0 B14R1.419 CC(=O)/C=C/C1=CC=C(C=C1)N(=O)=O MCULE-5885063859 [0,0,0,0,0,0|1,0,2]=3 1 B14R1.419 CC(=O)/C=C/C1=CC=C(C=C1)N(C)C MCULE-6069295475 [0,0,0,0,0,0|3,0,1]=4 2 B14R1.419 CC(=O)C1=CC=C(C=C1)CCC(=O)O MCULE-6606465558 [0,0,0,0,0,0|2,0,2]=4 3 B14R1.419 CC(=O)C1=CC=C(C=C1)NCC(=O)O MCULE-6308989130 [0,0,0,0,0,0|3,0,1]=4 4 B14R1.419 CC(=O)C1=CC=C(C=C1)OCC(=O)O MCULE-1748099805 [0,0,0,0,0,0|3,0,1]=4 5 B14R1.419 CC(=O)C=CC1=CC=C(C=C1)N(C)C MCULE-7002972050 [0,0,0,0,0,0|3,0,1]=4 6 B14R1.419 CC(=O)C=CC1=CC=C(C=C1)[N+](=O)[O-] MCULE-8806924824 [0,0,0,0,0,0|1,0,0]=1 7 B14R1.419 CC(C)C1=CC=C(C=C1)/C=C/C(=O)Cl MCULE-5430772379 [0,0,0,0,0,0|4,0,0]=4 8 B14R1.419 CC(C)C1=CC=C(C=C1)/C=C/C(=O)O MCULE-9496807772 [0,0,0,0,0,0|3,0,0]=3 9 B14R1.419 CC(C)C1=CC=C(C=C1)C=CC(=O)Cl MCULE-4351535738 [0,0,0,0,0,0|4,0,0]=4 10 B14R1.419 CC(C)C1=CC=C(C=C1)C=CC(=O)O MCULE-2128812133 [0,0,0,0,0,0|3,0,0]=3 11 B14R1.419 CN(C)C1=CC=C(C=C1)/C=C/C(=O)O MCULE-2384930729 [0,0,0,0,0,0|2,0,1]=3 12 B14R1.419 CN(C)C1=CC=C(C=C1)C=CC(=O)N MCULE-1814537309 [0,0,0,0,0,0|3,0,1]=4 13 B14R1.419 CN(C)C1=CC=C(C=C1)C=CC(=O)O MCULE-1730398956 [0,0,0,0,0,0|2,0,1]=3 14 B14R1.419 CN(C)C1=CC=C(C=C1)C=CC(=O)O MCULE-7857746470 [0,0,0,0,0,0|2,0,1]=3 15 B14R1.419 CN(C)C=CC1=CC=C(C=C1)[N+](=O)[O-] MCULE-5091816603 [0,0,0,0,0,0|3,0,0]=3 16 B14R1.419 CN(C)N=CC1=CC=C(C=C1)[N+](=O)[O-] MCULE-4366993195 [0,0,0,0,0,0|4,0,0]=4 17 B14R1.419 CS(=O)C1=CC=C(C=C1)OCC(=O)O MCULE-4112594230 [0,0,0,0,0,0|3,0,1]=4 18 B14R1.419 NC(=O)C1=CC=C(C=C1)C=CC(=O)O MCULE-3221603484 [0,0,0,0,0,0|2,0,0]=2 19 B14R1.419 NC(=O)C1=CC=C(C=C1)CCC(=O)O MCULE-1942357944 [0,0,0,0,0,0|2,0,2]=4 20 B14R1.419 NC(=O)C1=CC=C(C=C1)NCC(=O)O MCULE-7853749088 [0,0,0,0,0,0|3,0,1]=4 21 B14R1.419 NC(=O)C1=CC=C(C=C1)OCC(=O)O MCULE-1220330631 [0,0,0,0,0,0|3,0,1]=4 22 B14R1.419 O=C(Cl)/C=C/C1=CC=C(C=C1)N(=O)=O MCULE-9680915919 [0,0,0,0,0,0|1,0,2]=3 23 B14R1.419 O=C(Cl)C=CC1=CC=C(C=C1)[N+](=O)[O-] MCULE-6021155359 [0,0,0,0,0,0|1,0,0]=1 24 B14R1.419 O=C(O)/C=C/C1=CC=C(C=C1)B(O)O MCULE-8951234096 [0,0,0,0,0,0|1,0,2]=3 25 B14R1.419 O=C(O)/C=C/C1=CC=C(C=C1)C(=O)O MCULE-1556557733 [0,0,0,0,0,0|1,0,1]=2 26 B14R1.419 O=C(O)/C=C/C1=CC=C(C=C1)N(=O)=O MCULE-1003929141 [0,0,0,0,0,0|0,0,2]=2 27 B14R1.419 O=C(O)C#CC1=CC=C(C=C1)C(=O)O MCULE-1712555337 [0,0,0,0,0,0|1,0,3]=4 28 B14R1.419 O=C(O)C#CC1=CC=C(C=C1)N(=O)=O MCULE-2828439530 [0,0,0,0,0,0|0,0,4]=4 29 B14R1.419 O=C(O)C1=CC=C(C=C1)C=C[N+](=O)[O-] MCULE-8480769528 [0,0,0,0,0,0|2,0,2]=4 30 B14R1.419 O=C(O)C=CC1=CC=C(C=C1)B(O)O MCULE-8243599413 [0,0,0,0,0,0|1,0,2]=3 31 B14R1.419 O=C(O)C=CC1=CC=C(C=C1)C(=O)O MCULE-8546356772 [0,0,0,0,0,0|1,0,1]=2 32 B14R1.419 O=C(O)C=CC1=CC=C(C=C1)C(F)F MCULE-4252789901 [0,0,0,0,0,0|3,0,0]=3 33 B14R1.419 O=C(O)C=CC1=CC=C(C=C1)[N+](=O)[O-] MCULE-9027320436 [0,0,0,0,0,0|0,0,0]=0 34 B14R1.419 O=C(O)CCC1=CC=C(C=C1)C(=O)O MCULE-9352979588 [0,0,0,0,0,0|1,0,3]=4 35 B14R1.419 O=C(O)CCC1=CC=C(C=C1)N(=O)=O MCULE-7564556532 [0,0,0,0,0,0|0,0,4]=4 36 B14R1.419 O=C(O)CNC1=CC=C(C=C1)C(=O)O MCULE-7640246804 [0,0,0,0,0,0|2,0,2]=4 37 B14R1.419 O=C(O)CNC1=CC=C(C=C1)C(=O)O MCULE-8996993209 [0,0,0,0,0,0|2,0,2]=4 38 B14R1.419 O=C(O)CNC1=CC=C(C=C1)N(=O)=O MCULE-3622411298 [0,0,0,0,0,0|1,0,3]=4 39 B14R1.419 O=C(O)COC1=CC=C(C=C1)C(=O)O MCULE-2855315257 [0,0,0,0,0,0|2,0,2]=4 40 B14R1.419 O=C(O)COC1=CC=C(C=C1)N(=O)=O MCULE-4354028178 [0,0,0,0,0,0|1,0,3]=4 41 B14R1.419 O=C(O)CSC1=CC=C(C=C1)N(=O)=O MCULE-4016627330 [0,0,0,0,0,0|1,0,3]=4 42 B14R1.419 O=N(=O)/C=C/C1=CC=C(C=C1)N(=O)=O MCULE-4423363200 [0,0,0,0,0,0|1,0,3]=4 43 B14R1.419 O=[N+]([O-])C=CC1=CC=C(C=C1)[N+](=O)[O-] MCULE-1340524704 [0,0,0,0,0,0|1,0,1]=2 44 B13R1.3 CC(=O)/C=C/C1=CC=C(C=C1)C=O MCULE-7052606082 [1,0,0,0,0,0|2,0,0]=3 45 B13R1.3 CC(=O)C=CC1=CC=C(C=C1)C=O MCULE-5147123485 [1,0,0,0,0,0|2,0,0]=3 46 B13R1.3 CCC1=CC=C(C=C1)/C=C/C(=O)O MCULE-3685032116 [1,0,0,0,0,0|2,0,0]=3 47 B13R1.3 CCC1=CC=C(C=C1)C=CC(=O)O MCULE-2720585827 [1,0,0,0,0,0|2,0,0]=3 48 B13R1.3 COC1=CC=C(C=C1)/C=C/C(=O)C MCULE-7015001426 [1,0,0,0,0,0|3,0,0]=4 49 B13R1.3 COC1=CC=C(C=C1)/C=C/C(=O)Cl MCULE-7256772196 [1,0,0,0,0,0|3,0,0]=4 50 B13R1.3 COC1=CC=C(C=C1)/C=C/C(=O)O MCULE-6993960877 [1,0,0,0,0,0|2,0,0]=3 51 B13R1.3 COC1=CC=C(C=C1)C=CC(=O)C MCULE-3255320679 [1,0,0,0,0,0|3,0,0]=4 52 B13R1.3 COC1=CC=C(C=C1)C=CC(=O)Cl MCULE-2384637852 [1,0,0,0,0,0|3,0,0]=4 53 B13R1.3 COC1=CC=C(C=C1)C=CC(=O)O MCULE-4456423689 [1,0,0,0,0,0|2,0,0]=3 54 B13R1.3 COC1=CC=C(C=C1)C=CC(=O)[O-] MCULE-3474372269 [1,0,0,0,0,0|2,0,1]=4 55 B13R1.3 COC1=CC=C(C=N1)/C=C/C(=O)O MCULE-1842553003 [1,0,0,0,0,0|3,0,0]=4 56 B13R1.3 COC1=NC=C(C=C1)C=CC(=O)O MCULE-9082686105 [1,0,0,0,0,0|3,0,0]=4 57 B13R1.3 CSC1=CC=C(C=C1)/C=C/C(=O)O MCULE-6324671016 [1,0,0,0,0,0|2,0,0]=3 58 B13R1.3 CSC1=CC=C(C=C1)C=CC(=O)O MCULE-9285137157 [1,0,0,0,0,0|2,0,0]=3 59 B13R1.3 N#CC1=CC=C(C=C1)/C=C/C(=O)O MCULE-4484869195 [1,0,0,0,0,0|2,0,0]=3 60 B13R1.3 N#CC1=CC=C(C=C1)C=CC(=O)O MCULE-9879860446 [1,0,0,0,0,0|2,0,0]=3 61 B13R1.3 O=C(O)/C=C/C1=CC=C(C=C1)CBr MCULE-9998924523 [1,0,0,0,0,0|2,0,0]=3 62 B13R1.3 O=C(O)C=CC1=CC=C(C=C1)CBr MCULE-1604768230 [1,0,0,0,0,0|2,0,0]=3 63 B13R1.3 O=CC1=CC=C(C=C1)/C=C/C(=O)O MCULE-5017170189 [1,0,0,0,0,0|1,0,0]=2 64 B13R1.3 O=CC1=CC=C(C=C1)C=CC(=O)O MCULE-2468143780 [1,0,0,0,0,0|1,0,0]=2 65 B13R1.3 O=CC1=CC=C(C=C1)CCC(=O)O MCULE-8265326595 [1,0,0,0,0,0|1,0,2]=4 66 B13R1.3 O=CC1=CC=C(C=C1)OCC(=O)O MCULE-9498358536 [1,0,0,0,0,0|2,0,1]=4 67 B13R1.74 CN(C)C1=CC=C(C=C1)/C=C/C=O MCULE-9796195033 [1,0,0,0,0,0|2,0,1]=4 68 B13R1.74 CN(C)C1=CC=C(C=C1)C=CC=O MCULE-6107274854 [1,0,0,0,0,0|2,0,1]=4 69 B13R1.74 N#CC=CC1=CC=C(C=C1)[N+](=O)[O-] MCULE-2485445720 [1,0,0,0,0,0|1,0,1]=3 70 B13R1.74 O=C/C=C/C1=CC=C(C=C1)N(=O)=O MCULE-2734359316 [1,0,0,0,0,0|0,0,2]=3 71 B13R1.74 O=CC=CC1=CC=C(C=C1)[N+](=O)[O-] MCULE-6924839107 [1,0,0,0,0,0|0,0,0]=1 72 B13R1.74 O=N(=O)C1=CC=C(C=C1)/C=C/CO MCULE-3649416363 [1,0,0,0,0,0|0,0,3]=4 73 B13R1.74 O=[N+]([O-])C1=CC=C(C=C1)C=CCBr MCULE-2389061763 [1,0,0,0,0,0|1,0,1]=3 74 B13R1.74 O=[N+]([O-])C1=CC=C(C=C1)C=CCO MCULE-5310040655 [1,0,0,0,0,0|0,0,1]=2 75 B15R1.495 CC(=CC1=CC=C(C=C1)C(C)C)C(=O)O MCULE-9446671941 [0,1,0,0,0,0|3,0,0]=4 76 B15R1.495 CC(=CC1=CC=C(C=C1)[N+](=O)[O-])[N+](=O)[O-] MCULE-1318716613 [0,1,0,0,0,0|1,0,1]=3 77 B15R1.495 CC(=O)C(=CC1=CC=C(C=C1)[N+](=O)[O-])C MCULE-2524898971 [0,1,0,0,0,0|1,0,0]=2 78 B15R1.495 CC(=O)C1=CC=C(C=C1)NC(=O)C(=O)O MCULE-3101229902 [0,1,0,0,0,0|3,0,0]=4 79 B15R1.495 CN(C)C1=CC=C(C=C1)C=C(S)C(=O)O MCULE-6018632598 [0,1,0,0,0,0|2,0,1]=4 80 B15R1.495 C[C@@H](NC1=CC=C(C=C1)[N+](=O)[O-])C(=O)O MCULE-6300415190 [0,1,0,0,0,0|1,0,1]=3 81 B15R1.495 C[C@@H](NC1=CC=C(C=C1)[N+](=O)[O-])C(=O)O MCULE-9871188117 [0,1,0,0,0,0|1,0,1]=3 82 B15R1.495 N[C@@H](CC1=CC=C(C=C1)[N+](=O)[O-])C(=O)O MCULE-1693855897 [0,1,0,0,0,0|0,0,2]=3 83 B15R1.495 N[C@@H](CC1=CC=C(C=C1)[N+](=O)[O-])C(=O)O MCULE-3511055155 [0,1,0,0,0,0|0,0,2]=3 84 B15R1.495 N[C@@H](CC1=CC=C(C=C1)[N+](=O)[O-])C(=O)O MCULE-8831767805 [0,1,0,0,0,0|0,0,2]=3 85 B15R1.495 N[C@@H](CC1=NC=C(C=C1)[N+](=O)[O-])C(=O)O MCULE-5418388495 [0,1,0,0,0,0|1,0,2]=4 86 B15R1.495 N[C@H](CC1=CC=C(C=C1)[N+](=O)[O-])C(=O)O MCULE-2856704024 [0,1,0,0,0,0|0,0,2]=3 87 B15R1.495 N[C@H](CC1=CC=C(C=C1)[N+](=O)[O-])C(=O)O MCULE-3581843023 [0,1,0,0,0,0|0,0,2]=3 88 B15R1.495 N[C@H](CC1=CC=C(C=C1)[N+](=O)[O-])C(=O)O MCULE-4275372069 [0,1,0,0,0,0|0,0,2]=3 89 B15R1.495 N[C@H](CC1=CC=C(C=C1)[N+](=O)[O-])C(=O)O MCULE-9556380283 [0,1,0,0,0,0|0,0,2]=3 90 B15R1.495 O=C(O)C(=O)CC1=CC=C(C=C1)N(=O)=O MCULE-6223294787 [0,1,0,0,0,0|0,0,3]=4 91 B15R1.495 O=C(O)C(=O)NC1=CC=C(C=C1)N(=O)=O MCULE-2403191345 [0,1,0,0,0,0|1,0,2]=4 92 B15R1.495 O=C(O)[C@@H](O)CC1=CC=C(C=C1)[N+](=O)[O-] MCULE-1733119463 [0,1,0,0,0,0|0,0,2]=3 93 B15R1.495 O=C(O)[C@@H](O)CC1=CC=C(C=C1)[N+](=O)[O-] MCULE-7846582064 [0,1,0,0,0,0|0,0,2]=3 94 B15R1.495 O=C(O)[C@H](O)CC1=CC=C(C=C1)[N+](=O)[O-] MCULE-8667813748 [0,1,0,0,0,0|0,0,2]=3 95 B15R1.495 O=[N+]([O-])C(=CC1=CC=C(C=C1)[N+](=O)[O-])Br MCULE-8795152512 [0,1,0,0,0,0|1,0,1]=3 96 B15R1.495 [C@H](N)(CC1=CC=C(C=C1)[N+](=O)[O-])C(=O)O MCULE-3738503916 [0,1,0,0,0,0|0,0,2]=3 97 B15R1.498 C(=CC1=CC=C(C=C1)S(=O)(=O)N)C(=O)C MCULE-9511394366 [0,1,0,0,0,0|2,0,1]=4 98 B15R1.498 CC(C)(C)C1=CC=C(C=C1)/C=C/C(=O)O MCULE-9807168351 [0,1,0,0,0,0|3,0,0]=4 99 B15R1.498 CC(C)(C)C1=CC=C(C=C1)C=CC(=O)O MCULE-7042549829 [0,1,0,0,0,0|3,0,0]=4 100 B15R1.498 CS(=O)(=O)C1=CC=C(C=C1)/C=C/C(=O)O MCULE-6734788801 [0,1,0,0,0,0|1,0,1]=3 101 B15R1.498 CS(=O)(=O)C1=CC=C(C=C1)C=CC(=O)O MCULE-7368416677 [0,1,0,0,0,0|1,0,1]=3 102 B15R1.498 NS(=O)(=O)C1=CC=C(C=C1)C=CC(=O)O MCULE-9030454310 [0,1,0,0,0,0|1,0,1]=3 103 B15R1.498 O=C(O)/C=C/C1=CC=C(C=C1)C(F)(F)F MCULE-8182170552 [0,1,0,0,0,0|3,0,0]=4 104 B15R1.498 O=C(O)C=CC1=CC=C(C=C1)C(F)(F)F MCULE-6699499799 [0,1,0,0,0,0|3,0,0]=4 105 B15R1.498 O=C(O)C=CC1=CC=C(C=C1)S(=O)(=O)Cl MCULE-7538279824 [0,1,0,0,0,0|1,0,1]=3 106 B15R1.944 CNC(=O)C1=CC=C(C=C1)C=CC(=O)O MCULE-4404621475 [0,1,0,0,0,0|2,0,0]=3 107 B15R1.944 COC(=O)C1=CC=C(C=C1)/C=C/C(=O)O MCULE-1662969874 [0,1,0,0,0,0|1,0,1]=3 108 B15R1.944 COC(=O)C1=CC=C(C=C1)C=CC(=O)O MCULE-4753574275 [0,1,0,0,0,0|1,0,1]=3 109 B15R1.944 COC(=O)C1=NC=C(C=C1)C=CC(=O)O MCULE-2415889469 [0,1,0,0,0,0|2,0,1]=4 110 B15R1.944 COC(=O)C1=NC=C(C=C1)C=CC(=O)O MCULE-8772542983 [0,1,0,0,0,0|2,0,1]=4 111 B15R1.956 CNC(=O)C=CC1=CC=C(C=C1)[N+](=O)[O-] MCULE-8455170565 [0,1,0,0,0,0|1,0,0]=2 112 B15R1.956 COC(=O)/C=C/C1=CC=C(C=C1)B(O)O MCULE-5467067328 [0,1,0,0,0,0|1,0,2]=4 113 B15R1.956 COC(=O)/C=C/C1=CC=C(C=C1)C(=O)O MCULE-3823711881 [0,1,0,0,0,0|1,0,1]=3 114 B15R1.956 COC(=O)/C=C/C1=CC=C(C=C1)N(=O)=O MCULE-7970935410 [0,1,0,0,0,0|0,0,2]=3 115 B15R1.956 COC(=O)/C=C/C1=CC=C(C=C1)N(C)C MCULE-7881062807 [0,1,0,0,0,0|2,0,1]=4 116 B15R1.956 COC(=O)C=CC1=CC=C(C=C1)B(O)O MCULE-7659983565 [0,1,0,0,0,0|1,0,2]=4 117 B15R1.956 COC(=O)C=CC1=CC=C(C=C1)C(=O)O MCULE-3793462505 [0,1,0,0,0,0|1,0,1]=3 118 B15R1.956 COC(=O)C=CC1=CC=C(C=C1)C(C)C MCULE-3645371508 [0,1,0,0,0,0|3,0,0]=4 119 B15R1.956 COC(=O)C=CC1=CC=C(C=C1)N(C)C MCULE-9167250487 [0,1,0,0,0,0|2,0,1]=4 120 B15R1.956 COC(=O)C=CC1=CC=C(C=C1)[N+](=O)[O-] MCULE-6147222723 [0,1,0,0,0,0|0,0,0]=1 121 B15R1.956 NNC(=O)N=CC1=CC=C(C=C1)[N+](=O)[O-] MCULE-1917071141 [0,1,0,0,0,0|2,0,0]=3 122 B15R1.5380 CN(C)C1=C(C=C(C=C1)C=CC(=O)O)Br MCULE-3401392310 [0,1,0,0,0,0|2,0,1]=4 123 B15R1.5504 CC(=N)CC(=O)C1=CC=C(C=C1)[N+](=O)[O-] MCULE-5244940588 [0,1,0,0,0,0|2,0,1]=4 124 B15R1.5504 N[C@@H](CC(=O)O)C1=CC=C(C=C1)[N+](=O)[O-] MCULE-1357783260 [0,1,0,0,0,0|0,0,2]=3 125 B15R1.5504 N[C@@H](CC(=O)O)C1=CC=C(C=C1)[N+](=O)[O-] MCULE-3677927687 [0,1,0,0,0,0|0,0,2]=3 126 B15R1.5504 N[C@H](CC(=O)O)C1=CC=C(C=C1)[N+](=O)[O-] MCULE-1026925409 [0,1,0,0,0,0|0,0,2]=3 127 B15R1.5504 N[C@H](CC(=O)O)C1=CC=C(C=C1)[N+](=O)[O-] MCULE-6038136748 [0,1,0,0,0,0|0,0,2]=3 128 B15R2.7174 CC(=O)C1=CC2=CC(=CC=C2C=C1)O MCULE-2544055214 [0,0,0,1,0,0|3,0,0]=4 129 B15R2.7174 O=C(O)C1=CC=C2C=CC(=CC2=C1)O MCULE-2450622052 [0,0,0,1,0,0|2,0,1]=4 130 B15R2.7174 O=C1C=CC2=C(N1)C=C(C=C2)C(=O)O MCULE-3657545345 [0,0,0,1,0,0|2,0,1]=4 131 B15R2.7174 O=C1C=CC2=C(N1)C=C(C=C2)N(=O)=O MCULE-8062649171 [0,0,0,1,0,0|1,0,2]=4 132 B15R2.7174 O=C1C=CC2=C(O1)C=C(C=C2)B(O)O MCULE-1674320715 [0,0,0,1,0,0|1,0,2]=4 133 B15R2.7686 O=C(O)C=CC1=CC=C(C=C1)C2CC2 MCULE-4671766080 [0,0,0,1,0,0|3,0,0]=4 134 B13R1.585 CC(=O)C1=CC=C(C=C1)CC(=O)O MCULE-7578046977 [0,0,0,0,1,0|2,0,1]=4 135 B13R1.585 CC(=O)NC1=CC=C(C=C1)S(=O)[O-] MCULE-1119866785 [0,0,0,0,1,0|3,0,0]=4 136 B13R1.585 CC(=O)OC1=CC=C(C=C1)C(=O)[O-] MCULE-1078231416 [0,0,0,0,1,0|3,0,0]=4 137 B13R1.585 CS(=O)C1=CC=C(C=C1)CC(=O)O MCULE-7818331596 [0,0,0,0,1,0|2,0,1]=4 138 B13R1.585 NC(=O)C1=CC=C(C=C1)CC(=O)O MCULE-1968975994 [0,0,0,0,1,0|2,0,1]=4 139 B13R1.585 O=C(O)CC1=CC=C(C=C1)C(=O)O MCULE-6154695882 [0,0,0,0,1,0|1,0,2]=4 140 B13R1.585 O=C(O)CC1=CC=C(C=C1)N(=O)=O MCULE-2593918770 [0,0,0,0,1,0|0,0,3]=4 141 B13R1.1985 CC(=O)C1=CC=C(O1)C=CC(=O)O MCULE-6502213067 [0,0,0,0,1,0|3,0,0]=4 142 B13R1.1985 O=C(O)/C=C/C1=CC=C(O1)N(=O)=O MCULE-3633437566 [0,0,0,0,1,0|1,0,2]=4 143 B13R1.1985 O=C(O)/C=C/C1=CC=C(S1)N(=O)=O MCULE-6075127382 [0,0,0,0,1,0|1,0,2]=4 144 B13R1.1985 O=C(O)C=CC1=CC=C(O1)[N+](=O)[O-] MCULE-6903611173 [0,0,0,0,1,0|1,0,0]=2 145 B13R1.1985 O=C(O)C=CC1=CC=C(S1)[N+](=O)[O-] MCULE-1564775970 [0,0,0,0,1,0|1,0,0]=2 146 B15R1.499 CC(=O)NC1=CC=C(C=C1)/C=C/C(=O)O MCULE-4810997249 [0,0,0,0,0,1|2,0,0]=3 147 B15R1.499 CC(=O)NC1=CC=C(C=C1)C=CC(=O)O MCULE-2626242680 [0,0,0,0,0,1|2,0,0]=3 148 B15R1.499 CC(=O)NC1=NC=C(C=C1)C=CC(=O)O MCULE-5706001243 [0,0,0,0,0,1|3,0,0]=4 149 B15R1.499 CC(=O)NC1=NC=C(C=C1)C=CC(=O)O MCULE-6136096612 [0,0,0,0,0,1|3,0,0]=4 150 B15R1.499 CC(=O)OC1=CC=C(C=C1)/C=C/C(=O)O MCULE-9227806605 [0,0,0,0,0,1|2,0,0]=3 151 B15R1.499 CC(=O)OC1=CC=C(C=C1)C=CC(=O)N MCULE-4471723191 [0,0,0,0,0,1|3,0,0]=4 152 B15R1.499 CC(=O)OC1=CC=C(C=C1)C=CC(=O)O MCULE-1179883430 [0,0,0,0,0,1|2,0,0]=3 153 B15R1.499 CC(C)CC1=CC=C(C=C1)/C=C/C(=O)O MCULE-9709552511 [0,0,0,0,0,1|3,0,0]=4 154 B15R1.499 CC(C)CC1=CC=C(C=C1)C=CC(=O)O MCULE-3426721499 [0,0,0,0,0,1|3,0,0]=4 155 B15R1.499 CC(C)OC1=CC=C(C=C1)/C=C/C(=O)O MCULE-1743121197 [0,0,0,0,0,1|3,0,0]=4 156 B15R1.499 CC(C)OC1=CC=C(C=C1)C=CC(=O)O MCULE-7674649726 [0,0,0,0,0,1|3,0,0]=4 157 B15R1.499 O=C(O)/C=C/C1=CC=C(C=C1)OC(F)F MCULE-1043282281 [0,0,0,0,0,1|3,0,0]=4 158 B15R1.499 O=C(O)C=CC1=CC=C(C=C1)OC(F)F MCULE-6584046485 [0,0,0,0,0,1|3,0,0]=4 159 B15R1.499 O=C(O)C=CC1=CC=C(C=C1)SC(F)F MCULE-8516993399 [0,0,0,0,0,1|3,0,0]=4 160 B15R1.1080 CC(=O)NN=CC1=CC=C(C=C1)[N+](=O)[O-] MCULE-6080828731 [0,0,0,0,0,1|2,0,0]=3 161 B15R1.1080 N/C(=N/N=CC1=CC=C(C=C1)[N+](=O)[O-])/[NH3+] MCULE-9064949088 [0,0,0,0,0,1|3,0,0]=4 162 B15R1.1080 NC(=NN=CC1=CC=C(C=C1)[N+](=O)[O-])N MCULE-1177256230 [0,0,0,0,0,1|3,0,0]=4 163 B15R1.1080 NC(=O)NN=CC1=CC=C(C=C1)[N+](=O)[O-] MCULE-7362846085 [0,0,0,0,0,1|2,0,0]=3 164 B15R1.1080 NC(=S)NN=CC1=CC=C(C=C1)[N+](=O)[O-] MCULE-5642191082 [0,0,0,0,0,1|2,1,0]=4 165 B15R1.1080 O=[N+]([O-])C1=CC=C(C=C1)C=NNC(=S)S MCULE-5293087706 [0,0,0,0,0,1|1,2,0]=4 166 B12R1.21 C(=CC1=CC=C(C=C1)I)C(=O)N MCULE-4953492668 [2,0,0,0,0,0|2,0,0]=4 167 B12R1.21 CC(=O)/C=C/C1=CC=C(C=C1)Br MCULE-4968966219 [2,0,0,0,0,0|2,0,0]=4 168 B12R1.21 CC(=O)/C=C/C1=CC=C(C=C1)C MCULE-1850770058 [2,0,0,0,0,0|2,0,0]=4 169 B12R1.21 CC(=O)/C=C/C1=CC=C(C=C1)Cl MCULE-8042406157 [2,0,0,0,0,0|2,0,0]=4 170 B12R1.21 CC(=O)/C=C/C1=CC=C(C=C1)F MCULE-1896531163 [2,0,0,0,0,0|2,0,0]=4 171 B12R1.21 CC(=O)/C=C/C1=CC=C(C=C1)O MCULE-3022611575 [2,0,0,0,0,0|1,0,1]=4 172 B12R1.21 CC(=O)C=CC1=CC=C(C=C1)Br MCULE-9469464573 [2,0,0,0,0,0|2,0,0]=4 173 B12R1.21 CC(=O)C=CC1=CC=C(C=C1)C MCULE-3065183970 [2,0,0,0,0,0|2,0,0]=4 174 B12R1.21 CC(=O)C=CC1=CC=C(C=C1)Cl MCULE-4900585766 [2,0,0,0,0,0|2,0,0]=4 175 B12R1.21 CC(=O)C=CC1=CC=C(C=C1)F MCULE-6872409442 [2,0,0,0,0,0|2,0,0]=4 176 B12R1.21 CC(=O)C=CC1=CC=C(C=C1)O MCULE-9722577866 [2,0,0,0,0,0|1,0,1]=4 177 B12R1.21 CC1=CC=C(C=C1)/C=C/C(=O)Cl MCULE-2058495596 [2,0,0,0,0,0|2,0,0]=4 178 B12R1.21 CC1=CC=C(C=C1)/C=C/C(=O)O MCULE-4218057596 [2,0,0,0,0,0|1,0,0]=3 179 B12R1.21 CC1=CC=C(C=C1)C=CC(=O)Cl MCULE-5021343987 [2,0,0,0,0,0|2,0,0]=4 180 B12R1.21 CC1=CC=C(C=C1)C=CC(=O)N MCULE-5979163187 [2,0,0,0,0,0|2,0,0]=4 181 B12R1.21 CC1=CC=C(C=C1)C=CC(=O)O MCULE-7310353888 [2,0,0,0,0,0|1,0,0]=3 182 B12R1.21 NC(=O)/C=C/C1=CC=C(C=C1)Br MCULE-9474644627 [2,0,0,0,0,0|2,0,0]=4 183 B12R1.21 NC(=O)/C=C/C1=CC=C(C=C1)Cl MCULE-4399110657 [2,0,0,0,0,0|2,0,0]=4 184 B12R1.21 NC(=O)/C=C/C1=CC=C(C=C1)O MCULE-7972851464 [2,0,0,0,0,0|1,0,1]=4 185 B12R1.21 NC(=O)C=CC1=CC=C(C=C1)Br MCULE-2059664507 [2,0,0,0,0,0|2,0,0]=4 186 B12R1.21 NC(=O)C=CC1=CC=C(C=C1)Cl MCULE-9226277544 [2,0,0,0,0,0|2,0,0]=4 187 B12R1.21 NC(=O)C=CC1=CC=C(C=C1)F MCULE-3516681833 [2,0,0,0,0,0|2,0,0]=4 188 B12R1.21 NC(=O)C=CC1=CC=C(C=C1)O MCULE-1974045025 [2,0,0,0,0,0|1,0,1]=4 189 B12R1.21 NC1=CC=C(C=C1)/C=C/C(=O)O MCULE-6477711177 [2,0,0,0,0,0|0,0,1]=3 190 B12R1.21 NC1=CC=C(C=C1)C=CC(=O)O MCULE-9065250783 [2,0,0,0,0,0|0,0,1]=3 191 B12R1.21 NC1=NC=C(C=C1)/C=C/C(=O)O MCULE-9571181864 [2,0,0,0,0,0|1,0,1]=4 192 B12R1.21 NC1=NC=C(C=C1)C=CC(=O)O MCULE-9262977474 [2,0,0,0,0,0|1,0,1]=4 193 B12R1.21 O=C(Cl)/C=C/C1=CC=C(C=C1)Br MCULE-1656107943 [2,0,0,0,0,0|2,0,0]=4 194 B12R1.21 O=C(Cl)/C=C/C1=CC=C(C=C1)Cl MCULE-5462639794 [2,0,0,0,0,0|2,0,0]=4 195 B12R1.21 O=C(Cl)/C=C/C1=CC=C(C=C1)F MCULE-3036184092 [2,0,0,0,0,0|2,0,0]=4 196 B12R1.21 O=C(Cl)C=CC1=CC=C(C=C1)Br MCULE-6741932936 [2,0,0,0,0,0|2,0,0]=4 197 B12R1.21 O=C(Cl)C=CC1=CC=C(C=C1)Cl MCULE-4301034303 [2,0,0,0,0,0|2,0,0]=4 198 B12R1.21 O=C(Cl)C=CC1=CC=C(C=C1)F MCULE-4813703106 [2,0,0,0,0,0|2,0,0]=4 199 B12R1.21 O=C(O)/C=C/C1=CC=C(C=C1)Br MCULE-4289979015 [2,0,0,0,0,0|1,0,0]=3 200 B12R1.21 O=C(O)/C=C/C1=CC=C(C=C1)Cl MCULE-4318861622 [2,0,0,0,0,0|1,0,0]=3 201 B12R1.21 O=C(O)/C=C/C1=CC=C(C=C1)F MCULE-9538614113 [2,0,0,0,0,0|1,0,0]=3 202 B12R1.21 O=C(O)/C=C/C1=CC=C(C=C1)I MCULE-3328397950 [2,0,0,0,0,0|1,0,0]=3 203 B12R1.21 O=C(O)/C=C/C1=CC=C(C=C1)O MCULE-9551292063 [2,0,0,0,0,0|0,0,1]=3 204 B12R1.21 O=C(O)/C=C/C1=CC=C(C=C1)S MCULE-2486115993 [2,0,0,0,0,0|0,1,0]=3 205 B12R1.21 O=C(O)/C=C/C1=CC=C(N=C1)Br MCULE-9625493002 [2,0,0,0,0,0|2,0,0]=4 206 B12R1.21 O=C(O)/C=C/C1=CN=C(C=C1)Cl MCULE-4772490742 [2,0,0,0,0,0|2,0,0]=4 207 B12R1.21 O=C(O)/C=C/C1=NC=C(C=C1)F MCULE-2551687293 [2,0,0,0,0,0|2,0,0]=4 208 B12R1.21 O=C(O)/C=C/C1=NC=C(C=C1)F MCULE-9601983386 [2,0,0,0,0,0|2,0,0]=4 209 B12R1.21 O=C(O)C=CC1=CC=C(C=C1)Br MCULE-6214703716 [2,0,0,0,0,0|1,0,0]=3 210 B12R1.21 O=C(O)C=CC1=CC=C(C=C1)Cl MCULE-6051545485 [2,0,0,0,0,0|1,0,0]=3 211 B12R1.21 O=C(O)C=CC1=CC=C(C=C1)F MCULE-8711973543 [2,0,0,0,0,0|1,0,0]=3 212 B12R1.21 O=C(O)C=CC1=CC=C(C=C1)I MCULE-2006397145 [2,0,0,0,0,0|1,0,0]=3 213 B12R1.21 O=C(O)C=CC1=CC=C(C=C1)O MCULE-2590309260 [2,0,0,0,0,0|0,0,1]=3 214 B12R1.21 O=C(O)C=CC1=CC=C(C=C1)S MCULE-4579832892 [2,0,0,0,0,0|0,1,0]=3 215 B12R1.21 O=C(O)C=CC1=CC=C(N=C1)Br MCULE-1067022604 [2,0,0,0,0,0|2,0,0]=4 216 B12R1.21 O=C(O)C=CC1=CN=C(C=C1)Cl MCULE-5983392112 [2,0,0,0,0,0|2,0,0]=4 217 B12R1.21 O=C(O)C=CC1=NC=C(C=C1)F MCULE-3616932768 [2,0,0,0,0,0|2,0,0]=4 218 B12R1.21 O=C(O)C=CC1=NC=C(C=C1)F MCULE-9950644550 [2,0,0,0,0,0|2,0,0]=4 219 B12R1.21 [NH3+]C1=CC=C(C=C1)C=CC(=O)O MCULE-3210030968 [2,0,0,0,0,0|0,0,1]=3 220 B12R1.71 COC1=CC=C(C=C1)/C=C/C=O MCULE-3226309223 [2,0,0,0,0,0|2,0,0]=4 221 B12R1.71 COC1=CC=C(C=C1)C=CC=O MCULE-5600239185 [2,0,0,0,0,0|2,0,0]=4 222 B12R1.71 N#CC1=CC=C(C=C1)C=CC=O MCULE-5591872407 [2,0,0,0,0,0|2,0,0]=4 223 B12R1.113 CC=CC1=CC=C(C=C1)[N+](=O)[O-] MCULE-3161198110 [2,0,0,0,0,0|0,0,1]=3 224 B12R1.113 O=[N+]([O-])C1=CC=C(C=C1)C=CBr MCULE-3516765700 [2,0,0,0,0,0|1,0,0]=3 225 B12R1.113 O=[N+]([O-])C1=CC=C(C=C1)C=NO MCULE-1197206494 [2,0,0,0,0,0|1,0,0]=3 226 B14R1.2 CCC1=CC=C(C=C1)C(=CC(=O)O)C MCULE-8173227250 [1,1,0,0,0,0|2,0,0]=4 227 B14R1.2 COC1=CC=C(C=C1)C(=CC(=O)O)C MCULE-2787019026 [1,1,0,0,0,0|2,0,0]=4 228 B14R1.3 COC1=CC=C(C=C1)C=C(C)C(=O)O MCULE-1057313976 [1,1,0,0,0,0|2,0,0]=4 229 B14R1.3 COC1=CC=C(C=C1)C=C(O)C(=O)O MCULE-9861861363 [1,1,0,0,0,0|2,0,0]=4 230 B14R1.3 COC1=CC=C(C=C1)C=C(S)C(=O)O MCULE-6298732355 [1,1,0,0,0,0|2,0,0]=4 231 B14R1.5 CCC1=CC=C(C=C1)/C=C/C(=O)OC MCULE-8672377426 [1,1,0,0,0,0|2,0,0]=4 232 B14R1.5 CCC1=CC=C(C=C1)C=CC(=O)OC MCULE-7191795001 [1,1,0,0,0,0|2,0,0]=4 233 B14R1.5 COC(=O)/C=C/C1=CC=C(C=C1)C#N MCULE-5309344437 [1,1,0,0,0,0|2,0,0]=4 234 B14R1.5 COC(=O)/C=C/C1=CC=C(C=C1)C=O MCULE-4995088644 [1,1,0,0,0,0|1,0,0]=3 235 B14R1.5 COC(=O)/C=C/C1=CC=C(C=C1)CBr MCULE-3581139474 [1,1,0,0,0,0|2,0,0]=4 236 B14R1.5 COC(=O)/C=C/C1=CC=C(C=C1)OC MCULE-2196928387 [1,1,0,0,0,0|2,0,0]=4 237 B14R1.5 COC(=O)C=CC1=CC=C(C=C1)C#N MCULE-3037208203 [1,1,0,0,0,0|2,0,0]=4 238 B14R1.5 COC(=O)C=CC1=CC=C(C=C1)C=O MCULE-4158522955 [1,1,0,0,0,0|1,0,0]=3 239 B14R1.5 COC(=O)C=CC1=CC=C(C=C1)CBr MCULE-1671851680 [1,1,0,0,0,0|2,0,0]=4 240 B14R1.5 COC(=O)C=CC1=CC=C(C=C1)OC MCULE-3790454540 [1,1,0,0,0,0|2,0,0]=4 241 B14R1.5 COC(=O)C=CC1=CC=C(C=C1)SC MCULE-3643658717 [1,1,0,0,0,0|2,0,0]=4 242 B14R1.103 COC1=CC(=C(C=C1)C=CC(=O)O)C MCULE-8539249453 [1,1,0,0,0,0|2,0,0]=4 243 B14R1.103 COC1=CC=C(C(=C1)Cl)/C=C/C(=O)O MCULE-1122837892 [1,1,0,0,0,0|2,0,0]=4 244 B14R1.103 COC1=CC=C(C(=C1)F)C=CC(=O)O MCULE-1356879329 [1,1,0,0,0,0|2,0,0]=4 245 B14R1.103 COC1=CC=C(C(=C1)O)/C=C/C(=O)O MCULE-7886772948 [1,1,0,0,0,0|2,0,0]=4 246 B14R1.103 COC1=CC=C(C(=C1)O)C=CC(=O)O MCULE-7948310667 [1,1,0,0,0,0|2,0,0]=4 247 B14R1.142 CCOC1=CC=C(C=C1)/C=C/C(=O)O MCULE-9284982880 [1,1,0,0,0,0|2,0,0]=4 248 B14R1.142 CCOC1=CC=C(C=C1)C=CC(=O)O MCULE-1594342569 [1,1,0,0,0,0|2,0,0]=4 249 B14R1.3653 CNC1=C(C=C(C=C1)/C=C/C(=O)O)O MCULE-9192115439 [1,1,0,0,0,0|1,0,1]=4 250 B14R1.3653 COC1=C(C=C(C=C1)/C=C/C(=O)O)Br MCULE-1586272125 [1,1,0,0,0,0|2,0,0]=4 251 B14R1.3653 COC1=C(C=C(C=C1)/C=C/C(=O)O)C MCULE-7974239683 [1,1,0,0,0,0|2,0,0]=4 252 B14R1.3653 COC1=C(C=C(C=C1)C=CC(=O)O)Br MCULE-5799365931 [1,1,0,0,0,0|2,0,0]=4 253 B14R1.3653 COC1=C(C=C(C=C1)C=CC(=O)O)C MCULE-2414097443 [1,1,0,0,0,0|2,0,0]=4 254 B14R1.3653 COC1=C(C=C(C=C1)C=CC(=O)O)F MCULE-7712318283 [1,1,0,0,0,0|2,0,0]=4 255 B14R1.3653 COC1=C(C=C(C=C1)C=CC(=O)O)N MCULE-2903242419 [1,1,0,0,0,0|2,0,0]=4 256 B14R1.3653 COC1=C(C=C(C=C1)C=CC(=O)O)O MCULE-4571364221 [1,1,0,0,0,0|2,0,0]=4 257 B14R1.3653 COC1=CC=C(C=C1Cl)/C=C/C(=O)O MCULE-8384604948 [1,1,0,0,0,0|2,0,0]=4 258 B14R1.3653 COC1=CC=C(C=C1Cl)C=CC(=O)O MCULE-1014440304 [1,1,0,0,0,0|2,0,0]=4 259 B14R1.3653 COC1=CC=C(C=C1F)/C=C/C(=O)O MCULE-6414397588 [1,1,0,0,0,0|2,0,0]=4 260 B14R1.3653 COC1=CC=C(C=C1O)/C=C/C(=O)O MCULE-7013523945 [1,1,0,0,0,0|2,0,0]=4 261 B14R1.3653 N#CC1=CC=C(C=C1O)/C=C/C(=O)O MCULE-2681496672 [1,1,0,0,0,0|2,0,0]=4 262 B14R1.65 COC(=O)C1=CC=C(C=C1)/C=C/C=O MCULE-4865515397 [1,1,0,0,0,0|1,0,1]=4 263 B14R1.462 C=CC=NNC1=CC=C(C=C1)[N+](=O)[O-] MCULE-8796004164 [1,1,0,0,0,0|2,0,0]=4 264 B14R1.610 N#CC=C(Cl)C1=CC=C(C=C1)[N+](=O)[O-] MCULE-2075758286 [1,1,0,0,0,0|1,0,1]=4 265 B14R1.610 NN=CC(=O)C1=CC=C(C=C1)[N+](=O)[O-] MCULE-8241006161 [1,1,0,0,0,0|2,0,0]=4 266 B14R1.610 O=C(C=CCl)C1=CC=C(C=C1)[N+](=O)[O-] MCULE-7259700535 [1,1,0,0,0,0|1,0,0]=3 267 B14R1.610 O=CC=C(Cl)C1=CC=C(C=C1)[N+](=O)[O-] MCULE-5985779333 [1,1,0,0,0,0|0,0,0]=2 268 B14R1.6402 C[C@@H](C(=O)O)C1=CC=C(C=C1)[N+](=O)[O-] MCULE-5826701361 [0,1,0,0,1,0|0,0,1]=3 269 B14R1.6402 C[C@@H](C(=O)O)C1=CC=C(C=C1)[N+](=O)[O-] MCULE-6177919117 [0,1,0,0,1,0|0,0,1]=3 270 B14R1.6402 N[C@@H](C(=O)O)C1=CC=C(C=C1)[N+](=O)[O-] MCULE-8804782848 [0,1,0,0,1,0|0,0,1]=3 271 B14R1.6402 N[C@H](C(=O)O)C1=CC=C(C=C1)[N+](=O)[O-] MCULE-5519425312 [0,1,0,0,1,0|0,0,1]=3 272 B14R1.6402 N[C@H](C(=O)O)C1=CC=C(C=C1)[N+](=O)[O-] MCULE-9438161026 [0,1,0,0,1,0|0,0,1]=3 273 B14R1.6402 O=C(O)C(=O)C1=CC=C(C=C1)N(=O)=O MCULE-6406707671 [0,1,0,0,1,0|0,0,2]=4 274 B14R1.6402 O=C(O)[C@H](O)C1=CC=C(C=C1)[N+](=O)[O-] MCULE-5366390432 [0,1,0,0,1,0|0,0,1]=3 275 B14R1.826 COC(=O)C=CC1=CC=C(O1)[N+](=O)[O-] MCULE-5643892307 [0,1,0,0,1,0|1,0,0]=3 276 B16R1.1094 COC(=O)NN=CC1=CC=C(C=C1)[N+](=O)[O-] MCULE-1541528243 [0,1,0,0,0,1|1,0,0]=3 277 B16R1.1094 O=C(CO)NN=CC1=CC=C(C=C1)[N+](=O)[O-] MCULE-2099409148 [0,1,0,0,0,1|1,0,0]=3 278 B16R1.4542 CC(=NNC(=O)N)C1=CC=C(C=C1)[N+](=O)[O-] MCULE-2158854069 [0,1,0,0,0,1|2,0,0]=4 279 B16R1.4542 CC(=O)NN=C(C)C1=CC=C(C=C1)[N+](=O)[O-] MCULE-7147644688 [0,1,0,0,0,1|2,0,0]=4 280 B16R1.12326 CC(=NNC1=CC=C(C=C1)[N+](=O)[O-])C(=O)O MCULE-5107915474 [0,1,0,0,0,1|1,0,0]=3 281 B16R1.12326 N[C@@H](CCC1=CC=C(C=C1)[N+](=O)[O-])C(=O)O MCULE-5384747501 [0,1,0,0,0,1|0,0,2]=4 282 B16R1.12326 N[C@@H](CCC1=CC=C(C=C1)[N+](=O)[O-])C(=O)O MCULE-6677055260 [0,1,0,0,0,1|0,0,2]=4 283 B16R1.12326 N[C@@H](CSC1=CC=C(C=C1)[N+](=O)[O-])C(=O)O MCULE-1199548468 [0,1,0,0,0,1|0,0,2]=4 284 B16R1.12459 CC(=O)CC(=NC1=CC=C(C=C1)[N+](=O)[O-])C MCULE-1954024906 [0,1,0,0,0,1|1,0,1]=4 285 B16R1.12459 N[C@@H](CC(=O)O)CC1=CC=C(C=C1)[N+](=O)[O-] MCULE-4021627913 [0,1,0,0,0,1|0,0,2]=4 286 B16R1.12459 N[C@@H](CC(=O)O)CC1=CC=C(C=C1)[N+](=O)[O-] MCULE-5544399726 [0,1,0,0,0,1|0,0,2]=4 287 B16R1.12459 N[C@@H](CC(=O)O)CC1=CC=C(C=C1)[N+](=O)[O-] MCULE-5882774110 [0,1,0,0,0,1|0,0,2]=4 288 B16R1.12459 N[C@@H](CC(=O)O)CC1=CC=C(C=C1)[N+](=O)[O-] MCULE-7437131603 [0,1,0,0,0,1|0,0,2]=4 289 B16R1.12459 N[C@H](CC(=O)O)CC1=CC=C(C=C1)[N+](=O)[O-] MCULE-1079086678 [0,1,0,0,0,1|0,0,2]=4 290 B16R1.12459 N[C@H](CC(=O)O)CC1=CC=C(C=C1)[N+](=O)[O-] MCULE-1575950528 [0,1,0,0,0,1|0,0,2]=4 291 B16R1.12459 N[C@H](CC(=O)O)CC1=CC=C(C=C1)[N+](=O)[O-] MCULE-6555874242 [0,1,0,0,0,1|0,0,2]=4 292 B16R1.12459 N[C@H](CC(=O)O)CC1=CC=C(C=C1)[N+](=O)[O-] MCULE-7191914886 [0,1,0,0,0,1|0,0,2]=4 293 B16R1.758 CN[C@@H](CC1=CC=C(C=C1)[N+](=O)[O-])C(=O)O MCULE-1851510711 [0,2,0,0,0,0|0,0,2]=4 294 B16R1.758 CN[C@@H](CC1=CC=C(C=C1)[N+](=O)[O-])C(=O)O MCULE-4806402638 [0,2,0,0,0,0|0,0,2]=4 295 B16R1.758 CO[C@@H](CC1=CC=C(C=C1)[N+](=O)[O-])C(=O)O MCULE-7863722144 [0,2,0,0,0,0|0,0,2]=4 296 B16R1.758 CO[C@@H](CC1=CC=C(C=C1)[N+](=O)[O-])C(=O)O MCULE-8871474806 [0,2,0,0,0,0|0,0,2]=4 297 B16R1.758 N#CC(=CC1=CC=C(C=C1)C(=O)O)C(=O)O MCULE-9532946867 [0,2,0,0,0,0|1,0,1]=4 298 B16R1.758 N#CC(=CC1=CC=C(C=C1)[N+](=O)[O-])C(=O)N MCULE-1077924778 [0,2,0,0,0,0|1,0,0]=3 299 B16R1.758 N#CC(=CC1=CC=C(C=C1)[N+](=O)[O-])C(=O)O MCULE-9024522635 [0,2,0,0,0,0|0,0,0]=2 300 B16R1.758 N#CC(=CC1=CC=C(C=C1)[N+](=O)[O-])C(=S)N MCULE-3178386770 [0,2,0,0,0,0|1,1,0]=4 301 B16R1.6949 CC(=CC1=CC=C(C=C1)[N+](=O)[O-])C(=NO)C MCULE-8602525726 [0,2,0,0,0,0|1,0,0]=3 302 B16R1.6949 COC(=O)[C@@H](N)CC1=CC=C(C=C1)[N+](=O)[O-] MCULE-1853205017 [0,2,0,0,0,0|0,0,2]=4 303 B16R1.6949 COC(=O)[C@@H](O)CC1=CC=C(C=C1)[N+](=O)[O-] MCULE-2481249216 [0,2,0,0,0,0|0,0,2]=4 304 B16R1.6949 COC(=O)[C@@H](O)CC1=CC=C(C=C1)[N+](=O)[O-] MCULE-4612198444 [0,2,0,0,0,0|0,0,2]=4 305 B16R1.6949 COC(=O)[C@@H]([NH3+])CC1=CC=C(C=C1)[N+](=O)[O-] MCULE-8933765773 [0,2,0,0,0,0|0,0,2]=4 306 B16R1.6949 COC(=O)[C@H](N)CC1=CC=C(C=C1)[N+](=O)[O-] MCULE-5088276149 [0,2,0,0,0,0|0,0,2]=4 307 B16R1.6949 COC(=O)[C@H](N)CC1=CC=C(C=C1)[N+](=O)[O-] MCULE-7835171070 [0,2,0,0,0,0|0,0,2]=4 308 B16R1.6949 COC(=O)[C@H](N)CC1=CC=C(C=C1)[N+](=O)[O-] MCULE-8022208180 [0,2,0,0,0,0|0,0,2]=4 309 B16R1.6949 COC(=O)[C@H](N)CC1=CC=C(C=C1)[N+](=O)[O-] MCULE-9317613375 [0,2,0,0,0,0|0,0,2]=4 310 B16R1.6949 [C@H](N)(CC1=CC=C(C=C1)[N+](=O)[O-])C(=O)OC MCULE-2597522683 [0,2,0,0,0,0|0,0,2]=4 311 B16R1.6949 [C@H](N)(CC1=CC=C(C=C1)[N+](=O)[O-])C(=O)OC MCULE-9742253649 [0,2,0,0,0,0|0,0,2]=4 312 B16R1.341 CNS(=O)(=O)C1=CC=C(C=C1)C=CC(=O)O MCULE-6693977513 [0,2,0,0,0,0|1,0,1]=4 313 B16R1.1136 COC(=O)/C=C/C1=CC=C(C=C1)C(=O)OC MCULE-3896981436 [0,2,0,0,0,0|1,0,1]=4 314 B16R1.1136 COC(=O)C=CC1=CC=C(C=C1)C(=O)OC MCULE-7884913235 [0,2,0,0,0,0|1,0,1]=4 315 B16R1.1184 COC(=O)C1=CC=C(C(=C1)F)/C=C/C(=O)O MCULE-9364958233 [0,2,0,0,0,0|1,0,1]=4 316 B16R1.1184 COC(=O)C1=CC=C(C(=C1)F)C=CC(=O)O MCULE-8095903388 [0,2,0,0,0,0|1,0,1]=4 317 B16R1.864 COC(=O)C[C@@H](N)C1=CC=C(C=C1)[N+](=O)[O-] MCULE-4400080631 [0,2,0,0,0,0|0,0,2]=4 318 B16R1.864 COC(=O)C[C@@H](N)C1=CC=C(C=C1)[N+](=O)[O-] MCULE-7444546531 [0,2,0,0,0,0|0,0,2]=4 319 B16R1.864 COC(=O)C[C@H](N)C1=CC=C(C=C1)[N+](=O)[O-] MCULE-4270973590 [0,2,0,0,0,0|0,0,2]=4 320 B16R1.864 COC(=O)C[C@H](N)C1=CC=C(C=C1)[N+](=O)[O-] MCULE-9622031472 [0,2,0,0,0,0|0,0,2]=4 321 B16R1.925 CCNC(=O)C=CC1=CC=C(C=C1)[N+](=O)[O-] MCULE-4652348914 [0,2,0,0,0,0|1,0,0]=3 322 B16R1.925 CCOC(=O)/C=C/C1=CC=C(C=C1)N(=O)=O MCULE-2179003140 [0,2,0,0,0,0|0,0,2]=4 323 B16R1.925 CCOC(=O)C=CC1=CC=C(C=C1)[N+](=O)[O-] MCULE-5416319879 [0,2,0,0,0,0|0,0,0]=2 324 B16R1.925 CCOC(=O)N=NC1=CC=C(C=C1)[N+](=O)[O-] MCULE-9122404588 [0,2,0,0,0,0|2,0,0]=4 325 B16R1.11372 O=C(O)/C=C/C1=CC(=C(C=C1F)N(=O)=O)F MCULE-1959878294 [0,2,0,0,0,0|0,0,2]=4 326 B16R1.52972 O=C(O)/C=C/C1=CC(=C(C(=C1)F)N(=O)=O)F MCULE-6297996497 [0,2,0,0,0,0|0,0,2]=4 327 B16R1.52974 O=C(O)/C=C/C1=C(C=C(C=C1F)N(=O)=O)F MCULE-9784374014 [0,2,0,0,0,0|0,0,2]=4 328 B14R2.134 C#CC1=CC2=C(C=CC(=O)O2)C=C1 MCULE-6261387870 [1,0,0,1,0,0|2,0,0]=4 329 B14R2.134 COC1=CC2=C(C=CC(=O)O2)C=C1 MCULE-4358069418 [1,0,0,1,0,0|2,0,0]=4 330 B14R2.781 O=C([O-])C1=CC=C2C=CC=CC2=C1 MCULE-6940210490 [1,0,0,1,0,0|2,0,0]=4 331 B14R2.781 O=S([O-])C1=CC=C2C=CC=CC2=C1 MCULE-5030461126 [1,0,0,1,0,0|2,0,0]=4 332 B16R2.11975 CC(=O)OC1=CC=C2C=CC(=O)OC2=C1 MCULE-1305466379 [0,0,0,1,0,1|2,0,0]=4 333 B16R2.2827 O=C1NC=C(O1)C2=CC=C(C=C2)N(=O)=O MCULE-6003721444 [0,0,0,1,0,1|0,0,2]=4 334 B16R2.27312 O=C(O)[C@@H]1C[C@H]1C2=CC=C(C=C2)[N+](=O)[O-] MCULE-2336402517 [0,0,0,1,0,1|0,0,2]=4 335 B16R2.143127 O=C(O)C1=CC2=C(C=C1)NC=C2C(=O)O MCULE-6570143946 [0,0,0,1,0,1|1,0,1]=4 336 B16R2.143127 O=C(O)C1=CNC2=C1C=C(C=C2)N(=O)=O MCULE-6831192498 [0,0,0,1,0,1|0,0,2]=4 337 B16R2.27395 CC(=O)C1=CC2=C(C=C1)C=C(N2)C(=O)O MCULE-9975000886 [0,1,0,1,0,0|2,0,0]=4 338 B16R2.27395 O=C(O)C1=CC2=C(O1)C=C(C=C2)N(=O)=O MCULE-1663273678 [0,1,0,1,0,0|0,0,2]=4 339 B16R2.27395 O=C(O)C1=CC2=C(S1)C=C(C=C2)N(=O)=O MCULE-3163041959 [0,1,0,1,0,0|0,0,2]=4 340 B16R2.27395 O=C(O)C1=CC2=CC=C(C=C2N1)N(=O)=O MCULE-6360877534 [0,1,0,1,0,0|0,0,2]=4 341 B16R2.27395 O=C(O)C1=CC=C2C=C(NC2=C1)C(=O)O MCULE-2967692631 [0,1,0,1,0,0|1,0,1]=4 342 B16R2.26103 CC1=CC(=O)OC2=CC(=CC=C12)S(=O)C MCULE-4573636464 [0,1,0,1,0,0|2,0,0]=4 343 B12R1.4 O=CC1=CC=C(C=C1)CC(=O)O MCULE-6530164917 [1,0,0,0,1,0|1,0,1]=4 344 B12R1.337 O=CC=CC1=CC=C(O1)[N+](=O)[O-] MCULE-9336394813 [1,0,0,0,1,0|1,0,0]=3 345 B12R1.256 CC(=O)C1=CC=C(C=C1)C(=O)O MCULE-5486422687 [0,0,0,0,2,0|2,0,0]=4 346 B12R1.256 CS(=O)C1=CC=C(C=C1)C(=O)O MCULE-5973526071 [0,0,0,0,2,0|2,0,0]=4 347 B12R1.256 C[C@@H](O)C1=CC=C(C=C1)[N+](=O)[O-] MCULE-2145104300 [0,0,0,0,2,0|1,0,1]=4 348 B12R1.256 C[C@@H](O)C1=CC=C(C=C1)[N+](=O)[O-] MCULE-5793896928 [0,0,0,0,2,0|1,0,1]=4 349 B12R1.256 NC(=O)C1=CC=C(C=C1)C(=O)O MCULE-9178311509 [0,0,0,0,2,0|2,0,0]=4 350 B12R1.256 O=C(O)C1=CC=C(C=C1)C(=O)O MCULE-9289682931 [0,0,0,0,2,0|1,0,1]=4 351 B12R1.256 O=C(O)C1=CC=C(C=C1)N(=O)=O MCULE-9990648682 [0,0,0,0,2,0|0,0,2]=4 352 B12R1.256 O=C([O-])C1=CC=C(C=C1)C(=O)[O-] MCULE-1079660937 [0,0,0,0,2,0|1,0,1]=4 353 B14R1.4 COC1=CC=C(C=C1)C=CCC(=O)O MCULE-9925377647 [1,0,0,0,0,1|2,0,0]=4 354 B14R1.6355 NC(=O)C=CC1=CC(=CC=C1)[N+](=O)[O-] MCULE-7483465798 [0,0,0,0,1,1|1,0,0]=3 355 B14R1.6355 O=C(Cl)C=CC1=CC=CC(=C1)[N+](=O)[O-] MCULE-8038074176 [0,0,0,0,1,1|1,0,0]=3 356 B14R1.6355 O=C(O)/C=C/C1=CC(=CC=C1)C(=O)O MCULE-1646086804 [0,0,0,0,1,1|1,0,1]=4 357 B14R1.6355 O=C(O)/C=C/C1=CC(=CC=C1)N(=O)=O MCULE-7585183206 [0,0,0,0,1,1|0,0,2]=4 358 B14R1.6355 O=C(O)C=CC1=CC(=CC=C1)C(=O)O MCULE-4970731182 [0,0,0,0,1,1|1,0,1]=4 359 B14R1.6355 O=C(O)C=CC1=CC(=CC=C1)[N+](=O)[O-] MCULE-4148176380 [0,0,0,0,1,1|0,0,0]=2 360 B14R1.6355 O=[N+]([O-])C=CC1=CC(=CC=C1)[N+](=O)[O-] MCULE-1462028702 [0,0,0,0,1,1|1,0,1]=4 361 B16R1.603 NC(=O)COC1=CC=C(C=C1)/C=C/C(=O)O MCULE-8330551307 [0,0,0,0,0,2|2,0,0]=4 362 B16R1.603 NC(=O)COC1=CC=C(C=C1)C=CC(=O)O MCULE-6634727385 [0,0,0,0,0,2|2,0,0]=4 363 B16R1.603 O=C(O)/C=C/C1=CC=C(C=C1)/C=C/C(=O)O MCULE-6704274265 [0,0,0,0,0,2|1,0,1]=4 364 B16R1.603 O=C(O)C=CC1=CC=C(C=C1)C=CC(=O)O MCULE-5277708928 [0,0,0,0,0,2|1,0,1]=4 365 B16R1.603 O=C(O)COC1=CC=C(C=C1)C=C[N+](=O)[O-] MCULE-9013385378 [0,0,0,0,0,2|1,0,1]=4 366 B16R1.603 O=[N+]([O-])C=CC1=CC=C(C=C1)C=C[N+](=O)[O-] MCULE-3954054794 [0,0,0,0,0,2|1,0,1]=4 367 B16R1.1274 NC(=O)NN=CCC1=CC=C(C=C1)[N+](=O)[O-] MCULE-6453383723 [0,0,0,0,0,2|1,0,1]=4