0 B21R2.252202 CC(=O)N1CCCCC1C(=O)NCCc2ccccc2 LN00002762_AK00498_SB0150 [0,0,0,0,0,0|2,0,0]=2 1 B21R2.252202 CC(=O)N1CCCCC1C(=O)NCCc2ccccn2 LN00002762_AK0019_SB0150 [0,0,0,0,0,0|3,0,0]=3 2 B21R2.252202 CC(=O)N1CCCCC1C(=O)NCCc2cccnc2 LN00002762_AK00436_SB0150 [0,0,0,0,0,0|3,0,0]=3 3 B21R2.252202 CC(=O)N1CCCCC1C(=O)NCCc2ccncc2 LN00002762_AK0093_SB0150 [0,0,0,0,0,0|3,0,0]=3 4 B21R2.252202 CC(=O)N1CCCCC1C(=O)NCCc2ccncn2 LN00002762_AK6509_SB0150 [0,0,0,0,0,0|4,0,0]=4 5 B21R2.252202 CC(=O)N1CCOCC1C(=O)NCCc2ccccc2 LN00010971_AK00498_SB0150 [0,0,0,0,0,0|3,0,0]=3 6 B21R2.252202 CC(=O)N1CCOCC1C(=O)NCCc2ccccn2 LN00010971_AK0019_SB0150 [0,0,0,0,0,0|4,0,0]=4 7 B21R2.252202 CC(=O)N1CCOCC1C(=O)NCCc2cccnc2 LN00010971_AK00436_SB0150 [0,0,0,0,0,0|4,0,0]=4 8 B21R2.252202 CC(=O)N1CCOCC1C(=O)NCCc2ccncc2 LN00010971_AK0093_SB0150 [0,0,0,0,0,0|4,0,0]=4 9 B21R2.252202 CC(=O)N1CCOC[C@H]1C(=O)NCCc2ccccc2 LN00174413_AK00498_SB0150 [0,0,0,0,0,0|3,0,0]=3 10 B21R2.252202 CC(=O)N1CCOC[C@H]1C(=O)NCCc2ccccn2 LN00174413_AK0019_SB0150 [0,0,0,0,0,0|4,0,0]=4 11 B21R2.252202 CC(=O)N1CCOC[C@H]1C(=O)NCCc2cccnc2 LN00174413_AK00436_SB0150 [0,0,0,0,0,0|4,0,0]=4 12 B21R2.252202 CC(=O)N1CCOC[C@H]1C(=O)NCCc2ccncc2 LN00174413_AK0093_SB0150 [0,0,0,0,0,0|4,0,0]=4 13 B21R2.252202 CC(=O)N1CCSCC1C(=O)NCCc2ccccc2 LN00200726_AK00498_SB0150 [0,0,0,0,0,0|3,0,0]=3 14 B21R2.252202 CC(=O)N1CCSCC1C(=O)NCCc2ccccn2 LN00200726_AK0019_SB0150 [0,0,0,0,0,0|4,0,0]=4 15 B21R2.252202 CC(=O)N1CCSCC1C(=O)NCCc2cccnc2 LN00200726_AK00436_SB0150 [0,0,0,0,0,0|4,0,0]=4 16 B21R2.252202 CC(=O)N1CCSCC1C(=O)NCCc2ccncc2 LN00200726_AK0093_SB0150 [0,0,0,0,0,0|4,0,0]=4 17 B21R2.252202 NC(=O)C1CCCCN1C(=O)CCCc2ccccc2 LN00002762_AK0084_SB0121 [0,0,0,0,0,0|3,0,0]=3 18 B21R2.252202 NC(=O)C1CCCCN1C(=O)CCOc2ccccc2 LN00002762_AK0084_SB0066 [0,0,0,0,0,0|4,0,0]=4 19 B21R2.252202 NC(=O)C1CCCCN1C(=O)COCc2ccccc2 LN00002762_AK0084_SB0185 [0,0,0,0,0,0|4,0,0]=4 20 B21R2.252202 NC(=O)C1COCCN1C(=O)CCCc2ccccc2 LN00010971_AK0084_SB0121 [0,0,0,0,0,0|4,0,0]=4 21 B21R2.252202 NC(=O)C1CSCCN1C(=O)CCCc2ccccc2 LN00200726_AK0084_SB0121 [0,0,0,0,0,0|4,0,0]=4 22 B21R2.252202 NC(=O)[C@@H]1COCCN1C(=O)CCCc2ccccc2 LN00174413_AK0084_SB0121 [0,0,0,0,0,0|4,0,0]=4 23 B22R2.15382 CC(=O)N1CCCCC1C(=O)NCC(C)c2ccccc2 LN00002762_AK00546_SB0150 [0,1,0,0,0,0|2,0,0]=3 24 B22R2.15382 CC(=O)N1CCCCC1C(=O)NCC(O)c2ccccc2 LN00002762_AK0051_SB0150 [0,1,0,0,0,0|2,0,0]=3 25 B22R2.15382 CC(=O)N1CCCCC1C(=O)NC[C@@H](C)c2ccccc2 LN00002762_AK00506_SB0150 [0,1,0,0,0,0|2,0,0]=3 26 B22R2.15382 CC(=O)N1CCOCC1C(=O)NCC(C)c2ccccc2 LN00010971_AK00546_SB0150 [0,1,0,0,0,0|3,0,0]=4 27 B22R2.15382 CC(=O)N1CCOCC1C(=O)NCC(O)c2ccccc2 LN00010971_AK0051_SB0150 [0,1,0,0,0,0|3,0,0]=4 28 B22R2.15382 CC(=O)N1CCOCC1C(=O)NC[C@@H](C)c2ccccc2 LN00010971_AK00506_SB0150 [0,1,0,0,0,0|3,0,0]=4 29 B22R2.15382 CC(=O)N1CCOC[C@H]1C(=O)NCC(C)c2ccccc2 LN00174413_AK00546_SB0150 [0,1,0,0,0,0|3,0,0]=4 30 B22R2.15382 CC(=O)N1CCOC[C@H]1C(=O)NCC(O)c2ccccc2 LN00174413_AK0051_SB0150 [0,1,0,0,0,0|3,0,0]=4 31 B22R2.15382 CC(=O)N1CCOC[C@H]1C(=O)NC[C@@H](C)c2ccccc2 LN00174413_AK00506_SB0150 [0,1,0,0,0,0|3,0,0]=4 32 B22R2.15382 CC(=O)N1CCSCC1C(=O)NCC(C)c2ccccc2 LN00200726_AK00546_SB0150 [0,1,0,0,0,0|3,0,0]=4 33 B22R2.15382 CC(=O)N1CCSCC1C(=O)NCC(O)c2ccccc2 LN00200726_AK0051_SB0150 [0,1,0,0,0,0|3,0,0]=4 34 B22R2.15382 CC(=O)N1CCSCC1C(=O)NC[C@@H](C)c2ccccc2 LN00200726_AK00506_SB0150 [0,1,0,0,0,0|3,0,0]=4 35 B22R2.139840 CC(=O)N1CCCCC1C(=O)NCCc2cccc(c2)Br LN00002762_AK0800_SB0150 [0,1,0,0,0,0|2,0,0]=3 36 B22R2.139840 CC(=O)N1CCCCC1C(=O)NCCc2cccc(c2)C LN00002762_AK8219_SB0150 [0,1,0,0,0,0|2,0,0]=3 37 B22R2.139840 CC(=O)N1CCCCC1C(=O)NCCc2cccc(c2)Cl LN00002762_AK0776_SB0150 [0,1,0,0,0,0|2,0,0]=3 38 B22R2.139840 CC(=O)N1CCCCC1C(=O)NCCc2cccc(c2)F LN00002762_AK0117_SB0150 [0,1,0,0,0,0|2,0,0]=3 39 B22R2.139840 CC(=O)N1CCCCC1C(=O)NCCc2cccc(c2)O LN00002762_AK00421_SB0150 [0,1,0,0,0,0|2,0,0]=3 40 B22R2.139840 CC(=O)N1CCOCC1C(=O)NCCc2cccc(c2)Br LN00010971_AK0800_SB0150 [0,1,0,0,0,0|3,0,0]=4 41 B22R2.139840 CC(=O)N1CCOCC1C(=O)NCCc2cccc(c2)C LN00010971_AK8219_SB0150 [0,1,0,0,0,0|3,0,0]=4 42 B22R2.139840 CC(=O)N1CCOCC1C(=O)NCCc2cccc(c2)Cl LN00010971_AK0776_SB0150 [0,1,0,0,0,0|3,0,0]=4 43 B22R2.139840 CC(=O)N1CCOCC1C(=O)NCCc2cccc(c2)F LN00010971_AK0117_SB0150 [0,1,0,0,0,0|3,0,0]=4 44 B22R2.139840 CC(=O)N1CCOCC1C(=O)NCCc2cccc(c2)O LN00010971_AK00421_SB0150 [0,1,0,0,0,0|3,0,0]=4 45 B22R2.139840 CC(=O)N1CCOC[C@H]1C(=O)NCCc2cccc(c2)Br LN00174413_AK0800_SB0150 [0,1,0,0,0,0|3,0,0]=4 46 B22R2.139840 CC(=O)N1CCOC[C@H]1C(=O)NCCc2cccc(c2)C LN00174413_AK8219_SB0150 [0,1,0,0,0,0|3,0,0]=4 47 B22R2.139840 CC(=O)N1CCOC[C@H]1C(=O)NCCc2cccc(c2)Cl LN00174413_AK0776_SB0150 [0,1,0,0,0,0|3,0,0]=4 48 B22R2.139840 CC(=O)N1CCOC[C@H]1C(=O)NCCc2cccc(c2)F LN00174413_AK0117_SB0150 [0,1,0,0,0,0|3,0,0]=4 49 B22R2.139840 CC(=O)N1CCOC[C@H]1C(=O)NCCc2cccc(c2)O LN00174413_AK00421_SB0150 [0,1,0,0,0,0|3,0,0]=4 50 B22R2.139840 CC(=O)N1CCSCC1C(=O)NCCc2cccc(c2)Br LN00200726_AK0800_SB0150 [0,1,0,0,0,0|3,0,0]=4 51 B22R2.139840 CC(=O)N1CCSCC1C(=O)NCCc2cccc(c2)C LN00200726_AK8219_SB0150 [0,1,0,0,0,0|3,0,0]=4 52 B22R2.139840 CC(=O)N1CCSCC1C(=O)NCCc2cccc(c2)Cl LN00200726_AK0776_SB0150 [0,1,0,0,0,0|3,0,0]=4 53 B22R2.139840 CC(=O)N1CCSCC1C(=O)NCCc2cccc(c2)F LN00200726_AK0117_SB0150 [0,1,0,0,0,0|3,0,0]=4 54 B22R2.139840 CC(=O)N1CCSCC1C(=O)NCCc2cccc(c2)O LN00200726_AK00421_SB0150 [0,1,0,0,0,0|3,0,0]=4 55 B22R2.144288 CC(=O)N1CCCCC1C(=O)NCCc2ccccc2Br LN00002762_AK0778_SB0150 [0,1,0,0,0,0|2,0,0]=3 56 B22R2.144288 CC(=O)N1CCCCC1C(=O)NCCc2ccccc2C LN00002762_AK0254_SB0150 [0,1,0,0,0,0|2,0,0]=3 57 B22R2.144288 CC(=O)N1CCCCC1C(=O)NCCc2ccccc2Cl LN00002762_AK0715_SB0150 [0,1,0,0,0,0|2,0,0]=3 58 B22R2.144288 CC(=O)N1CCCCC1C(=O)NCCc2ccccc2F LN00002762_AK0118_SB0150 [0,1,0,0,0,0|2,0,0]=3 59 B22R2.144288 CC(=O)N1CCCCC1C(=O)NCCc2ccccc2O LN00002762_AK2884_SB0150 [0,1,0,0,0,0|2,0,0]=3 60 B22R2.144288 CC(=O)N1CCOCC1C(=O)NCCc2ccccc2Br LN00010971_AK0778_SB0150 [0,1,0,0,0,0|3,0,0]=4 61 B22R2.144288 CC(=O)N1CCOCC1C(=O)NCCc2ccccc2C LN00010971_AK0254_SB0150 [0,1,0,0,0,0|3,0,0]=4 62 B22R2.144288 CC(=O)N1CCOCC1C(=O)NCCc2ccccc2Cl LN00010971_AK0715_SB0150 [0,1,0,0,0,0|3,0,0]=4 63 B22R2.144288 CC(=O)N1CCOCC1C(=O)NCCc2ccccc2F LN00010971_AK0118_SB0150 [0,1,0,0,0,0|3,0,0]=4 64 B22R2.144288 CC(=O)N1CCOCC1C(=O)NCCc2ccccc2O LN00010971_AK2884_SB0150 [0,1,0,0,0,0|3,0,0]=4 65 B22R2.144288 CC(=O)N1CCOC[C@H]1C(=O)NCCc2ccccc2Br LN00174413_AK0778_SB0150 [0,1,0,0,0,0|3,0,0]=4 66 B22R2.144288 CC(=O)N1CCOC[C@H]1C(=O)NCCc2ccccc2C LN00174413_AK0254_SB0150 [0,1,0,0,0,0|3,0,0]=4 67 B22R2.144288 CC(=O)N1CCOC[C@H]1C(=O)NCCc2ccccc2Cl LN00174413_AK0715_SB0150 [0,1,0,0,0,0|3,0,0]=4 68 B22R2.144288 CC(=O)N1CCOC[C@H]1C(=O)NCCc2ccccc2F LN00174413_AK0118_SB0150 [0,1,0,0,0,0|3,0,0]=4 69 B22R2.144288 CC(=O)N1CCOC[C@H]1C(=O)NCCc2ccccc2O LN00174413_AK2884_SB0150 [0,1,0,0,0,0|3,0,0]=4 70 B22R2.144288 CC(=O)N1CCSCC1C(=O)NCCc2ccccc2Br LN00200726_AK0778_SB0150 [0,1,0,0,0,0|3,0,0]=4 71 B22R2.144288 CC(=O)N1CCSCC1C(=O)NCCc2ccccc2C LN00200726_AK0254_SB0150 [0,1,0,0,0,0|3,0,0]=4 72 B22R2.144288 CC(=O)N1CCSCC1C(=O)NCCc2ccccc2Cl LN00200726_AK0715_SB0150 [0,1,0,0,0,0|3,0,0]=4 73 B22R2.144288 CC(=O)N1CCSCC1C(=O)NCCc2ccccc2F LN00200726_AK0118_SB0150 [0,1,0,0,0,0|3,0,0]=4 74 B22R2.144288 CC(=O)N1CCSCC1C(=O)NCCc2ccccc2O LN00200726_AK2884_SB0150 [0,1,0,0,0,0|3,0,0]=4 75 B22R2.144288 NC(=O)C1CCCCN1C(=O)CCCc2ccccc2F LN00002762_AK0084_SB3843 [0,1,0,0,0,0|3,0,0]=4 76 B22R2.147308 CC(=O)N1CC[C@H](C[C@H]1C(=O)NCCc2ccccc2)O LN00156667_AK00498_SB0150 [0,1,0,0,0,0|2,0,0]=3 77 B22R2.147308 CC(=O)N1CC[C@H](C[C@H]1C(=O)NCCc2ccccn2)O LN00156667_AK0019_SB0150 [0,1,0,0,0,0|3,0,0]=4 78 B22R2.147308 CC(=O)N1CC[C@H](C[C@H]1C(=O)NCCc2cccnc2)O LN00156667_AK00436_SB0150 [0,1,0,0,0,0|3,0,0]=4 79 B22R2.147308 CC(=O)N1CC[C@H](C[C@H]1C(=O)NCCc2ccncc2)O LN00156667_AK0093_SB0150 [0,1,0,0,0,0|3,0,0]=4 80 B22R2.309483 NC(=O)[C@@H]1C[C@@H](CCN1C(=O)CCCc2ccccc2)O LN00156667_AK0084_SB0121 [0,1,0,0,0,0|3,0,0]=4 81 B22R2.519238 CC(=O)N1CCCCC1C(=O)NCCc2ccc(cc2)Br LN00002762_AK0745_SB0150 [0,1,0,0,0,0|2,0,0]=3 82 B22R2.519238 CC(=O)N1CCCCC1C(=O)NCCc2ccc(cc2)C LN00002762_AK0066_SB0150 [0,1,0,0,0,0|2,0,0]=3 83 B22R2.519238 CC(=O)N1CCCCC1C(=O)NCCc2ccc(cc2)Cl LN00002762_AK1369_SB0150 [0,1,0,0,0,0|2,0,0]=3 84 B22R2.519238 CC(=O)N1CCCCC1C(=O)NCCc2ccc(cc2)F LN00002762_AK0123_SB0150 [0,1,0,0,0,0|2,0,0]=3 85 B22R2.519238 CC(=O)N1CCCCC1C(=O)NCCc2ccc(cc2)O LN00002762_AK0748_SB0150 [0,1,0,0,0,0|2,0,0]=3 86 B22R2.519238 CC(=O)N1CCOCC1C(=O)NCCc2ccc(cc2)Br LN00010971_AK0745_SB0150 [0,1,0,0,0,0|3,0,0]=4 87 B22R2.519238 CC(=O)N1CCOCC1C(=O)NCCc2ccc(cc2)C LN00010971_AK0066_SB0150 [0,1,0,0,0,0|3,0,0]=4 88 B22R2.519238 CC(=O)N1CCOCC1C(=O)NCCc2ccc(cc2)Cl LN00010971_AK1369_SB0150 [0,1,0,0,0,0|3,0,0]=4 89 B22R2.519238 CC(=O)N1CCOCC1C(=O)NCCc2ccc(cc2)F LN00010971_AK0123_SB0150 [0,1,0,0,0,0|3,0,0]=4 90 B22R2.519238 CC(=O)N1CCOCC1C(=O)NCCc2ccc(cc2)O LN00010971_AK0748_SB0150 [0,1,0,0,0,0|3,0,0]=4 91 B22R2.519238 CC(=O)N1CCOC[C@H]1C(=O)NCCc2ccc(cc2)Br LN00174413_AK0745_SB0150 [0,1,0,0,0,0|3,0,0]=4 92 B22R2.519238 CC(=O)N1CCOC[C@H]1C(=O)NCCc2ccc(cc2)C LN00174413_AK0066_SB0150 [0,1,0,0,0,0|3,0,0]=4 93 B22R2.519238 CC(=O)N1CCOC[C@H]1C(=O)NCCc2ccc(cc2)Cl LN00174413_AK1369_SB0150 [0,1,0,0,0,0|3,0,0]=4 94 B22R2.519238 CC(=O)N1CCOC[C@H]1C(=O)NCCc2ccc(cc2)F LN00174413_AK0123_SB0150 [0,1,0,0,0,0|3,0,0]=4 95 B22R2.519238 CC(=O)N1CCOC[C@H]1C(=O)NCCc2ccc(cc2)O LN00174413_AK0748_SB0150 [0,1,0,0,0,0|3,0,0]=4 96 B22R2.519238 CC(=O)N1CCSCC1C(=O)NCCc2ccc(cc2)Br LN00200726_AK0745_SB0150 [0,1,0,0,0,0|3,0,0]=4 97 B22R2.519238 CC(=O)N1CCSCC1C(=O)NCCc2ccc(cc2)C LN00200726_AK0066_SB0150 [0,1,0,0,0,0|3,0,0]=4 98 B22R2.519238 CC(=O)N1CCSCC1C(=O)NCCc2ccc(cc2)Cl LN00200726_AK1369_SB0150 [0,1,0,0,0,0|3,0,0]=4 99 B22R2.519238 CC(=O)N1CCSCC1C(=O)NCCc2ccc(cc2)F LN00200726_AK0123_SB0150 [0,1,0,0,0,0|3,0,0]=4 100 B22R2.519238 CC(=O)N1CCSCC1C(=O)NCCc2ccc(cc2)O LN00200726_AK0748_SB0150 [0,1,0,0,0,0|3,0,0]=4 101 B22R2.519238 NC(=O)C1CCCCN1C(=O)CCCc2ccc(cc2)Br LN00002762_AK0084_SB4477 [0,1,0,0,0,0|3,0,0]=4 102 B22R2.519238 NC(=O)C1CCCCN1C(=O)CCCc2ccc(cc2)F LN00002762_AK0084_SB1490 [0,1,0,0,0,0|3,0,0]=4 103 B22R2.534193 C#CC(=O)N1CCCCC1C(=O)NCCc2ccccc2 LN00002762_AK00498_SB0338 [0,1,0,0,0,0|2,0,0]=3 104 B22R2.534193 C#CC(=O)N1CCCCC1C(=O)NCCc2ccccn2 LN00002762_AK0019_SB0338 [0,1,0,0,0,0|3,0,0]=4 105 B22R2.534193 C#CC(=O)N1CCCCC1C(=O)NCCc2cccnc2 LN00002762_AK00436_SB0338 [0,1,0,0,0,0|3,0,0]=4 106 B22R2.534193 C#CC(=O)N1CCCCC1C(=O)NCCc2ccncc2 LN00002762_AK0093_SB0338 [0,1,0,0,0,0|3,0,0]=4 107 B22R2.534193 C#CC(=O)N1CCOCC1C(=O)NCCc2ccccc2 LN00010971_AK00498_SB0338 [0,1,0,0,0,0|3,0,0]=4 108 B22R2.534193 C#CC(=O)N1CCOC[C@H]1C(=O)NCCc2ccccc2 LN00174413_AK00498_SB0338 [0,1,0,0,0,0|3,0,0]=4 109 B22R2.534193 C#CC(=O)N1CCSCC1C(=O)NCCc2ccccc2 LN00200726_AK00498_SB0338 [0,1,0,0,0,0|3,0,0]=4 110 B22R2.534193 CCC(=O)N1CCCCC1C(=O)NCCc2ccccc2 LN00002762_AK00498_SB0064 [0,1,0,0,0,0|2,0,0]=3 111 B22R2.534193 CCC(=O)N1CCCCC1C(=O)NCCc2ccccn2 LN00002762_AK0019_SB0064 [0,1,0,0,0,0|3,0,0]=4 112 B22R2.534193 CCC(=O)N1CCCCC1C(=O)NCCc2cccnc2 LN00002762_AK00436_SB0064 [0,1,0,0,0,0|3,0,0]=4 113 B22R2.534193 CCC(=O)N1CCCCC1C(=O)NCCc2ccncc2 LN00002762_AK0093_SB0064 [0,1,0,0,0,0|3,0,0]=4 114 B22R2.534193 CCC(=O)N1CCOCC1C(=O)NCCc2ccccc2 LN00010971_AK00498_SB0064 [0,1,0,0,0,0|3,0,0]=4 115 B22R2.534193 CCC(=O)N1CCOC[C@H]1C(=O)NCCc2ccccc2 LN00174413_AK00498_SB0064 [0,1,0,0,0,0|3,0,0]=4 116 B22R2.534193 CCC(=O)N1CCSCC1C(=O)NCCc2ccccc2 LN00200726_AK00498_SB0064 [0,1,0,0,0,0|3,0,0]=4 117 B22R2.534193 CNC(=O)C1CCCCN1C(=O)CCCc2ccccc2 LN00002762_AK00442_SB0121 [0,1,0,0,0,0|3,0,0]=4 118 B22R2.534193 O=C(NCCc1ccccc1)C2CCCCN2C(=O)CO LN00002762_AK00498_SB2706 [0,1,0,0,0,0|1,0,0]=2 119 B22R2.534193 O=C(NCCc1ccccc1)C2COCCN2C(=O)CO LN00010971_AK00498_SB2706 [0,1,0,0,0,0|2,0,0]=3 120 B22R2.534193 O=C(NCCc1ccccc1)C2CSCCN2C(=O)CO LN00200726_AK00498_SB2706 [0,1,0,0,0,0|2,0,0]=3 121 B22R2.534193 O=C(NCCc1ccccc1)[C@@H]2COCCN2C(=O)CO LN00174413_AK00498_SB2706 [0,1,0,0,0,0|2,0,0]=3 122 B22R2.534193 O=C(NCCc1ccccn1)C2CCCCN2C(=O)CO LN00002762_AK0019_SB2706 [0,1,0,0,0,0|2,0,0]=3 123 B22R2.534193 O=C(NCCc1ccccn1)C2COCCN2C(=O)CO LN00010971_AK0019_SB2706 [0,1,0,0,0,0|3,0,0]=4 124 B22R2.534193 O=C(NCCc1ccccn1)C2CSCCN2C(=O)CO LN00200726_AK0019_SB2706 [0,1,0,0,0,0|3,0,0]=4 125 B22R2.534193 O=C(NCCc1ccccn1)[C@@H]2COCCN2C(=O)CO LN00174413_AK0019_SB2706 [0,1,0,0,0,0|3,0,0]=4 126 B22R2.534193 O=C(NCCc1cccnc1)C2CCCCN2C(=O)CO LN00002762_AK00436_SB2706 [0,1,0,0,0,0|2,0,0]=3 127 B22R2.534193 O=C(NCCc1cccnc1)C2COCCN2C(=O)CO LN00010971_AK00436_SB2706 [0,1,0,0,0,0|3,0,0]=4 128 B22R2.534193 O=C(NCCc1cccnc1)C2CSCCN2C(=O)CO LN00200726_AK00436_SB2706 [0,1,0,0,0,0|3,0,0]=4 129 B22R2.534193 O=C(NCCc1cccnc1)[C@@H]2COCCN2C(=O)CO LN00174413_AK00436_SB2706 [0,1,0,0,0,0|3,0,0]=4 130 B22R2.534193 O=C(NCCc1ccncc1)C2CCCCN2C(=O)CO LN00002762_AK0093_SB2706 [0,1,0,0,0,0|2,0,0]=3 131 B22R2.534193 O=C(NCCc1ccncc1)C2COCCN2C(=O)CO LN00010971_AK0093_SB2706 [0,1,0,0,0,0|3,0,0]=4 132 B22R2.534193 O=C(NCCc1ccncc1)C2CSCCN2C(=O)CO LN00200726_AK0093_SB2706 [0,1,0,0,0,0|3,0,0]=4 133 B22R2.534193 O=C(NCCc1ccncc1)[C@@H]2COCCN2C(=O)CO LN00174413_AK0093_SB2706 [0,1,0,0,0,0|3,0,0]=4 134 B22R2.534193 O=C(NCCc1ccncn1)C2CCCCN2C(=O)CO LN00002762_AK6509_SB2706 [0,1,0,0,0,0|3,0,0]=4 135 B22R3.35950 NC(=O)C1CCCCN1C(=O)C2CCc3c2cccc3 LN00002762_AK0084_SB3073 [0,0,0,1,0,0|3,0,0]=4 136 B22R3.783709 NC(=O)C1CCCCN1C(=O)C2CC2c3ccccc3 LN00002762_AK0084_SB2474 [0,0,0,1,0,0|3,0,0]=4 137 B22R3.783709 NC(=O)C1CCCCN1C(=O)[C@@H]2C[C@H]2c3ccccc3 LN00002762_AK0084_SB3176 [0,0,0,1,0,0|3,0,0]=4 138 B22R3.12267911 CC(=O)N1[C@@H](C[C@@H]2[C@@H]1C2)C(=O)NCCc3ccccc3 LN00001750_AK00498_SB0150 [0,0,0,1,0,0|2,0,0]=3 139 B22R3.12267911 CC(=O)N1[C@@H](C[C@@H]2[C@@H]1C2)C(=O)NCCc3ccccn3 LN00001750_AK0019_SB0150 [0,0,0,1,0,0|3,0,0]=4 140 B22R3.12267911 CC(=O)N1[C@@H](C[C@@H]2[C@@H]1C2)C(=O)NCCc3cccnc3 LN00001750_AK00436_SB0150 [0,0,0,1,0,0|3,0,0]=4 141 B22R3.12267911 CC(=O)N1[C@@H](C[C@@H]2[C@@H]1C2)C(=O)NCCc3ccncc3 LN00001750_AK0093_SB0150 [0,0,0,1,0,0|3,0,0]=4 142 B22R3.12267911 CC(=O)N1[C@@H](C[C@H]2[C@H]1C2)C(=O)NCCc3ccccc3 LN01276741_AK00498_SB0150 [0,0,0,1,0,0|2,0,0]=3 143 B22R3.12267911 CC(=O)N1[C@@H](C[C@H]2[C@H]1C2)C(=O)NCCc3ccccn3 LN01276741_AK0019_SB0150 [0,0,0,1,0,0|3,0,0]=4 144 B22R3.12267911 CC(=O)N1[C@@H](C[C@H]2[C@H]1C2)C(=O)NCCc3cccnc3 LN01276741_AK00436_SB0150 [0,0,0,1,0,0|3,0,0]=4 145 B22R3.12267911 CC(=O)N1[C@@H](C[C@H]2[C@H]1C2)C(=O)NCCc3ccncc3 LN01276741_AK0093_SB0150 [0,0,0,1,0,0|3,0,0]=4 146 B22R3.12267911 CC(=O)N1[C@H]2C[C@@H]2C[C@@H]1C(=O)NCCc3ccccc3 LN02186583_AK00498_SB0150 [0,0,0,1,0,0|2,0,0]=3 147 B22R3.12267911 CC(=O)N1[C@H]2C[C@@H]2C[C@@H]1C(=O)NCCc3ccccn3 LN02186583_AK0019_SB0150 [0,0,0,1,0,0|3,0,0]=4 148 B22R3.12267911 CC(=O)N1[C@H]2C[C@@H]2C[C@@H]1C(=O)NCCc3cccnc3 LN02186583_AK00436_SB0150 [0,0,0,1,0,0|3,0,0]=4 149 B22R3.12267911 CC(=O)N1[C@H]2C[C@@H]2C[C@@H]1C(=O)NCCc3ccncc3 LN02186583_AK0093_SB0150 [0,0,0,1,0,0|3,0,0]=4 150 B22R3.12267911 CC(=O)N1[C@H]2C[C@H]2C[C@@H]1C(=O)NCCc3ccccc3 LN03203809_AK00498_SB0150 [0,0,0,1,0,0|2,0,0]=3 151 B22R3.12267911 CC(=O)N1[C@H]2C[C@H]2C[C@@H]1C(=O)NCCc3ccccn3 LN03203809_AK0019_SB0150 [0,0,0,1,0,0|3,0,0]=4 152 B22R3.12267911 CC(=O)N1[C@H]2C[C@H]2C[C@@H]1C(=O)NCCc3cccnc3 LN03203809_AK00436_SB0150 [0,0,0,1,0,0|3,0,0]=4 153 B22R3.12267911 CC(=O)N1[C@H]2C[C@H]2C[C@@H]1C(=O)NCCc3ccncc3 LN03203809_AK0093_SB0150 [0,0,0,1,0,0|3,0,0]=4 154 B22R3.12417752 NC(=O)[C@@H]1C[C@@H]2C[C@H]2N1C(=O)CCCc3ccccc3 LN01276741_AK0084_SB0121 [0,0,0,1,0,0|3,0,0]=4 155 B22R3.12417752 NC(=O)[C@@H]1C[C@H]2C[C@@H]2N1C(=O)CCCc3ccccc3 LN00001750_AK0084_SB0121 [0,0,0,1,0,0|3,0,0]=4 156 B22R3.12417752 NC(=O)[C@H]1C[C@@H]2C[C@@H]2N1C(=O)CCCc3ccccc3 LN03203809_AK0084_SB0121 [0,0,0,1,0,0|3,0,0]=4 157 B22R3.12417752 NC(=O)[C@H]1C[C@H]2C[C@@H]2N1C(=O)CCCc3ccccc3 LN02186583_AK0084_SB0121 [0,0,0,1,0,0|3,0,0]=4 158 B20R2.10746 CC(=O)N1CCCCC1C(=O)NCc2ccccc2 LN00002762_AK00502_SB0150 [0,0,0,0,1,0|2,0,0]=3 159 B20R2.10746 CC(=O)N1CCCCC1C(=O)NCc2ccccn2 LN00002762_AK0018_SB0150 [0,0,0,0,1,0|3,0,0]=4 160 B20R2.10746 CC(=O)N1CCCCC1C(=O)NCc2cccnc2 LN00002762_AK0020_SB0150 [0,0,0,0,1,0|3,0,0]=4 161 B20R2.10746 CC(=O)N1CCCCC1C(=O)NCc2ccncc2 LN00002762_AK0021_SB0150 [0,0,0,0,1,0|3,0,0]=4 162 B20R2.10746 CC(=O)N1CCOCC1C(=O)NCc2ccccc2 LN00010971_AK00502_SB0150 [0,0,0,0,1,0|3,0,0]=4 163 B20R2.10746 CC(=O)N1CCOC[C@H]1C(=O)NCc2ccccc2 LN00174413_AK00502_SB0150 [0,0,0,0,1,0|3,0,0]=4 164 B20R2.10746 CC(=O)N1CCSCC1C(=O)NCc2ccccc2 LN00200726_AK00502_SB0150 [0,0,0,0,1,0|3,0,0]=4 165 B20R2.10746 NC(=O)C1CCCCN1C(=O)CCc2ccccc2 LN00002762_AK0084_SB0067 [0,0,0,0,1,0|2,0,0]=3 166 B20R2.10746 NC(=O)C1CCCCN1C(=O)CCc2ccccn2 LN00002762_AK0084_SA0316 [0,0,0,0,1,0|3,0,0]=4 167 B20R2.10746 NC(=O)C1CCCCN1C(=O)CCc2cccnc2 LN00002762_AK0084_SA0031 [0,0,0,0,1,0|3,0,0]=4 168 B20R2.10746 NC(=O)C1CCCCN1C(=O)COc2ccccc2 LN00002762_AK0084_SB0086 [0,0,0,0,1,0|3,0,0]=4 169 B20R2.10746 NC(=O)C1CCCCN1C(=O)CSc2ccccc2 LN00002762_AK0084_SB0113 [0,0,0,0,1,0|3,0,0]=4 170 B20R2.10746 NC(=O)C1COCCN1C(=O)CCc2ccccc2 LN00010971_AK0084_SB0067 [0,0,0,0,1,0|3,0,0]=4 171 B20R2.10746 NC(=O)C1CSCCN1C(=O)CCc2ccccc2 LN00200726_AK0084_SB0067 [0,0,0,0,1,0|3,0,0]=4 172 B20R2.10746 NC(=O)[C@@H]1COCCN1C(=O)CCc2ccccc2 LN00174413_AK0084_SB0067 [0,0,0,0,1,0|3,0,0]=4 173 B20R2.170942 CC(=O)N1CCCC1C(=O)NCCc2ccccc2 LN00142236_AK00498_SB0150 [0,0,0,0,1,0|2,0,0]=3 174 B20R2.170942 CC(=O)N1CCCC1C(=O)NCCc2ccccn2 LN00142236_AK0019_SB0150 [0,0,0,0,1,0|3,0,0]=4 175 B20R2.170942 CC(=O)N1CCCC1C(=O)NCCc2cccnc2 LN00142236_AK00436_SB0150 [0,0,0,0,1,0|3,0,0]=4 176 B20R2.170942 CC(=O)N1CCCC1C(=O)NCCc2ccncc2 LN00142236_AK0093_SB0150 [0,0,0,0,1,0|3,0,0]=4 177 B20R2.170942 CC(=O)N1CCC[C@@H]1C(=O)NCCc2ccccc2 LN00008660_AK00498_SB0150 [0,0,0,0,1,0|2,0,0]=3 178 B20R2.170942 CC(=O)N1CCC[C@@H]1C(=O)NCCc2ccccn2 LN00008660_AK0019_SB0150 [0,0,0,0,1,0|3,0,0]=4 179 B20R2.170942 CC(=O)N1CCC[C@@H]1C(=O)NCCc2cccnc2 LN00008660_AK00436_SB0150 [0,0,0,0,1,0|3,0,0]=4 180 B20R2.170942 CC(=O)N1CCC[C@@H]1C(=O)NCCc2ccncc2 LN00008660_AK0093_SB0150 [0,0,0,0,1,0|3,0,0]=4 181 B20R2.170942 NC(=O)C1CCCN1C(=O)CCCc2ccccc2 LN00142236_AK0084_SB0121 [0,0,0,0,1,0|3,0,0]=4 182 B20R2.170942 NC(=O)[C@H]1CCCN1C(=O)CCCc2ccccc2 LN00008660_AK0084_SB0121 [0,0,0,0,1,0|3,0,0]=4 183 B20R2.173482 CC(=O)N1CCCCC1C(=O)NCCc2ccco2 LN00002762_AK0989_SB0150 [0,0,0,0,1,0|3,0,0]=4 184 B20R2.173482 CC(=O)N1CCCCC1C(=O)NCCc2cccs2 LN00002762_AK0098_SB0150 [0,0,0,0,1,0|3,0,0]=4 185 B20R2.173482 CC(=O)N1CCCCC1C(=O)NCCc2ccsc2 LN00002762_AK1342_SB0150 [0,0,0,0,1,0|3,0,0]=4 186 B20R2.173482 CC(=O)N1CCCCC1C(=O)NCCn2cccc2 LN00002762_AK1188_SB0150 [0,0,0,0,1,0|3,0,0]=4 187 B22R2.357836 CC(=O)N1CCCCC1C(=O)NC/C=C/c2ccccc2 LN00002762_AK00073_SB0150 [0,0,0,0,0,1|2,0,1]=4 188 B22R2.357836 CC(=O)N1CCCCC1C(=O)NCCCc2ccccc2 LN00002762_AK0074_SB0150 [0,0,0,0,0,1|2,0,0]=3 189 B22R2.357836 CC(=O)N1CCCCC1C(=O)NCCCc2cccnc2 LN00002762_AK2339_SB0150 [0,0,0,0,0,1|3,0,0]=4 190 B22R2.357836 CC(=O)N1CCCCC1C(=O)NCCCc2ccncc2 LN00002762_AK1251_SB0150 [0,0,0,0,0,1|3,0,0]=4 191 B22R2.357836 CC(=O)N1CCCCC1C(=O)NCCOc2ccccc2 LN00002762_AK0103_SB0150 [0,0,0,0,0,1|2,0,0]=3 192 B22R2.357836 CC(=O)N1CCCCC1C(=O)NCCOc2ccccn2 LN00002762_AK2654_SB0150 [0,0,0,0,0,1|3,0,0]=4 193 B22R2.357836 CC(=O)N1CCCCC1C(=O)NCCOc2cccnc2 LN00002762_AK2245_SB0150 [0,0,0,0,0,1|3,0,0]=4 194 B22R2.357836 CC(=O)N1CCCCC1C(=O)NCCOc2ccncc2 LN00002762_AK00818_SB0150 [0,0,0,0,0,1|3,0,0]=4 195 B22R2.357836 CC(=O)N1CCOCC1C(=O)NCCCc2ccccc2 LN00010971_AK0074_SB0150 [0,0,0,0,0,1|3,0,0]=4 196 B22R2.357836 CC(=O)N1CCOCC1C(=O)NCCOc2ccccc2 LN00010971_AK0103_SB0150 [0,0,0,0,0,1|3,0,0]=4 197 B22R2.357836 CC(=O)N1CCOC[C@H]1C(=O)NCCCc2ccccc2 LN00174413_AK0074_SB0150 [0,0,0,0,0,1|3,0,0]=4 198 B22R2.357836 CC(=O)N1CCOC[C@H]1C(=O)NCCOc2ccccc2 LN00174413_AK0103_SB0150 [0,0,0,0,0,1|3,0,0]=4 199 B22R2.357836 CC(=O)N1CCSCC1C(=O)NCCCc2ccccc2 LN00200726_AK0074_SB0150 [0,0,0,0,0,1|3,0,0]=4 200 B22R2.357836 CC(=O)N1CCSCC1C(=O)NCCOc2ccccc2 LN00200726_AK0103_SB0150 [0,0,0,0,0,1|3,0,0]=4 201 B22R2.357836 NC(=O)C1CCCCN1C(=O)CCCCc2ccccc2 LN00002762_AK0084_SB0460 [0,0,0,0,0,1|3,0,0]=4 202 B22R2.357997 CC(=O)N1CCOCC1CC(=O)NCCc2ccccc2 LN00137987_AK00498_SB0150 [0,0,0,0,0,1|3,0,0]=4 203 B22R2.357997 NC(=O)[C@H]1CCCC[C@H]1NC(=O)CCCc2ccccc2 LN00145068_AK0084_SB0121 [0,0,0,0,0,1|2,0,0]=3 204 B22R2.357997 NC(=O)[C@H]1CCCC[C@H]1NC(=O)CCOc2ccccc2 LN00145068_AK0084_SB0066 [0,0,0,0,0,1|3,0,0]=4 205 B22R2.357997 NC(=O)[C@H]1CCCC[C@H]1NC(=O)COCc2ccccc2 LN00145068_AK0084_SB0185 [0,0,0,0,0,1|3,0,0]=4 206 B22R2.359516 CC(=O)N[C@@H]1CCCC[C@@H]1C(=O)NCCc2ccccc2 LN00145068_AK00498_SB0150 [0,0,0,0,0,1|1,0,0]=2 207 B22R2.359516 CC(=O)N[C@@H]1CCCC[C@@H]1C(=O)NCCc2ccccn2 LN00145068_AK0019_SB0150 [0,0,0,0,0,1|2,0,0]=3 208 B22R2.359516 CC(=O)N[C@@H]1CCCC[C@@H]1C(=O)NCCc2cccnc2 LN00145068_AK00436_SB0150 [0,0,0,0,0,1|2,0,0]=3 209 B22R2.359516 CC(=O)N[C@@H]1CCCC[C@@H]1C(=O)NCCc2ccncc2 LN00145068_AK0093_SB0150 [0,0,0,0,0,1|2,0,0]=3 210 B22R2.359516 CC(=O)N[C@@H]1CCCC[C@@H]1C(=O)NCCc2ccncn2 LN00145068_AK6509_SB0150 [0,0,0,0,0,1|3,0,0]=4 211 B21R2.13048 CC(=O)N1CCCCC1C(=O)N(C)Cc2ccccc2 LN00002762_AN0033_SB0150 [0,1,0,0,1,0|2,0,0]=4 212 B21R2.13048 CC(Cc1ccccc1)C(=O)N2CCCCC2C(=O)N LN00002762_AK0084_SB3205 [0,1,0,0,1,0|2,0,0]=4 213 B21R2.19470 CC(=O)N1CCCCC1C(=O)NCc2ccc(cc2)Br LN00002762_AK1474_SB0150 [0,1,0,0,1,0|2,0,0]=4 214 B21R2.19470 CC(=O)N1CCCCC1C(=O)NCc2ccc(cc2)C LN00002762_AK0048_SB0150 [0,1,0,0,1,0|2,0,0]=4 215 B21R2.19470 CC(=O)N1CCCCC1C(=O)NCc2ccc(cc2)Cl LN00002762_AK0047_SB0150 [0,1,0,0,1,0|2,0,0]=4 216 B21R2.19470 CC(=O)N1CCCCC1C(=O)NCc2ccc(cc2)F LN00002762_AK0046_SB0150 [0,1,0,0,1,0|2,0,0]=4 217 B21R2.19470 CC(=O)N1CCCCC1C(=O)NCc2ccc(cc2)I LN00002762_AK1644_SB0150 [0,1,0,0,1,0|2,0,0]=4 218 B21R2.19470 CC(=O)N1CCCCC1C(=O)NCc2ccc(cc2)O LN00002762_AK0926_SB0150 [0,1,0,0,1,0|2,0,0]=4 219 B21R2.19470 Cc1ccc(cc1)CCC(=O)N2CCCCC2C(=O)N LN00002762_AK0084_SB0421 [0,1,0,0,1,0|2,0,0]=4 220 B21R2.19470 NC(=O)C1CCCCN1C(=O)CCc2ccc(cc2)Br LN00002762_AK0084_SB1166 [0,1,0,0,1,0|2,0,0]=4 221 B21R2.19470 NC(=O)C1CCCCN1C(=O)CCc2ccc(cc2)F LN00002762_AK0084_SB1123 [0,1,0,0,1,0|2,0,0]=4 222 B21R2.19470 NC(=O)C1CCCCN1C(=O)CCc2ccc(cc2)O LN00002762_AK0084_SB2324 [0,1,0,0,1,0|2,0,0]=4 223 B21R2.21089 C#CC(=O)N1CCCCC1C(=O)NCc2ccccc2 LN00002762_AK00502_SB0338 [0,1,0,0,1,0|2,0,0]=4 224 B21R2.21089 CCC(=O)N1CCCCC1C(=O)NCc2ccccc2 LN00002762_AK00502_SB0064 [0,1,0,0,1,0|2,0,0]=4 225 B21R2.21089 CNC(=O)C1CCCCN1C(=O)CCc2ccccc2 LN00002762_AK00442_SB0067 [0,1,0,0,1,0|2,0,0]=4 226 B21R2.21089 O=C(NCc1ccccc1)C2CCCCN2C(=O)CO LN00002762_AK00502_SB2706 [0,1,0,0,1,0|1,0,0]=3 227 B21R2.21089 O=C(NCc1ccccc1)C2COCCN2C(=O)CO LN00010971_AK00502_SB2706 [0,1,0,0,1,0|2,0,0]=4 228 B21R2.21089 O=C(NCc1ccccc1)C2CSCCN2C(=O)CO LN00200726_AK00502_SB2706 [0,1,0,0,1,0|2,0,0]=4 229 B21R2.21089 O=C(NCc1ccccc1)[C@@H]2COCCN2C(=O)CO LN00174413_AK00502_SB2706 [0,1,0,0,1,0|2,0,0]=4 230 B21R2.21089 O=C(NCc1ccccn1)C2CCCCN2C(=O)CO LN00002762_AK0018_SB2706 [0,1,0,0,1,0|2,0,0]=4 231 B21R2.21089 O=C(NCc1cccnc1)C2CCCCN2C(=O)CO LN00002762_AK0020_SB2706 [0,1,0,0,1,0|2,0,0]=4 232 B21R2.21089 O=C(NCc1ccncc1)C2CCCCN2C(=O)CO LN00002762_AK0021_SB2706 [0,1,0,0,1,0|2,0,0]=4 233 B21R2.107208 CC(=O)N1CCCCC1C(=O)NCc2ccccc2Br LN00002762_AK1632_SB0150 [0,1,0,0,1,0|2,0,0]=4 234 B21R2.107208 CC(=O)N1CCCCC1C(=O)NCc2ccccc2C LN00002762_AK0040_SB0150 [0,1,0,0,1,0|2,0,0]=4 235 B21R2.107208 CC(=O)N1CCCCC1C(=O)NCc2ccccc2Cl LN00002762_AK0038_SB0150 [0,1,0,0,1,0|2,0,0]=4 236 B21R2.107208 CC(=O)N1CCCCC1C(=O)NCc2ccccc2F LN00002762_AK0037_SB0150 [0,1,0,0,1,0|2,0,0]=4 237 B21R2.107208 CC(=O)N1CCCCC1C(=O)NCc2ccccc2I LN00002762_AK3923_SB0150 [0,1,0,0,1,0|2,0,0]=4 238 B21R2.107208 CC(=O)N1CCCCC1C(=O)NCc2ccccc2O LN00002762_AK0963_SB0150 [0,1,0,0,1,0|2,0,0]=4 239 B21R2.107208 Cc1ccccc1CCC(=O)N2CCCCC2C(=O)N LN00002762_AK0084_SB0422 [0,1,0,0,1,0|2,0,0]=4 240 B21R2.107208 NC(=O)C1CCCCN1C(=O)CCc2ccccc2Br LN00002762_AK0084_SB1278 [0,1,0,0,1,0|2,0,0]=4 241 B21R2.107208 NC(=O)C1CCCCN1C(=O)CCc2ccccc2Cl LN00002762_AK0084_SB0140 [0,1,0,0,1,0|2,0,0]=4 242 B21R2.107208 NC(=O)C1CCCCN1C(=O)CCc2ccccc2F LN00002762_AK0084_SB0008 [0,1,0,0,1,0|2,0,0]=4 243 B21R2.222491 CC(=O)N1CCCCC1C(=O)NCc2cccc(c2)Br LN00002762_AK1177_SB0150 [0,1,0,0,1,0|2,0,0]=4 244 B21R2.222491 CC(=O)N1CCCCC1C(=O)NCc2cccc(c2)C LN00002762_AK0045_SB0150 [0,1,0,0,1,0|2,0,0]=4 245 B21R2.222491 CC(=O)N1CCCCC1C(=O)NCc2cccc(c2)Cl LN00002762_AK0094_SB0150 [0,1,0,0,1,0|2,0,0]=4 246 B21R2.222491 CC(=O)N1CCCCC1C(=O)NCc2cccc(c2)F LN00002762_AK0041_SB0150 [0,1,0,0,1,0|2,0,0]=4 247 B21R2.222491 CC(=O)N1CCCCC1C(=O)NCc2cccc(c2)I LN00002762_AK1572_SB0150 [0,1,0,0,1,0|2,0,0]=4 248 B21R2.222491 CC(=O)N1CCCCC1C(=O)NCc2cccc(c2)O LN00002762_AK0974_SB0150 [0,1,0,0,1,0|2,0,0]=4 249 B21R2.222491 Cc1cccc(c1)CCC(=O)N2CCCCC2C(=O)N LN00002762_AK0084_SB1394 [0,1,0,0,1,0|2,0,0]=4 250 B21R2.222491 NC(=O)C1CCCCN1C(=O)CCc2cccc(c2)Br LN00002762_AK0084_SB0278 [0,1,0,0,1,0|2,0,0]=4 251 B21R2.222491 NC(=O)C1CCCCN1C(=O)CCc2cccc(c2)O LN00002762_AK0084_SB3088 [0,1,0,0,1,0|2,0,0]=4 252 B21R2.225975 NC(=O)[C@@H]1C[C@@H](CCN1C(=O)CCc2ccccc2)O LN00156667_AK0084_SB0067 [0,1,0,0,1,0|2,0,0]=4 253 B21R2.226148 CC(=O)N1CC[C@H](C[C@H]1C(=O)NCc2ccccc2)O LN00156667_AK00502_SB0150 [0,1,0,0,1,0|2,0,0]=4 254 B21R2.252192 CC(CC(=O)N1CCCCC1C(=O)N)c2ccccc2 LN00002762_AK0084_SB0419 [0,1,0,0,1,0|2,0,0]=4 255 B21R2.252192 NC(=O)C1CCCCN1C(=O)CC(O)c2ccccc2 LN00002762_AK0084_SB2325 [0,1,0,0,1,0|2,0,0]=4 256 B21R2.13104 CC(=O)N1CCCC1C(=O)NCC(C)c2ccccc2 LN00142236_AK00546_SB0150 [0,1,0,0,1,0|2,0,0]=4 257 B21R2.13104 CC(=O)N1CCCC1C(=O)NCC(O)c2ccccc2 LN00142236_AK0051_SB0150 [0,1,0,0,1,0|2,0,0]=4 258 B21R2.13104 CC(=O)N1CCCC1C(=O)NC[C@@H](C)c2ccccc2 LN00142236_AK00506_SB0150 [0,1,0,0,1,0|2,0,0]=4 259 B21R2.13104 CC(=O)N1CCC[C@@H]1C(=O)NCC(C)c2ccccc2 LN00008660_AK00546_SB0150 [0,1,0,0,1,0|2,0,0]=4 260 B21R2.13104 CC(=O)N1CCC[C@@H]1C(=O)NCC(O)c2ccccc2 LN00008660_AK0051_SB0150 [0,1,0,0,1,0|2,0,0]=4 261 B21R2.13104 CC(=O)N1CCC[C@@H]1C(=O)NC[C@@H](C)c2ccccc2 LN00008660_AK00506_SB0150 [0,1,0,0,1,0|2,0,0]=4 262 B21R2.103601 CC(=O)N1CCCC1C(=O)NCCc2cccc(c2)Br LN00142236_AK0800_SB0150 [0,1,0,0,1,0|2,0,0]=4 263 B21R2.103601 CC(=O)N1CCCC1C(=O)NCCc2cccc(c2)C LN00142236_AK8219_SB0150 [0,1,0,0,1,0|2,0,0]=4 264 B21R2.103601 CC(=O)N1CCCC1C(=O)NCCc2cccc(c2)Cl LN00142236_AK0776_SB0150 [0,1,0,0,1,0|2,0,0]=4 265 B21R2.103601 CC(=O)N1CCCC1C(=O)NCCc2cccc(c2)F LN00142236_AK0117_SB0150 [0,1,0,0,1,0|2,0,0]=4 266 B21R2.103601 CC(=O)N1CCCC1C(=O)NCCc2cccc(c2)O LN00142236_AK00421_SB0150 [0,1,0,0,1,0|2,0,0]=4 267 B21R2.103601 CC(=O)N1CCC[C@@H]1C(=O)NCCc2cccc(c2)Br LN00008660_AK0800_SB0150 [0,1,0,0,1,0|2,0,0]=4 268 B21R2.103601 CC(=O)N1CCC[C@@H]1C(=O)NCCc2cccc(c2)C LN00008660_AK8219_SB0150 [0,1,0,0,1,0|2,0,0]=4 269 B21R2.103601 CC(=O)N1CCC[C@@H]1C(=O)NCCc2cccc(c2)Cl LN00008660_AK0776_SB0150 [0,1,0,0,1,0|2,0,0]=4 270 B21R2.103601 CC(=O)N1CCC[C@@H]1C(=O)NCCc2cccc(c2)F LN00008660_AK0117_SB0150 [0,1,0,0,1,0|2,0,0]=4 271 B21R2.103601 CC(=O)N1CCC[C@@H]1C(=O)NCCc2cccc(c2)O LN00008660_AK00421_SB0150 [0,1,0,0,1,0|2,0,0]=4 272 B21R2.107193 CC(=O)N1CCCC1C(=O)NCCc2ccccc2Br LN00142236_AK0778_SB0150 [0,1,0,0,1,0|2,0,0]=4 273 B21R2.107193 CC(=O)N1CCCC1C(=O)NCCc2ccccc2C LN00142236_AK0254_SB0150 [0,1,0,0,1,0|2,0,0]=4 274 B21R2.107193 CC(=O)N1CCCC1C(=O)NCCc2ccccc2Cl LN00142236_AK0715_SB0150 [0,1,0,0,1,0|2,0,0]=4 275 B21R2.107193 CC(=O)N1CCCC1C(=O)NCCc2ccccc2F LN00142236_AK0118_SB0150 [0,1,0,0,1,0|2,0,0]=4 276 B21R2.107193 CC(=O)N1CCCC1C(=O)NCCc2ccccc2O LN00142236_AK2884_SB0150 [0,1,0,0,1,0|2,0,0]=4 277 B21R2.107193 CC(=O)N1CCC[C@@H]1C(=O)NCCc2ccccc2Br LN00008660_AK0778_SB0150 [0,1,0,0,1,0|2,0,0]=4 278 B21R2.107193 CC(=O)N1CCC[C@@H]1C(=O)NCCc2ccccc2C LN00008660_AK0254_SB0150 [0,1,0,0,1,0|2,0,0]=4 279 B21R2.107193 CC(=O)N1CCC[C@@H]1C(=O)NCCc2ccccc2Cl LN00008660_AK0715_SB0150 [0,1,0,0,1,0|2,0,0]=4 280 B21R2.107193 CC(=O)N1CCC[C@@H]1C(=O)NCCc2ccccc2F LN00008660_AK0118_SB0150 [0,1,0,0,1,0|2,0,0]=4 281 B21R2.107193 CC(=O)N1CCC[C@@H]1C(=O)NCCc2ccccc2O LN00008660_AK2884_SB0150 [0,1,0,0,1,0|2,0,0]=4 282 B21R2.257055 CC(=O)N1CCCC1(C)C(=O)NCCc2ccccc2 LN00167526_AK00498_SB0150 [0,1,0,0,1,0|2,0,0]=4 283 B21R2.257055 CC(=O)N1CCC[C@]1(C)C(=O)NCCc2ccccc2 LN00214848_AK00498_SB0150 [0,1,0,0,1,0|2,0,0]=4 284 B21R2.358853 CC(=O)N1CCCC1C(=O)NCCc2ccc(cc2)Br LN00142236_AK0745_SB0150 [0,1,0,0,1,0|2,0,0]=4 285 B21R2.358853 CC(=O)N1CCCC1C(=O)NCCc2ccc(cc2)C LN00142236_AK0066_SB0150 [0,1,0,0,1,0|2,0,0]=4 286 B21R2.358853 CC(=O)N1CCCC1C(=O)NCCc2ccc(cc2)Cl LN00142236_AK1369_SB0150 [0,1,0,0,1,0|2,0,0]=4 287 B21R2.358853 CC(=O)N1CCCC1C(=O)NCCc2ccc(cc2)F LN00142236_AK0123_SB0150 [0,1,0,0,1,0|2,0,0]=4 288 B21R2.358853 CC(=O)N1CCCC1C(=O)NCCc2ccc(cc2)O LN00142236_AK0748_SB0150 [0,1,0,0,1,0|2,0,0]=4 289 B21R2.358853 CC(=O)N1CCC[C@@H]1C(=O)NCCc2ccc(cc2)Br LN00008660_AK0745_SB0150 [0,1,0,0,1,0|2,0,0]=4 290 B21R2.358853 CC(=O)N1CCC[C@@H]1C(=O)NCCc2ccc(cc2)C LN00008660_AK0066_SB0150 [0,1,0,0,1,0|2,0,0]=4 291 B21R2.358853 CC(=O)N1CCC[C@@H]1C(=O)NCCc2ccc(cc2)Cl LN00008660_AK1369_SB0150 [0,1,0,0,1,0|2,0,0]=4 292 B21R2.358853 CC(=O)N1CCC[C@@H]1C(=O)NCCc2ccc(cc2)F LN00008660_AK0123_SB0150 [0,1,0,0,1,0|2,0,0]=4 293 B21R2.358853 CC(=O)N1CCC[C@@H]1C(=O)NCCc2ccc(cc2)O LN00008660_AK0748_SB0150 [0,1,0,0,1,0|2,0,0]=4 294 B21R2.368273 C#CC(=O)N1CCCC1C(=O)NCCc2ccccc2 LN00142236_AK00498_SB0338 [0,1,0,0,1,0|2,0,0]=4 295 B21R2.368273 C#CC(=O)N1CCC[C@@H]1C(=O)NCCc2ccccc2 LN00008660_AK00498_SB0338 [0,1,0,0,1,0|2,0,0]=4 296 B21R2.368273 CCC(=O)N1CCCC1C(=O)NCCc2ccccc2 LN00142236_AK00498_SB0064 [0,1,0,0,1,0|2,0,0]=4 297 B21R2.368273 CCC(=O)N1CCC[C@@H]1C(=O)NCCc2ccccc2 LN00008660_AK00498_SB0064 [0,1,0,0,1,0|2,0,0]=4 298 B21R2.368273 O=C(NCCc1ccccc1)C2CCCN2C(=O)CO LN00142236_AK00498_SB2706 [0,1,0,0,1,0|1,0,0]=3 299 B21R2.368273 O=C(NCCc1ccccc1)[C@H]2CCCN2C(=O)CO LN00008660_AK00498_SB2706 [0,1,0,0,1,0|1,0,0]=3 300 B21R2.368273 O=C(NCCc1ccccn1)C2CCCN2C(=O)CO LN00142236_AK0019_SB2706 [0,1,0,0,1,0|2,0,0]=4 301 B21R2.368273 O=C(NCCc1ccccn1)[C@H]2CCCN2C(=O)CO LN00008660_AK0019_SB2706 [0,1,0,0,1,0|2,0,0]=4 302 B21R2.368273 O=C(NCCc1cccnc1)C2CCCN2C(=O)CO LN00142236_AK00436_SB2706 [0,1,0,0,1,0|2,0,0]=4 303 B21R2.368273 O=C(NCCc1cccnc1)[C@H]2CCCN2C(=O)CO LN00008660_AK00436_SB2706 [0,1,0,0,1,0|2,0,0]=4 304 B21R2.368273 O=C(NCCc1ccncc1)C2CCCN2C(=O)CO LN00142236_AK0093_SB2706 [0,1,0,0,1,0|2,0,0]=4 305 B21R2.368273 O=C(NCCc1ccncc1)[C@H]2CCCN2C(=O)CO LN00008660_AK0093_SB2706 [0,1,0,0,1,0|2,0,0]=4 306 B21R2.2405228 CC(=O)N1[C@H](CC[C@H]1C(=O)NCCc2ccccc2)C LN00001987_AK00498_SB0150 [0,1,0,0,1,0|2,0,0]=4 307 B21R2.3233932 CC(=O)N1CC[C@H]([C@H]1C(=O)NCCc2ccccc2)O LN01264161_AK00498_SB0150 [0,1,0,0,1,0|2,0,0]=4 308 B21R2.4372528 CC(=O)N1C[C@@H](C[C@@H]1C(=O)NCCc2ccccc2)O LN00144769_AK00498_SB0150 [0,1,0,0,1,0|2,0,0]=4 309 B21R2.4372528 CC(=O)N1C[C@@H](C[C@H]1C(=O)NCCc2ccccc2)C LN00001965_AK00498_SB0150 [0,1,0,0,1,0|2,0,0]=4 310 B21R2.4372528 CC(=O)N1C[C@@H](C[C@H]1C(=O)NCCc2ccccc2)F LN00002261_AK00498_SB0150 [0,1,0,0,1,0|2,0,0]=4 311 B21R2.4372528 CC(=O)N1C[C@@H](C[C@H]1C(=O)NCCc2ccccc2)O LN00009383_AK00498_SB0150 [0,1,0,0,1,0|2,0,0]=4 312 B21R2.4372528 CC(=O)N1C[C@H](C[C@@H]1C(=O)NCCc2ccccc2)F LN00340045_AK00498_SB0150 [0,1,0,0,1,0|2,0,0]=4 313 B21R2.4372528 CC(=O)N1C[C@H](C[C@H]1C(=O)NCCc2ccccc2)C LN00001753_AK00498_SB0150 [0,1,0,0,1,0|2,0,0]=4 314 B21R2.4372528 CC(=O)N1C[C@H](C[C@H]1C(=O)NCCc2ccccc2)F LN00001388_AK00498_SB0150 [0,1,0,0,1,0|2,0,0]=4 315 B21R2.4372528 CC(=O)N1C[C@H](C[C@H]1C(=O)NCCc2ccccc2)O LN00144963_AK00498_SB0150 [0,1,0,0,1,0|2,0,0]=4 316 B21R2.379440 O=C(NCCc1ccco1)C2CCCCN2C(=O)CO LN00002762_AK0989_SB2706 [0,1,0,0,1,0|2,0,0]=4 317 B21R2.379440 O=C(NCCc1cccs1)C2CCCCN2C(=O)CO LN00002762_AK0098_SB2706 [0,1,0,0,1,0|2,0,0]=4 318 B21R2.379440 O=C(NCCc1ccsc1)C2CCCCN2C(=O)CO LN00002762_AK1342_SB2706 [0,1,0,0,1,0|2,0,0]=4 319 B21R2.379440 O=C(NCCn1cccc1)C2CCCCN2C(=O)CO LN00002762_AK1188_SB2706 [0,1,0,0,1,0|2,0,0]=4 320 B23R2.17146 CC(=O)N1CCCCC1C(=O)NC[C@H](O)Cc2ccccc2 LN00002762_AKA020_SB0150 [0,1,0,0,0,1|2,0,0]=4 321 B23R2.174169 CC(=O)N1CCCCC1C(=O)NCCOc2cccc(c2)Br LN00002762_AK0441_SB0150 [0,1,0,0,0,1|2,0,0]=4 322 B23R2.174169 CC(=O)N1CCCCC1C(=O)NCCOc2cccc(c2)F LN00002762_AK2572_SB0150 [0,1,0,0,0,1|2,0,0]=4 323 B23R2.180038 CC(=O)N1CCCCC1C(=O)NCCOc2ccccc2C LN00002762_AK1111_SB0150 [0,1,0,0,0,1|2,0,0]=4 324 B23R2.180038 CC(=O)N1CCCCC1C(=O)NCCOc2ccccc2Cl LN00002762_AK0815_SB0150 [0,1,0,0,0,1|2,0,0]=4 325 B23R2.474960 CC(=O)N1CCCCC1C(=O)NCCN(C)c2ccccc2 LN00002762_AK00706_SB0150 [0,1,0,0,0,1|2,0,0]=4 326 B23R2.474971 CC(=O)N1CCCCC1C(=O)N(C)CCCc2ccccc2 LN00002762_AN2288_SB0150 [0,1,0,0,0,1|2,0,0]=4 327 B23R2.714879 CC(=O)N1CCCCC1C(=O)NCCOc2ccc(cc2)C LN00002762_AK7560_SB0150 [0,1,0,0,0,1|2,0,0]=4 328 B23R2.714879 CC(=O)N1CCCCC1C(=O)NCCOc2ccc(cc2)Cl LN00002762_AK0501_SB0150 [0,1,0,0,0,1|2,0,0]=4 329 B23R2.714879 CC(=O)N1CCCCC1C(=O)NCCOc2ccc(cc2)F LN00002762_AK0979_SB0150 [0,1,0,0,0,1|2,0,0]=4 330 B23R2.763305 C#CC(=O)N1CCCCC1C(=O)NCCCc2ccccc2 LN00002762_AK0074_SB0338 [0,1,0,0,0,1|2,0,0]=4 331 B23R2.763305 C#CC(=O)N1CCCCC1C(=O)NCCOc2ccccc2 LN00002762_AK0103_SB0338 [0,1,0,0,0,1|2,0,0]=4 332 B23R2.763305 CCC(=O)N1CCCCC1C(=O)NCCCc2ccccc2 LN00002762_AK0074_SB0064 [0,1,0,0,0,1|2,0,0]=4 333 B23R2.763305 CCC(=O)N1CCCCC1C(=O)NCCOc2ccccc2 LN00002762_AK0103_SB0064 [0,1,0,0,0,1|2,0,0]=4 334 B23R2.763305 O=C(NC/C=C/c1ccccc1)C2CCCCN2C(=O)CO LN00002762_AK00073_SB2706 [0,1,0,0,0,1|1,0,1]=4 335 B23R2.763305 O=C(NCCCc1ccccc1)C2CCCCN2C(=O)CO LN00002762_AK0074_SB2706 [0,1,0,0,0,1|1,0,0]=3 336 B23R2.763305 O=C(NCCCc1ccccc1)C2COCCN2C(=O)CO LN00010971_AK0074_SB2706 [0,1,0,0,0,1|2,0,0]=4 337 B23R2.763305 O=C(NCCCc1ccccc1)C2CSCCN2C(=O)CO LN00200726_AK0074_SB2706 [0,1,0,0,0,1|2,0,0]=4 338 B23R2.763305 O=C(NCCCc1ccccc1)[C@@H]2COCCN2C(=O)CO LN00174413_AK0074_SB2706 [0,1,0,0,0,1|2,0,0]=4 339 B23R2.763305 O=C(NCCCc1cccnc1)C2CCCCN2C(=O)CO LN00002762_AK2339_SB2706 [0,1,0,0,0,1|2,0,0]=4 340 B23R2.763305 O=C(NCCCc1ccncc1)C2CCCCN2C(=O)CO LN00002762_AK1251_SB2706 [0,1,0,0,0,1|2,0,0]=4 341 B23R2.763305 O=C(NCCOc1ccccc1)C2CCCCN2C(=O)CO LN00002762_AK0103_SB2706 [0,1,0,0,0,1|1,0,0]=3 342 B23R2.763305 O=C(NCCOc1ccccc1)C2COCCN2C(=O)CO LN00010971_AK0103_SB2706 [0,1,0,0,0,1|2,0,0]=4 343 B23R2.763305 O=C(NCCOc1ccccc1)C2CSCCN2C(=O)CO LN00200726_AK0103_SB2706 [0,1,0,0,0,1|2,0,0]=4 344 B23R2.763305 O=C(NCCOc1ccccc1)[C@@H]2COCCN2C(=O)CO LN00174413_AK0103_SB2706 [0,1,0,0,0,1|2,0,0]=4 345 B23R2.763305 O=C(NCCOc1ccccn1)C2CCCCN2C(=O)CO LN00002762_AK2654_SB2706 [0,1,0,0,0,1|2,0,0]=4 346 B23R2.763305 O=C(NCCOc1cccnc1)C2CCCCN2C(=O)CO LN00002762_AK2245_SB2706 [0,1,0,0,0,1|2,0,0]=4 347 B23R2.763305 O=C(NCCOc1ccncc1)C2CCCCN2C(=O)CO LN00002762_AK00818_SB2706 [0,1,0,0,0,1|2,0,0]=4 348 B23R2.8322293 CC(=O)N1CC[C@H](C[C@H]1C(=O)NCCCc2ccccc2)O LN00156667_AK0074_SB0150 [0,1,0,0,0,1|2,0,0]=4 349 B23R2.8322293 CC(=O)N1CC[C@H](C[C@H]1C(=O)NCCOc2ccccc2)O LN00156667_AK0103_SB0150 [0,1,0,0,0,1|2,0,0]=4 350 B23R2.179646 NC(=O)[C@H]1CCCC[C@H]1NC(=O)CCCc2ccccc2F LN00145068_AK0084_SB3843 [0,1,0,0,0,1|2,0,0]=4 351 B23R2.714612 NC(=O)[C@H]1CCCC[C@H]1NC(=O)CCCc2ccc(cc2)Br LN00145068_AK0084_SB4477 [0,1,0,0,0,1|2,0,0]=4 352 B23R2.714612 NC(=O)[C@H]1CCCC[C@H]1NC(=O)CCCc2ccc(cc2)F LN00145068_AK0084_SB1490 [0,1,0,0,0,1|2,0,0]=4 353 B23R2.763882 CNC(=O)[C@H]1CCCC[C@@H]1NC(=O)CCCc2ccccc2 LN00145068_AK00442_SB0121 [0,1,0,0,0,1|2,0,0]=4 354 B23R2.763882 O=C(CC1COCCN1C(=O)CO)NCCc2ccccc2 LN00137987_AK00498_SB2706 [0,1,0,0,0,1|2,0,0]=4 355 B23R2.29641 CC(=O)N[C@@H]1CCCC[C@@H]1C(=O)NCC(O)c2ccccc2 LN00145068_AK0051_SB0150 [0,1,0,0,0,1|1,0,0]=3 356 B23R2.29641 CC(=O)N[C@H]1CCCC[C@@H]1C(=O)NCC(C)c2ccccc2 LN00145068_AK00546_SB0150 [0,1,0,0,0,1|1,0,0]=3 357 B23R2.29641 CC(=O)N[C@H]1CCCC[C@@H]1C(=O)NC[C@@H](C)c2ccccc2 LN00145068_AK00506_SB0150 [0,1,0,0,0,1|1,0,0]=3 358 B23R2.174196 CC(=O)N[C@@H]1CCCC[C@@H]1C(=O)NCCc2cccc(c2)Br LN00145068_AK0800_SB0150 [0,1,0,0,0,1|1,0,0]=3 359 B23R2.174196 CC(=O)N[C@@H]1CCCC[C@@H]1C(=O)NCCc2cccc(c2)Cl LN00145068_AK0776_SB0150 [0,1,0,0,0,1|1,0,0]=3 360 B23R2.174196 CC(=O)N[C@@H]1CCCC[C@@H]1C(=O)NCCc2cccc(c2)F LN00145068_AK0117_SB0150 [0,1,0,0,0,1|1,0,0]=3 361 B23R2.174196 CC(=O)N[C@@H]1CCCC[C@@H]1C(=O)NCCc2cccc(c2)O LN00145068_AK00421_SB0150 [0,1,0,0,0,1|1,0,0]=3 362 B23R2.174196 CC(=O)N[C@H]1CCCC[C@@H]1C(=O)NCCc2cccc(c2)C LN00145068_AK8219_SB0150 [0,1,0,0,0,1|1,0,0]=3 363 B23R2.179624 CC(=O)N[C@@H]1CCCC[C@@H]1C(=O)NCCc2ccccc2Br LN00145068_AK0778_SB0150 [0,1,0,0,0,1|1,0,0]=3 364 B23R2.179624 CC(=O)N[C@@H]1CCCC[C@@H]1C(=O)NCCc2ccccc2Cl LN00145068_AK0715_SB0150 [0,1,0,0,0,1|1,0,0]=3 365 B23R2.179624 CC(=O)N[C@@H]1CCCC[C@@H]1C(=O)NCCc2ccccc2F LN00145068_AK0118_SB0150 [0,1,0,0,0,1|1,0,0]=3 366 B23R2.179624 CC(=O)N[C@@H]1CCCC[C@@H]1C(=O)NCCc2ccccc2O LN00145068_AK2884_SB0150 [0,1,0,0,0,1|1,0,0]=3 367 B23R2.179624 CC(=O)N[C@H]1CCCC[C@@H]1C(=O)NCCc2ccccc2C LN00145068_AK0254_SB0150 [0,1,0,0,0,1|1,0,0]=3 368 B23R2.714584 CC(=O)N[C@@H]1CCCC[C@@H]1C(=O)NCCc2ccc(cc2)Br LN00145068_AK0745_SB0150 [0,1,0,0,0,1|1,0,0]=3 369 B23R2.714584 CC(=O)N[C@@H]1CCCC[C@@H]1C(=O)NCCc2ccc(cc2)Cl LN00145068_AK1369_SB0150 [0,1,0,0,0,1|1,0,0]=3 370 B23R2.714584 CC(=O)N[C@@H]1CCCC[C@@H]1C(=O)NCCc2ccc(cc2)F LN00145068_AK0123_SB0150 [0,1,0,0,0,1|1,0,0]=3 371 B23R2.714584 CC(=O)N[C@@H]1CCCC[C@@H]1C(=O)NCCc2ccc(cc2)O LN00145068_AK0748_SB0150 [0,1,0,0,0,1|1,0,0]=3 372 B23R2.714584 CC(=O)N[C@H]1CCCC[C@@H]1C(=O)NCCc2ccc(cc2)C LN00145068_AK0066_SB0150 [0,1,0,0,0,1|1,0,0]=3 373 B23R2.771522 C#CC(=O)N[C@@H]1CCCC[C@@H]1C(=O)NCCc2ccccc2 LN00145068_AK00498_SB0338 [0,1,0,0,0,1|1,0,0]=3 374 B23R2.771522 C#CC(=O)N[C@@H]1CCCC[C@@H]1C(=O)NCCc2ccccn2 LN00145068_AK0019_SB0338 [0,1,0,0,0,1|2,0,0]=4 375 B23R2.771522 C#CC(=O)N[C@@H]1CCCC[C@@H]1C(=O)NCCc2cccnc2 LN00145068_AK00436_SB0338 [0,1,0,0,0,1|2,0,0]=4 376 B23R2.771522 C#CC(=O)N[C@@H]1CCCC[C@@H]1C(=O)NCCc2ccncc2 LN00145068_AK0093_SB0338 [0,1,0,0,0,1|2,0,0]=4 377 B23R2.771522 CCC(=O)N[C@@H]1CCCC[C@@H]1C(=O)NCCc2ccccc2 LN00145068_AK00498_SB0064 [0,1,0,0,0,1|1,0,0]=3 378 B23R2.771522 CCC(=O)N[C@@H]1CCCC[C@@H]1C(=O)NCCc2ccccn2 LN00145068_AK0019_SB0064 [0,1,0,0,0,1|2,0,0]=4 379 B23R2.771522 CCC(=O)N[C@@H]1CCCC[C@@H]1C(=O)NCCc2cccnc2 LN00145068_AK00436_SB0064 [0,1,0,0,0,1|2,0,0]=4 380 B23R2.771522 CCC(=O)N[C@@H]1CCCC[C@@H]1C(=O)NCCc2ccncc2 LN00145068_AK0093_SB0064 [0,1,0,0,0,1|2,0,0]=4 381 B23R2.771522 O=C(CO)N[C@@H]1CCCC[C@@H]1C(=O)NCCc2ccccc2 LN00145068_AK00498_SB2706 [0,1,0,0,0,1|0,0,0]=2 382 B23R2.771522 O=C(CO)N[C@@H]1CCCC[C@@H]1C(=O)NCCc2ccccn2 LN00145068_AK0019_SB2706 [0,1,0,0,0,1|1,0,0]=3 383 B23R2.771522 O=C(CO)N[C@@H]1CCCC[C@@H]1C(=O)NCCc2cccnc2 LN00145068_AK00436_SB2706 [0,1,0,0,0,1|1,0,0]=3 384 B23R2.771522 O=C(CO)N[C@@H]1CCCC[C@@H]1C(=O)NCCc2ccncc2 LN00145068_AK0093_SB2706 [0,1,0,0,0,1|1,0,0]=3 385 B23R2.771522 O=C(CO)N[C@@H]1CCCC[C@@H]1C(=O)NCCc2ccncn2 LN00145068_AK6509_SB2706 [0,1,0,0,0,1|2,0,0]=4 386 B23R2.3085413 CC(=O)C(=O)N1CCCCC1C(=O)NCCc2ccccc2 LN00002762_AK00498_SB0051 [0,1,0,0,0,1|2,0,0]=4 387 B23R2.3085413 NC(=O)C(=O)N1CCCCC1C(=O)NCCc2ccccc2 LN00002762_AK00498_SB0128 [0,1,0,0,0,1|2,0,0]=4 388 B23R2.474956 CC(=O)N1CCCCC1C(=O)N(C)CC(O)c2ccccc2 LN00002762_AN3044_SB0150 [0,2,0,0,0,0|2,0,0]=4 389 B23R2.714960 CC(=O)N1CCCCC1C(=O)N(C)CCc2ccc(cc2)Cl LN00002762_AN3038_SB0150 [0,2,0,0,0,0|2,0,0]=4 390 B23R2.8229924 CC(=O)N1CCCCC1C(=O)N(C)CCc2cccc(c2)C LN00002762_AN3025_SB0150 [0,2,0,0,0,0|2,0,0]=4 391 B23R2.8229924 CC(=O)N1CCCCC1C(=O)N(C)CCc2cccc(c2)F LN00002762_AN5203_SB0150 [0,2,0,0,0,0|2,0,0]=4 392 B23R2.27973 C#CC(=O)N1CCCCC1C(=O)NCC(C)c2ccccc2 LN00002762_AK00546_SB0338 [0,2,0,0,0,0|2,0,0]=4 393 B23R2.27973 C#CC(=O)N1CCCCC1C(=O)NCC(O)c2ccccc2 LN00002762_AK0051_SB0338 [0,2,0,0,0,0|2,0,0]=4 394 B23R2.27973 C#CC(=O)N1CCCCC1C(=O)NC[C@@H](C)c2ccccc2 LN00002762_AK00506_SB0338 [0,2,0,0,0,0|2,0,0]=4 395 B23R2.27973 CC(CNC(=O)C1CCCCN1C(=O)CO)c2ccccc2 LN00002762_AK00546_SB2706 [0,2,0,0,0,0|1,0,0]=3 396 B23R2.27973 CC(CNC(=O)C1COCCN1C(=O)CO)c2ccccc2 LN00010971_AK00546_SB2706 [0,2,0,0,0,0|2,0,0]=4 397 B23R2.27973 CC(CNC(=O)C1CSCCN1C(=O)CO)c2ccccc2 LN00200726_AK00546_SB2706 [0,2,0,0,0,0|2,0,0]=4 398 B23R2.27973 CC(CNC(=O)[C@@H]1COCCN1C(=O)CO)c2ccccc2 LN00174413_AK00546_SB2706 [0,2,0,0,0,0|2,0,0]=4 399 B23R2.27973 CCC(=O)N1CCCCC1C(=O)NCC(C)c2ccccc2 LN00002762_AK00546_SB0064 [0,2,0,0,0,0|2,0,0]=4 400 B23R2.27973 CCC(=O)N1CCCCC1C(=O)NCC(O)c2ccccc2 LN00002762_AK0051_SB0064 [0,2,0,0,0,0|2,0,0]=4 401 B23R2.27973 CCC(=O)N1CCCCC1C(=O)NC[C@@H](C)c2ccccc2 LN00002762_AK00506_SB0064 [0,2,0,0,0,0|2,0,0]=4 402 B23R2.27973 C[C@H](CNC(=O)C1CCCCN1C(=O)CO)c2ccccc2 LN00002762_AK00506_SB2706 [0,2,0,0,0,0|1,0,0]=3 403 B23R2.27973 C[C@H](CNC(=O)C1COCCN1C(=O)CO)c2ccccc2 LN00010971_AK00506_SB2706 [0,2,0,0,0,0|2,0,0]=4 404 B23R2.27973 C[C@H](CNC(=O)C1CSCCN1C(=O)CO)c2ccccc2 LN00200726_AK00506_SB2706 [0,2,0,0,0,0|2,0,0]=4 405 B23R2.27973 C[C@H](CNC(=O)[C@@H]1COCCN1C(=O)CO)c2ccccc2 LN00174413_AK00506_SB2706 [0,2,0,0,0,0|2,0,0]=4 406 B23R2.27973 O=C(NCC(O)c1ccccc1)C2CCCCN2C(=O)CO LN00002762_AK0051_SB2706 [0,2,0,0,0,0|1,0,0]=3 407 B23R2.27973 O=C(NCC(O)c1ccccc1)C2COCCN2C(=O)CO LN00010971_AK0051_SB2706 [0,2,0,0,0,0|2,0,0]=4 408 B23R2.27973 O=C(NCC(O)c1ccccc1)C2CSCCN2C(=O)CO LN00200726_AK0051_SB2706 [0,2,0,0,0,0|2,0,0]=4 409 B23R2.27973 O=C(NCC(O)c1ccccc1)[C@@H]2COCCN2C(=O)CO LN00174413_AK0051_SB2706 [0,2,0,0,0,0|2,0,0]=4 410 B23R2.174231 CC(=O)N1CCCCC1C(=O)NCC(O)c2cccc(c2)O LN00002762_AK00484_SB0150 [0,2,0,0,0,0|2,0,0]=4 411 B23R2.182703 CC(=O)N1CC[C@H](C[C@H]1C(=O)NCC(C)c2ccccc2)O LN00156667_AK00546_SB0150 [0,2,0,0,0,0|2,0,0]=4 412 B23R2.182703 CC(=O)N1CC[C@H](C[C@H]1C(=O)NCC(O)c2ccccc2)O LN00156667_AK0051_SB0150 [0,2,0,0,0,0|2,0,0]=4 413 B23R2.182703 CC(=O)N1CC[C@H](C[C@H]1C(=O)NC[C@@H](C)c2ccccc2)O LN00156667_AK00506_SB0150 [0,2,0,0,0,0|2,0,0]=4 414 B23R2.475325 CC(=O)N1CCCCC1C(=O)NCC(C)(O)c2ccccc2 LN00002762_AK0159_SB0150 [0,2,0,0,0,0|2,0,0]=4 415 B23R2.714939 CC(=O)N1CCCCC1C(=O)NCC(O)c2ccc(cc2)O LN00002762_AK00470_SB0150 [0,2,0,0,0,0|2,0,0]=4 416 B23R2.94206 COc1cccc(c1)CCNC(=O)C2CCCCN2C(=O)C LN00002762_AK0065_SB0150 [0,2,0,0,0,0|2,0,0]=4 417 B23R2.158114 CC(=O)N1CCCCC1C(=O)NCCc2cc(cc(c2)Cl)Cl LN00002762_AK2851_SB0150 [0,2,0,0,0,0|2,0,0]=4 418 B23R2.174192 CC(=O)N1CC[C@H](C[C@H]1C(=O)NCCc2cccc(c2)Br)O LN00156667_AK0800_SB0150 [0,2,0,0,0,0|2,0,0]=4 419 B23R2.174192 CC(=O)N1CC[C@H](C[C@H]1C(=O)NCCc2cccc(c2)C)O LN00156667_AK8219_SB0150 [0,2,0,0,0,0|2,0,0]=4 420 B23R2.174192 CC(=O)N1CC[C@H](C[C@H]1C(=O)NCCc2cccc(c2)Cl)O LN00156667_AK0776_SB0150 [0,2,0,0,0,0|2,0,0]=4 421 B23R2.174192 CC(=O)N1CC[C@H](C[C@H]1C(=O)NCCc2cccc(c2)F)O LN00156667_AK0117_SB0150 [0,2,0,0,0,0|2,0,0]=4 422 B23R2.174192 CC(=O)N1CC[C@H](C[C@H]1C(=O)NCCc2cccc(c2)O)O LN00156667_AK00421_SB0150 [0,2,0,0,0,0|2,0,0]=4 423 B23R2.182679 CC(=O)N1CCCCC1C(=O)NCCc2cc(ccc2Cl)Cl LN00002762_AK0419_SB0150 [0,2,0,0,0,0|2,0,0]=4 424 B23R2.720949 CC(=O)N1CCCCC1C(=O)NCCc2ccc(c(c2)C)C LN00002762_AK0924_SB0150 [0,2,0,0,0,0|2,0,0]=4 425 B23R2.720949 CC(=O)N1CCCCC1C(=O)NCCc2ccc(c(c2)Cl)Cl LN00002762_AK0874_SB0150 [0,2,0,0,0,0|2,0,0]=4 426 B23R2.720949 CC(=O)N1CCCCC1C(=O)NCCc2ccc(c(c2)O)O LN00002762_AK00493_SB0150 [0,2,0,0,0,0|2,0,0]=4 427 B23R2.763304 C#CC(=O)N1CCCCC1C(=O)NCCc2cccc(c2)Br LN00002762_AK0800_SB0338 [0,2,0,0,0,0|2,0,0]=4 428 B23R2.763304 C#CC(=O)N1CCCCC1C(=O)NCCc2cccc(c2)C LN00002762_AK8219_SB0338 [0,2,0,0,0,0|2,0,0]=4 429 B23R2.763304 C#CC(=O)N1CCCCC1C(=O)NCCc2cccc(c2)Cl LN00002762_AK0776_SB0338 [0,2,0,0,0,0|2,0,0]=4 430 B23R2.763304 C#CC(=O)N1CCCCC1C(=O)NCCc2cccc(c2)F LN00002762_AK0117_SB0338 [0,2,0,0,0,0|2,0,0]=4 431 B23R2.763304 C#CC(=O)N1CCCCC1C(=O)NCCc2cccc(c2)O LN00002762_AK00421_SB0338 [0,2,0,0,0,0|2,0,0]=4 432 B23R2.763304 CCC(=O)N1CCCCC1C(=O)NCCc2cccc(c2)Br LN00002762_AK0800_SB0064 [0,2,0,0,0,0|2,0,0]=4 433 B23R2.763304 CCC(=O)N1CCCCC1C(=O)NCCc2cccc(c2)C LN00002762_AK8219_SB0064 [0,2,0,0,0,0|2,0,0]=4 434 B23R2.763304 CCC(=O)N1CCCCC1C(=O)NCCc2cccc(c2)Cl LN00002762_AK0776_SB0064 [0,2,0,0,0,0|2,0,0]=4 435 B23R2.763304 CCC(=O)N1CCCCC1C(=O)NCCc2cccc(c2)F LN00002762_AK0117_SB0064 [0,2,0,0,0,0|2,0,0]=4 436 B23R2.763304 CCC(=O)N1CCCCC1C(=O)NCCc2cccc(c2)O LN00002762_AK00421_SB0064 [0,2,0,0,0,0|2,0,0]=4 437 B23R2.763304 Cc1cccc(c1)CCNC(=O)C2CCCCN2C(=O)CO LN00002762_AK8219_SB2706 [0,2,0,0,0,0|1,0,0]=3 438 B23R2.763304 Cc1cccc(c1)CCNC(=O)C2COCCN2C(=O)CO LN00010971_AK8219_SB2706 [0,2,0,0,0,0|2,0,0]=4 439 B23R2.763304 Cc1cccc(c1)CCNC(=O)C2CSCCN2C(=O)CO LN00200726_AK8219_SB2706 [0,2,0,0,0,0|2,0,0]=4 440 B23R2.763304 Cc1cccc(c1)CCNC(=O)[C@@H]2COCCN2C(=O)CO LN00174413_AK8219_SB2706 [0,2,0,0,0,0|2,0,0]=4 441 B23R2.763304 O=C(NCCc1cccc(c1)Br)C2CCCCN2C(=O)CO LN00002762_AK0800_SB2706 [0,2,0,0,0,0|1,0,0]=3 442 B23R2.763304 O=C(NCCc1cccc(c1)Br)C2COCCN2C(=O)CO LN00010971_AK0800_SB2706 [0,2,0,0,0,0|2,0,0]=4 443 B23R2.763304 O=C(NCCc1cccc(c1)Br)C2CSCCN2C(=O)CO LN00200726_AK0800_SB2706 [0,2,0,0,0,0|2,0,0]=4 444 B23R2.763304 O=C(NCCc1cccc(c1)Br)[C@@H]2COCCN2C(=O)CO LN00174413_AK0800_SB2706 [0,2,0,0,0,0|2,0,0]=4 445 B23R2.763304 O=C(NCCc1cccc(c1)Cl)C2CCCCN2C(=O)CO LN00002762_AK0776_SB2706 [0,2,0,0,0,0|1,0,0]=3 446 B23R2.763304 O=C(NCCc1cccc(c1)Cl)C2COCCN2C(=O)CO LN00010971_AK0776_SB2706 [0,2,0,0,0,0|2,0,0]=4 447 B23R2.763304 O=C(NCCc1cccc(c1)Cl)C2CSCCN2C(=O)CO LN00200726_AK0776_SB2706 [0,2,0,0,0,0|2,0,0]=4 448 B23R2.763304 O=C(NCCc1cccc(c1)Cl)[C@@H]2COCCN2C(=O)CO LN00174413_AK0776_SB2706 [0,2,0,0,0,0|2,0,0]=4 449 B23R2.763304 O=C(NCCc1cccc(c1)F)C2CCCCN2C(=O)CO LN00002762_AK0117_SB2706 [0,2,0,0,0,0|1,0,0]=3 450 B23R2.763304 O=C(NCCc1cccc(c1)F)C2COCCN2C(=O)CO LN00010971_AK0117_SB2706 [0,2,0,0,0,0|2,0,0]=4 451 B23R2.763304 O=C(NCCc1cccc(c1)F)C2CSCCN2C(=O)CO LN00200726_AK0117_SB2706 [0,2,0,0,0,0|2,0,0]=4 452 B23R2.763304 O=C(NCCc1cccc(c1)F)[C@@H]2COCCN2C(=O)CO LN00174413_AK0117_SB2706 [0,2,0,0,0,0|2,0,0]=4 453 B23R2.763304 O=C(NCCc1cccc(c1)O)C2CCCCN2C(=O)CO LN00002762_AK00421_SB2706 [0,2,0,0,0,0|1,0,0]=3 454 B23R2.763304 O=C(NCCc1cccc(c1)O)C2COCCN2C(=O)CO LN00010971_AK00421_SB2706 [0,2,0,0,0,0|2,0,0]=4 455 B23R2.763304 O=C(NCCc1cccc(c1)O)C2CSCCN2C(=O)CO LN00200726_AK00421_SB2706 [0,2,0,0,0,0|2,0,0]=4 456 B23R2.763304 O=C(NCCc1cccc(c1)O)[C@@H]2COCCN2C(=O)CO LN00174413_AK00421_SB2706 [0,2,0,0,0,0|2,0,0]=4 457 B23R2.8245171 CC(=O)N1CCCCC1C(=O)NC(C)Cc2cccc(c2)Br LN00002762_AK4310_SB0150 [0,2,0,0,0,0|2,0,0]=4 458 B23R2.104165 COc1ccccc1CCNC(=O)C2CCCCN2C(=O)C LN00002762_AK00321_SB0150 [0,2,0,0,0,0|2,0,0]=4 459 B23R2.183407 CC(=O)N1CC[C@H](C[C@H]1C(=O)NCCc2ccccc2Br)O LN00156667_AK0778_SB0150 [0,2,0,0,0,0|2,0,0]=4 460 B23R2.183407 CC(=O)N1CC[C@H](C[C@H]1C(=O)NCCc2ccccc2C)O LN00156667_AK0254_SB0150 [0,2,0,0,0,0|2,0,0]=4 461 B23R2.183407 CC(=O)N1CC[C@H](C[C@H]1C(=O)NCCc2ccccc2Cl)O LN00156667_AK0715_SB0150 [0,2,0,0,0,0|2,0,0]=4 462 B23R2.183407 CC(=O)N1CC[C@H](C[C@H]1C(=O)NCCc2ccccc2F)O LN00156667_AK0118_SB0150 [0,2,0,0,0,0|2,0,0]=4 463 B23R2.183407 CC(=O)N1CC[C@H](C[C@H]1C(=O)NCCc2ccccc2O)O LN00156667_AK2884_SB0150 [0,2,0,0,0,0|2,0,0]=4 464 B23R2.392872 CC(=O)N1CCCCC1C(=O)NCCc2c(cccc2Cl)Cl LN00002762_AK0905_SB0150 [0,2,0,0,0,0|2,0,0]=4 465 B23R2.392872 CC(=O)N1CCCCC1C(=O)NCCc2c(cccc2Cl)F LN00002762_AK0192_SB0150 [0,2,0,0,0,0|2,0,0]=4 466 B23R2.5166027 CC(=O)N1CCCCC1C(=O)NCCc2ccc(cc2Cl)Cl LN00002762_AK0889_SB0150 [0,2,0,0,0,0|2,0,0]=4 467 B23R2.5166027 CC(=O)N1CCCCC1C(=O)NCCc2ccc(cc2F)F LN00002762_AK3943_SB0150 [0,2,0,0,0,0|2,0,0]=4 468 B23R2.12190825 C#CC(=O)N1CCCCC1C(=O)NCCc2ccccc2Br LN00002762_AK0778_SB0338 [0,2,0,0,0,0|2,0,0]=4 469 B23R2.12190825 C#CC(=O)N1CCCCC1C(=O)NCCc2ccccc2C LN00002762_AK0254_SB0338 [0,2,0,0,0,0|2,0,0]=4 470 B23R2.12190825 C#CC(=O)N1CCCCC1C(=O)NCCc2ccccc2Cl LN00002762_AK0715_SB0338 [0,2,0,0,0,0|2,0,0]=4 471 B23R2.12190825 C#CC(=O)N1CCCCC1C(=O)NCCc2ccccc2F LN00002762_AK0118_SB0338 [0,2,0,0,0,0|2,0,0]=4 472 B23R2.12190825 C#CC(=O)N1CCCCC1C(=O)NCCc2ccccc2O LN00002762_AK2884_SB0338 [0,2,0,0,0,0|2,0,0]=4 473 B23R2.12190825 CCC(=O)N1CCCCC1C(=O)NCCc2ccccc2Br LN00002762_AK0778_SB0064 [0,2,0,0,0,0|2,0,0]=4 474 B23R2.12190825 CCC(=O)N1CCCCC1C(=O)NCCc2ccccc2C LN00002762_AK0254_SB0064 [0,2,0,0,0,0|2,0,0]=4 475 B23R2.12190825 CCC(=O)N1CCCCC1C(=O)NCCc2ccccc2Cl LN00002762_AK0715_SB0064 [0,2,0,0,0,0|2,0,0]=4 476 B23R2.12190825 CCC(=O)N1CCCCC1C(=O)NCCc2ccccc2F LN00002762_AK0118_SB0064 [0,2,0,0,0,0|2,0,0]=4 477 B23R2.12190825 CCC(=O)N1CCCCC1C(=O)NCCc2ccccc2O LN00002762_AK2884_SB0064 [0,2,0,0,0,0|2,0,0]=4 478 B23R2.12190825 Cc1ccccc1CCNC(=O)C2CCCCN2C(=O)CO LN00002762_AK0254_SB2706 [0,2,0,0,0,0|1,0,0]=3 479 B23R2.12190825 Cc1ccccc1CCNC(=O)C2COCCN2C(=O)CO LN00010971_AK0254_SB2706 [0,2,0,0,0,0|2,0,0]=4 480 B23R2.12190825 Cc1ccccc1CCNC(=O)C2CSCCN2C(=O)CO LN00200726_AK0254_SB2706 [0,2,0,0,0,0|2,0,0]=4 481 B23R2.12190825 Cc1ccccc1CCNC(=O)[C@@H]2COCCN2C(=O)CO LN00174413_AK0254_SB2706 [0,2,0,0,0,0|2,0,0]=4 482 B23R2.12190825 O=C(NCCc1ccccc1Br)C2CCCCN2C(=O)CO LN00002762_AK0778_SB2706 [0,2,0,0,0,0|1,0,0]=3 483 B23R2.12190825 O=C(NCCc1ccccc1Br)C2COCCN2C(=O)CO LN00010971_AK0778_SB2706 [0,2,0,0,0,0|2,0,0]=4 484 B23R2.12190825 O=C(NCCc1ccccc1Br)C2CSCCN2C(=O)CO LN00200726_AK0778_SB2706 [0,2,0,0,0,0|2,0,0]=4 485 B23R2.12190825 O=C(NCCc1ccccc1Br)[C@@H]2COCCN2C(=O)CO LN00174413_AK0778_SB2706 [0,2,0,0,0,0|2,0,0]=4 486 B23R2.12190825 O=C(NCCc1ccccc1Cl)C2CCCCN2C(=O)CO LN00002762_AK0715_SB2706 [0,2,0,0,0,0|1,0,0]=3 487 B23R2.12190825 O=C(NCCc1ccccc1Cl)C2COCCN2C(=O)CO LN00010971_AK0715_SB2706 [0,2,0,0,0,0|2,0,0]=4 488 B23R2.12190825 O=C(NCCc1ccccc1Cl)C2CSCCN2C(=O)CO LN00200726_AK0715_SB2706 [0,2,0,0,0,0|2,0,0]=4 489 B23R2.12190825 O=C(NCCc1ccccc1Cl)[C@@H]2COCCN2C(=O)CO LN00174413_AK0715_SB2706 [0,2,0,0,0,0|2,0,0]=4 490 B23R2.12190825 O=C(NCCc1ccccc1F)C2CCCCN2C(=O)CO LN00002762_AK0118_SB2706 [0,2,0,0,0,0|1,0,0]=3 491 B23R2.12190825 O=C(NCCc1ccccc1F)C2COCCN2C(=O)CO LN00010971_AK0118_SB2706 [0,2,0,0,0,0|2,0,0]=4 492 B23R2.12190825 O=C(NCCc1ccccc1F)C2CSCCN2C(=O)CO LN00200726_AK0118_SB2706 [0,2,0,0,0,0|2,0,0]=4 493 B23R2.12190825 O=C(NCCc1ccccc1F)[C@@H]2COCCN2C(=O)CO LN00174413_AK0118_SB2706 [0,2,0,0,0,0|2,0,0]=4 494 B23R2.12190825 O=C(NCCc1ccccc1O)C2CCCCN2C(=O)CO LN00002762_AK2884_SB2706 [0,2,0,0,0,0|1,0,0]=3 495 B23R2.12190825 O=C(NCCc1ccccc1O)C2COCCN2C(=O)CO LN00010971_AK2884_SB2706 [0,2,0,0,0,0|2,0,0]=4 496 B23R2.12190825 O=C(NCCc1ccccc1O)C2CSCCN2C(=O)CO LN00200726_AK2884_SB2706 [0,2,0,0,0,0|2,0,0]=4 497 B23R2.12190825 O=C(NCCc1ccccc1O)[C@@H]2COCCN2C(=O)CO LN00174413_AK2884_SB2706 [0,2,0,0,0,0|2,0,0]=4 498 B23R2.714580 CC(=O)N1CC[C@H](C[C@H]1C(=O)NCCc2ccc(cc2)Br)O LN00156667_AK0745_SB0150 [0,2,0,0,0,0|2,0,0]=4 499 B23R2.714580 CC(=O)N1CC[C@H](C[C@H]1C(=O)NCCc2ccc(cc2)C)O LN00156667_AK0066_SB0150 [0,2,0,0,0,0|2,0,0]=4 500 B23R2.714580 CC(=O)N1CC[C@H](C[C@H]1C(=O)NCCc2ccc(cc2)Cl)O LN00156667_AK1369_SB0150 [0,2,0,0,0,0|2,0,0]=4 501 B23R2.714580 CC(=O)N1CC[C@H](C[C@H]1C(=O)NCCc2ccc(cc2)F)O LN00156667_AK0123_SB0150 [0,2,0,0,0,0|2,0,0]=4 502 B23R2.714580 CC(=O)N1CC[C@H](C[C@H]1C(=O)NCCc2ccc(cc2)O)O LN00156667_AK0748_SB0150 [0,2,0,0,0,0|2,0,0]=4 503 B23R2.11901519 C#CC(=O)N1CC[C@H](C[C@H]1C(=O)NCCc2ccccc2)O LN00156667_AK00498_SB0338 [0,2,0,0,0,0|2,0,0]=4 504 B23R2.11901519 CCC(=O)N1CC[C@H](C[C@H]1C(=O)NCCc2ccccc2)O LN00156667_AK00498_SB0064 [0,2,0,0,0,0|2,0,0]=4 505 B23R2.11901519 O=C(NCCc1ccccc1)[C@@H]2C[C@@H](CCN2C(=O)CO)O LN00156667_AK00498_SB2706 [0,2,0,0,0,0|1,0,0]=3 506 B23R2.11901519 O=C(NCCc1ccccn1)[C@@H]2C[C@@H](CCN2C(=O)CO)O LN00156667_AK0019_SB2706 [0,2,0,0,0,0|2,0,0]=4 507 B23R2.11901519 O=C(NCCc1cccnc1)[C@@H]2C[C@@H](CCN2C(=O)CO)O LN00156667_AK00436_SB2706 [0,2,0,0,0,0|2,0,0]=4 508 B23R2.11901519 O=C(NCCc1ccncc1)[C@@H]2C[C@@H](CCN2C(=O)CO)O LN00156667_AK0093_SB2706 [0,2,0,0,0,0|2,0,0]=4 509 B23R2.566810 CC(=O)N1CCCCC1C(=O)N[C@H](CO)Cc2ccccc2 LN00002762_AK00517_SB0150 [0,2,0,0,0,0|2,0,0]=4 510 B23R2.7946 COc1ccc(cc1)CCNC(=O)C2CCCCN2C(=O)C LN00002762_AK2321_SB0150 [0,2,0,0,0,0|2,0,0]=4 511 B23R2.737259 C#CC(=O)N1CCCCC1C(=O)NCCc2ccc(cc2)Br LN00002762_AK0745_SB0338 [0,2,0,0,0,0|2,0,0]=4 512 B23R2.737259 C#CC(=O)N1CCCCC1C(=O)NCCc2ccc(cc2)C LN00002762_AK0066_SB0338 [0,2,0,0,0,0|2,0,0]=4 513 B23R2.737259 C#CC(=O)N1CCCCC1C(=O)NCCc2ccc(cc2)Cl LN00002762_AK1369_SB0338 [0,2,0,0,0,0|2,0,0]=4 514 B23R2.737259 C#CC(=O)N1CCCCC1C(=O)NCCc2ccc(cc2)F LN00002762_AK0123_SB0338 [0,2,0,0,0,0|2,0,0]=4 515 B23R2.737259 C#CC(=O)N1CCCCC1C(=O)NCCc2ccc(cc2)O LN00002762_AK0748_SB0338 [0,2,0,0,0,0|2,0,0]=4 516 B23R2.737259 CCC(=O)N1CCCCC1C(=O)NCCc2ccc(cc2)Br LN00002762_AK0745_SB0064 [0,2,0,0,0,0|2,0,0]=4 517 B23R2.737259 CCC(=O)N1CCCCC1C(=O)NCCc2ccc(cc2)C LN00002762_AK0066_SB0064 [0,2,0,0,0,0|2,0,0]=4 518 B23R2.737259 CCC(=O)N1CCCCC1C(=O)NCCc2ccc(cc2)Cl LN00002762_AK1369_SB0064 [0,2,0,0,0,0|2,0,0]=4 519 B23R2.737259 CCC(=O)N1CCCCC1C(=O)NCCc2ccc(cc2)F LN00002762_AK0123_SB0064 [0,2,0,0,0,0|2,0,0]=4 520 B23R2.737259 CCC(=O)N1CCCCC1C(=O)NCCc2ccc(cc2)O LN00002762_AK0748_SB0064 [0,2,0,0,0,0|2,0,0]=4 521 B23R2.737259 Cc1ccc(cc1)CCNC(=O)C2CCCCN2C(=O)CO LN00002762_AK0066_SB2706 [0,2,0,0,0,0|1,0,0]=3 522 B23R2.737259 Cc1ccc(cc1)CCNC(=O)C2COCCN2C(=O)CO LN00010971_AK0066_SB2706 [0,2,0,0,0,0|2,0,0]=4 523 B23R2.737259 Cc1ccc(cc1)CCNC(=O)C2CSCCN2C(=O)CO LN00200726_AK0066_SB2706 [0,2,0,0,0,0|2,0,0]=4 524 B23R2.737259 Cc1ccc(cc1)CCNC(=O)[C@@H]2COCCN2C(=O)CO LN00174413_AK0066_SB2706 [0,2,0,0,0,0|2,0,0]=4 525 B23R2.737259 O=C(NCCc1ccc(cc1)Br)C2CCCCN2C(=O)CO LN00002762_AK0745_SB2706 [0,2,0,0,0,0|1,0,0]=3 526 B23R2.737259 O=C(NCCc1ccc(cc1)Br)C2COCCN2C(=O)CO LN00010971_AK0745_SB2706 [0,2,0,0,0,0|2,0,0]=4 527 B23R2.737259 O=C(NCCc1ccc(cc1)Br)C2CSCCN2C(=O)CO LN00200726_AK0745_SB2706 [0,2,0,0,0,0|2,0,0]=4 528 B23R2.737259 O=C(NCCc1ccc(cc1)Br)[C@@H]2COCCN2C(=O)CO LN00174413_AK0745_SB2706 [0,2,0,0,0,0|2,0,0]=4 529 B23R2.737259 O=C(NCCc1ccc(cc1)Cl)C2CCCCN2C(=O)CO LN00002762_AK1369_SB2706 [0,2,0,0,0,0|1,0,0]=3 530 B23R2.737259 O=C(NCCc1ccc(cc1)Cl)C2COCCN2C(=O)CO LN00010971_AK1369_SB2706 [0,2,0,0,0,0|2,0,0]=4 531 B23R2.737259 O=C(NCCc1ccc(cc1)Cl)C2CSCCN2C(=O)CO LN00200726_AK1369_SB2706 [0,2,0,0,0,0|2,0,0]=4 532 B23R2.737259 O=C(NCCc1ccc(cc1)Cl)[C@@H]2COCCN2C(=O)CO LN00174413_AK1369_SB2706 [0,2,0,0,0,0|2,0,0]=4 533 B23R2.737259 O=C(NCCc1ccc(cc1)F)C2CCCCN2C(=O)CO LN00002762_AK0123_SB2706 [0,2,0,0,0,0|1,0,0]=3 534 B23R2.737259 O=C(NCCc1ccc(cc1)F)C2COCCN2C(=O)CO LN00010971_AK0123_SB2706 [0,2,0,0,0,0|2,0,0]=4 535 B23R2.737259 O=C(NCCc1ccc(cc1)F)C2CSCCN2C(=O)CO LN00200726_AK0123_SB2706 [0,2,0,0,0,0|2,0,0]=4 536 B23R2.737259 O=C(NCCc1ccc(cc1)F)[C@@H]2COCCN2C(=O)CO LN00174413_AK0123_SB2706 [0,2,0,0,0,0|2,0,0]=4 537 B23R2.737259 O=C(NCCc1ccc(cc1)O)C2CCCCN2C(=O)CO LN00002762_AK0748_SB2706 [0,2,0,0,0,0|1,0,0]=3 538 B23R2.737259 O=C(NCCc1ccc(cc1)O)C2COCCN2C(=O)CO LN00010971_AK0748_SB2706 [0,2,0,0,0,0|2,0,0]=4 539 B23R2.737259 O=C(NCCc1ccc(cc1)O)C2CSCCN2C(=O)CO LN00200726_AK0748_SB2706 [0,2,0,0,0,0|2,0,0]=4 540 B23R2.737259 O=C(NCCc1ccc(cc1)O)[C@@H]2COCCN2C(=O)CO LN00174413_AK0748_SB2706 [0,2,0,0,0,0|2,0,0]=4 541 B23R2.617746 C#CCC(=O)N1CCCCC1C(=O)NCCc2ccccc2 LN00002762_AK00498_SB3070 [0,2,0,0,0,0|2,0,0]=4 542 B23R2.617746 C/C=C/C(=O)N1CCCCC1C(=O)NCCc2ccccc2 LN00002762_AK00498_SB0340 [0,2,0,0,0,0|2,0,0]=4 543 B23R2.617746 C=CCC(=O)N1CCCCC1C(=O)NCCc2ccccc2 LN00002762_AK00498_SB2732 [0,2,0,0,0,0|2,0,0]=4 544 B23R2.617746 CC#CC(=O)N1CCCCC1C(=O)NCCc2ccccc2 LN00002762_AK00498_SB1240 [0,2,0,0,0,0|2,0,0]=4 545 B23R2.617746 CCCC(=O)N1CCCCC1C(=O)NCCc2ccccc2 LN00002762_AK00498_SB0073 [0,2,0,0,0,0|2,0,0]=4 546 B23R2.617746 COCC(=O)N1CCCCC1C(=O)NCCc2ccccc2 LN00002762_AK00498_SB0090 [0,2,0,0,0,0|1,0,0]=3 547 B23R2.617746 COCC(=O)N1CCCCC1C(=O)NCCc2ccccn2 LN00002762_AK0019_SB0090 [0,2,0,0,0,0|2,0,0]=4 548 B23R2.617746 COCC(=O)N1CCCCC1C(=O)NCCc2cccnc2 LN00002762_AK00436_SB0090 [0,2,0,0,0,0|2,0,0]=4 549 B23R2.617746 COCC(=O)N1CCCCC1C(=O)NCCc2ccncc2 LN00002762_AK0093_SB0090 [0,2,0,0,0,0|2,0,0]=4 550 B23R2.617746 COCC(=O)N1CCOCC1C(=O)NCCc2ccccc2 LN00010971_AK00498_SB0090 [0,2,0,0,0,0|2,0,0]=4 551 B23R2.617746 COCC(=O)N1CCOC[C@H]1C(=O)NCCc2ccccc2 LN00174413_AK00498_SB0090 [0,2,0,0,0,0|2,0,0]=4 552 B23R2.617746 COCC(=O)N1CCSCC1C(=O)NCCc2ccccc2 LN00200726_AK00498_SB0090 [0,2,0,0,0,0|2,0,0]=4 553 B23R2.617746 CSCC(=O)N1CCCCC1C(=O)NCCc2ccccc2 LN00002762_AK00498_SB1267 [0,2,0,0,0,0|1,1,0]=4 554 B23R2.617746 N#CCC(=O)N1CCCCC1C(=O)NCCc2ccccc2 LN00002762_AK00498_SB0057 [0,2,0,0,0,0|2,0,0]=4 555 B21R2.256097 CC(=O)N1CCCC1CC(=O)NCCc2ccccc2 LN00167386_AK00498_SB0150 [0,0,1,1,0,0|2,0,0]=4 556 B21R2.256097 CC(=O)N1CCC[C@@H]1CC(=O)NCCc2ccccc2 LN00204181_AK00498_SB0150 [0,0,1,1,0,0|2,0,0]=4 557 B21R2.257290 CC(=O)N[C@@H]1CCC[C@@H]1C(=O)NCCc2ccccc2 LN00144702_AK00498_SB0150 [0,0,1,1,0,0|2,0,0]=4 558 B21R2.257290 CC(=O)N[C@@H]1CCC[C@H]1C(=O)NCCc2ccccc2 LN00144604_AK00498_SB0150 [0,0,1,1,0,0|2,0,0]=4 559 B21R3.7851241 CC(=O)N1[C@@H](C[C@@H]2[C@@H]1C2)C(=O)NCc3ccccc3 LN00001750_AK00502_SB0150 [0,0,0,1,1,0|2,0,0]=4 560 B21R3.7851241 CC(=O)N1[C@@H](C[C@H]2[C@H]1C2)C(=O)NCc3ccccc3 LN01276741_AK00502_SB0150 [0,0,0,1,1,0|2,0,0]=4 561 B21R3.7851241 CC(=O)N1[C@H]2C[C@@H]2C[C@@H]1C(=O)NCc3ccccc3 LN02186583_AK00502_SB0150 [0,0,0,1,1,0|2,0,0]=4 562 B21R3.7851241 CC(=O)N1[C@H]2C[C@H]2C[C@@H]1C(=O)NCc3ccccc3 LN03203809_AK00502_SB0150 [0,0,0,1,1,0|2,0,0]=4 563 B21R3.7942360 NC(=O)[C@@H]1C[C@@H]2C[C@H]2N1C(=O)CCc3ccccc3 LN01276741_AK0084_SB0067 [0,0,0,1,1,0|2,0,0]=4 564 B21R3.7942360 NC(=O)[C@@H]1C[C@H]2C[C@@H]2N1C(=O)CCc3ccccc3 LN00001750_AK0084_SB0067 [0,0,0,1,1,0|2,0,0]=4 565 B21R3.7942360 NC(=O)[C@H]1C[C@@H]2C[C@@H]2N1C(=O)CCc3ccccc3 LN03203809_AK0084_SB0067 [0,0,0,1,1,0|2,0,0]=4 566 B21R3.7942360 NC(=O)[C@H]1C[C@H]2C[C@@H]2N1C(=O)CCc3ccccc3 LN02186583_AK0084_SB0067 [0,0,0,1,1,0|2,0,0]=4 567 B23R3.50477 CC(=O)N1CCCCC1C(=O)NC2CCc3c2cccc3 LN00002762_AK1156_SB0150 [0,0,0,1,0,1|2,0,0]=4 568 B23R3.50477 CC(=O)N1CCCCC1C(=O)NC2COc3c2cccc3 LN00002762_AK2368_SB0150 [0,0,0,1,0,1|2,0,0]=4 569 B23R3.50477 CC(=O)N1CCCCC1C(=O)N[C@H]2CCc3c2cccc3 LN00002762_AK00474_SB0150 [0,0,0,1,0,1|2,0,0]=4 570 B23R3.930100 CC(=O)N1CCCCC1C(=O)N2CCC2c3ccccc3 LN00002762_AN3661_SB0150 [0,0,0,1,0,1|2,0,0]=4 571 B23R3.148807135 CC(=O)N1[C@@H](C[C@@H]2[C@@H]1C2)C(=O)NCCCc3ccccc3 LN00001750_AK0074_SB0150 [0,0,0,1,0,1|2,0,0]=4 572 B23R3.148807135 CC(=O)N1[C@@H](C[C@@H]2[C@@H]1C2)C(=O)NCCOc3ccccc3 LN00001750_AK0103_SB0150 [0,0,0,1,0,1|2,0,0]=4 573 B23R3.148807135 CC(=O)N1[C@@H](C[C@H]2[C@H]1C2)C(=O)NCCCc3ccccc3 LN01276741_AK0074_SB0150 [0,0,0,1,0,1|2,0,0]=4 574 B23R3.148807135 CC(=O)N1[C@@H](C[C@H]2[C@H]1C2)C(=O)NCCOc3ccccc3 LN01276741_AK0103_SB0150 [0,0,0,1,0,1|2,0,0]=4 575 B23R3.148807135 CC(=O)N1[C@H]2C[C@@H]2C[C@@H]1C(=O)NCCCc3ccccc3 LN02186583_AK0074_SB0150 [0,0,0,1,0,1|2,0,0]=4 576 B23R3.148807135 CC(=O)N1[C@H]2C[C@@H]2C[C@@H]1C(=O)NCCOc3ccccc3 LN02186583_AK0103_SB0150 [0,0,0,1,0,1|2,0,0]=4 577 B23R3.148807135 CC(=O)N1[C@H]2C[C@H]2C[C@@H]1C(=O)NCCCc3ccccc3 LN03203809_AK0074_SB0150 [0,0,0,1,0,1|2,0,0]=4 578 B23R3.148807135 CC(=O)N1[C@H]2C[C@H]2C[C@@H]1C(=O)NCCOc3ccccc3 LN03203809_AK0103_SB0150 [0,0,0,1,0,1|2,0,0]=4 579 B23R3.50449 NC(=O)[C@H]1CCCC[C@H]1NC(=O)C2CCc3c2cccc3 LN00145068_AK0084_SB3073 [0,0,0,1,0,1|2,0,0]=4 580 B23R3.930389 NC(=O)[C@H]1CCCC[C@H]1NC(=O)C2CC2c3ccccc3 LN00145068_AK0084_SB2474 [0,0,0,1,0,1|2,0,0]=4 581 B23R3.930389 NC(=O)[C@H]1CCCC[C@H]1NC(=O)[C@@H]2C[C@H]2c3ccccc3 LN00145068_AK0084_SB3176 [0,0,0,1,0,1|2,0,0]=4 582 B23R3.930124 CC(=O)N1CCCCC1C(=O)N2CCc3ccccc3C2 LN00002762_AN00480_SB0150 [0,1,0,1,0,0|2,0,0]=4 583 B23R3.19090858 CC(=O)N1[C@@H](C[C@@H]2[C@@H]1C2)C(=O)NCC(C)c3ccccc3 LN00001750_AK00546_SB0150 [0,1,0,1,0,0|2,0,0]=4 584 B23R3.19090858 CC(=O)N1[C@@H](C[C@@H]2[C@@H]1C2)C(=O)NCC(O)c3ccccc3 LN00001750_AK0051_SB0150 [0,1,0,1,0,0|2,0,0]=4 585 B23R3.19090858 CC(=O)N1[C@@H](C[C@@H]2[C@@H]1C2)C(=O)NC[C@@H](C)c3ccccc3 LN00001750_AK00506_SB0150 [0,1,0,1,0,0|2,0,0]=4 586 B23R3.19090858 CC(=O)N1[C@@H](C[C@H]2[C@H]1C2)C(=O)NCC(C)c3ccccc3 LN01276741_AK00546_SB0150 [0,1,0,1,0,0|2,0,0]=4 587 B23R3.19090858 CC(=O)N1[C@@H](C[C@H]2[C@H]1C2)C(=O)NCC(O)c3ccccc3 LN01276741_AK0051_SB0150 [0,1,0,1,0,0|2,0,0]=4 588 B23R3.19090858 CC(=O)N1[C@@H](C[C@H]2[C@H]1C2)C(=O)NC[C@@H](C)c3ccccc3 LN01276741_AK00506_SB0150 [0,1,0,1,0,0|2,0,0]=4 589 B23R3.19090858 CC(=O)N1[C@H](C[C@H]2[C@H]1C2)C(=O)NCC(C)c3ccccc3 LN03203809_AK00546_SB0150 [0,1,0,1,0,0|2,0,0]=4 590 B23R3.19090858 CC(=O)N1[C@H](C[C@H]2[C@H]1C2)C(=O)NC[C@@H](C)c3ccccc3 LN03203809_AK00506_SB0150 [0,1,0,1,0,0|2,0,0]=4 591 B23R3.19090858 CC(=O)N1[C@H]2C[C@@H]2C[C@@H]1C(=O)NCC(C)c3ccccc3 LN02186583_AK00546_SB0150 [0,1,0,1,0,0|2,0,0]=4 592 B23R3.19090858 CC(=O)N1[C@H]2C[C@@H]2C[C@@H]1C(=O)NCC(O)c3ccccc3 LN02186583_AK0051_SB0150 [0,1,0,1,0,0|2,0,0]=4 593 B23R3.19090858 CC(=O)N1[C@H]2C[C@@H]2C[C@@H]1C(=O)NC[C@@H](C)c3ccccc3 LN02186583_AK00506_SB0150 [0,1,0,1,0,0|2,0,0]=4 594 B23R3.19090858 CC(=O)N1[C@H]2C[C@H]2C[C@@H]1C(=O)NCC(O)c3ccccc3 LN03203809_AK0051_SB0150 [0,1,0,1,0,0|2,0,0]=4 595 B23R3.73242117 CC(=O)N1[C@@H](C[C@@H]2[C@@H]1C2)C(=O)NCCc3cccc(c3)Br LN00001750_AK0800_SB0150 [0,1,0,1,0,0|2,0,0]=4 596 B23R3.73242117 CC(=O)N1[C@@H](C[C@@H]2[C@@H]1C2)C(=O)NCCc3cccc(c3)C LN00001750_AK8219_SB0150 [0,1,0,1,0,0|2,0,0]=4 597 B23R3.73242117 CC(=O)N1[C@@H](C[C@@H]2[C@@H]1C2)C(=O)NCCc3cccc(c3)Cl LN00001750_AK0776_SB0150 [0,1,0,1,0,0|2,0,0]=4 598 B23R3.73242117 CC(=O)N1[C@@H](C[C@@H]2[C@@H]1C2)C(=O)NCCc3cccc(c3)F LN00001750_AK0117_SB0150 [0,1,0,1,0,0|2,0,0]=4 599 B23R3.73242117 CC(=O)N1[C@@H](C[C@@H]2[C@@H]1C2)C(=O)NCCc3cccc(c3)O LN00001750_AK00421_SB0150 [0,1,0,1,0,0|2,0,0]=4 600 B23R3.73242117 CC(=O)N1[C@@H](C[C@H]2[C@H]1C2)C(=O)NCCc3cccc(c3)Br LN01276741_AK0800_SB0150 [0,1,0,1,0,0|2,0,0]=4 601 B23R3.73242117 CC(=O)N1[C@@H](C[C@H]2[C@H]1C2)C(=O)NCCc3cccc(c3)C LN01276741_AK8219_SB0150 [0,1,0,1,0,0|2,0,0]=4 602 B23R3.73242117 CC(=O)N1[C@@H](C[C@H]2[C@H]1C2)C(=O)NCCc3cccc(c3)Cl LN01276741_AK0776_SB0150 [0,1,0,1,0,0|2,0,0]=4 603 B23R3.73242117 CC(=O)N1[C@@H](C[C@H]2[C@H]1C2)C(=O)NCCc3cccc(c3)F LN01276741_AK0117_SB0150 [0,1,0,1,0,0|2,0,0]=4 604 B23R3.73242117 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CCC(=O)N1[C@H]2C[C@H]2C[C@@H]1C(=O)NCCc3ccccc3 LN03203809_AK00498_SB0064 [0,1,0,1,0,0|2,0,0]=4 664 B23R3.24778290 O=C(NCCc1ccccc1)[C@@H]2C[C@@H]3C[C@H]3N2C(=O)CO LN01276741_AK00498_SB2706 [0,1,0,1,0,0|1,0,0]=3 665 B23R3.24778290 O=C(NCCc1ccccc1)[C@@H]2C[C@H]3C[C@@H]3N2C(=O)CO LN00001750_AK00498_SB2706 [0,1,0,1,0,0|1,0,0]=3 666 B23R3.24778290 O=C(NCCc1ccccc1)[C@H]2C[C@@H]3C[C@@H]3N2C(=O)CO LN03203809_AK00498_SB2706 [0,1,0,1,0,0|1,0,0]=3 667 B23R3.24778290 O=C(NCCc1ccccc1)[C@H]2C[C@H]3C[C@@H]3N2C(=O)CO LN02186583_AK00498_SB2706 [0,1,0,1,0,0|1,0,0]=3 668 B23R3.24778290 O=C(NCCc1ccccn1)[C@@H]2C[C@@H]3C[C@H]3N2C(=O)CO LN01276741_AK0019_SB2706 [0,1,0,1,0,0|2,0,0]=4 669 B23R3.24778290 O=C(NCCc1ccccn1)[C@@H]2C[C@H]3C[C@@H]3N2C(=O)CO LN00001750_AK0019_SB2706 [0,1,0,1,0,0|2,0,0]=4 670 B23R3.24778290 O=C(NCCc1ccccn1)[C@H]2C[C@@H]3C[C@@H]3N2C(=O)CO LN03203809_AK0019_SB2706 [0,1,0,1,0,0|2,0,0]=4 671 B23R3.24778290 O=C(NCCc1ccccn1)[C@H]2C[C@H]3C[C@@H]3N2C(=O)CO LN02186583_AK0019_SB2706 [0,1,0,1,0,0|2,0,0]=4 672 B23R3.24778290 O=C(NCCc1cccnc1)[C@@H]2C[C@@H]3C[C@H]3N2C(=O)CO LN01276741_AK00436_SB2706 [0,1,0,1,0,0|2,0,0]=4 673 B23R3.24778290 O=C(NCCc1cccnc1)[C@@H]2C[C@H]3C[C@@H]3N2C(=O)CO LN00001750_AK00436_SB2706 [0,1,0,1,0,0|2,0,0]=4 674 B23R3.24778290 O=C(NCCc1cccnc1)[C@H]2C[C@@H]3C[C@@H]3N2C(=O)CO LN03203809_AK00436_SB2706 [0,1,0,1,0,0|2,0,0]=4 675 B23R3.24778290 O=C(NCCc1cccnc1)[C@H]2C[C@H]3C[C@@H]3N2C(=O)CO LN02186583_AK00436_SB2706 [0,1,0,1,0,0|2,0,0]=4 676 B23R3.24778290 O=C(NCCc1ccncc1)[C@@H]2C[C@@H]3C[C@H]3N2C(=O)CO LN01276741_AK0093_SB2706 [0,1,0,1,0,0|2,0,0]=4 677 B23R3.24778290 O=C(NCCc1ccncc1)[C@@H]2C[C@H]3C[C@@H]3N2C(=O)CO LN00001750_AK0093_SB2706 [0,1,0,1,0,0|2,0,0]=4 678 B23R3.24778290 O=C(NCCc1ccncc1)[C@H]2C[C@@H]3C[C@@H]3N2C(=O)CO LN03203809_AK0093_SB2706 [0,1,0,1,0,0|2,0,0]=4 679 B23R3.24778290 O=C(NCCc1ccncc1)[C@H]2C[C@H]3C[C@@H]3N2C(=O)CO LN02186583_AK0093_SB2706 [0,1,0,1,0,0|2,0,0]=4 680 B19R2.8825 CC(=O)N1CCCCC1C(=O)Nc2ccccc2 LN00002762_AG00183_SB0150 [0,0,0,0,2,0|2,0,0]=4 681 B19R2.8825 NC(=O)C1CCCCN1C(=O)Cc2ccccc2 LN00002762_AK0084_SB0092 [0,0,0,0,2,0|2,0,0]=4 682 B19R2.8883 CC(=O)N1CCCC1C(=O)NCc2ccccc2 LN00142236_AK00502_SB0150 [0,0,0,0,2,0|2,0,0]=4 683 B19R2.8883 CC(=O)N1CCC[C@@H]1C(=O)NCc2ccccc2 LN00008660_AK00502_SB0150 [0,0,0,0,2,0|2,0,0]=4 684 B19R2.8883 NC(=O)C1CCCN1C(=O)CCc2ccccc2 LN00142236_AK0084_SB0067 [0,0,0,0,2,0|2,0,0]=4 685 B19R2.8883 NC(=O)[C@H]1CCCN1C(=O)CCc2ccccc2 LN00008660_AK0084_SB0067 [0,0,0,0,2,0|2,0,0]=4 686 B19R2.112804 CC(=O)N1CCC1C(=O)NCCc2ccccc2 LN00223863_AK00498_SB0150 [0,0,0,0,2,0|2,0,0]=4 687 B19R2.112804 CC(=O)N1CC[C@@H]1C(=O)NCCc2ccccc2 LN00170742_AK00498_SB0150 [0,0,0,0,2,0|2,0,0]=4 688 B19R2.112804 CC(=O)N1CC[C@H]1C(=O)NCCc2ccccc2 LN00010329_AK00498_SB0150 [0,0,0,0,2,0|2,0,0]=4 689 B21R2.22510 CC(=O)N[C@@H]1CCCC[C@@H]1C(=O)NCc2ccccc2 LN00145068_AK00502_SB0150 [0,0,0,0,1,1|1,0,0]=3 690 B21R2.22510 CC(=O)N[C@@H]1CCCC[C@@H]1C(=O)NCc2ccccn2 LN00145068_AK0018_SB0150 [0,0,0,0,1,1|2,0,0]=4 691 B21R2.22510 CC(=O)N[C@@H]1CCCC[C@@H]1C(=O)NCc2cccnc2 LN00145068_AK0020_SB0150 [0,0,0,0,1,1|2,0,0]=4 692 B21R2.22510 CC(=O)N[C@@H]1CCCC[C@@H]1C(=O)NCc2ccncc2 LN00145068_AK0021_SB0150 [0,0,0,0,1,1|2,0,0]=4 693 B21R2.12990 CC(=O)N1CCCC(C1)C(=O)NCCc2ccccc2 LN00141827_AK00498_SB0150 [0,0,0,0,1,1|2,0,0]=4 694 B21R2.12990 CC(=O)N1CCC[C@@H](C1)C(=O)NCCc2ccccc2 LN00144816_AK00498_SB0150 [0,0,0,0,1,1|2,0,0]=4 695 B21R2.12990 CC(=O)N1CCC[C@H](C1)C(=O)NCCc2ccccc2 LN00008404_AK00498_SB0150 [0,0,0,0,1,1|2,0,0]=4 696 B21R2.257219 CC(=O)N1CCCC1C(=O)NCCCc2ccccc2 LN00142236_AK0074_SB0150 [0,0,0,0,1,1|2,0,0]=4 697 B21R2.257219 CC(=O)N1CCCC1C(=O)NCCOc2ccccc2 LN00142236_AK0103_SB0150 [0,0,0,0,1,1|2,0,0]=4 698 B21R2.257219 CC(=O)N1CCC[C@@H]1C(=O)NCCCc2ccccc2 LN00008660_AK0074_SB0150 [0,0,0,0,1,1|2,0,0]=4 699 B21R2.257219 CC(=O)N1CCC[C@@H]1C(=O)NCCOc2ccccc2 LN00008660_AK0103_SB0150 [0,0,0,0,1,1|2,0,0]=4 700 B21R2.401255 CC(=O)N[C@@H]1CCCC[C@@H]1C(=O)NCCc2ccco2 LN00145068_AK0989_SB0150 [0,0,0,0,1,1|2,0,0]=4 701 B21R2.401255 CC(=O)N[C@@H]1CCCC[C@@H]1C(=O)NCCc2cccs2 LN00145068_AK0098_SB0150 [0,0,0,0,1,1|2,0,0]=4 702 B21R2.401255 CC(=O)N[C@@H]1CCCC[C@@H]1C(=O)NCCc2ccsc2 LN00145068_AK1342_SB0150 [0,0,0,0,1,1|2,0,0]=4 703 B21R2.401255 CC(=O)N[C@@H]1CCCC[C@@H]1C(=O)NCCn2cccc2 LN00145068_AK1188_SB0150 [0,0,0,0,1,1|2,0,0]=4 704 B23R2.474955 CC(=O)N1CCCCC1C(=O)NCCCCc2ccccc2 LN00002762_AK00516_SB0150 [0,0,0,0,0,2|2,0,0]=4 705 B23R2.474955 CC(=O)N1CCCCC1C(=O)NCCCOc2ccccc2 LN00002762_AK2366_SB0150 [0,0,0,0,0,2|2,0,0]=4 706 B23R2.474955 CC(=O)N1CCCCC1C(=O)NCCOCc2ccccc2 LN00002762_AK1105_SB0150 [0,0,0,0,0,2|2,0,0]=4 707 B23R2.475111 NC(=O)[C@H]1CCCC[C@H]1NC(=O)CCCCc2ccccc2 LN00145068_AK0084_SB0460 [0,0,0,0,0,2|2,0,0]=4 708 B23R2.813547 CC(=O)N[C@@H]1CCCC[C@@H]1C(=O)NC/C=C/c2ccccc2 LN00145068_AK00073_SB0150 [0,0,0,0,0,2|1,0,1]=4 709 B23R2.813547 CC(=O)N[C@@H]1CCCC[C@@H]1C(=O)NCCCc2ccccc2 LN00145068_AK0074_SB0150 [0,0,0,0,0,2|1,0,0]=3 710 B23R2.813547 CC(=O)N[C@@H]1CCCC[C@@H]1C(=O)NCCCc2cccnc2 LN00145068_AK2339_SB0150 [0,0,0,0,0,2|2,0,0]=4 711 B23R2.813547 CC(=O)N[C@@H]1CCCC[C@@H]1C(=O)NCCCc2ccncc2 LN00145068_AK1251_SB0150 [0,0,0,0,0,2|2,0,0]=4 712 B23R2.813547 CC(=O)N[C@@H]1CCCC[C@@H]1C(=O)NCCOc2ccccc2 LN00145068_AK0103_SB0150 [0,0,0,0,0,2|1,0,0]=3 713 B23R2.813547 CC(=O)N[C@@H]1CCCC[C@@H]1C(=O)NCCOc2ccccn2 LN00145068_AK2654_SB0150 [0,0,0,0,0,2|2,0,0]=4 714 B23R2.813547 CC(=O)N[C@@H]1CCCC[C@@H]1C(=O)NCCOc2cccnc2 LN00145068_AK2245_SB0150 [0,0,0,0,0,2|2,0,0]=4 715 B23R2.813547 CC(=O)N[C@@H]1CCCC[C@@H]1C(=O)NCCOc2ccncc2 LN00145068_AK00818_SB0150 [0,0,0,0,0,2|2,0,0]=4