0 B14R2.101 c1cc(ncn1)NCc2cocn2 WXVL_AK00016LP3358 [0,0,0,0,0,0|4,0,0]=4 1 B14R2.101 c1cc(ncn1)NCc2cocn2 WXVL_AK00016LP3358 [0,0,0,0,0,0|4,0,0]=4 2 B14R2.101 c1cc(ncn1)NCc2cscn2 WXVL_AK0325LP3358 [0,0,0,0,0,0|4,0,0]=4 3 B14R2.101 c1cc(ncn1)NCc2cscn2 WXVL_AK0325LP3358 [0,0,0,0,0,0|4,0,0]=4 4 B14R2.101 c1cnc(nc1)NCc2cocn2 WXVL_AK00016LP0002 [0,0,0,0,0,0|4,0,0]=4 5 B14R2.101 c1cnc(nc1)NCc2cocn2 WXVL_AK00016LP0002 [0,0,0,0,0,0|4,0,0]=4 6 B14R2.101 c1cnc(nc1)NCc2cscn2 WXVL_AK0325LP0002 [0,0,0,0,0,0|4,0,0]=4 7 B14R2.101 c1cnc(nc1)NCc2cscn2 WXVL_AK0325LP0002 [0,0,0,0,0,0|4,0,0]=4 8 B15R2.64 O=C(Nc1ccccc1)c2c[nH]cn2 WXVL_AG00183SC0074 [0,1,0,0,0,0|1,0,1]=3 9 B15R2.64 O=C(Nc1ccccc1)c2c[nH]cn2 WXVL_AG00183SC0074 [0,1,0,0,0,0|1,0,1]=3 10 B15R2.64 O=C(Nc1ccccc1)c2cc[nH]c2 WXVL_AG00183SC0013 [0,1,0,0,0,0|2,0,1]=4 11 B15R2.64 O=C(Nc1ccccc1)c2cc[nH]c2 WXVL_AG00183SC0013 [0,1,0,0,0,0|2,0,1]=4 12 B15R2.64 O=C(Nc1ccccc1)c2cocn2 WXVL_AG00183SC0118 [0,1,0,0,0,0|2,0,1]=4 13 B15R2.64 O=C(Nc1ccccc1)c2cocn2 WXVL_AG00183SC0118 [0,1,0,0,0,0|2,0,1]=4 14 B15R2.64 O=C(Nc1ccccc1)c2cscn2 WXVL_AG00183SC0092 [0,1,0,0,0,0|2,0,1]=4 15 B15R2.64 O=C(Nc1ccccc1)c2cscn2 WXVL_AG00183SC0092 [0,1,0,0,0,0|2,0,1]=4 16 B15R2.64 O=C(Nc1ccccc1)c2nc[nH]n2 WXVL_AG00183SC0376 [0,1,0,0,0,0|2,0,1]=4 17 B15R2.64 O=C(Nc1ccccc1)c2nc[nH]n2 WXVL_AG00183SC0376 [0,1,0,0,0,0|2,0,1]=4 18 B15R2.64 O=C(Nc1ccccn1)c2c[nH]cn2 WXVL_AF00298SC0074 [0,1,0,0,0,0|2,0,1]=4 19 B15R2.64 O=C(Nc1ccccn1)c2c[nH]cn2 WXVL_AF00298SC0074 [0,1,0,0,0,0|2,0,1]=4 20 B15R2.283 Cn1cnc(c1)CNc2ccncn2 WXVL_AK00449LP3358 [0,1,0,0,0,0|3,0,0]=4 21 B15R2.283 Cn1cnc(c1)CNc2ccncn2 WXVL_AK00449LP3358 [0,1,0,0,0,0|3,0,0]=4 22 B15R2.283 Cn1cnc(c1)CNc2ncccn2 WXVL_AK00449LP0002 [0,1,0,0,0,0|3,0,0]=4 23 B15R2.283 Cn1cnc(c1)CNc2ncccn2 WXVL_AK00449LP0002 [0,1,0,0,0,0|3,0,0]=4 24 B15R2.1259 O=C(Nc1cscn1)c2ccccc2 WXVL_AF00216SD0001 [0,1,0,0,0,0|2,0,1]=4 25 B15R2.1259 O=C(Nc1cscn1)c2ccccc2 WXVL_AF00216SD0001 [0,1,0,0,0,0|2,0,1]=4 26 B15R2.2195 c1cc(ccn1)CNc2ccncn2 WXVL_AK0021LP3358 [0,0,0,0,0,1|2,0,1]=4 27 B15R2.2195 c1cc(ccn1)CNc2ccncn2 WXVL_AK0021LP3358 [0,0,0,0,0,1|2,0,1]=4 28 B15R2.2195 c1ccc(cc1)CNc2ccncn2 WXVL_AK00502LP3358 [0,0,0,0,0,1|1,0,1]=3 29 B15R2.2195 c1ccc(cc1)CNc2ccncn2 WXVL_AK00502LP3358 [0,0,0,0,0,1|1,0,1]=3 30 B15R2.2195 c1ccc(cc1)CNc2ncccn2 WXVL_AK00502LP0002 [0,0,0,0,0,1|2,0,0]=3 31 B15R2.2195 c1ccc(cc1)CNc2ncccn2 WXVL_AK00502LP0002 [0,0,0,0,0,1|2,0,0]=3 32 B15R2.2195 c1ccc(nc1)CNc2ccncn2 WXVL_AK0018LP3358 [0,0,0,0,0,1|2,0,1]=4 33 B15R2.2195 c1ccc(nc1)CNc2ccncn2 WXVL_AK0018LP3358 [0,0,0,0,0,1|2,0,1]=4 34 B15R2.2195 c1ccc(nc1)CNc2ncccn2 WXVL_AK0018LP0002 [0,0,0,0,0,1|3,0,0]=4 35 B15R2.2195 c1ccc(nc1)CNc2ncccn2 WXVL_AK0018LP0002 [0,0,0,0,0,1|3,0,0]=4 36 B15R2.2195 c1cnc(nc1)NCc2cccnc2 WXVL_AK0020LP0002 [0,0,0,0,0,1|3,0,0]=4 37 B15R2.2195 c1cnc(nc1)NCc2cccnc2 WXVL_AK0020LP0002 [0,0,0,0,0,1|3,0,0]=4 38 B15R2.2195 c1cnc(nc1)NCc2ccncc2 WXVL_AK0021LP0002 [0,0,0,0,0,1|3,0,0]=4 39 B15R2.2195 c1cnc(nc1)NCc2ccncc2 WXVL_AK0021LP0002 [0,0,0,0,0,1|3,0,0]=4 40 B15R2.2195 c1cncc(c1)CNc2ccncn2 WXVL_AK0020LP3358 [0,0,0,0,0,1|2,0,1]=4 41 B15R2.2195 c1cncc(c1)CNc2ccncn2 WXVL_AK0020LP3358 [0,0,0,0,0,1|2,0,1]=4 42 B12R1.27 CNC(=O)CCc1ccccc1 WXVL_AK00442SB0067 [1,0,1,0,0,0|1,0,1]=4 43 B12R1.27 CNC(=O)CCc1ccccc1 WXVL_AK00442SB0067 [1,0,1,0,0,0|1,0,1]=4 44 B16R2.71 Brc1ccccc1CNc2ccncn2 WXVL_AK1632LP3358 [0,1,0,0,0,1|1,0,1]=4 45 B16R2.71 Brc1ccccc1CNc2ccncn2 WXVL_AK1632LP3358 [0,1,0,0,0,1|1,0,1]=4 46 B16R2.71 Brc1ccccc1CNc2ncccn2 WXVL_AK1632LP0002 [0,1,0,0,0,1|2,0,0]=4 47 B16R2.71 Brc1ccccc1CNc2ncccn2 WXVL_AK1632LP0002 [0,1,0,0,0,1|2,0,0]=4 48 B16R2.71 Brc1cncnc1NCc2ccccc2 WXVL_AK00502LQ2111 [0,1,0,0,0,1|1,0,1]=4 49 B16R2.71 Brc1cncnc1NCc2ccccc2 WXVL_AK00502LQ2111 [0,1,0,0,0,1|1,0,1]=4 50 B16R2.71 Cc1ccccc1CNc2ccncn2 WXVL_AK0040LP3358 [0,1,0,0,0,1|1,0,1]=4 51 B16R2.71 Cc1ccccc1CNc2ccncn2 WXVL_AK0040LP3358 [0,1,0,0,0,1|1,0,1]=4 52 B16R2.71 Cc1ccccc1CNc2ncccn2 WXVL_AK0040LP0002 [0,1,0,0,0,1|2,0,0]=4 53 B16R2.71 Cc1ccccc1CNc2ncccn2 WXVL_AK0040LP0002 [0,1,0,0,0,1|2,0,0]=4 54 B16R2.71 Cc1cncnc1NCc2ccccc2 WXVL_AK00502LP0053 [0,1,0,0,0,1|1,0,1]=4 55 B16R2.71 Cc1cncnc1NCc2ccccc2 WXVL_AK00502LP0053 [0,1,0,0,0,1|1,0,1]=4 56 B16R2.71 Clc1ccccc1CNc2ccncn2 WXVL_AK0038LP3358 [0,1,0,0,0,1|1,0,1]=4 57 B16R2.71 Clc1ccccc1CNc2ccncn2 WXVL_AK0038LP3358 [0,1,0,0,0,1|1,0,1]=4 58 B16R2.71 Clc1ccccc1CNc2ncccn2 WXVL_AK0038LP0002 [0,1,0,0,0,1|2,0,0]=4 59 B16R2.71 Clc1ccccc1CNc2ncccn2 WXVL_AK0038LP0002 [0,1,0,0,0,1|2,0,0]=4 60 B16R2.71 Fc1ccccc1CNc2ccncn2 WXVL_AK0037LP3358 [0,1,0,0,0,1|1,0,1]=4 61 B16R2.71 Fc1ccccc1CNc2ccncn2 WXVL_AK0037LP3358 [0,1,0,0,0,1|1,0,1]=4 62 B16R2.71 Fc1ccccc1CNc2ncccn2 WXVL_AK0037LP0002 [0,1,0,0,0,1|2,0,0]=4 63 B16R2.71 Fc1ccccc1CNc2ncccn2 WXVL_AK0037LP0002 [0,1,0,0,0,1|2,0,0]=4 64 B16R2.71 Fc1cncnc1NCc2ccccc2 WXVL_AK00502LP0435 [0,1,0,0,0,1|1,0,1]=4 65 B16R2.71 Fc1cncnc1NCc2ccccc2 WXVL_AK00502LP0435 [0,1,0,0,0,1|1,0,1]=4 66 B16R2.71 Ic1ccccc1CNc2ccncn2 WXVL_AK3923LP3358 [0,1,0,0,0,1|1,0,1]=4 67 B16R2.71 Ic1ccccc1CNc2ccncn2 WXVL_AK3923LP3358 [0,1,0,0,0,1|1,0,1]=4 68 B16R2.71 Ic1ccccc1CNc2ncccn2 WXVL_AK3923LP0002 [0,1,0,0,0,1|2,0,0]=4 69 B16R2.71 Ic1ccccc1CNc2ncccn2 WXVL_AK3923LP0002 [0,1,0,0,0,1|2,0,0]=4 70 B16R2.71 Ic1cncnc1NCc2ccccc2 WXVL_AK00502LP3348 [0,1,0,0,0,1|1,0,1]=4 71 B16R2.71 Ic1cncnc1NCc2ccccc2 WXVL_AK00502LP3348 [0,1,0,0,0,1|1,0,1]=4 72 B16R2.71 Oc1ccccc1CNc2ccncn2 WXVL_AK0963LP3358 [0,1,0,0,0,1|1,0,1]=4 73 B16R2.71 Oc1ccccc1CNc2ccncn2 WXVL_AK0963LP3358 [0,1,0,0,0,1|1,0,1]=4 74 B16R2.71 Oc1ccccc1CNc2ncccn2 WXVL_AK0963LP0002 [0,1,0,0,0,1|2,0,0]=4 75 B16R2.71 Oc1ccccc1CNc2ncccn2 WXVL_AK0963LP0002 [0,1,0,0,0,1|2,0,0]=4 76 B16R2.88 CN(Cc1ccccc1)c2ccncn2 WXVL_AN0033LP3358 [0,1,0,0,0,1|1,0,1]=4 77 B16R2.88 CN(Cc1ccccc1)c2ccncn2 WXVL_AN0033LP3358 [0,1,0,0,0,1|1,0,1]=4 78 B16R2.88 CN(Cc1ccccc1)c2ncccn2 WXVL_AN0033LP0002 [0,1,0,0,0,1|2,0,0]=4 79 B16R2.88 CN(Cc1ccccc1)c2ncccn2 WXVL_AN0033LP0002 [0,1,0,0,0,1|2,0,0]=4 80 B16R2.132 Brc1ccc(cc1)CNc2ccncn2 WXVL_AK1474LP3358 [0,1,0,0,0,1|1,0,1]=4 81 B16R2.132 Brc1ccc(cc1)CNc2ccncn2 WXVL_AK1474LP3358 [0,1,0,0,0,1|1,0,1]=4 82 B16R2.132 Brc1ccc(cc1)CNc2ncccn2 WXVL_AK1474LP0002 [0,1,0,0,0,1|2,0,0]=4 83 B16R2.132 Brc1ccc(cc1)CNc2ncccn2 WXVL_AK1474LP0002 [0,1,0,0,0,1|2,0,0]=4 84 B16R2.132 Brc1cnc(nc1)NCc2ccccc2 WXVL_AK00502LQ1546 [0,1,0,0,0,1|2,0,0]=4 85 B16R2.132 Brc1cnc(nc1)NCc2ccccc2 WXVL_AK00502LQ1546 [0,1,0,0,0,1|2,0,0]=4 86 B16R2.132 Cc1ccc(cc1)CNc2ccncn2 WXVL_AK0048LP3358 [0,1,0,0,0,1|1,0,1]=4 87 B16R2.132 Cc1ccc(cc1)CNc2ccncn2 WXVL_AK0048LP3358 [0,1,0,0,0,1|1,0,1]=4 88 B16R2.132 Cc1ccc(cc1)CNc2ncccn2 WXVL_AK0048LP0002 [0,1,0,0,0,1|2,0,0]=4 89 B16R2.132 Cc1ccc(cc1)CNc2ncccn2 WXVL_AK0048LP0002 [0,1,0,0,0,1|2,0,0]=4 90 B16R2.132 Cc1cnc(nc1)NCc2ccccc2 WXVL_AK00502LP0025 [0,1,0,0,0,1|2,0,0]=4 91 B16R2.132 Cc1cnc(nc1)NCc2ccccc2 WXVL_AK00502LP0025 [0,1,0,0,0,1|2,0,0]=4 92 B16R2.132 Clc1ccc(cc1)CNc2ccncn2 WXVL_AK0047LP3358 [0,1,0,0,0,1|1,0,1]=4 93 B16R2.132 Clc1ccc(cc1)CNc2ccncn2 WXVL_AK0047LP3358 [0,1,0,0,0,1|1,0,1]=4 94 B16R2.132 Clc1ccc(cc1)CNc2ncccn2 WXVL_AK0047LP0002 [0,1,0,0,0,1|2,0,0]=4 95 B16R2.132 Clc1ccc(cc1)CNc2ncccn2 WXVL_AK0047LP0002 [0,1,0,0,0,1|2,0,0]=4 96 B16R2.132 Fc1ccc(cc1)CNc2ccncn2 WXVL_AK0046LP3358 [0,1,0,0,0,1|1,0,1]=4 97 B16R2.132 Fc1ccc(cc1)CNc2ccncn2 WXVL_AK0046LP3358 [0,1,0,0,0,1|1,0,1]=4 98 B16R2.132 Fc1ccc(cc1)CNc2ncccn2 WXVL_AK0046LP0002 [0,1,0,0,0,1|2,0,0]=4 99 B16R2.132 Fc1ccc(cc1)CNc2ncccn2 WXVL_AK0046LP0002 [0,1,0,0,0,1|2,0,0]=4 100 B16R2.132 Fc1cnc(nc1)NCc2ccccc2 WXVL_AK00502LP0017 [0,1,0,0,0,1|2,0,0]=4 101 B16R2.132 Fc1cnc(nc1)NCc2ccccc2 WXVL_AK00502LP0017 [0,1,0,0,0,1|2,0,0]=4 102 B16R2.132 Ic1ccc(cc1)CNc2ccncn2 WXVL_AK1644LP3358 [0,1,0,0,0,1|1,0,1]=4 103 B16R2.132 Ic1ccc(cc1)CNc2ccncn2 WXVL_AK1644LP3358 [0,1,0,0,0,1|1,0,1]=4 104 B16R2.132 Ic1ccc(cc1)CNc2ncccn2 WXVL_AK1644LP0002 [0,1,0,0,0,1|2,0,0]=4 105 B16R2.132 Ic1ccc(cc1)CNc2ncccn2 WXVL_AK1644LP0002 [0,1,0,0,0,1|2,0,0]=4 106 B16R2.132 Ic1cnc(nc1)NCc2ccccc2 WXVL_AK00502LP3340 [0,1,0,0,0,1|2,0,0]=4 107 B16R2.132 Ic1cnc(nc1)NCc2ccccc2 WXVL_AK00502LP3340 [0,1,0,0,0,1|2,0,0]=4 108 B16R2.132 Oc1ccc(cc1)CNc2ccncn2 WXVL_AK0926LP3358 [0,1,0,0,0,1|1,0,1]=4 109 B16R2.132 Oc1ccc(cc1)CNc2ccncn2 WXVL_AK0926LP3358 [0,1,0,0,0,1|1,0,1]=4 110 B16R2.132 Oc1ccc(cc1)CNc2ncccn2 WXVL_AK0926LP0002 [0,1,0,0,0,1|2,0,0]=4 111 B16R2.132 Oc1ccc(cc1)CNc2ncccn2 WXVL_AK0926LP0002 [0,1,0,0,0,1|2,0,0]=4 112 B16R2.252 Brc1cccc(c1)CNc2ccncn2 WXVL_AK1177LP3358 [0,1,0,0,0,1|1,0,1]=4 113 B16R2.252 Brc1cccc(c1)CNc2ccncn2 WXVL_AK1177LP3358 [0,1,0,0,0,1|1,0,1]=4 114 B16R2.252 Brc1cccc(c1)CNc2ncccn2 WXVL_AK1177LP0002 [0,1,0,0,0,1|2,0,0]=4 115 B16R2.252 Brc1cccc(c1)CNc2ncccn2 WXVL_AK1177LP0002 [0,1,0,0,0,1|2,0,0]=4 116 B16R2.252 Brc1ccnc(n1)NCc2ccccc2 WXVL_AK00502LQ3192 [0,1,0,0,0,1|2,0,0]=4 117 B16R2.252 Brc1ccnc(n1)NCc2ccccc2 WXVL_AK00502LQ3192 [0,1,0,0,0,1|2,0,0]=4 118 B16R2.252 Brc1nccc(n1)NCc2ccccc2 WXVL_AK00502LQ4646 [0,1,0,0,0,1|1,0,1]=4 119 B16R2.252 Brc1nccc(n1)NCc2ccccc2 WXVL_AK00502LQ4646 [0,1,0,0,0,1|1,0,1]=4 120 B16R2.252 Cc1cc(ncn1)NCc2ccccc2 WXVL_AK00502LP0109 [0,1,0,0,0,1|1,0,1]=4 121 B16R2.252 Cc1cc(ncn1)NCc2ccccc2 WXVL_AK00502LP0109 [0,1,0,0,0,1|1,0,1]=4 122 B16R2.252 Cc1cccc(c1)CNc2ccncn2 WXVL_AK0045LP3358 [0,1,0,0,0,1|1,0,1]=4 123 B16R2.252 Cc1cccc(c1)CNc2ccncn2 WXVL_AK0045LP3358 [0,1,0,0,0,1|1,0,1]=4 124 B16R2.252 Cc1cccc(c1)CNc2ncccn2 WXVL_AK0045LP0002 [0,1,0,0,0,1|2,0,0]=4 125 B16R2.252 Cc1cccc(c1)CNc2ncccn2 WXVL_AK0045LP0002 [0,1,0,0,0,1|2,0,0]=4 126 B16R2.252 Cc1ccnc(n1)NCc2ccccc2 WXVL_AK00502LP0007 [0,1,0,0,0,1|2,0,0]=4 127 B16R2.252 Cc1ccnc(n1)NCc2ccccc2 WXVL_AK00502LP0007 [0,1,0,0,0,1|2,0,0]=4 128 B16R2.252 Cc1nccc(n1)NCc2ccccc2 WXVL_AK00502LP0556 [0,1,0,0,0,1|1,0,1]=4 129 B16R2.252 Cc1nccc(n1)NCc2ccccc2 WXVL_AK00502LP0556 [0,1,0,0,0,1|1,0,1]=4 130 B16R2.252 Clc1cccc(c1)CNc2ccncn2 WXVL_AK0094LP3358 [0,1,0,0,0,1|1,0,1]=4 131 B16R2.252 Clc1cccc(c1)CNc2ccncn2 WXVL_AK0094LP3358 [0,1,0,0,0,1|1,0,1]=4 132 B16R2.252 Clc1cccc(c1)CNc2ncccn2 WXVL_AK0094LP0002 [0,1,0,0,0,1|2,0,0]=4 133 B16R2.252 Clc1cccc(c1)CNc2ncccn2 WXVL_AK0094LP0002 [0,1,0,0,0,1|2,0,0]=4 134 B16R2.252 Fc1cccc(c1)CNc2ccncn2 WXVL_AK0041LP3358 [0,1,0,0,0,1|1,0,1]=4 135 B16R2.252 Fc1cccc(c1)CNc2ccncn2 WXVL_AK0041LP3358 [0,1,0,0,0,1|1,0,1]=4 136 B16R2.252 Fc1cccc(c1)CNc2ncccn2 WXVL_AK0041LP0002 [0,1,0,0,0,1|2,0,0]=4 137 B16R2.252 Fc1cccc(c1)CNc2ncccn2 WXVL_AK0041LP0002 [0,1,0,0,0,1|2,0,0]=4 138 B16R2.252 Ic1cccc(c1)CNc2ccncn2 WXVL_AK1572LP3358 [0,1,0,0,0,1|1,0,1]=4 139 B16R2.252 Ic1cccc(c1)CNc2ccncn2 WXVL_AK1572LP3358 [0,1,0,0,0,1|1,0,1]=4 140 B16R2.252 Ic1cccc(c1)CNc2ncccn2 WXVL_AK1572LP0002 [0,1,0,0,0,1|2,0,0]=4 141 B16R2.252 Ic1cccc(c1)CNc2ncccn2 WXVL_AK1572LP0002 [0,1,0,0,0,1|2,0,0]=4 142 B16R2.252 Oc1cccc(c1)CNc2ccncn2 WXVL_AK0974LP3358 [0,1,0,0,0,1|1,0,1]=4 143 B16R2.252 Oc1cccc(c1)CNc2ccncn2 WXVL_AK0974LP3358 [0,1,0,0,0,1|1,0,1]=4 144 B16R2.252 Oc1cccc(c1)CNc2ncccn2 WXVL_AK0974LP0002 [0,1,0,0,0,1|2,0,0]=4 145 B16R2.252 Oc1cccc(c1)CNc2ncccn2 WXVL_AK0974LP0002 [0,1,0,0,0,1|2,0,0]=4 146 B16R2.524 O=C(Cc1ccccc1)Nc2cscn2 WXVL_AF00216SB0092 [0,1,0,0,0,1|1,0,1]=4 147 B16R2.524 O=C(Cc1ccccc1)Nc2cscn2 WXVL_AF00216SB0092 [0,1,0,0,0,1|1,0,1]=4 148 B16R2.524 O=C(Cc1cscn1)Nc2ccccc2 WXVL_AG00183SA0012 [0,1,0,0,0,1|1,0,1]=4 149 B16R2.524 O=C(Cc1cscn1)Nc2ccccc2 WXVL_AG00183SA0012 [0,1,0,0,0,1|1,0,1]=4 150 B16R2.2238 O=C(NCc1ccccc1)c2c[nH]cn2 WXVL_AK00502SC0074 [0,1,0,0,0,1|0,0,1]=3 151 B16R2.2238 O=C(NCc1ccccc1)c2c[nH]cn2 WXVL_AK00502SC0074 [0,1,0,0,0,1|0,0,1]=3 152 B16R2.2238 O=C(NCc1ccccc1)c2cc[nH]c2 WXVL_AK00502SC0013 [0,1,0,0,0,1|1,0,1]=4 153 B16R2.2238 O=C(NCc1ccccc1)c2cc[nH]c2 WXVL_AK00502SC0013 [0,1,0,0,0,1|1,0,1]=4 154 B16R2.2238 O=C(NCc1ccccc1)c2cocn2 WXVL_AK00502SC0118 [0,1,0,0,0,1|1,0,1]=4 155 B16R2.2238 O=C(NCc1ccccc1)c2cocn2 WXVL_AK00502SC0118 [0,1,0,0,0,1|1,0,1]=4 156 B16R2.2238 O=C(NCc1ccccc1)c2cscn2 WXVL_AK00502SC0092 [0,1,0,0,0,1|1,0,1]=4 157 B16R2.2238 O=C(NCc1ccccc1)c2cscn2 WXVL_AK00502SC0092 [0,1,0,0,0,1|1,0,1]=4 158 B16R2.2238 O=C(NCc1ccccc1)c2nc[nH]n2 WXVL_AK00502SC0376 [0,1,0,0,0,1|1,0,1]=4 159 B16R2.2238 O=C(NCc1ccccc1)c2nc[nH]n2 WXVL_AK00502SC0376 [0,1,0,0,0,1|1,0,1]=4 160 B16R2.2238 O=C(NCc1ccccn1)c2c[nH]cn2 WXVL_AK0018SC0074 [0,1,0,0,0,1|1,0,1]=4 161 B16R2.2238 O=C(NCc1ccccn1)c2c[nH]cn2 WXVL_AK0018SC0074 [0,1,0,0,0,1|1,0,1]=4 162 B16R2.2238 O=C(NCc1cccnc1)c2c[nH]cn2 WXVL_AK0020SC0074 [0,1,0,0,0,1|1,0,1]=4 163 B16R2.2238 O=C(NCc1cccnc1)c2c[nH]cn2 WXVL_AK0020SC0074 [0,1,0,0,0,1|1,0,1]=4 164 B16R2.2238 O=C(NCc1ccncc1)c2c[nH]cn2 WXVL_AK0021SC0074 [0,1,0,0,0,1|1,0,1]=4 165 B16R2.2238 O=C(NCc1ccncc1)c2c[nH]cn2 WXVL_AK0021SC0074 [0,1,0,0,0,1|1,0,1]=4 166 B16R2.5767 O=C(NCc1cocn1)c2ccccc2 WXVL_AK00016SD0001 [0,1,0,0,0,1|1,0,1]=4 167 B16R2.5767 O=C(NCc1cocn1)c2ccccc2 WXVL_AK00016SD0001 [0,1,0,0,0,1|1,0,1]=4 168 B16R2.5767 O=C(NCc1cscn1)c2ccccc2 WXVL_AK0325SD0001 [0,1,0,0,0,1|1,0,1]=4 169 B16R2.5767 O=C(NCc1cscn1)c2ccccc2 WXVL_AK0325SD0001 [0,1,0,0,0,1|1,0,1]=4 170 B16R2.133 O=C(Nc1ccc(cc1)Cl)c2c[nH]cn2 WXVL_AG0062SC0074 [0,2,0,0,0,0|1,0,1]=4 171 B16R2.133 O=C(Nc1ccc(cc1)Cl)c2c[nH]cn2 WXVL_AG0062SC0074 [0,2,0,0,0,0|1,0,1]=4 172 B16R2.133 O=C(Nc1ccc(cc1)I)c2c[nH]cn2 WXVL_AG1742SC0074 [0,2,0,0,0,0|1,0,1]=4 173 B16R2.133 O=C(Nc1ccc(cc1)I)c2c[nH]cn2 WXVL_AG1742SC0074 [0,2,0,0,0,0|1,0,1]=4 174 B16R2.253 Cc1cccc(c1)NC(=O)c2c[nH]cn2 WXVL_AG0052SC0074 [0,2,0,0,0,0|1,0,1]=4 175 B16R2.253 Cc1cccc(c1)NC(=O)c2c[nH]cn2 WXVL_AG0052SC0074 [0,2,0,0,0,0|1,0,1]=4 176 B16R2.253 O=C(Nc1cccc(c1)I)c2c[nH]cn2 WXVL_AG0649SC0074 [0,2,0,0,0,0|1,0,1]=4 177 B16R2.253 O=C(Nc1cccc(c1)I)c2c[nH]cn2 WXVL_AG0649SC0074 [0,2,0,0,0,0|1,0,1]=4 178 B16R2.253 O=C(Nc1cccc(c1)O)c2c[nH]cn2 WXVL_AG00200SC0074 [0,2,0,0,0,0|1,0,1]=4 179 B16R2.253 O=C(Nc1cccc(c1)O)c2c[nH]cn2 WXVL_AG00200SC0074 [0,2,0,0,0,0|1,0,1]=4 180 B16R2.2843 Cc1nc(c[nH]1)C(=O)Nc2ccccc2 WXVL_AG00183SC0009 [0,2,0,0,0,0|1,0,1]=4 181 B16R2.2843 Cc1nc(c[nH]1)C(=O)Nc2ccccc2 WXVL_AG00183SC0009 [0,2,0,0,0,0|1,0,1]=4 182 B16R2.2843 Cn1cnc(c1)C(=O)Nc2ccccc2 WXVL_AG00183SC0111 [0,2,0,0,0,0|1,0,1]=4 183 B16R2.2843 Cn1cnc(c1)C(=O)Nc2ccccc2 WXVL_AG00183SC0111 [0,2,0,0,0,0|1,0,1]=4 184 B16R2.2957 Cc1ccccc1NC(=O)c2c[nH]cn2 WXVL_AG0027SC0074 [0,2,0,0,0,0|1,0,1]=4 185 B16R2.2957 Cc1ccccc1NC(=O)c2c[nH]cn2 WXVL_AG0027SC0074 [0,2,0,0,0,0|1,0,1]=4 186 B16R2.2957 O=C(Nc1ccccc1Br)c2c[nH]cn2 WXVL_AG00180SC0074 [0,2,0,0,0,0|1,0,1]=4 187 B16R2.2957 O=C(Nc1ccccc1Br)c2c[nH]cn2 WXVL_AG00180SC0074 [0,2,0,0,0,0|1,0,1]=4 188 B16R2.2957 O=C(Nc1ccccc1Cl)c2c[nH]cn2 WXVL_AG00129SC0074 [0,2,0,0,0,0|1,0,1]=4 189 B16R2.2957 O=C(Nc1ccccc1Cl)c2c[nH]cn2 WXVL_AG00129SC0074 [0,2,0,0,0,0|1,0,1]=4 190 B16R2.2957 O=C(Nc1ccccc1I)c2c[nH]cn2 WXVL_AG0385SC0074 [0,2,0,0,0,0|1,0,1]=4 191 B16R2.2957 O=C(Nc1ccccc1I)c2c[nH]cn2 WXVL_AG0385SC0074 [0,2,0,0,0,0|1,0,1]=4 192 B16R2.2829 Cn1cnc(c1)NC(=O)c2ccccc2 WXVL_AF0086SD0001 [0,2,0,0,0,0|1,0,1]=4 193 B16R2.2829 Cn1cnc(c1)NC(=O)c2ccccc2 WXVL_AF0086SD0001 [0,2,0,0,0,0|1,0,1]=4 194 B16R3.5925 C1=C(Cc2c1cccc2)c3nc[nH]n3 WXVL_LR0419BT0542 [0,1,0,1,0,0|1,0,1]=4 195 B16R3.5925 C1=C(Cc2c1cccc2)c3nc[nH]n3 WXVL_LR0419BT3426 [0,1,0,1,0,0|1,0,1]=4 196 B12R2.2 c1cc(ccn1)c2nc[nH]n2 WXVL_LR0419BT0574 [0,0,0,0,2,0|2,0,0]=4 197 B12R2.2 c1ccc(cc1)c2cccs2 WXVL_LR0498BT0919 [0,0,0,0,2,0|2,0,0]=4 198 B12R2.2 c1ccc(cc1)c2cccs2 WXVL_LR0498BT1115 [0,0,0,0,2,0|2,0,0]=4 199 B12R2.2 c1ccc(cc1)c2cccs2 WXVL_LR0498BT2957 [0,0,0,0,2,0|2,0,0]=4 200 B12R2.2 c1ccc(cc1)c2ccon2 WXVL_LR0685BT0919 [0,0,0,0,2,0|2,0,0]=4 201 B12R2.2 c1ccc(cc1)c2ccon2 WXVL_LR0685BT1115 [0,0,0,0,2,0|2,0,0]=4 202 B12R2.2 c1ccc(cc1)c2ccon2 WXVL_LR0685BT2957 [0,0,0,0,2,0|2,0,0]=4 203 B12R2.2 c1ccc(cc1)c2cn[nH]n2 WXVL_LR0395BT0919 [0,0,0,0,2,0|1,0,1]=4 204 B12R2.2 c1ccc(cc1)c2cn[nH]n2 WXVL_LR0395BT1115 [0,0,0,0,2,0|1,0,1]=4 205 B12R2.2 c1ccc(cc1)c2cn[nH]n2 WXVL_LR0395BT2957 [0,0,0,0,2,0|1,0,1]=4 206 B12R2.2 c1ccc(cc1)c2cnc[nH]2 WXVL_LR0418BT0919 [0,0,0,0,2,0|0,0,2]=4 207 B12R2.2 c1ccc(cc1)c2cnc[nH]2 WXVL_LR0418BT1115 [0,0,0,0,2,0|0,0,2]=4 208 B12R2.2 c1ccc(cc1)c2cnc[nH]2 WXVL_LR0418BT2957 [0,0,0,0,2,0|0,0,2]=4 209 B12R2.2 c1ccc(cc1)c2nc[nH]n2 WXVL_LR0419BT0919 [0,0,0,0,2,0|1,0,0]=3 210 B12R2.2 c1ccc(cc1)c2nc[nH]n2 WXVL_LR0419BT1115 [0,0,0,0,2,0|1,0,0]=3 211 B12R2.2 c1ccc(cc1)c2nc[nH]n2 WXVL_LR0419BT2957 [0,0,0,0,2,0|1,0,0]=3 212 B12R2.2 c1ccc(cc1)c2ncns2 WXVL_LR0623BT0919 [0,0,0,0,2,0|1,0,1]=4 213 B12R2.2 c1ccc(cc1)c2ncns2 WXVL_LR0623BT1115 [0,0,0,0,2,0|1,0,1]=4 214 B12R2.2 c1ccc(cc1)c2ncns2 WXVL_LR0623BT2957 [0,0,0,0,2,0|1,0,1]=4 215 B12R2.2 c1ccc(nc1)c2nc[nH]n2 WXVL_LR0419BT0164 [0,0,0,0,2,0|2,0,0]=4 216 B12R2.2 c1cncc(c1)c2nc[nH]n2 WXVL_LR0419BT1208 [0,0,0,0,2,0|2,0,0]=4 217 B12R2.2 c1cncc(c1)c2nc[nH]n2 WXVL_LR0419BT3912 [0,0,0,0,2,0|2,0,0]=4 218 B16R2.2256 c1cc(ccn1)CCNc2ccncn2 WXVL_AK0093LP3358 [0,0,0,0,0,2|1,0,1]=4 219 B16R2.2256 c1cc(ccn1)CCNc2ccncn2 WXVL_AK0093LP3358 [0,0,0,0,0,2|1,0,1]=4 220 B16R2.2256 c1ccc(cc1)CCNc2ccncn2 WXVL_AK00498LP3358 [0,0,0,0,0,2|0,0,1]=3 221 B16R2.2256 c1ccc(cc1)CCNc2ccncn2 WXVL_AK00498LP3358 [0,0,0,0,0,2|0,0,1]=3 222 B16R2.2256 c1ccc(cc1)CCNc2ncccn2 WXVL_AK00498LP0002 [0,0,0,0,0,2|1,0,0]=3 223 B16R2.2256 c1ccc(cc1)CCNc2ncccn2 WXVL_AK00498LP0002 [0,0,0,0,0,2|1,0,0]=3 224 B16R2.2256 c1ccc(nc1)CCNc2ccncn2 WXVL_AK0019LP3358 [0,0,0,0,0,2|1,0,1]=4 225 B16R2.2256 c1ccc(nc1)CCNc2ccncn2 WXVL_AK0019LP3358 [0,0,0,0,0,2|1,0,1]=4 226 B16R2.2256 c1ccc(nc1)CCNc2ncccn2 WXVL_AK0019LP0002 [0,0,0,0,0,2|2,0,0]=4 227 B16R2.2256 c1ccc(nc1)CCNc2ncccn2 WXVL_AK0019LP0002 [0,0,0,0,0,2|2,0,0]=4 228 B16R2.2256 c1cnc(nc1)NCCc2cccnc2 WXVL_AK00436LP0002 [0,0,0,0,0,2|2,0,0]=4 229 B16R2.2256 c1cnc(nc1)NCCc2cccnc2 WXVL_AK00436LP0002 [0,0,0,0,0,2|2,0,0]=4 230 B16R2.2256 c1cnc(nc1)NCCc2ccncc2 WXVL_AK0093LP0002 [0,0,0,0,0,2|2,0,0]=4 231 B16R2.2256 c1cnc(nc1)NCCc2ccncc2 WXVL_AK0093LP0002 [0,0,0,0,0,2|2,0,0]=4 232 B16R2.2256 c1cncc(c1)CCNc2ccncn2 WXVL_AK00436LP3358 [0,0,0,0,0,2|1,0,1]=4 233 B16R2.2256 c1cncc(c1)CCNc2ccncn2 WXVL_AK00436LP3358 [0,0,0,0,0,2|1,0,1]=4