0 B10R1.15 CNC(=O)C1=CCCCO1 WXVL_AK00442SB4858 [0,0,0,0,0,0|1,0,3]=4 1 B10R1.15 CNC(=O)C1=CCCCO1 WXVL_AK00442SB4858 [0,0,0,0,0,0|1,0,3]=4 2 B10R1.15 CNC(=O)C1=COCCC1 WXVL_AK00442SB2928 [0,0,0,0,0,0|1,0,3]=4 3 B10R1.15 CNC(=O)C1=COCCC1 WXVL_AK00442SB2928 [0,0,0,0,0,0|1,0,3]=4 4 B10R1.15 CNC(=O)C1CC=CCC1 WXVL_AK00442SB3640 [0,0,0,0,0,0|0,0,4]=4 5 B10R1.15 CNC(=O)C1CC=CCC1 WXVL_AK00442SB3640 [0,0,0,0,0,0|0,0,4]=4 6 B10R1.15 CNC(=O)c1ccccc1 WXVL_AK00442SD0001 [0,0,0,0,0,0|0,0,0]=0 7 B10R1.15 CNC(=O)c1ccccc1 WXVL_AK00442SD0001 [0,0,0,0,0,0|0,0,0]=0 8 B10R1.15 CNC(=O)c1ccccn1 WXVL_AK00442SC0058 [0,0,0,0,0,0|1,0,0]=1 9 B10R1.15 CNC(=O)c1ccccn1 WXVL_AK00442SC0058 [0,0,0,0,0,0|1,0,0]=1 10 B10R1.15 CNC(=O)c1cccnc1 WXVL_AK00442SC0061 [0,0,0,0,0,0|1,0,0]=1 11 B10R1.15 CNC(=O)c1cccnc1 WXVL_AK00442SC0061 [0,0,0,0,0,0|1,0,0]=1 12 B10R1.15 CNC(=O)c1cccnn1 WXVL_AK00442SC0374 [0,0,0,0,0,0|2,0,0]=2 13 B10R1.15 CNC(=O)c1cccnn1 WXVL_AK00442SC0374 [0,0,0,0,0,0|2,0,0]=2 14 B10R1.15 CNC(=O)c1ccncc1 WXVL_AK00442SC0062 [0,0,0,0,0,0|1,0,0]=1 15 B10R1.15 CNC(=O)c1ccncc1 WXVL_AK00442SC0062 [0,0,0,0,0,0|1,0,0]=1 16 B10R1.15 CNC(=O)c1ccncn1 WXVL_AK00442SC0231 [0,0,0,0,0,0|2,0,0]=2 17 B10R1.15 CNC(=O)c1ccncn1 WXVL_AK00442SC0231 [0,0,0,0,0,0|2,0,0]=2 18 B10R1.15 CNC(=O)c1ccnnc1 WXVL_AK00442SC0064 [0,0,0,0,0,0|2,0,0]=2 19 B10R1.15 CNC(=O)c1ccnnc1 WXVL_AK00442SC0064 [0,0,0,0,0,0|2,0,0]=2 20 B10R1.15 CNC(=O)c1cncnc1 WXVL_AK00442SC0097 [0,0,0,0,0,0|2,0,0]=2 21 B10R1.15 CNC(=O)c1cncnc1 WXVL_AK00442SC0097 [0,0,0,0,0,0|2,0,0]=2 22 B10R1.15 CNC(=O)c1ncccn1 WXVL_AK00442SC0096 [0,0,0,0,0,0|2,0,0]=2 23 B10R1.15 CNC(=O)c1ncccn1 WXVL_AK00442SC0096 [0,0,0,0,0,0|2,0,0]=2 24 B9R1.6 NC(=O)c1ccccc1 WXVL_AK0084SD0001 [1,0,0,0,0,0|0,0,0]=1 25 B9R1.6 NC(=O)c1ccccc1 WXVL_AK0084SD0001 [1,0,0,0,0,0|0,0,0]=1 26 B9R1.6 NC(=O)c1ccccn1 WXVL_AK0084SC0058 [1,0,0,0,0,0|1,0,0]=2 27 B9R1.6 NC(=O)c1ccccn1 WXVL_AK0084SC0058 [1,0,0,0,0,0|1,0,0]=2 28 B9R1.6 NC(=O)c1cccnc1 WXVL_AK0084SC0061 [1,0,0,0,0,0|1,0,0]=2 29 B9R1.6 NC(=O)c1cccnc1 WXVL_AK0084SC0061 [1,0,0,0,0,0|1,0,0]=2 30 B9R1.6 NC(=O)c1cccnn1 WXVL_AK0084SC0374 [1,0,0,0,0,0|2,0,0]=3 31 B9R1.6 NC(=O)c1cccnn1 WXVL_AK0084SC0374 [1,0,0,0,0,0|2,0,0]=3 32 B9R1.6 NC(=O)c1ccncc1 WXVL_AK0084SC0062 [1,0,0,0,0,0|1,0,0]=2 33 B9R1.6 NC(=O)c1ccncc1 WXVL_AK0084SC0062 [1,0,0,0,0,0|1,0,0]=2 34 B9R1.6 NC(=O)c1ccncn1 WXVL_AK0084SC0231 [1,0,0,0,0,0|2,0,0]=3 35 B9R1.6 NC(=O)c1ccncn1 WXVL_AK0084SC0231 [1,0,0,0,0,0|2,0,0]=3 36 B9R1.6 NC(=O)c1ccnnc1 WXVL_AK0084SC0064 [1,0,0,0,0,0|2,0,0]=3 37 B9R1.6 NC(=O)c1ccnnc1 WXVL_AK0084SC0064 [1,0,0,0,0,0|2,0,0]=3 38 B9R1.6 NC(=O)c1cncnc1 WXVL_AK0084SC0097 [1,0,0,0,0,0|2,0,0]=3 39 B9R1.6 NC(=O)c1cncnc1 WXVL_AK0084SC0097 [1,0,0,0,0,0|2,0,0]=3 40 B9R1.6 NC(=O)c1ncccn1 WXVL_AK0084SC0096 [1,0,0,0,0,0|2,0,0]=3 41 B9R1.6 NC(=O)c1ncccn1 WXVL_AK0084SC0096 [1,0,0,0,0,0|2,0,0]=3 42 B11R1.7 CNS(=O)(=O)c1ccccn1 WXVL_AK00442HU0098 [0,1,0,0,0,0|2,0,0]=3 43 B11R1.7 CNS(=O)(=O)c1ccccn1 WXVL_AK00442HU0098 [0,1,0,0,0,0|2,0,0]=3 44 B11R1.7 CNS(=O)(=O)c1cccnc1 WXVL_AK00442HU0127 [0,1,0,0,0,0|2,0,0]=3 45 B11R1.7 CNS(=O)(=O)c1cccnc1 WXVL_AK00442HU0127 [0,1,0,0,0,0|2,0,0]=3 46 B11R1.7 CNS(=O)(=O)c1ccncc1 WXVL_AK00442HU0382 [0,1,0,0,0,0|2,0,0]=3 47 B11R1.7 CNS(=O)(=O)c1ccncc1 WXVL_AK00442HU0382 [0,1,0,0,0,0|2,0,0]=3 48 B11R1.16 CCNC(=O)c1ccccc1 WXVL_AK00476SD0001 [0,1,0,0,0,0|0,0,0]=1 49 B11R1.16 CCNC(=O)c1ccccc1 WXVL_AK00476SD0001 [0,1,0,0,0,0|0,0,0]=1 50 B11R1.16 CCNC(=O)c1ccccn1 WXVL_AK00476SC0058 [0,1,0,0,0,0|1,0,0]=2 51 B11R1.16 CCNC(=O)c1ccccn1 WXVL_AK00476SC0058 [0,1,0,0,0,0|1,0,0]=2 52 B11R1.16 CCNC(=O)c1cccnc1 WXVL_AK00476SC0061 [0,1,0,0,0,0|1,0,0]=2 53 B11R1.16 CCNC(=O)c1cccnc1 WXVL_AK00476SC0061 [0,1,0,0,0,0|1,0,0]=2 54 B11R1.16 CCNC(=O)c1cccnn1 WXVL_AK00476SC0374 [0,1,0,0,0,0|2,0,0]=3 55 B11R1.16 CCNC(=O)c1cccnn1 WXVL_AK00476SC0374 [0,1,0,0,0,0|2,0,0]=3 56 B11R1.16 CCNC(=O)c1ccncc1 WXVL_AK00476SC0062 [0,1,0,0,0,0|1,0,0]=2 57 B11R1.16 CCNC(=O)c1ccncc1 WXVL_AK00476SC0062 [0,1,0,0,0,0|1,0,0]=2 58 B11R1.16 CCNC(=O)c1ccncn1 WXVL_AK00476SC0231 [0,1,0,0,0,0|2,0,0]=3 59 B11R1.16 CCNC(=O)c1ccncn1 WXVL_AK00476SC0231 [0,1,0,0,0,0|2,0,0]=3 60 B11R1.16 CCNC(=O)c1ccnnc1 WXVL_AK00476SC0064 [0,1,0,0,0,0|2,0,0]=3 61 B11R1.16 CCNC(=O)c1ccnnc1 WXVL_AK00476SC0064 [0,1,0,0,0,0|2,0,0]=3 62 B11R1.16 CCNC(=O)c1cncnc1 WXVL_AK00476SC0097 [0,1,0,0,0,0|2,0,0]=3 63 B11R1.16 CCNC(=O)c1cncnc1 WXVL_AK00476SC0097 [0,1,0,0,0,0|2,0,0]=3 64 B11R1.16 CCNC(=O)c1ncccn1 WXVL_AK00476SC0096 [0,1,0,0,0,0|2,0,0]=3 65 B11R1.16 CCNC(=O)c1ncccn1 WXVL_AK00476SC0096 [0,1,0,0,0,0|2,0,0]=3 66 B11R1.22 CNC(=O)C1C=CC(=O)N=N1 WXVL_AK00442SB5455 [0,1,0,0,0,0|2,0,1]=4 67 B11R1.22 CNC(=O)C1C=CC(=O)N=N1 WXVL_AK00442SB5455 [0,1,0,0,0,0|2,0,1]=4 68 B11R1.22 CNC(=O)c1cc[n+](cc1)[O-] WXVL_AK00442SC0858 [0,1,0,0,0,0|1,0,0]=2 69 B11R1.22 CNC(=O)c1cc[n+](cc1)[O-] WXVL_AK00442SC0858 [0,1,0,0,0,0|1,0,0]=2 70 B11R1.22 CNC(=O)c1ccc(=O)[nH]c1 WXVL_AK00442SC2212 [0,1,0,0,0,0|1,0,0]=2 71 B11R1.22 CNC(=O)c1ccc(=O)[nH]c1 WXVL_AK00442SC2212 [0,1,0,0,0,0|1,0,0]=2 72 B11R1.22 CNC(=O)c1ccc(=O)oc1 WXVL_AK00442SC0132 [0,1,0,0,0,0|1,0,0]=2 73 B11R1.22 CNC(=O)c1ccc(=O)oc1 WXVL_AK00442SC0132 [0,1,0,0,0,0|1,0,0]=2 74 B11R1.22 CNC(=O)c1ccc(cc1)Br WXVL_AK00442SD0060 [0,1,0,0,0,0|0,0,0]=1 75 B11R1.22 CNC(=O)c1ccc(cc1)Br WXVL_AK00442SD0060 [0,1,0,0,0,0|0,0,0]=1 76 B11R1.22 CNC(=O)c1ccc(cc1)C WXVL_AK00442SD0078 [0,1,0,0,0,0|0,0,0]=1 77 B11R1.22 CNC(=O)c1ccc(cc1)C WXVL_AK00442SD0078 [0,1,0,0,0,0|0,0,0]=1 78 B11R1.22 CNC(=O)c1ccc(cc1)Cl WXVL_AK00442SD0062 [0,1,0,0,0,0|0,0,0]=1 79 B11R1.22 CNC(=O)c1ccc(cc1)Cl WXVL_AK00442SD0062 [0,1,0,0,0,0|0,0,0]=1 80 B11R1.22 CNC(=O)c1ccc(cc1)F WXVL_AK00442SD0061 [0,1,0,0,0,0|0,0,0]=1 81 B11R1.22 CNC(=O)c1ccc(cc1)F WXVL_AK00442SD0061 [0,1,0,0,0,0|0,0,0]=1 82 B11R1.22 CNC(=O)c1ccc(cc1)I WXVL_AK00442SD0421 [0,1,0,0,0,0|0,0,0]=1 83 B11R1.22 CNC(=O)c1ccc(cc1)I WXVL_AK00442SD0421 [0,1,0,0,0,0|0,0,0]=1 84 B11R1.22 CNC(=O)c1ccc(cc1)O WXVL_AK00442SD0069 [0,1,0,0,0,0|0,0,0]=1 85 B11R1.22 CNC(=O)c1ccc(cc1)O WXVL_AK00442SD0069 [0,1,0,0,0,0|0,0,0]=1 86 B11R1.22 CNC(=O)c1ccc(cc1)S WXVL_AK00442SD0154 [0,1,0,0,0,0|0,0,0]=1 87 B11R1.22 CNC(=O)c1ccc(cc1)S WXVL_AK00442SD0154 [0,1,0,0,0,0|0,0,0]=1 88 B11R1.22 CNC(=O)c1ccc(cn1)Br WXVL_AK00442SC0363 [0,1,0,0,0,0|1,0,0]=2 89 B11R1.22 CNC(=O)c1ccc(cn1)Br WXVL_AK00442SC0363 [0,1,0,0,0,0|1,0,0]=2 90 B11R1.22 CNC(=O)c1ccc(cn1)C WXVL_AK00442SC0104 [0,1,0,0,0,0|1,0,0]=2 91 B11R1.22 CNC(=O)c1ccc(cn1)C WXVL_AK00442SC0104 [0,1,0,0,0,0|1,0,0]=2 92 B11R1.22 CNC(=O)c1ccc(cn1)Cl WXVL_AK00442SC0381 [0,1,0,0,0,0|1,0,0]=2 93 B11R1.22 CNC(=O)c1ccc(cn1)Cl WXVL_AK00442SC0381 [0,1,0,0,0,0|1,0,0]=2 94 B11R1.22 CNC(=O)c1ccc(cn1)F WXVL_AK00442SC0114 [0,1,0,0,0,0|1,0,0]=2 95 B11R1.22 CNC(=O)c1ccc(cn1)F WXVL_AK00442SC0114 [0,1,0,0,0,0|1,0,0]=2 96 B11R1.22 CNC(=O)c1ccc(cn1)O WXVL_AK00442SC0130 [0,1,0,0,0,0|1,0,0]=2 97 B11R1.22 CNC(=O)c1ccc(cn1)O WXVL_AK00442SC0130 [0,1,0,0,0,0|1,0,0]=2 98 B11R1.22 CNC(=O)c1ccc(nc1)Br WXVL_AK00442SC0352 [0,1,0,0,0,0|1,0,0]=2 99 B11R1.22 CNC(=O)c1ccc(nc1)Br WXVL_AK00442SC0352 [0,1,0,0,0,0|1,0,0]=2 100 B11R1.22 CNC(=O)c1ccc(nc1)C WXVL_AK00442SC0060 [0,1,0,0,0,0|1,0,0]=2 101 B11R1.22 CNC(=O)c1ccc(nc1)C WXVL_AK00442SC0060 [0,1,0,0,0,0|1,0,0]=2 102 B11R1.22 CNC(=O)c1ccc(nc1)Cl WXVL_AK00442SC0147 [0,1,0,0,0,0|1,0,0]=2 103 B11R1.22 CNC(=O)c1ccc(nc1)Cl WXVL_AK00442SC0147 [0,1,0,0,0,0|1,0,0]=2 104 B11R1.22 CNC(=O)c1ccc(nc1)F WXVL_AK00442SC0370 [0,1,0,0,0,0|1,0,0]=2 105 B11R1.22 CNC(=O)c1ccc(nc1)F WXVL_AK00442SC0370 [0,1,0,0,0,0|1,0,0]=2 106 B11R1.22 CNC(=O)c1ccc(nc1)O WXVL_AK00442SC0057 [0,1,0,0,0,0|1,0,0]=2 107 B11R1.22 CNC(=O)c1ccc(nc1)O WXVL_AK00442SC0057 [0,1,0,0,0,0|1,0,0]=2 108 B11R1.22 CNC(=O)c1cnc(cn1)C WXVL_AK00442SC0072 [0,1,0,0,0,0|2,0,0]=3 109 B11R1.22 CNC(=O)c1cnc(cn1)C WXVL_AK00442SC0072 [0,1,0,0,0,0|2,0,0]=3 110 B11R1.22 CNC(=O)c1cnc(cn1)Cl WXVL_AK00442SC0383 [0,1,0,0,0,0|2,0,0]=3 111 B11R1.22 CNC(=O)c1cnc(cn1)Cl WXVL_AK00442SC0383 [0,1,0,0,0,0|2,0,0]=3 112 B11R1.22 CNC(=O)c1cnc(nc1)C WXVL_AK00442SC0032 [0,1,0,0,0,0|2,0,0]=3 113 B11R1.22 CNC(=O)c1cnc(nc1)C WXVL_AK00442SC0032 [0,1,0,0,0,0|2,0,0]=3 114 B11R1.22 CNC(=O)c1cnc(nc1)Cl WXVL_AK00442SC0148 [0,1,0,0,0,0|2,0,0]=3 115 B11R1.22 CNC(=O)c1cnc(nc1)Cl WXVL_AK00442SC0148 [0,1,0,0,0,0|2,0,0]=3 116 B11R1.22 CNC(=O)c1ncc(cn1)Cl WXVL_AK00442SC0029 [0,1,0,0,0,0|2,0,0]=3 117 B11R1.22 CNC(=O)c1ncc(cn1)Cl WXVL_AK00442SC0029 [0,1,0,0,0,0|2,0,0]=3 118 B11R1.23 CNC(=O)C1=CC=NC(=O)C1 WXVL_AK00442SC0016 [0,1,0,0,0,0|1,0,1]=3 119 B11R1.23 CNC(=O)C1=CC=NC(=O)C1 WXVL_AK00442SC0016 [0,1,0,0,0,0|1,0,1]=3 120 B11R1.23 CNC(=O)c1cc(=O)cco1 WXVL_AK00442SC0133 [0,1,0,0,0,0|1,0,0]=2 121 B11R1.23 CNC(=O)c1cc(=O)cco1 WXVL_AK00442SC0133 [0,1,0,0,0,0|1,0,0]=2 122 B11R1.23 CNC(=O)c1cc(ccn1)Br WXVL_AK00442SC0243 [0,1,0,0,0,0|1,0,0]=2 123 B11R1.23 CNC(=O)c1cc(ccn1)Br WXVL_AK00442SC0243 [0,1,0,0,0,0|1,0,0]=2 124 B11R1.23 CNC(=O)c1cc(ccn1)C WXVL_AK00442SC0235 [0,1,0,0,0,0|1,0,0]=2 125 B11R1.23 CNC(=O)c1cc(ccn1)C WXVL_AK00442SC0235 [0,1,0,0,0,0|1,0,0]=2 126 B11R1.23 CNC(=O)c1cc(ccn1)Cl WXVL_AK00442SC0373 [0,1,0,0,0,0|1,0,0]=2 127 B11R1.23 CNC(=O)c1cc(ccn1)Cl WXVL_AK00442SC0373 [0,1,0,0,0,0|1,0,0]=2 128 B11R1.23 CNC(=O)c1cc(ncn1)Cl WXVL_AK00442SC0775 [0,1,0,0,0,0|2,0,0]=3 129 B11R1.23 CNC(=O)c1cc(ncn1)Cl WXVL_AK00442SC0775 [0,1,0,0,0,0|2,0,0]=3 130 B11R1.23 CNC(=O)c1cc(ncn1)O WXVL_AK00442SC0001 [0,1,0,0,0,0|2,0,0]=3 131 B11R1.23 CNC(=O)c1cc(ncn1)O WXVL_AK00442SC0001 [0,1,0,0,0,0|2,0,0]=3 132 B11R1.23 CNC(=O)c1ccc[n+](c1)[O-] WXVL_AK00442SC1039 [0,1,0,0,0,0|1,0,0]=2 133 B11R1.23 CNC(=O)c1ccc[n+](c1)[O-] WXVL_AK00442SC1039 [0,1,0,0,0,0|1,0,0]=2 134 B11R1.23 CNC(=O)c1cccc(c1)Br WXVL_AK00442SD0041 [0,1,0,0,0,0|0,0,0]=1 135 B11R1.23 CNC(=O)c1cccc(c1)Br WXVL_AK00442SD0041 [0,1,0,0,0,0|0,0,0]=1 136 B11R1.23 CNC(=O)c1cccc(c1)C WXVL_AK00442SD0056 [0,1,0,0,0,0|0,0,0]=1 137 B11R1.23 CNC(=O)c1cccc(c1)C WXVL_AK00442SD0056 [0,1,0,0,0,0|0,0,0]=1 138 B11R1.23 CNC(=O)c1cccc(c1)Cl WXVL_AK00442SD0045 [0,1,0,0,0,0|0,0,0]=1 139 B11R1.23 CNC(=O)c1cccc(c1)Cl WXVL_AK00442SD0045 [0,1,0,0,0,0|0,0,0]=1 140 B11R1.23 CNC(=O)c1cccc(c1)F WXVL_AK00442SD0043 [0,1,0,0,0,0|0,0,0]=1 141 B11R1.23 CNC(=O)c1cccc(c1)F WXVL_AK00442SD0043 [0,1,0,0,0,0|0,0,0]=1 142 B11R1.23 CNC(=O)c1cccc(c1)I WXVL_AK00442SD0405 [0,1,0,0,0,0|0,0,0]=1 143 B11R1.23 CNC(=O)c1cccc(c1)I WXVL_AK00442SD0405 [0,1,0,0,0,0|0,0,0]=1 144 B11R1.23 CNC(=O)c1cccc(c1)O WXVL_AK00442SD1724 [0,1,0,0,0,0|0,0,0]=1 145 B11R1.23 CNC(=O)c1cccc(c1)O WXVL_AK00442SD1724 [0,1,0,0,0,0|0,0,0]=1 146 B11R1.23 CNC(=O)c1cccc(n1)Br WXVL_AK00442SC0366 [0,1,0,0,0,0|1,0,0]=2 147 B11R1.23 CNC(=O)c1cccc(n1)Br WXVL_AK00442SC0366 [0,1,0,0,0,0|1,0,0]=2 148 B11R1.23 CNC(=O)c1cccc(n1)F WXVL_AK00442SC0386 [0,1,0,0,0,0|1,0,0]=2 149 B11R1.23 CNC(=O)c1cccc(n1)F WXVL_AK00442SC0386 [0,1,0,0,0,0|1,0,0]=2 150 B11R1.23 CNC(=O)c1cccc(n1)O WXVL_AK00442SC0084 [0,1,0,0,0,0|1,0,0]=2 151 B11R1.23 CNC(=O)c1cccc(n1)O WXVL_AK00442SC0084 [0,1,0,0,0,0|1,0,0]=2 152 B11R1.23 CNC(=O)c1ccnc(c1)Br WXVL_AK00442SC0349 [0,1,0,0,0,0|1,0,0]=2 153 B11R1.23 CNC(=O)c1ccnc(c1)Br WXVL_AK00442SC0349 [0,1,0,0,0,0|1,0,0]=2 154 B11R1.23 CNC(=O)c1ccnc(c1)C WXVL_AK00442SC0400 [0,1,0,0,0,0|1,0,0]=2 155 B11R1.23 CNC(=O)c1ccnc(c1)C WXVL_AK00442SC0400 [0,1,0,0,0,0|1,0,0]=2 156 B11R1.23 CNC(=O)c1ccnc(c1)Cl WXVL_AK00442SC0083 [0,1,0,0,0,0|1,0,0]=2 157 B11R1.23 CNC(=O)c1ccnc(c1)Cl WXVL_AK00442SC0083 [0,1,0,0,0,0|1,0,0]=2 158 B11R1.23 CNC(=O)c1ccnc(c1)F WXVL_AK00442SC0015 [0,1,0,0,0,0|1,0,0]=2 159 B11R1.23 CNC(=O)c1ccnc(c1)F WXVL_AK00442SC0015 [0,1,0,0,0,0|1,0,0]=2 160 B11R1.23 CNC(=O)c1ccnc(c1)O WXVL_AK00442SC0131 [0,1,0,0,0,0|1,0,0]=2 161 B11R1.23 CNC(=O)c1ccnc(c1)O WXVL_AK00442SC0131 [0,1,0,0,0,0|1,0,0]=2 162 B11R1.23 CNC(=O)c1ccnc(n1)C WXVL_AK00442SC0296 [0,1,0,0,0,0|2,0,0]=3 163 B11R1.23 CNC(=O)c1ccnc(n1)C WXVL_AK00442SC0296 [0,1,0,0,0,0|2,0,0]=3 164 B11R1.23 CNC(=O)c1ccnc(n1)Cl WXVL_AK00442SC0392 [0,1,0,0,0,0|2,0,0]=3 165 B11R1.23 CNC(=O)c1ccnc(n1)Cl WXVL_AK00442SC0392 [0,1,0,0,0,0|2,0,0]=3 166 B11R1.23 CNC(=O)c1cncc(c1)Br WXVL_AK00442SC0369 [0,1,0,0,0,0|1,0,0]=2 167 B11R1.23 CNC(=O)c1cncc(c1)Br WXVL_AK00442SC0369 [0,1,0,0,0,0|1,0,0]=2 168 B11R1.23 CNC(=O)c1cncc(c1)C WXVL_AK00442SC0095 [0,1,0,0,0,0|1,0,0]=2 169 B11R1.23 CNC(=O)c1cncc(c1)C WXVL_AK00442SC0095 [0,1,0,0,0,0|1,0,0]=2 170 B11R1.23 CNC(=O)c1cncc(c1)Cl WXVL_AK00442SC0291 [0,1,0,0,0,0|1,0,0]=2 171 B11R1.23 CNC(=O)c1cncc(c1)Cl WXVL_AK00442SC0291 [0,1,0,0,0,0|1,0,0]=2 172 B11R1.23 CNC(=O)c1cncc(c1)F WXVL_AK00442SC0102 [0,1,0,0,0,0|1,0,0]=2 173 B11R1.23 CNC(=O)c1cncc(c1)F WXVL_AK00442SC0102 [0,1,0,0,0,0|1,0,0]=2 174 B11R1.23 CNC(=O)c1cncc(c1)O WXVL_AK00442SC0333 [0,1,0,0,0,0|1,0,0]=2 175 B11R1.23 CNC(=O)c1cncc(c1)O WXVL_AK00442SC0333 [0,1,0,0,0,0|1,0,0]=2 176 B11R1.23 CNC(=O)c1cncc(n1)C WXVL_AK00442SC0391 [0,1,0,0,0,0|2,0,0]=3 177 B11R1.23 CNC(=O)c1cncc(n1)C WXVL_AK00442SC0391 [0,1,0,0,0,0|2,0,0]=3 178 B11R1.23 CNC(=O)c1cnnc(c1)Cl WXVL_AK00442SC0966 [0,1,0,0,0,0|2,0,0]=3 179 B11R1.23 CNC(=O)c1cnnc(c1)Cl WXVL_AK00442SC0966 [0,1,0,0,0,0|2,0,0]=3 180 B11R1.23 CNC(=O)c1cnnc(c1)O WXVL_AK00442SC0795 [0,1,0,0,0,0|2,0,0]=3 181 B11R1.23 CNC(=O)c1cnnc(c1)O WXVL_AK00442SC0795 [0,1,0,0,0,0|2,0,0]=3 182 B11R1.36 CN(C)C(=O)c1ccccc1 WXVL_AN0032SD0001 [0,1,0,0,0,0|0,0,0]=1 183 B11R1.36 CN(C)C(=O)c1ccccc1 WXVL_AN0032SD0001 [0,1,0,0,0,0|0,0,0]=1 184 B11R1.36 CN(C)C(=O)c1ccccn1 WXVL_AN0032SC0058 [0,1,0,0,0,0|1,0,0]=2 185 B11R1.36 CN(C)C(=O)c1ccccn1 WXVL_AN0032SC0058 [0,1,0,0,0,0|1,0,0]=2 186 B11R1.36 CN(C)C(=O)c1cccnc1 WXVL_AN0032SC0061 [0,1,0,0,0,0|1,0,0]=2 187 B11R1.36 CN(C)C(=O)c1cccnc1 WXVL_AN0032SC0061 [0,1,0,0,0,0|1,0,0]=2 188 B11R1.36 CN(C)C(=O)c1cccnn1 WXVL_AN0032SC0374 [0,1,0,0,0,0|2,0,0]=3 189 B11R1.36 CN(C)C(=O)c1cccnn1 WXVL_AN0032SC0374 [0,1,0,0,0,0|2,0,0]=3 190 B11R1.36 CN(C)C(=O)c1ccncc1 WXVL_AN0032SC0062 [0,1,0,0,0,0|1,0,0]=2 191 B11R1.36 CN(C)C(=O)c1ccncc1 WXVL_AN0032SC0062 [0,1,0,0,0,0|1,0,0]=2 192 B11R1.36 CN(C)C(=O)c1ccncn1 WXVL_AN0032SC0231 [0,1,0,0,0,0|2,0,0]=3 193 B11R1.36 CN(C)C(=O)c1ccncn1 WXVL_AN0032SC0231 [0,1,0,0,0,0|2,0,0]=3 194 B11R1.36 CN(C)C(=O)c1ccnnc1 WXVL_AN0032SC0064 [0,1,0,0,0,0|2,0,0]=3 195 B11R1.36 CN(C)C(=O)c1ccnnc1 WXVL_AN0032SC0064 [0,1,0,0,0,0|2,0,0]=3 196 B11R1.36 CN(C)C(=O)c1cncnc1 WXVL_AN0032SC0097 [0,1,0,0,0,0|2,0,0]=3 197 B11R1.36 CN(C)C(=O)c1cncnc1 WXVL_AN0032SC0097 [0,1,0,0,0,0|2,0,0]=3 198 B11R1.36 CN(C)C(=O)c1ncccn1 WXVL_AN0032SC0096 [0,1,0,0,0,0|2,0,0]=3 199 B11R1.36 CN(C)C(=O)c1ncccn1 WXVL_AN0032SC0096 [0,1,0,0,0,0|2,0,0]=3 200 B11R1.36 NC(=O)C(=O)c1ccccc1 WXVL_AK0084SB0050 [0,1,0,0,0,0|2,0,0]=3 201 B11R1.36 NC(=O)C(=O)c1ccccc1 WXVL_AK0084SB0050 [0,1,0,0,0,0|2,0,0]=3 202 B11R1.222 CNC(=O)C1C=CCC=C1C WXVL_AK00442SB0380 [0,1,0,0,0,0|0,0,2]=3 203 B11R1.222 CNC(=O)C1C=CCC=C1C WXVL_AK00442SB0380 [0,1,0,0,0,0|0,0,2]=3 204 B11R1.222 CNC(=O)c1ccccc1Br WXVL_AK00442SD0002 [0,1,0,0,0,0|0,0,0]=1 205 B11R1.222 CNC(=O)c1ccccc1Br WXVL_AK00442SD0002 [0,1,0,0,0,0|0,0,0]=1 206 B11R1.222 CNC(=O)c1ccccc1C WXVL_AK00442SD0037 [0,1,0,0,0,0|0,0,0]=1 207 B11R1.222 CNC(=O)c1ccccc1C WXVL_AK00442SD0037 [0,1,0,0,0,0|0,0,0]=1 208 B11R1.222 CNC(=O)c1ccccc1Cl WXVL_AK00442SD0006 [0,1,0,0,0,0|0,0,0]=1 209 B11R1.222 CNC(=O)c1ccccc1Cl WXVL_AK00442SD0006 [0,1,0,0,0,0|0,0,0]=1 210 B11R1.222 CNC(=O)c1ccccc1F WXVL_AK00442SD0003 [0,1,0,0,0,0|0,0,0]=1 211 B11R1.222 CNC(=O)c1ccccc1F WXVL_AK00442SD0003 [0,1,0,0,0,0|0,0,0]=1 212 B11R1.222 CNC(=O)c1ccccc1I WXVL_AK00442SD0303 [0,1,0,0,0,0|0,0,0]=1 213 B11R1.222 CNC(=O)c1ccccc1I WXVL_AK00442SD0303 [0,1,0,0,0,0|0,0,0]=1 214 B11R1.222 CNC(=O)c1ccccc1O WXVL_AK00442SD00056 [0,1,0,0,0,0|0,0,0]=1 215 B11R1.222 CNC(=O)c1ccccc1O WXVL_AK00442SD00056 [0,1,0,0,0,0|0,0,0]=1 216 B11R1.222 CNC(=O)c1ccccc1S WXVL_AK00442SD0153 [0,1,0,0,0,0|0,0,0]=1 217 B11R1.222 CNC(=O)c1ccccc1S WXVL_AK00442SD0153 [0,1,0,0,0,0|0,0,0]=1 218 B11R1.222 CNC(=O)c1cccnc1Br WXVL_AK00442SC0367 [0,1,0,0,0,0|1,0,0]=2 219 B11R1.222 CNC(=O)c1cccnc1Br WXVL_AK00442SC0367 [0,1,0,0,0,0|1,0,0]=2 220 B11R1.222 CNC(=O)c1cccnc1C WXVL_AK00442SC0065 [0,1,0,0,0,0|1,0,0]=2 221 B11R1.222 CNC(=O)c1cccnc1C WXVL_AK00442SC0065 [0,1,0,0,0,0|1,0,0]=2 222 B11R1.222 CNC(=O)c1cccnc1Cl WXVL_AK00442SC0146 [0,1,0,0,0,0|1,0,0]=2 223 B11R1.222 CNC(=O)c1cccnc1Cl WXVL_AK00442SC0146 [0,1,0,0,0,0|1,0,0]=2 224 B11R1.222 CNC(=O)c1cccnc1F WXVL_AK00442SC0350 [0,1,0,0,0,0|1,0,0]=2 225 B11R1.222 CNC(=O)c1cccnc1F WXVL_AK00442SC0350 [0,1,0,0,0,0|1,0,0]=2 226 B11R1.222 CNC(=O)c1cccnc1O WXVL_AK00442SC0063 [0,1,0,0,0,0|1,0,0]=2 227 B11R1.222 CNC(=O)c1cccnc1O WXVL_AK00442SC0063 [0,1,0,0,0,0|1,0,0]=2 228 B11R1.222 CNC(=O)c1ccncc1Br WXVL_AK00442SC0365 [0,1,0,0,0,0|1,0,0]=2 229 B11R1.222 CNC(=O)c1ccncc1Br WXVL_AK00442SC0365 [0,1,0,0,0,0|1,0,0]=2 230 B11R1.222 CNC(=O)c1ccncc1Cl WXVL_AK00442SC0375 [0,1,0,0,0,0|1,0,0]=2 231 B11R1.222 CNC(=O)c1ccncc1Cl WXVL_AK00442SC0375 [0,1,0,0,0,0|1,0,0]=2 232 B11R1.222 CNC(=O)c1ccncc1F WXVL_AK00442SC0320 [0,1,0,0,0,0|1,0,0]=2 233 B11R1.222 CNC(=O)c1ccncc1F WXVL_AK00442SC0320 [0,1,0,0,0,0|1,0,0]=2 234 B11R1.222 CNC(=O)c1ccncc1O WXVL_AK00442SC0354 [0,1,0,0,0,0|1,0,0]=2 235 B11R1.222 CNC(=O)c1ccncc1O WXVL_AK00442SC0354 [0,1,0,0,0,0|1,0,0]=2 236 B11R1.222 CNC(=O)c1ccnnc1O WXVL_AK00442SC0899 [0,1,0,0,0,0|2,0,0]=3 237 B11R1.222 CNC(=O)c1ccnnc1O WXVL_AK00442SC0899 [0,1,0,0,0,0|2,0,0]=3 238 B11R1.222 CNC(=O)c1cnccc1Br WXVL_AK00442SC0500 [0,1,0,0,0,0|1,0,0]=2 239 B11R1.222 CNC(=O)c1cnccc1Br WXVL_AK00442SC0500 [0,1,0,0,0,0|1,0,0]=2 240 B11R1.222 CNC(=O)c1cnccc1C WXVL_AK00442SC0301 [0,1,0,0,0,0|1,0,0]=2 241 B11R1.222 CNC(=O)c1cnccc1C WXVL_AK00442SC0301 [0,1,0,0,0,0|1,0,0]=2 242 B11R1.222 CNC(=O)c1cnccc1Cl WXVL_AK00442SC0340 [0,1,0,0,0,0|1,0,0]=2 243 B11R1.222 CNC(=O)c1cnccc1Cl WXVL_AK00442SC0340 [0,1,0,0,0,0|1,0,0]=2 244 B11R1.222 CNC(=O)c1cncnc1C WXVL_AK00442SC0515 [0,1,0,0,0,0|2,0,0]=3 245 B11R1.222 CNC(=O)c1cncnc1C WXVL_AK00442SC0515 [0,1,0,0,0,0|2,0,0]=3 246 B11R1.222 CNC(=O)c1cnncc1C WXVL_AK00442SC0973 [0,1,0,0,0,0|2,0,0]=3 247 B11R1.222 CNC(=O)c1cnncc1C WXVL_AK00442SC0973 [0,1,0,0,0,0|2,0,0]=3 248 B11R1.222 CNC(=O)c1ncccc1Br WXVL_AK00442SC0501 [0,1,0,0,0,0|1,0,0]=2 249 B11R1.222 CNC(=O)c1ncccc1Br WXVL_AK00442SC0501 [0,1,0,0,0,0|1,0,0]=2 250 B11R1.222 CNC(=O)c1ncccc1C WXVL_AK00442SC0008 [0,1,0,0,0,0|1,0,0]=2 251 B11R1.222 CNC(=O)c1ncccc1C WXVL_AK00442SC0008 [0,1,0,0,0,0|1,0,0]=2 252 B11R1.222 CNC(=O)c1ncccc1Cl WXVL_AK00442SC0609 [0,1,0,0,0,0|1,0,0]=2 253 B11R1.222 CNC(=O)c1ncccc1Cl WXVL_AK00442SC0609 [0,1,0,0,0,0|1,0,0]=2 254 B11R1.222 CNC(=O)c1ncccc1F WXVL_AK00442SC0773 [0,1,0,0,0,0|1,0,0]=2 255 B11R1.222 CNC(=O)c1ncccc1F WXVL_AK00442SC0773 [0,1,0,0,0,0|1,0,0]=2 256 B11R1.222 CNC(=O)c1nccnc1Br WXVL_AK00442SC0785 [0,1,0,0,0,0|2,0,0]=3 257 B11R1.222 CNC(=O)c1nccnc1Br WXVL_AK00442SC0785 [0,1,0,0,0,0|2,0,0]=3 258 B11R1.222 CNC(=O)c1nccnc1Cl WXVL_AK00442SC0361 [0,1,0,0,0,0|2,0,0]=3 259 B11R1.222 CNC(=O)c1nccnc1Cl WXVL_AK00442SC0361 [0,1,0,0,0,0|2,0,0]=3 260 B9R1.11 CNC(=O)c1c[nH]cn1 WXVL_AK00442SC0074 [0,0,0,0,1,0|2,0,0]=3 261 B9R1.11 CNC(=O)c1c[nH]cn1 WXVL_AK00442SC0074 [0,0,0,0,1,0|2,0,0]=3 262 B9R1.11 CNC(=O)c1cc[nH]c1 WXVL_AK00442SC0013 [0,0,0,0,1,0|1,0,0]=2 263 B9R1.11 CNC(=O)c1cc[nH]c1 WXVL_AK00442SC0013 [0,0,0,0,1,0|1,0,0]=2 264 B9R1.11 CNC(=O)c1cc[nH]n1 WXVL_AK00442SC0003 [0,0,0,0,1,0|2,0,0]=3 265 B9R1.11 CNC(=O)c1cc[nH]n1 WXVL_AK00442SC0003 [0,0,0,0,1,0|2,0,0]=3 266 B9R1.11 CNC(=O)c1ccco1 WXVL_AK00442SC0049 [0,0,0,0,1,0|1,0,0]=2 267 B9R1.11 CNC(=O)c1ccco1 WXVL_AK00442SC0049 [0,0,0,0,1,0|1,0,0]=2 268 B9R1.11 CNC(=O)c1cccs1 WXVL_AK00442SC0051 [0,0,0,0,1,0|1,0,0]=2 269 B9R1.11 CNC(=O)c1cccs1 WXVL_AK00442SC0051 [0,0,0,0,1,0|1,0,0]=2 270 B9R1.11 CNC(=O)c1ccno1 WXVL_AK00442SC0080 [0,0,0,0,1,0|2,0,0]=3 271 B9R1.11 CNC(=O)c1ccno1 WXVL_AK00442SC0080 [0,0,0,0,1,0|2,0,0]=3 272 B9R1.11 CNC(=O)c1ccns1 WXVL_AK00442SC0027 [0,0,0,0,1,0|2,0,0]=3 273 B9R1.11 CNC(=O)c1ccns1 WXVL_AK00442SC0027 [0,0,0,0,1,0|2,0,0]=3 274 B9R1.11 CNC(=O)c1ccoc1 WXVL_AK00442SC0050 [0,0,0,0,1,0|1,0,0]=2 275 B9R1.11 CNC(=O)c1ccoc1 WXVL_AK00442SC0050 [0,0,0,0,1,0|1,0,0]=2 276 B9R1.11 CNC(=O)c1ccon1 WXVL_AK00442SC0116 [0,0,0,0,1,0|2,0,0]=3 277 B9R1.11 CNC(=O)c1ccon1 WXVL_AK00442SC0116 [0,0,0,0,1,0|2,0,0]=3 278 B9R1.11 CNC(=O)c1ccsc1 WXVL_AK00442SC0054 [0,0,0,0,1,0|1,0,0]=2 279 B9R1.11 CNC(=O)c1ccsc1 WXVL_AK00442SC0054 [0,0,0,0,1,0|1,0,0]=2 280 B9R1.11 CNC(=O)c1ccsn1 WXVL_AK00442SC0764 [0,0,0,0,1,0|2,0,0]=3 281 B9R1.11 CNC(=O)c1ccsn1 WXVL_AK00442SC0764 [0,0,0,0,1,0|2,0,0]=3 282 B9R1.11 CNC(=O)c1cn[nH]c1 WXVL_AK00442SC0254 [0,0,0,0,1,0|2,0,0]=3 283 B9R1.11 CNC(=O)c1cn[nH]c1 WXVL_AK00442SC0254 [0,0,0,0,1,0|2,0,0]=3 284 B9R1.11 CNC(=O)c1cnc[nH]1 WXVL_AK00442SC0247 [0,0,0,0,1,0|2,0,0]=3 285 B9R1.11 CNC(=O)c1cnc[nH]1 WXVL_AK00442SC0247 [0,0,0,0,1,0|2,0,0]=3 286 B9R1.11 CNC(=O)c1cnco1 WXVL_AK00442SC0018 [0,0,0,0,1,0|2,0,0]=3 287 B9R1.11 CNC(=O)c1cnco1 WXVL_AK00442SC0018 [0,0,0,0,1,0|2,0,0]=3 288 B9R1.11 CNC(=O)c1cncs1 WXVL_AK00442SC0113 [0,0,0,0,1,0|2,0,0]=3 289 B9R1.11 CNC(=O)c1cncs1 WXVL_AK00442SC0113 [0,0,0,0,1,0|2,0,0]=3 290 B9R1.11 CNC(=O)c1cnon1 WXVL_AK00442SC0777 [0,0,0,0,1,0|3,0,0]=4 291 B9R1.11 CNC(=O)c1cnon1 WXVL_AK00442SC0777 [0,0,0,0,1,0|3,0,0]=4 292 B9R1.11 CNC(=O)c1cnsn1 WXVL_AK00442SC1291 [0,0,0,0,1,0|3,0,0]=4 293 B9R1.11 CNC(=O)c1cnsn1 WXVL_AK00442SC1291 [0,0,0,0,1,0|3,0,0]=4 294 B9R1.11 CNC(=O)c1cocn1 WXVL_AK00442SC0118 [0,0,0,0,1,0|2,0,0]=3 295 B9R1.11 CNC(=O)c1cocn1 WXVL_AK00442SC0118 [0,0,0,0,1,0|2,0,0]=3 296 B9R1.11 CNC(=O)c1cscn1 WXVL_AK00442SC0092 [0,0,0,0,1,0|2,0,0]=3 297 B9R1.11 CNC(=O)c1cscn1 WXVL_AK00442SC0092 [0,0,0,0,1,0|2,0,0]=3 298 B9R1.11 CNC(=O)c1csnn1 WXVL_AK00442SC0002 [0,0,0,0,1,0|3,0,0]=4 299 B9R1.11 CNC(=O)c1csnn1 WXVL_AK00442SC0002 [0,0,0,0,1,0|3,0,0]=4 300 B9R1.11 CNC(=O)c1nc[nH]n1 WXVL_AK00442SC0376 [0,0,0,0,1,0|3,0,0]=4 301 B9R1.11 CNC(=O)c1nc[nH]n1 WXVL_AK00442SC0376 [0,0,0,0,1,0|3,0,0]=4 302 B9R1.11 CNC(=O)c1nccs1 WXVL_AK00442SC0110 [0,0,0,0,1,0|2,0,0]=3 303 B9R1.11 CNC(=O)c1nccs1 WXVL_AK00442SC0110 [0,0,0,0,1,0|2,0,0]=3 304 B9R1.11 CNC(=O)c1nnc[nH]1 WXVL_AK00442SC00053 [0,0,0,0,1,0|3,0,0]=4 305 B9R1.11 CNC(=O)c1nnc[nH]1 WXVL_AK00442SC00053 [0,0,0,0,1,0|3,0,0]=4 306 B11R1.40 C#CC(=O)Nc1ccccc1 WXVL_AG00183SB0338 [0,0,0,0,0,1|1,0,1]=3 307 B11R1.40 C#CC(=O)Nc1ccccc1 WXVL_AG00183SB0338 [0,0,0,0,0,1|1,0,1]=3 308 B11R1.40 C#CC(=O)Nc1ccccn1 WXVL_AF00298SB0338 [0,0,0,0,0,1|2,0,1]=4 309 B11R1.40 C#CC(=O)Nc1ccccn1 WXVL_AF00298SB0338 [0,0,0,0,0,1|2,0,1]=4 310 B11R1.40 CCC(=O)Nc1ccccc1 WXVL_AG00183SB0064 [0,0,0,0,0,1|1,0,0]=2 311 B11R1.40 CCC(=O)Nc1ccccc1 WXVL_AG00183SB0064 [0,0,0,0,0,1|1,0,0]=2 312 B11R1.40 CCC(=O)Nc1ccccn1 WXVL_AF00298SB0064 [0,0,0,0,0,1|2,0,0]=3 313 B11R1.40 CCC(=O)Nc1ccccn1 WXVL_AF00298SB0064 [0,0,0,0,0,1|2,0,0]=3 314 B11R1.40 CCC(=O)Nc1cccnn1 WXVL_AF0151SB0064 [0,0,0,0,0,1|3,0,0]=4 315 B11R1.40 CCC(=O)Nc1cccnn1 WXVL_AF0151SB0064 [0,0,0,0,0,1|3,0,0]=4 316 B11R1.40 CCC(=O)Nc1ccncn1 WXVL_AF0139SB0064 [0,0,0,0,0,1|3,0,0]=4 317 B11R1.40 CCC(=O)Nc1ccncn1 WXVL_AF0139SB0064 [0,0,0,0,0,1|3,0,0]=4 318 B11R1.40 CCC(=O)Nc1ccnnc1 WXVL_AF0624SB0064 [0,0,0,0,0,1|3,0,0]=4 319 B11R1.40 CCC(=O)Nc1ccnnc1 WXVL_AF0624SB0064 [0,0,0,0,0,1|3,0,0]=4 320 B11R1.40 CCC(=O)Nc1cnccn1 WXVL_AF0120SB0064 [0,0,0,0,0,1|3,0,0]=4 321 B11R1.40 CCC(=O)Nc1cnccn1 WXVL_AF0120SB0064 [0,0,0,0,0,1|3,0,0]=4 322 B11R1.40 CCC(=O)Nc1cncnc1 WXVL_AF0085SB0064 [0,0,0,0,0,1|3,0,0]=4 323 B11R1.40 CCC(=O)Nc1cncnc1 WXVL_AF0085SB0064 [0,0,0,0,0,1|3,0,0]=4 324 B11R1.40 CNC(=O)Cc1ccccc1 WXVL_AK00442SB0092 [0,0,0,0,0,1|0,0,0]=1 325 B11R1.40 CNC(=O)Cc1ccccc1 WXVL_AK00442SB0092 [0,0,0,0,0,1|0,0,0]=1 326 B11R1.40 CNC(=O)Cc1ccccn1 WXVL_AK00442SA0032 [0,0,0,0,0,1|1,0,0]=2 327 B11R1.40 CNC(=O)Cc1ccccn1 WXVL_AK00442SA0032 [0,0,0,0,0,1|1,0,0]=2 328 B11R1.40 CNC(=O)Cc1cccnc1 WXVL_AK00442SA0029 [0,0,0,0,0,1|1,0,0]=2 329 B11R1.40 CNC(=O)Cc1cccnc1 WXVL_AK00442SA0029 [0,0,0,0,0,1|1,0,0]=2 330 B11R1.40 CNC(=O)Cc1cccnc1 WXVL_AK00442SB00049 [0,0,0,0,0,1|1,0,0]=2 331 B11R1.40 CNC(=O)Cc1cccnc1 WXVL_AK00442SB00049 [0,0,0,0,0,1|1,0,0]=2 332 B11R1.40 CNC(=O)Cc1ccncc1 WXVL_AK00442SA00106 [0,0,0,0,0,1|1,0,0]=2 333 B11R1.40 CNC(=O)Cc1ccncc1 WXVL_AK00442SA00106 [0,0,0,0,0,1|1,0,0]=2 334 B11R1.40 CNC(=O)Cc1cncnc1 WXVL_AK00442SA0242 [0,0,0,0,0,1|2,0,0]=3 335 B11R1.40 CNC(=O)Cc1cncnc1 WXVL_AK00442SA0242 [0,0,0,0,0,1|2,0,0]=3 336 B11R1.40 CNC(=O)Cc1ncccn1 WXVL_AK00442SA0307 [0,0,0,0,0,1|2,0,0]=3 337 B11R1.40 CNC(=O)Cc1ncccn1 WXVL_AK00442SA0307 [0,0,0,0,0,1|2,0,0]=3 338 B11R1.40 CNC(=O)Nc1ccccn1 WXVL_AK00442YV0189 [0,0,0,0,0,1|1,0,0]=2 339 B11R1.40 CNC(=O)Nc1ccccn1 WXVL_AK00442YV0189 [0,0,0,0,0,1|1,0,0]=2 340 B11R1.40 O=C(CO)Nc1ccccc1 WXVL_AG00183SB2706 [0,0,0,0,0,1|2,0,0]=3 341 B11R1.40 O=C(CO)Nc1ccccc1 WXVL_AG00183SB2706 [0,0,0,0,0,1|2,0,0]=3 342 B11R1.40 O=C(CO)Nc1ccccn1 WXVL_AF00298SB2706 [0,0,0,0,0,1|3,0,0]=4 343 B11R1.40 O=C(CO)Nc1ccccn1 WXVL_AF00298SB2706 [0,0,0,0,0,1|3,0,0]=4 344 B8R0.6 C/C=C/C=C/C(=O)NC WXVL_AK00442SB0348 [1,0,1,0,0,0|0,0,1]=3 345 B8R0.6 C/C=C/C=C/C(=O)NC WXVL_AK00442SB0348 [1,0,1,0,0,0|0,0,1]=3 346 B8R1.2 CNc1ccncn1 WXVL_AK00442LP3358 [2,0,0,0,0,0|2,0,0]=4 347 B8R1.2 CNc1ccncn1 WXVL_AK00442LP3358 [2,0,0,0,0,0|2,0,0]=4 348 B8R1.2 CNc1ncccn1 WXVL_AK00442LP0002 [2,0,0,0,0,0|2,0,0]=4 349 B8R1.2 CNc1ncccn1 WXVL_AK00442LP0002 [2,0,0,0,0,0|2,0,0]=4 350 B10R1.13 Cc1ccc(cc1)C(=O)N WXVL_AK0084SD0078 [1,1,0,0,0,0|0,0,0]=2 351 B10R1.13 Cc1ccc(cc1)C(=O)N WXVL_AK0084SD0078 [1,1,0,0,0,0|0,0,0]=2 352 B10R1.13 Cc1ccc(cn1)C(=O)N WXVL_AK0084SC0060 [1,1,0,0,0,0|1,0,0]=3 353 B10R1.13 Cc1ccc(cn1)C(=O)N WXVL_AK0084SC0060 [1,1,0,0,0,0|1,0,0]=3 354 B10R1.13 Cc1ccc(nc1)C(=O)N WXVL_AK0084SC0104 [1,1,0,0,0,0|1,0,0]=3 355 B10R1.13 Cc1ccc(nc1)C(=O)N WXVL_AK0084SC0104 [1,1,0,0,0,0|1,0,0]=3 356 B10R1.13 Cc1cnc(cn1)C(=O)N WXVL_AK0084SC0072 [1,1,0,0,0,0|2,0,0]=4 357 B10R1.13 Cc1cnc(cn1)C(=O)N WXVL_AK0084SC0072 [1,1,0,0,0,0|2,0,0]=4 358 B10R1.13 Cc1ncc(cn1)C(=O)N WXVL_AK0084SC0032 [1,1,0,0,0,0|2,0,0]=4 359 B10R1.13 Cc1ncc(cn1)C(=O)N WXVL_AK0084SC0032 [1,1,0,0,0,0|2,0,0]=4 360 B10R1.13 NC(=O)c1cc[n+](cc1)[O-] WXVL_AK0084SC0858 [1,1,0,0,0,0|1,0,0]=3 361 B10R1.13 NC(=O)c1cc[n+](cc1)[O-] WXVL_AK0084SC0858 [1,1,0,0,0,0|1,0,0]=3 362 B10R1.13 NC(=O)c1ccc(=O)[nH]c1 WXVL_AK0084SC2212 [1,1,0,0,0,0|1,0,0]=3 363 B10R1.13 NC(=O)c1ccc(=O)[nH]c1 WXVL_AK0084SC2212 [1,1,0,0,0,0|1,0,0]=3 364 B10R1.13 NC(=O)c1ccc(=O)oc1 WXVL_AK0084SC0132 [1,1,0,0,0,0|1,0,0]=3 365 B10R1.13 NC(=O)c1ccc(=O)oc1 WXVL_AK0084SC0132 [1,1,0,0,0,0|1,0,0]=3 366 B10R1.13 NC(=O)c1ccc(cc1)Br WXVL_AK0084SD0060 [1,1,0,0,0,0|0,0,0]=2 367 B10R1.13 NC(=O)c1ccc(cc1)Br WXVL_AK0084SD0060 [1,1,0,0,0,0|0,0,0]=2 368 B10R1.13 NC(=O)c1ccc(cc1)Cl WXVL_AK0084SD0062 [1,1,0,0,0,0|0,0,0]=2 369 B10R1.13 NC(=O)c1ccc(cc1)Cl WXVL_AK0084SD0062 [1,1,0,0,0,0|0,0,0]=2 370 B10R1.13 NC(=O)c1ccc(cc1)F WXVL_AK0084SD0061 [1,1,0,0,0,0|0,0,0]=2 371 B10R1.13 NC(=O)c1ccc(cc1)F WXVL_AK0084SD0061 [1,1,0,0,0,0|0,0,0]=2 372 B10R1.13 NC(=O)c1ccc(cc1)I WXVL_AK0084SD0421 [1,1,0,0,0,0|0,0,0]=2 373 B10R1.13 NC(=O)c1ccc(cc1)I WXVL_AK0084SD0421 [1,1,0,0,0,0|0,0,0]=2 374 B10R1.13 NC(=O)c1ccc(cc1)O WXVL_AK0084SD0069 [1,1,0,0,0,0|0,0,0]=2 375 B10R1.13 NC(=O)c1ccc(cc1)O WXVL_AK0084SD0069 [1,1,0,0,0,0|0,0,0]=2 376 B10R1.13 NC(=O)c1ccc(cc1)S WXVL_AK0084SD0154 [1,1,0,0,0,0|0,0,0]=2 377 B10R1.13 NC(=O)c1ccc(cc1)S WXVL_AK0084SD0154 [1,1,0,0,0,0|0,0,0]=2 378 B10R1.13 NC(=O)c1ccc(cn1)Br WXVL_AK0084SC0363 [1,1,0,0,0,0|1,0,0]=3 379 B10R1.13 NC(=O)c1ccc(cn1)Br WXVL_AK0084SC0363 [1,1,0,0,0,0|1,0,0]=3 380 B10R1.13 NC(=O)c1ccc(cn1)Cl WXVL_AK0084SC0381 [1,1,0,0,0,0|1,0,0]=3 381 B10R1.13 NC(=O)c1ccc(cn1)Cl WXVL_AK0084SC0381 [1,1,0,0,0,0|1,0,0]=3 382 B10R1.13 NC(=O)c1ccc(cn1)F WXVL_AK0084SC0114 [1,1,0,0,0,0|1,0,0]=3 383 B10R1.13 NC(=O)c1ccc(cn1)F WXVL_AK0084SC0114 [1,1,0,0,0,0|1,0,0]=3 384 B10R1.13 NC(=O)c1ccc(cn1)O WXVL_AK0084SC0130 [1,1,0,0,0,0|1,0,0]=3 385 B10R1.13 NC(=O)c1ccc(cn1)O WXVL_AK0084SC0130 [1,1,0,0,0,0|1,0,0]=3 386 B10R1.13 NC(=O)c1ccc(nc1)Br WXVL_AK0084SC0352 [1,1,0,0,0,0|1,0,0]=3 387 B10R1.13 NC(=O)c1ccc(nc1)Br WXVL_AK0084SC0352 [1,1,0,0,0,0|1,0,0]=3 388 B10R1.13 NC(=O)c1ccc(nc1)Cl WXVL_AK0084SC0147 [1,1,0,0,0,0|1,0,0]=3 389 B10R1.13 NC(=O)c1ccc(nc1)Cl WXVL_AK0084SC0147 [1,1,0,0,0,0|1,0,0]=3 390 B10R1.13 NC(=O)c1ccc(nc1)F WXVL_AK0084SC0370 [1,1,0,0,0,0|1,0,0]=3 391 B10R1.13 NC(=O)c1ccc(nc1)F WXVL_AK0084SC0370 [1,1,0,0,0,0|1,0,0]=3 392 B10R1.13 NC(=O)c1ccc(nc1)O WXVL_AK0084SC0057 [1,1,0,0,0,0|1,0,0]=3 393 B10R1.13 NC(=O)c1ccc(nc1)O WXVL_AK0084SC0057 [1,1,0,0,0,0|1,0,0]=3 394 B10R1.13 NC(=O)c1cnc(cn1)Cl WXVL_AK0084SC0383 [1,1,0,0,0,0|2,0,0]=4 395 B10R1.13 NC(=O)c1cnc(cn1)Cl WXVL_AK0084SC0383 [1,1,0,0,0,0|2,0,0]=4 396 B10R1.13 NC(=O)c1cnc(nc1)Cl WXVL_AK0084SC0148 [1,1,0,0,0,0|2,0,0]=4 397 B10R1.13 NC(=O)c1cnc(nc1)Cl WXVL_AK0084SC0148 [1,1,0,0,0,0|2,0,0]=4 398 B10R1.13 NC(=O)c1ncc(cn1)Cl WXVL_AK0084SC0029 [1,1,0,0,0,0|2,0,0]=4 399 B10R1.13 NC(=O)c1ncc(cn1)Cl WXVL_AK0084SC0029 [1,1,0,0,0,0|2,0,0]=4 400 B10R1.28 NS(=O)(=O)c1ccccn1 WXVL_AK0084HU0098 [1,1,0,0,0,0|2,0,0]=4 401 B10R1.28 NS(=O)(=O)c1ccccn1 WXVL_AK0084HU0098 [1,1,0,0,0,0|2,0,0]=4 402 B10R1.28 NS(=O)(=O)c1cccnc1 WXVL_AK0084HU0127 [1,1,0,0,0,0|2,0,0]=4 403 B10R1.28 NS(=O)(=O)c1cccnc1 WXVL_AK0084HU0127 [1,1,0,0,0,0|2,0,0]=4 404 B10R1.28 NS(=O)(=O)c1ccncc1 WXVL_AK0084HU0382 [1,1,0,0,0,0|2,0,0]=4 405 B10R1.28 NS(=O)(=O)c1ccncc1 WXVL_AK0084HU0382 [1,1,0,0,0,0|2,0,0]=4 406 B10R1.61 CC1=CCC=CC1C(=O)N WXVL_AK0084SB0380 [1,1,0,0,0,0|0,0,2]=4 407 B10R1.61 CC1=CCC=CC1C(=O)N WXVL_AK0084SB0380 [1,1,0,0,0,0|0,0,2]=4 408 B10R1.61 Cc1ccccc1C(=O)N WXVL_AK0084SD0037 [1,1,0,0,0,0|0,0,0]=2 409 B10R1.61 Cc1ccccc1C(=O)N WXVL_AK0084SD0037 [1,1,0,0,0,0|0,0,0]=2 410 B10R1.61 Cc1cccnc1C(=O)N WXVL_AK0084SC0008 [1,1,0,0,0,0|1,0,0]=3 411 B10R1.61 Cc1cccnc1C(=O)N WXVL_AK0084SC0008 [1,1,0,0,0,0|1,0,0]=3 412 B10R1.61 Cc1ccncc1C(=O)N WXVL_AK0084SC0301 [1,1,0,0,0,0|1,0,0]=3 413 B10R1.61 Cc1ccncc1C(=O)N WXVL_AK0084SC0301 [1,1,0,0,0,0|1,0,0]=3 414 B10R1.61 Cc1cnncc1C(=O)N WXVL_AK0084SC0973 [1,1,0,0,0,0|2,0,0]=4 415 B10R1.61 Cc1cnncc1C(=O)N WXVL_AK0084SC0973 [1,1,0,0,0,0|2,0,0]=4 416 B10R1.61 Cc1ncccc1C(=O)N WXVL_AK0084SC0065 [1,1,0,0,0,0|1,0,0]=3 417 B10R1.61 Cc1ncccc1C(=O)N WXVL_AK0084SC0065 [1,1,0,0,0,0|1,0,0]=3 418 B10R1.61 Cc1ncncc1C(=O)N WXVL_AK0084SC0515 [1,1,0,0,0,0|2,0,0]=4 419 B10R1.61 Cc1ncncc1C(=O)N WXVL_AK0084SC0515 [1,1,0,0,0,0|2,0,0]=4 420 B10R1.61 NC(=O)c1ccccc1Br WXVL_AK0084SD0002 [1,1,0,0,0,0|0,0,0]=2 421 B10R1.61 NC(=O)c1ccccc1Br WXVL_AK0084SD0002 [1,1,0,0,0,0|0,0,0]=2 422 B10R1.61 NC(=O)c1ccccc1Cl WXVL_AK0084SD0006 [1,1,0,0,0,0|0,0,0]=2 423 B10R1.61 NC(=O)c1ccccc1Cl WXVL_AK0084SD0006 [1,1,0,0,0,0|0,0,0]=2 424 B10R1.61 NC(=O)c1ccccc1F WXVL_AK0084SD0003 [1,1,0,0,0,0|0,0,0]=2 425 B10R1.61 NC(=O)c1ccccc1F WXVL_AK0084SD0003 [1,1,0,0,0,0|0,0,0]=2 426 B10R1.61 NC(=O)c1ccccc1I WXVL_AK0084SD0303 [1,1,0,0,0,0|0,0,0]=2 427 B10R1.61 NC(=O)c1ccccc1I WXVL_AK0084SD0303 [1,1,0,0,0,0|0,0,0]=2 428 B10R1.61 NC(=O)c1ccccc1O WXVL_AK0084SD00056 [1,1,0,0,0,0|0,0,0]=2 429 B10R1.61 NC(=O)c1ccccc1O WXVL_AK0084SD00056 [1,1,0,0,0,0|0,0,0]=2 430 B10R1.61 NC(=O)c1ccccc1S WXVL_AK0084SD0153 [1,1,0,0,0,0|0,0,0]=2 431 B10R1.61 NC(=O)c1ccccc1S WXVL_AK0084SD0153 [1,1,0,0,0,0|0,0,0]=2 432 B10R1.61 NC(=O)c1cccnc1Br WXVL_AK0084SC0367 [1,1,0,0,0,0|1,0,0]=3 433 B10R1.61 NC(=O)c1cccnc1Br WXVL_AK0084SC0367 [1,1,0,0,0,0|1,0,0]=3 434 B10R1.61 NC(=O)c1cccnc1Cl WXVL_AK0084SC0146 [1,1,0,0,0,0|1,0,0]=3 435 B10R1.61 NC(=O)c1cccnc1Cl WXVL_AK0084SC0146 [1,1,0,0,0,0|1,0,0]=3 436 B10R1.61 NC(=O)c1cccnc1F WXVL_AK0084SC0350 [1,1,0,0,0,0|1,0,0]=3 437 B10R1.61 NC(=O)c1cccnc1F WXVL_AK0084SC0350 [1,1,0,0,0,0|1,0,0]=3 438 B10R1.61 NC(=O)c1cccnc1O WXVL_AK0084SC0063 [1,1,0,0,0,0|1,0,0]=3 439 B10R1.61 NC(=O)c1cccnc1O WXVL_AK0084SC0063 [1,1,0,0,0,0|1,0,0]=3 440 B10R1.61 NC(=O)c1ccncc1Br WXVL_AK0084SC0365 [1,1,0,0,0,0|1,0,0]=3 441 B10R1.61 NC(=O)c1ccncc1Br WXVL_AK0084SC0365 [1,1,0,0,0,0|1,0,0]=3 442 B10R1.61 NC(=O)c1ccncc1Cl WXVL_AK0084SC0375 [1,1,0,0,0,0|1,0,0]=3 443 B10R1.61 NC(=O)c1ccncc1Cl WXVL_AK0084SC0375 [1,1,0,0,0,0|1,0,0]=3 444 B10R1.61 NC(=O)c1ccncc1F WXVL_AK0084SC0320 [1,1,0,0,0,0|1,0,0]=3 445 B10R1.61 NC(=O)c1ccncc1F WXVL_AK0084SC0320 [1,1,0,0,0,0|1,0,0]=3 446 B10R1.61 NC(=O)c1ccncc1O WXVL_AK0084SC0354 [1,1,0,0,0,0|1,0,0]=3 447 B10R1.61 NC(=O)c1ccncc1O WXVL_AK0084SC0354 [1,1,0,0,0,0|1,0,0]=3 448 B10R1.61 NC(=O)c1ccnnc1O WXVL_AK0084SC0899 [1,1,0,0,0,0|2,0,0]=4 449 B10R1.61 NC(=O)c1ccnnc1O WXVL_AK0084SC0899 [1,1,0,0,0,0|2,0,0]=4 450 B10R1.61 NC(=O)c1cnccc1Br WXVL_AK0084SC0500 [1,1,0,0,0,0|1,0,0]=3 451 B10R1.61 NC(=O)c1cnccc1Br WXVL_AK0084SC0500 [1,1,0,0,0,0|1,0,0]=3 452 B10R1.61 NC(=O)c1cnccc1Cl WXVL_AK0084SC0340 [1,1,0,0,0,0|1,0,0]=3 453 B10R1.61 NC(=O)c1cnccc1Cl WXVL_AK0084SC0340 [1,1,0,0,0,0|1,0,0]=3 454 B10R1.61 NC(=O)c1ncccc1Br WXVL_AK0084SC0501 [1,1,0,0,0,0|1,0,0]=3 455 B10R1.61 NC(=O)c1ncccc1Br WXVL_AK0084SC0501 [1,1,0,0,0,0|1,0,0]=3 456 B10R1.61 NC(=O)c1ncccc1Cl WXVL_AK0084SC0609 [1,1,0,0,0,0|1,0,0]=3 457 B10R1.61 NC(=O)c1ncccc1Cl WXVL_AK0084SC0609 [1,1,0,0,0,0|1,0,0]=3 458 B10R1.61 NC(=O)c1ncccc1F WXVL_AK0084SC0773 [1,1,0,0,0,0|1,0,0]=3 459 B10R1.61 NC(=O)c1ncccc1F WXVL_AK0084SC0773 [1,1,0,0,0,0|1,0,0]=3 460 B10R1.61 NC(=O)c1nccnc1Br WXVL_AK0084SC0785 [1,1,0,0,0,0|2,0,0]=4 461 B10R1.61 NC(=O)c1nccnc1Br WXVL_AK0084SC0785 [1,1,0,0,0,0|2,0,0]=4 462 B10R1.61 NC(=O)c1nccnc1Cl WXVL_AK0084SC0361 [1,1,0,0,0,0|2,0,0]=4 463 B10R1.61 NC(=O)c1nccnc1Cl WXVL_AK0084SC0361 [1,1,0,0,0,0|2,0,0]=4 464 B10R1.113 Cc1cc(ccn1)C(=O)N WXVL_AK0084SC0400 [1,1,0,0,0,0|1,0,0]=3 465 B10R1.113 Cc1cc(ccn1)C(=O)N WXVL_AK0084SC0400 [1,1,0,0,0,0|1,0,0]=3 466 B10R1.113 Cc1cccc(c1)C(=O)N WXVL_AK0084SD0056 [1,1,0,0,0,0|0,0,0]=2 467 B10R1.113 Cc1cccc(c1)C(=O)N WXVL_AK0084SD0056 [1,1,0,0,0,0|0,0,0]=2 468 B10R1.113 Cc1ccnc(c1)C(=O)N WXVL_AK0084SC0235 [1,1,0,0,0,0|1,0,0]=3 469 B10R1.113 Cc1ccnc(c1)C(=O)N WXVL_AK0084SC0235 [1,1,0,0,0,0|1,0,0]=3 470 B10R1.113 Cc1cncc(c1)C(=O)N WXVL_AK0084SC0095 [1,1,0,0,0,0|1,0,0]=3 471 B10R1.113 Cc1cncc(c1)C(=O)N WXVL_AK0084SC0095 [1,1,0,0,0,0|1,0,0]=3 472 B10R1.113 Cc1cncc(n1)C(=O)N WXVL_AK0084SC0391 [1,1,0,0,0,0|2,0,0]=4 473 B10R1.113 Cc1cncc(n1)C(=O)N WXVL_AK0084SC0391 [1,1,0,0,0,0|2,0,0]=4 474 B10R1.113 Cc1nccc(n1)C(=O)N WXVL_AK0084SC0296 [1,1,0,0,0,0|2,0,0]=4 475 B10R1.113 Cc1nccc(n1)C(=O)N WXVL_AK0084SC0296 [1,1,0,0,0,0|2,0,0]=4 476 B10R1.113 NC(=O)C1=CC=NC(=O)C1 WXVL_AK0084SC0016 [1,1,0,0,0,0|1,0,1]=4 477 B10R1.113 NC(=O)C1=CC=NC(=O)C1 WXVL_AK0084SC0016 [1,1,0,0,0,0|1,0,1]=4 478 B10R1.113 NC(=O)c1cc(=O)cco1 WXVL_AK0084SC0133 [1,1,0,0,0,0|1,0,0]=3 479 B10R1.113 NC(=O)c1cc(=O)cco1 WXVL_AK0084SC0133 [1,1,0,0,0,0|1,0,0]=3 480 B10R1.113 NC(=O)c1cc(ccn1)Br WXVL_AK0084SC0243 [1,1,0,0,0,0|1,0,0]=3 481 B10R1.113 NC(=O)c1cc(ccn1)Br WXVL_AK0084SC0243 [1,1,0,0,0,0|1,0,0]=3 482 B10R1.113 NC(=O)c1cc(ccn1)Cl WXVL_AK0084SC0373 [1,1,0,0,0,0|1,0,0]=3 483 B10R1.113 NC(=O)c1cc(ccn1)Cl WXVL_AK0084SC0373 [1,1,0,0,0,0|1,0,0]=3 484 B10R1.113 NC(=O)c1cc(ncn1)Cl WXVL_AK0084SC0775 [1,1,0,0,0,0|2,0,0]=4 485 B10R1.113 NC(=O)c1cc(ncn1)Cl WXVL_AK0084SC0775 [1,1,0,0,0,0|2,0,0]=4 486 B10R1.113 NC(=O)c1cc(ncn1)O WXVL_AK0084SC0001 [1,1,0,0,0,0|2,0,0]=4 487 B10R1.113 NC(=O)c1cc(ncn1)O WXVL_AK0084SC0001 [1,1,0,0,0,0|2,0,0]=4 488 B10R1.113 NC(=O)c1ccc[n+](c1)[O-] WXVL_AK0084SC1039 [1,1,0,0,0,0|1,0,0]=3 489 B10R1.113 NC(=O)c1ccc[n+](c1)[O-] WXVL_AK0084SC1039 [1,1,0,0,0,0|1,0,0]=3 490 B10R1.113 NC(=O)c1cccc(c1)Br WXVL_AK0084SD0041 [1,1,0,0,0,0|0,0,0]=2 491 B10R1.113 NC(=O)c1cccc(c1)Br WXVL_AK0084SD0041 [1,1,0,0,0,0|0,0,0]=2 492 B10R1.113 NC(=O)c1cccc(c1)Cl WXVL_AK0084SD0045 [1,1,0,0,0,0|0,0,0]=2 493 B10R1.113 NC(=O)c1cccc(c1)Cl WXVL_AK0084SD0045 [1,1,0,0,0,0|0,0,0]=2 494 B10R1.113 NC(=O)c1cccc(c1)F WXVL_AK0084SD0043 [1,1,0,0,0,0|0,0,0]=2 495 B10R1.113 NC(=O)c1cccc(c1)F WXVL_AK0084SD0043 [1,1,0,0,0,0|0,0,0]=2 496 B10R1.113 NC(=O)c1cccc(c1)I WXVL_AK0084SD0405 [1,1,0,0,0,0|0,0,0]=2 497 B10R1.113 NC(=O)c1cccc(c1)I WXVL_AK0084SD0405 [1,1,0,0,0,0|0,0,0]=2 498 B10R1.113 NC(=O)c1cccc(c1)O WXVL_AK0084SD1724 [1,1,0,0,0,0|0,0,0]=2 499 B10R1.113 NC(=O)c1cccc(c1)O WXVL_AK0084SD1724 [1,1,0,0,0,0|0,0,0]=2 500 B10R1.113 NC(=O)c1cccc(n1)Br WXVL_AK0084SC0366 [1,1,0,0,0,0|1,0,0]=3 501 B10R1.113 NC(=O)c1cccc(n1)Br WXVL_AK0084SC0366 [1,1,0,0,0,0|1,0,0]=3 502 B10R1.113 NC(=O)c1cccc(n1)F WXVL_AK0084SC0386 [1,1,0,0,0,0|1,0,0]=3 503 B10R1.113 NC(=O)c1cccc(n1)F WXVL_AK0084SC0386 [1,1,0,0,0,0|1,0,0]=3 504 B10R1.113 NC(=O)c1cccc(n1)O WXVL_AK0084SC0084 [1,1,0,0,0,0|1,0,0]=3 505 B10R1.113 NC(=O)c1cccc(n1)O WXVL_AK0084SC0084 [1,1,0,0,0,0|1,0,0]=3 506 B10R1.113 NC(=O)c1ccnc(c1)Br WXVL_AK0084SC0349 [1,1,0,0,0,0|1,0,0]=3 507 B10R1.113 NC(=O)c1ccnc(c1)Br WXVL_AK0084SC0349 [1,1,0,0,0,0|1,0,0]=3 508 B10R1.113 NC(=O)c1ccnc(c1)Cl WXVL_AK0084SC0083 [1,1,0,0,0,0|1,0,0]=3 509 B10R1.113 NC(=O)c1ccnc(c1)Cl WXVL_AK0084SC0083 [1,1,0,0,0,0|1,0,0]=3 510 B10R1.113 NC(=O)c1ccnc(c1)F WXVL_AK0084SC0015 [1,1,0,0,0,0|1,0,0]=3 511 B10R1.113 NC(=O)c1ccnc(c1)F WXVL_AK0084SC0015 [1,1,0,0,0,0|1,0,0]=3 512 B10R1.113 NC(=O)c1ccnc(c1)O WXVL_AK0084SC0131 [1,1,0,0,0,0|1,0,0]=3 513 B10R1.113 NC(=O)c1ccnc(c1)O WXVL_AK0084SC0131 [1,1,0,0,0,0|1,0,0]=3 514 B10R1.113 NC(=O)c1ccnc(n1)Cl WXVL_AK0084SC0392 [1,1,0,0,0,0|2,0,0]=4 515 B10R1.113 NC(=O)c1ccnc(n1)Cl WXVL_AK0084SC0392 [1,1,0,0,0,0|2,0,0]=4 516 B10R1.113 NC(=O)c1cncc(c1)Br WXVL_AK0084SC0369 [1,1,0,0,0,0|1,0,0]=3 517 B10R1.113 NC(=O)c1cncc(c1)Br WXVL_AK0084SC0369 [1,1,0,0,0,0|1,0,0]=3 518 B10R1.113 NC(=O)c1cncc(c1)Cl WXVL_AK0084SC0291 [1,1,0,0,0,0|1,0,0]=3 519 B10R1.113 NC(=O)c1cncc(c1)Cl WXVL_AK0084SC0291 [1,1,0,0,0,0|1,0,0]=3 520 B10R1.113 NC(=O)c1cncc(c1)F WXVL_AK0084SC0102 [1,1,0,0,0,0|1,0,0]=3 521 B10R1.113 NC(=O)c1cncc(c1)F WXVL_AK0084SC0102 [1,1,0,0,0,0|1,0,0]=3 522 B10R1.113 NC(=O)c1cncc(c1)O WXVL_AK0084SC0333 [1,1,0,0,0,0|1,0,0]=3 523 B10R1.113 NC(=O)c1cncc(c1)O WXVL_AK0084SC0333 [1,1,0,0,0,0|1,0,0]=3 524 B10R1.113 NC(=O)c1cnnc(c1)Cl WXVL_AK0084SC0966 [1,1,0,0,0,0|2,0,0]=4 525 B10R1.113 NC(=O)c1cnnc(c1)Cl WXVL_AK0084SC0966 [1,1,0,0,0,0|2,0,0]=4 526 B10R1.113 NC(=O)c1cnnc(c1)O WXVL_AK0084SC0795 [1,1,0,0,0,0|2,0,0]=4 527 B10R1.113 NC(=O)c1cnnc(c1)O WXVL_AK0084SC0795 [1,1,0,0,0,0|2,0,0]=4 528 B10R1.18 CC(=O)Nc1ccccc1 WXVL_AG00183SB0150 [1,1,0,0,0,0|2,0,0]=4 529 B10R1.18 CC(=O)Nc1ccccc1 WXVL_AG00183SB0150 [1,1,0,0,0,0|2,0,0]=4 530 B10R1.6 CNS(=O)(=O)c1cccs1 WXVL_AK00442HU0005 [0,1,0,0,1,0|2,0,0]=4 531 B10R1.6 CNS(=O)(=O)c1cccs1 WXVL_AK00442HU0005 [0,1,0,0,1,0|2,0,0]=4 532 B10R1.11 CCNC(=O)c1c[nH]cn1 WXVL_AK00476SC0074 [0,1,0,0,1,0|2,0,0]=4 533 B10R1.11 CCNC(=O)c1c[nH]cn1 WXVL_AK00476SC0074 [0,1,0,0,1,0|2,0,0]=4 534 B10R1.11 CCNC(=O)c1cc[nH]c1 WXVL_AK00476SC0013 [0,1,0,0,1,0|1,0,0]=3 535 B10R1.11 CCNC(=O)c1cc[nH]c1 WXVL_AK00476SC0013 [0,1,0,0,1,0|1,0,0]=3 536 B10R1.11 CCNC(=O)c1cc[nH]n1 WXVL_AK00476SC0003 [0,1,0,0,1,0|2,0,0]=4 537 B10R1.11 CCNC(=O)c1cc[nH]n1 WXVL_AK00476SC0003 [0,1,0,0,1,0|2,0,0]=4 538 B10R1.11 CCNC(=O)c1ccco1 WXVL_AK00476SC0049 [0,1,0,0,1,0|1,0,0]=3 539 B10R1.11 CCNC(=O)c1ccco1 WXVL_AK00476SC0049 [0,1,0,0,1,0|1,0,0]=3 540 B10R1.11 CCNC(=O)c1cccs1 WXVL_AK00476SC0051 [0,1,0,0,1,0|1,0,0]=3 541 B10R1.11 CCNC(=O)c1cccs1 WXVL_AK00476SC0051 [0,1,0,0,1,0|1,0,0]=3 542 B10R1.11 CCNC(=O)c1ccno1 WXVL_AK00476SC0080 [0,1,0,0,1,0|2,0,0]=4 543 B10R1.11 CCNC(=O)c1ccno1 WXVL_AK00476SC0080 [0,1,0,0,1,0|2,0,0]=4 544 B10R1.11 CCNC(=O)c1ccns1 WXVL_AK00476SC0027 [0,1,0,0,1,0|2,0,0]=4 545 B10R1.11 CCNC(=O)c1ccns1 WXVL_AK00476SC0027 [0,1,0,0,1,0|2,0,0]=4 546 B10R1.11 CCNC(=O)c1ccoc1 WXVL_AK00476SC0050 [0,1,0,0,1,0|1,0,0]=3 547 B10R1.11 CCNC(=O)c1ccoc1 WXVL_AK00476SC0050 [0,1,0,0,1,0|1,0,0]=3 548 B10R1.11 CCNC(=O)c1ccon1 WXVL_AK00476SC0116 [0,1,0,0,1,0|2,0,0]=4 549 B10R1.11 CCNC(=O)c1ccon1 WXVL_AK00476SC0116 [0,1,0,0,1,0|2,0,0]=4 550 B10R1.11 CCNC(=O)c1ccsc1 WXVL_AK00476SC0054 [0,1,0,0,1,0|1,0,0]=3 551 B10R1.11 CCNC(=O)c1ccsc1 WXVL_AK00476SC0054 [0,1,0,0,1,0|1,0,0]=3 552 B10R1.11 CCNC(=O)c1ccsn1 WXVL_AK00476SC0764 [0,1,0,0,1,0|2,0,0]=4 553 B10R1.11 CCNC(=O)c1ccsn1 WXVL_AK00476SC0764 [0,1,0,0,1,0|2,0,0]=4 554 B10R1.11 CCNC(=O)c1cn[nH]c1 WXVL_AK00476SC0254 [0,1,0,0,1,0|2,0,0]=4 555 B10R1.11 CCNC(=O)c1cn[nH]c1 WXVL_AK00476SC0254 [0,1,0,0,1,0|2,0,0]=4 556 B10R1.11 CCNC(=O)c1cnc[nH]1 WXVL_AK00476SC0247 [0,1,0,0,1,0|2,0,0]=4 557 B10R1.11 CCNC(=O)c1cnc[nH]1 WXVL_AK00476SC0247 [0,1,0,0,1,0|2,0,0]=4 558 B10R1.11 CCNC(=O)c1cnco1 WXVL_AK00476SC0018 [0,1,0,0,1,0|2,0,0]=4 559 B10R1.11 CCNC(=O)c1cnco1 WXVL_AK00476SC0018 [0,1,0,0,1,0|2,0,0]=4 560 B10R1.11 CCNC(=O)c1cncs1 WXVL_AK00476SC0113 [0,1,0,0,1,0|2,0,0]=4 561 B10R1.11 CCNC(=O)c1cncs1 WXVL_AK00476SC0113 [0,1,0,0,1,0|2,0,0]=4 562 B10R1.11 CCNC(=O)c1cocn1 WXVL_AK00476SC0118 [0,1,0,0,1,0|2,0,0]=4 563 B10R1.11 CCNC(=O)c1cocn1 WXVL_AK00476SC0118 [0,1,0,0,1,0|2,0,0]=4 564 B10R1.11 CCNC(=O)c1cscn1 WXVL_AK00476SC0092 [0,1,0,0,1,0|2,0,0]=4 565 B10R1.11 CCNC(=O)c1cscn1 WXVL_AK00476SC0092 [0,1,0,0,1,0|2,0,0]=4 566 B10R1.11 CCNC(=O)c1nccs1 WXVL_AK00476SC0110 [0,1,0,0,1,0|2,0,0]=4 567 B10R1.11 CCNC(=O)c1nccs1 WXVL_AK00476SC0110 [0,1,0,0,1,0|2,0,0]=4 568 B10R1.14 CNC(=O)c1c[nH]c(c1)C WXVL_AK00442SC0298 [0,1,0,0,1,0|1,0,0]=3 569 B10R1.14 CNC(=O)c1c[nH]c(c1)C WXVL_AK00442SC0298 [0,1,0,0,1,0|1,0,0]=3 570 B10R1.14 CNC(=O)c1c[nH]c(n1)C WXVL_AK00442SC0009 [0,1,0,0,1,0|2,0,0]=4 571 B10R1.14 CNC(=O)c1c[nH]c(n1)C WXVL_AK00442SC0009 [0,1,0,0,1,0|2,0,0]=4 572 B10R1.14 CNC(=O)c1cc([nH]n1)C WXVL_AK00442SC0267 [0,1,0,0,1,0|2,0,0]=4 573 B10R1.14 CNC(=O)c1cc([nH]n1)C WXVL_AK00442SC0267 [0,1,0,0,1,0|2,0,0]=4 574 B10R1.14 CNC(=O)c1cc(c[nH]1)Br WXVL_AK00442SC0644 [0,1,0,0,1,0|1,0,0]=3 575 B10R1.14 CNC(=O)c1cc(c[nH]1)Br WXVL_AK00442SC0644 [0,1,0,0,1,0|1,0,0]=3 576 B10R1.14 CNC(=O)c1cc(c[nH]1)C WXVL_AK00442SC0830 [0,1,0,0,1,0|1,0,0]=3 577 B10R1.14 CNC(=O)c1cc(c[nH]1)C WXVL_AK00442SC0830 [0,1,0,0,1,0|1,0,0]=3 578 B10R1.14 CNC(=O)c1cc(c[nH]1)F WXVL_AK00442SC0334 [0,1,0,0,1,0|1,0,0]=3 579 B10R1.14 CNC(=O)c1cc(c[nH]1)F WXVL_AK00442SC0334 [0,1,0,0,1,0|1,0,0]=3 580 B10R1.14 CNC(=O)c1cc(cs1)Br WXVL_AK00442SC0188 [0,1,0,0,1,0|1,0,0]=3 581 B10R1.14 CNC(=O)c1cc(cs1)Br WXVL_AK00442SC0188 [0,1,0,0,1,0|1,0,0]=3 582 B10R1.14 CNC(=O)c1cc(cs1)C WXVL_AK00442SC0004 [0,1,0,0,1,0|1,0,0]=3 583 B10R1.14 CNC(=O)c1cc(cs1)C WXVL_AK00442SC0004 [0,1,0,0,1,0|1,0,0]=3 584 B10R1.14 CNC(=O)c1cc(n[nH]1)C WXVL_AK00442SC2215 [0,1,0,0,1,0|2,0,0]=4 585 B10R1.14 CNC(=O)c1cc(n[nH]1)C WXVL_AK00442SC2215 [0,1,0,0,1,0|2,0,0]=4 586 B10R1.14 CNC(=O)c1cc(no1)C WXVL_AK00442SC0089 [0,1,0,0,1,0|2,0,0]=4 587 B10R1.14 CNC(=O)c1cc(no1)C WXVL_AK00442SC0089 [0,1,0,0,1,0|2,0,0]=4 588 B10R1.14 CNC(=O)c1cc(no1)O WXVL_AK00442SC0522 [0,1,0,0,1,0|2,0,0]=4 589 B10R1.14 CNC(=O)c1cc(no1)O WXVL_AK00442SC0522 [0,1,0,0,1,0|2,0,0]=4 590 B10R1.14 CNC(=O)c1cc(on1)C WXVL_AK00442SC0101 [0,1,0,0,1,0|2,0,0]=4 591 B10R1.14 CNC(=O)c1cc(on1)C WXVL_AK00442SC0101 [0,1,0,0,1,0|2,0,0]=4 592 B10R1.14 CNC(=O)c1ccc(o1)C WXVL_AK00442SC0005 [0,1,0,0,1,0|1,0,0]=3 593 B10R1.14 CNC(=O)c1ccc(o1)C WXVL_AK00442SC0005 [0,1,0,0,1,0|1,0,0]=3 594 B10R1.14 CNC(=O)c1ccc(o1)Cl WXVL_AK00442SC0926 [0,1,0,0,1,0|1,0,0]=3 595 B10R1.14 CNC(=O)c1ccc(o1)Cl WXVL_AK00442SC0926 [0,1,0,0,1,0|1,0,0]=3 596 B10R1.14 CNC(=O)c1ccc(s1)Br WXVL_AK00442SC0359 [0,1,0,0,1,0|1,0,0]=3 597 B10R1.14 CNC(=O)c1ccc(s1)Br WXVL_AK00442SC0359 [0,1,0,0,1,0|1,0,0]=3 598 B10R1.14 CNC(=O)c1ccc(s1)C WXVL_AK00442SC0053 [0,1,0,0,1,0|1,0,0]=3 599 B10R1.14 CNC(=O)c1ccc(s1)C WXVL_AK00442SC0053 [0,1,0,0,1,0|1,0,0]=3 600 B10R1.14 CNC(=O)c1ccc(s1)Cl WXVL_AK00442SC0067 [0,1,0,0,1,0|1,0,0]=3 601 B10R1.14 CNC(=O)c1ccc(s1)Cl WXVL_AK00442SC0067 [0,1,0,0,1,0|1,0,0]=3 602 B10R1.14 CNC(=O)c1ccn(c1)C WXVL_AK00442SC0038 [0,1,0,0,1,0|1,0,0]=3 603 B10R1.14 CNC(=O)c1ccn(c1)C WXVL_AK00442SC0038 [0,1,0,0,1,0|1,0,0]=3 604 B10R1.14 CNC(=O)c1ccn(n1)C WXVL_AK00442SC0091 [0,1,0,0,1,0|2,0,0]=4 605 B10R1.14 CNC(=O)c1ccn(n1)C WXVL_AK00442SC0091 [0,1,0,0,1,0|2,0,0]=4 606 B10R1.14 CNC(=O)c1cn(cn1)C WXVL_AK00442SC0111 [0,1,0,0,1,0|2,0,0]=4 607 B10R1.14 CNC(=O)c1cn(cn1)C WXVL_AK00442SC0111 [0,1,0,0,1,0|2,0,0]=4 608 B10R1.14 CNC(=O)c1cnc([nH]1)O WXVL_AK00442SC0498 [0,1,0,0,1,0|2,0,0]=4 609 B10R1.14 CNC(=O)c1cnc([nH]1)O WXVL_AK00442SC0498 [0,1,0,0,1,0|2,0,0]=4 610 B10R1.14 CNC(=O)c1cnc(o1)Br WXVL_AK00442SC0815 [0,1,0,0,1,0|2,0,0]=4 611 B10R1.14 CNC(=O)c1cnc(o1)Br WXVL_AK00442SC0815 [0,1,0,0,1,0|2,0,0]=4 612 B10R1.14 CNC(=O)c1cnc(s1)Br WXVL_AK00442SC0723 [0,1,0,0,1,0|2,0,0]=4 613 B10R1.14 CNC(=O)c1cnc(s1)Br WXVL_AK00442SC0723 [0,1,0,0,1,0|2,0,0]=4 614 B10R1.14 CNC(=O)c1cnc(s1)C WXVL_AK00442SC0326 [0,1,0,0,1,0|2,0,0]=4 615 B10R1.14 CNC(=O)c1cnc(s1)C WXVL_AK00442SC0326 [0,1,0,0,1,0|2,0,0]=4 616 B10R1.14 CNC(=O)c1cnc(s1)Cl WXVL_AK00442SC0638 [0,1,0,0,1,0|2,0,0]=4 617 B10R1.14 CNC(=O)c1cnc(s1)Cl WXVL_AK00442SC0638 [0,1,0,0,1,0|2,0,0]=4 618 B10R1.14 CNC(=O)c1cnn(c1)C WXVL_AK00442SC0082 [0,1,0,0,1,0|2,0,0]=4 619 B10R1.14 CNC(=O)c1cnn(c1)C WXVL_AK00442SC0082 [0,1,0,0,1,0|2,0,0]=4 620 B10R1.14 CNC(=O)c1coc(n1)C WXVL_AK00442SC0086 [0,1,0,0,1,0|2,0,0]=4 621 B10R1.14 CNC(=O)c1coc(n1)C WXVL_AK00442SC0086 [0,1,0,0,1,0|2,0,0]=4 622 B10R1.14 CNC(=O)c1coc(n1)Cl WXVL_AK00442SC1341 [0,1,0,0,1,0|2,0,0]=4 623 B10R1.14 CNC(=O)c1coc(n1)Cl WXVL_AK00442SC1341 [0,1,0,0,1,0|2,0,0]=4 624 B10R1.14 CNC(=O)c1csc(c1)Br WXVL_AK00442SC0189 [0,1,0,0,1,0|1,0,0]=3 625 B10R1.14 CNC(=O)c1csc(c1)Br WXVL_AK00442SC0189 [0,1,0,0,1,0|1,0,0]=3 626 B10R1.14 CNC(=O)c1csc(n1)C WXVL_AK00442SC0112 [0,1,0,0,1,0|2,0,0]=4 627 B10R1.14 CNC(=O)c1csc(n1)C WXVL_AK00442SC0112 [0,1,0,0,1,0|2,0,0]=4 628 B10R1.14 CNC(=O)c1csc(n1)Cl WXVL_AK00442SC0688 [0,1,0,0,1,0|2,0,0]=4 629 B10R1.14 CNC(=O)c1csc(n1)Cl WXVL_AK00442SC0688 [0,1,0,0,1,0|2,0,0]=4 630 B10R1.14 CNC(=O)c1nc(cs1)Br WXVL_AK00442SC0687 [0,1,0,0,1,0|2,0,0]=4 631 B10R1.14 CNC(=O)c1nc(cs1)Br WXVL_AK00442SC0687 [0,1,0,0,1,0|2,0,0]=4 632 B10R1.14 CNC(=O)c1nc(cs1)C WXVL_AK00442SC0538 [0,1,0,0,1,0|2,0,0]=4 633 B10R1.14 CNC(=O)c1nc(cs1)C WXVL_AK00442SC0538 [0,1,0,0,1,0|2,0,0]=4 634 B10R1.14 CNC(=O)c1ncc(s1)C WXVL_AK00442SC0031 [0,1,0,0,1,0|2,0,0]=4 635 B10R1.14 CNC(=O)c1ncc(s1)C WXVL_AK00442SC0031 [0,1,0,0,1,0|2,0,0]=4 636 B10R1.23 CN(C)C(=O)c1c[nH]cn1 WXVL_AN0032SC0074 [0,1,0,0,1,0|2,0,0]=4 637 B10R1.23 CN(C)C(=O)c1c[nH]cn1 WXVL_AN0032SC0074 [0,1,0,0,1,0|2,0,0]=4 638 B10R1.23 CN(C)C(=O)c1cc[nH]c1 WXVL_AN0032SC0013 [0,1,0,0,1,0|1,0,0]=3 639 B10R1.23 CN(C)C(=O)c1cc[nH]c1 WXVL_AN0032SC0013 [0,1,0,0,1,0|1,0,0]=3 640 B10R1.23 CN(C)C(=O)c1cc[nH]n1 WXVL_AN0032SC0003 [0,1,0,0,1,0|2,0,0]=4 641 B10R1.23 CN(C)C(=O)c1cc[nH]n1 WXVL_AN0032SC0003 [0,1,0,0,1,0|2,0,0]=4 642 B10R1.23 CN(C)C(=O)c1ccco1 WXVL_AN0032SC0049 [0,1,0,0,1,0|1,0,0]=3 643 B10R1.23 CN(C)C(=O)c1ccco1 WXVL_AN0032SC0049 [0,1,0,0,1,0|1,0,0]=3 644 B10R1.23 CN(C)C(=O)c1cccs1 WXVL_AN0032SC0051 [0,1,0,0,1,0|1,0,0]=3 645 B10R1.23 CN(C)C(=O)c1cccs1 WXVL_AN0032SC0051 [0,1,0,0,1,0|1,0,0]=3 646 B10R1.23 CN(C)C(=O)c1ccno1 WXVL_AN0032SC0080 [0,1,0,0,1,0|2,0,0]=4 647 B10R1.23 CN(C)C(=O)c1ccno1 WXVL_AN0032SC0080 [0,1,0,0,1,0|2,0,0]=4 648 B10R1.23 CN(C)C(=O)c1ccns1 WXVL_AN0032SC0027 [0,1,0,0,1,0|2,0,0]=4 649 B10R1.23 CN(C)C(=O)c1ccns1 WXVL_AN0032SC0027 [0,1,0,0,1,0|2,0,0]=4 650 B10R1.23 CN(C)C(=O)c1ccoc1 WXVL_AN0032SC0050 [0,1,0,0,1,0|1,0,0]=3 651 B10R1.23 CN(C)C(=O)c1ccoc1 WXVL_AN0032SC0050 [0,1,0,0,1,0|1,0,0]=3 652 B10R1.23 CN(C)C(=O)c1ccon1 WXVL_AN0032SC0116 [0,1,0,0,1,0|2,0,0]=4 653 B10R1.23 CN(C)C(=O)c1ccon1 WXVL_AN0032SC0116 [0,1,0,0,1,0|2,0,0]=4 654 B10R1.23 CN(C)C(=O)c1ccsc1 WXVL_AN0032SC0054 [0,1,0,0,1,0|1,0,0]=3 655 B10R1.23 CN(C)C(=O)c1ccsc1 WXVL_AN0032SC0054 [0,1,0,0,1,0|1,0,0]=3 656 B10R1.23 CN(C)C(=O)c1ccsn1 WXVL_AN0032SC0764 [0,1,0,0,1,0|2,0,0]=4 657 B10R1.23 CN(C)C(=O)c1ccsn1 WXVL_AN0032SC0764 [0,1,0,0,1,0|2,0,0]=4 658 B10R1.23 CN(C)C(=O)c1cn[nH]c1 WXVL_AN0032SC0254 [0,1,0,0,1,0|2,0,0]=4 659 B10R1.23 CN(C)C(=O)c1cn[nH]c1 WXVL_AN0032SC0254 [0,1,0,0,1,0|2,0,0]=4 660 B10R1.23 CN(C)C(=O)c1cnc[nH]1 WXVL_AN0032SC0247 [0,1,0,0,1,0|2,0,0]=4 661 B10R1.23 CN(C)C(=O)c1cnc[nH]1 WXVL_AN0032SC0247 [0,1,0,0,1,0|2,0,0]=4 662 B10R1.23 CN(C)C(=O)c1cnco1 WXVL_AN0032SC0018 [0,1,0,0,1,0|2,0,0]=4 663 B10R1.23 CN(C)C(=O)c1cnco1 WXVL_AN0032SC0018 [0,1,0,0,1,0|2,0,0]=4 664 B10R1.23 CN(C)C(=O)c1cncs1 WXVL_AN0032SC0113 [0,1,0,0,1,0|2,0,0]=4 665 B10R1.23 CN(C)C(=O)c1cncs1 WXVL_AN0032SC0113 [0,1,0,0,1,0|2,0,0]=4 666 B10R1.23 CN(C)C(=O)c1cocn1 WXVL_AN0032SC0118 [0,1,0,0,1,0|2,0,0]=4 667 B10R1.23 CN(C)C(=O)c1cocn1 WXVL_AN0032SC0118 [0,1,0,0,1,0|2,0,0]=4 668 B10R1.23 CN(C)C(=O)c1cscn1 WXVL_AN0032SC0092 [0,1,0,0,1,0|2,0,0]=4 669 B10R1.23 CN(C)C(=O)c1cscn1 WXVL_AN0032SC0092 [0,1,0,0,1,0|2,0,0]=4 670 B10R1.23 CN(C)C(=O)c1nccs1 WXVL_AN0032SC0110 [0,1,0,0,1,0|2,0,0]=4 671 B10R1.23 CN(C)C(=O)c1nccs1 WXVL_AN0032SC0110 [0,1,0,0,1,0|2,0,0]=4 672 B10R1.149 CNC(=O)c1[nH]ccc1C WXVL_AK00442SC1315 [0,1,0,0,1,0|1,0,0]=3 673 B10R1.149 CNC(=O)c1[nH]ccc1C WXVL_AK00442SC1315 [0,1,0,0,1,0|1,0,0]=3 674 B10R1.149 CNC(=O)c1[nH]cnc1C WXVL_AK00442SC0269 [0,1,0,0,1,0|2,0,0]=4 675 B10R1.149 CNC(=O)c1[nH]cnc1C WXVL_AK00442SC0269 [0,1,0,0,1,0|2,0,0]=4 676 B10R1.149 CNC(=O)c1c[nH]cc1C WXVL_AK00442SC0251 [0,1,0,0,1,0|1,0,0]=3 677 B10R1.149 CNC(=O)c1c[nH]cc1C WXVL_AK00442SC0251 [0,1,0,0,1,0|1,0,0]=3 678 B10R1.149 CNC(=O)c1c[nH]nc1C WXVL_AK00442SC2225 [0,1,0,0,1,0|2,0,0]=4 679 B10R1.149 CNC(=O)c1c[nH]nc1C WXVL_AK00442SC2225 [0,1,0,0,1,0|2,0,0]=4 680 B10R1.149 CNC(=O)c1ccnn1C WXVL_AK00442SC0090 [0,1,0,0,1,0|2,0,0]=4 681 B10R1.149 CNC(=O)c1ccnn1C WXVL_AK00442SC0090 [0,1,0,0,1,0|2,0,0]=4 682 B10R1.149 CNC(=O)c1ccsc1C WXVL_AK00442SC1037 [0,1,0,0,1,0|1,0,0]=3 683 B10R1.149 CNC(=O)c1ccsc1C WXVL_AK00442SC1037 [0,1,0,0,1,0|1,0,0]=3 684 B10R1.149 CNC(=O)c1ccsc1Cl WXVL_AK00442SC0794 [0,1,0,0,1,0|1,0,0]=3 685 B10R1.149 CNC(=O)c1ccsc1Cl WXVL_AK00442SC0794 [0,1,0,0,1,0|1,0,0]=3 686 B10R1.149 CNC(=O)c1cncn1C WXVL_AK00442SC0099 [0,1,0,0,1,0|2,0,0]=4 687 B10R1.149 CNC(=O)c1cncn1C WXVL_AK00442SC0099 [0,1,0,0,1,0|2,0,0]=4 688 B10R1.149 CNC(=O)c1conc1C WXVL_AK00442SC0100 [0,1,0,0,1,0|2,0,0]=4 689 B10R1.149 CNC(=O)c1conc1C WXVL_AK00442SC0100 [0,1,0,0,1,0|2,0,0]=4 690 B10R1.149 CNC(=O)c1cscc1Br WXVL_AK00442SC1024 [0,1,0,0,1,0|1,0,0]=3 691 B10R1.149 CNC(=O)c1cscc1Br WXVL_AK00442SC1024 [0,1,0,0,1,0|1,0,0]=3 692 B10R1.149 CNC(=O)c1cscc1C WXVL_AK00442SC0257 [0,1,0,0,1,0|1,0,0]=3 693 B10R1.149 CNC(=O)c1cscc1C WXVL_AK00442SC0257 [0,1,0,0,1,0|1,0,0]=3 694 B10R1.149 CNC(=O)c1csnc1C WXVL_AK00442SC2175 [0,1,0,0,1,0|2,0,0]=4 695 B10R1.149 CNC(=O)c1csnc1C WXVL_AK00442SC2175 [0,1,0,0,1,0|2,0,0]=4 696 B10R1.149 CNC(=O)c1n[nH]cc1I WXVL_AK00442SC0442 [0,1,0,0,1,0|2,0,0]=4 697 B10R1.149 CNC(=O)c1n[nH]cc1I WXVL_AK00442SC0442 [0,1,0,0,1,0|2,0,0]=4 698 B10R1.149 CNC(=O)c1nccn1C WXVL_AK00442SC0106 [0,1,0,0,1,0|2,0,0]=4 699 B10R1.149 CNC(=O)c1nccn1C WXVL_AK00442SC0106 [0,1,0,0,1,0|2,0,0]=4 700 B10R1.149 CNC(=O)c1ncoc1C WXVL_AK00442SC0732 [0,1,0,0,1,0|2,0,0]=4 701 B10R1.149 CNC(=O)c1ncoc1C WXVL_AK00442SC0732 [0,1,0,0,1,0|2,0,0]=4 702 B10R1.149 CNC(=O)c1ncsc1Br WXVL_AK00442SC0192 [0,1,0,0,1,0|2,0,0]=4 703 B10R1.149 CNC(=O)c1ncsc1Br WXVL_AK00442SC0192 [0,1,0,0,1,0|2,0,0]=4 704 B10R1.149 CNC(=O)c1ncsc1C WXVL_AK00442SC0722 [0,1,0,0,1,0|2,0,0]=4 705 B10R1.149 CNC(=O)c1ncsc1C WXVL_AK00442SC0722 [0,1,0,0,1,0|2,0,0]=4 706 B10R1.149 CNC(=O)c1occc1Br WXVL_AK00442SC0241 [0,1,0,0,1,0|1,0,0]=3 707 B10R1.149 CNC(=O)c1occc1Br WXVL_AK00442SC0241 [0,1,0,0,1,0|1,0,0]=3 708 B10R1.149 CNC(=O)c1occc1C WXVL_AK00442SC0230 [0,1,0,0,1,0|1,0,0]=3 709 B10R1.149 CNC(=O)c1occc1C WXVL_AK00442SC0230 [0,1,0,0,1,0|1,0,0]=3 710 B10R1.149 CNC(=O)c1ocnc1C WXVL_AK00442SC0103 [0,1,0,0,1,0|2,0,0]=4 711 B10R1.149 CNC(=O)c1ocnc1C WXVL_AK00442SC0103 [0,1,0,0,1,0|2,0,0]=4 712 B10R1.149 CNC(=O)c1oncc1C WXVL_AK00442SC0912 [0,1,0,0,1,0|2,0,0]=4 713 B10R1.149 CNC(=O)c1oncc1C WXVL_AK00442SC0912 [0,1,0,0,1,0|2,0,0]=4 714 B10R1.149 CNC(=O)c1sccc1Br WXVL_AK00442SC0364 [0,1,0,0,1,0|1,0,0]=3 715 B10R1.149 CNC(=O)c1sccc1Br WXVL_AK00442SC0364 [0,1,0,0,1,0|1,0,0]=3 716 B10R1.149 CNC(=O)c1sccc1C WXVL_AK00442SC0052 [0,1,0,0,1,0|1,0,0]=3 717 B10R1.149 CNC(=O)c1sccc1C WXVL_AK00442SC0052 [0,1,0,0,1,0|1,0,0]=3 718 B10R1.149 CNC(=O)c1sccc1Cl WXVL_AK00442SC0756 [0,1,0,0,1,0|1,0,0]=3 719 B10R1.149 CNC(=O)c1sccc1Cl WXVL_AK00442SC0756 [0,1,0,0,1,0|1,0,0]=3 720 B10R1.149 CNC(=O)c1sccc1F WXVL_AK00442SC0017 [0,1,0,0,1,0|1,0,0]=3 721 B10R1.149 CNC(=O)c1sccc1F WXVL_AK00442SC0017 [0,1,0,0,1,0|1,0,0]=3 722 B10R1.149 CNC(=O)c1sccc1I WXVL_AK00442SC1579 [0,1,0,0,1,0|1,0,0]=3 723 B10R1.149 CNC(=O)c1sccc1I WXVL_AK00442SC1579 [0,1,0,0,1,0|1,0,0]=3 724 B10R1.149 CNC(=O)c1scnc1C WXVL_AK00442SC0093 [0,1,0,0,1,0|2,0,0]=4 725 B10R1.149 CNC(=O)c1scnc1C WXVL_AK00442SC0093 [0,1,0,0,1,0|2,0,0]=4 726 B12R1.32 C#CCC(=O)Nc1ccccc1 WXVL_AG00183SB3070 [0,1,0,0,0,1|1,0,1]=4 727 B12R1.32 C#CCC(=O)Nc1ccccc1 WXVL_AG00183SB3070 [0,1,0,0,0,1|1,0,1]=4 728 B12R1.32 C/C=C/C(=O)Nc1ccccc1 WXVL_AG00183SB0340 [0,1,0,0,0,1|1,0,0]=3 729 B12R1.32 C/C=C/C(=O)Nc1ccccc1 WXVL_AG00183SB0340 [0,1,0,0,0,1|1,0,0]=3 730 B12R1.32 C/C=C/C(=O)Nc1ccccn1 WXVL_AF00298SB0340 [0,1,0,0,0,1|2,0,0]=4 731 B12R1.32 C/C=C/C(=O)Nc1ccccn1 WXVL_AF00298SB0340 [0,1,0,0,0,1|2,0,0]=4 732 B12R1.32 C=CCC(=O)Nc1ccccc1 WXVL_AG00183SB2732 [0,1,0,0,0,1|1,0,1]=4 733 B12R1.32 C=CCC(=O)Nc1ccccc1 WXVL_AG00183SB2732 [0,1,0,0,0,1|1,0,1]=4 734 B12R1.32 CC#CC(=O)Nc1ccccc1 WXVL_AG00183SB1240 [0,1,0,0,0,1|1,0,0]=3 735 B12R1.32 CC#CC(=O)Nc1ccccc1 WXVL_AG00183SB1240 [0,1,0,0,0,1|1,0,0]=3 736 B12R1.32 CC#CC(=O)Nc1ccccn1 WXVL_AF00298SB1240 [0,1,0,0,0,1|2,0,0]=4 737 B12R1.32 CC#CC(=O)Nc1ccccn1 WXVL_AF00298SB1240 [0,1,0,0,0,1|2,0,0]=4 738 B12R1.32 CCCC(=O)Nc1ccccc1 WXVL_AG00183SB0073 [0,1,0,0,0,1|1,0,0]=3 739 B12R1.32 CCCC(=O)Nc1ccccc1 WXVL_AG00183SB0073 [0,1,0,0,0,1|1,0,0]=3 740 B12R1.32 CCCC(=O)Nc1ccccn1 WXVL_AF00298SB0073 [0,1,0,0,0,1|2,0,0]=4 741 B12R1.32 CCCC(=O)Nc1ccccn1 WXVL_AF00298SB0073 [0,1,0,0,0,1|2,0,0]=4 742 B12R1.32 CCNC(=O)Cc1ccccc1 WXVL_AK00476SB0092 [0,1,0,0,0,1|0,0,0]=2 743 B12R1.32 CCNC(=O)Cc1ccccc1 WXVL_AK00476SB0092 [0,1,0,0,0,1|0,0,0]=2 744 B12R1.32 CCNC(=O)Cc1ccccn1 WXVL_AK00476SA0032 [0,1,0,0,0,1|1,0,0]=3 745 B12R1.32 CCNC(=O)Cc1ccccn1 WXVL_AK00476SA0032 [0,1,0,0,0,1|1,0,0]=3 746 B12R1.32 CCNC(=O)Cc1cccnc1 WXVL_AK00476SA0029 [0,1,0,0,0,1|1,0,0]=3 747 B12R1.32 CCNC(=O)Cc1cccnc1 WXVL_AK00476SA0029 [0,1,0,0,0,1|1,0,0]=3 748 B12R1.32 CCNC(=O)Cc1cccnc1 WXVL_AK00476SB00049 [0,1,0,0,0,1|1,0,0]=3 749 B12R1.32 CCNC(=O)Cc1cccnc1 WXVL_AK00476SB00049 [0,1,0,0,0,1|1,0,0]=3 750 B12R1.32 CCNC(=O)Cc1ccncc1 WXVL_AK00476SA00106 [0,1,0,0,0,1|1,0,0]=3 751 B12R1.32 CCNC(=O)Cc1ccncc1 WXVL_AK00476SA00106 [0,1,0,0,0,1|1,0,0]=3 752 B12R1.32 CCNC(=O)Cc1cncnc1 WXVL_AK00476SA0242 [0,1,0,0,0,1|2,0,0]=4 753 B12R1.32 CCNC(=O)Cc1cncnc1 WXVL_AK00476SA0242 [0,1,0,0,0,1|2,0,0]=4 754 B12R1.32 CCNC(=O)Cc1ncccn1 WXVL_AK00476SA0307 [0,1,0,0,0,1|2,0,0]=4 755 B12R1.32 CCNC(=O)Cc1ncccn1 WXVL_AK00476SA0307 [0,1,0,0,0,1|2,0,0]=4 756 B12R1.32 CCNC(=O)Nc1ccccn1 WXVL_AK00476YV0189 [0,1,0,0,0,1|1,0,0]=3 757 B12R1.32 CCNC(=O)Nc1ccccn1 WXVL_AK00476YV0189 [0,1,0,0,0,1|1,0,0]=3 758 B12R1.32 COCC(=O)Nc1ccccc1 WXVL_AG00183SB0090 [0,1,0,0,0,1|1,0,0]=3 759 B12R1.32 COCC(=O)Nc1ccccc1 WXVL_AG00183SB0090 [0,1,0,0,0,1|1,0,0]=3 760 B12R1.32 COCC(=O)Nc1ccccn1 WXVL_AF00298SB0090 [0,1,0,0,0,1|2,0,0]=4 761 B12R1.32 COCC(=O)Nc1ccccn1 WXVL_AF00298SB0090 [0,1,0,0,0,1|2,0,0]=4 762 B12R1.32 CSCC(=O)Nc1ccccc1 WXVL_AG00183SB1267 [0,1,0,0,0,1|1,0,0]=3 763 B12R1.32 CSCC(=O)Nc1ccccc1 WXVL_AG00183SB1267 [0,1,0,0,0,1|1,0,0]=3 764 B12R1.32 CSCC(=O)Nc1ccccn1 WXVL_AF00298SB1267 [0,1,0,0,0,1|2,0,0]=4 765 B12R1.32 CSCC(=O)Nc1ccccn1 WXVL_AF00298SB1267 [0,1,0,0,0,1|2,0,0]=4 766 B12R1.32 N#CCC(=O)Nc1ccccc1 WXVL_AG00183SB0057 [0,1,0,0,0,1|1,0,1]=4 767 B12R1.32 N#CCC(=O)Nc1ccccc1 WXVL_AG00183SB0057 [0,1,0,0,0,1|1,0,1]=4 768 B12R1.34 CNC(=O)C(=O)c1ccccc1 WXVL_AK00442SB0050 [0,1,0,0,0,1|0,0,0]=2 769 B12R1.34 CNC(=O)C(=O)c1ccccc1 WXVL_AK00442SB0050 [0,1,0,0,0,1|0,0,0]=2 770 B12R1.34 CNC(=O)C(C)c1ccccc1 WXVL_AK00442SB2326 [0,1,0,0,0,1|0,0,0]=2 771 B12R1.34 CNC(=O)C(C)c1ccccc1 WXVL_AK00442SB2326 [0,1,0,0,0,1|0,0,0]=2 772 B12R1.34 CNC(=O)C(O)c1ccccc1 WXVL_AK00442SB0168 [0,1,0,0,0,1|0,0,0]=2 773 B12R1.34 CNC(=O)C(O)c1ccccc1 WXVL_AK00442SB0168 [0,1,0,0,0,1|0,0,0]=2 774 B12R1.43 C=C(F)C(=O)Nc1ccccc1 WXVL_AG00183SB1376 [0,1,0,0,0,1|1,0,1]=4 775 B12R1.43 C=C(F)C(=O)Nc1ccccc1 WXVL_AG00183SB1376 [0,1,0,0,0,1|1,0,1]=4 776 B12R1.43 CC(=O)C(=O)Nc1ccccc1 WXVL_AG00183SB0051 [0,1,0,0,0,1|1,0,0]=3 777 B12R1.43 CC(=O)C(=O)Nc1ccccc1 WXVL_AG00183SB0051 [0,1,0,0,0,1|1,0,0]=3 778 B12R1.43 CC(=O)C(=O)Nc1ccccn1 WXVL_AF00298SB0051 [0,1,0,0,0,1|2,0,0]=4 779 B12R1.43 CC(=O)C(=O)Nc1ccccn1 WXVL_AF00298SB0051 [0,1,0,0,0,1|2,0,0]=4 780 B12R1.43 CC(C)C(=O)Nc1ccccc1 WXVL_AG00183SB0052 [0,1,0,0,0,1|1,0,0]=3 781 B12R1.43 CC(C)C(=O)Nc1ccccc1 WXVL_AG00183SB0052 [0,1,0,0,0,1|1,0,0]=3 782 B12R1.43 CC(C)C(=O)Nc1ccccn1 WXVL_AF00298SB0052 [0,1,0,0,0,1|2,0,0]=4 783 B12R1.43 CC(C)C(=O)Nc1ccccn1 WXVL_AF00298SB0052 [0,1,0,0,0,1|2,0,0]=4 784 B12R1.43 CC(S)C(=O)Nc1ccccc1 WXVL_AG00183SB2708 [0,1,0,0,0,1|1,0,0]=3 785 B12R1.43 CC(S)C(=O)Nc1ccccc1 WXVL_AG00183SB2708 [0,1,0,0,0,1|1,0,0]=3 786 B12R1.43 CC(S)C(=O)Nc1ccccn1 WXVL_AF00298SB2708 [0,1,0,0,0,1|2,0,0]=4 787 B12R1.43 CC(S)C(=O)Nc1ccccn1 WXVL_AF00298SB2708 [0,1,0,0,0,1|2,0,0]=4 788 B12R1.43 CN(C)C(=O)Cc1ccccc1 WXVL_AN0032SB0092 [0,1,0,0,0,1|0,0,0]=2 789 B12R1.43 CN(C)C(=O)Cc1ccccc1 WXVL_AN0032SB0092 [0,1,0,0,0,1|0,0,0]=2 790 B12R1.43 CN(C)C(=O)Cc1ccccn1 WXVL_AN0032SA0032 [0,1,0,0,0,1|1,0,0]=3 791 B12R1.43 CN(C)C(=O)Cc1ccccn1 WXVL_AN0032SA0032 [0,1,0,0,0,1|1,0,0]=3 792 B12R1.43 CN(C)C(=O)Cc1cccnc1 WXVL_AN0032SA0029 [0,1,0,0,0,1|1,0,0]=3 793 B12R1.43 CN(C)C(=O)Cc1cccnc1 WXVL_AN0032SA0029 [0,1,0,0,0,1|1,0,0]=3 794 B12R1.43 CN(C)C(=O)Cc1cccnc1 WXVL_AN0032SB00049 [0,1,0,0,0,1|1,0,0]=3 795 B12R1.43 CN(C)C(=O)Cc1cccnc1 WXVL_AN0032SB00049 [0,1,0,0,0,1|1,0,0]=3 796 B12R1.43 CN(C)C(=O)Cc1ccncc1 WXVL_AN0032SA00106 [0,1,0,0,0,1|1,0,0]=3 797 B12R1.43 CN(C)C(=O)Cc1ccncc1 WXVL_AN0032SA00106 [0,1,0,0,0,1|1,0,0]=3 798 B12R1.43 CN(C)C(=O)Cc1cncnc1 WXVL_AN0032SA0242 [0,1,0,0,0,1|2,0,0]=4 799 B12R1.43 CN(C)C(=O)Cc1cncnc1 WXVL_AN0032SA0242 [0,1,0,0,0,1|2,0,0]=4 800 B12R1.43 CN(C)C(=O)Cc1ncccn1 WXVL_AN0032SA0307 [0,1,0,0,0,1|2,0,0]=4 801 B12R1.43 CN(C)C(=O)Cc1ncccn1 WXVL_AN0032SA0307 [0,1,0,0,0,1|2,0,0]=4 802 B12R1.43 CN(C)C(=O)Nc1ccccn1 WXVL_AN0032YV0189 [0,1,0,0,0,1|1,0,0]=3 803 B12R1.43 CN(C)C(=O)Nc1ccccn1 WXVL_AN0032YV0189 [0,1,0,0,0,1|1,0,0]=3 804 B12R1.43 C[C@@H](O)C(=O)Nc1ccccc1 WXVL_AG00183SB1085 [0,1,0,0,0,1|1,0,0]=3 805 B12R1.43 C[C@@H](O)C(=O)Nc1ccccc1 WXVL_AG00183SB1085 [0,1,0,0,0,1|1,0,0]=3 806 B12R1.43 C[C@@H](O)C(=O)Nc1ccccn1 WXVL_AF00298SB1085 [0,1,0,0,0,1|2,0,0]=4 807 B12R1.43 C[C@@H](O)C(=O)Nc1ccccn1 WXVL_AF00298SB1085 [0,1,0,0,0,1|2,0,0]=4 808 B12R1.43 NC(=O)C(=O)Nc1ccccc1 WXVL_AG00183SB0128 [0,1,0,0,0,1|2,0,0]=4 809 B12R1.43 NC(=O)C(=O)Nc1ccccc1 WXVL_AG00183SB0128 [0,1,0,0,0,1|2,0,0]=4 810 B12R1.43 O=C(Nc1ccccc1)C(F)F WXVL_AG00183SB0079 [0,1,0,0,0,1|2,0,0]=4 811 B12R1.43 O=C(Nc1ccccc1)C(F)F WXVL_AG00183SB0079 [0,1,0,0,0,1|2,0,0]=4 812 B12R1.49 C#CC(=O)Nc1ccc(cc1)Cl WXVL_AG0062SB0338 [0,1,0,0,0,1|1,0,1]=4 813 B12R1.49 C#CC(=O)Nc1ccc(cc1)Cl WXVL_AG0062SB0338 [0,1,0,0,0,1|1,0,1]=4 814 B12R1.49 C#CC(=O)Nc1ccc(cc1)I WXVL_AG1742SB0338 [0,1,0,0,0,1|1,0,1]=4 815 B12R1.49 C#CC(=O)Nc1ccc(cc1)I WXVL_AG1742SB0338 [0,1,0,0,0,1|1,0,1]=4 816 B12R1.49 CCC(=O)Nc1ccc(cc1)Cl WXVL_AG0062SB0064 [0,1,0,0,0,1|1,0,0]=3 817 B12R1.49 CCC(=O)Nc1ccc(cc1)Cl WXVL_AG0062SB0064 [0,1,0,0,0,1|1,0,0]=3 818 B12R1.49 CCC(=O)Nc1ccc(cc1)I WXVL_AG1742SB0064 [0,1,0,0,0,1|1,0,0]=3 819 B12R1.49 CCC(=O)Nc1ccc(cc1)I WXVL_AG1742SB0064 [0,1,0,0,0,1|1,0,0]=3 820 B12R1.49 CCC(=O)Nc1ccc(cn1)C WXVL_AF0018SB0064 [0,1,0,0,0,1|2,0,0]=4 821 B12R1.49 CCC(=O)Nc1ccc(cn1)C WXVL_AF0018SB0064 [0,1,0,0,0,1|2,0,0]=4 822 B12R1.49 CCC(=O)Nc1ccc(cn1)Cl WXVL_AF0017SB0064 [0,1,0,0,0,1|2,0,0]=4 823 B12R1.49 CCC(=O)Nc1ccc(cn1)Cl WXVL_AF0017SB0064 [0,1,0,0,0,1|2,0,0]=4 824 B12R1.49 CCC(=O)Nc1ccc(cn1)O WXVL_AF3250SB0064 [0,1,0,0,0,1|2,0,0]=4 825 B12R1.49 CCC(=O)Nc1ccc(cn1)O WXVL_AF3250SB0064 [0,1,0,0,0,1|2,0,0]=4 826 B12R1.49 CCC(=O)Nc1ccc(nc1)Br WXVL_AF0320SB0064 [0,1,0,0,0,1|2,0,0]=4 827 B12R1.49 CCC(=O)Nc1ccc(nc1)Br WXVL_AF0320SB0064 [0,1,0,0,0,1|2,0,0]=4 828 B12R1.49 CCC(=O)Nc1ccc(nc1)C WXVL_AF0076SB0064 [0,1,0,0,0,1|2,0,0]=4 829 B12R1.49 CCC(=O)Nc1ccc(nc1)C WXVL_AF0076SB0064 [0,1,0,0,0,1|2,0,0]=4 830 B12R1.49 CCC(=O)Nc1ccc(nc1)Cl WXVL_AF0323SB0064 [0,1,0,0,0,1|2,0,0]=4 831 B12R1.49 CCC(=O)Nc1ccc(nc1)Cl WXVL_AF0323SB0064 [0,1,0,0,0,1|2,0,0]=4 832 B12R1.49 CCC(=O)Nc1ccc(nc1)F WXVL_AF0400SB0064 [0,1,0,0,0,1|2,0,0]=4 833 B12R1.49 CCC(=O)Nc1ccc(nc1)F WXVL_AF0400SB0064 [0,1,0,0,0,1|2,0,0]=4 834 B12R1.49 CCC(=O)Nc1ccc(nc1)I WXVL_AF1228SB0064 [0,1,0,0,0,1|2,0,0]=4 835 B12R1.49 CCC(=O)Nc1ccc(nc1)I WXVL_AF1228SB0064 [0,1,0,0,0,1|2,0,0]=4 836 B12R1.49 CCC(=O)Nc1ccc(nc1)O WXVL_AF0322SB0064 [0,1,0,0,0,1|2,0,0]=4 837 B12R1.49 CCC(=O)Nc1ccc(nc1)O WXVL_AF0322SB0064 [0,1,0,0,0,1|2,0,0]=4 838 B12R1.49 CNC(=O)Cc1ccc(cc1)Br WXVL_AK00442SB0926 [0,1,0,0,0,1|0,0,0]=2 839 B12R1.49 CNC(=O)Cc1ccc(cc1)Br WXVL_AK00442SB0926 [0,1,0,0,0,1|0,0,0]=2 840 B12R1.49 CNC(=O)Cc1ccc(cc1)C WXVL_AK00442SB0112 [0,1,0,0,0,1|0,0,0]=2 841 B12R1.49 CNC(=O)Cc1ccc(cc1)C WXVL_AK00442SB0112 [0,1,0,0,0,1|0,0,0]=2 842 B12R1.49 CNC(=O)Cc1ccc(cc1)Cl WXVL_AK00442SB0107 [0,1,0,0,0,1|0,0,0]=2 843 B12R1.49 CNC(=O)Cc1ccc(cc1)Cl WXVL_AK00442SB0107 [0,1,0,0,0,1|0,0,0]=2 844 B12R1.49 CNC(=O)Cc1ccc(cc1)F WXVL_AK00442SB0106 [0,1,0,0,0,1|0,0,0]=2 845 B12R1.49 CNC(=O)Cc1ccc(cc1)F WXVL_AK00442SB0106 [0,1,0,0,0,1|0,0,0]=2 846 B12R1.49 CNC(=O)Cc1ccc(cc1)O WXVL_AK00442SB0110 [0,1,0,0,0,1|0,0,0]=2 847 B12R1.49 CNC(=O)Cc1ccc(cc1)O WXVL_AK00442SB0110 [0,1,0,0,0,1|0,0,0]=2 848 B12R1.49 CNC(=O)Cc1ccc(cn1)Br WXVL_AK00442SA0212 [0,1,0,0,0,1|1,0,0]=3 849 B12R1.49 CNC(=O)Cc1ccc(cn1)Br WXVL_AK00442SA0212 [0,1,0,0,0,1|1,0,0]=3 850 B12R1.49 CNC(=O)Cc1ccc(cn1)Cl WXVL_AK00442SA0537 [0,1,0,0,0,1|1,0,0]=3 851 B12R1.49 CNC(=O)Cc1ccc(cn1)Cl WXVL_AK00442SA0537 [0,1,0,0,0,1|1,0,0]=3 852 B12R1.49 CNC(=O)Cc1ccc(cn1)F WXVL_AK00442SA0011 [0,1,0,0,0,1|1,0,0]=3 853 B12R1.49 CNC(=O)Cc1ccc(cn1)F WXVL_AK00442SA0011 [0,1,0,0,0,1|1,0,0]=3 854 B12R1.49 CNC(=O)Cc1ccc(cn1)O WXVL_AK00442SA2976 [0,1,0,0,0,1|1,0,0]=3 855 B12R1.49 CNC(=O)Cc1ccc(cn1)O WXVL_AK00442SA2976 [0,1,0,0,0,1|1,0,0]=3 856 B12R1.49 CNC(=O)Cc1ccc(nc1)Br WXVL_AK00442SA00056 [0,1,0,0,0,1|1,0,0]=3 857 B12R1.49 CNC(=O)Cc1ccc(nc1)Br WXVL_AK00442SA00056 [0,1,0,0,0,1|1,0,0]=3 858 B12R1.49 CNC(=O)Cc1ccc(nc1)C WXVL_AK00442SA0250 [0,1,0,0,0,1|1,0,0]=3 859 B12R1.49 CNC(=O)Cc1ccc(nc1)C WXVL_AK00442SA0250 [0,1,0,0,0,1|1,0,0]=3 860 B12R1.49 CNC(=O)Nc1ccc(cc1)C WXVL_AK00442YV0026 [0,1,0,0,0,1|0,0,0]=2 861 B12R1.49 CNC(=O)Nc1ccc(cc1)C WXVL_AK00442YV0026 [0,1,0,0,0,1|0,0,0]=2 862 B12R1.49 CNC(=O)Nc1ccc(cc1)Cl WXVL_AK00442YV0023 [0,1,0,0,0,1|0,0,0]=2 863 B12R1.49 CNC(=O)Nc1ccc(cc1)Cl WXVL_AK00442YV0023 [0,1,0,0,0,1|0,0,0]=2 864 B12R1.49 O=C(CO)Nc1ccc(cc1)Cl WXVL_AG0062SB2706 [0,1,0,0,0,1|2,0,0]=4 865 B12R1.49 O=C(CO)Nc1ccc(cc1)Cl WXVL_AG0062SB2706 [0,1,0,0,0,1|2,0,0]=4 866 B12R1.49 O=C(CO)Nc1ccc(cc1)I WXVL_AG1742SB2706 [0,1,0,0,0,1|2,0,0]=4 867 B12R1.49 O=C(CO)Nc1ccc(cc1)I WXVL_AG1742SB2706 [0,1,0,0,0,1|2,0,0]=4 868 B12R1.50 C#CC(=O)Nc1cccc(c1)C WXVL_AG0052SB0338 [0,1,0,0,0,1|1,0,1]=4 869 B12R1.50 C#CC(=O)Nc1cccc(c1)C WXVL_AG0052SB0338 [0,1,0,0,0,1|1,0,1]=4 870 B12R1.50 C#CC(=O)Nc1cccc(c1)I WXVL_AG0649SB0338 [0,1,0,0,0,1|1,0,1]=4 871 B12R1.50 C#CC(=O)Nc1cccc(c1)I WXVL_AG0649SB0338 [0,1,0,0,0,1|1,0,1]=4 872 B12R1.50 C#CC(=O)Nc1cccc(c1)O WXVL_AG00200SB0338 [0,1,0,0,0,1|1,0,1]=4 873 B12R1.50 C#CC(=O)Nc1cccc(c1)O WXVL_AG00200SB0338 [0,1,0,0,0,1|1,0,1]=4 874 B12R1.50 CCC(=O)Nc1cc(ccn1)Cl WXVL_AF3296SB0064 [0,1,0,0,0,1|2,0,0]=4 875 B12R1.50 CCC(=O)Nc1cc(ccn1)Cl WXVL_AF3296SB0064 [0,1,0,0,0,1|2,0,0]=4 876 B12R1.50 CCC(=O)Nc1cc(ccn1)F WXVL_AF0152SB0064 [0,1,0,0,0,1|2,0,0]=4 877 B12R1.50 CCC(=O)Nc1cc(ccn1)F WXVL_AF0152SB0064 [0,1,0,0,0,1|2,0,0]=4 878 B12R1.50 CCC(=O)Nc1cc(ccn1)O WXVL_AF3303SB0064 [0,1,0,0,0,1|2,0,0]=4 879 B12R1.50 CCC(=O)Nc1cc(ccn1)O WXVL_AF3303SB0064 [0,1,0,0,0,1|2,0,0]=4 880 B12R1.50 CCC(=O)Nc1cc[nH]c(=O)c1 WXVL_AK8414SB0064 [0,1,0,0,0,1|2,0,0]=4 881 B12R1.50 CCC(=O)Nc1cc[nH]c(=O)c1 WXVL_AK8414SB0064 [0,1,0,0,0,1|2,0,0]=4 882 B12R1.50 CCC(=O)Nc1cccc(c1)C WXVL_AG0052SB0064 [0,1,0,0,0,1|1,0,0]=3 883 B12R1.50 CCC(=O)Nc1cccc(c1)C WXVL_AG0052SB0064 [0,1,0,0,0,1|1,0,0]=3 884 B12R1.50 CCC(=O)Nc1cccc(c1)I WXVL_AG0649SB0064 [0,1,0,0,0,1|1,0,0]=3 885 B12R1.50 CCC(=O)Nc1cccc(c1)I WXVL_AG0649SB0064 [0,1,0,0,0,1|1,0,0]=3 886 B12R1.50 CCC(=O)Nc1cccc(c1)O WXVL_AG00200SB0064 [0,1,0,0,0,1|1,0,0]=3 887 B12R1.50 CCC(=O)Nc1cccc(c1)O WXVL_AG00200SB0064 [0,1,0,0,0,1|1,0,0]=3 888 B12R1.50 CCC(=O)Nc1cccc(n1)Br WXVL_AF0038SB0064 [0,1,0,0,0,1|2,0,0]=4 889 B12R1.50 CCC(=O)Nc1cccc(n1)Br WXVL_AF0038SB0064 [0,1,0,0,0,1|2,0,0]=4 890 B12R1.50 CCC(=O)Nc1cccc(n1)C WXVL_AF0019SB0064 [0,1,0,0,0,1|2,0,0]=4 891 B12R1.50 CCC(=O)Nc1cccc(n1)C WXVL_AF0019SB0064 [0,1,0,0,0,1|2,0,0]=4 892 B12R1.50 CCC(=O)Nc1cccc(n1)Cl WXVL_AF0312SB0064 [0,1,0,0,0,1|2,0,0]=4 893 B12R1.50 CCC(=O)Nc1cccc(n1)Cl WXVL_AF0312SB0064 [0,1,0,0,0,1|2,0,0]=4 894 B12R1.50 CCC(=O)Nc1cccc(n1)F WXVL_AF0307SB0064 [0,1,0,0,0,1|2,0,0]=4 895 B12R1.50 CCC(=O)Nc1cccc(n1)F WXVL_AF0307SB0064 [0,1,0,0,0,1|2,0,0]=4 896 B12R1.50 CCC(=O)Nc1cccc(n1)I WXVL_AF0430SB0064 [0,1,0,0,0,1|2,0,0]=4 897 B12R1.50 CCC(=O)Nc1cccc(n1)I WXVL_AF0430SB0064 [0,1,0,0,0,1|2,0,0]=4 898 B12R1.50 CCC(=O)Nc1cccc(n1)O WXVL_AF2469SB0064 [0,1,0,0,0,1|2,0,0]=4 899 B12R1.50 CCC(=O)Nc1cccc(n1)O WXVL_AF2469SB0064 [0,1,0,0,0,1|2,0,0]=4 900 B12R1.50 CCC(=O)Nc1ccnc(c1)Br WXVL_AF0395SB0064 [0,1,0,0,0,1|2,0,0]=4 901 B12R1.50 CCC(=O)Nc1ccnc(c1)Br WXVL_AF0395SB0064 [0,1,0,0,0,1|2,0,0]=4 902 B12R1.50 CCC(=O)Nc1ccnc(c1)Cl WXVL_AF0319SB0064 [0,1,0,0,0,1|2,0,0]=4 903 B12R1.50 CCC(=O)Nc1ccnc(c1)Cl WXVL_AF0319SB0064 [0,1,0,0,0,1|2,0,0]=4 904 B12R1.50 CCC(=O)Nc1ccnc(c1)F WXVL_AF0676SB0064 [0,1,0,0,0,1|2,0,0]=4 905 B12R1.50 CCC(=O)Nc1ccnc(c1)F WXVL_AF0676SB0064 [0,1,0,0,0,1|2,0,0]=4 906 B12R1.50 CCC(=O)Nc1ccnc(c1)O WXVL_AF0326SB0064 [0,1,0,0,0,1|2,0,0]=4 907 B12R1.50 CCC(=O)Nc1ccnc(c1)O WXVL_AF0326SB0064 [0,1,0,0,0,1|2,0,0]=4 908 B12R1.50 CCC(=O)Nc1cncc(c1)Br WXVL_AF0318SB0064 [0,1,0,0,0,1|2,0,0]=4 909 B12R1.50 CCC(=O)Nc1cncc(c1)Br WXVL_AF0318SB0064 [0,1,0,0,0,1|2,0,0]=4 910 B12R1.50 CCC(=O)Nc1cncc(c1)C WXVL_AF0136SB0064 [0,1,0,0,0,1|2,0,0]=4 911 B12R1.50 CCC(=O)Nc1cncc(c1)C WXVL_AF0136SB0064 [0,1,0,0,0,1|2,0,0]=4 912 B12R1.50 CCC(=O)Nc1cncc(c1)Cl WXVL_AF0629SB0064 [0,1,0,0,0,1|2,0,0]=4 913 B12R1.50 CCC(=O)Nc1cncc(c1)Cl WXVL_AF0629SB0064 [0,1,0,0,0,1|2,0,0]=4 914 B12R1.50 CCC(=O)Nc1cncc(c1)F WXVL_AF0342SB0064 [0,1,0,0,0,1|2,0,0]=4 915 B12R1.50 CCC(=O)Nc1cncc(c1)F WXVL_AF0342SB0064 [0,1,0,0,0,1|2,0,0]=4 916 B12R1.50 CCC(=O)Nc1cncc(c1)O WXVL_AF0659SB0064 [0,1,0,0,0,1|2,0,0]=4 917 B12R1.50 CCC(=O)Nc1cncc(c1)O WXVL_AF0659SB0064 [0,1,0,0,0,1|2,0,0]=4 918 B12R1.50 CNC(=O)Cc1cccc(c1)Br WXVL_AK00442SB0099 [0,1,0,0,0,1|0,0,0]=2 919 B12R1.50 CNC(=O)Cc1cccc(c1)Br WXVL_AK00442SB0099 [0,1,0,0,0,1|0,0,0]=2 920 B12R1.50 CNC(=O)Cc1cccc(c1)C WXVL_AK00442SB0105 [0,1,0,0,0,1|0,0,0]=2 921 B12R1.50 CNC(=O)Cc1cccc(c1)C WXVL_AK00442SB0105 [0,1,0,0,0,1|0,0,0]=2 922 B12R1.50 CNC(=O)Cc1cccc(c1)Cl WXVL_AK00442SB0101 [0,1,0,0,0,1|0,0,0]=2 923 B12R1.50 CNC(=O)Cc1cccc(c1)Cl WXVL_AK00442SB0101 [0,1,0,0,0,1|0,0,0]=2 924 B12R1.50 CNC(=O)Cc1cccc(c1)F WXVL_AK00442SB0100 [0,1,0,0,0,1|0,0,0]=2 925 B12R1.50 CNC(=O)Cc1cccc(c1)F WXVL_AK00442SB0100 [0,1,0,0,0,1|0,0,0]=2 926 B12R1.50 CNC(=O)Cc1cccc(c1)O WXVL_AK00442SB0104 [0,1,0,0,0,1|0,0,0]=2 927 B12R1.50 CNC(=O)Cc1cccc(c1)O WXVL_AK00442SB0104 [0,1,0,0,0,1|0,0,0]=2 928 B12R1.50 CNC(=O)Cc1cccc(n1)C WXVL_AK00442SA0399 [0,1,0,0,0,1|1,0,0]=3 929 B12R1.50 CNC(=O)Cc1cccc(n1)C WXVL_AK00442SA0399 [0,1,0,0,0,1|1,0,0]=3 930 B12R1.50 CNC(=O)Cc1cccc(n1)Cl WXVL_AK00442SA0313 [0,1,0,0,0,1|1,0,0]=3 931 B12R1.50 CNC(=O)Cc1cccc(n1)Cl WXVL_AK00442SA0313 [0,1,0,0,0,1|1,0,0]=3 932 B12R1.50 CNC(=O)Cc1ccnc(c1)Br WXVL_AK00442SA0520 [0,1,0,0,0,1|1,0,0]=3 933 B12R1.50 CNC(=O)Cc1ccnc(c1)Br WXVL_AK00442SA0520 [0,1,0,0,0,1|1,0,0]=3 934 B12R1.50 CNC(=O)Nc1cccc(c1)Br WXVL_AK00442YV0098 [0,1,0,0,0,1|0,0,0]=2 935 B12R1.50 CNC(=O)Nc1cccc(c1)Br WXVL_AK00442YV0098 [0,1,0,0,0,1|0,0,0]=2 936 B12R1.50 CNC(=O)Nc1cccc(c1)C WXVL_AK00442YV0020 [0,1,0,0,0,1|0,0,0]=2 937 B12R1.50 CNC(=O)Nc1cccc(c1)C WXVL_AK00442YV0020 [0,1,0,0,0,1|0,0,0]=2 938 B12R1.50 CNC(=O)Nc1cccc(c1)Cl WXVL_AK00442YV0016 [0,1,0,0,0,1|0,0,0]=2 939 B12R1.50 CNC(=O)Nc1cccc(c1)Cl WXVL_AK00442YV0016 [0,1,0,0,0,1|0,0,0]=2 940 B12R1.50 Cc1cccc(c1)NC(=O)CO WXVL_AG0052SB2706 [0,1,0,0,0,1|2,0,0]=4 941 B12R1.50 Cc1cccc(c1)NC(=O)CO WXVL_AG0052SB2706 [0,1,0,0,0,1|2,0,0]=4 942 B12R1.50 O=C(CO)Nc1cccc(c1)I WXVL_AG0649SB2706 [0,1,0,0,0,1|2,0,0]=4 943 B12R1.50 O=C(CO)Nc1cccc(c1)I WXVL_AG0649SB2706 [0,1,0,0,0,1|2,0,0]=4 944 B12R1.50 O=C(CO)Nc1cccc(c1)O WXVL_AG00200SB2706 [0,1,0,0,0,1|2,0,0]=4 945 B12R1.50 O=C(CO)Nc1cccc(c1)O WXVL_AG00200SB2706 [0,1,0,0,0,1|2,0,0]=4 946 B12R1.194 CCS(=O)(=O)Nc1ccccc1 WXVL_AG00183HU0028 [0,1,0,0,0,1|2,0,0]=4 947 B12R1.194 CCS(=O)(=O)Nc1ccccc1 WXVL_AG00183HU0028 [0,1,0,0,0,1|2,0,0]=4 948 B12R1.194 CNS(=O)(=O)Cc1ccccc1 WXVL_AK00442HU0025 [0,1,0,0,0,1|1,0,0]=3 949 B12R1.194 CNS(=O)(=O)Cc1ccccc1 WXVL_AK00442HU0025 [0,1,0,0,0,1|1,0,0]=3 950 B12R1.371 C#CC(=O)Nc1ccccc1Br WXVL_AG00180SB0338 [0,1,0,0,0,1|1,0,1]=4 951 B12R1.371 C#CC(=O)Nc1ccccc1Br WXVL_AG00180SB0338 [0,1,0,0,0,1|1,0,1]=4 952 B12R1.371 C#CC(=O)Nc1ccccc1C WXVL_AG0027SB0338 [0,1,0,0,0,1|1,0,1]=4 953 B12R1.371 C#CC(=O)Nc1ccccc1C WXVL_AG0027SB0338 [0,1,0,0,0,1|1,0,1]=4 954 B12R1.371 C#CC(=O)Nc1ccccc1Cl WXVL_AG00129SB0338 [0,1,0,0,0,1|1,0,1]=4 955 B12R1.371 C#CC(=O)Nc1ccccc1Cl WXVL_AG00129SB0338 [0,1,0,0,0,1|1,0,1]=4 956 B12R1.371 C#CC(=O)Nc1ccccc1I WXVL_AG0385SB0338 [0,1,0,0,0,1|1,0,1]=4 957 B12R1.371 C#CC(=O)Nc1ccccc1I WXVL_AG0385SB0338 [0,1,0,0,0,1|1,0,1]=4 958 B12R1.371 CCC(=O)Nc1ccccc1Br WXVL_AG00180SB0064 [0,1,0,0,0,1|1,0,0]=3 959 B12R1.371 CCC(=O)Nc1ccccc1Br WXVL_AG00180SB0064 [0,1,0,0,0,1|1,0,0]=3 960 B12R1.371 CCC(=O)Nc1ccccc1C WXVL_AG0027SB0064 [0,1,0,0,0,1|1,0,0]=3 961 B12R1.371 CCC(=O)Nc1ccccc1C WXVL_AG0027SB0064 [0,1,0,0,0,1|1,0,0]=3 962 B12R1.371 CCC(=O)Nc1ccccc1Cl WXVL_AG00129SB0064 [0,1,0,0,0,1|1,0,0]=3 963 B12R1.371 CCC(=O)Nc1ccccc1Cl WXVL_AG00129SB0064 [0,1,0,0,0,1|1,0,0]=3 964 B12R1.371 CCC(=O)Nc1ccccc1I WXVL_AG0385SB0064 [0,1,0,0,0,1|1,0,0]=3 965 B12R1.371 CCC(=O)Nc1ccccc1I WXVL_AG0385SB0064 [0,1,0,0,0,1|1,0,0]=3 966 B12R1.371 CCC(=O)Nc1cccnc1Br WXVL_AF0399SB0064 [0,1,0,0,0,1|2,0,0]=4 967 B12R1.371 CCC(=O)Nc1cccnc1Br WXVL_AF0399SB0064 [0,1,0,0,0,1|2,0,0]=4 968 B12R1.371 CCC(=O)Nc1cccnc1C WXVL_AF0055SB0064 [0,1,0,0,0,1|2,0,0]=4 969 B12R1.371 CCC(=O)Nc1cccnc1C WXVL_AF0055SB0064 [0,1,0,0,0,1|2,0,0]=4 970 B12R1.371 CCC(=O)Nc1cccnc1Cl WXVL_AF0009SB0064 [0,1,0,0,0,1|2,0,0]=4 971 B12R1.371 CCC(=O)Nc1cccnc1Cl WXVL_AF0009SB0064 [0,1,0,0,0,1|2,0,0]=4 972 B12R1.371 CCC(=O)Nc1cccnc1F WXVL_AF0419SB0064 [0,1,0,0,0,1|2,0,0]=4 973 B12R1.371 CCC(=O)Nc1cccnc1F WXVL_AF0419SB0064 [0,1,0,0,0,1|2,0,0]=4 974 B12R1.371 CCC(=O)Nc1cccnc1I WXVL_AF0681SB0064 [0,1,0,0,0,1|2,0,0]=4 975 B12R1.371 CCC(=O)Nc1cccnc1I WXVL_AF0681SB0064 [0,1,0,0,0,1|2,0,0]=4 976 B12R1.371 CCC(=O)Nc1cccnc1O WXVL_AF0440SB0064 [0,1,0,0,0,1|2,0,0]=4 977 B12R1.371 CCC(=O)Nc1cccnc1O WXVL_AF0440SB0064 [0,1,0,0,0,1|2,0,0]=4 978 B12R1.371 CCC(=O)Nc1ccncc1C WXVL_AF0049SB0064 [0,1,0,0,0,1|2,0,0]=4 979 B12R1.371 CCC(=O)Nc1ccncc1C WXVL_AF0049SB0064 [0,1,0,0,0,1|2,0,0]=4 980 B12R1.371 CCC(=O)Nc1ccncc1Cl WXVL_AF3285SB0064 [0,1,0,0,0,1|2,0,0]=4 981 B12R1.371 CCC(=O)Nc1ccncc1Cl WXVL_AF3285SB0064 [0,1,0,0,0,1|2,0,0]=4 982 B12R1.371 CCC(=O)Nc1ccncc1F WXVL_AF2713SB0064 [0,1,0,0,0,1|2,0,0]=4 983 B12R1.371 CCC(=O)Nc1ccncc1F WXVL_AF2713SB0064 [0,1,0,0,0,1|2,0,0]=4 984 B12R1.371 CCC(=O)Nc1ccncc1O WXVL_AF0234SB0064 [0,1,0,0,0,1|2,0,0]=4 985 B12R1.371 CCC(=O)Nc1ccncc1O WXVL_AF0234SB0064 [0,1,0,0,0,1|2,0,0]=4 986 B12R1.371 CCC(=O)Nc1cnccc1Br WXVL_AF1085SB0064 [0,1,0,0,0,1|2,0,0]=4 987 B12R1.371 CCC(=O)Nc1cnccc1Br WXVL_AF1085SB0064 [0,1,0,0,0,1|2,0,0]=4 988 B12R1.371 CCC(=O)Nc1cnccc1C WXVL_AF0075SB0064 [0,1,0,0,0,1|2,0,0]=4 989 B12R1.371 CCC(=O)Nc1cnccc1C WXVL_AF0075SB0064 [0,1,0,0,0,1|2,0,0]=4 990 B12R1.371 CCC(=O)Nc1cnccc1Cl WXVL_AF0294SB0064 [0,1,0,0,0,1|2,0,0]=4 991 B12R1.371 CCC(=O)Nc1cnccc1Cl WXVL_AF0294SB0064 [0,1,0,0,0,1|2,0,0]=4 992 B12R1.371 CCC(=O)Nc1cnccc1I WXVL_AF0133SB0064 [0,1,0,0,0,1|2,0,0]=4 993 B12R1.371 CCC(=O)Nc1cnccc1I WXVL_AF0133SB0064 [0,1,0,0,0,1|2,0,0]=4 994 B12R1.371 CCC(=O)Nc1ncccc1Br WXVL_AF0053SB0064 [0,1,0,0,0,1|2,0,0]=4 995 B12R1.371 CCC(=O)Nc1ncccc1Br WXVL_AF0053SB0064 [0,1,0,0,0,1|2,0,0]=4 996 B12R1.371 CCC(=O)Nc1ncccc1C WXVL_AF0013SB0064 [0,1,0,0,0,1|2,0,0]=4 997 B12R1.371 CCC(=O)Nc1ncccc1C WXVL_AF0013SB0064 [0,1,0,0,0,1|2,0,0]=4 998 B12R1.371 CCC(=O)Nc1ncccc1Cl WXVL_AF1147SB0064 [0,1,0,0,0,1|2,0,0]=4 999 B12R1.371 CCC(=O)Nc1ncccc1Cl WXVL_AF1147SB0064 [0,1,0,0,0,1|2,0,0]=4 1000 B12R1.371 CCC(=O)Nc1ncccc1F WXVL_AF0321SB0064 [0,1,0,0,0,1|2,0,0]=4 1001 B12R1.371 CCC(=O)Nc1ncccc1F WXVL_AF0321SB0064 [0,1,0,0,0,1|2,0,0]=4 1002 B12R1.371 CCC(=O)Nc1ncccc1I WXVL_AF0298SB0064 [0,1,0,0,0,1|2,0,0]=4 1003 B12R1.371 CCC(=O)Nc1ncccc1I WXVL_AF0298SB0064 [0,1,0,0,0,1|2,0,0]=4 1004 B12R1.371 CCC(=O)Nc1ncccc1O WXVL_AF0347SB0064 [0,1,0,0,0,1|2,0,0]=4 1005 B12R1.371 CCC(=O)Nc1ncccc1O WXVL_AF0347SB0064 [0,1,0,0,0,1|2,0,0]=4 1006 B12R1.371 CNC(=O)Cc1ccccc1Br WXVL_AK00442SB0093 [0,1,0,0,0,1|0,0,0]=2 1007 B12R1.371 CNC(=O)Cc1ccccc1Br WXVL_AK00442SB0093 [0,1,0,0,0,1|0,0,0]=2 1008 B12R1.371 CNC(=O)Cc1ccccc1C WXVL_AK00442SB0098 [0,1,0,0,0,1|0,0,0]=2 1009 B12R1.371 CNC(=O)Cc1ccccc1C WXVL_AK00442SB0098 [0,1,0,0,0,1|0,0,0]=2 1010 B12R1.371 CNC(=O)Cc1ccccc1Cl WXVL_AK00442SB0095 [0,1,0,0,0,1|0,0,0]=2 1011 B12R1.371 CNC(=O)Cc1ccccc1Cl WXVL_AK00442SB0095 [0,1,0,0,0,1|0,0,0]=2 1012 B12R1.371 CNC(=O)Cc1ccccc1F WXVL_AK00442SB0094 [0,1,0,0,0,1|0,0,0]=2 1013 B12R1.371 CNC(=O)Cc1ccccc1F WXVL_AK00442SB0094 [0,1,0,0,0,1|0,0,0]=2 1014 B12R1.371 CNC(=O)Cc1ccccc1I WXVL_AK00442SB1145 [0,1,0,0,0,1|0,0,0]=2 1015 B12R1.371 CNC(=O)Cc1ccccc1I WXVL_AK00442SB1145 [0,1,0,0,0,1|0,0,0]=2 1016 B12R1.371 CNC(=O)Cc1ccccc1O WXVL_AK00442SB0400 [0,1,0,0,0,1|0,0,0]=2 1017 B12R1.371 CNC(=O)Cc1ccccc1O WXVL_AK00442SB0400 [0,1,0,0,0,1|0,0,0]=2 1018 B12R1.371 CNC(=O)Cc1cccnc1Cl WXVL_AK00442SA0056 [0,1,0,0,0,1|1,0,0]=3 1019 B12R1.371 CNC(=O)Cc1cccnc1Cl WXVL_AK00442SA0056 [0,1,0,0,0,1|1,0,0]=3 1020 B12R1.371 CNC(=O)Nc1ccccc1Br WXVL_AK00442YV0003 [0,1,0,0,0,1|0,0,0]=2 1021 B12R1.371 CNC(=O)Nc1ccccc1Br WXVL_AK00442YV0003 [0,1,0,0,0,1|0,0,0]=2 1022 B12R1.371 CNC(=O)Nc1ccccc1C WXVL_AK00442YV0013 [0,1,0,0,0,1|0,0,0]=2 1023 B12R1.371 CNC(=O)Nc1ccccc1C WXVL_AK00442YV0013 [0,1,0,0,0,1|0,0,0]=2 1024 B12R1.371 CNC(=O)Nc1ccccc1Cl WXVL_AK00442YV0007 [0,1,0,0,0,1|0,0,0]=2 1025 B12R1.371 CNC(=O)Nc1ccccc1Cl WXVL_AK00442YV0007 [0,1,0,0,0,1|0,0,0]=2 1026 B12R1.371 Cc1ccccc1NC(=O)CO WXVL_AG0027SB2706 [0,1,0,0,0,1|2,0,0]=4 1027 B12R1.371 Cc1ccccc1NC(=O)CO WXVL_AG0027SB2706 [0,1,0,0,0,1|2,0,0]=4 1028 B12R1.371 O=C(CO)Nc1ccccc1Br WXVL_AG00180SB2706 [0,1,0,0,0,1|2,0,0]=4 1029 B12R1.371 O=C(CO)Nc1ccccc1Br WXVL_AG00180SB2706 [0,1,0,0,0,1|2,0,0]=4 1030 B12R1.371 O=C(CO)Nc1ccccc1Cl WXVL_AG00129SB2706 [0,1,0,0,0,1|2,0,0]=4 1031 B12R1.371 O=C(CO)Nc1ccccc1Cl WXVL_AG00129SB2706 [0,1,0,0,0,1|2,0,0]=4 1032 B12R1.371 O=C(CO)Nc1ccccc1I WXVL_AG0385SB2706 [0,1,0,0,0,1|2,0,0]=4 1033 B12R1.371 O=C(CO)Nc1ccccc1I WXVL_AG0385SB2706 [0,1,0,0,0,1|2,0,0]=4 1034 B12R1.9 CNS(=O)(=O)c1ccc(cc1)Cl WXVL_AK00442HU0016 [0,2,0,0,0,0|1,0,0]=3 1035 B12R1.9 CNS(=O)(=O)c1ccc(cc1)Cl WXVL_AK00442HU0016 [0,2,0,0,0,0|1,0,0]=3 1036 B12R1.9 CNS(=O)(=O)c1ccc(cc1)F WXVL_AK00442HU0015 [0,2,0,0,0,0|1,0,0]=3 1037 B12R1.9 CNS(=O)(=O)c1ccc(cc1)F WXVL_AK00442HU0015 [0,2,0,0,0,0|1,0,0]=3 1038 B12R1.9 CNS(=O)(=O)c1ccc(cc1)I WXVL_AK00442HU0017 [0,2,0,0,0,0|1,0,0]=3 1039 B12R1.9 CNS(=O)(=O)c1ccc(cc1)I WXVL_AK00442HU0017 [0,2,0,0,0,0|1,0,0]=3 1040 B12R1.9 CNS(=O)(=O)c1ccc(cc1)O WXVL_AK00442HU0459 [0,2,0,0,0,0|1,0,0]=3 1041 B12R1.9 CNS(=O)(=O)c1ccc(cc1)O WXVL_AK00442HU0459 [0,2,0,0,0,0|1,0,0]=3 1042 B12R1.9 CNS(=O)(=O)c1ccc(cn1)Br WXVL_AK00442HU0466 [0,2,0,0,0,0|2,0,0]=4 1043 B12R1.9 CNS(=O)(=O)c1ccc(cn1)Br WXVL_AK00442HU0466 [0,2,0,0,0,0|2,0,0]=4 1044 B12R1.9 CNS(=O)(=O)c1ccc(cn1)Cl WXVL_AK00442HU0467 [0,2,0,0,0,0|2,0,0]=4 1045 B12R1.9 CNS(=O)(=O)c1ccc(cn1)Cl WXVL_AK00442HU0467 [0,2,0,0,0,0|2,0,0]=4 1046 B12R1.9 CNS(=O)(=O)c1ccc(nc1)C WXVL_AK00442HU0506 [0,2,0,0,0,0|2,0,0]=4 1047 B12R1.9 CNS(=O)(=O)c1ccc(nc1)C WXVL_AK00442HU0506 [0,2,0,0,0,0|2,0,0]=4 1048 B12R1.9 CNS(=O)(=O)c1ccc(nc1)Cl WXVL_AK00442HU0290 [0,2,0,0,0,0|2,0,0]=4 1049 B12R1.9 CNS(=O)(=O)c1ccc(nc1)Cl WXVL_AK00442HU0290 [0,2,0,0,0,0|2,0,0]=4 1050 B12R1.10 CNS(=O)(=O)c1cccc(c1)Br WXVL_AK00442HU0059 [0,2,0,0,0,0|1,0,0]=3 1051 B12R1.10 CNS(=O)(=O)c1cccc(c1)Br WXVL_AK00442HU0059 [0,2,0,0,0,0|1,0,0]=3 1052 B12R1.10 CNS(=O)(=O)c1cccc(c1)C WXVL_AK00442HU0052 [0,2,0,0,0,0|1,0,0]=3 1053 B12R1.10 CNS(=O)(=O)c1cccc(c1)C WXVL_AK00442HU0052 [0,2,0,0,0,0|1,0,0]=3 1054 B12R1.10 CNS(=O)(=O)c1cccc(c1)Cl WXVL_AK00442HU0051 [0,2,0,0,0,0|1,0,0]=3 1055 B12R1.10 CNS(=O)(=O)c1cccc(c1)Cl WXVL_AK00442HU0051 [0,2,0,0,0,0|1,0,0]=3 1056 B12R1.10 CNS(=O)(=O)c1cccc(c1)F WXVL_AK00442HU0043 [0,2,0,0,0,0|1,0,0]=3 1057 B12R1.10 CNS(=O)(=O)c1cccc(c1)F WXVL_AK00442HU0043 [0,2,0,0,0,0|1,0,0]=3 1058 B12R1.10 CNS(=O)(=O)c1cccc(n1)Br WXVL_AK00442HU0468 [0,2,0,0,0,0|2,0,0]=4 1059 B12R1.10 CNS(=O)(=O)c1cccc(n1)Br WXVL_AK00442HU0468 [0,2,0,0,0,0|2,0,0]=4 1060 B12R1.10 CNS(=O)(=O)c1cccc(n1)Cl WXVL_AK00442HU0505 [0,2,0,0,0,0|2,0,0]=4 1061 B12R1.10 CNS(=O)(=O)c1cccc(n1)Cl WXVL_AK00442HU0505 [0,2,0,0,0,0|2,0,0]=4 1062 B12R1.10 CNS(=O)(=O)c1cncc(c1)Br WXVL_AK00442HU0301 [0,2,0,0,0,0|2,0,0]=4 1063 B12R1.10 CNS(=O)(=O)c1cncc(c1)Br WXVL_AK00442HU0301 [0,2,0,0,0,0|2,0,0]=4 1064 B12R1.39 CCNS(=O)(=O)c1ccccn1 WXVL_AK00476HU0098 [0,2,0,0,0,0|2,0,0]=4 1065 B12R1.39 CCNS(=O)(=O)c1ccccn1 WXVL_AK00476HU0098 [0,2,0,0,0,0|2,0,0]=4 1066 B12R1.39 CCNS(=O)(=O)c1cccnc1 WXVL_AK00476HU0127 [0,2,0,0,0,0|2,0,0]=4 1067 B12R1.39 CCNS(=O)(=O)c1cccnc1 WXVL_AK00476HU0127 [0,2,0,0,0,0|2,0,0]=4 1068 B12R1.39 CCNS(=O)(=O)c1ccncc1 WXVL_AK00476HU0382 [0,2,0,0,0,0|2,0,0]=4 1069 B12R1.39 CCNS(=O)(=O)c1ccncc1 WXVL_AK00476HU0382 [0,2,0,0,0,0|2,0,0]=4 1070 B12R1.195 CNS(=O)(=O)c1ccccc1Br WXVL_AK00442HU0055 [0,2,0,0,0,0|1,0,0]=3 1071 B12R1.195 CNS(=O)(=O)c1ccccc1Br WXVL_AK00442HU0055 [0,2,0,0,0,0|1,0,0]=3 1072 B12R1.195 CNS(=O)(=O)c1ccccc1Cl WXVL_AK00442HU0048 [0,2,0,0,0,0|1,0,0]=3 1073 B12R1.195 CNS(=O)(=O)c1ccccc1Cl WXVL_AK00442HU0048 [0,2,0,0,0,0|1,0,0]=3 1074 B12R1.195 CNS(=O)(=O)c1ccccc1F WXVL_AK00442HU0042 [0,2,0,0,0,0|1,0,0]=3 1075 B12R1.195 CNS(=O)(=O)c1ccccc1F WXVL_AK00442HU0042 [0,2,0,0,0,0|1,0,0]=3 1076 B12R1.195 CNS(=O)(=O)c1cccnc1Cl WXVL_AK00442HU0278 [0,2,0,0,0,0|2,0,0]=4 1077 B12R1.195 CNS(=O)(=O)c1cccnc1Cl WXVL_AK00442HU0278 [0,2,0,0,0,0|2,0,0]=4 1078 B12R1.253 CN(C)S(=O)(=O)c1ccccn1 WXVL_AN0032HU0098 [0,2,0,0,0,0|2,0,0]=4 1079 B12R1.253 CN(C)S(=O)(=O)c1ccccn1 WXVL_AN0032HU0098 [0,2,0,0,0,0|2,0,0]=4 1080 B12R1.253 CN(C)S(=O)(=O)c1cccnc1 WXVL_AN0032HU0127 [0,2,0,0,0,0|2,0,0]=4 1081 B12R1.253 CN(C)S(=O)(=O)c1cccnc1 WXVL_AN0032HU0127 [0,2,0,0,0,0|2,0,0]=4 1082 B12R1.253 CN(C)S(=O)(=O)c1ccncc1 WXVL_AN0032HU0382 [0,2,0,0,0,0|2,0,0]=4 1083 B12R1.253 CN(C)S(=O)(=O)c1ccncc1 WXVL_AN0032HU0382 [0,2,0,0,0,0|2,0,0]=4 1084 B12R1.478 CCC(C(=O)N)c1ccccc1 WXVL_AK0084SB0053 [0,2,0,0,0,0|1,0,1]=4 1085 B12R1.478 CCC(C(=O)N)c1ccccc1 WXVL_AK0084SB0053 [0,2,0,0,0,0|1,0,1]=4 1086 B12R1.478 CO[C@@H](C(=O)N)c1ccccc1 WXVL_AK0084SB0081 [0,2,0,0,0,0|1,0,1]=4 1087 B12R1.478 CO[C@@H](C(=O)N)c1ccccc1 WXVL_AK0084SB0081 [0,2,0,0,0,0|1,0,1]=4 1088 B12R1.16 CCNC(=O)c1cc[n+](cc1)[O-] WXVL_AK00476SC0858 [0,2,0,0,0,0|1,0,0]=3 1089 B12R1.16 CCNC(=O)c1cc[n+](cc1)[O-] WXVL_AK00476SC0858 [0,2,0,0,0,0|1,0,0]=3 1090 B12R1.16 CCNC(=O)c1ccc(=O)[nH]c1 WXVL_AK00476SC2212 [0,2,0,0,0,0|1,0,0]=3 1091 B12R1.16 CCNC(=O)c1ccc(=O)[nH]c1 WXVL_AK00476SC2212 [0,2,0,0,0,0|1,0,0]=3 1092 B12R1.16 CCNC(=O)c1ccc(=O)oc1 WXVL_AK00476SC0132 [0,2,0,0,0,0|1,0,0]=3 1093 B12R1.16 CCNC(=O)c1ccc(=O)oc1 WXVL_AK00476SC0132 [0,2,0,0,0,0|1,0,0]=3 1094 B12R1.16 CCNC(=O)c1ccc(cc1)Br WXVL_AK00476SD0060 [0,2,0,0,0,0|0,0,0]=2 1095 B12R1.16 CCNC(=O)c1ccc(cc1)Br WXVL_AK00476SD0060 [0,2,0,0,0,0|0,0,0]=2 1096 B12R1.16 CCNC(=O)c1ccc(cc1)C WXVL_AK00476SD0078 [0,2,0,0,0,0|0,0,0]=2 1097 B12R1.16 CCNC(=O)c1ccc(cc1)C WXVL_AK00476SD0078 [0,2,0,0,0,0|0,0,0]=2 1098 B12R1.16 CCNC(=O)c1ccc(cc1)Cl WXVL_AK00476SD0062 [0,2,0,0,0,0|0,0,0]=2 1099 B12R1.16 CCNC(=O)c1ccc(cc1)Cl WXVL_AK00476SD0062 [0,2,0,0,0,0|0,0,0]=2 1100 B12R1.16 CCNC(=O)c1ccc(cc1)F WXVL_AK00476SD0061 [0,2,0,0,0,0|0,0,0]=2 1101 B12R1.16 CCNC(=O)c1ccc(cc1)F WXVL_AK00476SD0061 [0,2,0,0,0,0|0,0,0]=2 1102 B12R1.16 CCNC(=O)c1ccc(cc1)I WXVL_AK00476SD0421 [0,2,0,0,0,0|0,0,0]=2 1103 B12R1.16 CCNC(=O)c1ccc(cc1)I WXVL_AK00476SD0421 [0,2,0,0,0,0|0,0,0]=2 1104 B12R1.16 CCNC(=O)c1ccc(cc1)O WXVL_AK00476SD0069 [0,2,0,0,0,0|0,0,0]=2 1105 B12R1.16 CCNC(=O)c1ccc(cc1)O WXVL_AK00476SD0069 [0,2,0,0,0,0|0,0,0]=2 1106 B12R1.16 CCNC(=O)c1ccc(cc1)S WXVL_AK00476SD0154 [0,2,0,0,0,0|0,0,0]=2 1107 B12R1.16 CCNC(=O)c1ccc(cc1)S WXVL_AK00476SD0154 [0,2,0,0,0,0|0,0,0]=2 1108 B12R1.16 CCNC(=O)c1ccc(cn1)Br WXVL_AK00476SC0363 [0,2,0,0,0,0|1,0,0]=3 1109 B12R1.16 CCNC(=O)c1ccc(cn1)Br WXVL_AK00476SC0363 [0,2,0,0,0,0|1,0,0]=3 1110 B12R1.16 CCNC(=O)c1ccc(cn1)C WXVL_AK00476SC0104 [0,2,0,0,0,0|1,0,0]=3 1111 B12R1.16 CCNC(=O)c1ccc(cn1)C WXVL_AK00476SC0104 [0,2,0,0,0,0|1,0,0]=3 1112 B12R1.16 CCNC(=O)c1ccc(cn1)Cl WXVL_AK00476SC0381 [0,2,0,0,0,0|1,0,0]=3 1113 B12R1.16 CCNC(=O)c1ccc(cn1)Cl WXVL_AK00476SC0381 [0,2,0,0,0,0|1,0,0]=3 1114 B12R1.16 CCNC(=O)c1ccc(cn1)F WXVL_AK00476SC0114 [0,2,0,0,0,0|1,0,0]=3 1115 B12R1.16 CCNC(=O)c1ccc(cn1)F WXVL_AK00476SC0114 [0,2,0,0,0,0|1,0,0]=3 1116 B12R1.16 CCNC(=O)c1ccc(cn1)O WXVL_AK00476SC0130 [0,2,0,0,0,0|1,0,0]=3 1117 B12R1.16 CCNC(=O)c1ccc(cn1)O WXVL_AK00476SC0130 [0,2,0,0,0,0|1,0,0]=3 1118 B12R1.16 CCNC(=O)c1ccc(nc1)Br WXVL_AK00476SC0352 [0,2,0,0,0,0|1,0,0]=3 1119 B12R1.16 CCNC(=O)c1ccc(nc1)Br WXVL_AK00476SC0352 [0,2,0,0,0,0|1,0,0]=3 1120 B12R1.16 CCNC(=O)c1ccc(nc1)C WXVL_AK00476SC0060 [0,2,0,0,0,0|1,0,0]=3 1121 B12R1.16 CCNC(=O)c1ccc(nc1)C WXVL_AK00476SC0060 [0,2,0,0,0,0|1,0,0]=3 1122 B12R1.16 CCNC(=O)c1ccc(nc1)Cl WXVL_AK00476SC0147 [0,2,0,0,0,0|1,0,0]=3 1123 B12R1.16 CCNC(=O)c1ccc(nc1)Cl WXVL_AK00476SC0147 [0,2,0,0,0,0|1,0,0]=3 1124 B12R1.16 CCNC(=O)c1ccc(nc1)F WXVL_AK00476SC0370 [0,2,0,0,0,0|1,0,0]=3 1125 B12R1.16 CCNC(=O)c1ccc(nc1)F WXVL_AK00476SC0370 [0,2,0,0,0,0|1,0,0]=3 1126 B12R1.16 CCNC(=O)c1ccc(nc1)O WXVL_AK00476SC0057 [0,2,0,0,0,0|1,0,0]=3 1127 B12R1.16 CCNC(=O)c1ccc(nc1)O WXVL_AK00476SC0057 [0,2,0,0,0,0|1,0,0]=3 1128 B12R1.16 CCNC(=O)c1cnc(cn1)C WXVL_AK00476SC0072 [0,2,0,0,0,0|2,0,0]=4 1129 B12R1.16 CCNC(=O)c1cnc(cn1)C WXVL_AK00476SC0072 [0,2,0,0,0,0|2,0,0]=4 1130 B12R1.16 CCNC(=O)c1cnc(cn1)Cl WXVL_AK00476SC0383 [0,2,0,0,0,0|2,0,0]=4 1131 B12R1.16 CCNC(=O)c1cnc(cn1)Cl WXVL_AK00476SC0383 [0,2,0,0,0,0|2,0,0]=4 1132 B12R1.16 CCNC(=O)c1cnc(nc1)C WXVL_AK00476SC0032 [0,2,0,0,0,0|2,0,0]=4 1133 B12R1.16 CCNC(=O)c1cnc(nc1)C WXVL_AK00476SC0032 [0,2,0,0,0,0|2,0,0]=4 1134 B12R1.16 CCNC(=O)c1cnc(nc1)Cl WXVL_AK00476SC0148 [0,2,0,0,0,0|2,0,0]=4 1135 B12R1.16 CCNC(=O)c1cnc(nc1)Cl WXVL_AK00476SC0148 [0,2,0,0,0,0|2,0,0]=4 1136 B12R1.16 CCNC(=O)c1ncc(cn1)Cl WXVL_AK00476SC0029 [0,2,0,0,0,0|2,0,0]=4 1137 B12R1.16 CCNC(=O)c1ncc(cn1)Cl WXVL_AK00476SC0029 [0,2,0,0,0,0|2,0,0]=4 1138 B12R1.17 CCNC(=O)C1=CC=NC(=O)C1 WXVL_AK00476SC0016 [0,2,0,0,0,0|1,0,1]=4 1139 B12R1.17 CCNC(=O)C1=CC=NC(=O)C1 WXVL_AK00476SC0016 [0,2,0,0,0,0|1,0,1]=4 1140 B12R1.17 CCNC(=O)c1cc(=O)cco1 WXVL_AK00476SC0133 [0,2,0,0,0,0|1,0,0]=3 1141 B12R1.17 CCNC(=O)c1cc(=O)cco1 WXVL_AK00476SC0133 [0,2,0,0,0,0|1,0,0]=3 1142 B12R1.17 CCNC(=O)c1cc(ccn1)Br WXVL_AK00476SC0243 [0,2,0,0,0,0|1,0,0]=3 1143 B12R1.17 CCNC(=O)c1cc(ccn1)Br WXVL_AK00476SC0243 [0,2,0,0,0,0|1,0,0]=3 1144 B12R1.17 CCNC(=O)c1cc(ccn1)C WXVL_AK00476SC0235 [0,2,0,0,0,0|1,0,0]=3 1145 B12R1.17 CCNC(=O)c1cc(ccn1)C WXVL_AK00476SC0235 [0,2,0,0,0,0|1,0,0]=3 1146 B12R1.17 CCNC(=O)c1cc(ccn1)Cl WXVL_AK00476SC0373 [0,2,0,0,0,0|1,0,0]=3 1147 B12R1.17 CCNC(=O)c1cc(ccn1)Cl WXVL_AK00476SC0373 [0,2,0,0,0,0|1,0,0]=3 1148 B12R1.17 CCNC(=O)c1cc(ncn1)Cl WXVL_AK00476SC0775 [0,2,0,0,0,0|2,0,0]=4 1149 B12R1.17 CCNC(=O)c1cc(ncn1)Cl WXVL_AK00476SC0775 [0,2,0,0,0,0|2,0,0]=4 1150 B12R1.17 CCNC(=O)c1cc(ncn1)O WXVL_AK00476SC0001 [0,2,0,0,0,0|2,0,0]=4 1151 B12R1.17 CCNC(=O)c1cc(ncn1)O WXVL_AK00476SC0001 [0,2,0,0,0,0|2,0,0]=4 1152 B12R1.17 CCNC(=O)c1ccc[n+](c1)[O-] WXVL_AK00476SC1039 [0,2,0,0,0,0|1,0,0]=3 1153 B12R1.17 CCNC(=O)c1ccc[n+](c1)[O-] WXVL_AK00476SC1039 [0,2,0,0,0,0|1,0,0]=3 1154 B12R1.17 CCNC(=O)c1cccc(c1)Br WXVL_AK00476SD0041 [0,2,0,0,0,0|0,0,0]=2 1155 B12R1.17 CCNC(=O)c1cccc(c1)Br WXVL_AK00476SD0041 [0,2,0,0,0,0|0,0,0]=2 1156 B12R1.17 CCNC(=O)c1cccc(c1)C WXVL_AK00476SD0056 [0,2,0,0,0,0|0,0,0]=2 1157 B12R1.17 CCNC(=O)c1cccc(c1)C WXVL_AK00476SD0056 [0,2,0,0,0,0|0,0,0]=2 1158 B12R1.17 CCNC(=O)c1cccc(c1)Cl WXVL_AK00476SD0045 [0,2,0,0,0,0|0,0,0]=2 1159 B12R1.17 CCNC(=O)c1cccc(c1)Cl WXVL_AK00476SD0045 [0,2,0,0,0,0|0,0,0]=2 1160 B12R1.17 CCNC(=O)c1cccc(c1)F WXVL_AK00476SD0043 [0,2,0,0,0,0|0,0,0]=2 1161 B12R1.17 CCNC(=O)c1cccc(c1)F WXVL_AK00476SD0043 [0,2,0,0,0,0|0,0,0]=2 1162 B12R1.17 CCNC(=O)c1cccc(c1)I WXVL_AK00476SD0405 [0,2,0,0,0,0|0,0,0]=2 1163 B12R1.17 CCNC(=O)c1cccc(c1)I WXVL_AK00476SD0405 [0,2,0,0,0,0|0,0,0]=2 1164 B12R1.17 CCNC(=O)c1cccc(c1)O WXVL_AK00476SD1724 [0,2,0,0,0,0|0,0,0]=2 1165 B12R1.17 CCNC(=O)c1cccc(c1)O WXVL_AK00476SD1724 [0,2,0,0,0,0|0,0,0]=2 1166 B12R1.17 CCNC(=O)c1cccc(n1)Br WXVL_AK00476SC0366 [0,2,0,0,0,0|1,0,0]=3 1167 B12R1.17 CCNC(=O)c1cccc(n1)Br WXVL_AK00476SC0366 [0,2,0,0,0,0|1,0,0]=3 1168 B12R1.17 CCNC(=O)c1cccc(n1)F WXVL_AK00476SC0386 [0,2,0,0,0,0|1,0,0]=3 1169 B12R1.17 CCNC(=O)c1cccc(n1)F WXVL_AK00476SC0386 [0,2,0,0,0,0|1,0,0]=3 1170 B12R1.17 CCNC(=O)c1cccc(n1)O WXVL_AK00476SC0084 [0,2,0,0,0,0|1,0,0]=3 1171 B12R1.17 CCNC(=O)c1cccc(n1)O WXVL_AK00476SC0084 [0,2,0,0,0,0|1,0,0]=3 1172 B12R1.17 CCNC(=O)c1ccnc(c1)Br WXVL_AK00476SC0349 [0,2,0,0,0,0|1,0,0]=3 1173 B12R1.17 CCNC(=O)c1ccnc(c1)Br WXVL_AK00476SC0349 [0,2,0,0,0,0|1,0,0]=3 1174 B12R1.17 CCNC(=O)c1ccnc(c1)C WXVL_AK00476SC0400 [0,2,0,0,0,0|1,0,0]=3 1175 B12R1.17 CCNC(=O)c1ccnc(c1)C WXVL_AK00476SC0400 [0,2,0,0,0,0|1,0,0]=3 1176 B12R1.17 CCNC(=O)c1ccnc(c1)Cl WXVL_AK00476SC0083 [0,2,0,0,0,0|1,0,0]=3 1177 B12R1.17 CCNC(=O)c1ccnc(c1)Cl WXVL_AK00476SC0083 [0,2,0,0,0,0|1,0,0]=3 1178 B12R1.17 CCNC(=O)c1ccnc(c1)F WXVL_AK00476SC0015 [0,2,0,0,0,0|1,0,0]=3 1179 B12R1.17 CCNC(=O)c1ccnc(c1)F WXVL_AK00476SC0015 [0,2,0,0,0,0|1,0,0]=3 1180 B12R1.17 CCNC(=O)c1ccnc(c1)O WXVL_AK00476SC0131 [0,2,0,0,0,0|1,0,0]=3 1181 B12R1.17 CCNC(=O)c1ccnc(c1)O WXVL_AK00476SC0131 [0,2,0,0,0,0|1,0,0]=3 1182 B12R1.17 CCNC(=O)c1ccnc(n1)C WXVL_AK00476SC0296 [0,2,0,0,0,0|2,0,0]=4 1183 B12R1.17 CCNC(=O)c1ccnc(n1)C WXVL_AK00476SC0296 [0,2,0,0,0,0|2,0,0]=4 1184 B12R1.17 CCNC(=O)c1ccnc(n1)Cl WXVL_AK00476SC0392 [0,2,0,0,0,0|2,0,0]=4 1185 B12R1.17 CCNC(=O)c1ccnc(n1)Cl WXVL_AK00476SC0392 [0,2,0,0,0,0|2,0,0]=4 1186 B12R1.17 CCNC(=O)c1cncc(c1)Br WXVL_AK00476SC0369 [0,2,0,0,0,0|1,0,0]=3 1187 B12R1.17 CCNC(=O)c1cncc(c1)Br WXVL_AK00476SC0369 [0,2,0,0,0,0|1,0,0]=3 1188 B12R1.17 CCNC(=O)c1cncc(c1)C WXVL_AK00476SC0095 [0,2,0,0,0,0|1,0,0]=3 1189 B12R1.17 CCNC(=O)c1cncc(c1)C WXVL_AK00476SC0095 [0,2,0,0,0,0|1,0,0]=3 1190 B12R1.17 CCNC(=O)c1cncc(c1)Cl WXVL_AK00476SC0291 [0,2,0,0,0,0|1,0,0]=3 1191 B12R1.17 CCNC(=O)c1cncc(c1)Cl WXVL_AK00476SC0291 [0,2,0,0,0,0|1,0,0]=3 1192 B12R1.17 CCNC(=O)c1cncc(c1)F WXVL_AK00476SC0102 [0,2,0,0,0,0|1,0,0]=3 1193 B12R1.17 CCNC(=O)c1cncc(c1)F WXVL_AK00476SC0102 [0,2,0,0,0,0|1,0,0]=3 1194 B12R1.17 CCNC(=O)c1cncc(c1)O WXVL_AK00476SC0333 [0,2,0,0,0,0|1,0,0]=3 1195 B12R1.17 CCNC(=O)c1cncc(c1)O WXVL_AK00476SC0333 [0,2,0,0,0,0|1,0,0]=3 1196 B12R1.17 CCNC(=O)c1cncc(n1)C WXVL_AK00476SC0391 [0,2,0,0,0,0|2,0,0]=4 1197 B12R1.17 CCNC(=O)c1cncc(n1)C WXVL_AK00476SC0391 [0,2,0,0,0,0|2,0,0]=4 1198 B12R1.17 CCNC(=O)c1cnnc(c1)Cl WXVL_AK00476SC0966 [0,2,0,0,0,0|2,0,0]=4 1199 B12R1.17 CCNC(=O)c1cnnc(c1)Cl WXVL_AK00476SC0966 [0,2,0,0,0,0|2,0,0]=4 1200 B12R1.17 CCNC(=O)c1cnnc(c1)O WXVL_AK00476SC0795 [0,2,0,0,0,0|2,0,0]=4 1201 B12R1.17 CCNC(=O)c1cnnc(c1)O WXVL_AK00476SC0795 [0,2,0,0,0,0|2,0,0]=4 1202 B12R1.30 C=CCNC(=O)c1ccccc1 WXVL_AK00561SD0001 [0,2,0,0,0,0|0,0,0]=2 1203 B12R1.30 C=CCNC(=O)c1ccccc1 WXVL_AK00561SD0001 [0,2,0,0,0,0|0,0,0]=2 1204 B12R1.30 C=CCNC(=O)c1ccccn1 WXVL_AK00561SC0058 [0,2,0,0,0,0|1,0,0]=3 1205 B12R1.30 C=CCNC(=O)c1ccccn1 WXVL_AK00561SC0058 [0,2,0,0,0,0|1,0,0]=3 1206 B12R1.30 C=CCNC(=O)c1cccnc1 WXVL_AK00561SC0061 [0,2,0,0,0,0|1,0,0]=3 1207 B12R1.30 C=CCNC(=O)c1cccnc1 WXVL_AK00561SC0061 [0,2,0,0,0,0|1,0,0]=3 1208 B12R1.30 C=CCNC(=O)c1cccnn1 WXVL_AK00561SC0374 [0,2,0,0,0,0|2,0,0]=4 1209 B12R1.30 C=CCNC(=O)c1cccnn1 WXVL_AK00561SC0374 [0,2,0,0,0,0|2,0,0]=4 1210 B12R1.30 C=CCNC(=O)c1ccncc1 WXVL_AK00561SC0062 [0,2,0,0,0,0|1,0,0]=3 1211 B12R1.30 C=CCNC(=O)c1ccncc1 WXVL_AK00561SC0062 [0,2,0,0,0,0|1,0,0]=3 1212 B12R1.30 C=CCNC(=O)c1ccncn1 WXVL_AK00561SC0231 [0,2,0,0,0,0|2,0,0]=4 1213 B12R1.30 C=CCNC(=O)c1ccncn1 WXVL_AK00561SC0231 [0,2,0,0,0,0|2,0,0]=4 1214 B12R1.30 C=CCNC(=O)c1ccnnc1 WXVL_AK00561SC0064 [0,2,0,0,0,0|2,0,0]=4 1215 B12R1.30 C=CCNC(=O)c1ccnnc1 WXVL_AK00561SC0064 [0,2,0,0,0,0|2,0,0]=4 1216 B12R1.30 C=CCNC(=O)c1cncnc1 WXVL_AK00561SC0097 [0,2,0,0,0,0|2,0,0]=4 1217 B12R1.30 C=CCNC(=O)c1cncnc1 WXVL_AK00561SC0097 [0,2,0,0,0,0|2,0,0]=4 1218 B12R1.30 C=CCNC(=O)c1ncccn1 WXVL_AK00561SC0096 [0,2,0,0,0,0|2,0,0]=4 1219 B12R1.30 C=CCNC(=O)c1ncccn1 WXVL_AK00561SC0096 [0,2,0,0,0,0|2,0,0]=4 1220 B12R1.30 CCCNC(=O)c1ccccc1 WXVL_AK00504SD0001 [0,2,0,0,0,0|0,0,0]=2 1221 B12R1.30 CCCNC(=O)c1ccccc1 WXVL_AK00504SD0001 [0,2,0,0,0,0|0,0,0]=2 1222 B12R1.30 CCCNC(=O)c1ccccn1 WXVL_AK00504SC0058 [0,2,0,0,0,0|1,0,0]=3 1223 B12R1.30 CCCNC(=O)c1ccccn1 WXVL_AK00504SC0058 [0,2,0,0,0,0|1,0,0]=3 1224 B12R1.30 CCCNC(=O)c1cccnc1 WXVL_AK00504SC0061 [0,2,0,0,0,0|1,0,0]=3 1225 B12R1.30 CCCNC(=O)c1cccnc1 WXVL_AK00504SC0061 [0,2,0,0,0,0|1,0,0]=3 1226 B12R1.30 CCCNC(=O)c1cccnn1 WXVL_AK00504SC0374 [0,2,0,0,0,0|2,0,0]=4 1227 B12R1.30 CCCNC(=O)c1cccnn1 WXVL_AK00504SC0374 [0,2,0,0,0,0|2,0,0]=4 1228 B12R1.30 CCCNC(=O)c1ccncc1 WXVL_AK00504SC0062 [0,2,0,0,0,0|1,0,0]=3 1229 B12R1.30 CCCNC(=O)c1ccncc1 WXVL_AK00504SC0062 [0,2,0,0,0,0|1,0,0]=3 1230 B12R1.30 CCCNC(=O)c1ccncn1 WXVL_AK00504SC0231 [0,2,0,0,0,0|2,0,0]=4 1231 B12R1.30 CCCNC(=O)c1ccncn1 WXVL_AK00504SC0231 [0,2,0,0,0,0|2,0,0]=4 1232 B12R1.30 CCCNC(=O)c1ccnnc1 WXVL_AK00504SC0064 [0,2,0,0,0,0|2,0,0]=4 1233 B12R1.30 CCCNC(=O)c1ccnnc1 WXVL_AK00504SC0064 [0,2,0,0,0,0|2,0,0]=4 1234 B12R1.30 CCCNC(=O)c1cncnc1 WXVL_AK00504SC0097 [0,2,0,0,0,0|2,0,0]=4 1235 B12R1.30 CCCNC(=O)c1cncnc1 WXVL_AK00504SC0097 [0,2,0,0,0,0|2,0,0]=4 1236 B12R1.30 CCCNC(=O)c1ncccn1 WXVL_AK00504SC0096 [0,2,0,0,0,0|2,0,0]=4 1237 B12R1.30 CCCNC(=O)c1ncccn1 WXVL_AK00504SC0096 [0,2,0,0,0,0|2,0,0]=4 1238 B12R1.30 N#CCNC(=O)c1ccccc1 WXVL_AK0683SD0001 [0,2,0,0,0,0|0,0,0]=2 1239 B12R1.30 N#CCNC(=O)c1ccccc1 WXVL_AK0683SD0001 [0,2,0,0,0,0|0,0,0]=2 1240 B12R1.30 N#CCNC(=O)c1ccccn1 WXVL_AK0683SC0058 [0,2,0,0,0,0|1,0,0]=3 1241 B12R1.30 N#CCNC(=O)c1ccccn1 WXVL_AK0683SC0058 [0,2,0,0,0,0|1,0,0]=3 1242 B12R1.30 N#CCNC(=O)c1cccnc1 WXVL_AK0683SC0061 [0,2,0,0,0,0|1,0,0]=3 1243 B12R1.30 N#CCNC(=O)c1cccnc1 WXVL_AK0683SC0061 [0,2,0,0,0,0|1,0,0]=3 1244 B12R1.30 N#CCNC(=O)c1cccnn1 WXVL_AK0683SC0374 [0,2,0,0,0,0|2,0,0]=4 1245 B12R1.30 N#CCNC(=O)c1cccnn1 WXVL_AK0683SC0374 [0,2,0,0,0,0|2,0,0]=4 1246 B12R1.30 N#CCNC(=O)c1ccncc1 WXVL_AK0683SC0062 [0,2,0,0,0,0|1,0,0]=3 1247 B12R1.30 N#CCNC(=O)c1ccncc1 WXVL_AK0683SC0062 [0,2,0,0,0,0|1,0,0]=3 1248 B12R1.30 N#CCNC(=O)c1ccncn1 WXVL_AK0683SC0231 [0,2,0,0,0,0|2,0,0]=4 1249 B12R1.30 N#CCNC(=O)c1ccncn1 WXVL_AK0683SC0231 [0,2,0,0,0,0|2,0,0]=4 1250 B12R1.30 N#CCNC(=O)c1ccnnc1 WXVL_AK0683SC0064 [0,2,0,0,0,0|2,0,0]=4 1251 B12R1.30 N#CCNC(=O)c1ccnnc1 WXVL_AK0683SC0064 [0,2,0,0,0,0|2,0,0]=4 1252 B12R1.30 N#CCNC(=O)c1cncnc1 WXVL_AK0683SC0097 [0,2,0,0,0,0|2,0,0]=4 1253 B12R1.30 N#CCNC(=O)c1cncnc1 WXVL_AK0683SC0097 [0,2,0,0,0,0|2,0,0]=4 1254 B12R1.30 N#CCNC(=O)c1ncccn1 WXVL_AK0683SC0096 [0,2,0,0,0,0|2,0,0]=4 1255 B12R1.30 N#CCNC(=O)c1ncccn1 WXVL_AK0683SC0096 [0,2,0,0,0,0|2,0,0]=4 1256 B12R1.30 O=C(NCCF)c1ccccc1 WXVL_AK00466SD0001 [0,2,0,0,0,0|0,0,0]=2 1257 B12R1.30 O=C(NCCF)c1ccccc1 WXVL_AK00466SD0001 [0,2,0,0,0,0|0,0,0]=2 1258 B12R1.30 O=C(NCCF)c1ccccn1 WXVL_AK00466SC0058 [0,2,0,0,0,0|1,0,0]=3 1259 B12R1.30 O=C(NCCF)c1ccccn1 WXVL_AK00466SC0058 [0,2,0,0,0,0|1,0,0]=3 1260 B12R1.30 O=C(NCCF)c1cccnc1 WXVL_AK00466SC0061 [0,2,0,0,0,0|1,0,0]=3 1261 B12R1.30 O=C(NCCF)c1cccnc1 WXVL_AK00466SC0061 [0,2,0,0,0,0|1,0,0]=3 1262 B12R1.30 O=C(NCCF)c1cccnn1 WXVL_AK00466SC0374 [0,2,0,0,0,0|2,0,0]=4 1263 B12R1.30 O=C(NCCF)c1cccnn1 WXVL_AK00466SC0374 [0,2,0,0,0,0|2,0,0]=4 1264 B12R1.30 O=C(NCCF)c1ccncc1 WXVL_AK00466SC0062 [0,2,0,0,0,0|1,0,0]=3 1265 B12R1.30 O=C(NCCF)c1ccncc1 WXVL_AK00466SC0062 [0,2,0,0,0,0|1,0,0]=3 1266 B12R1.30 O=C(NCCF)c1ccncn1 WXVL_AK00466SC0231 [0,2,0,0,0,0|2,0,0]=4 1267 B12R1.30 O=C(NCCF)c1ccncn1 WXVL_AK00466SC0231 [0,2,0,0,0,0|2,0,0]=4 1268 B12R1.30 O=C(NCCF)c1ccnnc1 WXVL_AK00466SC0064 [0,2,0,0,0,0|2,0,0]=4 1269 B12R1.30 O=C(NCCF)c1ccnnc1 WXVL_AK00466SC0064 [0,2,0,0,0,0|2,0,0]=4 1270 B12R1.30 O=C(NCCF)c1cncnc1 WXVL_AK00466SC0097 [0,2,0,0,0,0|2,0,0]=4 1271 B12R1.30 O=C(NCCF)c1cncnc1 WXVL_AK00466SC0097 [0,2,0,0,0,0|2,0,0]=4 1272 B12R1.30 O=C(NCCF)c1ncccn1 WXVL_AK00466SC0096 [0,2,0,0,0,0|2,0,0]=4 1273 B12R1.30 O=C(NCCF)c1ncccn1 WXVL_AK00466SC0096 [0,2,0,0,0,0|2,0,0]=4 1274 B12R1.107 CC(C)NC(=O)c1ccccc1 WXVL_AK0030SD0001 [0,2,0,0,0,0|0,0,0]=2 1275 B12R1.107 CC(C)NC(=O)c1ccccc1 WXVL_AK0030SD0001 [0,2,0,0,0,0|0,0,0]=2 1276 B12R1.107 CC(C)NC(=O)c1ccccn1 WXVL_AK0030SC0058 [0,2,0,0,0,0|1,0,0]=3 1277 B12R1.107 CC(C)NC(=O)c1ccccn1 WXVL_AK0030SC0058 [0,2,0,0,0,0|1,0,0]=3 1278 B12R1.107 CC(C)NC(=O)c1cccnc1 WXVL_AK0030SC0061 [0,2,0,0,0,0|1,0,0]=3 1279 B12R1.107 CC(C)NC(=O)c1cccnc1 WXVL_AK0030SC0061 [0,2,0,0,0,0|1,0,0]=3 1280 B12R1.107 CC(C)NC(=O)c1cccnn1 WXVL_AK0030SC0374 [0,2,0,0,0,0|2,0,0]=4 1281 B12R1.107 CC(C)NC(=O)c1cccnn1 WXVL_AK0030SC0374 [0,2,0,0,0,0|2,0,0]=4 1282 B12R1.107 CC(C)NC(=O)c1ccncc1 WXVL_AK0030SC0062 [0,2,0,0,0,0|1,0,0]=3 1283 B12R1.107 CC(C)NC(=O)c1ccncc1 WXVL_AK0030SC0062 [0,2,0,0,0,0|1,0,0]=3 1284 B12R1.107 CC(C)NC(=O)c1ccncn1 WXVL_AK0030SC0231 [0,2,0,0,0,0|2,0,0]=4 1285 B12R1.107 CC(C)NC(=O)c1ccncn1 WXVL_AK0030SC0231 [0,2,0,0,0,0|2,0,0]=4 1286 B12R1.107 CC(C)NC(=O)c1ccnnc1 WXVL_AK0030SC0064 [0,2,0,0,0,0|2,0,0]=4 1287 B12R1.107 CC(C)NC(=O)c1ccnnc1 WXVL_AK0030SC0064 [0,2,0,0,0,0|2,0,0]=4 1288 B12R1.107 CC(C)NC(=O)c1cncnc1 WXVL_AK0030SC0097 [0,2,0,0,0,0|2,0,0]=4 1289 B12R1.107 CC(C)NC(=O)c1cncnc1 WXVL_AK0030SC0097 [0,2,0,0,0,0|2,0,0]=4 1290 B12R1.107 CC(C)NC(=O)c1ncccn1 WXVL_AK0030SC0096 [0,2,0,0,0,0|2,0,0]=4 1291 B12R1.107 CC(C)NC(=O)c1ncccn1 WXVL_AK0030SC0096 [0,2,0,0,0,0|2,0,0]=4 1292 B12R1.308 CCNC(=O)C1C=CCC=C1C WXVL_AK00476SB0380 [0,2,0,0,0,0|0,0,2]=4 1293 B12R1.308 CCNC(=O)C1C=CCC=C1C WXVL_AK00476SB0380 [0,2,0,0,0,0|0,0,2]=4 1294 B12R1.308 CCNC(=O)c1ccccc1Br WXVL_AK00476SD0002 [0,2,0,0,0,0|0,0,0]=2 1295 B12R1.308 CCNC(=O)c1ccccc1Br WXVL_AK00476SD0002 [0,2,0,0,0,0|0,0,0]=2 1296 B12R1.308 CCNC(=O)c1ccccc1C WXVL_AK00476SD0037 [0,2,0,0,0,0|0,0,0]=2 1297 B12R1.308 CCNC(=O)c1ccccc1C WXVL_AK00476SD0037 [0,2,0,0,0,0|0,0,0]=2 1298 B12R1.308 CCNC(=O)c1ccccc1Cl WXVL_AK00476SD0006 [0,2,0,0,0,0|0,0,0]=2 1299 B12R1.308 CCNC(=O)c1ccccc1Cl WXVL_AK00476SD0006 [0,2,0,0,0,0|0,0,0]=2 1300 B12R1.308 CCNC(=O)c1ccccc1F WXVL_AK00476SD0003 [0,2,0,0,0,0|0,0,0]=2 1301 B12R1.308 CCNC(=O)c1ccccc1F WXVL_AK00476SD0003 [0,2,0,0,0,0|0,0,0]=2 1302 B12R1.308 CCNC(=O)c1ccccc1I WXVL_AK00476SD0303 [0,2,0,0,0,0|0,0,0]=2 1303 B12R1.308 CCNC(=O)c1ccccc1I WXVL_AK00476SD0303 [0,2,0,0,0,0|0,0,0]=2 1304 B12R1.308 CCNC(=O)c1ccccc1O WXVL_AK00476SD00056 [0,2,0,0,0,0|0,0,0]=2 1305 B12R1.308 CCNC(=O)c1ccccc1O WXVL_AK00476SD00056 [0,2,0,0,0,0|0,0,0]=2 1306 B12R1.308 CCNC(=O)c1ccccc1S WXVL_AK00476SD0153 [0,2,0,0,0,0|0,0,0]=2 1307 B12R1.308 CCNC(=O)c1ccccc1S WXVL_AK00476SD0153 [0,2,0,0,0,0|0,0,0]=2 1308 B12R1.308 CCNC(=O)c1cccnc1Br WXVL_AK00476SC0367 [0,2,0,0,0,0|1,0,0]=3 1309 B12R1.308 CCNC(=O)c1cccnc1Br WXVL_AK00476SC0367 [0,2,0,0,0,0|1,0,0]=3 1310 B12R1.308 CCNC(=O)c1cccnc1C WXVL_AK00476SC0065 [0,2,0,0,0,0|1,0,0]=3 1311 B12R1.308 CCNC(=O)c1cccnc1C WXVL_AK00476SC0065 [0,2,0,0,0,0|1,0,0]=3 1312 B12R1.308 CCNC(=O)c1cccnc1Cl WXVL_AK00476SC0146 [0,2,0,0,0,0|1,0,0]=3 1313 B12R1.308 CCNC(=O)c1cccnc1Cl WXVL_AK00476SC0146 [0,2,0,0,0,0|1,0,0]=3 1314 B12R1.308 CCNC(=O)c1cccnc1F WXVL_AK00476SC0350 [0,2,0,0,0,0|1,0,0]=3 1315 B12R1.308 CCNC(=O)c1cccnc1F WXVL_AK00476SC0350 [0,2,0,0,0,0|1,0,0]=3 1316 B12R1.308 CCNC(=O)c1cccnc1O WXVL_AK00476SC0063 [0,2,0,0,0,0|1,0,0]=3 1317 B12R1.308 CCNC(=O)c1cccnc1O WXVL_AK00476SC0063 [0,2,0,0,0,0|1,0,0]=3 1318 B12R1.308 CCNC(=O)c1ccncc1Br WXVL_AK00476SC0365 [0,2,0,0,0,0|1,0,0]=3 1319 B12R1.308 CCNC(=O)c1ccncc1Br WXVL_AK00476SC0365 [0,2,0,0,0,0|1,0,0]=3 1320 B12R1.308 CCNC(=O)c1ccncc1Cl WXVL_AK00476SC0375 [0,2,0,0,0,0|1,0,0]=3 1321 B12R1.308 CCNC(=O)c1ccncc1Cl WXVL_AK00476SC0375 [0,2,0,0,0,0|1,0,0]=3 1322 B12R1.308 CCNC(=O)c1ccncc1F WXVL_AK00476SC0320 [0,2,0,0,0,0|1,0,0]=3 1323 B12R1.308 CCNC(=O)c1ccncc1F WXVL_AK00476SC0320 [0,2,0,0,0,0|1,0,0]=3 1324 B12R1.308 CCNC(=O)c1ccncc1O WXVL_AK00476SC0354 [0,2,0,0,0,0|1,0,0]=3 1325 B12R1.308 CCNC(=O)c1ccncc1O WXVL_AK00476SC0354 [0,2,0,0,0,0|1,0,0]=3 1326 B12R1.308 CCNC(=O)c1ccnnc1O WXVL_AK00476SC0899 [0,2,0,0,0,0|2,0,0]=4 1327 B12R1.308 CCNC(=O)c1ccnnc1O WXVL_AK00476SC0899 [0,2,0,0,0,0|2,0,0]=4 1328 B12R1.308 CCNC(=O)c1cnccc1Br WXVL_AK00476SC0500 [0,2,0,0,0,0|1,0,0]=3 1329 B12R1.308 CCNC(=O)c1cnccc1Br WXVL_AK00476SC0500 [0,2,0,0,0,0|1,0,0]=3 1330 B12R1.308 CCNC(=O)c1cnccc1C WXVL_AK00476SC0301 [0,2,0,0,0,0|1,0,0]=3 1331 B12R1.308 CCNC(=O)c1cnccc1C WXVL_AK00476SC0301 [0,2,0,0,0,0|1,0,0]=3 1332 B12R1.308 CCNC(=O)c1cnccc1Cl WXVL_AK00476SC0340 [0,2,0,0,0,0|1,0,0]=3 1333 B12R1.308 CCNC(=O)c1cnccc1Cl WXVL_AK00476SC0340 [0,2,0,0,0,0|1,0,0]=3 1334 B12R1.308 CCNC(=O)c1cncnc1C WXVL_AK00476SC0515 [0,2,0,0,0,0|2,0,0]=4 1335 B12R1.308 CCNC(=O)c1cncnc1C WXVL_AK00476SC0515 [0,2,0,0,0,0|2,0,0]=4 1336 B12R1.308 CCNC(=O)c1cnncc1C WXVL_AK00476SC0973 [0,2,0,0,0,0|2,0,0]=4 1337 B12R1.308 CCNC(=O)c1cnncc1C WXVL_AK00476SC0973 [0,2,0,0,0,0|2,0,0]=4 1338 B12R1.308 CCNC(=O)c1ncccc1Br WXVL_AK00476SC0501 [0,2,0,0,0,0|1,0,0]=3 1339 B12R1.308 CCNC(=O)c1ncccc1Br WXVL_AK00476SC0501 [0,2,0,0,0,0|1,0,0]=3 1340 B12R1.308 CCNC(=O)c1ncccc1C WXVL_AK00476SC0008 [0,2,0,0,0,0|1,0,0]=3 1341 B12R1.308 CCNC(=O)c1ncccc1C WXVL_AK00476SC0008 [0,2,0,0,0,0|1,0,0]=3 1342 B12R1.308 CCNC(=O)c1ncccc1Cl WXVL_AK00476SC0609 [0,2,0,0,0,0|1,0,0]=3 1343 B12R1.308 CCNC(=O)c1ncccc1Cl WXVL_AK00476SC0609 [0,2,0,0,0,0|1,0,0]=3 1344 B12R1.308 CCNC(=O)c1ncccc1F WXVL_AK00476SC0773 [0,2,0,0,0,0|1,0,0]=3 1345 B12R1.308 CCNC(=O)c1ncccc1F WXVL_AK00476SC0773 [0,2,0,0,0,0|1,0,0]=3 1346 B12R1.308 CCNC(=O)c1nccnc1Br WXVL_AK00476SC0785 [0,2,0,0,0,0|2,0,0]=4 1347 B12R1.308 CCNC(=O)c1nccnc1Br WXVL_AK00476SC0785 [0,2,0,0,0,0|2,0,0]=4 1348 B12R1.308 CCNC(=O)c1nccnc1Cl WXVL_AK00476SC0361 [0,2,0,0,0,0|2,0,0]=4 1349 B12R1.308 CCNC(=O)c1nccnc1Cl WXVL_AK00476SC0361 [0,2,0,0,0,0|2,0,0]=4 1350 B12R1.5 C#Cc1ccc(cc1)C(=O)NC WXVL_AK00442SD0813 [0,2,0,0,0,0|0,0,0]=2 1351 B12R1.5 C#Cc1ccc(cc1)C(=O)NC WXVL_AK00442SD0813 [0,2,0,0,0,0|0,0,0]=2 1352 B12R1.5 C=Cc1ccc(cc1)C(=O)NC WXVL_AK00442SD0529 [0,2,0,0,0,0|0,0,0]=2 1353 B12R1.5 C=Cc1ccc(cc1)C(=O)NC WXVL_AK00442SD0529 [0,2,0,0,0,0|0,0,0]=2 1354 B12R1.5 CCc1ccc(cc1)C(=O)NC WXVL_AK00442SD0080 [0,2,0,0,0,0|0,0,0]=2 1355 B12R1.5 CCc1ccc(cc1)C(=O)NC WXVL_AK00442SD0080 [0,2,0,0,0,0|0,0,0]=2 1356 B12R1.5 CCc1ccc(cn1)C(=O)NC WXVL_AK00442SC0043 [0,2,0,0,0,0|1,0,0]=3 1357 B12R1.5 CCc1ccc(cn1)C(=O)NC WXVL_AK00442SC0043 [0,2,0,0,0,0|1,0,0]=3 1358 B12R1.5 CNC(=O)c1ccc(cc1)CO WXVL_AK00442SD0451 [0,2,0,0,0,0|0,0,0]=2 1359 B12R1.5 CNC(=O)c1ccc(cc1)CO WXVL_AK00442SD0451 [0,2,0,0,0,0|0,0,0]=2 1360 B12R1.5 CNC(=O)c1ccc(cc1)OC WXVL_AK00442SD0066 [0,2,0,0,0,0|0,0,0]=2 1361 B12R1.5 CNC(=O)c1ccc(cc1)OC WXVL_AK00442SD0066 [0,2,0,0,0,0|0,0,0]=2 1362 B12R1.5 CNC(=O)c1ccc(cc1)SC WXVL_AK00442SD0072 [0,2,0,0,0,0|0,0,0]=2 1363 B12R1.5 CNC(=O)c1ccc(cc1)SC WXVL_AK00442SD0072 [0,2,0,0,0,0|0,0,0]=2 1364 B12R1.5 CNC(=O)c1ccc(nc1)OC WXVL_AK00442SC0019 [0,2,0,0,0,0|1,0,0]=3 1365 B12R1.5 CNC(=O)c1ccc(nc1)OC WXVL_AK00442SC0019 [0,2,0,0,0,0|1,0,0]=3 1366 B12R1.5 CNC(=O)c1ccc(nn1)OC WXVL_AK00442SC0883 [0,2,0,0,0,0|2,0,0]=4 1367 B12R1.5 CNC(=O)c1ccc(nn1)OC WXVL_AK00442SC0883 [0,2,0,0,0,0|2,0,0]=4 1368 B12R1.5 CNC(=O)c1cnc(cn1)OC WXVL_AK00442SC0120 [0,2,0,0,0,0|2,0,0]=4 1369 B12R1.5 CNC(=O)c1cnc(cn1)OC WXVL_AK00442SC0120 [0,2,0,0,0,0|2,0,0]=4 1370 B12R1.5 CNC(=O)c1cnc(nc1)OC WXVL_AK00442SC0509 [0,2,0,0,0,0|2,0,0]=4 1371 B12R1.5 CNC(=O)c1cnc(nc1)OC WXVL_AK00442SC0509 [0,2,0,0,0,0|2,0,0]=4 1372 B12R1.5 CNC(=O)c1cnc(nc1)SC WXVL_AK00442SC0770 [0,2,0,0,0,0|2,0,0]=4 1373 B12R1.5 CNC(=O)c1cnc(nc1)SC WXVL_AK00442SC0770 [0,2,0,0,0,0|2,0,0]=4 1374 B12R1.20 CN(C)C(=O)c1cc[n+](cc1)[O-] WXVL_AN0032SC0858 [0,2,0,0,0,0|1,0,0]=3 1375 B12R1.20 CN(C)C(=O)c1cc[n+](cc1)[O-] WXVL_AN0032SC0858 [0,2,0,0,0,0|1,0,0]=3 1376 B12R1.20 CN(C)C(=O)c1ccc(=O)[nH]c1 WXVL_AN0032SC2212 [0,2,0,0,0,0|1,0,0]=3 1377 B12R1.20 CN(C)C(=O)c1ccc(=O)[nH]c1 WXVL_AN0032SC2212 [0,2,0,0,0,0|1,0,0]=3 1378 B12R1.20 CN(C)C(=O)c1ccc(=O)oc1 WXVL_AN0032SC0132 [0,2,0,0,0,0|1,0,0]=3 1379 B12R1.20 CN(C)C(=O)c1ccc(=O)oc1 WXVL_AN0032SC0132 [0,2,0,0,0,0|1,0,0]=3 1380 B12R1.20 CN(C)C(=O)c1ccc(cc1)Br WXVL_AN0032SD0060 [0,2,0,0,0,0|0,0,0]=2 1381 B12R1.20 CN(C)C(=O)c1ccc(cc1)Br WXVL_AN0032SD0060 [0,2,0,0,0,0|0,0,0]=2 1382 B12R1.20 CN(C)C(=O)c1ccc(cc1)Cl WXVL_AN0032SD0062 [0,2,0,0,0,0|0,0,0]=2 1383 B12R1.20 CN(C)C(=O)c1ccc(cc1)Cl WXVL_AN0032SD0062 [0,2,0,0,0,0|0,0,0]=2 1384 B12R1.20 CN(C)C(=O)c1ccc(cc1)F WXVL_AN0032SD0061 [0,2,0,0,0,0|0,0,0]=2 1385 B12R1.20 CN(C)C(=O)c1ccc(cc1)F WXVL_AN0032SD0061 [0,2,0,0,0,0|0,0,0]=2 1386 B12R1.20 CN(C)C(=O)c1ccc(cc1)I WXVL_AN0032SD0421 [0,2,0,0,0,0|0,0,0]=2 1387 B12R1.20 CN(C)C(=O)c1ccc(cc1)I WXVL_AN0032SD0421 [0,2,0,0,0,0|0,0,0]=2 1388 B12R1.20 CN(C)C(=O)c1ccc(cc1)O WXVL_AN0032SD0069 [0,2,0,0,0,0|0,0,0]=2 1389 B12R1.20 CN(C)C(=O)c1ccc(cc1)O WXVL_AN0032SD0069 [0,2,0,0,0,0|0,0,0]=2 1390 B12R1.20 CN(C)C(=O)c1ccc(cc1)S WXVL_AN0032SD0154 [0,2,0,0,0,0|0,0,0]=2 1391 B12R1.20 CN(C)C(=O)c1ccc(cc1)S WXVL_AN0032SD0154 [0,2,0,0,0,0|0,0,0]=2 1392 B12R1.20 CN(C)C(=O)c1ccc(cn1)Br WXVL_AN0032SC0363 [0,2,0,0,0,0|1,0,0]=3 1393 B12R1.20 CN(C)C(=O)c1ccc(cn1)Br WXVL_AN0032SC0363 [0,2,0,0,0,0|1,0,0]=3 1394 B12R1.20 CN(C)C(=O)c1ccc(cn1)Cl WXVL_AN0032SC0381 [0,2,0,0,0,0|1,0,0]=3 1395 B12R1.20 CN(C)C(=O)c1ccc(cn1)Cl WXVL_AN0032SC0381 [0,2,0,0,0,0|1,0,0]=3 1396 B12R1.20 CN(C)C(=O)c1ccc(cn1)F WXVL_AN0032SC0114 [0,2,0,0,0,0|1,0,0]=3 1397 B12R1.20 CN(C)C(=O)c1ccc(cn1)F WXVL_AN0032SC0114 [0,2,0,0,0,0|1,0,0]=3 1398 B12R1.20 CN(C)C(=O)c1ccc(cn1)O WXVL_AN0032SC0130 [0,2,0,0,0,0|1,0,0]=3 1399 B12R1.20 CN(C)C(=O)c1ccc(cn1)O WXVL_AN0032SC0130 [0,2,0,0,0,0|1,0,0]=3 1400 B12R1.20 CN(C)C(=O)c1ccc(nc1)Br WXVL_AN0032SC0352 [0,2,0,0,0,0|1,0,0]=3 1401 B12R1.20 CN(C)C(=O)c1ccc(nc1)Br WXVL_AN0032SC0352 [0,2,0,0,0,0|1,0,0]=3 1402 B12R1.20 CN(C)C(=O)c1ccc(nc1)Cl WXVL_AN0032SC0147 [0,2,0,0,0,0|1,0,0]=3 1403 B12R1.20 CN(C)C(=O)c1ccc(nc1)Cl WXVL_AN0032SC0147 [0,2,0,0,0,0|1,0,0]=3 1404 B12R1.20 CN(C)C(=O)c1ccc(nc1)F WXVL_AN0032SC0370 [0,2,0,0,0,0|1,0,0]=3 1405 B12R1.20 CN(C)C(=O)c1ccc(nc1)F WXVL_AN0032SC0370 [0,2,0,0,0,0|1,0,0]=3 1406 B12R1.20 CN(C)C(=O)c1ccc(nc1)O WXVL_AN0032SC0057 [0,2,0,0,0,0|1,0,0]=3 1407 B12R1.20 CN(C)C(=O)c1ccc(nc1)O WXVL_AN0032SC0057 [0,2,0,0,0,0|1,0,0]=3 1408 B12R1.20 CN(C)C(=O)c1cnc(cn1)Cl WXVL_AN0032SC0383 [0,2,0,0,0,0|2,0,0]=4 1409 B12R1.20 CN(C)C(=O)c1cnc(cn1)Cl WXVL_AN0032SC0383 [0,2,0,0,0,0|2,0,0]=4 1410 B12R1.20 CN(C)C(=O)c1cnc(nc1)Cl WXVL_AN0032SC0148 [0,2,0,0,0,0|2,0,0]=4 1411 B12R1.20 CN(C)C(=O)c1cnc(nc1)Cl WXVL_AN0032SC0148 [0,2,0,0,0,0|2,0,0]=4 1412 B12R1.20 CN(C)C(=O)c1ncc(cn1)Cl WXVL_AN0032SC0029 [0,2,0,0,0,0|2,0,0]=4 1413 B12R1.20 CN(C)C(=O)c1ncc(cn1)Cl WXVL_AN0032SC0029 [0,2,0,0,0,0|2,0,0]=4 1414 B12R1.20 Cc1ccc(cc1)C(=O)C(=O)N WXVL_AK0084SB7750 [0,2,0,0,0,0|2,0,0]=4 1415 B12R1.20 Cc1ccc(cc1)C(=O)C(=O)N WXVL_AK0084SB7750 [0,2,0,0,0,0|2,0,0]=4 1416 B12R1.20 Cc1ccc(cc1)C(=O)N(C)C WXVL_AN0032SD0078 [0,2,0,0,0,0|0,0,0]=2 1417 B12R1.20 Cc1ccc(cc1)C(=O)N(C)C WXVL_AN0032SD0078 [0,2,0,0,0,0|0,0,0]=2 1418 B12R1.20 Cc1ccc(cn1)C(=O)N(C)C WXVL_AN0032SC0060 [0,2,0,0,0,0|1,0,0]=3 1419 B12R1.20 Cc1ccc(cn1)C(=O)N(C)C WXVL_AN0032SC0060 [0,2,0,0,0,0|1,0,0]=3 1420 B12R1.20 Cc1ccc(nc1)C(=O)N(C)C WXVL_AN0032SC0104 [0,2,0,0,0,0|1,0,0]=3 1421 B12R1.20 Cc1ccc(nc1)C(=O)N(C)C WXVL_AN0032SC0104 [0,2,0,0,0,0|1,0,0]=3 1422 B12R1.20 Cc1cnc(cn1)C(=O)N(C)C WXVL_AN0032SC0072 [0,2,0,0,0,0|2,0,0]=4 1423 B12R1.20 Cc1cnc(cn1)C(=O)N(C)C WXVL_AN0032SC0072 [0,2,0,0,0,0|2,0,0]=4 1424 B12R1.20 Cc1ncc(cn1)C(=O)N(C)C WXVL_AN0032SC0032 [0,2,0,0,0,0|2,0,0]=4 1425 B12R1.20 Cc1ncc(cn1)C(=O)N(C)C WXVL_AN0032SC0032 [0,2,0,0,0,0|2,0,0]=4 1426 B12R1.20 NC(=O)C(=O)c1ccc(cc1)Cl WXVL_AK0084SB3791 [0,2,0,0,0,0|2,0,0]=4 1427 B12R1.20 NC(=O)C(=O)c1ccc(cc1)Cl WXVL_AK0084SB3791 [0,2,0,0,0,0|2,0,0]=4 1428 B12R1.367 CNC(=O)c1cc(c(cn1)Br)C WXVL_AK00442SC0194 [0,2,0,0,0,0|1,0,0]=3 1429 B12R1.367 CNC(=O)c1cc(c(cn1)Br)C WXVL_AK00442SC0194 [0,2,0,0,0,0|1,0,0]=3 1430 B12R1.367 CNC(=O)c1cc(c(cn1)C)Br WXVL_AK00442SC1641 [0,2,0,0,0,0|1,0,0]=3 1431 B12R1.367 CNC(=O)c1cc(c(cn1)C)Br WXVL_AK00442SC1641 [0,2,0,0,0,0|1,0,0]=3 1432 B12R1.367 CNC(=O)c1cc(c(cn1)Cl)Cl WXVL_AK00442SC1450 [0,2,0,0,0,0|1,0,0]=3 1433 B12R1.367 CNC(=O)c1cc(c(cn1)Cl)Cl WXVL_AK00442SC1450 [0,2,0,0,0,0|1,0,0]=3 1434 B12R1.367 CNC(=O)c1ccc(c(c1)Br)Br WXVL_AK00442SD1271 [0,2,0,0,0,0|0,0,0]=2 1435 B12R1.367 CNC(=O)c1ccc(c(c1)Br)Br WXVL_AK00442SD1271 [0,2,0,0,0,0|0,0,0]=2 1436 B12R1.367 CNC(=O)c1ccc(c(c1)Br)C WXVL_AK00442SD0042 [0,2,0,0,0,0|0,0,0]=2 1437 B12R1.367 CNC(=O)c1ccc(c(c1)Br)C WXVL_AK00442SD0042 [0,2,0,0,0,0|0,0,0]=2 1438 B12R1.367 CNC(=O)c1ccc(c(c1)Br)Cl WXVL_AK00442SD0496 [0,2,0,0,0,0|0,0,0]=2 1439 B12R1.367 CNC(=O)c1ccc(c(c1)Br)Cl WXVL_AK00442SD0496 [0,2,0,0,0,0|0,0,0]=2 1440 B12R1.367 CNC(=O)c1ccc(c(c1)Br)F WXVL_AK00442SD0435 [0,2,0,0,0,0|0,0,0]=2 1441 B12R1.367 CNC(=O)c1ccc(c(c1)Br)F WXVL_AK00442SD0435 [0,2,0,0,0,0|0,0,0]=2 1442 B12R1.367 CNC(=O)c1ccc(c(c1)Br)I WXVL_AK00442SD0333 [0,2,0,0,0,0|0,0,0]=2 1443 B12R1.367 CNC(=O)c1ccc(c(c1)Br)I WXVL_AK00442SD0333 [0,2,0,0,0,0|0,0,0]=2 1444 B12R1.367 CNC(=O)c1ccc(c(c1)Br)O WXVL_AK00442SD0263 [0,2,0,0,0,0|0,0,0]=2 1445 B12R1.367 CNC(=O)c1ccc(c(c1)Br)O WXVL_AK00442SD0263 [0,2,0,0,0,0|0,0,0]=2 1446 B12R1.367 CNC(=O)c1ccc(c(c1)C)Br WXVL_AK00442SD0103 [0,2,0,0,0,0|0,0,0]=2 1447 B12R1.367 CNC(=O)c1ccc(c(c1)C)Br WXVL_AK00442SD0103 [0,2,0,0,0,0|0,0,0]=2 1448 B12R1.367 CNC(=O)c1ccc(c(c1)C)C WXVL_AK00442SD0057 [0,2,0,0,0,0|0,0,0]=2 1449 B12R1.367 CNC(=O)c1ccc(c(c1)C)C WXVL_AK00442SD0057 [0,2,0,0,0,0|0,0,0]=2 1450 B12R1.367 CNC(=O)c1ccc(c(c1)C)Cl WXVL_AK00442SD0115 [0,2,0,0,0,0|0,0,0]=2 1451 B12R1.367 CNC(=O)c1ccc(c(c1)C)Cl WXVL_AK00442SD0115 [0,2,0,0,0,0|0,0,0]=2 1452 B12R1.367 CNC(=O)c1ccc(c(c1)C)F WXVL_AK00442SD0507 [0,2,0,0,0,0|0,0,0]=2 1453 B12R1.367 CNC(=O)c1ccc(c(c1)C)F WXVL_AK00442SD0507 [0,2,0,0,0,0|0,0,0]=2 1454 B12R1.367 CNC(=O)c1ccc(c(c1)C)I WXVL_AK00442SD0536 [0,2,0,0,0,0|0,0,0]=2 1455 B12R1.367 CNC(=O)c1ccc(c(c1)C)I WXVL_AK00442SD0536 [0,2,0,0,0,0|0,0,0]=2 1456 B12R1.367 CNC(=O)c1ccc(c(c1)C)O WXVL_AK00442SD0489 [0,2,0,0,0,0|0,0,0]=2 1457 B12R1.367 CNC(=O)c1ccc(c(c1)C)O WXVL_AK00442SD0489 [0,2,0,0,0,0|0,0,0]=2 1458 B12R1.367 CNC(=O)c1ccc(c(c1)Cl)Br WXVL_AK00442SD0457 [0,2,0,0,0,0|0,0,0]=2 1459 B12R1.367 CNC(=O)c1ccc(c(c1)Cl)Br WXVL_AK00442SD0457 [0,2,0,0,0,0|0,0,0]=2 1460 B12R1.367 CNC(=O)c1ccc(c(c1)Cl)C WXVL_AK00442SD0113 [0,2,0,0,0,0|0,0,0]=2 1461 B12R1.367 CNC(=O)c1ccc(c(c1)Cl)C WXVL_AK00442SD0113 [0,2,0,0,0,0|0,0,0]=2 1462 B12R1.367 CNC(=O)c1ccc(c(c1)Cl)Cl WXVL_AK00442SD0046 [0,2,0,0,0,0|0,0,0]=2 1463 B12R1.367 CNC(=O)c1ccc(c(c1)Cl)Cl WXVL_AK00442SD0046 [0,2,0,0,0,0|0,0,0]=2 1464 B12R1.367 CNC(=O)c1ccc(c(c1)Cl)F WXVL_AK00442SD0107 [0,2,0,0,0,0|0,0,0]=2 1465 B12R1.367 CNC(=O)c1ccc(c(c1)Cl)F WXVL_AK00442SD0107 [0,2,0,0,0,0|0,0,0]=2 1466 B12R1.367 CNC(=O)c1ccc(c(c1)Cl)I WXVL_AK00442SD1017 [0,2,0,0,0,0|0,0,0]=2 1467 B12R1.367 CNC(=O)c1ccc(c(c1)Cl)I WXVL_AK00442SD1017 [0,2,0,0,0,0|0,0,0]=2 1468 B12R1.367 CNC(=O)c1ccc(c(c1)Cl)O WXVL_AK00442SD0177 [0,2,0,0,0,0|0,0,0]=2 1469 B12R1.367 CNC(=O)c1ccc(c(c1)Cl)O WXVL_AK00442SD0177 [0,2,0,0,0,0|0,0,0]=2 1470 B12R1.367 CNC(=O)c1ccc(c(c1)F)Br WXVL_AK00442SD0440 [0,2,0,0,0,0|0,0,0]=2 1471 B12R1.367 CNC(=O)c1ccc(c(c1)F)Br WXVL_AK00442SD0440 [0,2,0,0,0,0|0,0,0]=2 1472 B12R1.367 CNC(=O)c1ccc(c(c1)F)C WXVL_AK00442SD0044 [0,2,0,0,0,0|0,0,0]=2 1473 B12R1.367 CNC(=O)c1ccc(c(c1)F)C WXVL_AK00442SD0044 [0,2,0,0,0,0|0,0,0]=2 1474 B12R1.367 CNC(=O)c1ccc(c(c1)F)Cl WXVL_AK00442SD0414 [0,2,0,0,0,0|0,0,0]=2 1475 B12R1.367 CNC(=O)c1ccc(c(c1)F)Cl WXVL_AK00442SD0414 [0,2,0,0,0,0|0,0,0]=2 1476 B12R1.367 CNC(=O)c1ccc(c(c1)F)F WXVL_AK00442SD0093 [0,2,0,0,0,0|0,0,0]=2 1477 B12R1.367 CNC(=O)c1ccc(c(c1)F)F WXVL_AK00442SD0093 [0,2,0,0,0,0|0,0,0]=2 1478 B12R1.367 CNC(=O)c1ccc(c(c1)F)I WXVL_AK00442SD0316 [0,2,0,0,0,0|0,0,0]=2 1479 B12R1.367 CNC(=O)c1ccc(c(c1)F)I WXVL_AK00442SD0316 [0,2,0,0,0,0|0,0,0]=2 1480 B12R1.367 CNC(=O)c1ccc(c(c1)F)O WXVL_AK00442SD0481 [0,2,0,0,0,0|0,0,0]=2 1481 B12R1.367 CNC(=O)c1ccc(c(c1)F)O WXVL_AK00442SD0481 [0,2,0,0,0,0|0,0,0]=2 1482 B12R1.367 CNC(=O)c1ccc(c(c1)I)C WXVL_AK00442SD0450 [0,2,0,0,0,0|0,0,0]=2 1483 B12R1.367 CNC(=O)c1ccc(c(c1)I)C WXVL_AK00442SD0450 [0,2,0,0,0,0|0,0,0]=2 1484 B12R1.367 CNC(=O)c1ccc(c(c1)I)Cl WXVL_AK00442SD0532 [0,2,0,0,0,0|0,0,0]=2 1485 B12R1.367 CNC(=O)c1ccc(c(c1)I)Cl WXVL_AK00442SD0532 [0,2,0,0,0,0|0,0,0]=2 1486 B12R1.367 CNC(=O)c1ccc(c(c1)I)F WXVL_AK00442SD0814 [0,2,0,0,0,0|0,0,0]=2 1487 B12R1.367 CNC(=O)c1ccc(c(c1)I)F WXVL_AK00442SD0814 [0,2,0,0,0,0|0,0,0]=2 1488 B12R1.367 CNC(=O)c1ccc(c(c1)I)O WXVL_AK00442SD2189 [0,2,0,0,0,0|0,0,0]=2 1489 B12R1.367 CNC(=O)c1ccc(c(c1)I)O WXVL_AK00442SD2189 [0,2,0,0,0,0|0,0,0]=2 1490 B12R1.367 CNC(=O)c1ccc(c(c1)O)Br WXVL_AK00442SD0565 [0,2,0,0,0,0|0,0,0]=2 1491 B12R1.367 CNC(=O)c1ccc(c(c1)O)Br WXVL_AK00442SD0565 [0,2,0,0,0,0|0,0,0]=2 1492 B12R1.367 CNC(=O)c1ccc(c(c1)O)C WXVL_AK00442SD0404 [0,2,0,0,0,0|0,0,0]=2 1493 B12R1.367 CNC(=O)c1ccc(c(c1)O)C WXVL_AK00442SD0404 [0,2,0,0,0,0|0,0,0]=2 1494 B12R1.367 CNC(=O)c1ccc(c(c1)O)Cl WXVL_AK00442SD0487 [0,2,0,0,0,0|0,0,0]=2 1495 B12R1.367 CNC(=O)c1ccc(c(c1)O)Cl WXVL_AK00442SD0487 [0,2,0,0,0,0|0,0,0]=2 1496 B12R1.367 CNC(=O)c1ccc(c(c1)O)F WXVL_AK00442SD0505 [0,2,0,0,0,0|0,0,0]=2 1497 B12R1.367 CNC(=O)c1ccc(c(c1)O)F WXVL_AK00442SD0505 [0,2,0,0,0,0|0,0,0]=2 1498 B12R1.367 CNC(=O)c1ccc(c(c1)O)I WXVL_AK00442SD0354 [0,2,0,0,0,0|0,0,0]=2 1499 B12R1.367 CNC(=O)c1ccc(c(c1)O)I WXVL_AK00442SD0354 [0,2,0,0,0,0|0,0,0]=2 1500 B12R1.367 CNC(=O)c1ccc(c(c1)O)O WXVL_AK00442SD0979 [0,2,0,0,0,0|0,0,0]=2 1501 B12R1.367 CNC(=O)c1ccc(c(c1)O)O WXVL_AK00442SD0979 [0,2,0,0,0,0|0,0,0]=2 1502 B12R1.367 CNC(=O)c1ccc(c(n1)C)Br WXVL_AK00442SC1002 [0,2,0,0,0,0|1,0,0]=3 1503 B12R1.367 CNC(=O)c1ccc(c(n1)C)Br WXVL_AK00442SC1002 [0,2,0,0,0,0|1,0,0]=3 1504 B12R1.367 CNC(=O)c1ccc(c(n1)C)C WXVL_AK00442SC2108 [0,2,0,0,0,0|1,0,0]=3 1505 B12R1.367 CNC(=O)c1ccc(c(n1)C)C WXVL_AK00442SC2108 [0,2,0,0,0,0|1,0,0]=3 1506 B12R1.367 CNC(=O)c1ccc(c(n1)C)F WXVL_AK00442SC1215 [0,2,0,0,0,0|1,0,0]=3 1507 B12R1.367 CNC(=O)c1ccc(c(n1)C)F WXVL_AK00442SC1215 [0,2,0,0,0,0|1,0,0]=3 1508 B12R1.367 CNC(=O)c1ccc(c(n1)Cl)Br WXVL_AK00442SC0811 [0,2,0,0,0,0|1,0,0]=3 1509 B12R1.367 CNC(=O)c1ccc(c(n1)Cl)Br WXVL_AK00442SC0811 [0,2,0,0,0,0|1,0,0]=3 1510 B12R1.367 CNC(=O)c1ccc(c(n1)Cl)Cl WXVL_AK00442SC0806 [0,2,0,0,0,0|1,0,0]=3 1511 B12R1.367 CNC(=O)c1ccc(c(n1)Cl)Cl WXVL_AK00442SC0806 [0,2,0,0,0,0|1,0,0]=3 1512 B12R1.367 CNC(=O)c1cnc(c(c1)Br)Cl WXVL_AK00442SC0390 [0,2,0,0,0,0|1,0,0]=3 1513 B12R1.367 CNC(=O)c1cnc(c(c1)Br)Cl WXVL_AK00442SC0390 [0,2,0,0,0,0|1,0,0]=3 1514 B12R1.367 CNC(=O)c1cnc(c(c1)Br)O WXVL_AK00442SC0626 [0,2,0,0,0,0|1,0,0]=3 1515 B12R1.367 CNC(=O)c1cnc(c(c1)Br)O WXVL_AK00442SC0626 [0,2,0,0,0,0|1,0,0]=3 1516 B12R1.367 CNC(=O)c1cnc(c(c1)C)C WXVL_AK00442SC1055 [0,2,0,0,0,0|1,0,0]=3 1517 B12R1.367 CNC(=O)c1cnc(c(c1)C)C WXVL_AK00442SC1055 [0,2,0,0,0,0|1,0,0]=3 1518 B12R1.367 CNC(=O)c1cnc(c(c1)C)Cl WXVL_AK00442SC0962 [0,2,0,0,0,0|1,0,0]=3 1519 B12R1.367 CNC(=O)c1cnc(c(c1)C)Cl WXVL_AK00442SC0962 [0,2,0,0,0,0|1,0,0]=3 1520 B12R1.367 CNC(=O)c1cnc(c(c1)C)F WXVL_AK00442SC1078 [0,2,0,0,0,0|1,0,0]=3 1521 B12R1.367 CNC(=O)c1cnc(c(c1)C)F WXVL_AK00442SC1078 [0,2,0,0,0,0|1,0,0]=3 1522 B12R1.367 CNC(=O)c1cnc(c(c1)Cl)Cl WXVL_AK00442SC0389 [0,2,0,0,0,0|1,0,0]=3 1523 B12R1.367 CNC(=O)c1cnc(c(c1)Cl)Cl WXVL_AK00442SC0389 [0,2,0,0,0,0|1,0,0]=3 1524 B12R1.367 CNC(=O)c1cnc(c(c1)Cl)O WXVL_AK00442SC0424 [0,2,0,0,0,0|1,0,0]=3 1525 B12R1.367 CNC(=O)c1cnc(c(c1)Cl)O WXVL_AK00442SC0424 [0,2,0,0,0,0|1,0,0]=3 1526 B12R1.367 CNC(=O)c1cnc(c(c1)F)Cl WXVL_AK00442SC0952 [0,2,0,0,0,0|1,0,0]=3 1527 B12R1.367 CNC(=O)c1cnc(c(c1)F)Cl WXVL_AK00442SC0952 [0,2,0,0,0,0|1,0,0]=3 1528 B12R1.367 CNC(=O)c1cnc(c(c1)I)Cl WXVL_AK00442SC0650 [0,2,0,0,0,0|1,0,0]=3 1529 B12R1.367 CNC(=O)c1cnc(c(c1)I)Cl WXVL_AK00442SC0650 [0,2,0,0,0,0|1,0,0]=3 1530 B12R1.1703 CNC(=O)c1ccc([nH]c1=O)C WXVL_AK00442SC2217 [0,2,0,0,0,0|1,0,0]=3 1531 B12R1.1703 CNC(=O)c1ccc([nH]c1=O)C WXVL_AK00442SC2217 [0,2,0,0,0,0|1,0,0]=3 1532 B12R1.1703 CNC(=O)c1ccc(cc1Br)Br WXVL_AK00442SD0488 [0,2,0,0,0,0|0,0,0]=2 1533 B12R1.1703 CNC(=O)c1ccc(cc1Br)Br WXVL_AK00442SD0488 [0,2,0,0,0,0|0,0,0]=2 1534 B12R1.1703 CNC(=O)c1ccc(cc1Br)C WXVL_AK00442SD1112 [0,2,0,0,0,0|0,0,0]=2 1535 B12R1.1703 CNC(=O)c1ccc(cc1Br)C WXVL_AK00442SD1112 [0,2,0,0,0,0|0,0,0]=2 1536 B12R1.1703 CNC(=O)c1ccc(cc1Br)Cl WXVL_AK00442SD0436 [0,2,0,0,0,0|0,0,0]=2 1537 B12R1.1703 CNC(=O)c1ccc(cc1Br)Cl WXVL_AK00442SD0436 [0,2,0,0,0,0|0,0,0]=2 1538 B12R1.1703 CNC(=O)c1ccc(cc1Br)F WXVL_AK00442SD0119 [0,2,0,0,0,0|0,0,0]=2 1539 B12R1.1703 CNC(=O)c1ccc(cc1Br)F WXVL_AK00442SD0119 [0,2,0,0,0,0|0,0,0]=2 1540 B12R1.1703 CNC(=O)c1ccc(cc1Br)I WXVL_AK00442SD1097 [0,2,0,0,0,0|0,0,0]=2 1541 B12R1.1703 CNC(=O)c1ccc(cc1Br)I WXVL_AK00442SD1097 [0,2,0,0,0,0|0,0,0]=2 1542 B12R1.1703 CNC(=O)c1ccc(cc1Br)O WXVL_AK00442SD1328 [0,2,0,0,0,0|0,0,0]=2 1543 B12R1.1703 CNC(=O)c1ccc(cc1Br)O WXVL_AK00442SD1328 [0,2,0,0,0,0|0,0,0]=2 1544 B12R1.1703 CNC(=O)c1ccc(cc1C)Br WXVL_AK00442SD0441 [0,2,0,0,0,0|0,0,0]=2 1545 B12R1.1703 CNC(=O)c1ccc(cc1C)Br WXVL_AK00442SD0441 [0,2,0,0,0,0|0,0,0]=2 1546 B12R1.1703 CNC(=O)c1ccc(cc1C)C WXVL_AK00442SD0038 [0,2,0,0,0,0|0,0,0]=2 1547 B12R1.1703 CNC(=O)c1ccc(cc1C)C WXVL_AK00442SD0038 [0,2,0,0,0,0|0,0,0]=2 1548 B12R1.1703 CNC(=O)c1ccc(cc1C)Cl WXVL_AK00442SD0114 [0,2,0,0,0,0|0,0,0]=2 1549 B12R1.1703 CNC(=O)c1ccc(cc1C)Cl WXVL_AK00442SD0114 [0,2,0,0,0,0|0,0,0]=2 1550 B12R1.1703 CNC(=O)c1ccc(cc1C)F WXVL_AK00442SD0338 [0,2,0,0,0,0|0,0,0]=2 1551 B12R1.1703 CNC(=O)c1ccc(cc1C)F WXVL_AK00442SD0338 [0,2,0,0,0,0|0,0,0]=2 1552 B12R1.1703 CNC(=O)c1ccc(cc1C)I WXVL_AK00442SD1541 [0,2,0,0,0,0|0,0,0]=2 1553 B12R1.1703 CNC(=O)c1ccc(cc1C)I WXVL_AK00442SD1541 [0,2,0,0,0,0|0,0,0]=2 1554 B12R1.1703 CNC(=O)c1ccc(cc1C)O WXVL_AK00442SD0475 [0,2,0,0,0,0|0,0,0]=2 1555 B12R1.1703 CNC(=O)c1ccc(cc1C)O WXVL_AK00442SD0475 [0,2,0,0,0,0|0,0,0]=2 1556 B12R1.1703 CNC(=O)c1ccc(cc1Cl)Br WXVL_AK00442SD0104 [0,2,0,0,0,0|0,0,0]=2 1557 B12R1.1703 CNC(=O)c1ccc(cc1Cl)Br WXVL_AK00442SD0104 [0,2,0,0,0,0|0,0,0]=2 1558 B12R1.1703 CNC(=O)c1ccc(cc1Cl)C WXVL_AK00442SD0171 [0,2,0,0,0,0|0,0,0]=2 1559 B12R1.1703 CNC(=O)c1ccc(cc1Cl)C WXVL_AK00442SD0171 [0,2,0,0,0,0|0,0,0]=2 1560 B12R1.1703 CNC(=O)c1ccc(cc1Cl)Cl WXVL_AK00442SD0008 [0,2,0,0,0,0|0,0,0]=2 1561 B12R1.1703 CNC(=O)c1ccc(cc1Cl)Cl WXVL_AK00442SD0008 [0,2,0,0,0,0|0,0,0]=2 1562 B12R1.1703 CNC(=O)c1ccc(cc1Cl)F WXVL_AK00442SD0091 [0,2,0,0,0,0|0,0,0]=2 1563 B12R1.1703 CNC(=O)c1ccc(cc1Cl)F WXVL_AK00442SD0091 [0,2,0,0,0,0|0,0,0]=2 1564 B12R1.1703 CNC(=O)c1ccc(cc1Cl)I WXVL_AK00442SD0324 [0,2,0,0,0,0|0,0,0]=2 1565 B12R1.1703 CNC(=O)c1ccc(cc1Cl)I WXVL_AK00442SD0324 [0,2,0,0,0,0|0,0,0]=2 1566 B12R1.1703 CNC(=O)c1ccc(cc1Cl)O WXVL_AK00442SD0179 [0,2,0,0,0,0|0,0,0]=2 1567 B12R1.1703 CNC(=O)c1ccc(cc1Cl)O WXVL_AK00442SD0179 [0,2,0,0,0,0|0,0,0]=2 1568 B12R1.1703 CNC(=O)c1ccc(cc1F)Br WXVL_AK00442SD0127 [0,2,0,0,0,0|0,0,0]=2 1569 B12R1.1703 CNC(=O)c1ccc(cc1F)Br WXVL_AK00442SD0127 [0,2,0,0,0,0|0,0,0]=2 1570 B12R1.1703 CNC(=O)c1ccc(cc1F)C WXVL_AK00442SD0394 [0,2,0,0,0,0|0,0,0]=2 1571 B12R1.1703 CNC(=O)c1ccc(cc1F)C WXVL_AK00442SD0394 [0,2,0,0,0,0|0,0,0]=2 1572 B12R1.1703 CNC(=O)c1ccc(cc1F)Cl WXVL_AK00442SD0106 [0,2,0,0,0,0|0,0,0]=2 1573 B12R1.1703 CNC(=O)c1ccc(cc1F)Cl WXVL_AK00442SD0106 [0,2,0,0,0,0|0,0,0]=2 1574 B12R1.1703 CNC(=O)c1ccc(cc1F)F WXVL_AK00442SD0092 [0,2,0,0,0,0|0,0,0]=2 1575 B12R1.1703 CNC(=O)c1ccc(cc1F)F WXVL_AK00442SD0092 [0,2,0,0,0,0|0,0,0]=2 1576 B12R1.1703 CNC(=O)c1ccc(cc1F)I WXVL_AK00442SD0313 [0,2,0,0,0,0|0,0,0]=2 1577 B12R1.1703 CNC(=O)c1ccc(cc1F)I WXVL_AK00442SD0313 [0,2,0,0,0,0|0,0,0]=2 1578 B12R1.1703 CNC(=O)c1ccc(cc1F)O WXVL_AK00442SD0499 [0,2,0,0,0,0|0,0,0]=2 1579 B12R1.1703 CNC(=O)c1ccc(cc1F)O WXVL_AK00442SD0499 [0,2,0,0,0,0|0,0,0]=2 1580 B12R1.1703 CNC(=O)c1ccc(cc1I)Br WXVL_AK00442SD1410 [0,2,0,0,0,0|0,0,0]=2 1581 B12R1.1703 CNC(=O)c1ccc(cc1I)Br WXVL_AK00442SD1410 [0,2,0,0,0,0|0,0,0]=2 1582 B12R1.1703 CNC(=O)c1ccc(cc1I)C WXVL_AK00442SD1846 [0,2,0,0,0,0|0,0,0]=2 1583 B12R1.1703 CNC(=O)c1ccc(cc1I)C WXVL_AK00442SD1846 [0,2,0,0,0,0|0,0,0]=2 1584 B12R1.1703 CNC(=O)c1ccc(cc1I)Cl WXVL_AK00442SD0323 [0,2,0,0,0,0|0,0,0]=2 1585 B12R1.1703 CNC(=O)c1ccc(cc1I)Cl WXVL_AK00442SD0323 [0,2,0,0,0,0|0,0,0]=2 1586 B12R1.1703 CNC(=O)c1ccc(cc1I)F WXVL_AK00442SD0315 [0,2,0,0,0,0|0,0,0]=2 1587 B12R1.1703 CNC(=O)c1ccc(cc1I)F WXVL_AK00442SD0315 [0,2,0,0,0,0|0,0,0]=2 1588 B12R1.1703 CNC(=O)c1ccc(cc1O)Br WXVL_AK00442SD0411 [0,2,0,0,0,0|0,0,0]=2 1589 B12R1.1703 CNC(=O)c1ccc(cc1O)Br WXVL_AK00442SD0411 [0,2,0,0,0,0|0,0,0]=2 1590 B12R1.1703 CNC(=O)c1ccc(cc1O)C WXVL_AK00442SD0148 [0,2,0,0,0,0|0,0,0]=2 1591 B12R1.1703 CNC(=O)c1ccc(cc1O)C WXVL_AK00442SD0148 [0,2,0,0,0,0|0,0,0]=2 1592 B12R1.1703 CNC(=O)c1ccc(cc1O)Cl WXVL_AK00442SD0550 [0,2,0,0,0,0|0,0,0]=2 1593 B12R1.1703 CNC(=O)c1ccc(cc1O)Cl WXVL_AK00442SD0550 [0,2,0,0,0,0|0,0,0]=2 1594 B12R1.1703 CNC(=O)c1ccc(cc1O)F WXVL_AK00442SD0561 [0,2,0,0,0,0|0,0,0]=2 1595 B12R1.1703 CNC(=O)c1ccc(cc1O)F WXVL_AK00442SD0561 [0,2,0,0,0,0|0,0,0]=2 1596 B12R1.1703 CNC(=O)c1ccc(cc1O)I WXVL_AK00442SD0717 [0,2,0,0,0,0|0,0,0]=2 1597 B12R1.1703 CNC(=O)c1ccc(cc1O)I WXVL_AK00442SD0717 [0,2,0,0,0,0|0,0,0]=2 1598 B12R1.1703 CNC(=O)c1ccc(cc1O)O WXVL_AK00442SD0149 [0,2,0,0,0,0|0,0,0]=2 1599 B12R1.1703 CNC(=O)c1ccc(cc1O)O WXVL_AK00442SD0149 [0,2,0,0,0,0|0,0,0]=2 1600 B12R1.1703 CNC(=O)c1ccc(nc1Br)Br WXVL_AK00442SC0673 [0,2,0,0,0,0|1,0,0]=3 1601 B12R1.1703 CNC(=O)c1ccc(nc1Br)Br WXVL_AK00442SC0673 [0,2,0,0,0,0|1,0,0]=3 1602 B12R1.1703 CNC(=O)c1ccc(nc1C)Br WXVL_AK00442SC0965 [0,2,0,0,0,0|1,0,0]=3 1603 B12R1.1703 CNC(=O)c1ccc(nc1C)Br WXVL_AK00442SC0965 [0,2,0,0,0,0|1,0,0]=3 1604 B12R1.1703 CNC(=O)c1ccc(nc1C)C WXVL_AK00442SC0897 [0,2,0,0,0,0|1,0,0]=3 1605 B12R1.1703 CNC(=O)c1ccc(nc1C)C WXVL_AK00442SC0897 [0,2,0,0,0,0|1,0,0]=3 1606 B12R1.1703 CNC(=O)c1ccc(nc1C)Cl WXVL_AK00442SC0240 [0,2,0,0,0,0|1,0,0]=3 1607 B12R1.1703 CNC(=O)c1ccc(nc1C)Cl WXVL_AK00442SC0240 [0,2,0,0,0,0|1,0,0]=3 1608 B12R1.1703 CNC(=O)c1ccc(nc1C)F WXVL_AK00442SC0792 [0,2,0,0,0,0|1,0,0]=3 1609 B12R1.1703 CNC(=O)c1ccc(nc1C)F WXVL_AK00442SC0792 [0,2,0,0,0,0|1,0,0]=3 1610 B12R1.1703 CNC(=O)c1ccc(nc1Cl)Cl WXVL_AK00442SC0357 [0,2,0,0,0,0|1,0,0]=3 1611 B12R1.1703 CNC(=O)c1ccc(nc1Cl)Cl WXVL_AK00442SC0357 [0,2,0,0,0,0|1,0,0]=3 1612 B12R1.1703 CNC(=O)c1ccc(nc1Cl)O WXVL_AK00442SC0689 [0,2,0,0,0,0|1,0,0]=3 1613 B12R1.1703 CNC(=O)c1ccc(nc1Cl)O WXVL_AK00442SC0689 [0,2,0,0,0,0|1,0,0]=3 1614 B12R1.1703 CNC(=O)c1ccc(nc1F)Br WXVL_AK00442SC1029 [0,2,0,0,0,0|1,0,0]=3 1615 B12R1.1703 CNC(=O)c1ccc(nc1F)Br WXVL_AK00442SC1029 [0,2,0,0,0,0|1,0,0]=3 1616 B12R1.1703 CNC(=O)c1ccc(nc1F)Cl WXVL_AK00442SC1033 [0,2,0,0,0,0|1,0,0]=3 1617 B12R1.1703 CNC(=O)c1ccc(nc1F)Cl WXVL_AK00442SC1033 [0,2,0,0,0,0|1,0,0]=3 1618 B12R1.1703 CNC(=O)c1ccc(nc1F)F WXVL_AK00442SC0149 [0,2,0,0,0,0|1,0,0]=3 1619 B12R1.1703 CNC(=O)c1ccc(nc1F)F WXVL_AK00442SC0149 [0,2,0,0,0,0|1,0,0]=3 1620 B12R1.1703 CNC(=O)c1cnc(cc1C)Cl WXVL_AK00442SC0997 [0,2,0,0,0,0|1,0,0]=3 1621 B12R1.1703 CNC(=O)c1cnc(cc1C)Cl WXVL_AK00442SC0997 [0,2,0,0,0,0|1,0,0]=3 1622 B12R1.1703 CNC(=O)c1cnc(cc1C)F WXVL_AK00442SC1066 [0,2,0,0,0,0|1,0,0]=3 1623 B12R1.1703 CNC(=O)c1cnc(cc1C)F WXVL_AK00442SC1066 [0,2,0,0,0,0|1,0,0]=3 1624 B12R1.1703 CNC(=O)c1cnc(cc1Cl)Cl WXVL_AK00442SC0010 [0,2,0,0,0,0|1,0,0]=3 1625 B12R1.1703 CNC(=O)c1cnc(cc1Cl)Cl WXVL_AK00442SC0010 [0,2,0,0,0,0|1,0,0]=3 1626 B12R1.1703 CNC(=O)c1cnc(cc1I)Cl WXVL_AK00442SC2048 [0,2,0,0,0,0|1,0,0]=3 1627 B12R1.1703 CNC(=O)c1cnc(cc1I)Cl WXVL_AK00442SC2048 [0,2,0,0,0,0|1,0,0]=3 1628 B12R1.1703 CNC(=O)c1cnc(cc1O)O WXVL_AK00442SC0656 [0,2,0,0,0,0|1,0,0]=3 1629 B12R1.1703 CNC(=O)c1cnc(cc1O)O WXVL_AK00442SC0656 [0,2,0,0,0,0|1,0,0]=3 1630 B12R1.1703 CNC(=O)c1cnc(nc1C)C WXVL_AK00442SC0028 [0,2,0,0,0,0|2,0,0]=4 1631 B12R1.1703 CNC(=O)c1cnc(nc1C)C WXVL_AK00442SC0028 [0,2,0,0,0,0|2,0,0]=4 1632 B12R1.1703 CNC(=O)c1cnc(nc1O)O WXVL_AK00442SC0142 [0,2,0,0,0,0|2,0,0]=4 1633 B12R1.1703 CNC(=O)c1cnc(nc1O)O WXVL_AK00442SC0142 [0,2,0,0,0,0|2,0,0]=4 1634 B12R1.1703 CNC(=O)c1ncc(cc1Br)Cl WXVL_AK00442SC0384 [0,2,0,0,0,0|1,0,0]=3 1635 B12R1.1703 CNC(=O)c1ncc(cc1Br)Cl WXVL_AK00442SC0384 [0,2,0,0,0,0|1,0,0]=3 1636 B12R1.1703 CNC(=O)c1ncc(cc1C)Br WXVL_AK00442SC0123 [0,2,0,0,0,0|1,0,0]=3 1637 B12R1.1703 CNC(=O)c1ncc(cc1C)Br WXVL_AK00442SC0123 [0,2,0,0,0,0|1,0,0]=3 1638 B12R1.1703 CNC(=O)c1ncc(cc1C)Cl WXVL_AK00442SC0157 [0,2,0,0,0,0|1,0,0]=3 1639 B12R1.1703 CNC(=O)c1ncc(cc1C)Cl WXVL_AK00442SC0157 [0,2,0,0,0,0|1,0,0]=3 1640 B12R1.1703 CNC(=O)c1ncc(cc1Cl)Br WXVL_AK00442SC0603 [0,2,0,0,0,0|1,0,0]=3 1641 B12R1.1703 CNC(=O)c1ncc(cc1Cl)Br WXVL_AK00442SC0603 [0,2,0,0,0,0|1,0,0]=3 1642 B12R1.1703 CNC(=O)c1ncc(cc1Cl)Cl WXVL_AK00442SC0175 [0,2,0,0,0,0|1,0,0]=3 1643 B12R1.1703 CNC(=O)c1ncc(cc1Cl)Cl WXVL_AK00442SC0175 [0,2,0,0,0,0|1,0,0]=3 1644 B12R1.1703 CNC(=O)c1ncc(cc1F)Br WXVL_AK00442SC0593 [0,2,0,0,0,0|1,0,0]=3 1645 B12R1.1703 CNC(=O)c1ncc(cc1F)Br WXVL_AK00442SC0593 [0,2,0,0,0,0|1,0,0]=3 1646 B12R1.1703 CNC(=O)c1ncc(cc1F)F WXVL_AK00442SC0020 [0,2,0,0,0,0|1,0,0]=3 1647 B12R1.1703 CNC(=O)c1ncc(cc1F)F WXVL_AK00442SC0020 [0,2,0,0,0,0|1,0,0]=3 1648 B12R1.24 CNC(=O)c1cccc(=O)n1C WXVL_AK00442SC0041 [0,2,0,0,0,0|1,0,0]=3 1649 B12R1.24 CNC(=O)c1cccc(=O)n1C WXVL_AK00442SC0041 [0,2,0,0,0,0|1,0,0]=3 1650 B12R1.24 CNC(=O)c1cccc(=O)n1O WXVL_AK00442SC1224 [0,2,0,0,0,0|1,0,0]=3 1651 B12R1.24 CNC(=O)c1cccc(=O)n1O WXVL_AK00442SC1224 [0,2,0,0,0,0|1,0,0]=3 1652 B12R1.24 CNC(=O)c1cccc(c1Br)Br WXVL_AK00442SD1269 [0,2,0,0,0,0|0,0,0]=2 1653 B12R1.24 CNC(=O)c1cccc(c1Br)Br WXVL_AK00442SD1269 [0,2,0,0,0,0|0,0,0]=2 1654 B12R1.24 CNC(=O)c1cccc(c1Br)C WXVL_AK00442SD0617 [0,2,0,0,0,0|0,0,0]=2 1655 B12R1.24 CNC(=O)c1cccc(c1Br)C WXVL_AK00442SD0617 [0,2,0,0,0,0|0,0,0]=2 1656 B12R1.24 CNC(=O)c1cccc(c1Br)Cl WXVL_AK00442SD0290 [0,2,0,0,0,0|0,0,0]=2 1657 B12R1.24 CNC(=O)c1cccc(c1Br)Cl WXVL_AK00442SD0290 [0,2,0,0,0,0|0,0,0]=2 1658 B12R1.24 CNC(=O)c1cccc(c1Br)F WXVL_AK00442SD1450 [0,2,0,0,0,0|0,0,0]=2 1659 B12R1.24 CNC(=O)c1cccc(c1Br)F WXVL_AK00442SD1450 [0,2,0,0,0,0|0,0,0]=2 1660 B12R1.24 CNC(=O)c1cccc(c1C)Br WXVL_AK00442SD0415 [0,2,0,0,0,0|0,0,0]=2 1661 B12R1.24 CNC(=O)c1cccc(c1C)Br WXVL_AK00442SD0415 [0,2,0,0,0,0|0,0,0]=2 1662 B12R1.24 CNC(=O)c1cccc(c1C)C WXVL_AK00442SD0552 [0,2,0,0,0,0|0,0,0]=2 1663 B12R1.24 CNC(=O)c1cccc(c1C)C WXVL_AK00442SD0552 [0,2,0,0,0,0|0,0,0]=2 1664 B12R1.24 CNC(=O)c1cccc(c1C)Cl WXVL_AK00442SD0117 [0,2,0,0,0,0|0,0,0]=2 1665 B12R1.24 CNC(=O)c1cccc(c1C)Cl WXVL_AK00442SD0117 [0,2,0,0,0,0|0,0,0]=2 1666 B12R1.24 CNC(=O)c1cccc(c1C)F WXVL_AK00442SD0123 [0,2,0,0,0,0|0,0,0]=2 1667 B12R1.24 CNC(=O)c1cccc(c1C)F WXVL_AK00442SD0123 [0,2,0,0,0,0|0,0,0]=2 1668 B12R1.24 CNC(=O)c1cccc(c1C)I WXVL_AK00442SD0312 [0,2,0,0,0,0|0,0,0]=2 1669 B12R1.24 CNC(=O)c1cccc(c1C)I WXVL_AK00442SD0312 [0,2,0,0,0,0|0,0,0]=2 1670 B12R1.24 CNC(=O)c1cccc(c1C)O WXVL_AK00442SD0711 [0,2,0,0,0,0|0,0,0]=2 1671 B12R1.24 CNC(=O)c1cccc(c1C)O WXVL_AK00442SD0711 [0,2,0,0,0,0|0,0,0]=2 1672 B12R1.24 CNC(=O)c1cccc(c1Cl)Br WXVL_AK00442SD0291 [0,2,0,0,0,0|0,0,0]=2 1673 B12R1.24 CNC(=O)c1cccc(c1Cl)Br WXVL_AK00442SD0291 [0,2,0,0,0,0|0,0,0]=2 1674 B12R1.24 CNC(=O)c1cccc(c1Cl)C WXVL_AK00442SD0170 [0,2,0,0,0,0|0,0,0]=2 1675 B12R1.24 CNC(=O)c1cccc(c1Cl)C WXVL_AK00442SD0170 [0,2,0,0,0,0|0,0,0]=2 1676 B12R1.24 CNC(=O)c1cccc(c1Cl)Cl WXVL_AK00442SD0007 [0,2,0,0,0,0|0,0,0]=2 1677 B12R1.24 CNC(=O)c1cccc(c1Cl)Cl WXVL_AK00442SD0007 [0,2,0,0,0,0|0,0,0]=2 1678 B12R1.24 CNC(=O)c1cccc(c1Cl)F WXVL_AK00442SD0533 [0,2,0,0,0,0|0,0,0]=2 1679 B12R1.24 CNC(=O)c1cccc(c1Cl)F WXVL_AK00442SD0533 [0,2,0,0,0,0|0,0,0]=2 1680 B12R1.24 CNC(=O)c1cccc(c1Cl)I WXVL_AK00442SD2528 [0,2,0,0,0,0|0,0,0]=2 1681 B12R1.24 CNC(=O)c1cccc(c1Cl)I WXVL_AK00442SD2528 [0,2,0,0,0,0|0,0,0]=2 1682 B12R1.24 CNC(=O)c1cccc(c1Cl)O WXVL_AK00442SD1045 [0,2,0,0,0,0|0,0,0]=2 1683 B12R1.24 CNC(=O)c1cccc(c1Cl)O WXVL_AK00442SD1045 [0,2,0,0,0,0|0,0,0]=2 1684 B12R1.24 CNC(=O)c1cccc(c1F)Br WXVL_AK00442SD0434 [0,2,0,0,0,0|0,0,0]=2 1685 B12R1.24 CNC(=O)c1cccc(c1F)Br WXVL_AK00442SD0434 [0,2,0,0,0,0|0,0,0]=2 1686 B12R1.24 CNC(=O)c1cccc(c1F)C WXVL_AK00442SD0108 [0,2,0,0,0,0|0,0,0]=2 1687 B12R1.24 CNC(=O)c1cccc(c1F)C WXVL_AK00442SD0108 [0,2,0,0,0,0|0,0,0]=2 1688 B12R1.24 CNC(=O)c1cccc(c1F)Cl WXVL_AK00442SD0498 [0,2,0,0,0,0|0,0,0]=2 1689 B12R1.24 CNC(=O)c1cccc(c1F)Cl WXVL_AK00442SD0498 [0,2,0,0,0,0|0,0,0]=2 1690 B12R1.24 CNC(=O)c1cccc(c1F)F WXVL_AK00442SD0089 [0,2,0,0,0,0|0,0,0]=2 1691 B12R1.24 CNC(=O)c1cccc(c1F)F WXVL_AK00442SD0089 [0,2,0,0,0,0|0,0,0]=2 1692 B12R1.24 CNC(=O)c1cccc(c1F)I WXVL_AK00442SD0783 [0,2,0,0,0,0|0,0,0]=2 1693 B12R1.24 CNC(=O)c1cccc(c1F)I WXVL_AK00442SD0783 [0,2,0,0,0,0|0,0,0]=2 1694 B12R1.24 CNC(=O)c1cccc(c1F)O WXVL_AK00442SD0583 [0,2,0,0,0,0|0,0,0]=2 1695 B12R1.24 CNC(=O)c1cccc(c1F)O WXVL_AK00442SD0583 [0,2,0,0,0,0|0,0,0]=2 1696 B12R1.24 CNC(=O)c1cccc(c1I)C WXVL_AK00442SD0540 [0,2,0,0,0,0|0,0,0]=2 1697 B12R1.24 CNC(=O)c1cccc(c1I)C WXVL_AK00442SD0540 [0,2,0,0,0,0|0,0,0]=2 1698 B12R1.24 CNC(=O)c1cccc(c1I)Cl WXVL_AK00442SD1616 [0,2,0,0,0,0|0,0,0]=2 1699 B12R1.24 CNC(=O)c1cccc(c1I)Cl WXVL_AK00442SD1616 [0,2,0,0,0,0|0,0,0]=2 1700 B12R1.24 CNC(=O)c1cccc(c1I)F WXVL_AK00442SD0816 [0,2,0,0,0,0|0,0,0]=2 1701 B12R1.24 CNC(=O)c1cccc(c1I)F WXVL_AK00442SD0816 [0,2,0,0,0,0|0,0,0]=2 1702 B12R1.24 CNC(=O)c1cccc(c1O)Br WXVL_AK00442SD0745 [0,2,0,0,0,0|0,0,0]=2 1703 B12R1.24 CNC(=O)c1cccc(c1O)Br WXVL_AK00442SD0745 [0,2,0,0,0,0|0,0,0]=2 1704 B12R1.24 CNC(=O)c1cccc(c1O)C WXVL_AK00442SD1710 [0,2,0,0,0,0|0,0,0]=2 1705 B12R1.24 CNC(=O)c1cccc(c1O)C WXVL_AK00442SD1710 [0,2,0,0,0,0|0,0,0]=2 1706 B12R1.24 CNC(=O)c1cccc(c1O)Cl WXVL_AK00442SD0178 [0,2,0,0,0,0|0,0,0]=2 1707 B12R1.24 CNC(=O)c1cccc(c1O)Cl WXVL_AK00442SD0178 [0,2,0,0,0,0|0,0,0]=2 1708 B12R1.24 CNC(=O)c1cccc(c1O)F WXVL_AK00442SD0514 [0,2,0,0,0,0|0,0,0]=2 1709 B12R1.24 CNC(=O)c1cccc(c1O)F WXVL_AK00442SD0514 [0,2,0,0,0,0|0,0,0]=2 1710 B12R1.24 CNC(=O)c1cccc(c1O)O WXVL_AK00442SD0025 [0,2,0,0,0,0|0,0,0]=2 1711 B12R1.24 CNC(=O)c1cccc(c1O)O WXVL_AK00442SD0025 [0,2,0,0,0,0|0,0,0]=2 1712 B12R1.24 CNC(=O)c1cccn(c1=O)C WXVL_AK00442SC0012 [0,2,0,0,0,0|1,0,0]=3 1713 B12R1.24 CNC(=O)c1cccn(c1=O)C WXVL_AK00442SC0012 [0,2,0,0,0,0|1,0,0]=3 1714 B12R1.24 CNC(=O)c1ccnc(c1C)Cl WXVL_AK00442SC1331 [0,2,0,0,0,0|1,0,0]=3 1715 B12R1.24 CNC(=O)c1ccnc(c1C)Cl WXVL_AK00442SC1331 [0,2,0,0,0,0|1,0,0]=3 1716 B12R1.24 CNC(=O)c1ccnc(c1Cl)Br WXVL_AK00442SC0670 [0,2,0,0,0,0|1,0,0]=3 1717 B12R1.24 CNC(=O)c1ccnc(c1Cl)Br WXVL_AK00442SC0670 [0,2,0,0,0,0|1,0,0]=3 1718 B12R1.24 CNC(=O)c1ccnc(c1Cl)Cl WXVL_AK00442SC0174 [0,2,0,0,0,0|1,0,0]=3 1719 B12R1.24 CNC(=O)c1ccnc(c1Cl)Cl WXVL_AK00442SC0174 [0,2,0,0,0,0|1,0,0]=3 1720 B12R1.24 CNC(=O)c1ccnc(c1Cl)F WXVL_AK00442SC4099 [0,2,0,0,0,0|1,0,0]=3 1721 B12R1.24 CNC(=O)c1ccnc(c1Cl)F WXVL_AK00442SC4099 [0,2,0,0,0,0|1,0,0]=3 1722 B12R1.24 CNC(=O)c1ccnc(c1F)Br WXVL_AK00442SC0199 [0,2,0,0,0,0|1,0,0]=3 1723 B12R1.24 CNC(=O)c1ccnc(c1F)Br WXVL_AK00442SC0199 [0,2,0,0,0,0|1,0,0]=3 1724 B12R1.24 CNC(=O)c1ccnc(c1F)Cl WXVL_AK00442SC0324 [0,2,0,0,0,0|1,0,0]=3 1725 B12R1.24 CNC(=O)c1ccnc(c1F)Cl WXVL_AK00442SC0324 [0,2,0,0,0,0|1,0,0]=3 1726 B12R1.24 CNC(=O)c1ccnc(c1F)F WXVL_AK00442SC0410 [0,2,0,0,0,0|1,0,0]=3 1727 B12R1.24 CNC(=O)c1ccnc(c1F)F WXVL_AK00442SC0410 [0,2,0,0,0,0|1,0,0]=3 1728 B12R1.24 CNC(=O)c1cncc(c1C)Br WXVL_AK00442SC1094 [0,2,0,0,0,0|1,0,0]=3 1729 B12R1.24 CNC(=O)c1cncc(c1C)Br WXVL_AK00442SC1094 [0,2,0,0,0,0|1,0,0]=3 1730 B12R1.225 CN(C)C(=O)C1=CC=NC(=O)C1 WXVL_AN0032SC0016 [0,2,0,0,0,0|1,0,1]=4 1731 B12R1.225 CN(C)C(=O)C1=CC=NC(=O)C1 WXVL_AN0032SC0016 [0,2,0,0,0,0|1,0,1]=4 1732 B12R1.225 CN(C)C(=O)c1cc(=O)cco1 WXVL_AN0032SC0133 [0,2,0,0,0,0|1,0,0]=3 1733 B12R1.225 CN(C)C(=O)c1cc(=O)cco1 WXVL_AN0032SC0133 [0,2,0,0,0,0|1,0,0]=3 1734 B12R1.225 CN(C)C(=O)c1cc(ccn1)Br WXVL_AN0032SC0243 [0,2,0,0,0,0|1,0,0]=3 1735 B12R1.225 CN(C)C(=O)c1cc(ccn1)Br WXVL_AN0032SC0243 [0,2,0,0,0,0|1,0,0]=3 1736 B12R1.225 CN(C)C(=O)c1cc(ccn1)Cl WXVL_AN0032SC0373 [0,2,0,0,0,0|1,0,0]=3 1737 B12R1.225 CN(C)C(=O)c1cc(ccn1)Cl WXVL_AN0032SC0373 [0,2,0,0,0,0|1,0,0]=3 1738 B12R1.225 CN(C)C(=O)c1cc(ncn1)Cl WXVL_AN0032SC0775 [0,2,0,0,0,0|2,0,0]=4 1739 B12R1.225 CN(C)C(=O)c1cc(ncn1)Cl WXVL_AN0032SC0775 [0,2,0,0,0,0|2,0,0]=4 1740 B12R1.225 CN(C)C(=O)c1cc(ncn1)O WXVL_AN0032SC0001 [0,2,0,0,0,0|2,0,0]=4 1741 B12R1.225 CN(C)C(=O)c1cc(ncn1)O WXVL_AN0032SC0001 [0,2,0,0,0,0|2,0,0]=4 1742 B12R1.225 CN(C)C(=O)c1ccc[n+](c1)[O-] WXVL_AN0032SC1039 [0,2,0,0,0,0|1,0,0]=3 1743 B12R1.225 CN(C)C(=O)c1ccc[n+](c1)[O-] WXVL_AN0032SC1039 [0,2,0,0,0,0|1,0,0]=3 1744 B12R1.225 CN(C)C(=O)c1cccc(c1)Br WXVL_AN0032SD0041 [0,2,0,0,0,0|0,0,0]=2 1745 B12R1.225 CN(C)C(=O)c1cccc(c1)Br WXVL_AN0032SD0041 [0,2,0,0,0,0|0,0,0]=2 1746 B12R1.225 CN(C)C(=O)c1cccc(c1)Cl WXVL_AN0032SD0045 [0,2,0,0,0,0|0,0,0]=2 1747 B12R1.225 CN(C)C(=O)c1cccc(c1)Cl WXVL_AN0032SD0045 [0,2,0,0,0,0|0,0,0]=2 1748 B12R1.225 CN(C)C(=O)c1cccc(c1)F WXVL_AN0032SD0043 [0,2,0,0,0,0|0,0,0]=2 1749 B12R1.225 CN(C)C(=O)c1cccc(c1)F WXVL_AN0032SD0043 [0,2,0,0,0,0|0,0,0]=2 1750 B12R1.225 CN(C)C(=O)c1cccc(c1)I WXVL_AN0032SD0405 [0,2,0,0,0,0|0,0,0]=2 1751 B12R1.225 CN(C)C(=O)c1cccc(c1)I WXVL_AN0032SD0405 [0,2,0,0,0,0|0,0,0]=2 1752 B12R1.225 CN(C)C(=O)c1cccc(c1)O WXVL_AN0032SD1724 [0,2,0,0,0,0|0,0,0]=2 1753 B12R1.225 CN(C)C(=O)c1cccc(c1)O WXVL_AN0032SD1724 [0,2,0,0,0,0|0,0,0]=2 1754 B12R1.225 CN(C)C(=O)c1cccc(n1)Br WXVL_AN0032SC0366 [0,2,0,0,0,0|1,0,0]=3 1755 B12R1.225 CN(C)C(=O)c1cccc(n1)Br WXVL_AN0032SC0366 [0,2,0,0,0,0|1,0,0]=3 1756 B12R1.225 CN(C)C(=O)c1cccc(n1)F WXVL_AN0032SC0386 [0,2,0,0,0,0|1,0,0]=3 1757 B12R1.225 CN(C)C(=O)c1cccc(n1)F WXVL_AN0032SC0386 [0,2,0,0,0,0|1,0,0]=3 1758 B12R1.225 CN(C)C(=O)c1cccc(n1)O WXVL_AN0032SC0084 [0,2,0,0,0,0|1,0,0]=3 1759 B12R1.225 CN(C)C(=O)c1cccc(n1)O WXVL_AN0032SC0084 [0,2,0,0,0,0|1,0,0]=3 1760 B12R1.225 CN(C)C(=O)c1ccnc(c1)Br WXVL_AN0032SC0349 [0,2,0,0,0,0|1,0,0]=3 1761 B12R1.225 CN(C)C(=O)c1ccnc(c1)Br WXVL_AN0032SC0349 [0,2,0,0,0,0|1,0,0]=3 1762 B12R1.225 CN(C)C(=O)c1ccnc(c1)Cl WXVL_AN0032SC0083 [0,2,0,0,0,0|1,0,0]=3 1763 B12R1.225 CN(C)C(=O)c1ccnc(c1)Cl WXVL_AN0032SC0083 [0,2,0,0,0,0|1,0,0]=3 1764 B12R1.225 CN(C)C(=O)c1ccnc(c1)F WXVL_AN0032SC0015 [0,2,0,0,0,0|1,0,0]=3 1765 B12R1.225 CN(C)C(=O)c1ccnc(c1)F WXVL_AN0032SC0015 [0,2,0,0,0,0|1,0,0]=3 1766 B12R1.225 CN(C)C(=O)c1ccnc(c1)O WXVL_AN0032SC0131 [0,2,0,0,0,0|1,0,0]=3 1767 B12R1.225 CN(C)C(=O)c1ccnc(c1)O WXVL_AN0032SC0131 [0,2,0,0,0,0|1,0,0]=3 1768 B12R1.225 CN(C)C(=O)c1ccnc(n1)Cl WXVL_AN0032SC0392 [0,2,0,0,0,0|2,0,0]=4 1769 B12R1.225 CN(C)C(=O)c1ccnc(n1)Cl WXVL_AN0032SC0392 [0,2,0,0,0,0|2,0,0]=4 1770 B12R1.225 CN(C)C(=O)c1cncc(c1)Br WXVL_AN0032SC0369 [0,2,0,0,0,0|1,0,0]=3 1771 B12R1.225 CN(C)C(=O)c1cncc(c1)Br WXVL_AN0032SC0369 [0,2,0,0,0,0|1,0,0]=3 1772 B12R1.225 CN(C)C(=O)c1cncc(c1)Cl WXVL_AN0032SC0291 [0,2,0,0,0,0|1,0,0]=3 1773 B12R1.225 CN(C)C(=O)c1cncc(c1)Cl WXVL_AN0032SC0291 [0,2,0,0,0,0|1,0,0]=3 1774 B12R1.225 CN(C)C(=O)c1cncc(c1)F WXVL_AN0032SC0102 [0,2,0,0,0,0|1,0,0]=3 1775 B12R1.225 CN(C)C(=O)c1cncc(c1)F WXVL_AN0032SC0102 [0,2,0,0,0,0|1,0,0]=3 1776 B12R1.225 CN(C)C(=O)c1cncc(c1)O WXVL_AN0032SC0333 [0,2,0,0,0,0|1,0,0]=3 1777 B12R1.225 CN(C)C(=O)c1cncc(c1)O WXVL_AN0032SC0333 [0,2,0,0,0,0|1,0,0]=3 1778 B12R1.225 CN(C)C(=O)c1cnnc(c1)Cl WXVL_AN0032SC0966 [0,2,0,0,0,0|2,0,0]=4 1779 B12R1.225 CN(C)C(=O)c1cnnc(c1)Cl WXVL_AN0032SC0966 [0,2,0,0,0,0|2,0,0]=4 1780 B12R1.225 CN(C)C(=O)c1cnnc(c1)O WXVL_AN0032SC0795 [0,2,0,0,0,0|2,0,0]=4 1781 B12R1.225 CN(C)C(=O)c1cnnc(c1)O WXVL_AN0032SC0795 [0,2,0,0,0,0|2,0,0]=4 1782 B12R1.225 Cc1cc(ccn1)C(=O)N(C)C WXVL_AN0032SC0400 [0,2,0,0,0,0|1,0,0]=3 1783 B12R1.225 Cc1cc(ccn1)C(=O)N(C)C WXVL_AN0032SC0400 [0,2,0,0,0,0|1,0,0]=3 1784 B12R1.225 Cc1cccc(c1)C(=O)N(C)C WXVL_AN0032SD0056 [0,2,0,0,0,0|0,0,0]=2 1785 B12R1.225 Cc1cccc(c1)C(=O)N(C)C WXVL_AN0032SD0056 [0,2,0,0,0,0|0,0,0]=2 1786 B12R1.225 Cc1ccnc(c1)C(=O)N(C)C WXVL_AN0032SC0235 [0,2,0,0,0,0|1,0,0]=3 1787 B12R1.225 Cc1ccnc(c1)C(=O)N(C)C WXVL_AN0032SC0235 [0,2,0,0,0,0|1,0,0]=3 1788 B12R1.225 Cc1cncc(c1)C(=O)N(C)C WXVL_AN0032SC0095 [0,2,0,0,0,0|1,0,0]=3 1789 B12R1.225 Cc1cncc(c1)C(=O)N(C)C WXVL_AN0032SC0095 [0,2,0,0,0,0|1,0,0]=3 1790 B12R1.225 Cc1cncc(n1)C(=O)N(C)C WXVL_AN0032SC0391 [0,2,0,0,0,0|2,0,0]=4 1791 B12R1.225 Cc1cncc(n1)C(=O)N(C)C WXVL_AN0032SC0391 [0,2,0,0,0,0|2,0,0]=4 1792 B12R1.225 Cc1nccc(n1)C(=O)N(C)C WXVL_AN0032SC0296 [0,2,0,0,0,0|2,0,0]=4 1793 B12R1.225 Cc1nccc(n1)C(=O)N(C)C WXVL_AN0032SC0296 [0,2,0,0,0,0|2,0,0]=4 1794 B12R1.354 CNC(=O)c1cc(=O)ccn1C WXVL_AK00442SD00008 [0,2,0,0,0,0|1,0,0]=3 1795 B12R1.354 CNC(=O)c1cc(=O)ccn1C WXVL_AK00442SD00008 [0,2,0,0,0,0|1,0,0]=3 1796 B12R1.354 CNC(=O)c1cc(ccc1Br)Br WXVL_AK00442SD0449 [0,2,0,0,0,0|0,0,0]=2 1797 B12R1.354 CNC(=O)c1cc(ccc1Br)Br WXVL_AK00442SD0449 [0,2,0,0,0,0|0,0,0]=2 1798 B12R1.354 CNC(=O)c1cc(ccc1Br)C WXVL_AK00442SD0598 [0,2,0,0,0,0|0,0,0]=2 1799 B12R1.354 CNC(=O)c1cc(ccc1Br)C WXVL_AK00442SD0598 [0,2,0,0,0,0|0,0,0]=2 1800 B12R1.354 CNC(=O)c1cc(ccc1Br)Cl WXVL_AK00442SD0426 [0,2,0,0,0,0|0,0,0]=2 1801 B12R1.354 CNC(=O)c1cc(ccc1Br)Cl WXVL_AK00442SD0426 [0,2,0,0,0,0|0,0,0]=2 1802 B12R1.354 CNC(=O)c1cc(ccc1Br)F WXVL_AK00442SD0126 [0,2,0,0,0,0|0,0,0]=2 1803 B12R1.354 CNC(=O)c1cc(ccc1Br)F WXVL_AK00442SD0126 [0,2,0,0,0,0|0,0,0]=2 1804 B12R1.354 CNC(=O)c1cc(ccc1Br)I WXVL_AK00442SD0332 [0,2,0,0,0,0|0,0,0]=2 1805 B12R1.354 CNC(=O)c1cc(ccc1Br)I WXVL_AK00442SD0332 [0,2,0,0,0,0|0,0,0]=2 1806 B12R1.354 CNC(=O)c1cc(ccc1Br)O WXVL_AK00442SD1131 [0,2,0,0,0,0|0,0,0]=2 1807 B12R1.354 CNC(=O)c1cc(ccc1Br)O WXVL_AK00442SD1131 [0,2,0,0,0,0|0,0,0]=2 1808 B12R1.354 CNC(=O)c1cc(ccc1C)Br WXVL_AK00442SD0407 [0,2,0,0,0,0|0,0,0]=2 1809 B12R1.354 CNC(=O)c1cc(ccc1C)Br WXVL_AK00442SD0407 [0,2,0,0,0,0|0,0,0]=2 1810 B12R1.354 CNC(=O)c1cc(ccc1C)C WXVL_AK00442SD0146 [0,2,0,0,0,0|0,0,0]=2 1811 B12R1.354 CNC(=O)c1cc(ccc1C)C WXVL_AK00442SD0146 [0,2,0,0,0,0|0,0,0]=2 1812 B12R1.354 CNC(=O)c1cc(ccc1C)Cl WXVL_AK00442SD0169 [0,2,0,0,0,0|0,0,0]=2 1813 B12R1.354 CNC(=O)c1cc(ccc1C)Cl WXVL_AK00442SD0169 [0,2,0,0,0,0|0,0,0]=2 1814 B12R1.354 CNC(=O)c1cc(ccc1C)F WXVL_AK00442SD0105 [0,2,0,0,0,0|0,0,0]=2 1815 B12R1.354 CNC(=O)c1cc(ccc1C)F WXVL_AK00442SD0105 [0,2,0,0,0,0|0,0,0]=2 1816 B12R1.354 CNC(=O)c1cc(ccc1C)I WXVL_AK00442SD0430 [0,2,0,0,0,0|0,0,0]=2 1817 B12R1.354 CNC(=O)c1cc(ccc1C)I WXVL_AK00442SD0430 [0,2,0,0,0,0|0,0,0]=2 1818 B12R1.354 CNC(=O)c1cc(ccc1C)O WXVL_AK00442SD0424 [0,2,0,0,0,0|0,0,0]=2 1819 B12R1.354 CNC(=O)c1cc(ccc1C)O WXVL_AK00442SD0424 [0,2,0,0,0,0|0,0,0]=2 1820 B12R1.354 CNC(=O)c1cc(ccc1Cl)Br WXVL_AK00442SD0009 [0,2,0,0,0,0|0,0,0]=2 1821 B12R1.354 CNC(=O)c1cc(ccc1Cl)Br WXVL_AK00442SD0009 [0,2,0,0,0,0|0,0,0]=2 1822 B12R1.354 CNC(=O)c1cc(ccc1Cl)C WXVL_AK00442SD0473 [0,2,0,0,0,0|0,0,0]=2 1823 B12R1.354 CNC(=O)c1cc(ccc1Cl)C WXVL_AK00442SD0473 [0,2,0,0,0,0|0,0,0]=2 1824 B12R1.354 CNC(=O)c1cc(ccc1Cl)Cl WXVL_AK00442SD0010 [0,2,0,0,0,0|0,0,0]=2 1825 B12R1.354 CNC(=O)c1cc(ccc1Cl)Cl WXVL_AK00442SD0010 [0,2,0,0,0,0|0,0,0]=2 1826 B12R1.354 CNC(=O)c1cc(ccc1Cl)F WXVL_AK00442SD0537 [0,2,0,0,0,0|0,0,0]=2 1827 B12R1.354 CNC(=O)c1cc(ccc1Cl)F WXVL_AK00442SD0537 [0,2,0,0,0,0|0,0,0]=2 1828 B12R1.354 CNC(=O)c1cc(ccc1Cl)I WXVL_AK00442SD0410 [0,2,0,0,0,0|0,0,0]=2 1829 B12R1.354 CNC(=O)c1cc(ccc1Cl)I WXVL_AK00442SD0410 [0,2,0,0,0,0|0,0,0]=2 1830 B12R1.354 CNC(=O)c1cc(ccc1Cl)O WXVL_AK00442SD0180 [0,2,0,0,0,0|0,0,0]=2 1831 B12R1.354 CNC(=O)c1cc(ccc1Cl)O WXVL_AK00442SD0180 [0,2,0,0,0,0|0,0,0]=2 1832 B12R1.354 CNC(=O)c1cc(ccc1F)Br WXVL_AK00442SD0128 [0,2,0,0,0,0|0,0,0]=2 1833 B12R1.354 CNC(=O)c1cc(ccc1F)Br WXVL_AK00442SD0128 [0,2,0,0,0,0|0,0,0]=2 1834 B12R1.354 CNC(=O)c1cc(ccc1F)C WXVL_AK00442SD0492 [0,2,0,0,0,0|0,0,0]=2 1835 B12R1.354 CNC(=O)c1cc(ccc1F)C WXVL_AK00442SD0492 [0,2,0,0,0,0|0,0,0]=2 1836 B12R1.354 CNC(=O)c1cc(ccc1F)Cl WXVL_AK00442SD0130 [0,2,0,0,0,0|0,0,0]=2 1837 B12R1.354 CNC(=O)c1cc(ccc1F)Cl WXVL_AK00442SD0130 [0,2,0,0,0,0|0,0,0]=2 1838 B12R1.354 CNC(=O)c1cc(ccc1F)F WXVL_AK00442SD0004 [0,2,0,0,0,0|0,0,0]=2 1839 B12R1.354 CNC(=O)c1cc(ccc1F)F WXVL_AK00442SD0004 [0,2,0,0,0,0|0,0,0]=2 1840 B12R1.354 CNC(=O)c1cc(ccc1F)I WXVL_AK00442SD0314 [0,2,0,0,0,0|0,0,0]=2 1841 B12R1.354 CNC(=O)c1cc(ccc1F)I WXVL_AK00442SD0314 [0,2,0,0,0,0|0,0,0]=2 1842 B12R1.354 CNC(=O)c1cc(ccc1F)O WXVL_AK00442SD0462 [0,2,0,0,0,0|0,0,0]=2 1843 B12R1.354 CNC(=O)c1cc(ccc1F)O WXVL_AK00442SD0462 [0,2,0,0,0,0|0,0,0]=2 1844 B12R1.354 CNC(=O)c1cc(ccc1I)Br WXVL_AK00442SD0546 [0,2,0,0,0,0|0,0,0]=2 1845 B12R1.354 CNC(=O)c1cc(ccc1I)Br WXVL_AK00442SD0546 [0,2,0,0,0,0|0,0,0]=2 1846 B12R1.354 CNC(=O)c1cc(ccc1I)C WXVL_AK00442SD0554 [0,2,0,0,0,0|0,0,0]=2 1847 B12R1.354 CNC(=O)c1cc(ccc1I)C WXVL_AK00442SD0554 [0,2,0,0,0,0|0,0,0]=2 1848 B12R1.354 CNC(=O)c1cc(ccc1I)Cl WXVL_AK00442SD0461 [0,2,0,0,0,0|0,0,0]=2 1849 B12R1.354 CNC(=O)c1cc(ccc1I)Cl WXVL_AK00442SD0461 [0,2,0,0,0,0|0,0,0]=2 1850 B12R1.354 CNC(=O)c1cc(ccc1I)F WXVL_AK00442SD0454 [0,2,0,0,0,0|0,0,0]=2 1851 B12R1.354 CNC(=O)c1cc(ccc1I)F WXVL_AK00442SD0454 [0,2,0,0,0,0|0,0,0]=2 1852 B12R1.354 CNC(=O)c1cc(ccc1I)O WXVL_AK00442SD1452 [0,2,0,0,0,0|0,0,0]=2 1853 B12R1.354 CNC(=O)c1cc(ccc1I)O WXVL_AK00442SD1452 [0,2,0,0,0,0|0,0,0]=2 1854 B12R1.354 CNC(=O)c1cc(ccc1O)Br WXVL_AK00442SD0028 [0,2,0,0,0,0|0,0,0]=2 1855 B12R1.354 CNC(=O)c1cc(ccc1O)Br WXVL_AK00442SD0028 [0,2,0,0,0,0|0,0,0]=2 1856 B12R1.354 CNC(=O)c1cc(ccc1O)C WXVL_AK00442SD0032 [0,2,0,0,0,0|0,0,0]=2 1857 B12R1.354 CNC(=O)c1cc(ccc1O)C WXVL_AK00442SD0032 [0,2,0,0,0,0|0,0,0]=2 1858 B12R1.354 CNC(=O)c1cc(ccc1O)Cl WXVL_AK00442SD0029 [0,2,0,0,0,0|0,0,0]=2 1859 B12R1.354 CNC(=O)c1cc(ccc1O)Cl WXVL_AK00442SD0029 [0,2,0,0,0,0|0,0,0]=2 1860 B12R1.354 CNC(=O)c1cc(ccc1O)F WXVL_AK00442SD0469 [0,2,0,0,0,0|0,0,0]=2 1861 B12R1.354 CNC(=O)c1cc(ccc1O)F WXVL_AK00442SD0469 [0,2,0,0,0,0|0,0,0]=2 1862 B12R1.354 CNC(=O)c1cc(ccc1O)I WXVL_AK00442SD0030 [0,2,0,0,0,0|0,0,0]=2 1863 B12R1.354 CNC(=O)c1cc(ccc1O)I WXVL_AK00442SD0030 [0,2,0,0,0,0|0,0,0]=2 1864 B12R1.354 CNC(=O)c1cc(ccc1O)O WXVL_AK00442SD1721 [0,2,0,0,0,0|0,0,0]=2 1865 B12R1.354 CNC(=O)c1cc(ccc1O)O WXVL_AK00442SD1721 [0,2,0,0,0,0|0,0,0]=2 1866 B12R1.354 CNC(=O)c1cc(cnc1Br)Br WXVL_AK00442SC0221 [0,2,0,0,0,0|1,0,0]=3 1867 B12R1.354 CNC(=O)c1cc(cnc1Br)Br WXVL_AK00442SC0221 [0,2,0,0,0,0|1,0,0]=3 1868 B12R1.354 CNC(=O)c1cc(cnc1Br)Cl WXVL_AK00442SC1019 [0,2,0,0,0,0|1,0,0]=3 1869 B12R1.354 CNC(=O)c1cc(cnc1Br)Cl WXVL_AK00442SC1019 [0,2,0,0,0,0|1,0,0]=3 1870 B12R1.354 CNC(=O)c1cc(cnc1C)Br WXVL_AK00442SC1114 [0,2,0,0,0,0|1,0,0]=3 1871 B12R1.354 CNC(=O)c1cc(cnc1C)Br WXVL_AK00442SC1114 [0,2,0,0,0,0|1,0,0]=3 1872 B12R1.354 CNC(=O)c1cc(cnc1Cl)Br WXVL_AK00442SC0342 [0,2,0,0,0,0|1,0,0]=3 1873 B12R1.354 CNC(=O)c1cc(cnc1Cl)Br WXVL_AK00442SC0342 [0,2,0,0,0,0|1,0,0]=3 1874 B12R1.354 CNC(=O)c1cc(cnc1Cl)C WXVL_AK00442SC0124 [0,2,0,0,0,0|1,0,0]=3 1875 B12R1.354 CNC(=O)c1cc(cnc1Cl)C WXVL_AK00442SC0124 [0,2,0,0,0,0|1,0,0]=3 1876 B12R1.354 CNC(=O)c1cc(cnc1Cl)Cl WXVL_AK00442SC0377 [0,2,0,0,0,0|1,0,0]=3 1877 B12R1.354 CNC(=O)c1cc(cnc1Cl)Cl WXVL_AK00442SC0377 [0,2,0,0,0,0|1,0,0]=3 1878 B12R1.354 CNC(=O)c1cc(cnc1Cl)F WXVL_AK00442SC0372 [0,2,0,0,0,0|1,0,0]=3 1879 B12R1.354 CNC(=O)c1cc(cnc1Cl)F WXVL_AK00442SC0372 [0,2,0,0,0,0|1,0,0]=3 1880 B12R1.354 CNC(=O)c1cc(cnc1Cl)I WXVL_AK00442SC00133 [0,2,0,0,0,0|1,0,0]=3 1881 B12R1.354 CNC(=O)c1cc(cnc1Cl)I WXVL_AK00442SC00133 [0,2,0,0,0,0|1,0,0]=3 1882 B12R1.354 CNC(=O)c1cc(cnc1F)Br WXVL_AK00442SC0712 [0,2,0,0,0,0|1,0,0]=3 1883 B12R1.354 CNC(=O)c1cc(cnc1F)Br WXVL_AK00442SC0712 [0,2,0,0,0,0|1,0,0]=3 1884 B12R1.354 CNC(=O)c1cc(cnc1F)Cl WXVL_AK00442SC0575 [0,2,0,0,0,0|1,0,0]=3 1885 B12R1.354 CNC(=O)c1cc(cnc1F)Cl WXVL_AK00442SC0575 [0,2,0,0,0,0|1,0,0]=3 1886 B12R1.354 CNC(=O)c1cc(cnc1O)Br WXVL_AK00442SC0671 [0,2,0,0,0,0|1,0,0]=3 1887 B12R1.354 CNC(=O)c1cc(cnc1O)Br WXVL_AK00442SC0671 [0,2,0,0,0,0|1,0,0]=3 1888 B12R1.354 CNC(=O)c1cc(cnc1O)Cl WXVL_AK00442SC0161 [0,2,0,0,0,0|1,0,0]=3 1889 B12R1.354 CNC(=O)c1cc(cnc1O)Cl WXVL_AK00442SC0161 [0,2,0,0,0,0|1,0,0]=3 1890 B12R1.354 CNC(=O)c1cc(ncc1Br)Br WXVL_AK00442SC0520 [0,2,0,0,0,0|1,0,0]=3 1891 B12R1.354 CNC(=O)c1cc(ncc1Br)Br WXVL_AK00442SC0520 [0,2,0,0,0,0|1,0,0]=3 1892 B12R1.354 CNC(=O)c1cc(ncc1Br)Cl WXVL_AK00442SC0286 [0,2,0,0,0,0|1,0,0]=3 1893 B12R1.354 CNC(=O)c1cc(ncc1Br)Cl WXVL_AK00442SC0286 [0,2,0,0,0,0|1,0,0]=3 1894 B12R1.354 CNC(=O)c1cc(ncc1Br)F WXVL_AK00442SC0980 [0,2,0,0,0,0|1,0,0]=3 1895 B12R1.354 CNC(=O)c1cc(ncc1Br)F WXVL_AK00442SC0980 [0,2,0,0,0,0|1,0,0]=3 1896 B12R1.354 CNC(=O)c1cc(ncc1Cl)Br WXVL_AK00442SC0996 [0,2,0,0,0,0|1,0,0]=3 1897 B12R1.354 CNC(=O)c1cc(ncc1Cl)Br WXVL_AK00442SC0996 [0,2,0,0,0,0|1,0,0]=3 1898 B12R1.354 CNC(=O)c1cc(ncc1Cl)Cl WXVL_AK00442SC0356 [0,2,0,0,0,0|1,0,0]=3 1899 B12R1.354 CNC(=O)c1cc(ncc1Cl)Cl WXVL_AK00442SC0356 [0,2,0,0,0,0|1,0,0]=3 1900 B12R1.354 CNC(=O)c1cc(ncc1F)Br WXVL_AK00442SC0273 [0,2,0,0,0,0|1,0,0]=3 1901 B12R1.354 CNC(=O)c1cc(ncc1F)Br WXVL_AK00442SC0273 [0,2,0,0,0,0|1,0,0]=3 1902 B12R1.354 CNC(=O)c1cc(ncc1F)Cl WXVL_AK00442SC0255 [0,2,0,0,0,0|1,0,0]=3 1903 B12R1.354 CNC(=O)c1cc(ncc1F)Cl WXVL_AK00442SC0255 [0,2,0,0,0,0|1,0,0]=3 1904 B12R1.354 CNC(=O)c1nc(ccc1F)Cl WXVL_AK00442SC1009 [0,2,0,0,0,0|1,0,0]=3 1905 B12R1.354 CNC(=O)c1nc(ccc1F)Cl WXVL_AK00442SC1009 [0,2,0,0,0,0|1,0,0]=3 1906 B12R1.354 CNC(=O)c1nc(cnc1C)C WXVL_AK00442SC1225 [0,2,0,0,0,0|2,0,0]=4 1907 B12R1.354 CNC(=O)c1nc(cnc1C)C WXVL_AK00442SC1225 [0,2,0,0,0,0|2,0,0]=4 1908 B12R1.354 CNC(=O)c1nc(ncc1Br)C WXVL_AK00442SC0734 [0,2,0,0,0,0|2,0,0]=4 1909 B12R1.354 CNC(=O)c1nc(ncc1Br)C WXVL_AK00442SC0734 [0,2,0,0,0,0|2,0,0]=4 1910 B12R1.358 CNC(=O)c1cc(cc(c1)Br)Br WXVL_AK00442SD0322 [0,2,0,0,0,0|0,0,0]=2 1911 B12R1.358 CNC(=O)c1cc(cc(c1)Br)Br WXVL_AK00442SD0322 [0,2,0,0,0,0|0,0,0]=2 1912 B12R1.358 CNC(=O)c1cc(cc(c1)Br)C WXVL_AK00442SD0805 [0,2,0,0,0,0|0,0,0]=2 1913 B12R1.358 CNC(=O)c1cc(cc(c1)Br)C WXVL_AK00442SD0805 [0,2,0,0,0,0|0,0,0]=2 1914 B12R1.358 CNC(=O)c1cc(cc(c1)Br)Cl WXVL_AK00442SD0292 [0,2,0,0,0,0|0,0,0]=2 1915 B12R1.358 CNC(=O)c1cc(cc(c1)Br)Cl WXVL_AK00442SD0292 [0,2,0,0,0,0|0,0,0]=2 1916 B12R1.358 CNC(=O)c1cc(cc(c1)Br)F WXVL_AK00442SD0494 [0,2,0,0,0,0|0,0,0]=2 1917 B12R1.358 CNC(=O)c1cc(cc(c1)Br)F WXVL_AK00442SD0494 [0,2,0,0,0,0|0,0,0]=2 1918 B12R1.358 CNC(=O)c1cc(cc(c1)Br)O WXVL_AK00442SD0742 [0,2,0,0,0,0|0,0,0]=2 1919 B12R1.358 CNC(=O)c1cc(cc(c1)Br)O WXVL_AK00442SD0742 [0,2,0,0,0,0|0,0,0]=2 1920 B12R1.358 CNC(=O)c1cc(cc(c1)C)C WXVL_AK00442SD0058 [0,2,0,0,0,0|0,0,0]=2 1921 B12R1.358 CNC(=O)c1cc(cc(c1)C)C WXVL_AK00442SD0058 [0,2,0,0,0,0|0,0,0]=2 1922 B12R1.358 CNC(=O)c1cc(cc(c1)Cl)C WXVL_AK00442SD0173 [0,2,0,0,0,0|0,0,0]=2 1923 B12R1.358 CNC(=O)c1cc(cc(c1)Cl)C WXVL_AK00442SD0173 [0,2,0,0,0,0|0,0,0]=2 1924 B12R1.358 CNC(=O)c1cc(cc(c1)Cl)Cl WXVL_AK00442SD0214 [0,2,0,0,0,0|0,0,0]=2 1925 B12R1.358 CNC(=O)c1cc(cc(c1)Cl)Cl WXVL_AK00442SD0214 [0,2,0,0,0,0|0,0,0]=2 1926 B12R1.358 CNC(=O)c1cc(cc(c1)Cl)F WXVL_AK00442SD0182 [0,2,0,0,0,0|0,0,0]=2 1927 B12R1.358 CNC(=O)c1cc(cc(c1)Cl)F WXVL_AK00442SD0182 [0,2,0,0,0,0|0,0,0]=2 1928 B12R1.358 CNC(=O)c1cc(cc(c1)Cl)O WXVL_AK00442SD0891 [0,2,0,0,0,0|0,0,0]=2 1929 B12R1.358 CNC(=O)c1cc(cc(c1)Cl)O WXVL_AK00442SD0891 [0,2,0,0,0,0|0,0,0]=2 1930 B12R1.358 CNC(=O)c1cc(cc(c1)F)C WXVL_AK00442SD0444 [0,2,0,0,0,0|0,0,0]=2 1931 B12R1.358 CNC(=O)c1cc(cc(c1)F)C WXVL_AK00442SD0444 [0,2,0,0,0,0|0,0,0]=2 1932 B12R1.358 CNC(=O)c1cc(cc(c1)F)F WXVL_AK00442SD0090 [0,2,0,0,0,0|0,0,0]=2 1933 B12R1.358 CNC(=O)c1cc(cc(c1)F)F WXVL_AK00442SD0090 [0,2,0,0,0,0|0,0,0]=2 1934 B12R1.358 CNC(=O)c1cc(cc(c1)F)O WXVL_AK00442SD0722 [0,2,0,0,0,0|0,0,0]=2 1935 B12R1.358 CNC(=O)c1cc(cc(c1)F)O WXVL_AK00442SD0722 [0,2,0,0,0,0|0,0,0]=2 1936 B12R1.358 CNC(=O)c1cc(cc(c1)I)Br WXVL_AK00442SD1124 [0,2,0,0,0,0|0,0,0]=2 1937 B12R1.358 CNC(=O)c1cc(cc(c1)I)Br WXVL_AK00442SD1124 [0,2,0,0,0,0|0,0,0]=2 1938 B12R1.358 CNC(=O)c1cc(cc(c1)I)Cl WXVL_AK00442SD1014 [0,2,0,0,0,0|0,0,0]=2 1939 B12R1.358 CNC(=O)c1cc(cc(c1)I)Cl WXVL_AK00442SD1014 [0,2,0,0,0,0|0,0,0]=2 1940 B12R1.358 CNC(=O)c1cc(cc(c1)I)F WXVL_AK00442SD1604 [0,2,0,0,0,0|0,0,0]=2 1941 B12R1.358 CNC(=O)c1cc(cc(c1)I)F WXVL_AK00442SD1604 [0,2,0,0,0,0|0,0,0]=2 1942 B12R1.358 CNC(=O)c1cc(cc(c1)O)C WXVL_AK00442SD0503 [0,2,0,0,0,0|0,0,0]=2 1943 B12R1.358 CNC(=O)c1cc(cc(c1)O)C WXVL_AK00442SD0503 [0,2,0,0,0,0|0,0,0]=2 1944 B12R1.358 CNC(=O)c1cc(cc(c1)O)O WXVL_AK00442SD0152 [0,2,0,0,0,0|0,0,0]=2 1945 B12R1.358 CNC(=O)c1cc(cc(c1)O)O WXVL_AK00442SD0152 [0,2,0,0,0,0|0,0,0]=2 1946 B12R1.358 CNC(=O)c1cc(cc(n1)C)C WXVL_AK00442SC00037 [0,2,0,0,0,0|1,0,0]=3 1947 B12R1.358 CNC(=O)c1cc(cc(n1)C)C WXVL_AK00442SC00037 [0,2,0,0,0,0|1,0,0]=3 1948 B12R1.358 CNC(=O)c1cc(cc(n1)Cl)C WXVL_AK00442SC0385 [0,2,0,0,0,0|1,0,0]=3 1949 B12R1.358 CNC(=O)c1cc(cc(n1)Cl)C WXVL_AK00442SC0385 [0,2,0,0,0,0|1,0,0]=3 1950 B12R1.358 CNC(=O)c1cc(cc(n1)Cl)Cl WXVL_AK00442SC0772 [0,2,0,0,0,0|1,0,0]=3 1951 B12R1.358 CNC(=O)c1cc(cc(n1)Cl)Cl WXVL_AK00442SC0772 [0,2,0,0,0,0|1,0,0]=3 1952 B12R1.358 CNC(=O)c1cc(nc(c1)Br)Br WXVL_AK00442SC0394 [0,2,0,0,0,0|1,0,0]=3 1953 B12R1.358 CNC(=O)c1cc(nc(c1)Br)Br WXVL_AK00442SC0394 [0,2,0,0,0,0|1,0,0]=3 1954 B12R1.358 CNC(=O)c1cc(nc(c1)Cl)C WXVL_AK00442SC0599 [0,2,0,0,0,0|1,0,0]=3 1955 B12R1.358 CNC(=O)c1cc(nc(c1)Cl)C WXVL_AK00442SC0599 [0,2,0,0,0,0|1,0,0]=3 1956 B12R1.358 CNC(=O)c1cc(nc(c1)Cl)Cl WXVL_AK00442SC0358 [0,2,0,0,0,0|1,0,0]=3 1957 B12R1.358 CNC(=O)c1cc(nc(c1)Cl)Cl WXVL_AK00442SC0358 [0,2,0,0,0,0|1,0,0]=3 1958 B12R1.358 CNC(=O)c1cc(nc(c1)Cl)O WXVL_AK00442SC1413 [0,2,0,0,0,0|1,0,0]=3 1959 B12R1.358 CNC(=O)c1cc(nc(c1)Cl)O WXVL_AK00442SC1413 [0,2,0,0,0,0|1,0,0]=3 1960 B12R1.358 CNC(=O)c1cc(nc(c1)F)F WXVL_AK00442SC0594 [0,2,0,0,0,0|1,0,0]=3 1961 B12R1.358 CNC(=O)c1cc(nc(c1)F)F WXVL_AK00442SC0594 [0,2,0,0,0,0|1,0,0]=3 1962 B12R1.358 CNC(=O)c1cc(nc(c1)O)C WXVL_AK00442SC0876 [0,2,0,0,0,0|1,0,0]=3 1963 B12R1.358 CNC(=O)c1cc(nc(c1)O)C WXVL_AK00442SC0876 [0,2,0,0,0,0|1,0,0]=3 1964 B12R1.358 CNC(=O)c1cc(nc(n1)O)O WXVL_AK00442SC0143 [0,2,0,0,0,0|2,0,0]=4 1965 B12R1.358 CNC(=O)c1cc(nc(n1)O)O WXVL_AK00442SC0143 [0,2,0,0,0,0|2,0,0]=4 1966 B12R1.435 C#Cc1cccc(c1)C(=O)NC WXVL_AK00442SD1159 [0,2,0,0,0,0|0,0,0]=2 1967 B12R1.435 C#Cc1cccc(c1)C(=O)NC WXVL_AK00442SD1159 [0,2,0,0,0,0|0,0,0]=2 1968 B12R1.435 CCc1cccc(c1)C(=O)NC WXVL_AK00442SD1421 [0,2,0,0,0,0|0,0,0]=2 1969 B12R1.435 CCc1cccc(c1)C(=O)NC WXVL_AK00442SD1421 [0,2,0,0,0,0|0,0,0]=2 1970 B12R1.435 CCc1ccnc(c1)C(=O)NC WXVL_AK00442SC00058 [0,2,0,0,0,0|1,0,0]=3 1971 B12R1.435 CCc1ccnc(c1)C(=O)NC WXVL_AK00442SC00058 [0,2,0,0,0,0|1,0,0]=3 1972 B12R1.435 CNC(=O)c1cc(ccn1)CO WXVL_AK00442SC1099 [0,2,0,0,0,0|1,0,0]=3 1973 B12R1.435 CNC(=O)c1cc(ccn1)CO WXVL_AK00442SC1099 [0,2,0,0,0,0|1,0,0]=3 1974 B12R1.435 CNC(=O)c1cc(ccn1)OC WXVL_AK00442SC0403 [0,2,0,0,0,0|1,0,0]=3 1975 B12R1.435 CNC(=O)c1cc(ccn1)OC WXVL_AK00442SC0403 [0,2,0,0,0,0|1,0,0]=3 1976 B12R1.435 CNC(=O)c1cccc(c1)C#N WXVL_AK00442SD0040 [0,2,0,0,0,0|0,0,0]=2 1977 B12R1.435 CNC(=O)c1cccc(c1)C#N WXVL_AK00442SD0040 [0,2,0,0,0,0|0,0,0]=2 1978 B12R1.435 CNC(=O)c1cccc(c1)CO WXVL_AK00442SD0821 [0,2,0,0,0,0|0,0,0]=2 1979 B12R1.435 CNC(=O)c1cccc(c1)CO WXVL_AK00442SD0821 [0,2,0,0,0,0|0,0,0]=2 1980 B12R1.435 CNC(=O)c1cccc(c1)OC WXVL_AK00442SD0048 [0,2,0,0,0,0|0,0,0]=2 1981 B12R1.435 CNC(=O)c1cccc(c1)OC WXVL_AK00442SD0048 [0,2,0,0,0,0|0,0,0]=2 1982 B12R1.435 CNC(=O)c1cccc(c1)SC WXVL_AK00442SD1394 [0,2,0,0,0,0|0,0,0]=2 1983 B12R1.435 CNC(=O)c1cccc(c1)SC WXVL_AK00442SD1394 [0,2,0,0,0,0|0,0,0]=2 1984 B12R1.435 CNC(=O)c1cccc(n1)OC WXVL_AK00442SC0024 [0,2,0,0,0,0|1,0,0]=3 1985 B12R1.435 CNC(=O)c1cccc(n1)OC WXVL_AK00442SC0024 [0,2,0,0,0,0|1,0,0]=3 1986 B12R1.435 CNC(=O)c1ccnc(c1)OC WXVL_AK00442SC0449 [0,2,0,0,0,0|1,0,0]=3 1987 B12R1.435 CNC(=O)c1ccnc(c1)OC WXVL_AK00442SC0449 [0,2,0,0,0,0|1,0,0]=3 1988 B12R1.435 CNC(=O)c1cncc(c1)OC WXVL_AK00442SC0570 [0,2,0,0,0,0|1,0,0]=3 1989 B12R1.435 CNC(=O)c1cncc(c1)OC WXVL_AK00442SC0570 [0,2,0,0,0,0|1,0,0]=3 1990 B12R1.124 CC1=CCC=CC1C(=O)N(C)C WXVL_AN0032SB0380 [0,2,0,0,0,0|0,0,2]=4 1991 B12R1.124 CC1=CCC=CC1C(=O)N(C)C WXVL_AN0032SB0380 [0,2,0,0,0,0|0,0,2]=4 1992 B12R1.124 CN(C)C(=O)c1ccccc1Br WXVL_AN0032SD0002 [0,2,0,0,0,0|0,0,0]=2 1993 B12R1.124 CN(C)C(=O)c1ccccc1Br WXVL_AN0032SD0002 [0,2,0,0,0,0|0,0,0]=2 1994 B12R1.124 CN(C)C(=O)c1ccccc1Cl WXVL_AN0032SD0006 [0,2,0,0,0,0|0,0,0]=2 1995 B12R1.124 CN(C)C(=O)c1ccccc1Cl WXVL_AN0032SD0006 [0,2,0,0,0,0|0,0,0]=2 1996 B12R1.124 CN(C)C(=O)c1ccccc1F WXVL_AN0032SD0003 [0,2,0,0,0,0|0,0,0]=2 1997 B12R1.124 CN(C)C(=O)c1ccccc1F WXVL_AN0032SD0003 [0,2,0,0,0,0|0,0,0]=2 1998 B12R1.124 CN(C)C(=O)c1ccccc1I WXVL_AN0032SD0303 [0,2,0,0,0,0|0,0,0]=2 1999 B12R1.124 CN(C)C(=O)c1ccccc1I WXVL_AN0032SD0303 [0,2,0,0,0,0|0,0,0]=2 2000 B12R1.124 CN(C)C(=O)c1ccccc1O WXVL_AN0032SD00056 [0,2,0,0,0,0|0,0,0]=2 2001 B12R1.124 CN(C)C(=O)c1ccccc1O WXVL_AN0032SD00056 [0,2,0,0,0,0|0,0,0]=2 2002 B12R1.124 CN(C)C(=O)c1ccccc1S WXVL_AN0032SD0153 [0,2,0,0,0,0|0,0,0]=2 2003 B12R1.124 CN(C)C(=O)c1ccccc1S WXVL_AN0032SD0153 [0,2,0,0,0,0|0,0,0]=2 2004 B12R1.124 CN(C)C(=O)c1cccnc1Br WXVL_AN0032SC0367 [0,2,0,0,0,0|1,0,0]=3 2005 B12R1.124 CN(C)C(=O)c1cccnc1Br WXVL_AN0032SC0367 [0,2,0,0,0,0|1,0,0]=3 2006 B12R1.124 CN(C)C(=O)c1cccnc1Cl WXVL_AN0032SC0146 [0,2,0,0,0,0|1,0,0]=3 2007 B12R1.124 CN(C)C(=O)c1cccnc1Cl WXVL_AN0032SC0146 [0,2,0,0,0,0|1,0,0]=3 2008 B12R1.124 CN(C)C(=O)c1cccnc1F WXVL_AN0032SC0350 [0,2,0,0,0,0|1,0,0]=3 2009 B12R1.124 CN(C)C(=O)c1cccnc1F WXVL_AN0032SC0350 [0,2,0,0,0,0|1,0,0]=3 2010 B12R1.124 CN(C)C(=O)c1cccnc1O WXVL_AN0032SC0063 [0,2,0,0,0,0|1,0,0]=3 2011 B12R1.124 CN(C)C(=O)c1cccnc1O WXVL_AN0032SC0063 [0,2,0,0,0,0|1,0,0]=3 2012 B12R1.124 CN(C)C(=O)c1ccncc1Br WXVL_AN0032SC0365 [0,2,0,0,0,0|1,0,0]=3 2013 B12R1.124 CN(C)C(=O)c1ccncc1Br WXVL_AN0032SC0365 [0,2,0,0,0,0|1,0,0]=3 2014 B12R1.124 CN(C)C(=O)c1ccncc1Cl WXVL_AN0032SC0375 [0,2,0,0,0,0|1,0,0]=3 2015 B12R1.124 CN(C)C(=O)c1ccncc1Cl WXVL_AN0032SC0375 [0,2,0,0,0,0|1,0,0]=3 2016 B12R1.124 CN(C)C(=O)c1ccncc1F WXVL_AN0032SC0320 [0,2,0,0,0,0|1,0,0]=3 2017 B12R1.124 CN(C)C(=O)c1ccncc1F WXVL_AN0032SC0320 [0,2,0,0,0,0|1,0,0]=3 2018 B12R1.124 CN(C)C(=O)c1ccncc1O WXVL_AN0032SC0354 [0,2,0,0,0,0|1,0,0]=3 2019 B12R1.124 CN(C)C(=O)c1ccncc1O WXVL_AN0032SC0354 [0,2,0,0,0,0|1,0,0]=3 2020 B12R1.124 CN(C)C(=O)c1ccnnc1O WXVL_AN0032SC0899 [0,2,0,0,0,0|2,0,0]=4 2021 B12R1.124 CN(C)C(=O)c1ccnnc1O WXVL_AN0032SC0899 [0,2,0,0,0,0|2,0,0]=4 2022 B12R1.124 CN(C)C(=O)c1cnccc1Br WXVL_AN0032SC0500 [0,2,0,0,0,0|1,0,0]=3 2023 B12R1.124 CN(C)C(=O)c1cnccc1Br WXVL_AN0032SC0500 [0,2,0,0,0,0|1,0,0]=3 2024 B12R1.124 CN(C)C(=O)c1cnccc1Cl WXVL_AN0032SC0340 [0,2,0,0,0,0|1,0,0]=3 2025 B12R1.124 CN(C)C(=O)c1cnccc1Cl WXVL_AN0032SC0340 [0,2,0,0,0,0|1,0,0]=3 2026 B12R1.124 CN(C)C(=O)c1ncccc1Br WXVL_AN0032SC0501 [0,2,0,0,0,0|1,0,0]=3 2027 B12R1.124 CN(C)C(=O)c1ncccc1Br WXVL_AN0032SC0501 [0,2,0,0,0,0|1,0,0]=3 2028 B12R1.124 CN(C)C(=O)c1ncccc1Cl WXVL_AN0032SC0609 [0,2,0,0,0,0|1,0,0]=3 2029 B12R1.124 CN(C)C(=O)c1ncccc1Cl WXVL_AN0032SC0609 [0,2,0,0,0,0|1,0,0]=3 2030 B12R1.124 CN(C)C(=O)c1ncccc1F WXVL_AN0032SC0773 [0,2,0,0,0,0|1,0,0]=3 2031 B12R1.124 CN(C)C(=O)c1ncccc1F WXVL_AN0032SC0773 [0,2,0,0,0,0|1,0,0]=3 2032 B12R1.124 CN(C)C(=O)c1nccnc1Br WXVL_AN0032SC0785 [0,2,0,0,0,0|2,0,0]=4 2033 B12R1.124 CN(C)C(=O)c1nccnc1Br WXVL_AN0032SC0785 [0,2,0,0,0,0|2,0,0]=4 2034 B12R1.124 CN(C)C(=O)c1nccnc1Cl WXVL_AN0032SC0361 [0,2,0,0,0,0|2,0,0]=4 2035 B12R1.124 CN(C)C(=O)c1nccnc1Cl WXVL_AN0032SC0361 [0,2,0,0,0,0|2,0,0]=4 2036 B12R1.124 Cc1ccccc1C(=O)N(C)C WXVL_AN0032SD0037 [0,2,0,0,0,0|0,0,0]=2 2037 B12R1.124 Cc1ccccc1C(=O)N(C)C WXVL_AN0032SD0037 [0,2,0,0,0,0|0,0,0]=2 2038 B12R1.124 Cc1cccnc1C(=O)N(C)C WXVL_AN0032SC0008 [0,2,0,0,0,0|1,0,0]=3 2039 B12R1.124 Cc1cccnc1C(=O)N(C)C WXVL_AN0032SC0008 [0,2,0,0,0,0|1,0,0]=3 2040 B12R1.124 Cc1ccncc1C(=O)N(C)C WXVL_AN0032SC0301 [0,2,0,0,0,0|1,0,0]=3 2041 B12R1.124 Cc1ccncc1C(=O)N(C)C WXVL_AN0032SC0301 [0,2,0,0,0,0|1,0,0]=3 2042 B12R1.124 Cc1cnncc1C(=O)N(C)C WXVL_AN0032SC0973 [0,2,0,0,0,0|2,0,0]=4 2043 B12R1.124 Cc1cnncc1C(=O)N(C)C WXVL_AN0032SC0973 [0,2,0,0,0,0|2,0,0]=4 2044 B12R1.124 Cc1ncccc1C(=O)N(C)C WXVL_AN0032SC0065 [0,2,0,0,0,0|1,0,0]=3 2045 B12R1.124 Cc1ncccc1C(=O)N(C)C WXVL_AN0032SC0065 [0,2,0,0,0,0|1,0,0]=3 2046 B12R1.124 Cc1ncncc1C(=O)N(C)C WXVL_AN0032SC0515 [0,2,0,0,0,0|2,0,0]=4 2047 B12R1.124 Cc1ncncc1C(=O)N(C)C WXVL_AN0032SC0515 [0,2,0,0,0,0|2,0,0]=4 2048 B12R1.77 C#Cc1ccccc1C(=O)NC WXVL_AK00442SD1151 [0,2,0,0,0,0|0,0,0]=2 2049 B12R1.77 C#Cc1ccccc1C(=O)NC WXVL_AK00442SD1151 [0,2,0,0,0,0|0,0,0]=2 2050 B12R1.77 CCc1ccccc1C(=O)NC WXVL_AK00442SD0112 [0,2,0,0,0,0|0,0,0]=2 2051 B12R1.77 CCc1ccccc1C(=O)NC WXVL_AK00442SD0112 [0,2,0,0,0,0|0,0,0]=2 2052 B12R1.77 CCc1ncccc1C(=O)NC WXVL_AK00442SC1247 [0,2,0,0,0,0|1,0,0]=3 2053 B12R1.77 CCc1ncccc1C(=O)NC WXVL_AK00442SC1247 [0,2,0,0,0,0|1,0,0]=3 2054 B12R1.77 CNC(=O)c1ccccc1C#N WXVL_AK00442SD0111 [0,2,0,0,0,0|0,0,0]=2 2055 B12R1.77 CNC(=O)c1ccccc1C#N WXVL_AK00442SD0111 [0,2,0,0,0,0|0,0,0]=2 2056 B12R1.77 CNC(=O)c1ccccc1CO WXVL_AK00442SD1772 [0,2,0,0,0,0|0,0,0]=2 2057 B12R1.77 CNC(=O)c1ccccc1CO WXVL_AK00442SD1772 [0,2,0,0,0,0|0,0,0]=2 2058 B12R1.77 CNC(=O)c1ccccc1OC WXVL_AK00442SD0016 [0,2,0,0,0,0|0,0,0]=2 2059 B12R1.77 CNC(=O)c1ccccc1OC WXVL_AK00442SD0016 [0,2,0,0,0,0|0,0,0]=2 2060 B12R1.77 CNC(=O)c1ccccc1SC WXVL_AK00442SD0102 [0,2,0,0,0,0|0,0,0]=2 2061 B12R1.77 CNC(=O)c1ccccc1SC WXVL_AK00442SD0102 [0,2,0,0,0,0|0,0,0]=2 2062 B12R1.77 CNC(=O)c1cccnc1OC WXVL_AK00442SC0078 [0,2,0,0,0,0|1,0,0]=3 2063 B12R1.77 CNC(=O)c1cccnc1OC WXVL_AK00442SC0078 [0,2,0,0,0,0|1,0,0]=3 2064 B12R1.77 CNC(=O)c1cccnc1SC WXVL_AK00442SC0821 [0,2,0,0,0,0|1,0,0]=3 2065 B12R1.77 CNC(=O)c1cccnc1SC WXVL_AK00442SC0821 [0,2,0,0,0,0|1,0,0]=3 2066 B12R1.77 CNC(=O)c1cnccc1C#N WXVL_AK00442SC0979 [0,2,0,0,0,0|1,0,0]=3 2067 B12R1.77 CNC(=O)c1cnccc1C#N WXVL_AK00442SC0979 [0,2,0,0,0,0|1,0,0]=3 2068 B12R1.77 CNC(=O)c1ncccc1OC WXVL_AK00442SC0817 [0,2,0,0,0,0|1,0,0]=3 2069 B12R1.77 CNC(=O)c1ncccc1OC WXVL_AK00442SC0817 [0,2,0,0,0,0|1,0,0]=3 2070 B12R1.77 CNC(=O)c1nccnc1OC WXVL_AK00442SC1246 [0,2,0,0,0,0|2,0,0]=4 2071 B12R1.77 CNC(=O)c1nccnc1OC WXVL_AK00442SC1246 [0,2,0,0,0,0|2,0,0]=4 2072 B12R1.3441 CNC(=O)c1c(cccc1Br)Br WXVL_AK00442SD0851 [0,2,0,0,0,0|0,0,0]=2 2073 B12R1.3441 CNC(=O)c1c(cccc1Br)Br WXVL_AK00442SD0851 [0,2,0,0,0,0|0,0,0]=2 2074 B12R1.3441 CNC(=O)c1c(cccc1Br)C WXVL_AK00442SD1153 [0,2,0,0,0,0|0,0,0]=2 2075 B12R1.3441 CNC(=O)c1c(cccc1Br)C WXVL_AK00442SD1153 [0,2,0,0,0,0|0,0,0]=2 2076 B12R1.3441 CNC(=O)c1c(cccc1Br)Cl WXVL_AK00442SD0506 [0,2,0,0,0,0|0,0,0]=2 2077 B12R1.3441 CNC(=O)c1c(cccc1Br)Cl WXVL_AK00442SD0506 [0,2,0,0,0,0|0,0,0]=2 2078 B12R1.3441 CNC(=O)c1c(cccc1Br)F WXVL_AK00442SD0403 [0,2,0,0,0,0|0,0,0]=2 2079 B12R1.3441 CNC(=O)c1c(cccc1Br)F WXVL_AK00442SD0403 [0,2,0,0,0,0|0,0,0]=2 2080 B12R1.3441 CNC(=O)c1c(cccc1Br)O WXVL_AK00442SD1602 [0,2,0,0,0,0|0,0,0]=2 2081 B12R1.3441 CNC(=O)c1c(cccc1Br)O WXVL_AK00442SD1602 [0,2,0,0,0,0|0,0,0]=2 2082 B12R1.3441 CNC(=O)c1c(cccc1C)C WXVL_AK00442SD0861 [0,2,0,0,0,0|0,0,0]=2 2083 B12R1.3441 CNC(=O)c1c(cccc1C)C WXVL_AK00442SD0861 [0,2,0,0,0,0|0,0,0]=2 2084 B12R1.3441 CNC(=O)c1c(cccc1Cl)C WXVL_AK00442SD0615 [0,2,0,0,0,0|0,0,0]=2 2085 B12R1.3441 CNC(=O)c1c(cccc1Cl)C WXVL_AK00442SD0615 [0,2,0,0,0,0|0,0,0]=2 2086 B12R1.3441 CNC(=O)c1c(cccc1Cl)Cl WXVL_AK00442SD0012 [0,2,0,0,0,0|0,0,0]=2 2087 B12R1.3441 CNC(=O)c1c(cccc1Cl)Cl WXVL_AK00442SD0012 [0,2,0,0,0,0|0,0,0]=2 2088 B12R1.3441 CNC(=O)c1c(cccc1Cl)F WXVL_AK00442SD0011 [0,2,0,0,0,0|0,0,0]=2 2089 B12R1.3441 CNC(=O)c1c(cccc1Cl)F WXVL_AK00442SD0011 [0,2,0,0,0,0|0,0,0]=2 2090 B12R1.3441 CNC(=O)c1c(cccc1Cl)O WXVL_AK00442SD0796 [0,2,0,0,0,0|0,0,0]=2 2091 B12R1.3441 CNC(=O)c1c(cccc1Cl)O WXVL_AK00442SD0796 [0,2,0,0,0,0|0,0,0]=2 2092 B12R1.3441 CNC(=O)c1c(cccc1F)C WXVL_AK00442SD0136 [0,2,0,0,0,0|0,0,0]=2 2093 B12R1.3441 CNC(=O)c1c(cccc1F)C WXVL_AK00442SD0136 [0,2,0,0,0,0|0,0,0]=2 2094 B12R1.3441 CNC(=O)c1c(cccc1F)F WXVL_AK00442SD0005 [0,2,0,0,0,0|0,0,0]=2 2095 B12R1.3441 CNC(=O)c1c(cccc1F)F WXVL_AK00442SD0005 [0,2,0,0,0,0|0,0,0]=2 2096 B12R1.3441 CNC(=O)c1c(cccc1F)O WXVL_AK00442SD0472 [0,2,0,0,0,0|0,0,0]=2 2097 B12R1.3441 CNC(=O)c1c(cccc1F)O WXVL_AK00442SD0472 [0,2,0,0,0,0|0,0,0]=2 2098 B12R1.3441 CNC(=O)c1c(cccc1I)Cl WXVL_AK00442SD1366 [0,2,0,0,0,0|0,0,0]=2 2099 B12R1.3441 CNC(=O)c1c(cccc1I)Cl WXVL_AK00442SD1366 [0,2,0,0,0,0|0,0,0]=2 2100 B12R1.3441 CNC(=O)c1c(cccc1I)F WXVL_AK00442SD0526 [0,2,0,0,0,0|0,0,0]=2 2101 B12R1.3441 CNC(=O)c1c(cccc1I)F WXVL_AK00442SD0526 [0,2,0,0,0,0|0,0,0]=2 2102 B12R1.3441 CNC(=O)c1c(cccc1O)C WXVL_AK00442SD0804 [0,2,0,0,0,0|0,0,0]=2 2103 B12R1.3441 CNC(=O)c1c(cccc1O)C WXVL_AK00442SD0804 [0,2,0,0,0,0|0,0,0]=2 2104 B12R1.3441 CNC(=O)c1c(cccc1O)O WXVL_AK00442SD0150 [0,2,0,0,0,0|0,0,0]=2 2105 B12R1.3441 CNC(=O)c1c(cccc1O)O WXVL_AK00442SD0150 [0,2,0,0,0,0|0,0,0]=2 2106 B12R1.3441 CNC(=O)c1c(ccnc1Cl)Br WXVL_AK00442SC2040 [0,2,0,0,0,0|1,0,0]=3 2107 B12R1.3441 CNC(=O)c1c(ccnc1Cl)Br WXVL_AK00442SC2040 [0,2,0,0,0,0|1,0,0]=3 2108 B12R1.3441 CNC(=O)c1c(ccnc1Cl)C WXVL_AK00442SC2681 [0,2,0,0,0,0|1,0,0]=3 2109 B12R1.3441 CNC(=O)c1c(ccnc1Cl)C WXVL_AK00442SC2681 [0,2,0,0,0,0|1,0,0]=3 2110 B12R1.3441 CNC(=O)c1c(ccnc1Cl)Cl WXVL_AK00442SC0351 [0,2,0,0,0,0|1,0,0]=3 2111 B12R1.3441 CNC(=O)c1c(ccnc1Cl)Cl WXVL_AK00442SC0351 [0,2,0,0,0,0|1,0,0]=3 2112 B12R1.3441 CNC(=O)c1c(ccnc1Cl)F WXVL_AK00442SC1022 [0,2,0,0,0,0|1,0,0]=3 2113 B12R1.3441 CNC(=O)c1c(ccnc1Cl)F WXVL_AK00442SC1022 [0,2,0,0,0,0|1,0,0]=3 2114 B12R1.3441 CNC(=O)c1c(ccnc1Cl)I WXVL_AK00442SC0532 [0,2,0,0,0,0|1,0,0]=3 2115 B12R1.3441 CNC(=O)c1c(ccnc1Cl)I WXVL_AK00442SC0532 [0,2,0,0,0,0|1,0,0]=3 2116 B12R1.3441 CNC(=O)c1c(ccnc1F)I WXVL_AK00442SC0218 [0,2,0,0,0,0|1,0,0]=3 2117 B12R1.3441 CNC(=O)c1c(ccnc1F)I WXVL_AK00442SC0218 [0,2,0,0,0,0|1,0,0]=3 2118 B12R1.3441 CNC(=O)c1c(cncc1Br)Br WXVL_AK00442SC0748 [0,2,0,0,0,0|1,0,0]=3 2119 B12R1.3441 CNC(=O)c1c(cncc1Br)Br WXVL_AK00442SC0748 [0,2,0,0,0,0|1,0,0]=3 2120 B12R1.3441 CNC(=O)c1c(cncc1Br)F WXVL_AK00442SC1080 [0,2,0,0,0,0|1,0,0]=3 2121 B12R1.3441 CNC(=O)c1c(cncc1Br)F WXVL_AK00442SC1080 [0,2,0,0,0,0|1,0,0]=3 2122 B12R1.3441 CNC(=O)c1c(cncc1Cl)Cl WXVL_AK00442SC0173 [0,2,0,0,0,0|1,0,0]=3 2123 B12R1.3441 CNC(=O)c1c(cncc1Cl)Cl WXVL_AK00442SC0173 [0,2,0,0,0,0|1,0,0]=3 2124 B12R1.3441 CNC(=O)c1c(cncc1F)F WXVL_AK00442SC0642 [0,2,0,0,0,0|1,0,0]=3 2125 B12R1.3441 CNC(=O)c1c(cncc1F)F WXVL_AK00442SC0642 [0,2,0,0,0,0|1,0,0]=3 2126 B10R1.27 CNC(=O)Cc1cccs1 WXVL_AK00442SA0018 [0,0,1,1,0,0|1,0,1]=4 2127 B10R1.27 CNC(=O)Cc1cccs1 WXVL_AK00442SA0018 [0,0,1,1,0,0|1,0,1]=4 2128 B10R1.27 CNC(=O)Cc1ccsc1 WXVL_AK00442SA0020 [0,0,1,1,0,0|1,0,1]=4 2129 B10R1.27 CNC(=O)Cc1ccsc1 WXVL_AK00442SA0020 [0,0,1,1,0,0|1,0,1]=4 2130 B12R2.2 c1ccc(cc1)c2cn[nH]n2 WXVL_LR0395BT0919 [0,1,0,1,0,0|2,0,0]=4 2131 B12R2.2 c1ccc(cc1)c2cn[nH]n2 WXVL_LR0395BT1115 [0,1,0,1,0,0|2,0,0]=4 2132 B12R2.2 c1ccc(cc1)c2cn[nH]n2 WXVL_LR0395BT2957 [0,1,0,1,0,0|2,0,0]=4 2133 B12R2.2 c1ccc(cc1)c2cnc[nH]2 WXVL_LR0418BT0919 [0,1,0,1,0,0|1,0,1]=4 2134 B12R2.2 c1ccc(cc1)c2cnc[nH]2 WXVL_LR0418BT1115 [0,1,0,1,0,0|1,0,1]=4 2135 B12R2.2 c1ccc(cc1)c2cnc[nH]2 WXVL_LR0418BT2957 [0,1,0,1,0,0|1,0,1]=4 2136 B12R2.2 c1ccc(cc1)c2nc[nH]n2 WXVL_LR0419BT0919 [0,1,0,1,0,0|1,0,1]=4 2137 B12R2.2 c1ccc(cc1)c2nc[nH]n2 WXVL_LR0419BT1115 [0,1,0,1,0,0|1,0,1]=4 2138 B12R2.2 c1ccc(cc1)c2nc[nH]n2 WXVL_LR0419BT2957 [0,1,0,1,0,0|1,0,1]=4 2139 B8R1.7 NC(=O)c1c[nH]cn1 WXVL_AK0084SC0074 [1,0,0,0,1,0|2,0,0]=4 2140 B8R1.7 NC(=O)c1c[nH]cn1 WXVL_AK0084SC0074 [1,0,0,0,1,0|2,0,0]=4 2141 B8R1.7 NC(=O)c1cc[nH]c1 WXVL_AK0084SC0013 [1,0,0,0,1,0|1,0,0]=3 2142 B8R1.7 NC(=O)c1cc[nH]c1 WXVL_AK0084SC0013 [1,0,0,0,1,0|1,0,0]=3 2143 B8R1.7 NC(=O)c1cc[nH]n1 WXVL_AK0084SC0003 [1,0,0,0,1,0|2,0,0]=4 2144 B8R1.7 NC(=O)c1cc[nH]n1 WXVL_AK0084SC0003 [1,0,0,0,1,0|2,0,0]=4 2145 B8R1.7 NC(=O)c1ccco1 WXVL_AK0084SC0049 [1,0,0,0,1,0|1,0,0]=3 2146 B8R1.7 NC(=O)c1ccco1 WXVL_AK0084SC0049 [1,0,0,0,1,0|1,0,0]=3 2147 B8R1.7 NC(=O)c1cccs1 WXVL_AK0084SC0051 [1,0,0,0,1,0|1,0,0]=3 2148 B8R1.7 NC(=O)c1cccs1 WXVL_AK0084SC0051 [1,0,0,0,1,0|1,0,0]=3 2149 B8R1.7 NC(=O)c1ccno1 WXVL_AK0084SC0080 [1,0,0,0,1,0|2,0,0]=4 2150 B8R1.7 NC(=O)c1ccno1 WXVL_AK0084SC0080 [1,0,0,0,1,0|2,0,0]=4 2151 B8R1.7 NC(=O)c1ccns1 WXVL_AK0084SC0027 [1,0,0,0,1,0|2,0,0]=4 2152 B8R1.7 NC(=O)c1ccns1 WXVL_AK0084SC0027 [1,0,0,0,1,0|2,0,0]=4 2153 B8R1.7 NC(=O)c1ccoc1 WXVL_AK0084SC0050 [1,0,0,0,1,0|1,0,0]=3 2154 B8R1.7 NC(=O)c1ccoc1 WXVL_AK0084SC0050 [1,0,0,0,1,0|1,0,0]=3 2155 B8R1.7 NC(=O)c1ccon1 WXVL_AK0084SC0116 [1,0,0,0,1,0|2,0,0]=4 2156 B8R1.7 NC(=O)c1ccon1 WXVL_AK0084SC0116 [1,0,0,0,1,0|2,0,0]=4 2157 B8R1.7 NC(=O)c1ccsc1 WXVL_AK0084SC0054 [1,0,0,0,1,0|1,0,0]=3 2158 B8R1.7 NC(=O)c1ccsc1 WXVL_AK0084SC0054 [1,0,0,0,1,0|1,0,0]=3 2159 B8R1.7 NC(=O)c1ccsn1 WXVL_AK0084SC0764 [1,0,0,0,1,0|2,0,0]=4 2160 B8R1.7 NC(=O)c1ccsn1 WXVL_AK0084SC0764 [1,0,0,0,1,0|2,0,0]=4 2161 B8R1.7 NC(=O)c1cn[nH]c1 WXVL_AK0084SC0254 [1,0,0,0,1,0|2,0,0]=4 2162 B8R1.7 NC(=O)c1cn[nH]c1 WXVL_AK0084SC0254 [1,0,0,0,1,0|2,0,0]=4 2163 B8R1.7 NC(=O)c1cnc[nH]1 WXVL_AK0084SC0247 [1,0,0,0,1,0|2,0,0]=4 2164 B8R1.7 NC(=O)c1cnc[nH]1 WXVL_AK0084SC0247 [1,0,0,0,1,0|2,0,0]=4 2165 B8R1.7 NC(=O)c1cnco1 WXVL_AK0084SC0018 [1,0,0,0,1,0|2,0,0]=4 2166 B8R1.7 NC(=O)c1cnco1 WXVL_AK0084SC0018 [1,0,0,0,1,0|2,0,0]=4 2167 B8R1.7 NC(=O)c1cncs1 WXVL_AK0084SC0113 [1,0,0,0,1,0|2,0,0]=4 2168 B8R1.7 NC(=O)c1cncs1 WXVL_AK0084SC0113 [1,0,0,0,1,0|2,0,0]=4 2169 B8R1.7 NC(=O)c1cocn1 WXVL_AK0084SC0118 [1,0,0,0,1,0|2,0,0]=4 2170 B8R1.7 NC(=O)c1cocn1 WXVL_AK0084SC0118 [1,0,0,0,1,0|2,0,0]=4 2171 B8R1.7 NC(=O)c1cscn1 WXVL_AK0084SC0092 [1,0,0,0,1,0|2,0,0]=4 2172 B8R1.7 NC(=O)c1cscn1 WXVL_AK0084SC0092 [1,0,0,0,1,0|2,0,0]=4 2173 B8R1.7 NC(=O)c1nccs1 WXVL_AK0084SC0110 [1,0,0,0,1,0|2,0,0]=4 2174 B8R1.7 NC(=O)c1nccs1 WXVL_AK0084SC0110 [1,0,0,0,1,0|2,0,0]=4 2175 B12R1.27 C#CC(=O)NCc1ccccc1 WXVL_AK00502SB0338 [0,0,0,0,0,2|1,0,1]=4 2176 B12R1.27 C#CC(=O)NCc1ccccc1 WXVL_AK00502SB0338 [0,0,0,0,0,2|1,0,1]=4 2177 B12R1.27 CCC(=O)NCc1ccccc1 WXVL_AK00502SB0064 [0,0,0,0,0,2|1,0,0]=3 2178 B12R1.27 CCC(=O)NCc1ccccc1 WXVL_AK00502SB0064 [0,0,0,0,0,2|1,0,0]=3 2179 B12R1.27 CCC(=O)NCc1ccccn1 WXVL_AK0018SB0064 [0,0,0,0,0,2|2,0,0]=4 2180 B12R1.27 CCC(=O)NCc1ccccn1 WXVL_AK0018SB0064 [0,0,0,0,0,2|2,0,0]=4 2181 B12R1.27 CCC(=O)NCc1cccnc1 WXVL_AK0020SB0064 [0,0,0,0,0,2|2,0,0]=4 2182 B12R1.27 CCC(=O)NCc1cccnc1 WXVL_AK0020SB0064 [0,0,0,0,0,2|2,0,0]=4 2183 B12R1.27 CCC(=O)NCc1ccncc1 WXVL_AK0021SB0064 [0,0,0,0,0,2|2,0,0]=4 2184 B12R1.27 CCC(=O)NCc1ccncc1 WXVL_AK0021SB0064 [0,0,0,0,0,2|2,0,0]=4 2185 B12R1.27 CNC(=O)/C=C/c1ccccc1 WXVL_AK00442SB0115 [0,0,0,0,0,2|0,0,0]=2 2186 B12R1.27 CNC(=O)/C=C/c1ccccc1 WXVL_AK00442SB0115 [0,0,0,0,0,2|0,0,0]=2 2187 B12R1.27 CNC(=O)/C=C/c1cccnc1 WXVL_AK00442SA0193 [0,0,0,0,0,2|1,0,0]=3 2188 B12R1.27 CNC(=O)/C=C/c1cccnc1 WXVL_AK00442SA0193 [0,0,0,0,0,2|1,0,0]=3 2189 B12R1.27 CNC(=O)/C=C/c1cnccn1 WXVL_AK00442SA2885 [0,0,0,0,0,2|2,0,0]=4 2190 B12R1.27 CNC(=O)/C=C/c1cnccn1 WXVL_AK00442SA2885 [0,0,0,0,0,2|2,0,0]=4 2191 B12R1.27 CNC(=O)C#Cc1ccccc1 WXVL_AK00442SB0114 [0,0,0,0,0,2|0,0,0]=2 2192 B12R1.27 CNC(=O)C#Cc1ccccc1 WXVL_AK00442SB0114 [0,0,0,0,0,2|0,0,0]=2 2193 B12R1.27 CNC(=O)CCc1ccccc1 WXVL_AK00442SB0067 [0,0,0,0,0,2|0,0,0]=2 2194 B12R1.27 CNC(=O)CCc1ccccc1 WXVL_AK00442SB0067 [0,0,0,0,0,2|0,0,0]=2 2195 B12R1.27 CNC(=O)CCc1ccccn1 WXVL_AK00442SA0316 [0,0,0,0,0,2|1,0,0]=3 2196 B12R1.27 CNC(=O)CCc1ccccn1 WXVL_AK00442SA0316 [0,0,0,0,0,2|1,0,0]=3 2197 B12R1.27 CNC(=O)CCc1cccnc1 WXVL_AK00442SA0031 [0,0,0,0,0,2|1,0,0]=3 2198 B12R1.27 CNC(=O)CCc1cccnc1 WXVL_AK00442SA0031 [0,0,0,0,0,2|1,0,0]=3 2199 B12R1.27 CNC(=O)CCc1cnccn1 WXVL_AK00442SA2354 [0,0,0,0,0,2|2,0,0]=4 2200 B12R1.27 CNC(=O)CCc1cnccn1 WXVL_AK00442SA2354 [0,0,0,0,0,2|2,0,0]=4 2201 B12R1.27 CNC(=O)CCc1cncnc1 WXVL_AK00442SA0013 [0,0,0,0,0,2|2,0,0]=4 2202 B12R1.27 CNC(=O)CCc1cncnc1 WXVL_AK00442SA0013 [0,0,0,0,0,2|2,0,0]=4 2203 B12R1.27 CNC(=O)CNc1ccncn1 WXVL_AK1222LP3358 [0,0,0,0,0,2|2,0,0]=4 2204 B12R1.27 CNC(=O)CNc1ccncn1 WXVL_AK1222LP3358 [0,0,0,0,0,2|2,0,0]=4 2205 B12R1.27 CNC(=O)CNc1ncccn1 WXVL_AK1222LP0002 [0,0,0,0,0,2|2,0,0]=4 2206 B12R1.27 CNC(=O)CNc1ncccn1 WXVL_AK1222LP0002 [0,0,0,0,0,2|2,0,0]=4 2207 B12R1.27 CNC(=O)COc1ccccc1 WXVL_AK00442SB0086 [0,0,0,0,0,2|0,0,0]=2 2208 B12R1.27 CNC(=O)COc1ccccc1 WXVL_AK00442SB0086 [0,0,0,0,0,2|0,0,0]=2 2209 B12R1.27 CNC(=O)COc1cccnc1 WXVL_AK00442SA0051 [0,0,0,0,0,2|1,0,0]=3 2210 B12R1.27 CNC(=O)COc1cccnc1 WXVL_AK00442SA0051 [0,0,0,0,0,2|1,0,0]=3 2211 B12R1.27 CNC(=O)CSc1ccccc1 WXVL_AK00442SB0113 [0,0,0,0,0,2|0,0,0]=2 2212 B12R1.27 CNC(=O)CSc1ccccc1 WXVL_AK00442SB0113 [0,0,0,0,0,2|0,0,0]=2 2213 B12R1.27 CNC(=O)CSc1ccncc1 WXVL_AK00442SA0055 [0,0,0,0,0,2|1,0,0]=3 2214 B12R1.27 CNC(=O)CSc1ccncc1 WXVL_AK00442SA0055 [0,0,0,0,0,2|1,0,0]=3 2215 B12R1.27 CNC(=O)CSc1ncccn1 WXVL_AK00442SA0022 [0,0,0,0,0,2|2,0,0]=4 2216 B12R1.27 CNC(=O)CSc1ncccn1 WXVL_AK00442SA0022 [0,0,0,0,0,2|2,0,0]=4 2217 B12R1.27 O=C(CO)NCc1ccccc1 WXVL_AK00502SB2706 [0,0,0,0,0,2|2,0,0]=4 2218 B12R1.27 O=C(CO)NCc1ccccc1 WXVL_AK00502SB2706 [0,0,0,0,0,2|2,0,0]=4