0 B18R3.2098 c1ccc2c(c1)CCC2Nc3ccncn3 WXVL_AK1156LP3358 [0,0,0,0,0,1|2,0,1]=4 1 B18R3.2098 c1ccc2c(c1)CCC2Nc3ccncn3 WXVL_AK1156LP3358 [0,0,0,0,0,1|2,0,1]=4 2 B18R3.2098 c1ccc2c(c1)CC[C@@H]2Nc3ccncn3 WXVL_AK00474LP3358 [0,0,0,0,0,1|2,0,1]=4 3 B18R3.2098 c1ccc2c(c1)CC[C@@H]2Nc3ccncn3 WXVL_AK00474LP3358 [0,0,0,0,0,1|2,0,1]=4 4 B18R3.2098 c1cnc(nc1)NC2CCc3c2cccc3 WXVL_AK1156LP0002 [0,0,0,0,0,1|3,0,0]=4 5 B18R3.2098 c1cnc(nc1)NC2CCc3c2cccc3 WXVL_AK1156LP0002 [0,0,0,0,0,1|3,0,0]=4 6 B18R3.2098 c1cnc(nc1)N[C@H]2CCc3c2cccc3 WXVL_AK00474LP0002 [0,0,0,0,0,1|3,0,0]=4 7 B18R3.2098 c1cnc(nc1)N[C@H]2CCc3c2cccc3 WXVL_AK00474LP0002 [0,0,0,0,0,1|3,0,0]=4 8 B17R2.2737 COc1ccccc1NC(=O)c2c[nH]cn2 WXVL_AG00090SC0074 [0,1,1,0,0,0|1,0,1]=4 9 B17R2.2737 COc1ccccc1NC(=O)c2c[nH]cn2 WXVL_AG00090SC0074 [0,1,1,0,0,0|1,0,1]=4 10 B17R2.2737 CSc1ccccc1NC(=O)c2c[nH]cn2 WXVL_AG0585SC0074 [0,1,1,0,0,0|1,0,1]=4 11 B17R2.2737 CSc1ccccc1NC(=O)c2c[nH]cn2 WXVL_AG0585SC0074 [0,1,1,0,0,0|1,0,1]=4 12 B17R2.2737 O=C(Nc1ccccc1CO)c2c[nH]cn2 WXVL_AG0305SC0074 [0,1,1,0,0,0|1,0,1]=4 13 B17R2.2737 O=C(Nc1ccccc1CO)c2c[nH]cn2 WXVL_AG0305SC0074 [0,1,1,0,0,0|1,0,1]=4 14 B17R2.5714 O=C(NCCc1ccccc1)c2c[nH]cn2 WXVL_AK00498SC0074 [0,1,1,0,0,0|0,0,1]=3 15 B17R2.5714 O=C(NCCc1ccccc1)c2c[nH]cn2 WXVL_AK00498SC0074 [0,1,1,0,0,0|0,0,1]=3 16 B17R2.5714 O=C(NCCc1ccccc1)c2cc[nH]c2 WXVL_AK00498SC0013 [0,1,1,0,0,0|1,0,1]=4 17 B17R2.5714 O=C(NCCc1ccccc1)c2cc[nH]c2 WXVL_AK00498SC0013 [0,1,1,0,0,0|1,0,1]=4 18 B17R2.5714 O=C(NCCc1ccccc1)c2cocn2 WXVL_AK00498SC0118 [0,1,1,0,0,0|1,0,1]=4 19 B17R2.5714 O=C(NCCc1ccccc1)c2cocn2 WXVL_AK00498SC0118 [0,1,1,0,0,0|1,0,1]=4 20 B17R2.5714 O=C(NCCc1ccccc1)c2cscn2 WXVL_AK00498SC0092 [0,1,1,0,0,0|1,0,1]=4 21 B17R2.5714 O=C(NCCc1ccccc1)c2cscn2 WXVL_AK00498SC0092 [0,1,1,0,0,0|1,0,1]=4 22 B17R2.5714 O=C(NCCc1ccccc1)c2nc[nH]n2 WXVL_AK00498SC0376 [0,1,1,0,0,0|1,0,1]=4 23 B17R2.5714 O=C(NCCc1ccccc1)c2nc[nH]n2 WXVL_AK00498SC0376 [0,1,1,0,0,0|1,0,1]=4 24 B17R2.5714 O=C(NCCc1ccccn1)c2c[nH]cn2 WXVL_AK0019SC0074 [0,1,1,0,0,0|1,0,1]=4 25 B17R2.5714 O=C(NCCc1ccccn1)c2c[nH]cn2 WXVL_AK0019SC0074 [0,1,1,0,0,0|1,0,1]=4 26 B17R2.5714 O=C(NCCc1cccnc1)c2c[nH]cn2 WXVL_AK00436SC0074 [0,1,1,0,0,0|1,0,1]=4 27 B17R2.5714 O=C(NCCc1cccnc1)c2c[nH]cn2 WXVL_AK00436SC0074 [0,1,1,0,0,0|1,0,1]=4 28 B17R2.5714 O=C(NCCc1ccncc1)c2c[nH]cn2 WXVL_AK0093SC0074 [0,1,1,0,0,0|1,0,1]=4 29 B17R2.5714 O=C(NCCc1ccncc1)c2c[nH]cn2 WXVL_AK0093SC0074 [0,1,1,0,0,0|1,0,1]=4 30 B17R2.8341 O=C(Cc1ccccc1)NCc2cocn2 WXVL_AK00016SB0092 [0,1,1,0,0,0|1,0,1]=4 31 B17R2.8341 O=C(Cc1ccccc1)NCc2cocn2 WXVL_AK00016SB0092 [0,1,1,0,0,0|1,0,1]=4 32 B17R2.8341 O=C(Cc1ccccc1)NCc2cscn2 WXVL_AK0325SB0092 [0,1,1,0,0,0|1,0,1]=4 33 B17R2.8341 O=C(Cc1ccccc1)NCc2cscn2 WXVL_AK0325SB0092 [0,1,1,0,0,0|1,0,1]=4 34 B19R3.2488 O=C(NC1CCc2c1cccc2)c3c[nH]cn3 WXVL_AK1156SC0074 [0,1,0,0,0,1|1,0,1]=4 35 B19R3.2488 O=C(NC1CCc2c1cccc2)c3c[nH]cn3 WXVL_AK1156SC0074 [0,1,0,0,0,1|1,0,1]=4 36 B19R3.2488 O=C(N[C@H]1CCc2c1cccc2)c3c[nH]cn3 WXVL_AK00474SC0074 [0,1,0,0,0,1|1,0,1]=4 37 B19R3.2488 O=C(N[C@H]1CCc2c1cccc2)c3c[nH]cn3 WXVL_AK00474SC0074 [0,1,0,0,0,1|1,0,1]=4 38 B19R3.324030 O=C(c1c[nH]cn1)N2CCc3ccccc3C2 WXVL_AN00480SC0074 [0,1,0,0,0,1|0,0,1]=3 39 B19R3.324030 O=C(c1c[nH]cn1)N2CCc3ccccc3C2 WXVL_AN00480SC0074 [0,1,0,0,0,1|0,0,1]=3 40 B19R3.324030 O=C(c1c[nH]cn1)N2CCc3cccnc3C2 WXVL_AN00388SC0074 [0,1,0,0,0,1|1,0,1]=4 41 B19R3.324030 O=C(c1c[nH]cn1)N2CCc3cccnc3C2 WXVL_AN00388SC0074 [0,1,0,0,0,1|1,0,1]=4 42 B19R3.324030 O=C(c1c[nH]cn1)N2CCc3ccncc3C2 WXVL_AN00244SC0074 [0,1,0,0,0,1|1,0,1]=4 43 B19R3.324030 O=C(c1c[nH]cn1)N2CCc3ccncc3C2 WXVL_AN00244SC0074 [0,1,0,0,0,1|1,0,1]=4 44 B19R3.324030 O=C(c1c[nH]cn1)N2CCc3cnccc3C2 WXVL_AN0182SC0074 [0,1,0,0,0,1|1,0,1]=4 45 B19R3.324030 O=C(c1c[nH]cn1)N2CCc3cnccc3C2 WXVL_AN0182SC0074 [0,1,0,0,0,1|1,0,1]=4 46 B19R3.324030 O=C(c1c[nH]cn1)N2CCc3ncccc3C2 WXVL_AN00470SC0074 [0,1,0,0,0,1|1,0,1]=4 47 B19R3.324030 O=C(c1c[nH]cn1)N2CCc3ncccc3C2 WXVL_AN00470SC0074 [0,1,0,0,0,1|1,0,1]=4 48 B19R3.324030 O=C(c1cc[nH]c1)N2CCc3ccccc3C2 WXVL_AN00480SC0013 [0,1,0,0,0,1|1,0,1]=4 49 B19R3.324030 O=C(c1cc[nH]c1)N2CCc3ccccc3C2 WXVL_AN00480SC0013 [0,1,0,0,0,1|1,0,1]=4 50 B19R3.324030 O=C(c1cocn1)N2CCc3ccccc3C2 WXVL_AN00480SC0118 [0,1,0,0,0,1|1,0,1]=4 51 B19R3.324030 O=C(c1cocn1)N2CCc3ccccc3C2 WXVL_AN00480SC0118 [0,1,0,0,0,1|1,0,1]=4 52 B19R3.324030 O=C(c1cscn1)N2CCc3ccccc3C2 WXVL_AN00480SC0092 [0,1,0,0,0,1|1,0,1]=4 53 B19R3.324030 O=C(c1cscn1)N2CCc3ccccc3C2 WXVL_AN00480SC0092 [0,1,0,0,0,1|1,0,1]=4 54 B19R3.324030 O=C(c1nc[nH]n1)N2CCc3ccccc3C2 WXVL_AN00480SC0376 [0,1,0,0,0,1|1,0,1]=4 55 B19R3.324030 O=C(c1nc[nH]n1)N2CCc3ccccc3C2 WXVL_AN00480SC0376 [0,1,0,0,0,1|1,0,1]=4