0 B16R2.685 CCN(Cc1cccs1)c2ccncn2 WXVL_AN4283LP3358 [0,0,0,0,0,0|4,0,0]=4 1 B16R2.685 CCN(Cc1cccs1)c2ccncn2 WXVL_AN4283LP3358 [0,0,0,0,0,0|4,0,0]=4 2 B16R2.685 CCN(Cc1cccs1)c2ncccn2 WXVL_AN4283LP0002 [0,0,0,0,0,0|4,0,0]=4 3 B16R2.685 CCN(Cc1cccs1)c2ncccn2 WXVL_AN4283LP0002 [0,0,0,0,0,0|4,0,0]=4 4 B15R2.1259 O=C(Nc1cnc[nH]1)c2ccccc2 WXVL_AF00103SD0001 [1,0,0,0,0,0|3,0,0]=4 5 B15R2.1259 O=C(Nc1cnc[nH]1)c2ccccc2 WXVL_AF00103SD0001 [1,0,0,0,0,0|3,0,0]=4 6 B17R3.1941 c1cc(ncn1)N2CCc3nc[nH]c3C2 WXVL_AN00532LP3358 [0,0,0,1,0,0|2,0,0]=3 7 B17R3.1941 c1cc(ncn1)N2CCn3cncc3C2 WXVL_AN00427LP3358 [0,0,0,1,0,0|2,0,0]=3 8 B17R3.1941 c1cc(ncn1)N2CCn3cncc3C2 WXVL_AN00427LP3358 [0,0,0,1,0,0|2,0,0]=3 9 B17R3.1941 c1cc(ncn1)N2CCn3cnnc3C2 WXVL_AN00093LP3358 [0,0,0,1,0,0|3,0,0]=4 10 B17R3.1941 c1cc(ncn1)N2CCn3cnnc3C2 WXVL_AN00093LP3358 [0,0,0,1,0,0|3,0,0]=4 11 B17R3.1941 c1cc2n(c1)CCN(C2)c3ccncn3 WXVL_AN2419LP3358 [0,0,0,1,0,0|3,0,0]=4 12 B17R3.1941 c1cc2n(c1)CCN(C2)c3ccncn3 WXVL_AN2419LP3358 [0,0,0,1,0,0|3,0,0]=4 13 B17R3.1941 c1cnc(nc1)N2CCc3nc[nH]c3C2 WXVL_AN00532LP0002 [0,0,0,1,0,0|2,0,0]=3 14 B17R3.1941 c1cnc(nc1)N2CCn3cccc3C2 WXVL_AN2419LP0002 [0,0,0,1,0,0|3,0,0]=4 15 B17R3.1941 c1cnc(nc1)N2CCn3cccc3C2 WXVL_AN2419LP0002 [0,0,0,1,0,0|3,0,0]=4 16 B17R3.1941 c1cnc(nc1)N2CCn3cncc3C2 WXVL_AN00427LP0002 [0,0,0,1,0,0|2,0,0]=3 17 B17R3.1941 c1cnc(nc1)N2CCn3cncc3C2 WXVL_AN00427LP0002 [0,0,0,1,0,0|2,0,0]=3 18 B17R3.1941 c1cnc(nc1)N2CCn3cnnc3C2 WXVL_AN00093LP0002 [0,0,0,1,0,0|3,0,0]=4 19 B17R3.1941 c1cnc(nc1)N2CCn3cnnc3C2 WXVL_AN00093LP0002 [0,0,0,1,0,0|3,0,0]=4 20 B17R2.162 CCN(Cc1cccnc1)c2ccncn2 WXVL_AN2691LP3358 [0,0,0,0,0,1|3,0,0]=4 21 B17R2.162 CCN(Cc1cccnc1)c2ncccn2 WXVL_AN2691LP0002 [0,0,0,0,0,1|3,0,0]=4 22 B17R2.162 CCN(Cc1ccncc1)c2ccncn2 WXVL_AN0061LP3358 [0,0,0,0,0,1|3,0,0]=4 23 B17R2.162 CCN(Cc1ccncc1)c2ccncn2 WXVL_AN0061LP3358 [0,0,0,0,0,1|3,0,0]=4 24 B17R2.162 CCN(Cc1ccncc1)c2ncccn2 WXVL_AN0061LP0002 [0,0,0,0,0,1|3,0,0]=4 25 B17R2.162 CCN(Cc1ccncc1)c2ncccn2 WXVL_AN0061LP0002 [0,0,0,0,0,1|3,0,0]=4 26 B17R2.162 CC[C@H](Nc1ccncn1)c2ccccc2 WXVL_AK00525LP3358 [0,0,0,0,0,1|2,0,1]=4 27 B17R2.162 CC[C@H](Nc1ccncn1)c2ccccc2 WXVL_AK00525LP3358 [0,0,0,0,0,1|2,0,1]=4 28 B14R2.101 c1cc(ncn1)NCc2cnc[nH]2 WXVL_AK00778LP3358 [2,0,0,0,0,0|2,0,0]=4 29 B14R2.101 c1cc(ncn1)NCc2cnc[nH]2 WXVL_AK00778LP3358 [2,0,0,0,0,0|2,0,0]=4 30 B14R2.101 c1cnc(nc1)NCc2cnc[nH]2 WXVL_AK00778LP0002 [2,0,0,0,0,0|2,0,0]=4 31 B14R2.101 c1cnc(nc1)NCc2cnc[nH]2 WXVL_AK00778LP0002 [2,0,0,0,0,0|2,0,0]=4 32 B18R2.7828 CCN(Cc1ccccc1)C(=O)c2cnc[nH]2 WXVL_AN0041SC0247 [0,1,0,0,0,1|0,0,1]=3 33 B18R2.7828 CCN(Cc1ccccc1)C(=O)c2cnc[nH]2 WXVL_AN0041SC0247 [0,1,0,0,0,1|0,0,1]=3 34 B18R2.7828 CCN(Cc1ccccc1)C(=O)c2cnco2 WXVL_AN0041SC0018 [0,1,0,0,0,1|1,0,1]=4 35 B18R2.7828 CCN(Cc1ccccc1)C(=O)c2cnco2 WXVL_AN0041SC0018 [0,1,0,0,0,1|1,0,1]=4 36 B18R2.7828 CCN(Cc1ccccc1)C(=O)c2cncs2 WXVL_AN0041SC0113 [0,1,0,0,0,1|1,0,1]=4 37 B18R2.7828 CCN(Cc1ccccc1)C(=O)c2cncs2 WXVL_AN0041SC0113 [0,1,0,0,0,1|1,0,1]=4 38 B18R2.7828 CCN(Cc1ccccc1)C(=O)c2nnc[nH]2 WXVL_AN0041SC00053 [0,1,0,0,0,1|1,0,1]=4 39 B18R2.7828 CCN(Cc1ccccc1)C(=O)c2nnc[nH]2 WXVL_AN0041SC00053 [0,1,0,0,0,1|1,0,1]=4 40 B18R2.7828 CCN(Cc1ccccn1)C(=O)c2cnc[nH]2 WXVL_AN3463SC0247 [0,1,0,0,0,1|1,0,1]=4 41 B18R2.7828 CCN(Cc1cccnc1)C(=O)c2cnc[nH]2 WXVL_AN2691SC0247 [0,1,0,0,0,1|1,0,1]=4 42 B18R2.7828 CCN(Cc1ccncc1)C(=O)c2cnc[nH]2 WXVL_AN0061SC0247 [0,1,0,0,0,1|1,0,1]=4 43 B18R2.7828 CCN(Cc1ccncc1)C(=O)c2cnc[nH]2 WXVL_AN0061SC0247 [0,1,0,0,0,1|1,0,1]=4 44 B18R2.7838 CCN(Cc1cccs1)C(=O)c2ccccc2 WXVL_AN4283SD0001 [0,1,0,0,0,1|2,0,0]=4 45 B18R2.7838 CCN(Cc1cccs1)C(=O)c2ccccc2 WXVL_AN4283SD0001 [0,1,0,0,0,1|2,0,0]=4 46 B18R2.33880 CC(=O)N(Cc1ccccc1)Cc2cnc[nH]2 WXVL_AN00091SB0150 [0,1,0,0,0,1|0,0,1]=3 47 B18R2.33880 CC(=O)N(Cc1ccccc1)Cc2cnc[nH]2 WXVL_AN00091SB0150 [0,1,0,0,0,1|0,0,1]=3 48 B18R2.2319 CCC(C(=O)Nc1cnc[nH]1)c2ccccc2 WXVL_AF00103SB0053 [0,1,0,0,0,1|1,0,1]=4 49 B18R2.2319 CCC(C(=O)Nc1cnc[nH]1)c2ccccc2 WXVL_AF00103SB0053 [0,1,0,0,0,1|1,0,1]=4 50 B18R2.7228 CC[C@H](NC(=O)c1cnc[nH]1)c2ccccc2 WXVL_AK00525SC0247 [0,1,0,0,0,1|1,0,1]=4 51 B18R2.7228 CC[C@H](NC(=O)c1cnc[nH]1)c2ccccc2 WXVL_AK00525SC0247 [0,1,0,0,0,1|1,0,1]=4 52 B18R3.2972 Brc1cnc(nc1)N2CCc3nc[nH]c3C2 WXVL_AN00532LQ1546 [0,1,0,1,0,0|2,0,0]=4 53 B18R3.2972 Brc1cnc(nc1)N2CCn3cncc3C2 WXVL_AN00427LQ1546 [0,1,0,1,0,0|2,0,0]=4 54 B18R3.2972 Brc1cnc(nc1)N2CCn3cncc3C2 WXVL_AN00427LQ1546 [0,1,0,1,0,0|2,0,0]=4 55 B18R3.2972 Cc1cnc(nc1)N2CCc3nc[nH]c3C2 WXVL_AN00532LP0025 [0,1,0,1,0,0|2,0,0]=4 56 B18R3.2972 Cc1cnc(nc1)N2CCn3cncc3C2 WXVL_AN00427LP0025 [0,1,0,1,0,0|2,0,0]=4 57 B18R3.2972 Cc1cnc(nc1)N2CCn3cncc3C2 WXVL_AN00427LP0025 [0,1,0,1,0,0|2,0,0]=4 58 B18R3.2972 Fc1cnc(nc1)N2CCc3nc[nH]c3C2 WXVL_AN00532LP0017 [0,1,0,1,0,0|2,0,0]=4 59 B18R3.2972 Fc1cnc(nc1)N2CCn3cncc3C2 WXVL_AN00427LP0017 [0,1,0,1,0,0|2,0,0]=4 60 B18R3.2972 Fc1cnc(nc1)N2CCn3cncc3C2 WXVL_AN00427LP0017 [0,1,0,1,0,0|2,0,0]=4 61 B18R3.2972 Ic1cnc(nc1)N2CCc3nc[nH]c3C2 WXVL_AN00532LP3340 [0,1,0,1,0,0|2,0,0]=4 62 B18R3.2972 Ic1cnc(nc1)N2CCn3cncc3C2 WXVL_AN00427LP3340 [0,1,0,1,0,0|2,0,0]=4 63 B18R3.2972 Ic1cnc(nc1)N2CCn3cncc3C2 WXVL_AN00427LP3340 [0,1,0,1,0,0|2,0,0]=4 64 B18R3.3026 Brc1ccnc(n1)N2CCc3nc[nH]c3C2 WXVL_AN00532LQ3192 [0,1,0,1,0,0|2,0,0]=4 65 B18R3.3026 Brc1ccnc(n1)N2CCn3cncc3C2 WXVL_AN00427LQ3192 [0,1,0,1,0,0|2,0,0]=4 66 B18R3.3026 Brc1ccnc(n1)N2CCn3cncc3C2 WXVL_AN00427LQ3192 [0,1,0,1,0,0|2,0,0]=4 67 B18R3.3026 Brc1nccc(n1)N2CCc3nc[nH]c3C2 WXVL_AN00532LQ4646 [0,1,0,1,0,0|2,0,0]=4 68 B18R3.3026 Brc1nccc(n1)N2CCn3cncc3C2 WXVL_AN00427LQ4646 [0,1,0,1,0,0|2,0,0]=4 69 B18R3.3026 Brc1nccc(n1)N2CCn3cncc3C2 WXVL_AN00427LQ4646 [0,1,0,1,0,0|2,0,0]=4 70 B18R3.3026 Cc1cc(ncn1)N2CCc3nc[nH]c3C2 WXVL_AN00532LP0109 [0,1,0,1,0,0|2,0,0]=4 71 B18R3.3026 Cc1cc(ncn1)N2CCn3cncc3C2 WXVL_AN00427LP0109 [0,1,0,1,0,0|2,0,0]=4 72 B18R3.3026 Cc1cc(ncn1)N2CCn3cncc3C2 WXVL_AN00427LP0109 [0,1,0,1,0,0|2,0,0]=4 73 B18R3.3026 Cc1ccnc(n1)N2CCc3nc[nH]c3C2 WXVL_AN00532LP0007 [0,1,0,1,0,0|2,0,0]=4 74 B18R3.3026 Cc1ccnc(n1)N2CCn3cncc3C2 WXVL_AN00427LP0007 [0,1,0,1,0,0|2,0,0]=4 75 B18R3.3026 Cc1ccnc(n1)N2CCn3cncc3C2 WXVL_AN00427LP0007 [0,1,0,1,0,0|2,0,0]=4 76 B18R3.3026 Cc1nccc(n1)N2CCc3nc[nH]c3C2 WXVL_AN00532LP0556 [0,1,0,1,0,0|2,0,0]=4 77 B18R3.3026 Cc1nccc(n1)N2CCn3cncc3C2 WXVL_AN00427LP0556 [0,1,0,1,0,0|2,0,0]=4 78 B18R3.3026 Cc1nccc(n1)N2CCn3cncc3C2 WXVL_AN00427LP0556 [0,1,0,1,0,0|2,0,0]=4 79 B18R3.3958 Brc1cncnc1N2CCc3nc[nH]c3C2 WXVL_AN00532LQ2111 [0,1,0,1,0,0|2,0,0]=4 80 B18R3.3958 Brc1cncnc1N2CCn3cncc3C2 WXVL_AN00427LQ2111 [0,1,0,1,0,0|2,0,0]=4 81 B18R3.3958 Brc1cncnc1N2CCn3cncc3C2 WXVL_AN00427LQ2111 [0,1,0,1,0,0|2,0,0]=4 82 B18R3.3958 Cc1cncnc1N2CCc3nc[nH]c3C2 WXVL_AN00532LP0053 [0,1,0,1,0,0|2,0,0]=4 83 B18R3.3958 Cc1cncnc1N2CCn3cncc3C2 WXVL_AN00427LP0053 [0,1,0,1,0,0|2,0,0]=4 84 B18R3.3958 Cc1cncnc1N2CCn3cncc3C2 WXVL_AN00427LP0053 [0,1,0,1,0,0|2,0,0]=4 85 B18R3.3958 Fc1cncnc1N2CCc3nc[nH]c3C2 WXVL_AN00532LP0435 [0,1,0,1,0,0|2,0,0]=4 86 B18R3.3958 Fc1cncnc1N2CCn3cncc3C2 WXVL_AN00427LP0435 [0,1,0,1,0,0|2,0,0]=4 87 B18R3.3958 Fc1cncnc1N2CCn3cncc3C2 WXVL_AN00427LP0435 [0,1,0,1,0,0|2,0,0]=4 88 B18R3.3958 Ic1cncnc1N2CCc3nc[nH]c3C2 WXVL_AN00532LP3348 [0,1,0,1,0,0|2,0,0]=4 89 B18R3.3958 Ic1cncnc1N2CCn3cncc3C2 WXVL_AN00427LP3348 [0,1,0,1,0,0|2,0,0]=4 90 B18R3.3958 Ic1cncnc1N2CCn3cncc3C2 WXVL_AN00427LP3348 [0,1,0,1,0,0|2,0,0]=4 91 B16R2.5767 O=C(NCc1cnc[nH]1)c2ccccc2 WXVL_AK00778SD0001 [1,0,0,0,0,1|2,0,0]=4 92 B16R2.5767 O=C(NCc1cnc[nH]1)c2ccccc2 WXVL_AK00778SD0001 [1,0,0,0,0,1|2,0,0]=4