)Cl)F WXVL_AK00442SD0182 [0,2,0,0,0,0|2,0,0]=4 1610 B12R1.358 CNC(=O)c1cc(cc(c1)Cl)O WXVL_AK00442SD0891 [0,2,0,0,0,0|2,0,0]=4 1611 B12R1.358 CNC(=O)c1cc(cc(c1)Cl)O WXVL_AK00442SD0891 [0,2,0,0,0,0|2,0,0]=4 1612 B12R1.358 CNC(=O)c1cc(cc(c1)F)C WXVL_AK00442SD0444 [0,2,0,0,0,0|2,0,0]=4 1613 B12R1.358 CNC(=O)c1cc(cc(c1)F)C WXVL_AK00442SD0444 [0,2,0,0,0,0|2,0,0]=4 1614 B12R1.358 CNC(=O)c1cc(cc(c1)F)F WXVL_AK00442SD0090 [0,2,0,0,0,0|2,0,0]=4 1615 B12R1.358 CNC(=O)c1cc(cc(c1)F)F WXVL_AK00442SD0090 [0,2,0,0,0,0|2,0,0]=4 1616 B12R1.358 CNC(=O)c1cc(cc(c1)F)O WXVL_AK00442SD0722 [0,2,0,0,0,0|2,0,0]=4 1617 B12R1.358 CNC(=O)c1cc(cc(c1)F)O WXVL_AK00442SD0722 [0,2,0,0,0,0|2,0,0]=4 1618 B12R1.358 CNC(=O)c1cc(cc(c1)I)Br WXVL_AK00442SD1124 [0,2,0,0,0,0|2,0,0]=4 1619 B12R1.358 CNC(=O)c1cc(cc(c1)I)Br WXVL_AK00442SD1124 [0,2,0,0,0,0|2,0,0]=4 1620 B12R1.358 CNC(=O)c1cc(cc(c1)I)Cl WXVL_AK00442SD1014 [0,2,0,0,0,0|2,0,0]=4 1621 B12R1.358 CNC(=O)c1cc(cc(c1)I)Cl WXVL_AK00442SD1014 [0,2,0,0,0,0|2,0,0]=4 1622 B12R1.358 CNC(=O)c1cc(cc(c1)I)F WXVL_AK00442SD1604 [0,2,0,0,0,0|2,0,0]=4 1623 B12R1.358 CNC(=O)c1cc(cc(c1)I)F WXVL_AK00442SD1604 [0,2,0,0,0,0|2,0,0]=4 1624 B12R1.358 CNC(=O)c1cc(cc(c1)O)C WXVL_AK00442SD0503 [0,2,0,0,0,0|2,0,0]=4 1625 B12R1.358 CNC(=O)c1cc(cc(c1)O)C WXVL_AK00442SD0503 [0,2,0,0,0,0|2,0,0]=4 1626 B12R1.358 CNC(=O)c1cc(cc(c1)O)O WXVL_AK00442SD0152 [0,2,0,0,0,0|2,0,0]=4 1627 B12R1.358 CNC(=O)c1cc(cc(c1)O)O WXVL_AK00442SD0152 [0,2,0,0,0,0|2,0,0]=4 1628 B12R1.435 C#Cc1cccc(c1)C(=O)NC WXVL_AK00442SD1159 [0,2,0,0,0,0|2,0,0]=4 1629 B12R1.435 C#Cc1cccc(c1)C(=O)NC WXVL_AK00442SD1159 [0,2,0,0,0,0|2,0,0]=4 1630 B12R1.435 CCc1cccc(c1)C(=O)NC WXVL_AK00442SD1421 [0,2,0,0,0,0|2,0,0]=4 1631 B12R1.435 CCc1cccc(c1)C(=O)NC WXVL_AK00442SD1421 [0,2,0,0,0,0|2,0,0]=4 1632 B12R1.435 CNC(=O)c1cccc(c1)C#N WXVL_AK00442SD0040 [0,2,0,0,0,0|2,0,0]=4 1633 B12R1.435 CNC(=O)c1cccc(c1)C#N WXVL_AK00442SD0040 [0,2,0,0,0,0|2,0,0]=4 1634 B12R1.435 CNC(=O)c1cccc(c1)CO WXVL_AK00442SD0821 [0,2,0,0,0,0|2,0,0]=4 1635 B12R1.435 CNC(=O)c1cccc(c1)CO WXVL_AK00442SD0821 [0,2,0,0,0,0|2,0,0]=4 1636 B12R1.435 CNC(=O)c1cccc(c1)OC WXVL_AK00442SD0048 [0,2,0,0,0,0|2,0,0]=4 1637 B12R1.435 CNC(=O)c1cccc(c1)OC WXVL_AK00442SD0048 [0,2,0,0,0,0|2,0,0]=4 1638 B12R1.435 CNC(=O)c1cccc(c1)SC WXVL_AK00442SD1394 [0,2,0,0,0,0|2,0,0]=4 1639 B12R1.435 CNC(=O)c1cccc(c1)SC WXVL_AK00442SD1394 [0,2,0,0,0,0|2,0,0]=4 1640 B12R1.435 CNC(=O)c1cncc(c1)OC WXVL_AK00442SC0570 [0,2,0,0,0,0|1,0,0]=3 1641 B12R1.435 CNC(=O)c1cncc(c1)OC WXVL_AK00442SC0570 [0,2,0,0,0,0|1,0,0]=3 1642 B12R1.124 CN(C)C(=O)c1ccccc1Br WXVL_AN0032SD0002 [0,2,0,0,0,0|2,0,0]=4 1643 B12R1.124 CN(C)C(=O)c1ccccc1Br WXVL_AN0032SD0002 [0,2,0,0,0,0|2,0,0]=4 1644 B12R1.124 CN(C)C(=O)c1ccccc1Cl WXVL_AN0032SD0006 [0,2,0,0,0,0|2,0,0]=4 1645 B12R1.124 CN(C)C(=O)c1ccccc1Cl WXVL_AN0032SD0006 [0,2,0,0,0,0|2,0,0]=4 1646 B12R1.124 CN(C)C(=O)c1ccccc1F WXVL_AN0032SD0003 [0,2,0,0,0,0|2,0,0]=4 1647 B12R1.124 CN(C)C(=O)c1ccccc1F WXVL_AN0032SD0003 [0,2,0,0,0,0|2,0,0]=4 1648 B12R1.124 CN(C)C(=O)c1ccccc1I WXVL_AN0032SD0303 [0,2,0,0,0,0|2,0,0]=4 1649 B12R1.124 CN(C)C(=O)c1ccccc1I WXVL_AN0032SD0303 [0,2,0,0,0,0|2,0,0]=4 1650 B12R1.124 CN(C)C(=O)c1ccccc1O WXVL_AN0032SD00056 [0,2,0,0,0,0|2,0,0]=4 1651 B12R1.124 CN(C)C(=O)c1ccccc1O WXVL_AN0032SD00056 [0,2,0,0,0,0|2,0,0]=4 1652 B12R1.124 CN(C)C(=O)c1ccccc1S WXVL_AN0032SD0153 [0,2,0,0,0,0|2,0,0]=4 1653 B12R1.124 CN(C)C(=O)c1ccccc1S WXVL_AN0032SD0153 [0,2,0,0,0,0|2,0,0]=4 1654 B12R1.124 CN(C)C(=O)c1cccnc1Br WXVL_AN0032SC0367 [0,2,0,0,0,0|1,0,0]=3 1655 B12R1.124 CN(C)C(=O)c1cccnc1Br WXVL_AN0032SC0367 [0,2,0,0,0,0|1,0,0]=3 1656 B12R1.124 CN(C)C(=O)c1cccnc1Cl WXVL_AN0032SC0146 [0,2,0,0,0,0|1,0,0]=3 1657 B12R1.124 CN(C)C(=O)c1cccnc1Cl WXVL_AN0032SC0146 [0,2,0,0,0,0|1,0,0]=3 1658 B12R1.124 CN(C)C(=O)c1cccnc1F WXVL_AN0032SC0350 [0,2,0,0,0,0|1,0,0]=3 1659 B12R1.124 CN(C)C(=O)c1cccnc1F WXVL_AN0032SC0350 [0,2,0,0,0,0|1,0,0]=3 1660 B12R1.124 CN(C)C(=O)c1cccnc1O WXVL_AN0032SC0063 [0,2,0,0,0,0|1,0,0]=3 1661 B12R1.124 CN(C)C(=O)c1cccnc1O WXVL_AN0032SC0063 [0,2,0,0,0,0|1,0,0]=3 1662 B12R1.124 CN(C)C(=O)c1ccnnc1O WXVL_AN0032SC0899 [0,2,0,0,0,0|2,0,0]=4 1663 B12R1.124 CN(C)C(=O)c1ccnnc1O WXVL_AN0032SC0899 [0,2,0,0,0,0|2,0,0]=4 1664 B12R1.124 CN(C)C(=O)c1cnccc1Br WXVL_AN0032SC0500 [0,2,0,0,0,0|1,0,0]=3 1665 B12R1.124 CN(C)C(=O)c1cnccc1Br WXVL_AN0032SC0500 [0,2,0,0,0,0|1,0,0]=3 1666 B12R1.124 CN(C)C(=O)c1cnccc1Cl WXVL_AN0032SC0340 [0,2,0,0,0,0|1,0,0]=3 1667 B12R1.124 CN(C)C(=O)c1cnccc1Cl WXVL_AN0032SC0340 [0,2,0,0,0,0|1,0,0]=3 1668 B12R1.124 CN(C)C(=O)c1nccnc1Br WXVL_AN0032SC0785 [0,2,0,0,0,0|2,0,0]=4 1669 B12R1.124 CN(C)C(=O)c1nccnc1Br WXVL_AN0032SC0785 [0,2,0,0,0,0|2,0,0]=4 1670 B12R1.124 CN(C)C(=O)c1nccnc1Cl WXVL_AN0032SC0361 [0,2,0,0,0,0|2,0,0]=4 1671 B12R1.124 CN(C)C(=O)c1nccnc1Cl WXVL_AN0032SC0361 [0,2,0,0,0,0|2,0,0]=4 1672 B12R1.124 Cc1ccccc1C(=O)N(C)C WXVL_AN0032SD0037 [0,2,0,0,0,0|2,0,0]=4 1673 B12R1.124 Cc1ccccc1C(=O)N(C)C WXVL_AN0032SD0037 [0,2,0,0,0,0|2,0,0]=4 1674 B12R1.124 Cc1ccncc1C(=O)N(C)C WXVL_AN0032SC0301 [0,2,0,0,0,0|1,0,0]=3 1675 B12R1.124 Cc1ccncc1C(=O)N(C)C WXVL_AN0032SC0301 [0,2,0,0,0,0|1,0,0]=3 1676 B12R1.124 Cc1cnncc1C(=O)N(C)C WXVL_AN0032SC0973 [0,2,0,0,0,0|2,0,0]=4 1677 B12R1.124 Cc1cnncc1C(=O)N(C)C WXVL_AN0032SC0973 [0,2,0,0,0,0|2,0,0]=4 1678 B12R1.124 Cc1ncccc1C(=O)N(C)C WXVL_AN0032SC0065 [0,2,0,0,0,0|1,0,0]=3 1679 B12R1.124 Cc1ncccc1C(=O)N(C)C WXVL_AN0032SC0065 [0,2,0,0,0,0|1,0,0]=3 1680 B12R1.124 Cc1ncncc1C(=O)N(C)C WXVL_AN0032SC0515 [0,2,0,0,0,0|2,0,0]=4 1681 B12R1.124 Cc1ncncc1C(=O)N(C)C WXVL_AN0032SC0515 [0,2,0,0,0,0|2,0,0]=4 1682 B12R1.77 C#Cc1ccccc1C(=O)NC WXVL_AK00442SD1151 [0,2,0,0,0,0|2,0,0]=4 1683 B12R1.77 C#Cc1ccccc1C(=O)NC WXVL_AK00442SD1151 [0,2,0,0,0,0|2,0,0]=4 1684 B12R1.77 CCc1ccccc1C(=O)NC WXVL_AK00442SD0112 [0,2,0,0,0,0|2,0,0]=4 1685 B12R1.77 CCc1ccccc1C(=O)NC WXVL_AK00442SD0112 [0,2,0,0,0,0|2,0,0]=4 1686 B12R1.77 CCc1ncccc1C(=O)NC WXVL_AK00442SC1247 [0,2,0,0,0,0|1,0,0]=3 1687 B12R1.77 CCc1ncccc1C(=O)NC WXVL_AK00442SC1247 [0,2,0,0,0,0|1,0,0]=3 1688 B12R1.77 CNC(=O)c1ccccc1C#N WXVL_AK00442SD0111 [0,2,0,0,0,0|2,0,0]=4 1689 B12R1.77 CNC(=O)c1ccccc1C#N WXVL_AK00442SD0111 [0,2,0,0,0,0|2,0,0]=4 1690 B12R1.77 CNC(=O)c1ccccc1CO WXVL_AK00442SD1772 [0,2,0,0,0,0|2,0,0]=4 1691 B12R1.77 CNC(=O)c1ccccc1CO WXVL_AK00442SD1772 [0,2,0,0,0,0|2,0,0]=4 1692 B12R1.77 CNC(=O)c1ccccc1OC WXVL_AK00442SD0016 [0,2,0,0,0,0|2,0,0]=4 1693 B12R1.77 CNC(=O)c1ccccc1OC WXVL_AK00442SD0016 [0,2,0,0,0,0|2,0,0]=4 1694 B12R1.77 CNC(=O)c1ccccc1SC WXVL_AK00442SD0102 [0,2,0,0,0,0|2,0,0]=4 1695 B12R1.77 CNC(=O)c1ccccc1SC WXVL_AK00442SD0102 [0,2,0,0,0,0|2,0,0]=4 1696 B12R1.77 CNC(=O)c1cccnc1OC WXVL_AK00442SC0078 [0,2,0,0,0,0|1,0,0]=3 1697 B12R1.77 CNC(=O)c1cccnc1OC WXVL_AK00442SC0078 [0,2,0,0,0,0|1,0,0]=3 1698 B12R1.77 CNC(=O)c1cccnc1SC WXVL_AK00442SC0821 [0,2,0,0,0,0|1,0,0]=3 1699 B12R1.77 CNC(=O)c1cccnc1SC WXVL_AK00442SC0821 [0,2,0,0,0,0|1,0,0]=3 1700 B12R1.77 CNC(=O)c1cnccc1C#N WXVL_AK00442SC0979 [0,2,0,0,0,0|1,0,0]=3 1701 B12R1.77 CNC(=O)c1cnccc1C#N WXVL_AK00442SC0979 [0,2,0,0,0,0|1,0,0]=3 1702 B12R1.77 CNC(=O)c1nccnc1OC WXVL_AK00442SC1246 [0,2,0,0,0,0|2,0,0]=4 1703 B12R1.77 CNC(=O)c1nccnc1OC WXVL_AK00442SC1246 [0,2,0,0,0,0|2,0,0]=4 1704 B12R1.3441 CNC(=O)c1c(cccc1Br)Br WXVL_AK00442SD0851 [0,2,0,0,0,0|2,0,0]=4 1705 B12R1.3441 CNC(=O)c1c(cccc1Br)Br WXVL_AK00442SD0851 [0,2,0,0,0,0|2,0,0]=4 1706 B12R1.3441 CNC(=O)c1c(cccc1Br)C WXVL_AK00442SD1153 [0,2,0,0,0,0|2,0,0]=4 1707 B12R1.3441 CNC(=O)c1c(cccc1Br)C WXVL_AK00442SD1153 [0,2,0,0,0,0|2,0,0]=4 1708 B12R1.3441 CNC(=O)c1c(cccc1Br)Cl WXVL_AK00442SD0506 [0,2,0,0,0,0|2,0,0]=4 1709 B12R1.3441 CNC(=O)c1c(cccc1Br)Cl WXVL_AK00442SD0506 [0,2,0,0,0,0|2,0,0]=4 1710 B12R1.3441 CNC(=O)c1c(cccc1Br)F WXVL_AK00442SD0403 [0,2,0,0,0,0|2,0,0]=4 1711 B12R1.3441 CNC(=O)c1c(cccc1Br)F WXVL_AK00442SD0403 [0,2,0,0,0,0|2,0,0]=4 1712 B12R1.3441 CNC(=O)c1c(cccc1Br)O WXVL_AK00442SD1602 [0,2,0,0,0,0|2,0,0]=4 1713 B12R1.3441 CNC(=O)c1c(cccc1Br)O WXVL_AK00442SD1602 [0,2,0,0,0,0|2,0,0]=4 1714 B12R1.3441 CNC(=O)c1c(cccc1C)C WXVL_AK00442SD0861 [0,2,0,0,0,0|2,0,0]=4 1715 B12R1.3441 CNC(=O)c1c(cccc1C)C WXVL_AK00442SD0861 [0,2,0,0,0,0|2,0,0]=4 1716 B12R1.3441 CNC(=O)c1c(cccc1Cl)C WXVL_AK00442SD0615 [0,2,0,0,0,0|2,0,0]=4 1717 B12R1.3441 CNC(=O)c1c(cccc1Cl)C WXVL_AK00442SD0615 [0,2,0,0,0,0|2,0,0]=4 1718 B12R1.3441 CNC(=O)c1c(cccc1Cl)Cl WXVL_AK00442SD0012 [0,2,0,0,0,0|2,0,0]=4 1719 B12R1.3441 CNC(=O)c1c(cccc1Cl)Cl WXVL_AK00442SD0012 [0,2,0,0,0,0|2,0,0]=4 1720 B12R1.3441 CNC(=O)c1c(cccc1Cl)F WXVL_AK00442SD0011 [0,2,0,0,0,0|2,0,0]=4 1721 B12R1.3441 CNC(=O)c1c(cccc1Cl)F WXVL_AK00442SD0011 [0,2,0,0,0,0|2,0,0]=4 1722 B12R1.3441 CNC(=O)c1c(cccc1Cl)O WXVL_AK00442SD0796 [0,2,0,0,0,0|2,0,0]=4 1723 B12R1.3441 CNC(=O)c1c(cccc1Cl)O WXVL_AK00442SD0796 [0,2,0,0,0,0|2,0,0]=4 1724 B12R1.3441 CNC(=O)c1c(cccc1F)C WXVL_AK00442SD0136 [0,2,0,0,0,0|2,0,0]=4 1725 B12R1.3441 CNC(=O)c1c(cccc1F)C WXVL_AK00442SD0136 [0,2,0,0,0,0|2,0,0]=4 1726 B12R1.3441 CNC(=O)c1c(cccc1F)F WXVL_AK00442SD0005 [0,2,0,0,0,0|2,0,0]=4 1727 B12R1.3441 CNC(=O)c1c(cccc1F)F WXVL_AK00442SD0005 [0,2,0,0,0,0|2,0,0]=4 1728 B12R1.3441 CNC(=O)c1c(cccc1F)O WXVL_AK00442SD0472 [0,2,0,0,0,0|2,0,0]=4 1729 B12R1.3441 CNC(=O)c1c(cccc1F)O WXVL_AK00442SD0472 [0,2,0,0,0,0|2,0,0]=4 1730 B12R1.3441 CNC(=O)c1c(cccc1I)Cl WXVL_AK00442SD1366 [0,2,0,0,0,0|2,0,0]=4 1731 B12R1.3441 CNC(=O)c1c(cccc1I)Cl WXVL_AK00442SD1366 [0,2,0,0,0,0|2,0,0]=4 1732 B12R1.3441 CNC(=O)c1c(cccc1I)F WXVL_AK00442SD0526 [0,2,0,0,0,0|2,0,0]=4 1733 B12R1.3441 CNC(=O)c1c(cccc1I)F WXVL_AK00442SD0526 [0,2,0,0,0,0|2,0,0]=4 1734 B12R1.3441 CNC(=O)c1c(cccc1O)C WXVL_AK00442SD0804 [0,2,0,0,0,0|2,0,0]=4 1735 B12R1.3441 CNC(=O)c1c(cccc1O)C WXVL_AK00442SD0804 [0,2,0,0,0,0|2,0,0]=4 1736 B12R1.3441 CNC(=O)c1c(cccc1O)O WXVL_AK00442SD0150 [0,2,0,0,0,0|2,0,0]=4 1737 B12R1.3441 CNC(=O)c1c(cccc1O)O WXVL_AK00442SD0150 [0,2,0,0,0,0|2,0,0]=4 1738 B12R1.3441 CNC(=O)c1c(ccnc1Cl)Br WXVL_AK00442SC2040 [0,2,0,0,0,0|1,0,0]=3 1739 B12R1.3441 CNC(=O)c1c(ccnc1Cl)Br WXVL_AK00442SC2040 [0,2,0,0,0,0|1,0,0]=3 1740 B12R1.3441 CNC(=O)c1c(ccnc1Cl)C WXVL_AK00442SC2681 [0,2,0,0,0,0|1,0,0]=3 1741 B12R1.3441 CNC(=O)c1c(ccnc1Cl)C WXVL_AK00442SC2681 [0,2,0,0,0,0|1,0,0]=3 1742 B12R1.3441 CNC(=O)c1c(ccnc1Cl)Cl WXVL_AK00442SC0351 [0,2,0,0,0,0|1,0,0]=3 1743 B12R1.3441 CNC(=O)c1c(ccnc1Cl)Cl WXVL_AK00442SC0351 [0,2,0,0,0,0|1,0,0]=3 1744 B12R1.3441 CNC(=O)c1c(ccnc1Cl)F WXVL_AK00442SC1022 [0,2,0,0,0,0|1,0,0]=3 1745 B12R1.3441 CNC(=O)c1c(ccnc1Cl)F WXVL_AK00442SC1022 [0,2,0,0,0,0|1,0,0]=3 1746 B12R1.3441 CNC(=O)c1c(ccnc1Cl)I WXVL_AK00442SC0532 [0,2,0,0,0,0|1,0,0]=3 1747 B12R1.3441 CNC(=O)c1c(ccnc1Cl)I WXVL_AK00442SC0532 [0,2,0,0,0,0|1,0,0]=3 1748 B12R1.3441 CNC(=O)c1c(ccnc1F)I WXVL_AK00442SC0218 [0,2,0,0,0,0|1,0,0]=3 1749 B12R1.3441 CNC(=O)c1c(ccnc1F)I WXVL_AK00442SC0218 [0,2,0,0,0,0|1,0,0]=3 1750 B12R2.2 c1cncc(c1)c2ccon2 WXVL_LR0685BT1208 [0,1,0,1,0,0|1,0,1]=4 1751 B12R2.2 c1cncc(c1)c2ccon2 WXVL_LR0685BT3912 [0,1,0,1,0,0|1,0,1]=4 1752 B12R2.2 c1cncc(c1)c2cnoc2 WXVL_LR0706BT1208 [0,1,0,1,0,0|2,0,0]=4 1753 B12R2.2 c1cncc(c1)c2cnoc2 WXVL_LR0706BT3912 [0,1,0,1,0,0|2,0,0]=4 1754 B8R1.7 NC(=O)c1c[nH]cn1 WXVL_AK0084SC0074 [1,0,0,0,1,0|2,0,0]=4 1755 B8R1.7 NC(=O)c1c[nH]cn1 WXVL_AK0084SC0074 [1,0,0,0,1,0|2,0,0]=4 1756 B8R1.7 NC(=O)c1cc[nH]c1 WXVL_AK0084SC0013 [1,0,0,0,1,0|1,0,1]=4 1757 B8R1.7 NC(=O)c1cc[nH]c1 WXVL_AK0084SC0013 [1,0,0,0,1,0|1,0,1]=4 1758 B8R1.7 NC(=O)c1cc[nH]n1 WXVL_AK0084SC0003 [1,0,0,0,1,0|2,0,0]=4 1759 B8R1.7 NC(=O)c1cc[nH]n1 WXVL_AK0084SC0003 [1,0,0,0,1,0|2,0,0]=4 1760 B8R1.7 NC(=O)c1ccco1 WXVL_AK0084SC0049 [1,0,0,0,1,0|2,0,0]=4 1761 B8R1.7 NC(=O)c1ccco1 WXVL_AK0084SC0049 [1,0,0,0,1,0|2,0,0]=4 1762 B8R1.7 NC(=O)c1cccs1 WXVL_AK0084SC0051 [1,0,0,0,1,0|2,0,0]=4 1763 B8R1.7 NC(=O)c1cccs1 WXVL_AK0084SC0051 [1,0,0,0,1,0|2,0,0]=4 1764 B8R1.7 NC(=O)c1ccno1 WXVL_AK0084SC0080 [1,0,0,0,1,0|2,0,0]=4 1765 B8R1.7 NC(=O)c1ccno1 WXVL_AK0084SC0080 [1,0,0,0,1,0|2,0,0]=4 1766 B8R1.7 NC(=O)c1ccns1 WXVL_AK0084SC0027 [1,0,0,0,1,0|2,0,0]=4 1767 B8R1.7 NC(=O)c1ccns1 WXVL_AK0084SC0027 [1,0,0,0,1,0|2,0,0]=4 1768 B8R1.7 NC(=O)c1ccoc1 WXVL_AK0084SC0050 [1,0,0,0,1,0|2,0,0]=4 1769 B8R1.7 NC(=O)c1ccoc1 WXVL_AK0084SC0050 [1,0,0,0,1,0|2,0,0]=4 1770 B8R1.7 NC(=O)c1ccon1 WXVL_AK0084SC0116 [1,0,0,0,1,0|2,0,0]=4 1771 B8R1.7 NC(=O)c1ccon1 WXVL_AK0084SC0116 [1,0,0,0,1,0|2,0,0]=4 1772 B8R1.7 NC(=O)c1ccsc1 WXVL_AK0084SC0054 [1,0,0,0,1,0|2,0,0]=4 1773 B8R1.7 NC(=O)c1ccsc1 WXVL_AK0084SC0054 [1,0,0,0,1,0|2,0,0]=4 1774 B8R1.7 NC(=O)c1ccsn1 WXVL_AK0084SC0764 [1,0,0,0,1,0|2,0,0]=4 1775 B8R1.7 NC(=O)c1ccsn1 WXVL_AK0084SC0764 [1,0,0,0,1,0|2,0,0]=4 1776 B8R1.7 NC(=O)c1cn[nH]c1 WXVL_AK0084SC0254 [1,0,0,0,1,0|2,0,0]=4 1777 B8R1.7 NC(=O)c1cn[nH]c1 WXVL_AK0084SC0254 [1,0,0,0,1,0|2,0,0]=4 1778 B8R1.7 NC(=O)c1cnc[nH]1 WXVL_AK0084SC0247 [1,0,0,0,1,0|2,0,0]=4 1779 B8R1.7 NC(=O)c1cnc[nH]1 WXVL_AK0084SC0247 [1,0,0,0,1,0|2,0,0]=4 1780 B8R1.7 NC(=O)c1cnco1 WXVL_AK0084SC0018 [1,0,0,0,1,0|2,0,0]=4 1781 B8R1.7 NC(=O)c1cnco1 WXVL_AK0084SC0018 [1,0,0,0,1,0|2,0,0]=4 1782 B8R1.7 NC(=O)c1cncs1 WXVL_AK0084SC0113 [1,0,0,0,1,0|2,0,0]=4 1783 B8R1.7 NC(=O)c1cncs1 WXVL_AK0084SC0113 [1,0,0,0,1,0|2,0,0]=4 1784 B8R1.7 NC(=O)c1cocn1 WXVL_AK0084SC0118 [1,0,0,0,1,0|2,0,0]=4 1785 B8R1.7 NC(=O)c1cocn1 WXVL_AK0084SC0118 [1,0,0,0,1,0|2,0,0]=4 1786 B8R1.7 NC(=O)c1cscn1 WXVL_AK0084SC0092 [1,0,0,0,1,0|2,0,0]=4 1787 B8R1.7 NC(=O)c1cscn1 WXVL_AK0084SC0092 [1,0,0,0,1,0|2,0,0]=4 1788 B8R1.7 NC(=O)c1nccs1 WXVL_AK0084SC0110 [1,0,0,0,1,0|2,0,0]=4 1789 B8R1.7 NC(=O)c1nccs1 WXVL_AK0084SC0110 [1,0,0,0,1,0|2,0,0]=4 1790 B12R1.27 C#CC(=O)NCc1cccnc1 WXVL_AK0020SB0338 [0,0,0,0,0,2|1,0,1]=4 1791 B12R1.27 C#CC(=O)NCc1cccnc1 WXVL_AK0020SB0338 [0,0,0,0,0,2|1,0,1]=4 1792 B12R1.27 CCC(=O)NCc1ccccc1 WXVL_AK00502SB0064 [0,0,0,0,0,2|2,0,0]=4 1793 B12R1.27 CCC(=O)NCc1ccccc1 WXVL_AK00502SB0064 [0,0,0,0,0,2|2,0,0]=4 1794 B12R1.27 CCC(=O)NCc1cccnc1 WXVL_AK0020SB0064 [0,0,0,0,0,2|1,0,0]=3 1795 B12R1.27 CCC(=O)NCc1cccnc1 WXVL_AK0020SB0064 [0,0,0,0,0,2|1,0,0]=3 1796 B12R1.27 CCC(=O)NCc1cnccn1 WXVL_AK00262SB0064 [0,0,0,0,0,2|2,0,0]=4 1797 B12R1.27 CCC(=O)NCc1cnccn1 WXVL_AK00262SB0064 [0,0,0,0,0,2|2,0,0]=4 1798 B12R1.27 CCC(=O)NCc1cncnc1 WXVL_AK1364SB0064 [0,0,0,0,0,2|2,0,0]=4 1799 B12R1.27 CCC(=O)NCc1cncnc1 WXVL_AK1364SB0064 [0,0,0,0,0,2|2,0,0]=4 1800 B12R1.27 CNC(=O)/C=C/c1ccccc1 WXVL_AK00442SB0115 [0,0,0,0,0,2|2,0,0]=4 1801 B12R1.27 CNC(=O)/C=C/c1ccccc1 WXVL_AK00442SB0115 [0,0,0,0,0,2|2,0,0]=4 1802 B12R1.27 CNC(=O)/C=C/c1cccnc1 WXVL_AK00442SA0193 [0,0,0,0,0,2|1,0,0]=3 1803 B12R1.27 CNC(=O)/C=C/c1cccnc1 WXVL_AK00442SA0193 [0,0,0,0,0,2|1,0,0]=3 1804 B12R1.27 CNC(=O)/C=C/c1cnccn1 WXVL_AK00442SA2885 [0,0,0,0,0,2|2,0,0]=4 1805 B12R1.27 CNC(=O)/C=C/c1cnccn1 WXVL_AK00442SA2885 [0,0,0,0,0,2|2,0,0]=4 1806 B12R1.27 CNC(=O)C#Cc1ccccc1 WXVL_AK00442SB0114 [0,0,0,0,0,2|2,0,0]=4 1807 B12R1.27 CNC(=O)C#Cc1ccccc1 WXVL_AK00442SB0114 [0,0,0,0,0,2|2,0,0]=4 1808 B12R1.27 CNC(=O)CCc1ccccc1 WXVL_AK00442SB0067 [0,0,0,0,0,2|2,0,0]=4 1809 B12R1.27 CNC(=O)CCc1ccccc1 WXVL_AK00442SB0067 [0,0,0,0,0,2|2,0,0]=4 1810 B12R1.27 CNC(=O)CCc1cccnc1 WXVL_AK00442SA0031 [0,0,0,0,0,2|1,0,0]=3 1811 B12R1.27 CNC(=O)CCc1cccnc1 WXVL_AK00442SA0031 [0,0,0,0,0,2|1,0,0]=3 1812 B12R1.27 CNC(=O)CCc1cnccn1 WXVL_AK00442SA2354 [0,0,0,0,0,2|2,0,0]=4 1813 B12R1.27 CNC(=O)CCc1cnccn1 WXVL_AK00442SA2354 [0,0,0,0,0,2|2,0,0]=4 1814 B12R1.27 CNC(=O)CCc1cncnc1 WXVL_AK00442SA0013 [0,0,0,0,0,2|2,0,0]=4 1815 B12R1.27 CNC(=O)CCc1cncnc1 WXVL_AK00442SA0013 [0,0,0,0,0,2|2,0,0]=4 1816 B12R1.27 CNC(=O)COc1ccccc1 WXVL_AK00442SB0086 [0,0,0,0,0,2|2,0,0]=4 1817 B12R1.27 CNC(=O)COc1ccccc1 WXVL_AK00442SB0086 [0,0,0,0,0,2|2,0,0]=4 1818 B12R1.27 CNC(=O)COc1cccnc1 WXVL_AK00442SA0051 [0,0,0,0,0,2|1,0,0]=3 1819 B12R1.27 CNC(=O)COc1cccnc1 WXVL_AK00442SA0051 [0,0,0,0,0,2|1,0,0]=3 1820 B12R1.27 CNC(=O)CSc1ccccc1 WXVL_AK00442SB0113 [0,0,0,0,0,2|2,0,0]=4 1821 B12R1.27 CNC(=O)CSc1ccccc1 WXVL_AK00442SB0113 [0,0,0,0,0,2|2,0,0]=4 1822 B12R1.27 O=C(CO)NCc1cccnc1 WXVL_AK0020SB2706 [0,0,0,0,0,2|2,0,0]=4 1823 B12R1.27 O=C(CO)NCc1cccnc1 WXVL_AK0020SB2706 [0,0,0,0,0,2|2,0,0]=4