0 B27R3.43683236 O=C(NCCCCc1ccccc1)c2cc3cc(ccc3[nH]2)[N+](=O)[O-] WXVL_AK00516SE0081 [0,0,0,0,0,0|2,0,1]=3 1 B27R3.43683236 O=C(NCCCCc1ccccc1)c2cc3cc(ccc3[nH]2)[N+](=O)[O-] WXVL_AK00516SE0081 [0,0,0,0,0,0|2,0,1]=3 2 B27R3.43683236 O=C(NCCCCc1ccccc1)c2cc3cc(ccc3s2)[N+](=O)[O-] WXVL_AK00516SE1535 [0,0,0,0,0,0|3,0,0]=3 3 B27R3.43683236 O=C(NCCCCc1ccccc1)c2cc3cc(ccc3s2)[N+](=O)[O-] WXVL_AK00516SE1535 [0,0,0,0,0,0|3,0,0]=3 4 B27R3.43683236 O=C(NCCCCc1ccccc1)c2nc3cc(ccc3[nH]2)[N+](=O)[O-] WXVL_AK00516SE0672 [0,0,0,0,0,0|2,0,1]=3 5 B27R3.43683236 O=C(NCCCCc1ccccc1)c2nc3cc(ccc3[nH]2)[N+](=O)[O-] WXVL_AK00516SE0672 [0,0,0,0,0,0|2,0,1]=3 6 B27R3.43683236 O=C(NCCCOc1ccccc1)c2cc3cc(ccc3[nH]2)[N+](=O)[O-] WXVL_AK2366SE0081 [0,0,0,0,0,0|3,0,1]=4 7 B27R3.43683236 O=C(NCCCOc1ccccc1)c2cc3cc(ccc3[nH]2)[N+](=O)[O-] WXVL_AK2366SE0081 [0,0,0,0,0,0|3,0,1]=4 8 B27R3.43683236 O=C(NCCCOc1ccccc1)c2cc3cc(ccc3s2)[N+](=O)[O-] WXVL_AK2366SE1535 [0,0,0,0,0,0|4,0,0]=4 9 B27R3.43683236 O=C(NCCCOc1ccccc1)c2cc3cc(ccc3s2)[N+](=O)[O-] WXVL_AK2366SE1535 [0,0,0,0,0,0|4,0,0]=4 10 B27R3.43683236 O=C(NCCCOc1ccccc1)c2nc3cc(ccc3[nH]2)[N+](=O)[O-] WXVL_AK2366SE0672 [0,0,0,0,0,0|3,0,1]=4 11 B27R3.43683236 O=C(NCCCOc1ccccc1)c2nc3cc(ccc3[nH]2)[N+](=O)[O-] WXVL_AK2366SE0672 [0,0,0,0,0,0|3,0,1]=4 12 B27R3.43683236 O=C(NCCOCc1ccccc1)c2cc3cc(ccc3[nH]2)[N+](=O)[O-] WXVL_AK1105SE0081 [0,0,0,0,0,0|3,0,1]=4 13 B27R3.43683236 O=C(NCCOCc1ccccc1)c2cc3cc(ccc3[nH]2)[N+](=O)[O-] WXVL_AK1105SE0081 [0,0,0,0,0,0|3,0,1]=4 14 B27R3.43683236 O=C(NCCOCc1ccccc1)c2cc3cc(ccc3s2)[N+](=O)[O-] WXVL_AK1105SE1535 [0,0,0,0,0,0|4,0,0]=4 15 B27R3.43683236 O=C(NCCOCc1ccccc1)c2cc3cc(ccc3s2)[N+](=O)[O-] WXVL_AK1105SE1535 [0,0,0,0,0,0|4,0,0]=4 16 B27R3.43683236 O=C(NCCOCc1ccccc1)c2nc3cc(ccc3[nH]2)[N+](=O)[O-] WXVL_AK1105SE0672 [0,0,0,0,0,0|3,0,1]=4 17 B27R3.43683236 O=C(NCCOCc1ccccc1)c2nc3cc(ccc3[nH]2)[N+](=O)[O-] WXVL_AK1105SE0672 [0,0,0,0,0,0|3,0,1]=4 18 B28R3.83918538 O=C(NCCCCc1ccc(cc1)Cl)c2cc3cc(ccc3[nH]2)[N+](=O)[O-] WXVL_AK5305SE0081 [0,1,0,0,0,0|2,0,1]=4 19 B28R3.83918538 O=C(NCCCCc1ccc(cc1)Cl)c2cc3cc(ccc3[nH]2)[N+](=O)[O-] WXVL_AK5305SE0081 [0,1,0,0,0,0|2,0,1]=4 20 B28R3.83918538 O=C(NCCCCc1ccc(cc1)Cl)c2cc3cc(ccc3s2)[N+](=O)[O-] WXVL_AK5305SE1535 [0,1,0,0,0,0|3,0,0]=4 21 B28R3.83918538 O=C(NCCCCc1ccc(cc1)Cl)c2cc3cc(ccc3s2)[N+](=O)[O-] WXVL_AK5305SE1535 [0,1,0,0,0,0|3,0,0]=4 22 B28R3.83918538 O=C(NCCCCc1ccc(cc1)Cl)c2nc3cc(ccc3[nH]2)[N+](=O)[O-] WXVL_AK5305SE0672 [0,1,0,0,0,0|2,0,1]=4 23 B28R3.83918538 O=C(NCCCCc1ccc(cc1)Cl)c2nc3cc(ccc3[nH]2)[N+](=O)[O-] WXVL_AK5305SE0672 [0,1,0,0,0,0|2,0,1]=4 24 B28R4.40327952 O=C(c1cc2cc(ccc2[nH]1)[N+](=O)[O-])N3CCCC3c4ccccc4 WXVL_AN2347SE0081 [0,0,0,1,0,0|2,0,1]=4 25 B28R4.40327952 O=C(c1cc2cc(ccc2[nH]1)[N+](=O)[O-])N3CCCC3c4ccccc4 WXVL_AN2347SE0081 [0,0,0,1,0,0|2,0,1]=4 26 B28R4.40327952 O=C(c1cc2cc(ccc2[nH]1)[N+](=O)[O-])N3CCC[C@H]3c4ccccc4 WXVL_AN00549SE0081 [0,0,0,1,0,0|2,0,1]=4 27 B28R4.40327952 O=C(c1cc2cc(ccc2s1)[N+](=O)[O-])N3CCCC3c4ccccc4 WXVL_AN2347SE1535 [0,0,0,1,0,0|3,0,0]=4 28 B28R4.40327952 O=C(c1cc2cc(ccc2s1)[N+](=O)[O-])N3CCCC3c4ccccc4 WXVL_AN2347SE1535 [0,0,0,1,0,0|3,0,0]=4 29 B28R4.40327952 O=C(c1cc2cc(ccc2s1)[N+](=O)[O-])N3CCC[C@H]3c4ccccc4 WXVL_AN00549SE1535 [0,0,0,1,0,0|3,0,0]=4 30 B28R4.40327952 O=C(c1nc2cc(ccc2[nH]1)[N+](=O)[O-])N3CCCC3c4ccccc4 WXVL_AN2347SE0672 [0,0,0,1,0,0|2,0,1]=4 31 B28R4.40327952 O=C(c1nc2cc(ccc2[nH]1)[N+](=O)[O-])N3CCCC3c4ccccc4 WXVL_AN2347SE0672 [0,0,0,1,0,0|2,0,1]=4 32 B28R4.40327952 O=C(c1nc2cc(ccc2[nH]1)[N+](=O)[O-])N3CCC[C@H]3c4ccccc4 WXVL_AN00549SE0672 [0,0,0,1,0,0|2,0,1]=4 33 B28R4.40327961 O=C(N[C@@H]1CCCc2c1cccc2)c3cc4cc(ccc4[nH]3)[N+](=O)[O-] WXVL_AK0134SE0081 [0,0,0,1,0,0|2,0,1]=4 34 B28R4.40327961 O=C(N[C@@H]1CCCc2c1cccc2)c3cc4cc(ccc4[nH]3)[N+](=O)[O-] WXVL_AK0134SE0081 [0,0,0,1,0,0|2,0,1]=4 35 B28R4.40327961 O=C(N[C@@H]1CCCc2c1cccc2)c3cc4cc(ccc4s3)[N+](=O)[O-] WXVL_AK0134SE1535 [0,0,0,1,0,0|3,0,0]=4 36 B28R4.40327961 O=C(N[C@@H]1CCCc2c1cccc2)c3cc4cc(ccc4s3)[N+](=O)[O-] WXVL_AK0134SE1535 [0,0,0,1,0,0|3,0,0]=4 37 B28R4.40327961 O=C(N[C@@H]1CCCc2c1cccc2)c3nc4cc(ccc4[nH]3)[N+](=O)[O-] WXVL_AK0134SE0672 [0,0,0,1,0,0|2,0,1]=4 38 B28R4.40327961 O=C(N[C@@H]1CCCc2c1cccc2)c3nc4cc(ccc4[nH]3)[N+](=O)[O-] WXVL_AK0134SE0672 [0,0,0,1,0,0|2,0,1]=4 39 B26R3.39344201 O=C(CCCCc1ccccc1)N2Cc3ccc(cc3C2)[N+](=O)[O-] WXVL_AN00862SB0460 [0,0,0,0,1,0|3,0,0]=4 40 B26R3.39344201 O=C(NCCCc1ccccc1)c2cc3cc(ccc3[nH]2)[N+](=O)[O-] WXVL_AK0074SE0081 [0,0,0,0,1,0|2,0,1]=4 41 B26R3.39344201 O=C(NCCCc1ccccc1)c2cc3cc(ccc3[nH]2)[N+](=O)[O-] WXVL_AK0074SE0081 [0,0,0,0,1,0|2,0,1]=4 42 B26R3.39344201 O=C(NCCCc1ccccc1)c2cc3cc(ccc3s2)[N+](=O)[O-] WXVL_AK0074SE1535 [0,0,0,0,1,0|3,0,0]=4 43 B26R3.39344201 O=C(NCCCc1ccccc1)c2cc3cc(ccc3s2)[N+](=O)[O-] WXVL_AK0074SE1535 [0,0,0,0,1,0|3,0,0]=4 44 B26R3.39344201 O=C(NCCCc1ccccc1)c2nc3cc(ccc3[nH]2)[N+](=O)[O-] WXVL_AK0074SE0672 [0,0,0,0,1,0|2,0,1]=4 45 B26R3.39344201 O=C(NCCCc1ccccc1)c2nc3cc(ccc3[nH]2)[N+](=O)[O-] WXVL_AK0074SE0672 [0,0,0,0,1,0|2,0,1]=4 46 B28R3.60438536 O=C(NCCCOCc1ccccc1)c2cc3cc(ccc3[nH]2)[N+](=O)[O-] WXVL_AK2136SE0081 [0,0,0,0,0,1|2,0,1]=4 47 B28R3.60438536 O=C(NCCCOCc1ccccc1)c2cc3cc(ccc3[nH]2)[N+](=O)[O-] WXVL_AK2136SE0081 [0,0,0,0,0,1|2,0,1]=4 48 B28R3.60438536 O=C(NCCCOCc1ccccc1)c2cc3cc(ccc3s2)[N+](=O)[O-] WXVL_AK2136SE1535 [0,0,0,0,0,1|3,0,0]=4 49 B28R3.60438536 O=C(NCCCOCc1ccccc1)c2cc3cc(ccc3s2)[N+](=O)[O-] WXVL_AK2136SE1535 [0,0,0,0,0,1|3,0,0]=4 50 B28R3.60438536 O=C(NCCCOCc1ccccc1)c2nc3cc(ccc3[nH]2)[N+](=O)[O-] WXVL_AK2136SE0672 [0,0,0,0,0,1|2,0,1]=4 51 B28R3.60438536 O=C(NCCCOCc1ccccc1)c2nc3cc(ccc3[nH]2)[N+](=O)[O-] WXVL_AK2136SE0672 [0,0,0,0,0,1|2,0,1]=4 52 B25R2.728670 O=C(C=Cc1ccc(cc1)[N+](=O)[O-])NCCCCc2ccccc2 WXVL_AK00516SB0512 [1,0,1,0,0,0|2,0,0]=4 53 B25R2.728670 O=C(C=Cc1ccc(cc1)[N+](=O)[O-])NCCCCc2ccccc2 WXVL_AK00516SB0512 [1,0,1,0,0,0|2,0,0]=4 54 B25R2.733405 O=C(/C=C/c1cccc(c1)[N+](=O)[O-])NCCCCc2ccccc2 WXVL_AK00516SB0511 [1,0,1,0,0,0|2,0,0]=4 55 B25R2.733405 O=C(/C=C/c1cccc(c1)[N+](=O)[O-])NCCCCc2ccccc2 WXVL_AK00516SB0511 [1,0,1,0,0,0|2,0,0]=4 56 B29R4.61576467 O=C(NCC1CCCc2c1cccc2)c3cc4cc(ccc4[nH]3)[N+](=O)[O-] WXVL_AK5906SE0081 [0,0,0,1,0,1|1,0,1]=4 57 B29R4.61576467 O=C(NCC1CCCc2c1cccc2)c3cc4cc(ccc4[nH]3)[N+](=O)[O-] WXVL_AK5906SE0081 [0,0,0,1,0,1|1,0,1]=4 58 B29R4.61576467 O=C(NCC1CCCc2c1cccc2)c3cc4cc(ccc4s3)[N+](=O)[O-] WXVL_AK5906SE1535 [0,0,0,1,0,1|2,0,0]=4 59 B29R4.61576467 O=C(NCC1CCCc2c1cccc2)c3cc4cc(ccc4s3)[N+](=O)[O-] WXVL_AK5906SE1535 [0,0,0,1,0,1|2,0,0]=4 60 B29R4.61576467 O=C(NCC1CCCc2c1cccc2)c3nc4cc(ccc4[nH]3)[N+](=O)[O-] WXVL_AK5906SE0672 [0,0,0,1,0,1|1,0,1]=4 61 B29R4.61576467 O=C(NCC1CCCc2c1cccc2)c3nc4cc(ccc4[nH]3)[N+](=O)[O-] WXVL_AK5906SE0672 [0,0,0,1,0,1|1,0,1]=4 62 B29R4.61576479 O=C(c1cc2cc(ccc2[nH]1)[N+](=O)[O-])N3CCCCC3c4ccccc4 WXVL_AN0302SE0081 [0,0,0,1,0,1|1,0,1]=4 63 B29R4.61576479 O=C(c1cc2cc(ccc2[nH]1)[N+](=O)[O-])N3CCCCC3c4ccccc4 WXVL_AN0302SE0081 [0,0,0,1,0,1|1,0,1]=4 64 B29R4.61576479 O=C(c1cc2cc(ccc2[nH]1)[N+](=O)[O-])N3CCCC[C@@H]3c4ccccc4 WXVL_AN00696SE0081 [0,0,0,1,0,1|1,0,1]=4 65 B29R4.61576479 O=C(c1cc2cc(ccc2s1)[N+](=O)[O-])N3CCCCC3c4ccccc4 WXVL_AN0302SE1535 [0,0,0,1,0,1|2,0,0]=4 66 B29R4.61576479 O=C(c1cc2cc(ccc2s1)[N+](=O)[O-])N3CCCCC3c4ccccc4 WXVL_AN0302SE1535 [0,0,0,1,0,1|2,0,0]=4 67 B29R4.61576479 O=C(c1cc2cc(ccc2s1)[N+](=O)[O-])N3CCCC[C@@H]3c4ccccc4 WXVL_AN00696SE1535 [0,0,0,1,0,1|2,0,0]=4 68 B29R4.61576479 O=C(c1nc2cc(ccc2[nH]1)[N+](=O)[O-])N3CCCCC3c4ccccc4 WXVL_AN0302SE0672 [0,0,0,1,0,1|1,0,1]=4 69 B29R4.61576479 O=C(c1nc2cc(ccc2[nH]1)[N+](=O)[O-])N3CCCCC3c4ccccc4 WXVL_AN0302SE0672 [0,0,0,1,0,1|1,0,1]=4 70 B29R4.61576479 O=C(c1nc2cc(ccc2[nH]1)[N+](=O)[O-])N3CCCC[C@@H]3c4ccccc4 WXVL_AN00696SE0672 [0,0,0,1,0,1|1,0,1]=4