0 B16R2.36 CC(=O)NCCc1c[nH]c2c1cccc2 WXVL_AK0298SB0150 [0,0,0,0,0,0|0,0,0]=0 1 B16R2.36 CC(=O)NCCc1c[nH]c2c1cccc2 WXVL_AK0298SB0150 [0,0,0,0,0,0|0,0,0]=0 2 B16R2.36 CC(=O)NCCc1coc2c1cccc2 WXVL_AK2803SB0150 [0,0,0,0,0,0|1,0,0]=1 3 B16R2.36 CC(=O)NCCc1coc2c1cccc2 WXVL_AK2803SB0150 [0,0,0,0,0,0|1,0,0]=1 4 B17R2.4 C#CC(=O)NCCc1c[nH]c2c1cccc2 WXVL_AK0298SB0338 [0,1,0,0,0,0|0,0,1]=2 5 B17R2.4 C#CC(=O)NCCc1c[nH]c2c1cccc2 WXVL_AK0298SB0338 [0,1,0,0,0,0|0,0,1]=2 6 B17R2.4 C#CC(=O)NCCc1coc2c1cccc2 WXVL_AK2803SB0338 [0,1,0,0,0,0|1,0,1]=3 7 B17R2.4 C#CC(=O)NCCc1coc2c1cccc2 WXVL_AK2803SB0338 [0,1,0,0,0,0|1,0,1]=3 8 B17R2.4 CCC(=O)NCCc1c[nH]c2c1cccc2 WXVL_AK0298SB0064 [0,1,0,0,0,0|0,0,0]=1 9 B17R2.4 CCC(=O)NCCc1c[nH]c2c1cccc2 WXVL_AK0298SB0064 [0,1,0,0,0,0|0,0,0]=1 10 B17R2.4 CCC(=O)NCCc1coc2c1cccc2 WXVL_AK2803SB0064 [0,1,0,0,0,0|1,0,0]=2 11 B17R2.4 CCC(=O)NCCc1coc2c1cccc2 WXVL_AK2803SB0064 [0,1,0,0,0,0|1,0,0]=2 12 B17R2.4 O=C(CO)NCCc1c[nH]c2c1cccc2 WXVL_AK0298SB2706 [0,1,0,0,0,0|0,0,0]=1 13 B17R2.4 O=C(CO)NCCc1c[nH]c2c1cccc2 WXVL_AK0298SB2706 [0,1,0,0,0,0|0,0,0]=1 14 B17R2.4 O=C(CO)NCCc1coc2c1cccc2 WXVL_AK2803SB2706 [0,1,0,0,0,0|1,0,0]=2 15 B17R2.4 O=C(CO)NCCc1coc2c1cccc2 WXVL_AK2803SB2706 [0,1,0,0,0,0|1,0,0]=2 16 B17R2.16 CC(=O)C(=O)NCc1c[nH]c2c1cccc2 WXVL_AK0528SB0051 [0,1,0,0,0,0|2,0,0]=3 17 B17R2.16 CC(=O)C(=O)NCc1c[nH]c2c1cccc2 WXVL_AK0528SB0051 [0,1,0,0,0,0|2,0,0]=3 18 B17R2.16 CC(=O)C(=O)NCc1csc2c1cccc2 WXVL_AK3951SB0051 [0,1,0,0,0,0|3,0,0]=4 19 B17R2.16 CC(=O)C(=O)NCc1csc2c1cccc2 WXVL_AK3951SB0051 [0,1,0,0,0,0|3,0,0]=4 20 B17R2.16 CC(=O)C(=O)NCc1n[nH]c2c1cccc2 WXVL_AK1533SB0051 [0,1,0,0,0,0|3,0,0]=4 21 B17R2.16 CC(=O)C(=O)NCc1n[nH]c2c1cccc2 WXVL_AK1533SB0051 [0,1,0,0,0,0|3,0,0]=4 22 B17R2.16 CN(C)C(=O)CCc1c[nH]c2c1cccc2 WXVL_AN0032SA0021 [0,1,0,0,0,0|3,0,0]=4 23 B17R2.16 CN(C)C(=O)CCc1c[nH]c2c1cccc2 WXVL_AN0032SA0021 [0,1,0,0,0,0|3,0,0]=4 24 B17R2.16 NC(=O)C(=O)NCc1c[nH]c2c1cccc2 WXVL_AK0528SB0128 [0,1,0,0,0,0|3,0,0]=4 25 B17R2.16 NC(=O)C(=O)NCc1c[nH]c2c1cccc2 WXVL_AK0528SB0128 [0,1,0,0,0,0|3,0,0]=4 26 B17R2.39 CC(C)NC(=O)Cc1c[nH]c2c1cccc2 WXVL_AK0030SA00109 [0,1,0,0,0,0|1,0,2]=4 27 B17R2.39 CC(C)NC(=O)Cc1c[nH]c2c1cccc2 WXVL_AK0030SA00109 [0,1,0,0,0,0|1,0,2]=4 28 B17R2.3451 CC(=O)NCCc1c[nH]c2c1ccc(c2)F WXVL_AK00605SB0150 [0,1,0,0,0,0|0,0,0]=1 29 B17R2.3451 CC(=O)NCCc1c[nH]c2c1ccc(c2)F WXVL_AK00605SB0150 [0,1,0,0,0,0|0,0,0]=1 30 B17R2.5025 CC(=O)NCCc1c([nH]c2c1cccc2)C WXVL_AK0966SB0150 [0,1,0,0,0,0|0,0,0]=1 31 B17R2.5025 CC(=O)NCCc1c([nH]c2c1cccc2)C WXVL_AK0966SB0150 [0,1,0,0,0,0|0,0,0]=1 32 B17R2.5025 NC(=O)CCCn1c(=O)[nH]c2c1cccc2 WXVL_AK0084SA00071 [0,1,0,0,0,0|3,0,0]=4 33 B17R2.5025 NC(=O)CCCn1c(=O)[nH]c2c1cccc2 WXVL_AK0084SA00071 [0,1,0,0,0,0|3,0,0]=4 34 B17R2.25462 CC(=O)NCCc1c[nH]c2c1cc(cc2)C WXVL_AK00472SB0150 [0,1,0,0,0,0|0,0,0]=1 35 B17R2.25462 CC(=O)NCCc1c[nH]c2c1cc(cc2)C WXVL_AK00472SB0150 [0,1,0,0,0,0|0,0,0]=1 36 B17R2.25462 CC(=O)NCCc1c[nH]c2c1cc(cc2)Cl WXVL_AK00473SB0150 [0,1,0,0,0,0|0,0,0]=1 37 B17R2.25462 CC(=O)NCCc1c[nH]c2c1cc(cc2)Cl WXVL_AK00473SB0150 [0,1,0,0,0,0|0,0,0]=1 38 B17R2.25462 CC(=O)NCCc1c[nH]c2c1cc(cc2)O WXVL_AK1841SB0150 [0,1,0,0,0,0|0,0,0]=1 39 B17R2.25462 CC(=O)NCCc1c[nH]c2c1cc(cc2)O WXVL_AK1841SB0150 [0,1,0,0,0,0|0,0,0]=1 40 B15R1.84 COc1ccccc1OCCNC(=O)C WXVL_AK1067SB0150 [0,0,1,0,0,0|2,0,1]=4 41 B15R1.84 COc1ccccc1OCCNC(=O)C WXVL_AK1067SB0150 [0,0,1,0,0,0|2,0,1]=4 42 B15R1.84 CSc1ccccc1OCCNC(=O)C WXVL_AK4000SB0150 [0,0,1,0,0,0|2,0,1]=4 43 B15R1.84 CSc1ccccc1OCCNC(=O)C WXVL_AK4000SB0150 [0,0,1,0,0,0|2,0,1]=4 44 B15R1.504 CC(=O)NCCCOCc1ccccc1 WXVL_AK2136SB0150 [0,0,1,0,0,0|2,0,1]=4 45 B15R1.504 CC(=O)NCCCOCc1ccccc1 WXVL_AK2136SB0150 [0,0,1,0,0,0|2,0,1]=4 46 B15R2.6 CC(=O)NCc1c[nH]c2c1cccc2 WXVL_AK0528SB0150 [0,0,0,0,1,0|0,0,0]=1 47 B15R2.6 CC(=O)NCc1c[nH]c2c1cccc2 WXVL_AK0528SB0150 [0,0,0,0,1,0|0,0,0]=1 48 B15R2.6 CC(=O)NCc1cnc2n1cccc2 WXVL_AK00293SB0150 [0,0,0,0,1,0|1,0,1]=3 49 B15R2.6 CC(=O)NCc1cnc2n1cccc2 WXVL_AK00293SB0150 [0,0,0,0,1,0|1,0,1]=3 50 B15R2.6 CC(=O)NCc1csc2c1cccc2 WXVL_AK3951SB0150 [0,0,0,0,1,0|1,0,0]=2 51 B15R2.6 CC(=O)NCc1csc2c1cccc2 WXVL_AK3951SB0150 [0,0,0,0,1,0|1,0,0]=2 52 B15R2.6 CC(=O)NCc1n[nH]c2c1cccc2 WXVL_AK1533SB0150 [0,0,0,0,1,0|1,0,0]=2 53 B15R2.6 CC(=O)NCc1n[nH]c2c1cccc2 WXVL_AK1533SB0150 [0,0,0,0,1,0|1,0,0]=2 54 B15R2.6 NC(=O)/C=C/c1c[nH]c2c1cccc2 WXVL_AK0084SA0059 [0,0,0,0,1,0|1,0,2]=4 55 B15R2.6 NC(=O)/C=C/c1c[nH]c2c1cccc2 WXVL_AK0084SA0059 [0,0,0,0,1,0|1,0,2]=4 56 B15R2.6 NC(=O)CCc1c[nH]c2c1cccc2 WXVL_AK0084SA0021 [0,0,0,0,1,0|1,0,0]=2 57 B15R2.6 NC(=O)CCc1c[nH]c2c1cccc2 WXVL_AK0084SA0021 [0,0,0,0,1,0|1,0,0]=2 58 B15R2.6 NC(=O)CCc1c[nH]c2c1cccn2 WXVL_AK0084SB2286 [0,0,0,0,1,0|2,0,0]=3 59 B15R2.6 NC(=O)CCc1c[nH]c2c1cccn2 WXVL_AK0084SB2286 [0,0,0,0,1,0|2,0,0]=3 60 B15R2.6 NC(=O)CCn1ccc2c1cccc2 WXVL_AK0084SB1610 [0,0,0,0,1,0|3,0,0]=4 61 B15R2.6 NC(=O)CCn1ccc2c1cccc2 WXVL_AK0084SB1610 [0,0,0,0,1,0|3,0,0]=4 62 B15R2.6 NC(=O)CCn1cnc2c1cccc2 WXVL_AK0084SB1350 [0,0,0,0,1,0|2,0,1]=4 63 B15R2.6 NC(=O)CCn1cnc2c1cccc2 WXVL_AK0084SB1350 [0,0,0,0,1,0|2,0,1]=4 64 B17R2.137 CC(=O)NCCCc1c[nH]c2c1cccc2 WXVL_AK1422SB0150 [0,0,0,0,0,1|0,0,0]=1 65 B17R2.137 CC(=O)NCCCc1c[nH]c2c1cccc2 WXVL_AK1422SB0150 [0,0,0,0,0,1|0,0,0]=1 66 B17R2.5669 CC(=O)NCCc1ccc2ccccc2c1 WXVL_AK2322SB0150 [0,0,0,0,0,1|1,0,0]=2 67 B17R2.5669 CC(=O)NCCc1ccc2ccccc2c1 WXVL_AK2322SB0150 [0,0,0,0,0,1|1,0,0]=2 68 B17R2.5669 CC(=O)NCCc1ccc2ccccc2n1 WXVL_AK4300SB0150 [0,0,0,0,0,1|1,0,0]=2 69 B17R2.5669 CC(=O)NCCc1ccc2ccccc2n1 WXVL_AK4300SB0150 [0,0,0,0,0,1|1,0,0]=2 70 B17R2.291558 CC(=O)NCCc1cccc2c1cccc2 WXVL_AK9968SB0150 [0,0,0,0,0,1|1,0,0]=2 71 B17R2.291558 CC(=O)NCCc1cccc2c1cccc2 WXVL_AK9968SB0150 [0,0,0,0,0,1|1,0,0]=2 72 B14R1.159 CC(=O)NCCOc1ccccc1C WXVL_AK1111SB0150 [1,0,1,0,0,0|1,0,1]=4 73 B14R1.159 CC(=O)NCCOc1ccccc1C WXVL_AK1111SB0150 [1,0,1,0,0,0|1,0,1]=4 74 B14R1.159 CC(=O)NCCOc1ccccc1Cl WXVL_AK0815SB0150 [1,0,1,0,0,0|2,0,0]=4 75 B14R1.159 CC(=O)NCCOc1ccccc1Cl WXVL_AK0815SB0150 [1,0,1,0,0,0|2,0,0]=4 76 B14R1.420 CC(=O)NCCN(C)c1ccccc1 WXVL_AK00706SB0150 [1,0,1,0,0,0|1,0,1]=4 77 B14R1.420 CC(=O)NCCN(C)c1ccccc1 WXVL_AK00706SB0150 [1,0,1,0,0,0|1,0,1]=4 78 B16R1.608 CC(=O)NCCC(=O)NCc1ccccc1 WXVL_AK00502SB0374 [0,1,1,0,0,0|2,0,0]=4 79 B16R1.608 CC(=O)NCCC(=O)NCc1ccccc1 WXVL_AK00502SB0374 [0,1,1,0,0,0|2,0,0]=4 80 B16R1.610 CC(=O)NCCNC(=O)Cc1ccccc1 WXVL_AK0057SB0092 [0,1,1,0,0,0|2,0,0]=4 81 B16R1.610 CC(=O)NCCNC(=O)Cc1ccccc1 WXVL_AK0057SB0092 [0,1,1,0,0,0|2,0,0]=4 82 B16R1.610 CC(=O)NCCNC(=O)Nc1ccccn1 WXVL_AK0057YV0189 [0,1,1,0,0,0|2,0,0]=4 83 B16R1.610 CC(=O)NCCNC(=O)Nc1ccccn1 WXVL_AK0057YV0189 [0,1,1,0,0,0|2,0,0]=4 84 B16R2.5 CCNC(=O)Cc1c[nH]c2c1cccc2 WXVL_AK00476SA00109 [1,1,0,0,0,0|0,0,2]=4 85 B16R2.5 CCNC(=O)Cc1c[nH]c2c1cccc2 WXVL_AK00476SA00109 [1,1,0,0,0,0|0,0,2]=4 86 B16R2.14 CNC(=O)CCc1c[nH]c2c1cccc2 WXVL_AK00442SA0021 [1,1,0,0,0,0|2,0,0]=4 87 B16R2.14 CNC(=O)CCc1c[nH]c2c1cccc2 WXVL_AK00442SA0021 [1,1,0,0,0,0|2,0,0]=4 88 B16R2.12 CC(=O)C(=O)Nc1c[nH]c2c1cccc2 WXVL_AF00227SB0051 [0,1,0,0,1,0|1,0,1]=4 89 B16R2.12 CC(=O)C(=O)Nc1c[nH]c2c1cccc2 WXVL_AF00227SB0051 [0,1,0,0,1,0|1,0,1]=4 90 B16R2.15551 NC(=O)CCc1c[nH]c2c1cc(cc2)F WXVL_AK0084SB6827 [0,1,0,0,1,0|1,0,0]=3 91 B16R2.15551 NC(=O)CCc1c[nH]c2c1cc(cc2)F WXVL_AK0084SB6827 [0,1,0,0,1,0|1,0,0]=3 92 B16R2.104522 CC(=O)NCc1cn(c2c1cccc2)C WXVL_AK0543SB0150 [0,1,0,0,1,0|0,0,0]=2 93 B16R2.104522 CC(=O)NCc1cn(c2c1cccc2)C WXVL_AK0543SB0150 [0,1,0,0,1,0|0,0,0]=2 94 B18R2.11 C=C(C)CNC(=O)Cc1c[nH]c2c1cccc2 WXVL_AK0761SA00109 [0,1,0,0,0,1|1,0,1]=4 95 B18R2.11 C=C(C)CNC(=O)Cc1c[nH]c2c1cccc2 WXVL_AK0761SA00109 [0,1,0,0,0,1|1,0,1]=4 96 B18R2.11 CC(=O)CCC(=O)Nc1c[nH]c2c1cccc2 WXVL_AF00227SB0072 [0,1,0,0,0,1|1,0,1]=4 97 B18R2.11 CC(=O)CCC(=O)Nc1c[nH]c2c1cccc2 WXVL_AF00227SB0072 [0,1,0,0,0,1|1,0,1]=4 98 B18R2.11 CC(=O)NCC(=O)Nc1c[nH]c2c1cccc2 WXVL_AF00227SB0357 [0,1,0,0,0,1|0,0,1]=3 99 B18R2.11 CC(=O)NCC(=O)Nc1c[nH]c2c1cccc2 WXVL_AF00227SB0357 [0,1,0,0,0,1|0,0,1]=3 100 B18R2.11 CC(=O)NCC(=O)Nc1c[nH]c2c1cccn2 WXVL_AF00256SB0357 [0,1,0,0,0,1|1,0,1]=4 101 B18R2.11 CC(=O)NCC(=O)Nc1c[nH]c2c1cccn2 WXVL_AF00256SB0357 [0,1,0,0,0,1|1,0,1]=4 102 B18R2.11 CC(=O)NCC(=O)Nc1n[nH]c2c1cccc2 WXVL_AF2666SB0357 [0,1,0,0,0,1|1,0,1]=4 103 B18R2.11 CC(=O)NCC(=O)Nc1n[nH]c2c1cccc2 WXVL_AF2666SB0357 [0,1,0,0,0,1|1,0,1]=4 104 B18R2.11 CC(=O)OCC(=O)Nc1c[nH]c2c1cccc2 WXVL_AF00227SB2824 [0,1,0,0,0,1|1,0,1]=4 105 B18R2.11 CC(=O)OCC(=O)Nc1c[nH]c2c1cccc2 WXVL_AF00227SB2824 [0,1,0,0,0,1|1,0,1]=4 106 B18R2.11 CC(=O)SCC(=O)Nc1c[nH]c2c1cccc2 WXVL_AF00227SB3992 [0,1,0,0,0,1|1,0,1]=4 107 B18R2.11 CC(=O)SCC(=O)Nc1c[nH]c2c1cccc2 WXVL_AF00227SB3992 [0,1,0,0,0,1|1,0,1]=4 108 B18R2.11 NC(=O)CNC(=O)Cc1c[nH]c2c1cccc2 WXVL_AK0147SA00109 [0,1,0,0,0,1|1,0,1]=4 109 B18R2.11 NC(=O)CNC(=O)Cc1c[nH]c2c1cccc2 WXVL_AK0147SA00109 [0,1,0,0,0,1|1,0,1]=4 110 B18R2.11 NC(=O)NCC(=O)Nc1c[nH]c2c1cccc2 WXVL_AF00227SB0746 [0,1,0,0,0,1|1,0,1]=4 111 B18R2.11 NC(=O)NCC(=O)Nc1c[nH]c2c1cccc2 WXVL_AF00227SB0746 [0,1,0,0,0,1|1,0,1]=4 112 B18R2.178 CC(C)NC(=O)CCc1c[nH]c2c1cccc2 WXVL_AK0030SA0021 [0,1,0,0,0,1|1,0,1]=4 113 B18R2.178 CC(C)NC(=O)CCc1c[nH]c2c1cccc2 WXVL_AK0030SA0021 [0,1,0,0,0,1|1,0,1]=4 114 B18R2.179 C=C(F)C(=O)NCCc1c[nH]c2c1cccc2 WXVL_AK0298SB1376 [0,1,0,0,0,1|1,0,1]=4 115 B18R2.179 C=C(F)C(=O)NCCc1c[nH]c2c1cccc2 WXVL_AK0298SB1376 [0,1,0,0,0,1|1,0,1]=4 116 B18R2.179 CC(=O)C(=O)NCCc1c[nH]c2c1cccc2 WXVL_AK0298SB0051 [0,1,0,0,0,1|0,0,0]=2 117 B18R2.179 CC(=O)C(=O)NCCc1c[nH]c2c1cccc2 WXVL_AK0298SB0051 [0,1,0,0,0,1|0,0,0]=2 118 B18R2.179 CC(=O)C(=O)NCCc1coc2c1cccc2 WXVL_AK2803SB0051 [0,1,0,0,0,1|1,0,0]=3 119 B18R2.179 CC(=O)C(=O)NCCc1coc2c1cccc2 WXVL_AK2803SB0051 [0,1,0,0,0,1|1,0,0]=3 120 B18R2.179 CC(C)C(=O)NCCc1c[nH]c2c1cccc2 WXVL_AK0298SB0052 [0,1,0,0,0,1|1,0,1]=4 121 B18R2.179 CC(C)C(=O)NCCc1c[nH]c2c1cccc2 WXVL_AK0298SB0052 [0,1,0,0,0,1|1,0,1]=4 122 B18R2.179 CC(S)C(=O)NCCc1c[nH]c2c1cccc2 WXVL_AK0298SB2708 [0,1,0,0,0,1|0,1,1]=4 123 B18R2.179 CC(S)C(=O)NCCc1c[nH]c2c1cccc2 WXVL_AK0298SB2708 [0,1,0,0,0,1|0,1,1]=4 124 B18R2.179 C[C@@H](O)C(=O)NCCc1c[nH]c2c1cccc2 WXVL_AK0298SB1085 [0,1,0,0,0,1|0,0,2]=4 125 B18R2.179 C[C@@H](O)C(=O)NCCc1c[nH]c2c1cccc2 WXVL_AK0298SB1085 [0,1,0,0,0,1|0,0,2]=4 126 B18R2.179 NC(=O)C(=O)NCCc1c[nH]c2c1cccc2 WXVL_AK0298SB0128 [0,1,0,0,0,1|1,0,0]=3 127 B18R2.179 NC(=O)C(=O)NCCc1c[nH]c2c1cccc2 WXVL_AK0298SB0128 [0,1,0,0,0,1|1,0,0]=3 128 B18R2.179 NC(=O)C(=O)NCCc1coc2c1cccc2 WXVL_AK2803SB0128 [0,1,0,0,0,1|2,0,0]=4 129 B18R2.179 NC(=O)C(=O)NCCc1coc2c1cccc2 WXVL_AK2803SB0128 [0,1,0,0,0,1|2,0,0]=4 130 B18R2.375 C#CC(=O)NCCCc1c[nH]c2c1cccc2 WXVL_AK1422SB0338 [0,1,0,0,0,1|0,0,1]=3 131 B18R2.375 C#CC(=O)NCCCc1c[nH]c2c1cccc2 WXVL_AK1422SB0338 [0,1,0,0,0,1|0,0,1]=3 132 B18R2.375 CCC(=O)NCCCc1c[nH]c2c1cccc2 WXVL_AK1422SB0064 [0,1,0,0,0,1|0,0,0]=2 133 B18R2.375 CCC(=O)NCCCc1c[nH]c2c1cccc2 WXVL_AK1422SB0064 [0,1,0,0,0,1|0,0,0]=2 134 B18R2.375 O=C(CO)NCCCc1c[nH]c2c1cccc2 WXVL_AK1422SB2706 [0,1,0,0,0,1|0,0,0]=2 135 B18R2.375 O=C(CO)NCCCc1c[nH]c2c1cccc2 WXVL_AK1422SB2706 [0,1,0,0,0,1|0,0,0]=2 136 B18R2.40893 CC(=O)NCCCc1c[nH]c2c1cc(cc2)Cl WXVL_AK00815SB0150 [0,1,0,0,0,1|0,0,0]=2 137 B18R2.40893 CC(=O)NCCCc1c[nH]c2c1cc(cc2)Cl WXVL_AK00815SB0150 [0,1,0,0,0,1|0,0,0]=2 138 B18R2.9469 C#CC(=O)NCCc1ccc2ccccc2c1 WXVL_AK2322SB0338 [0,1,0,0,0,1|1,0,1]=4 139 B18R2.9469 C#CC(=O)NCCc1ccc2ccccc2c1 WXVL_AK2322SB0338 [0,1,0,0,0,1|1,0,1]=4 140 B18R2.9469 C#CC(=O)NCCc1ccc2ccccc2n1 WXVL_AK4300SB0338 [0,1,0,0,0,1|1,0,1]=4 141 B18R2.9469 C#CC(=O)NCCc1ccc2ccccc2n1 WXVL_AK4300SB0338 [0,1,0,0,0,1|1,0,1]=4 142 B18R2.9469 CCC(=O)NCCc1ccc2ccccc2c1 WXVL_AK2322SB0064 [0,1,0,0,0,1|1,0,0]=3 143 B18R2.9469 CCC(=O)NCCc1ccc2ccccc2c1 WXVL_AK2322SB0064 [0,1,0,0,0,1|1,0,0]=3 144 B18R2.9469 CCC(=O)NCCc1ccc2ccccc2n1 WXVL_AK4300SB0064 [0,1,0,0,0,1|1,0,0]=3 145 B18R2.9469 CCC(=O)NCCc1ccc2ccccc2n1 WXVL_AK4300SB0064 [0,1,0,0,0,1|1,0,0]=3 146 B18R2.9469 O=C(CO)NCCc1ccc2ccccc2c1 WXVL_AK2322SB2706 [0,1,0,0,0,1|1,0,0]=3 147 B18R2.9469 O=C(CO)NCCc1ccc2ccccc2c1 WXVL_AK2322SB2706 [0,1,0,0,0,1|1,0,0]=3 148 B18R2.9469 O=C(CO)NCCc1ccc2ccccc2n1 WXVL_AK4300SB2706 [0,1,0,0,0,1|1,0,0]=3 149 B18R2.9469 O=C(CO)NCCc1ccc2ccccc2n1 WXVL_AK4300SB2706 [0,1,0,0,0,1|1,0,0]=3 150 B18R2.741502 C#CC(=O)NCCc1cccc2c1cccc2 WXVL_AK9968SB0338 [0,1,0,0,0,1|1,0,1]=4 151 B18R2.741502 C#CC(=O)NCCc1cccc2c1cccc2 WXVL_AK9968SB0338 [0,1,0,0,0,1|1,0,1]=4 152 B18R2.741502 CCC(=O)NCCc1cccc2c1cccc2 WXVL_AK9968SB0064 [0,1,0,0,0,1|1,0,0]=3 153 B18R2.741502 CCC(=O)NCCc1cccc2c1cccc2 WXVL_AK9968SB0064 [0,1,0,0,0,1|1,0,0]=3 154 B18R2.741502 O=C(CO)NCCc1cccc2c1cccc2 WXVL_AK9968SB2706 [0,1,0,0,0,1|1,0,0]=3 155 B18R2.741502 O=C(CO)NCCc1cccc2c1cccc2 WXVL_AK9968SB2706 [0,1,0,0,0,1|1,0,0]=3 156 B18R2.9 C#CCC(=O)NCCc1c[nH]c2c1cccc2 WXVL_AK0298SB3070 [0,2,0,0,0,0|0,0,0]=2 157 B18R2.9 C#CCC(=O)NCCc1c[nH]c2c1cccc2 WXVL_AK0298SB3070 [0,2,0,0,0,0|0,0,0]=2 158 B18R2.9 C#CCC(=O)NCCc1coc2c1cccc2 WXVL_AK2803SB3070 [0,2,0,0,0,0|1,0,0]=3 159 B18R2.9 C#CCC(=O)NCCc1coc2c1cccc2 WXVL_AK2803SB3070 [0,2,0,0,0,0|1,0,0]=3 160 B18R2.9 C/C=C/C(=O)NCCc1c[nH]c2c1cccc2 WXVL_AK0298SB0340 [0,2,0,0,0,0|0,0,0]=2 161 B18R2.9 C/C=C/C(=O)NCCc1c[nH]c2c1cccc2 WXVL_AK0298SB0340 [0,2,0,0,0,0|0,0,0]=2 162 B18R2.9 C/C=C/C(=O)NCCc1coc2c1cccc2 WXVL_AK2803SB0340 [0,2,0,0,0,0|1,0,0]=3 163 B18R2.9 C/C=C/C(=O)NCCc1coc2c1cccc2 WXVL_AK2803SB0340 [0,2,0,0,0,0|1,0,0]=3 164 B18R2.9 C=CCC(=O)NCCc1c[nH]c2c1cccc2 WXVL_AK0298SB2732 [0,2,0,0,0,0|0,0,0]=2 165 B18R2.9 C=CCC(=O)NCCc1c[nH]c2c1cccc2 WXVL_AK0298SB2732 [0,2,0,0,0,0|0,0,0]=2 166 B18R2.9 C=CCC(=O)NCCc1coc2c1cccc2 WXVL_AK2803SB2732 [0,2,0,0,0,0|1,0,0]=3 167 B18R2.9 C=CCC(=O)NCCc1coc2c1cccc2 WXVL_AK2803SB2732 [0,2,0,0,0,0|1,0,0]=3 168 B18R2.9 CC#CC(=O)NCCc1c[nH]c2c1cccc2 WXVL_AK0298SB1240 [0,2,0,0,0,0|0,0,0]=2 169 B18R2.9 CC#CC(=O)NCCc1c[nH]c2c1cccc2 WXVL_AK0298SB1240 [0,2,0,0,0,0|0,0,0]=2 170 B18R2.9 CC#CC(=O)NCCc1coc2c1cccc2 WXVL_AK2803SB1240 [0,2,0,0,0,0|1,0,0]=3 171 B18R2.9 CC#CC(=O)NCCc1coc2c1cccc2 WXVL_AK2803SB1240 [0,2,0,0,0,0|1,0,0]=3 172 B18R2.9 CCCC(=O)NCCc1c[nH]c2c1cccc2 WXVL_AK0298SB0073 [0,2,0,0,0,0|0,0,0]=2 173 B18R2.9 CCCC(=O)NCCc1c[nH]c2c1cccc2 WXVL_AK0298SB0073 [0,2,0,0,0,0|0,0,0]=2 174 B18R2.9 CCCC(=O)NCCc1coc2c1cccc2 WXVL_AK2803SB0073 [0,2,0,0,0,0|1,0,0]=3 175 B18R2.9 CCCC(=O)NCCc1coc2c1cccc2 WXVL_AK2803SB0073 [0,2,0,0,0,0|1,0,0]=3 176 B18R2.9 COCC(=O)NCCc1c[nH]c2c1cccc2 WXVL_AK0298SB0090 [0,2,0,0,0,0|0,0,0]=2 177 B18R2.9 COCC(=O)NCCc1c[nH]c2c1cccc2 WXVL_AK0298SB0090 [0,2,0,0,0,0|0,0,0]=2 178 B18R2.9 COCC(=O)NCCc1coc2c1cccc2 WXVL_AK2803SB0090 [0,2,0,0,0,0|1,0,0]=3 179 B18R2.9 COCC(=O)NCCc1coc2c1cccc2 WXVL_AK2803SB0090 [0,2,0,0,0,0|1,0,0]=3 180 B18R2.9 CSCC(=O)NCCc1c[nH]c2c1cccc2 WXVL_AK0298SB1267 [0,2,0,0,0,0|0,0,0]=2 181 B18R2.9 CSCC(=O)NCCc1c[nH]c2c1cccc2 WXVL_AK0298SB1267 [0,2,0,0,0,0|0,0,0]=2 182 B18R2.9 CSCC(=O)NCCc1coc2c1cccc2 WXVL_AK2803SB1267 [0,2,0,0,0,0|1,0,0]=3 183 B18R2.9 CSCC(=O)NCCc1coc2c1cccc2 WXVL_AK2803SB1267 [0,2,0,0,0,0|1,0,0]=3 184 B18R2.9 N#CCC(=O)NCCc1c[nH]c2c1cccc2 WXVL_AK0298SB0057 [0,2,0,0,0,0|0,0,0]=2 185 B18R2.9 N#CCC(=O)NCCc1c[nH]c2c1cccc2 WXVL_AK0298SB0057 [0,2,0,0,0,0|0,0,0]=2 186 B18R2.9 N#CCC(=O)NCCc1coc2c1cccc2 WXVL_AK2803SB0057 [0,2,0,0,0,0|1,0,0]=3 187 B18R2.9 N#CCC(=O)NCCc1coc2c1cccc2 WXVL_AK2803SB0057 [0,2,0,0,0,0|1,0,0]=3 188 B18R2.37 CCC(=O)C(=O)NCc1c[nH]c2c1cccc2 WXVL_AK0528SB0344 [0,2,0,0,0,0|2,0,0]=4 189 B18R2.37 CCC(=O)C(=O)NCc1c[nH]c2c1cccc2 WXVL_AK0528SB0344 [0,2,0,0,0,0|2,0,0]=4 190 B18R2.117 CCS(=O)(=O)NCCc1c[nH]c2c1cccc2 WXVL_AK0298HU0028 [0,2,0,0,0,0|1,0,0]=3 191 B18R2.117 CCS(=O)(=O)NCCc1c[nH]c2c1cccc2 WXVL_AK0298HU0028 [0,2,0,0,0,0|1,0,0]=3 192 B18R2.117 CCS(=O)(=O)NCCc1coc2c1cccc2 WXVL_AK2803HU0028 [0,2,0,0,0,0|2,0,0]=4 193 B18R2.117 CCS(=O)(=O)NCCc1coc2c1cccc2 WXVL_AK2803HU0028 [0,2,0,0,0,0|2,0,0]=4 194 B18R2.101408 C#CC(=O)NCCc1c([nH]c2c1cccc2)C WXVL_AK0966SB0338 [0,2,0,0,0,0|0,0,1]=3 195 B18R2.101408 C#CC(=O)NCCc1c([nH]c2c1cccc2)C WXVL_AK0966SB0338 [0,2,0,0,0,0|0,0,1]=3 196 B18R2.101408 CCC(=O)NCCc1c([nH]c2c1cccc2)C WXVL_AK0966SB0064 [0,2,0,0,0,0|0,0,0]=2 197 B18R2.101408 CCC(=O)NCCc1c([nH]c2c1cccc2)C WXVL_AK0966SB0064 [0,2,0,0,0,0|0,0,0]=2 198 B18R2.101408 CNC(=O)CCCn1c(=O)[nH]c2c1cccc2 WXVL_AK00442SA00071 [0,2,0,0,0,0|2,0,0]=4 199 B18R2.101408 CNC(=O)CCCn1c(=O)[nH]c2c1cccc2 WXVL_AK00442SA00071 [0,2,0,0,0,0|2,0,0]=4 200 B18R2.101408 Cc1[nH]c2ccccc2c1CCNC(=O)CO WXVL_AK0966SB2706 [0,2,0,0,0,0|0,0,0]=2 201 B18R2.101408 Cc1[nH]c2ccccc2c1CCNC(=O)CO WXVL_AK0966SB2706 [0,2,0,0,0,0|0,0,0]=2 202 B18R2.102090 C#CC(=O)NCCc1c[nH]c2c1ccc(c2)F WXVL_AK00605SB0338 [0,2,0,0,0,0|0,0,1]=3 203 B18R2.102090 C#CC(=O)NCCc1c[nH]c2c1ccc(c2)F WXVL_AK00605SB0338 [0,2,0,0,0,0|0,0,1]=3 204 B18R2.102090 CCC(=O)NCCc1c[nH]c2c1ccc(c2)F WXVL_AK00605SB0064 [0,2,0,0,0,0|0,0,0]=2 205 B18R2.102090 CCC(=O)NCCc1c[nH]c2c1ccc(c2)F WXVL_AK00605SB0064 [0,2,0,0,0,0|0,0,0]=2 206 B18R2.102090 O=C(CO)NCCc1c[nH]c2c1ccc(c2)F WXVL_AK00605SB2706 [0,2,0,0,0,0|0,0,0]=2 207 B18R2.102090 O=C(CO)NCCc1c[nH]c2c1ccc(c2)F WXVL_AK00605SB2706 [0,2,0,0,0,0|0,0,0]=2 208 B18R2.746213 C#CC(=O)NCCc1c[nH]c2c1cc(cc2)C WXVL_AK00472SB0338 [0,2,0,0,0,0|0,0,1]=3 209 B18R2.746213 C#CC(=O)NCCc1c[nH]c2c1cc(cc2)C WXVL_AK00472SB0338 [0,2,0,0,0,0|0,0,1]=3 210 B18R2.746213 C#CC(=O)NCCc1c[nH]c2c1cc(cc2)Cl WXVL_AK00473SB0338 [0,2,0,0,0,0|0,0,1]=3 211 B18R2.746213 C#CC(=O)NCCc1c[nH]c2c1cc(cc2)Cl WXVL_AK00473SB0338 [0,2,0,0,0,0|0,0,1]=3 212 B18R2.746213 C#CC(=O)NCCc1c[nH]c2c1cc(cc2)O WXVL_AK1841SB0338 [0,2,0,0,0,0|0,0,1]=3 213 B18R2.746213 C#CC(=O)NCCc1c[nH]c2c1cc(cc2)O WXVL_AK1841SB0338 [0,2,0,0,0,0|0,0,1]=3 214 B18R2.746213 CCC(=O)NCCc1c[nH]c2c1cc(cc2)C WXVL_AK00472SB0064 [0,2,0,0,0,0|0,0,0]=2 215 B18R2.746213 CCC(=O)NCCc1c[nH]c2c1cc(cc2)C WXVL_AK00472SB0064 [0,2,0,0,0,0|0,0,0]=2 216 B18R2.746213 CCC(=O)NCCc1c[nH]c2c1cc(cc2)Cl WXVL_AK00473SB0064 [0,2,0,0,0,0|0,0,0]=2 217 B18R2.746213 CCC(=O)NCCc1c[nH]c2c1cc(cc2)Cl WXVL_AK00473SB0064 [0,2,0,0,0,0|0,0,0]=2 218 B18R2.746213 CCC(=O)NCCc1c[nH]c2c1cc(cc2)O WXVL_AK1841SB0064 [0,2,0,0,0,0|0,0,0]=2 219 B18R2.746213 CCC(=O)NCCc1c[nH]c2c1cc(cc2)O WXVL_AK1841SB0064 [0,2,0,0,0,0|0,0,0]=2 220 B18R2.746213 Cc1ccc2[nH]cc(c2c1)CCNC(=O)CO WXVL_AK00472SB2706 [0,2,0,0,0,0|0,0,0]=2 221 B18R2.746213 Cc1ccc2[nH]cc(c2c1)CCNC(=O)CO WXVL_AK00472SB2706 [0,2,0,0,0,0|0,0,0]=2 222 B18R2.746213 O=C(CO)NCCc1c[nH]c2c1cc(cc2)Cl WXVL_AK00473SB2706 [0,2,0,0,0,0|0,0,0]=2 223 B18R2.746213 O=C(CO)NCCc1c[nH]c2c1cc(cc2)Cl WXVL_AK00473SB2706 [0,2,0,0,0,0|0,0,0]=2 224 B18R2.746213 O=C(CO)NCCc1c[nH]c2c1cc(cc2)O WXVL_AK1841SB2706 [0,2,0,0,0,0|0,0,0]=2 225 B18R2.746213 O=C(CO)NCCc1c[nH]c2c1cc(cc2)O WXVL_AK1841SB2706 [0,2,0,0,0,0|0,0,0]=2 226 B18R2.978763 CC(=O)C(=O)NCc1cn(c2c1cccc2)C WXVL_AK0543SB0051 [0,2,0,0,0,0|2,0,0]=4 227 B18R2.978763 CC(=O)C(=O)NCc1cn(c2c1cccc2)C WXVL_AK0543SB0051 [0,2,0,0,0,0|2,0,0]=4 228 B18R2.371 CC(=O)N[C@H](CO)Cc1c[nH]c2c1cccc2 WXVL_AK1730SB0150 [0,2,0,0,0,0|0,0,0]=2 229 B18R2.371 CC(=O)N[C@H](CO)Cc1c[nH]c2c1cccc2 WXVL_AK1730SB0150 [0,2,0,0,0,0|0,0,0]=2 230 B18R2.120971 COc1ccc2[nH]cc(c2c1)CCNC(=O)C WXVL_AK0345SB0150 [0,2,0,0,0,0|0,0,0]=2 231 B18R2.120971 COc1ccc2[nH]cc(c2c1)CCNC(=O)C WXVL_AK0345SB0150 [0,2,0,0,0,0|0,0,0]=2 232 B16R2.477 CC(=O)NCc1ccc2ccccc2c1 WXVL_AK1490SB0150 [0,0,1,1,0,0|1,0,1]=4 233 B16R2.477 CC(=O)NCc1ccc2ccccc2c1 WXVL_AK1490SB0150 [0,0,1,1,0,0|1,0,1]=4 234 B16R2.179941 CC(=O)NCc1cccc2c1cccc2 WXVL_AK0011SB0150 [0,0,1,1,0,0|1,0,1]=4 235 B16R2.179941 CC(=O)NCc1cccc2c1cccc2 WXVL_AK0011SB0150 [0,0,1,1,0,0|1,0,1]=4 236 B16R2.179941 CC(=O)NCc1ccnc2c1cccc2 WXVL_AK0519SB0150 [0,0,1,1,0,0|0,0,2]=4 237 B16R2.179941 CC(=O)NCc1ccnc2c1cccc2 WXVL_AK0519SB0150 [0,0,1,1,0,0|0,0,2]=4 238 B16R2.85 CC(=O)N1CC=C(CC1)c2ccccc2 WXVL_AN3839SB0150 [0,0,1,1,0,0|1,0,0]=3 239 B16R2.85 CC(=O)N1CC=C(CC1)c2ccccc2 WXVL_AN3839SB0150 [0,0,1,1,0,0|1,0,0]=3 240 B18R3.116932 CC(=O)N1CCc2c([nH]c3c2cccc3)C1 WXVL_AN2481SB0150 [0,1,0,1,0,0|0,0,0]=2 241 B14R1.96 COc1ccccc1CCNC(=O)C WXVL_AK00321SB0150 [0,0,1,0,1,0|1,0,1]=4 242 B14R1.96 COc1ccccc1CCNC(=O)C WXVL_AK00321SB0150 [0,0,1,0,1,0|1,0,1]=4 243 B14R1.422 CC(=O)NCCCCc1ccccc1 WXVL_AK00516SB0150 [0,0,1,0,1,0|0,0,2]=4 244 B14R1.422 CC(=O)NCCCCc1ccccc1 WXVL_AK00516SB0150 [0,0,1,0,1,0|0,0,2]=4 245 B14R1.422 CC(=O)NCCCOc1ccccc1 WXVL_AK2366SB0150 [0,0,1,0,1,0|1,0,1]=4 246 B14R1.422 CC(=O)NCCCOc1ccccc1 WXVL_AK2366SB0150 [0,0,1,0,1,0|1,0,1]=4 247 B14R1.422 CC(=O)NCCOCc1ccccc1 WXVL_AK1105SB0150 [0,0,1,0,1,0|1,0,1]=4 248 B14R1.422 CC(=O)NCCOCc1ccccc1 WXVL_AK1105SB0150 [0,0,1,0,1,0|1,0,1]=4 249 B14R2.2 CC(=O)Nc1c[nH]c2c1cccc2 WXVL_AF00227SB0150 [0,0,0,0,2,0|0,0,0]=2 250 B14R2.2 CC(=O)Nc1c[nH]c2c1cccc2 WXVL_AF00227SB0150 [0,0,0,0,2,0|0,0,0]=2 251 B14R2.2 CC(=O)Nc1c[nH]c2c1cccn2 WXVL_AF00256SB0150 [0,0,0,0,2,0|1,0,0]=3 252 B14R2.2 CC(=O)Nc1c[nH]c2c1cccn2 WXVL_AF00256SB0150 [0,0,0,0,2,0|1,0,0]=3 253 B14R2.2 CC(=O)Nc1cnc2n1cccc2 WXVL_AF0835SB0150 [0,0,0,0,2,0|1,0,1]=4 254 B14R2.2 CC(=O)Nc1cnc2n1cccc2 WXVL_AF0835SB0150 [0,0,0,0,2,0|1,0,1]=4 255 B14R2.2 CC(=O)Nc1cnn2c1cccc2 WXVL_AF00111SB0150 [0,0,0,0,2,0|1,0,1]=4 256 B14R2.2 CC(=O)Nc1cnn2c1cccc2 WXVL_AF00111SB0150 [0,0,0,0,2,0|1,0,1]=4 257 B14R2.2 CC(=O)Nc1csc2c1cncc2 WXVL_AF4209SB0150 [0,0,0,0,2,0|2,0,0]=4 258 B14R2.2 CC(=O)Nc1csc2c1cncc2 WXVL_AF4209SB0150 [0,0,0,0,2,0|2,0,0]=4 259 B14R2.2 CC(=O)Nc1n[nH]c2c1cccc2 WXVL_AF2666SB0150 [0,0,0,0,2,0|1,0,0]=3 260 B14R2.2 CC(=O)Nc1n[nH]c2c1cccc2 WXVL_AF2666SB0150 [0,0,0,0,2,0|1,0,0]=3 261 B14R2.2 CC(=O)Nc1onc2c1cccc2 WXVL_AF00243SB0150 [0,0,0,0,2,0|1,0,1]=4 262 B14R2.2 CC(=O)Nc1onc2c1cccc2 WXVL_AF00243SB0150 [0,0,0,0,2,0|1,0,1]=4 263 B14R2.2 NC(=O)Cc1c[nH]c2c1cccc2 WXVL_AK0084SA00109 [0,0,0,0,2,0|1,0,0]=3 264 B14R2.2 NC(=O)Cc1c[nH]c2c1cccc2 WXVL_AK0084SA00109 [0,0,0,0,2,0|1,0,0]=3 265 B14R2.2 NC(=O)Cc1c[nH]c2c1cccn2 WXVL_AK0084SB4159 [0,0,0,0,2,0|2,0,0]=4 266 B14R2.2 NC(=O)Cc1c[nH]c2c1cccn2 WXVL_AK0084SB4159 [0,0,0,0,2,0|2,0,0]=4 267 B16R1.7414 CC(=O)NCCC(=O)Nc1ccccc1Br WXVL_AG00180SB0374 [0,0,1,0,0,1|2,0,0]=4 268 B16R1.7414 CC(=O)NCCC(=O)Nc1ccccc1Br WXVL_AG00180SB0374 [0,0,1,0,0,1|2,0,0]=4 269 B16R1.7414 CC(=O)NCCC(=O)Nc1ccccc1C WXVL_AG0027SB0374 [0,0,1,0,0,1|2,0,0]=4 270 B16R1.7414 CC(=O)NCCC(=O)Nc1ccccc1C WXVL_AG0027SB0374 [0,0,1,0,0,1|2,0,0]=4 271 B16R1.7414 CC(=O)NCCC(=O)Nc1ccccc1Cl WXVL_AG00129SB0374 [0,0,1,0,0,1|2,0,0]=4 272 B16R1.7414 CC(=O)NCCC(=O)Nc1ccccc1Cl WXVL_AG00129SB0374 [0,0,1,0,0,1|2,0,0]=4 273 B16R1.7414 CC(=O)NCCC(=O)Nc1ccccc1I WXVL_AG0385SB0374 [0,0,1,0,0,1|2,0,0]=4 274 B16R1.7414 CC(=O)NCCC(=O)Nc1ccccc1I WXVL_AG0385SB0374 [0,0,1,0,0,1|2,0,0]=4 275 B16R1.10817 CC(=O)NCCNC(=O)c1ccccc1Br WXVL_AK0057SD0002 [0,0,1,0,0,1|2,0,0]=4 276 B16R1.10817 CC(=O)NCCNC(=O)c1ccccc1Br WXVL_AK0057SD0002 [0,0,1,0,0,1|2,0,0]=4 277 B16R1.10817 CC(=O)NCCNC(=O)c1ccccc1C WXVL_AK0057SD0037 [0,0,1,0,0,1|2,0,0]=4 278 B16R1.10817 CC(=O)NCCNC(=O)c1ccccc1C WXVL_AK0057SD0037 [0,0,1,0,0,1|2,0,0]=4 279 B16R1.10817 CC(=O)NCCNC(=O)c1ccccc1Cl WXVL_AK0057SD0006 [0,0,1,0,0,1|2,0,0]=4 280 B16R1.10817 CC(=O)NCCNC(=O)c1ccccc1Cl WXVL_AK0057SD0006 [0,0,1,0,0,1|2,0,0]=4 281 B16R1.10817 CC(=O)NCCNC(=O)c1ccccc1F WXVL_AK0057SD0003 [0,0,1,0,0,1|2,0,0]=4 282 B16R1.10817 CC(=O)NCCNC(=O)c1ccccc1F WXVL_AK0057SD0003 [0,0,1,0,0,1|2,0,0]=4 283 B16R1.10817 CC(=O)NCCNC(=O)c1ccccc1I WXVL_AK0057SD0303 [0,0,1,0,0,1|2,0,0]=4 284 B16R1.10817 CC(=O)NCCNC(=O)c1ccccc1I WXVL_AK0057SD0303 [0,0,1,0,0,1|2,0,0]=4 285 B16R1.10817 CC(=O)NCCNC(=O)c1ccccc1O WXVL_AK0057SD00056 [0,0,1,0,0,1|2,0,0]=4 286 B16R1.10817 CC(=O)NCCNC(=O)c1ccccc1O WXVL_AK0057SD00056 [0,0,1,0,0,1|2,0,0]=4 287 B16R1.10817 CC(=O)NCCNC(=O)c1ccccc1S WXVL_AK0057SD0153 [0,0,1,0,0,1|2,0,0]=4 288 B16R1.10817 CC(=O)NCCNC(=O)c1ccccc1S WXVL_AK0057SD0153 [0,0,1,0,0,1|2,0,0]=4 289 B18R2.9909 CC(=O)NCCNc1ncc2ccccc2n1 WXVL_AK0057LP0064 [0,0,0,0,0,2|2,0,0]=4 290 B18R2.9909 CC(=O)NCCNc1ncc2ccccc2n1 WXVL_AK0057LP0064 [0,0,0,0,0,2|2,0,0]=4 291 B18R2.556536 CC(=O)NCCNc1ncnc2c1cccc2 WXVL_AK0057LP0257 [0,0,0,0,0,2|0,0,1]=3 292 B18R2.556536 CC(=O)NCCNc1ncnc2c1cccc2 WXVL_AK0057LP0257 [0,0,0,0,0,2|0,0,1]=3 293 B18R2.556536 CC(=O)NCCNc1ncnc2c1ccnc2 WXVL_AK0057LP0471 [0,0,0,0,0,2|1,0,1]=4 294 B18R2.556536 CC(=O)NCCNc1ncnc2c1ccnc2 WXVL_AK0057LP0471 [0,0,0,0,0,2|1,0,1]=4 295 B18R2.556536 CC(=O)NCCNc1ncnc2c1nccc2 WXVL_AK0057LP0411 [0,0,0,0,0,2|1,0,1]=4 296 B18R2.556536 CC(=O)NCCNc1ncnc2c1nccc2 WXVL_AK0057LP0411 [0,0,0,0,0,2|1,0,1]=4