0 B9R1.6 CN(C)c1ccncn1 WXVL_AN0032LP3358 [0,0,0,0,0,0|4,0,0]=4 1 B9R1.6 CN(C)c1ccncn1 WXVL_AN0032LP3358 [0,0,0,0,0,0|4,0,0]=4 2 B9R1.6 CN(C)c1ncccn1 WXVL_AN0032LP0002 [0,0,0,0,0,0|4,0,0]=4 3 B9R1.6 CN(C)c1ncccn1 WXVL_AN0032LP0002 [0,0,0,0,0,0|4,0,0]=4 4 B9R1.6 NC(=O)c1ccccc1 WXVL_AK0084SD0001 [0,0,0,0,0,0|1,0,2]=3 5 B9R1.6 NC(=O)c1ccccc1 WXVL_AK0084SD0001 [0,0,0,0,0,0|1,0,2]=3 6 B9R1.6 NC(=O)c1ccccn1 WXVL_AK0084SC0058 [0,0,0,0,0,0|2,0,2]=4 7 B9R1.6 NC(=O)c1ccccn1 WXVL_AK0084SC0058 [0,0,0,0,0,0|2,0,2]=4 8 B9R1.6 NC(=O)c1cccnc1 WXVL_AK0084SC0061 [0,0,0,0,0,0|2,0,2]=4 9 B9R1.6 NC(=O)c1cccnc1 WXVL_AK0084SC0061 [0,0,0,0,0,0|2,0,2]=4 10 B9R1.6 NC(=O)c1ccncc1 WXVL_AK0084SC0062 [0,0,0,0,0,0|2,0,2]=4 11 B9R1.6 NC(=O)c1ccncc1 WXVL_AK0084SC0062 [0,0,0,0,0,0|2,0,2]=4 12 B8R1.2 CNc1ccncn1 WXVL_AK00442LP3358 [1,0,0,0,0,0|3,0,0]=4 13 B8R1.2 CNc1ccncn1 WXVL_AK00442LP3358 [1,0,0,0,0,0|3,0,0]=4 14 B8R1.2 CNc1ncccn1 WXVL_AK00442LP0002 [1,0,0,0,0,0|3,0,0]=4 15 B8R1.2 CNc1ncccn1 WXVL_AK00442LP0002 [1,0,0,0,0,0|3,0,0]=4 16 B10R1.13 Cc1ccc(cc1)C(=O)N WXVL_AK0084SD0078 [0,1,0,0,0,0|1,0,2]=4 17 B10R1.13 Cc1ccc(cc1)C(=O)N WXVL_AK0084SD0078 [0,1,0,0,0,0|1,0,2]=4 18 B10R1.13 NC(=O)c1ccc(cc1)Br WXVL_AK0084SD0060 [0,1,0,0,0,0|1,0,2]=4 19 B10R1.13 NC(=O)c1ccc(cc1)Br WXVL_AK0084SD0060 [0,1,0,0,0,0|1,0,2]=4 20 B10R1.13 NC(=O)c1ccc(cc1)Cl WXVL_AK0084SD0062 [0,1,0,0,0,0|1,0,2]=4 21 B10R1.13 NC(=O)c1ccc(cc1)Cl WXVL_AK0084SD0062 [0,1,0,0,0,0|1,0,2]=4 22 B10R1.13 NC(=O)c1ccc(cc1)F WXVL_AK0084SD0061 [0,1,0,0,0,0|1,0,2]=4 23 B10R1.13 NC(=O)c1ccc(cc1)F WXVL_AK0084SD0061 [0,1,0,0,0,0|1,0,2]=4 24 B10R1.13 NC(=O)c1ccc(cc1)I WXVL_AK0084SD0421 [0,1,0,0,0,0|1,0,2]=4 25 B10R1.13 NC(=O)c1ccc(cc1)I WXVL_AK0084SD0421 [0,1,0,0,0,0|1,0,2]=4 26 B10R1.13 NC(=O)c1ccc(cc1)O WXVL_AK0084SD0069 [0,1,0,0,0,0|1,0,2]=4 27 B10R1.13 NC(=O)c1ccc(cc1)O WXVL_AK0084SD0069 [0,1,0,0,0,0|1,0,2]=4 28 B10R1.13 NC(=O)c1ccc(cc1)S WXVL_AK0084SD0154 [0,1,0,0,0,0|1,0,2]=4 29 B10R1.13 NC(=O)c1ccc(cc1)S WXVL_AK0084SD0154 [0,1,0,0,0,0|1,0,2]=4 30 B10R1.15 CNC(=O)c1ccccc1 WXVL_AK00442SD0001 [0,1,0,0,0,0|0,0,2]=3 31 B10R1.15 CNC(=O)c1ccccc1 WXVL_AK00442SD0001 [0,1,0,0,0,0|0,0,2]=3 32 B10R1.15 CNC(=O)c1ccccn1 WXVL_AK00442SC0058 [0,1,0,0,0,0|1,0,2]=4 33 B10R1.15 CNC(=O)c1ccccn1 WXVL_AK00442SC0058 [0,1,0,0,0,0|1,0,2]=4 34 B10R1.15 CNC(=O)c1cccnc1 WXVL_AK00442SC0061 [0,1,0,0,0,0|1,0,2]=4 35 B10R1.15 CNC(=O)c1cccnc1 WXVL_AK00442SC0061 [0,1,0,0,0,0|1,0,2]=4 36 B10R1.15 CNC(=O)c1ccncc1 WXVL_AK00442SC0062 [0,1,0,0,0,0|1,0,2]=4 37 B10R1.15 CNC(=O)c1ccncc1 WXVL_AK00442SC0062 [0,1,0,0,0,0|1,0,2]=4 38 B10R1.61 Cc1ccccc1C(=O)N WXVL_AK0084SD0037 [0,1,0,0,0,0|1,0,2]=4 39 B10R1.61 Cc1ccccc1C(=O)N WXVL_AK0084SD0037 [0,1,0,0,0,0|1,0,2]=4 40 B10R1.61 NC(=O)c1ccccc1Br WXVL_AK0084SD0002 [0,1,0,0,0,0|1,0,2]=4 41 B10R1.61 NC(=O)c1ccccc1Br WXVL_AK0084SD0002 [0,1,0,0,0,0|1,0,2]=4 42 B10R1.61 NC(=O)c1ccccc1Cl WXVL_AK0084SD0006 [0,1,0,0,0,0|1,0,2]=4 43 B10R1.61 NC(=O)c1ccccc1Cl WXVL_AK0084SD0006 [0,1,0,0,0,0|1,0,2]=4 44 B10R1.61 NC(=O)c1ccccc1F WXVL_AK0084SD0003 [0,1,0,0,0,0|1,0,2]=4 45 B10R1.61 NC(=O)c1ccccc1F WXVL_AK0084SD0003 [0,1,0,0,0,0|1,0,2]=4 46 B10R1.61 NC(=O)c1ccccc1I WXVL_AK0084SD0303 [0,1,0,0,0,0|1,0,2]=4 47 B10R1.61 NC(=O)c1ccccc1I WXVL_AK0084SD0303 [0,1,0,0,0,0|1,0,2]=4 48 B10R1.61 NC(=O)c1ccccc1O WXVL_AK0084SD00056 [0,1,0,0,0,0|1,0,2]=4 49 B10R1.61 NC(=O)c1ccccc1O WXVL_AK0084SD00056 [0,1,0,0,0,0|1,0,2]=4 50 B10R1.61 NC(=O)c1ccccc1S WXVL_AK0084SD0153 [0,1,0,0,0,0|1,0,2]=4 51 B10R1.61 NC(=O)c1ccccc1S WXVL_AK0084SD0153 [0,1,0,0,0,0|1,0,2]=4 52 B10R1.113 Cc1cccc(c1)C(=O)N WXVL_AK0084SD0056 [0,1,0,0,0,0|1,0,2]=4 53 B10R1.113 Cc1cccc(c1)C(=O)N WXVL_AK0084SD0056 [0,1,0,0,0,0|1,0,2]=4 54 B10R1.113 NC(=O)c1cccc(c1)Br WXVL_AK0084SD0041 [0,1,0,0,0,0|1,0,2]=4 55 B10R1.113 NC(=O)c1cccc(c1)Br WXVL_AK0084SD0041 [0,1,0,0,0,0|1,0,2]=4 56 B10R1.113 NC(=O)c1cccc(c1)Cl WXVL_AK0084SD0045 [0,1,0,0,0,0|1,0,2]=4 57 B10R1.113 NC(=O)c1cccc(c1)Cl WXVL_AK0084SD0045 [0,1,0,0,0,0|1,0,2]=4 58 B10R1.113 NC(=O)c1cccc(c1)F WXVL_AK0084SD0043 [0,1,0,0,0,0|1,0,2]=4 59 B10R1.113 NC(=O)c1cccc(c1)F WXVL_AK0084SD0043 [0,1,0,0,0,0|1,0,2]=4 60 B10R1.113 NC(=O)c1cccc(c1)I WXVL_AK0084SD0405 [0,1,0,0,0,0|1,0,2]=4 61 B10R1.113 NC(=O)c1cccc(c1)I WXVL_AK0084SD0405 [0,1,0,0,0,0|1,0,2]=4 62 B10R1.113 NC(=O)c1cccc(c1)O WXVL_AK0084SD1724 [0,1,0,0,0,0|1,0,2]=4 63 B10R1.113 NC(=O)c1cccc(c1)O WXVL_AK0084SD1724 [0,1,0,0,0,0|1,0,2]=4 64 B8R0.8 C=CCNC(=O)[C@@H](C)O WXVL_AK00561SB1085 [0,0,1,0,0,0|2,0,1]=4 65 B8R0.8 C=CCNC(=O)[C@@H](C)O WXVL_AK00561SB1085 [0,0,1,0,0,0|2,0,1]=4 66 B10R1.18 CC(=O)Nc1ccccc1 WXVL_AG00183SB0150 [0,0,0,0,0,1|0,0,2]=3 67 B10R1.18 CC(=O)Nc1ccccc1 WXVL_AG00183SB0150 [0,0,0,0,0,1|0,0,2]=3 68 B10R1.18 CC(=O)Nc1ccccn1 WXVL_AF00298SB0150 [0,0,0,0,0,1|1,0,2]=4 69 B10R1.18 CC(=O)Nc1ccccn1 WXVL_AF00298SB0150 [0,0,0,0,0,1|1,0,2]=4 70 B10R1.18 CC(C)Nc1ccncn1 WXVL_AK0030LP3358 [0,0,0,0,0,1|3,0,0]=4 71 B10R1.18 CC(C)Nc1ccncn1 WXVL_AK0030LP3358 [0,0,0,0,0,1|3,0,0]=4 72 B10R1.18 CC(C)Nc1ncccn1 WXVL_AK0030LP0002 [0,0,0,0,0,1|3,0,0]=4 73 B10R1.18 CC(C)Nc1ncccn1 WXVL_AK0030LP0002 [0,0,0,0,0,1|3,0,0]=4 74 B10R1.18 NC(=O)Cc1ccccc1 WXVL_AK0084SB0092 [0,0,0,0,0,1|1,0,2]=4 75 B10R1.18 NC(=O)Cc1ccccc1 WXVL_AK0084SB0092 [0,0,0,0,0,1|1,0,2]=4 76 B9R1.8 CCNc1ccncn1 WXVL_AK00476LP3358 [1,1,0,0,0,0|2,0,0]=4 77 B9R1.8 CCNc1ccncn1 WXVL_AK00476LP3358 [1,1,0,0,0,0|2,0,0]=4 78 B9R1.8 CCNc1ncccn1 WXVL_AK00476LP0002 [1,1,0,0,0,0|2,0,0]=4 79 B9R1.8 CCNc1ncccn1 WXVL_AK00476LP0002 [1,1,0,0,0,0|2,0,0]=4 80 B11R1.20 CC(=O)Nc1ccc(cc1)Cl WXVL_AG0062SB0150 [0,1,0,0,0,1|0,0,2]=4 81 B11R1.20 CC(=O)Nc1ccc(cc1)Cl WXVL_AG0062SB0150 [0,1,0,0,0,1|0,0,2]=4 82 B11R1.20 CC(=O)Nc1ccc(cc1)I WXVL_AG1742SB0150 [0,1,0,0,0,1|0,0,2]=4 83 B11R1.20 CC(=O)Nc1ccc(cc1)I WXVL_AG1742SB0150 [0,1,0,0,0,1|0,0,2]=4 84 B11R1.36 CN(C)C(=O)c1ccccc1 WXVL_AN0032SD0001 [0,1,0,0,0,1|2,0,0]=4 85 B11R1.36 CN(C)C(=O)c1ccccc1 WXVL_AN0032SD0001 [0,1,0,0,0,1|2,0,0]=4 86 B11R1.40 CCC(=O)Nc1ccccc1 WXVL_AG00183SB0064 [0,1,0,0,0,1|0,0,2]=4 87 B11R1.40 CCC(=O)Nc1ccccc1 WXVL_AG00183SB0064 [0,1,0,0,0,1|0,0,2]=4 88 B11R1.40 CNC(=O)Cc1ccccc1 WXVL_AK00442SB0092 [0,1,0,0,0,1|0,0,2]=4 89 B11R1.40 CNC(=O)Cc1ccccc1 WXVL_AK00442SB0092 [0,1,0,0,0,1|0,0,2]=4 90 B11R1.40 C[C@@H](CO)Nc1ccncn1 WXVL_AK0109LP3358 [0,1,0,0,0,1|2,0,0]=4 91 B11R1.40 C[C@@H](CO)Nc1ccncn1 WXVL_AK0109LP3358 [0,1,0,0,0,1|2,0,0]=4 92 B11R1.40 C[C@@H](CO)Nc1ncccn1 WXVL_AK0109LP0002 [0,1,0,0,0,1|2,0,0]=4 93 B11R1.40 C[C@@H](CO)Nc1ncccn1 WXVL_AK0109LP0002 [0,1,0,0,0,1|2,0,0]=4 94 B11R1.40 O=C(CO)Nc1ccccc1 WXVL_AG00183SB2706 [0,1,0,0,0,1|0,0,2]=4 95 B11R1.40 O=C(CO)Nc1ccccc1 WXVL_AG00183SB2706 [0,1,0,0,0,1|0,0,2]=4 96 B11R1.86 CC(=O)Nc1ccccc1Br WXVL_AG00180SB0150 [0,1,0,0,0,1|0,0,2]=4 97 B11R1.86 CC(=O)Nc1ccccc1Br WXVL_AG00180SB0150 [0,1,0,0,0,1|0,0,2]=4 98 B11R1.86 CC(=O)Nc1ccccc1C WXVL_AG0027SB0150 [0,1,0,0,0,1|0,0,2]=4 99 B11R1.86 CC(=O)Nc1ccccc1C WXVL_AG0027SB0150 [0,1,0,0,0,1|0,0,2]=4 100 B11R1.86 CC(=O)Nc1ccccc1Cl WXVL_AG00129SB0150 [0,1,0,0,0,1|0,0,2]=4 101 B11R1.86 CC(=O)Nc1ccccc1Cl WXVL_AG00129SB0150 [0,1,0,0,0,1|0,0,2]=4 102 B11R1.86 CC(=O)Nc1ccccc1I WXVL_AG0385SB0150 [0,1,0,0,0,1|0,0,2]=4 103 B11R1.86 CC(=O)Nc1ccccc1I WXVL_AG0385SB0150 [0,1,0,0,0,1|0,0,2]=4 104 B11R1.157 CC(=O)Nc1cccc(c1)C WXVL_AG0052SB0150 [0,1,0,0,0,1|0,0,2]=4 105 B11R1.157 CC(=O)Nc1cccc(c1)C WXVL_AG0052SB0150 [0,1,0,0,0,1|0,0,2]=4 106 B11R1.157 CC(=O)Nc1cccc(c1)I WXVL_AG0649SB0150 [0,1,0,0,0,1|0,0,2]=4 107 B11R1.157 CC(=O)Nc1cccc(c1)I WXVL_AG0649SB0150 [0,1,0,0,0,1|0,0,2]=4 108 B11R1.157 CC(=O)Nc1cccc(c1)O WXVL_AG00200SB0150 [0,1,0,0,0,1|0,0,2]=4 109 B11R1.157 CC(=O)Nc1cccc(c1)O WXVL_AG00200SB0150 [0,1,0,0,0,1|0,0,2]=4 110 B11R1.22 CNC(=O)c1ccc(cc1)Br WXVL_AK00442SD0060 [0,2,0,0,0,0|0,0,2]=4 111 B11R1.22 CNC(=O)c1ccc(cc1)Br WXVL_AK00442SD0060 [0,2,0,0,0,0|0,0,2]=4 112 B11R1.22 CNC(=O)c1ccc(cc1)C WXVL_AK00442SD0078 [0,2,0,0,0,0|0,0,2]=4 113 B11R1.22 CNC(=O)c1ccc(cc1)C WXVL_AK00442SD0078 [0,2,0,0,0,0|0,0,2]=4 114 B11R1.22 CNC(=O)c1ccc(cc1)Cl WXVL_AK00442SD0062 [0,2,0,0,0,0|0,0,2]=4 115 B11R1.22 CNC(=O)c1ccc(cc1)Cl WXVL_AK00442SD0062 [0,2,0,0,0,0|0,0,2]=4 116 B11R1.22 CNC(=O)c1ccc(cc1)F WXVL_AK00442SD0061 [0,2,0,0,0,0|0,0,2]=4 117 B11R1.22 CNC(=O)c1ccc(cc1)F WXVL_AK00442SD0061 [0,2,0,0,0,0|0,0,2]=4 118 B11R1.22 CNC(=O)c1ccc(cc1)I WXVL_AK00442SD0421 [0,2,0,0,0,0|0,0,2]=4 119 B11R1.22 CNC(=O)c1ccc(cc1)I WXVL_AK00442SD0421 [0,2,0,0,0,0|0,0,2]=4 120 B11R1.22 CNC(=O)c1ccc(cc1)O WXVL_AK00442SD0069 [0,2,0,0,0,0|0,0,2]=4 121 B11R1.22 CNC(=O)c1ccc(cc1)O WXVL_AK00442SD0069 [0,2,0,0,0,0|0,0,2]=4 122 B11R1.22 CNC(=O)c1ccc(cc1)S WXVL_AK00442SD0154 [0,2,0,0,0,0|0,0,2]=4 123 B11R1.22 CNC(=O)c1ccc(cc1)S WXVL_AK00442SD0154 [0,2,0,0,0,0|0,0,2]=4 124 B11R1.16 CCNC(=O)c1ccccc1 WXVL_AK00476SD0001 [0,2,0,0,0,0|0,0,2]=4 125 B11R1.16 CCNC(=O)c1ccccc1 WXVL_AK00476SD0001 [0,2,0,0,0,0|0,0,2]=4 126 B11R1.23 CNC(=O)c1cccc(c1)Br WXVL_AK00442SD0041 [0,2,0,0,0,0|0,0,2]=4 127 B11R1.23 CNC(=O)c1cccc(c1)Br WXVL_AK00442SD0041 [0,2,0,0,0,0|0,0,2]=4 128 B11R1.23 CNC(=O)c1cccc(c1)C WXVL_AK00442SD0056 [0,2,0,0,0,0|0,0,2]=4 129 B11R1.23 CNC(=O)c1cccc(c1)C WXVL_AK00442SD0056 [0,2,0,0,0,0|0,0,2]=4 130 B11R1.23 CNC(=O)c1cccc(c1)Cl WXVL_AK00442SD0045 [0,2,0,0,0,0|0,0,2]=4 131 B11R1.23 CNC(=O)c1cccc(c1)Cl WXVL_AK00442SD0045 [0,2,0,0,0,0|0,0,2]=4 132 B11R1.23 CNC(=O)c1cccc(c1)F WXVL_AK00442SD0043 [0,2,0,0,0,0|0,0,2]=4 133 B11R1.23 CNC(=O)c1cccc(c1)F WXVL_AK00442SD0043 [0,2,0,0,0,0|0,0,2]=4 134 B11R1.23 CNC(=O)c1cccc(c1)I WXVL_AK00442SD0405 [0,2,0,0,0,0|0,0,2]=4 135 B11R1.23 CNC(=O)c1cccc(c1)I WXVL_AK00442SD0405 [0,2,0,0,0,0|0,0,2]=4 136 B11R1.23 CNC(=O)c1cccc(c1)O WXVL_AK00442SD1724 [0,2,0,0,0,0|0,0,2]=4 137 B11R1.23 CNC(=O)c1cccc(c1)O WXVL_AK00442SD1724 [0,2,0,0,0,0|0,0,2]=4 138 B11R1.222 CNC(=O)c1ccccc1Br WXVL_AK00442SD0002 [0,2,0,0,0,0|0,0,2]=4 139 B11R1.222 CNC(=O)c1ccccc1Br WXVL_AK00442SD0002 [0,2,0,0,0,0|0,0,2]=4 140 B11R1.222 CNC(=O)c1ccccc1C WXVL_AK00442SD0037 [0,2,0,0,0,0|0,0,2]=4 141 B11R1.222 CNC(=O)c1ccccc1C WXVL_AK00442SD0037 [0,2,0,0,0,0|0,0,2]=4 142 B11R1.222 CNC(=O)c1ccccc1Cl WXVL_AK00442SD0006 [0,2,0,0,0,0|0,0,2]=4 143 B11R1.222 CNC(=O)c1ccccc1Cl WXVL_AK00442SD0006 [0,2,0,0,0,0|0,0,2]=4 144 B11R1.222 CNC(=O)c1ccccc1F WXVL_AK00442SD0003 [0,2,0,0,0,0|0,0,2]=4 145 B11R1.222 CNC(=O)c1ccccc1F WXVL_AK00442SD0003 [0,2,0,0,0,0|0,0,2]=4 146 B11R1.222 CNC(=O)c1ccccc1I WXVL_AK00442SD0303 [0,2,0,0,0,0|0,0,2]=4 147 B11R1.222 CNC(=O)c1ccccc1I WXVL_AK00442SD0303 [0,2,0,0,0,0|0,0,2]=4 148 B11R1.222 CNC(=O)c1ccccc1O WXVL_AK00442SD00056 [0,2,0,0,0,0|0,0,2]=4 149 B11R1.222 CNC(=O)c1ccccc1O WXVL_AK00442SD00056 [0,2,0,0,0,0|0,0,2]=4 150 B11R1.222 CNC(=O)c1ccccc1S WXVL_AK00442SD0153 [0,2,0,0,0,0|0,0,2]=4 151 B11R1.222 CNC(=O)c1ccccc1S WXVL_AK00442SD0153 [0,2,0,0,0,0|0,0,2]=4 152 B11R1.91 CC(=O)NCc1ccccc1 WXVL_AK00502SB0150 [0,0,0,0,0,2|0,0,2]=4 153 B11R1.91 CC(=O)NCc1ccccc1 WXVL_AK00502SB0150 [0,0,0,0,0,2|0,0,2]=4 154 B11R1.91 CC(O)CNc1ccncn1 WXVL_AK0052LP3358 [0,0,0,0,0,2|2,0,0]=4 155 B11R1.91 CC(O)CNc1ccncn1 WXVL_AK0052LP3358 [0,0,0,0,0,2|2,0,0]=4 156 B11R1.91 CC(O)CNc1ncccn1 WXVL_AK0052LP0002 [0,0,0,0,0,2|2,0,0]=4 157 B11R1.91 CC(O)CNc1ncccn1 WXVL_AK0052LP0002 [0,0,0,0,0,2|2,0,0]=4 158 B11R1.91 C[C@H](O)CNc1ccncn1 WXVL_AK0113LP3358 [0,0,0,0,0,2|2,0,0]=4 159 B11R1.91 C[C@H](O)CNc1ccncn1 WXVL_AK0113LP3358 [0,0,0,0,0,2|2,0,0]=4 160 B11R1.91 C[C@H](O)CNc1ncccn1 WXVL_AK0113LP0002 [0,0,0,0,0,2|2,0,0]=4 161 B11R1.91 C[C@H](O)CNc1ncccn1 WXVL_AK0113LP0002 [0,0,0,0,0,2|2,0,0]=4