0 B15R1.2560 C/C=C/C(=O)Nc1c(cccc1OC)C WXVL_AG0358SB0340 [0,0,1,0,0,0|1,0,2]=4 1 B15R1.2560 C/C=C/C(=O)Nc1c(cccc1OC)C WXVL_AG0358SB0340 [0,0,1,0,0,0|1,0,2]=4 2 B15R1.2560 CC#CC(=O)Nc1c(cccc1OC)C WXVL_AG0358SB1240 [0,0,1,0,0,0|1,0,2]=4 3 B15R1.2560 CC#CC(=O)Nc1c(cccc1OC)C WXVL_AG0358SB1240 [0,0,1,0,0,0|1,0,2]=4 4 B15R1.2560 CCCC(=O)Nc1c(cccc1OC)Br WXVL_AG2486SB0073 [0,0,1,0,0,0|2,0,1]=4 5 B15R1.2560 CCCC(=O)Nc1c(cccc1OC)Br WXVL_AG2486SB0073 [0,0,1,0,0,0|2,0,1]=4 6 B15R1.2560 CCCC(=O)Nc1c(cccc1OC)C WXVL_AG0358SB0073 [0,0,1,0,0,0|1,0,1]=3 7 B15R1.2560 CCCC(=O)Nc1c(cccc1OC)C WXVL_AG0358SB0073 [0,0,1,0,0,0|1,0,1]=3 8 B15R1.2560 CCCC(=O)Nc1c(cccc1OC)Cl WXVL_AG2171SB0073 [0,0,1,0,0,0|2,0,1]=4 9 B15R1.2560 CCCC(=O)Nc1c(cccc1OC)Cl WXVL_AG2171SB0073 [0,0,1,0,0,0|2,0,1]=4 10 B15R1.2560 CCCC(=O)Nc1c(cccc1OC)F WXVL_AG1384SB0073 [0,0,1,0,0,0|2,0,1]=4 11 B15R1.2560 CCCC(=O)Nc1c(cccc1OC)F WXVL_AG1384SB0073 [0,0,1,0,0,0|2,0,1]=4 12 B15R1.2560 CCCC(=O)Nc1c(cccc1OC)O WXVL_AG2151SB0073 [0,0,1,0,0,0|2,0,1]=4 13 B15R1.2560 CCCC(=O)Nc1c(cccc1OC)O WXVL_AG2151SB0073 [0,0,1,0,0,0|2,0,1]=4 14 B15R1.2560 CCCC(=O)Nc1c(ccnc1OC)C WXVL_AF0367SB0073 [0,0,1,0,0,0|2,0,1]=4 15 B15R1.2560 CCCC(=O)Nc1c(ccnc1OC)C WXVL_AF0367SB0073 [0,0,1,0,0,0|2,0,1]=4 16 B15R1.2560 COCC(=O)Nc1c(cccc1OC)C WXVL_AG0358SB0090 [0,0,1,0,0,0|2,0,1]=4 17 B15R1.2560 COCC(=O)Nc1c(cccc1OC)C WXVL_AG0358SB0090 [0,0,1,0,0,0|2,0,1]=4 18 B15R1.2560 COc1cccc(c1NC(=O)CSC)C WXVL_AG0358SB1267 [0,0,1,0,0,0|2,0,1]=4 19 B15R1.2560 COc1cccc(c1NC(=O)CSC)C WXVL_AG0358SB1267 [0,0,1,0,0,0|2,0,1]=4 20 B15R2.2493 COc1cccc(c1c2ccon2)C WXVL_LR0685BT5008 [0,0,0,0,1,0|2,0,1]=4 21 B15R2.2493 COc1cccc(c1c2cn[nH]n2)C WXVL_LR0395BT5008 [0,0,0,0,1,0|3,0,0]=4 22 B15R2.2493 COc1cccc(c1c2nc[nH]n2)C WXVL_LR0419BT5008 [0,0,0,0,1,0|2,0,1]=4 23 B15R2.2493 COc1cccc(c1c2ncns2)C WXVL_LR0623BT5008 [0,0,0,0,1,0|1,1,1]=4 24 B17R2.1791 COc1cccc(c1Nc2ccncn2)C WXVL_AG0358LP3358 [0,0,0,0,0,1|1,0,2]=4 25 B17R2.1791 COc1cccc(c1Nc2ccncn2)C WXVL_AG0358LP3358 [0,0,0,0,0,1|1,0,2]=4 26 B17R2.1791 COc1cccc(c1Nc2ncccn2)C WXVL_AG0358LP0002 [0,0,0,0,0,1|1,0,2]=4 27 B17R2.1791 COc1cccc(c1Nc2ncccn2)C WXVL_AG0358LP0002 [0,0,0,0,0,1|1,0,2]=4 28 B14R1.2178 CCC(=O)Nc1c(cccc1OC)Br WXVL_AG2486SB0064 [1,0,1,0,0,0|1,0,1]=4 29 B14R1.2178 CCC(=O)Nc1c(cccc1OC)Br WXVL_AG2486SB0064 [1,0,1,0,0,0|1,0,1]=4 30 B14R1.2178 CCC(=O)Nc1c(cccc1OC)C WXVL_AG0358SB0064 [1,0,1,0,0,0|0,0,1]=3 31 B14R1.2178 CCC(=O)Nc1c(cccc1OC)C WXVL_AG0358SB0064 [1,0,1,0,0,0|0,0,1]=3 32 B14R1.2178 CCC(=O)Nc1c(cccc1OC)Cl WXVL_AG2171SB0064 [1,0,1,0,0,0|1,0,1]=4 33 B14R1.2178 CCC(=O)Nc1c(cccc1OC)Cl WXVL_AG2171SB0064 [1,0,1,0,0,0|1,0,1]=4 34 B14R1.2178 CCC(=O)Nc1c(cccc1OC)F WXVL_AG1384SB0064 [1,0,1,0,0,0|1,0,1]=4 35 B14R1.2178 CCC(=O)Nc1c(cccc1OC)F WXVL_AG1384SB0064 [1,0,1,0,0,0|1,0,1]=4 36 B14R1.2178 CCC(=O)Nc1c(cccc1OC)O WXVL_AG2151SB0064 [1,0,1,0,0,0|1,0,1]=4 37 B14R1.2178 CCC(=O)Nc1c(cccc1OC)O WXVL_AG2151SB0064 [1,0,1,0,0,0|1,0,1]=4 38 B14R1.2178 CCC(=O)Nc1c(ccnc1OC)C WXVL_AF0367SB0064 [1,0,1,0,0,0|1,0,1]=4 39 B14R1.2178 CCC(=O)Nc1c(ccnc1OC)C WXVL_AF0367SB0064 [1,0,1,0,0,0|1,0,1]=4 40 B14R1.2178 COc1cccc(c1NC(=O)CO)C WXVL_AG0358SB2706 [1,0,1,0,0,0|1,0,1]=4 41 B14R1.2178 COc1cccc(c1NC(=O)CO)C WXVL_AG0358SB2706 [1,0,1,0,0,0|1,0,1]=4 42 B14R1.965 CCCC(=O)Nc1ccccc1OC WXVL_AG00090SB0073 [1,0,1,0,0,0|1,0,1]=4 43 B14R1.965 CCCC(=O)Nc1ccccc1OC WXVL_AG00090SB0073 [1,0,1,0,0,0|1,0,1]=4 44 B14R1.965 CCNC(=O)Nc1ccccc1OC WXVL_AK00476YV0010 [1,0,1,0,0,0|0,0,2]=4 45 B14R1.965 CCNC(=O)Nc1ccccc1OC WXVL_AK00476YV0010 [1,0,1,0,0,0|0,0,2]=4 46 B14R1.19171 CCCC(=O)Nc1c(cccc1O)C WXVL_AG1331SB0073 [1,0,1,0,0,0|1,0,1]=4 47 B14R1.19171 CCCC(=O)Nc1c(cccc1O)C WXVL_AG1331SB0073 [1,0,1,0,0,0|1,0,1]=4 48 B14R1.19171 CCNC(=O)Nc1c(cccc1C)C WXVL_AK00476YV0014 [1,0,1,0,0,0|0,0,2]=4 49 B14R1.19171 CCNC(=O)Nc1c(cccc1C)C WXVL_AK00476YV0014 [1,0,1,0,0,0|0,0,2]=4 50 B16R1.2234 CCCC(=O)Nc1c(cccc1OC)CO WXVL_AG2206SB0073 [0,1,1,0,0,0|1,0,1]=4 51 B16R1.2234 CCCC(=O)Nc1c(cccc1OC)CO WXVL_AG2206SB0073 [0,1,1,0,0,0|1,0,1]=4 52 B16R1.2234 CCCC(=O)Nc1c(cccc1OC)OC WXVL_AG0403SB0073 [0,1,1,0,0,0|1,0,1]=4 53 B16R1.2234 CCCC(=O)Nc1c(cccc1OC)OC WXVL_AG0403SB0073 [0,1,1,0,0,0|1,0,1]=4 54 B16R1.19758 COc1cccc(c1NC(=O)CC(C)C)C WXVL_AG0358SB0063 [0,1,1,0,0,0|1,0,1]=4 55 B16R1.19758 COc1cccc(c1NC(=O)CC(C)C)C WXVL_AG0358SB0063 [0,1,1,0,0,0|1,0,1]=4 56 B16R1.19758 COc1cccc(c1NC(=O)CC(C)O)C WXVL_AG0358SB3643 [0,1,1,0,0,0|1,0,1]=4 57 B16R1.19758 COc1cccc(c1NC(=O)CC(C)O)C WXVL_AG0358SB3643 [0,1,1,0,0,0|1,0,1]=4 58 B16R1.25706 CCCC(=O)Nc1c(cccc1OCC)C WXVL_AG00238SB0073 [0,1,1,0,0,0|1,0,1]=4 59 B16R1.25706 CCCC(=O)Nc1c(cccc1OCC)C WXVL_AG00238SB0073 [0,1,1,0,0,0|1,0,1]=4 60 B16R1.71801 CCCC(=O)Nc1c(cc(cc1OC)Br)C WXVL_AG1343SB0073 [0,1,1,0,0,0|1,0,1]=4 61 B16R1.71801 CCCC(=O)Nc1c(cc(cc1OC)Br)C WXVL_AG1343SB0073 [0,1,1,0,0,0|1,0,1]=4 62 B16R1.86889 CCC(=O)C(=O)Nc1c(cccc1OC)C WXVL_AG0358SB0344 [0,1,1,0,0,0|1,0,1]=4 63 B16R1.86889 CCC(=O)C(=O)Nc1c(cccc1OC)C WXVL_AG0358SB0344 [0,1,1,0,0,0|1,0,1]=4 64 B16R1.86889 CCC(C)C(=O)Nc1c(cccc1OC)C WXVL_AG0358SB0054 [0,1,1,0,0,0|1,0,1]=4 65 B16R1.86889 CCC(C)C(=O)Nc1c(cccc1OC)C WXVL_AG0358SB0054 [0,1,1,0,0,0|1,0,1]=4 66 B16R1.86889 CC[C@@H](C)C(=O)Nc1c(cccc1OC)C WXVL_AG0358SB00054 [0,1,1,0,0,0|1,0,1]=4 67 B16R1.86889 CC[C@@H](C)C(=O)Nc1c(cccc1OC)C WXVL_AG0358SB00054 [0,1,1,0,0,0|1,0,1]=4 68 B16R1.86889 CC[C@H](O)C(=O)Nc1c(cccc1OC)C WXVL_AG0358SB3573 [0,1,1,0,0,0|1,0,1]=4 69 B16R1.86889 CC[C@H](O)C(=O)Nc1c(cccc1OC)C WXVL_AG0358SB3573 [0,1,1,0,0,0|1,0,1]=4 70 B16R1.91108 CCOCC(=O)Nc1c(cccc1OC)Br WXVL_AG2486SB0091 [0,1,1,0,0,0|2,0,0]=4 71 B16R1.91108 CCOCC(=O)Nc1c(cccc1OC)Br WXVL_AG2486SB0091 [0,1,1,0,0,0|2,0,0]=4 72 B16R1.91108 CCOCC(=O)Nc1c(cccc1OC)C WXVL_AG0358SB0091 [0,1,1,0,0,0|1,0,0]=3 73 B16R1.91108 CCOCC(=O)Nc1c(cccc1OC)C WXVL_AG0358SB0091 [0,1,1,0,0,0|1,0,0]=3 74 B16R1.91108 CCOCC(=O)Nc1c(cccc1OC)Cl WXVL_AG2171SB0091 [0,1,1,0,0,0|2,0,0]=4 75 B16R1.91108 CCOCC(=O)Nc1c(cccc1OC)Cl WXVL_AG2171SB0091 [0,1,1,0,0,0|2,0,0]=4 76 B16R1.91108 CCOCC(=O)Nc1c(cccc1OC)F WXVL_AG1384SB0091 [0,1,1,0,0,0|2,0,0]=4 77 B16R1.91108 CCOCC(=O)Nc1c(cccc1OC)F WXVL_AG1384SB0091 [0,1,1,0,0,0|2,0,0]=4 78 B16R1.91108 CCOCC(=O)Nc1c(cccc1OC)O WXVL_AG2151SB0091 [0,1,1,0,0,0|2,0,0]=4 79 B16R1.91108 CCOCC(=O)Nc1c(cccc1OC)O WXVL_AG2151SB0091 [0,1,1,0,0,0|2,0,0]=4 80 B16R1.91108 CCOCC(=O)Nc1c(ccnc1OC)C WXVL_AF0367SB0091 [0,1,1,0,0,0|2,0,0]=4 81 B16R1.91108 CCOCC(=O)Nc1c(ccnc1OC)C WXVL_AF0367SB0091 [0,1,1,0,0,0|2,0,0]=4 82 B16R1.91108 CCSCC(=O)Nc1c(cccc1OC)C WXVL_AG0358SB0002 [0,1,1,0,0,0|1,0,1]=4 83 B16R1.91108 CCSCC(=O)Nc1c(cccc1OC)C WXVL_AG0358SB0002 [0,1,1,0,0,0|1,0,1]=4 84 B16R1.91108 COCCC(=O)Nc1c(cccc1OC)C WXVL_AG0358SB0156 [0,1,1,0,0,0|1,0,1]=4 85 B16R1.91108 COCCC(=O)Nc1c(cccc1OC)C WXVL_AG0358SB0156 [0,1,1,0,0,0|1,0,1]=4 86 B16R1.91108 COc1cccc(c1NC(=O)CCSC)C WXVL_AG0358SB0361 [0,1,1,0,0,0|1,0,1]=4 87 B16R1.91108 COc1cccc(c1NC(=O)CCSC)C WXVL_AG0358SB0361 [0,1,1,0,0,0|1,0,1]=4 88 B16R1.91108 COc1cccc(c1NC(=O)NCCCl)C WXVL_AG0358YV0092 [0,1,1,0,0,0|0,0,2]=4 89 B16R1.91108 COc1cccc(c1NC(=O)NCCCl)C WXVL_AG0358YV0092 [0,1,1,0,0,0|0,0,2]=4 90 B16R2.41377 COc1cccc(c1c2nnc(o2)C)C WXVL_LR0506BT5008 [0,1,0,0,1,0|1,0,1]=4 91 B18R2.118100 COc1cccc(c1NC(=O)C2CCCO2)C WXVL_AG0358SB1033 [0,1,0,0,0,1|1,0,1]=4 92 B18R2.118100 COc1cccc(c1NC(=O)C2CCCO2)C WXVL_AG0358SB1033 [0,1,0,0,0,1|1,0,1]=4 93 B18R2.118100 COc1cccc(c1NC(=O)[C@H]2CCCO2)C WXVL_AG0358SB00043 [0,1,0,0,0,1|1,0,1]=4 94 B18R2.118100 COc1cccc(c1NC(=O)[C@H]2CCCO2)C WXVL_AG0358SB00043 [0,1,0,0,0,1|1,0,1]=4 95 B18R2.118274 COc1cccc(c1C(=O)Nc2ncco2)C WXVL_AF0235SD0833 [0,1,0,0,0,1|0,0,2]=4 96 B18R2.118274 COc1cccc(c1C(=O)Nc2ncco2)C WXVL_AF0235SD0833 [0,1,0,0,0,1|0,0,2]=4 97 B18R2.118274 COc1cccc(c1C(=O)Nc2nnco2)C WXVL_AF0087SD0833 [0,1,0,0,0,1|1,0,1]=4 98 B18R2.118274 COc1cccc(c1C(=O)Nc2nnco2)C WXVL_AF0087SD0833 [0,1,0,0,0,1|1,0,1]=4 99 B16R2.201416 COc1cccc(c1NC(=O)C2CC2)C WXVL_AG0358SB0038 [0,0,1,1,0,0|1,0,1]=4 100 B16R2.201416 COc1cccc(c1NC(=O)C2CC2)C WXVL_AG0358SB0038 [0,0,1,1,0,0|1,0,1]=4 101 B14R1.7276 CCNC(=O)c1c(cccc1OC)C WXVL_AK00476SD0833 [0,0,1,0,1,0|0,0,2]=4 102 B14R1.7276 CCNC(=O)c1c(cccc1OC)C WXVL_AK00476SD0833 [0,0,1,0,1,0|0,0,2]=4