0 B14R1.149 C=C(Br)CNC(C)C1=CC(=CC=C1)O Z1589339921 [0,0,0,0,0,0|3,0,1]=4 1 B14R1.149 C=C(Cl)CNC(=O)C1=CC=CC(=C1)O Z1633264027 [0,0,0,0,0,0|2,0,0]=2 2 B14R1.149 CC(O)CNC(=O)C1=CC(=CC=C1)Br Z68385311 [0,0,0,0,0,0|2,0,1]=3 3 B14R1.149 CC(O)CNC(=O)C1=CC(=CC=C1)Cl Z68385304 [0,0,0,0,0,0|2,0,1]=3 4 B14R1.149 CC(O)CNC(=O)C1=CC(=CC=C1)O Z425742602 [0,0,0,0,0,0|1,0,1]=2 5 B14R1.149 CC1=CC(=CC=C1)C(=O)NCC(=O)O Z56827661 [0,0,0,0,0,0|1,0,0]=1 6 B14R1.149 C[C@H](NCC(=O)O)C1=CC(=CN=C1)F Z4616782481 [0,0,0,0,0,0|3,0,1]=4 7 B14R1.149 NC(=O)CNC(=O)C1=CC(=CC=C1)I Z102047916 [0,0,0,0,0,0|2,0,0]=2 8 B14R1.149 NC(=O)CNC(=O)C1=CC(=CC=C1)N Z239124966 [0,0,0,0,0,0|2,0,0]=2 9 B14R1.149 NC(=O)CNC(=O)C1=CC(=CC=C1)O Z323032236 [0,0,0,0,0,0|1,0,0]=1 10 B14R1.149 NC(=O)COC(=O)C1=CC(=CC=C1)I Z18359587 [0,0,0,0,0,0|3,0,0]=3 11 B14R1.149 NC(=O)COC(=O)C1=CC(=CN=C1)Br Z18390149 [0,0,0,0,0,0|4,0,0]=4 12 B14R1.149 NC(CCC(=O)O)C1=CC(=CC=C1)Cl Z3847932941 [0,0,0,0,0,0|3,0,1]=4 13 B14R1.149 NC1=CC(=CC=C1)C(=O)CCC(=O)O Z1251352838 [0,0,0,0,0,0|2,0,0]=2 14 B14R1.149 O=C(O)CCC(=O)C1=CC(=CC=C1)Br Z838955790 [0,0,0,0,0,0|2,0,0]=2 15 B14R1.149 O=C(O)CCC(=O)C1=CC(=CC=C1)Cl Z838955714 [0,0,0,0,0,0|2,0,0]=2 16 B14R1.149 O=C(O)CCC(=O)C1=CC(=CC=C1)F Z838955774 [0,0,0,0,0,0|2,0,0]=2 17 B14R1.149 O=C(O)CNC(=O)C1=CC(=CC=C1)Br Z55928783 [0,0,0,0,0,0|1,0,0]=1 18 B14R1.149 O=C(O)CNC(=O)C1=CC(=CC=C1)Cl Z56827660 [0,0,0,0,0,0|1,0,0]=1 19 B14R1.149 O=C(O)CNC(=O)C1=CC(=CC=C1)F Z56881200 [0,0,0,0,0,0|1,0,0]=1 20 B14R1.149 O=C(O)CNC(=O)C1=CC(=CC=C1)O Z239129930 [0,0,0,0,0,0|0,0,0]=0 21 B14R1.149 O=C(O)CNC(=O)C1=NC=CC(=C1)Cl Z90124527 [0,0,0,0,0,0|2,0,0]=2 22 B13R1.18 C#CCNC(=O)C1=CC=CC(=C1)Br Z52404026 [1,0,0,0,0,0|2,0,1]=4 23 B13R1.18 C#CCNC(=O)C1=CC=CC(=C1)C Z52404761 [1,0,0,0,0,0|2,0,1]=4 24 B13R1.18 C#CCNC(=O)C1=CC=CC(=C1)Cl Z52403959 [1,0,0,0,0,0|2,0,1]=4 25 B13R1.18 C#CCNC(=O)C1=CC=CC(=C1)F Z52404583 [1,0,0,0,0,0|2,0,1]=4 26 B13R1.18 C#CCNC(=O)C1=CC=CC(=C1)I Z52404260 [1,0,0,0,0,0|2,0,1]=4 27 B13R1.18 C=CCCC(=O)C1=CC=CC(=C1)Cl Z1219747789 [1,0,0,0,0,0|3,0,0]=4 28 B13R1.18 C=CCNC(=O)C1=CC=CC(=C1)Br Z30519214 [1,0,0,0,0,0|2,0,0]=3 29 B13R1.18 C=CCNC(=O)C1=CC=CC(=C1)I Z30519239 [1,0,0,0,0,0|2,0,0]=3 30 B13R1.18 C=CCNC(=O)C1=CN=CC(=C1)Br Z30519245 [1,0,0,0,0,0|3,0,0]=4 31 B13R1.18 C=CCNC(=O)C1=NC=CC(=C1)Cl Z82197203 [1,0,0,0,0,0|3,0,0]=4 32 B13R1.18 CC1=CC(=CC=C1)C(=O)NCCN Z259720776 [1,0,0,0,0,0|2,0,1]=4 33 B13R1.18 CCCNC(=O)C1=CC(=CC=C1)N Z239124184 [1,0,0,0,0,0|2,0,1]=4 34 B13R1.18 CCCNC(=O)C1=CC(=CC=C1)O Z33030404 [1,0,0,0,0,0|1,0,1]=3 35 B13R1.18 CCCOC(=O)C1=CC(=CC=C1)O Z53833422 [1,0,0,0,0,0|2,0,1]=4 36 B13R1.18 N#CCNC(=O)C1=CC=CC(=C1)Br Z600498404 [1,0,0,0,0,0|2,0,1]=4 37 B13R1.18 N#CCNC(=O)C1=CN=CC(=C1)O Z1162461266 [1,0,0,0,0,0|2,0,1]=4 38 B13R1.18 NC1=CC(=CC=C1)C(=O)NCCO Z1262250890 [1,0,0,0,0,0|1,0,1]=3 39 B13R1.18 NCCNC(=O)C1=CC(=CC=C1)Br Z992716926 [1,0,0,0,0,0|2,0,1]=4 40 B13R1.18 O=C(NCCO)C1=CC(=CC=C1)O Z31725204 [1,0,0,0,0,0|0,0,1]=2 41 B13R1.18 O=C(NCCO)C1=CC(=CN=C1)Br Z31725404 [1,0,0,0,0,0|2,0,1]=4 42 B13R1.45 CC(=NNC(=O)C1=CC=CC=C1)C Z57101751 [1,0,0,0,0,0|3,0,0]=4 43 B13R1.45 CC(CCC(=O)O)C1=CC=CC=C1 Z1198150373 [1,0,0,0,0,0|2,0,1]=4 44 B13R1.45 CC(O)CNC(=O)C1=CN=CC=C1 Z1416282904 [1,0,0,0,0,0|2,0,1]=4 45 B13R1.45 CN(CCC(=O)O)C1=CC=CC=C1 Z1259273310 [1,0,0,0,0,0|3,0,0]=4 46 B13R1.45 C[C@@H](NCC(=O)N)C1=CC=CC=C1 Z1165167250 [1,0,0,0,0,0|2,0,1]=4 47 B13R1.45 C[C@@H](O)CNC(=O)C1=CN=CC=C1 Z1564778137 [1,0,0,0,0,0|2,0,1]=4 48 B13R1.45 NC(=O)COC(=O)C1=CC=CC=C1 Z19825583 [1,0,0,0,0,0|2,0,0]=3 49 B13R1.45 NC(=S)CNC(=O)C1=CC=CC=C1 Z211300040 [1,0,0,0,0,0|1,1,0]=3 50 B13R1.45 NC(CCC(=O)O)C1=CC=CC=C1 Z2213893322 [1,0,0,0,0,0|2,0,1]=4 51 B13R1.45 O=C(NC=C(Cl)Cl)C1=CC=CC=C1 Z57088260 [1,0,0,0,0,0|2,0,1]=4 52 B13R1.45 O=C(O)/C=C/C(=O)C1=CC=CC=C1 Z2895088074 [1,0,0,0,0,0|1,0,1]=3 53 B13R1.45 O=C(O)CCC(=O)C1=CC=CC=C1 Z57127328 [1,0,0,0,0,0|1,0,0]=2 54 B13R1.45 O=C(O)CCC(=O)C1=CC=NC=C1 Z1255488500 [1,0,0,0,0,0|2,0,0]=3 55 B13R1.45 O=C(O)CCC(=O)C1=CN=CC=C1 Z838955798 [1,0,0,0,0,0|2,0,0]=3 56 B13R1.45 O=C(O)CNC(=O)C1=CC=CC=C1 Z56771024 [1,0,0,0,0,0|0,0,0]=1 57 B13R1.45 O=C(O)CNC(=O)C1=CC=NC=C1 Z239129814 [1,0,0,0,0,0|1,0,0]=2 58 B13R1.45 O=C(O)CNC(=O)C1=CN=CC=C1 Z239129822 [1,0,0,0,0,0|1,0,0]=2 59 B13R1.45 O=C(O)CNC(=O)C1=NC=CC=C1 Z228588744 [1,0,0,0,0,0|1,0,0]=2 60 B13R1.149 C=C(C)CNCC1=CC(=CC=C1)O Z1741933704 [1,0,0,0,0,0|2,0,1]=4 61 B13R1.149 CC1=CC(=CC=C1)CNCC(=O)O Z1270446344 [1,0,0,0,0,0|1,0,1]=3 62 B13R1.149 CC1=CC(=CC=C1)COCC(=O)O Z1251362362 [1,0,0,0,0,0|2,0,1]=4 63 B13R1.149 CC1=CC(=CC=C1)CSCC(=O)O Z19692175 [1,0,0,0,0,0|2,0,1]=4 64 B13R1.149 CC1=CC(=CC=C1)OCCC(=O)O Z56805757 [1,0,0,0,0,0|3,0,0]=4 65 B13R1.149 O=C(O)C/C=C/C1=CC(=CC=C1)F Z1350606434 [1,0,0,0,0,0|2,0,0]=3 66 B13R1.149 O=C(O)CCCC1=CC(=CC=C1)Br Z1097106911 [1,0,0,0,0,0|2,0,1]=4 67 B13R1.149 O=C(O)CCCC1=CC(=CC=C1)Cl Z1198171600 [1,0,0,0,0,0|2,0,1]=4 68 B13R1.149 O=C(O)CCOC1=CC(=CC=C1)Br Z56893184 [1,0,0,0,0,0|3,0,0]=4 69 B13R1.149 O=C(O)CCOC1=CC(=CC=C1)Cl Z240085186 [1,0,0,0,0,0|3,0,0]=4 70 B13R1.149 O=C(O)CCOC1=CC(=CC=C1)F Z240085194 [1,0,0,0,0,0|3,0,0]=4 71 B13R1.149 O=C(O)CCOC1=CC(=CC=C1)I Z381428310 [1,0,0,0,0,0|3,0,0]=4 72 B13R1.149 O=C(O)CCSC1=CC(=CC=C1)Cl Z994465870 [1,0,0,0,0,0|3,0,0]=4 73 B13R1.149 O=C(O)CNCC1=CC(=CC=C1)Br Z239092040 [1,0,0,0,0,0|1,0,1]=3 74 B13R1.149 O=C(O)CNCC1=CC(=CC=C1)F Z763367852 [1,0,0,0,0,0|1,0,1]=3 75 B13R1.149 O=C(O)COCC1=CC(=CC=C1)Cl Z1258763876 [1,0,0,0,0,0|2,0,1]=4 76 B13R1.149 O=C(O)CSCC1=CC(=CC=C1)Br Z19692009 [1,0,0,0,0,0|2,0,1]=4 77 B13R1.149 O=C(O)CSCC1=CC(=CC=C1)Cl Z19691783 [1,0,0,0,0,0|2,0,1]=4 78 B15R1.65 CCC1=CC(=NC=C1)C(=O)NCC(=O)O Z2295580683 [0,1,0,0,0,0|2,0,0]=3 79 B15R1.65 COC1=CC(=CC=C1)C(=O)NCC(=O)O Z56794748 [0,1,0,0,0,0|0,0,0]=1 80 B15R1.65 COC1=NC=CC(=C1)C(=O)CCC(=O)O Z1685963122 [0,1,0,0,0,0|2,0,0]=3 81 B15R1.124 C=C(C)CNC(=O)C1=C(C(=CC=C1)O)O Z1741936085 [0,1,0,0,0,0|2,0,0]=3 82 B15R1.124 CC1=C(C(=CC=C1)C(=O)OCC(=O)N)C Z18481655 [0,1,0,0,0,0|3,0,0]=4 83 B15R1.124 CC1=C(C(=CC=C1)C(=O)OCC(=O)N)O Z18889561 [0,1,0,0,0,0|3,0,0]=4 84 B15R1.124 O=C(O)CNC(=O)C1=C(C(=CC=C1)Br)Cl Z1650121509 [0,1,0,0,0,0|1,0,0]=2 85 B15R1.133 CC1=CC(=CC=C1)C(=O)NNC(=O)CCl Z57284903 [0,1,0,0,0,0|3,0,0]=4 86 B15R1.133 CC[C@H](O)CNC(=O)C1=CC(=CN=C1)O Z2229592231 [0,1,0,0,0,0|2,0,1]=4 87 B15R1.133 CNC(=O)CNC(=O)C1=CC(=CC=C1)Br Z32016173 [0,1,0,0,0,0|2,0,0]=3 88 B15R1.133 CNC(=O)CNC(=O)C1=CC(=CC=C1)Cl Z32016123 [0,1,0,0,0,0|2,0,0]=3 89 B15R1.133 CNC(=O)CNC(=O)C1=CC(=CC=C1)N Z414741322 [0,1,0,0,0,0|2,0,0]=3 90 B15R1.133 CNC(=O)CNC(=O)C1=CC(=CN=C1)Br Z52305549 [0,1,0,0,0,0|3,0,0]=4 91 B15R1.133 CNC(=O)COC(=O)C1=CC(=CC=C1)I Z18359026 [0,1,0,0,0,0|3,0,0]=4 92 B15R1.133 COC(=O)CNC(=O)C1=CC(=CC=C1)Br Z20197490 [0,1,0,0,0,0|1,0,0]=2 93 B15R1.133 COC(=O)CNC(=O)C1=CC(=CC=C1)C Z19497353 [0,1,0,0,0,0|1,0,0]=2 94 B15R1.133 COC(=O)CNC(=O)C1=CC(=CC=C1)N Z239125272 [0,1,0,0,0,0|1,0,0]=2 95 B15R1.133 O=C(CCl)NNC(=O)C1=CC(=CC=C1)Cl Z56968577 [0,1,0,0,0,0|3,0,0]=4 96 B15R1.889 C=C(Cl)COC(=O)C1=CC(=C(C=C1)Br)O Z1494787444 [0,1,0,0,0,0|3,0,0]=4 97 B15R1.889 CC1=C(C=C(C=C1)C(=O)CCC(=O)N)C Z101186192 [0,1,0,0,0,0|3,0,0]=4 98 B15R1.889 CC1=C(C=C(C=C1)C(=O)CCC(=O)O)C Z99599542 [0,1,0,0,0,0|2,0,0]=3 99 B15R1.889 CC1=C(C=C(C=C1)C(=O)NCC(=O)O)C Z56884346 [0,1,0,0,0,0|1,0,0]=2 100 B15R1.889 CC1=C(C=C(C=C1)C(=O)NCC(=O)O)F Z224128906 [0,1,0,0,0,0|1,0,0]=2 101 B15R1.889 CC1=C(C=C(C=C1)C(=O)OCC(=O)N)C Z18752379 [0,1,0,0,0,0|3,0,0]=4 102 B15R1.889 CC1=C(C=C(C=C1)C(=O)OCC(=O)N)N Z56856657 [0,1,0,0,0,0|3,0,0]=4 103 B15R1.889 CC1=C(C=CC(=C1)C(=O)NCC(=O)O)Cl Z1455009926 [0,1,0,0,0,0|1,0,0]=2 104 B15R1.889 CC1=C(C=CC(=C1)C(=O)NCC(=O)O)I Z1443710972 [0,1,0,0,0,0|1,0,0]=2 105 B15R1.889 CC1=C(C=CC(=C1)C(=O)NCC(C)O)F Z1098328423 [0,1,0,0,0,0|2,0,1]=4 106 B15R1.889 C[C@@H](O)CNC(=O)C1=CC(=C(C=C1)F)F Z1566429385 [0,1,0,0,0,0|2,0,1]=4 107 B15R1.889 NC(=O)CNC(=O)C1=CC(=C(C=C1)I)Cl Z1347810888 [0,1,0,0,0,0|2,0,0]=3 108 B15R1.889 NC(=O)CNC(=O)C1=CC(=C(C=C1)I)F Z1165597426 [0,1,0,0,0,0|2,0,0]=3 109 B15R1.889 NC(=O)COC(=O)C1=CC(=C(C=C1)Br)O Z1494787652 [0,1,0,0,0,0|2,0,0]=3 110 B15R1.889 NC(=O)COC(=O)C1=CC(=C(C=C1)Cl)Cl Z19801012 [0,1,0,0,0,0|3,0,0]=4 111 B15R1.889 NC(=O)COC(=O)C1=CC(=C(C=C1)Cl)N Z18480164 [0,1,0,0,0,0|3,0,0]=4 112 B15R1.889 NC(=O)COC(=O)C1=CC(=C(C=C1)I)Cl Z1352279375 [0,1,0,0,0,0|3,0,0]=4 113 B15R1.889 O=C(O)/C=C/C(=O)C1=CC(=C(C=C1)F)F Z56886352 [0,1,0,0,0,0|2,0,1]=4 114 B15R1.889 O=C(O)CCC(=O)C1=CC(=C(C=C1)F)F Z285137176 [0,1,0,0,0,0|2,0,0]=3 115 B15R1.889 O=C(O)CNC(=O)C1=CC(=C(C=C1)Cl)Cl Z56921152 [0,1,0,0,0,0|1,0,0]=2 116 B15R1.889 O=C(O)CNC(=O)C1=CC(=C(C=C1)Cl)F Z1869504329 [0,1,0,0,0,0|1,0,0]=2 117 B15R1.889 O=C(O)CNC(=O)C1=CC(=C(C=C1)F)Cl Z1455012309 [0,1,0,0,0,0|1,0,0]=2 118 B15R1.889 O=C(O)CNC(=O)C1=CC(=C(C=C1)F)F Z57249053 [0,1,0,0,0,0|1,0,0]=2 119 B15R1.889 O=C(O)CNC(=O)C1=CC(=C(N=C1)Cl)Br Z2068979302 [0,1,0,0,0,0|2,0,0]=3 120 B15R1.889 O=C(O)CNC(=O)C1=CC(=C(N=C1)Cl)Cl Z85886822 [0,1,0,0,0,0|2,0,0]=3 121 B15R1.5450 CC1=CC(=CC(=C1)Br)C(=O)OCC(=O)N Z1698019829 [0,1,0,0,0,0|3,0,0]=4 122 B15R1.5450 CC1=CC(=CC(=C1)C(=O)NCC(=O)O)C Z56887675 [0,1,0,0,0,0|1,0,0]=2 123 B15R1.5450 CC1=CC(=CC(=C1)C(=O)NCC(C)O)C Z68385398 [0,1,0,0,0,0|2,0,1]=4 124 B15R1.5450 CC1=CC(=CC(=C1)C(=O)OCC(=O)N)C Z18420991 [0,1,0,0,0,0|3,0,0]=4 125 B15R1.5450 NC(=O)COC(=O)C1=CC(=CC(=C1)Cl)Cl Z18403820 [0,1,0,0,0,0|3,0,0]=4 126 B15R1.5450 NC(=O)COC(=O)C1=CC(=CC(=C1)F)F Z25079776 [0,1,0,0,0,0|3,0,0]=4 127 B15R1.5450 O=C(O)CNC(=O)C1=CC(=CC(=C1)F)F Z85887064 [0,1,0,0,0,0|1,0,0]=2 128 B15R1.5728 NC(=O)CNS(=O)(=O)C1=CC(=CC=C1)Br Z33545566 [0,1,0,0,0,0|3,0,0]=4 129 B15R1.5728 NC(=O)CNS(=O)(=O)C1=CC(=CC=C1)Cl Z33545365 [0,1,0,0,0,0|3,0,0]=4 130 B15R1.5728 O=C(O)CNS(=O)(=O)C1=CC(=CC=C1)Br Z45658614 [0,1,0,0,0,0|2,0,0]=3 131 B15R1.5728 O=C(O)CNS(=O)(=O)C1=CC(=CC=C1)Cl Z45658569 [0,1,0,0,0,0|2,0,0]=3 132 B15R1.5728 O=C(O)CNS(=O)(=O)C1=CC(=CC=C1)F Z45658551 [0,1,0,0,0,0|2,0,0]=3 133 B15R1.8271 CC(C1=CC(=CC=C1)Cl)N(C)CC(=O)O Z1459968361 [0,1,0,0,0,0|2,0,1]=4 134 B15R1.8271 CC(CC(=O)O)C(=O)C1=CC(=CC=C1)F Z838957084 [0,1,0,0,0,0|2,0,0]=3 135 B15R1.8271 CC1=CC=CC(=C1)C(=O)N(C)CC(=O)O Z85895348 [0,1,0,0,0,0|1,0,0]=2 136 B15R1.8271 CN(CC(=O)N)C(=O)C1=CC(=CC=C1)N Z415691580 [0,1,0,0,0,0|2,0,0]=3 137 B15R1.8271 CN(CC(=O)N)C(=O)C1=CC(=CN=C1)Br Z422952578 [0,1,0,0,0,0|3,0,0]=4 138 B15R1.8271 CN(CC(=O)O)C(=O)C1=CC(=CC=C1)Cl Z85895221 [0,1,0,0,0,0|1,0,0]=2 139 B15R1.8271 CN(CC(=O)O)C(=O)C1=CC(=CC=C1)F Z85895270 [0,1,0,0,0,0|1,0,0]=2 140 B15R1.8271 CN(CC(F)F)C(=O)C1=CC(=CC=C1)O Z1633150740 [0,1,0,0,0,0|2,0,1]=4 141 B15R1.8272 CC(CC(=O)C1=CC(=CC=C1)Br)C(=O)O Z838957320 [0,1,0,0,0,0|2,0,0]=3 142 B15R1.8272 CC(CC(=O)C1=CC(=CC=C1)F)C(=O)O Z838957304 [0,1,0,0,0,0|2,0,0]=3 143 B15R1.8272 CC1=CC=CC(=C1)C(=O)NC(C)C(=O)O Z56346865 [0,1,0,0,0,0|1,0,0]=2 144 B15R1.8272 CC1=CC=CC(=C1)C(=O)N[C@@H](C)C(=O)O Z57029692 [0,1,0,0,0,0|1,0,0]=2 145 B15R1.8272 CC1=CC=CC(=C1)C(=O)OC(C)C(=O)N Z18750526 [0,1,0,0,0,0|3,0,0]=4 146 B15R1.8272 C[C@@H](NC(=O)C1=CC(=CC=C1)I)C(=O)O Z829931072 [0,1,0,0,0,0|1,0,0]=2 147 B15R1.8272 NC(CC(O)C1=CC(=CC=C1)O)C(=O)O Z1510039445 [0,1,0,0,0,0|1,0,2]=4 148 B15R1.8277 CC(C)(O)CNC(=O)C1=CC(=CC=C1)Br Z1258730037 [0,1,0,0,0,0|2,0,1]=4 149 B15R1.8420 CC(O)CNC(=O)C1=C(C=CC(=C1)Br)I Z83769338 [0,1,0,0,0,0|2,0,1]=4 150 B15R1.8420 CC(O)CNC(=O)C1=C(C=CC(=C1)F)Cl Z1507358312 [0,1,0,0,0,0|2,0,1]=4 151 B15R1.8420 CC1=C(C=C(C=C1)Br)C(=O)OCC(=O)N Z1291197650 [0,1,0,0,0,0|3,0,0]=4 152 B15R1.8420 CC1=CC(=C(C=C1)C)C(=O)CCC(=O)N Z33546709 [0,1,0,0,0,0|3,0,0]=4 153 B15R1.8420 CC1=CC(=C(C=C1)C)C(=O)CCC(=O)O Z56886447 [0,1,0,0,0,0|2,0,0]=3 154 B15R1.8420 CC1=CC(=C(C=C1)C)C(=O)NCC(C)O Z68385397 [0,1,0,0,0,0|2,0,1]=4 155 B15R1.8420 CC1=CC(=C(C=C1)C)C(=O)OCC(=O)N Z18419430 [0,1,0,0,0,0|3,0,0]=4 156 B15R1.8420 NC(=O)COC(=O)C1=C(C=CC(=C1)Br)Cl Z18462300 [0,1,0,0,0,0|3,0,0]=4 157 B15R1.8420 NC(=O)COC(=O)C1=C(C=CC(=C1)Br)F Z28824346 [0,1,0,0,0,0|3,0,0]=4 158 B15R1.8420 NC(=O)COC(=O)C1=C(C=CC(=C1)F)Br Z98998154 [0,1,0,0,0,0|3,0,0]=4 159 B15R1.8420 NC(=O)COC(=O)C1=C(C=CC(=C1)I)O Z18984615 [0,1,0,0,0,0|3,0,0]=4 160 B15R1.8420 O=C(O)CCC(=O)C1=C(C=CC(=C1)Cl)Cl Z389933216 [0,1,0,0,0,0|2,0,0]=3 161 B15R1.8420 O=C(O)CCC(=O)C1=C(C=CC(=C1)F)F Z285137126 [0,1,0,0,0,0|2,0,0]=3 162 B15R1.8420 O=C(O)CNC(=O)C1=C(C=CC(=C1)Cl)Br Z1455020404 [0,1,0,0,0,0|1,0,0]=2 163 B15R2.7332 CC1=CC2=C(C=C1)NC(=O)CNC2=O Z1198267161 [0,0,0,1,0,0|2,0,0]=3 164 B15R2.7332 O=C1CCC(=O)C2=C(N1)C=CC(=C2)Cl Z1269174694 [0,0,0,1,0,0|3,0,0]=4 165 B15R2.7332 O=C1CCC(=O)C2=C(N1)C=CC(=C2)F Z1509197283 [0,0,0,1,0,0|3,0,0]=4 166 B15R2.7332 O=C1CNC(=O)C2=C(N1)C=CC(=C2)Br Z57234678 [0,0,0,1,0,0|2,0,0]=3 167 B15R2.7355 CC1=C2NC(=O)CCC(=O)C2=CC=C1 Z2786051901 [0,0,0,1,0,0|3,0,0]=4 168 B15R2.7355 O=C1CNC(=O)C2=CC=CC(=C2N1)Br Z1524650197 [0,0,0,1,0,0|2,0,0]=3 169 B13R1.129 CC1=CC=C(S1)C(=O)CCC(=O)O Z85918817 [0,0,0,0,1,0|3,0,0]=4 170 B13R1.129 CC1=CC=C(S1)C(=O)NCC(=O)O Z56891397 [0,0,0,0,1,0|2,0,0]=3 171 B13R1.129 O=C(O)CCC(=O)C1=CC(=CS1)Br Z1272697131 [0,0,0,0,1,0|3,0,0]=4 172 B13R1.129 O=C(O)CCC(=O)C1=CC=C(S1)Cl Z56886344 [0,0,0,0,1,0|3,0,0]=4 173 B13R1.129 O=C(O)CNC(=O)C1=CC(=CS1)Br Z1416188675 [0,0,0,0,1,0|2,0,0]=3 174 B13R1.129 O=C(O)CNC(=O)C1=CC=C(O1)Br Z56912006 [0,0,0,0,1,0|2,0,0]=3 175 B13R1.129 O=C(O)CNC(=O)C1=CC=C(S1)Br Z85887069 [0,0,0,0,1,0|2,0,0]=3 176 B13R1.147 C/C(=C\C(=O)O)/C1=CC(=CC=C1)Br Z352748382 [0,0,0,0,1,0|2,0,1]=4 177 B13R1.147 C/C(=C\C(=O)O)/C1=CC(=CC=C1)Cl Z352746932 [0,0,0,0,1,0|2,0,1]=4 178 B13R1.147 C/C(=C\C(=O)O)/C1=CC(=CC=C1)F Z352748162 [0,0,0,0,1,0|2,0,1]=4 179 B13R1.147 CC(=O)CC(=O)C1=CC(=CC=C1)Cl Z228582718 [0,0,0,0,1,0|2,0,0]=3 180 B13R1.147 CC(CC(=O)O)C1=CC(=CC=C1)F Z352781822 [0,0,0,0,1,0|2,0,1]=4 181 B13R1.147 CC1=CC(=CC=C1)C(N)CC(=O)O Z317027260 [0,0,0,0,1,0|2,0,1]=4 182 B13R1.147 N=C(N)NC(=O)C1=CC(=CC=C1)Cl Z3270320661 [0,0,0,0,1,0|3,0,0]=4 183 B13R1.147 NC(=O)NC(=O)C1=CC(=CC=C1)N Z1262625087 [0,0,0,0,1,0|2,0,0]=3 184 B13R1.147 NC(CC(=O)O)C1=CC(=CC=C1)Br Z56899123 [0,0,0,0,1,0|2,0,1]=4 185 B13R1.147 NC(CC(=O)O)C1=CC(=CC=C1)Cl Z317027314 [0,0,0,0,1,0|2,0,1]=4 186 B13R1.147 NC(CC(=O)O)C1=CC(=CC=C1)O Z352252742 [0,0,0,0,1,0|1,0,1]=3 187 B13R1.147 NC1=CC=CC(=C1)C(N)CC(=O)O Z1198161215 [0,0,0,0,1,0|2,0,1]=4 188 B13R1.147 O=C(O)CC(O)C1=CC(=CC=C1)F Z982132016 [0,0,0,0,1,0|1,0,2]=4 189 B13R1.168 CC1=C(C=CO1)C(=O)NCC(=O)O Z239129908 [0,0,0,0,1,0|2,0,0]=3 190 B13R1.168 CC1=C(C=NO1)C(=O)NCC(=O)O Z239129920 [0,0,0,0,1,0|3,0,0]=4 191 B13R1.168 CC1=NSC=C1C(=O)NCC(=O)O Z1269193501 [0,0,0,0,1,0|3,0,0]=4 192 B15R1.120 CC(O)CNC(=O)NC1=CC(=CC=C1)Cl Z124035894 [0,0,0,0,0,1|2,0,1]=4 193 B15R1.120 CC1=CC(=CC=C1)NC(=O)CCC(=O)O Z56176901 [0,0,0,0,0,1|2,0,0]=3 194 B15R1.120 CC1=CC(=CC=C1)NC(=O)NCC(=O)O Z228588698 [0,0,0,0,0,1|1,0,0]=2 195 B15R1.120 CC1=CC=CC(=C1)NC(=O)NCC(C)O Z124035908 [0,0,0,0,0,1|2,0,1]=4 196 B15R1.120 NC(=O)CNC(=O)CC1=CC(=CC=C1)Br Z1165598187 [0,0,0,0,0,1|2,0,0]=3 197 B15R1.120 O=C(O)/C=C/C(=O)NC1=CC(=CC=C1)F Z56176654 [0,0,0,0,0,1|2,0,1]=4 198 B15R1.120 O=C(O)/C=C/C(=O)NC1=CC(=CC=C1)O Z56176670 [0,0,0,0,0,1|1,0,1]=3 199 B15R1.120 O=C(O)CCC(=O)NC1=CC(=CC=C1)Cl Z56176918 [0,0,0,0,0,1|2,0,0]=3 200 B15R1.120 O=C(O)CNC(=O)CC1=CC(=CC=C1)Br Z905183598 [0,0,0,0,0,1|1,0,0]=2 201 B15R1.120 O=C(O)CNC(=O)CC1=CC(=CC=C1)F Z85887050 [0,0,0,0,0,1|1,0,0]=2 202 B15R1.120 O=C(O)CNC(=O)CC1=CC(=CC=C1)O Z816009634 [0,0,0,0,0,1|0,0,0]=1 203 B15R1.8273 CC1=CC(=CC=C1)C(=O)NCCC(=O)O Z56957409 [0,0,0,0,0,1|1,0,0]=2 204 B15R1.8273 CC1=NC(=CC=N1)C(=O)NCCC(=O)O Z1443838930 [0,0,0,0,0,1|3,0,0]=4 205 B15R1.8273 NC(=O)CCNC(=O)C1=CC(=CC=C1)N Z1160899503 [0,0,0,0,0,1|2,0,0]=3 206 B15R1.8273 O=C(O)CCNC(=O)C1=CC(=CC=C1)Cl Z85914364 [0,0,0,0,0,1|1,0,0]=2 207 B12R1.17 CCNC(=O)C1=CC(=CC=C1)Cl Z32024415 [2,0,0,0,0,0|1,0,1]=4 208 B12R1.17 CCNC(=O)C1=CC(=CC=C1)N Z90120590 [2,0,0,0,0,0|1,0,1]=4 209 B12R1.17 CCNC(=O)C1=CC(=CC=C1)O Z32024396 [2,0,0,0,0,0|0,0,1]=3 210 B12R1.30 C#CCNC(=O)C1=CC=CC=C1 Z52404005 [2,0,0,0,0,0|1,0,1]=4 211 B12R1.30 C=CCCC(=O)C1=CC=CC=C1 Z406376458 [2,0,0,0,0,0|2,0,0]=4 212 B12R1.30 C=CCNC(=O)C1=CC=NC=C1 Z32064550 [2,0,0,0,0,0|2,0,0]=4 213 B12R1.30 NCCNC(=O)C1=CC=CC=C1 Z235363051 [2,0,0,0,0,0|1,0,1]=4 214 B12R1.30 O=C(NCCO)C1=CC=CC=C1 Z31725250 [2,0,0,0,0,0|0,0,1]=3 215 B12R1.30 O=C(NCCO)C1=CC=NC=C1 Z31725198 [2,0,0,0,0,0|1,0,1]=4 216 B12R1.30 O=C(NCCO)C1=CN=CC=C1 Z31725207 [2,0,0,0,0,0|1,0,1]=4 217 B12R1.30 O=C(OCCO)C1=CC=CC=C1 Z228585788 [2,0,0,0,0,0|1,0,1]=4 218 B12R1.252 NC(=O)CNCC1=CC=CC=C1 Z90608463 [2,0,0,0,0,0|1,0,1]=4 219 B12R1.252 O=C(O)CC#CC1=CC=CC=C1 Z976639296 [2,0,0,0,0,0|1,0,1]=4 220 B12R1.252 O=C(O)CCCC1=CC=CC=C1 Z234895119 [2,0,0,0,0,0|1,0,1]=4 221 B12R1.252 O=C(O)CCNC1=CC=CC=C1 Z56899128 [2,0,0,0,0,0|2,0,0]=4 222 B12R1.252 O=C(O)CCOC1=CC=CC=C1 Z56854475 [2,0,0,0,0,0|2,0,0]=4 223 B12R1.252 O=C(O)CCSC1=CC=CC=C1 Z56821538 [2,0,0,0,0,0|2,0,0]=4 224 B12R1.252 O=C(O)CNCC1=CN=CC=C1 Z372854000 [2,0,0,0,0,0|1,0,1]=4 225 B12R1.252 O=C(O)CNCC1=NC=CC=C1 Z1259041052 [2,0,0,0,0,0|1,0,1]=4 226 B12R1.252 O=C(O)CSCC1=CC=CC=C1 Z19691777 [2,0,0,0,0,0|1,0,1]=4 227 B14R1.16 CC1=C(C=CC=C1N)C(=O)NCCO Z390184944 [1,1,0,0,0,0|1,0,1]=4 228 B14R1.20 COCCNC(=O)C1=CC(=CC=C1)Br Z27706976 [1,1,0,0,0,0|1,0,1]=4 229 B14R1.20 COCCNC(=O)C1=CC(=CC=C1)Cl Z31438079 [1,1,0,0,0,0|1,0,1]=4 230 B14R1.20 COCCNC(=O)C1=CC(=CC=C1)N Z239124524 [1,1,0,0,0,0|1,0,1]=4 231 B14R1.20 NCCCNC(=O)C1=CC(=CC=C1)O Z295405232 [1,1,0,0,0,0|1,0,1]=4 232 B14R1.36 CN(CCO)C(=O)C1=CC(=CC=C1)Cl Z68138288 [1,1,0,0,0,0|1,0,1]=4 233 B14R1.36 CN(CCO)C(=O)C1=CC(=CC=C1)F Z68138343 [1,1,0,0,0,0|1,0,1]=4 234 B14R1.36 CN(CCO)C(=O)C1=CC(=CC=C1)O Z636107972 [1,1,0,0,0,0|0,0,1]=3 235 B14R1.918 C=CCNC(=O)C1=C(C=CC(=C1)Br)F Z30518928 [1,1,0,0,0,0|2,0,0]=4 236 B14R1.918 C=CCNC(=O)C1=C(C=CC(=C1)Br)O Z30519264 [1,1,0,0,0,0|2,0,0]=4 237 B14R1.918 C=CCNC(=O)C1=C(C=CC(=C1)C)O Z68264658 [1,1,0,0,0,0|2,0,0]=4 238 B14R1.918 C=CCNC(=O)C1=C(C=CC(=C1)Cl)F Z108761590 [1,1,0,0,0,0|2,0,0]=4 239 B14R1.918 C=CCNC(=O)C1=C(C=CC(=C1)Cl)O Z68263768 [1,1,0,0,0,0|2,0,0]=4 240 B14R1.918 C=CCNC(=O)C1=C(C=CC(=C1)F)Br Z99110834 [1,1,0,0,0,0|2,0,0]=4 241 B14R1.918 C=CCNC(=O)C1=C(C=CC(=C1)F)Cl Z2209583893 [1,1,0,0,0,0|2,0,0]=4 242 B14R1.918 C=CCNC(=O)C1=C(C=CC(=C1)F)I Z993023498 [1,1,0,0,0,0|2,0,0]=4 243 B14R1.923 C=CCNC(=O)C1=CC(=CC(=C1)F)Br Z420014540 [1,1,0,0,0,0|2,0,0]=4 244 B14R1.923 O=C(NCCO)C1=CC(=CC(=C1)F)Br Z423238660 [1,1,0,0,0,0|1,0,1]=4 245 B14R1.923 O=C(NCCO)C1=CC(=CC(=C1)F)Cl Z1451236475 [1,1,0,0,0,0|1,0,1]=4 246 B14R1.934 C#CCNC(=O)C1=CC=CC(=C1)OC Z52404256 [1,1,0,0,0,0|1,0,1]=4 247 B14R1.934 C=CCNC(=O)C1=CC(=CC=C1)C#N Z32065253 [1,1,0,0,0,0|2,0,0]=4 248 B14R1.934 COC1=CC(=CC=C1)C(=O)NCCN Z235351547 [1,1,0,0,0,0|1,0,1]=4 249 B14R1.941 C=CCNC(=O)C1=CC(=C(C=C1)F)F Z82197192 [1,1,0,0,0,0|2,0,0]=4 250 B14R1.941 CC1=C(C=C(C=C1)C(=O)NCCO)Cl Z57261333 [1,1,0,0,0,0|1,0,1]=4 251 B14R1.160 CC(O)CNC(=O)C1=C(C=CC=C1)Br Z68385274 [1,1,0,0,0,0|1,0,1]=4 252 B14R1.160 CC(O)CNC(=O)C1=C(C=CC=C1)Cl Z68385275 [1,1,0,0,0,0|1,0,1]=4 253 B14R1.160 CC(O)CNC(=O)C1=C(C=CC=C1)I Z68386382 [1,1,0,0,0,0|1,0,1]=4 254 B14R1.160 CC1=C(C=CC=C1)C(=O)NCC(=O)O Z56983120 [1,1,0,0,0,0|0,0,0]=2 255 B14R1.160 NC(=O)COC(=O)C1=C(C=CC=C1)Br Z19670143 [1,1,0,0,0,0|2,0,0]=4 256 B14R1.160 NC(=O)COC(=O)C1=C(C=CC=C1)Cl Z19671704 [1,1,0,0,0,0|2,0,0]=4 257 B14R1.160 NC1=C(C=CC=C1)C(=O)CCC(=O)O Z4561593840 [1,1,0,0,0,0|1,0,0]=3 258 B14R1.160 NC1=C(C=CC=C1)C(=O)NCC(=O)[O-] Z4994098029 [1,1,0,0,0,0|0,0,1]=3 259 B14R1.160 O=C(O)CCC(=O)C1=C(C=CC=C1)Br Z838955710 [1,1,0,0,0,0|1,0,0]=3 260 B14R1.160 O=C(O)CNC(=O)C1=C(C=CC=C1)Br Z56945486 [1,1,0,0,0,0|0,0,0]=2 261 B14R1.160 O=C(O)CNC(=O)C1=C(C=CC=C1)Cl Z56827160 [1,1,0,0,0,0|0,0,0]=2 262 B14R1.160 O=C(O)CNC(=O)C1=C(C=CC=C1)F Z56822248 [1,1,0,0,0,0|0,0,0]=2 263 B14R1.160 O=C(O)CNC(=O)C1=C(C=CC=C1)I Z85887266 [1,1,0,0,0,0|0,0,0]=2 264 B14R1.160 O=C(O)CNC(=O)C1=C(C=CC=C1)O Z3478749045 [1,1,0,0,0,0|0,0,0]=2 265 B14R1.160 O=C(O)CNC(=O)C1=C(C=CC=N1)O Z608480544 [1,1,0,0,0,0|1,0,0]=3 266 B14R1.160 O=C(O)CNC(=O)C1=C(C=NC=C1)Br Z1869503454 [1,1,0,0,0,0|1,0,0]=3 267 B14R1.163 C=CC(=O)NNC(=O)C1=CC=CC=C1 Z1726087774 [1,1,0,0,0,0|2,0,0]=4 268 B14R1.163 CNC(=O)CNC(=O)C1=CC=CC=C1 Z32016429 [1,1,0,0,0,0|1,0,0]=3 269 B14R1.163 COC(=O)/C=C/C(=O)C1=CC=CC=C1 Z381040998 [1,1,0,0,0,0|1,0,1]=4 270 B14R1.163 N/C(=N\O)/CNC(=O)C1=CC=CC=C1 Z283822908 [1,1,0,0,0,0|1,0,0]=3 271 B14R1.163 NNC(=O)CNC(=O)C1=CN=CC=C1 Z1203154714 [1,1,0,0,0,0|2,0,0]=4 272 B14R1.163 O=C(CCl)NNC(=O)C1=CC=CC=C1 Z56872003 [1,1,0,0,0,0|2,0,0]=4 273 B14R1.415 CC(NC(=O)C1=CC=CC=C1)C(=O)O Z57229049 [1,1,0,0,0,0|0,0,0]=2 274 B14R1.415 CC(NC(=O)C1=CN=CC=C1)C(=O)N Z247459020 [1,1,0,0,0,0|2,0,0]=4 275 B14R1.415 CC(NC(C)C1=CC=CC=C1)C(=O)O Z1762658315 [1,1,0,0,0,0|1,0,1]=4 276 B14R1.415 C[C@@H](NC(=O)C1=NC=CC=C1)C(=O)O Z829930530 [1,1,0,0,0,0|1,0,0]=3 277 B14R1.415 C[C@H](NC(=O)C1=CC=CC=C1)C(=O)O Z56889031 [1,1,0,0,0,0|0,0,0]=2 278 B14R1.415 C[C@H](NC(=O)C1=NC=CC=C1)C(=O)O Z756424920 [1,1,0,0,0,0|1,0,0]=3 279 B14R1.415 NC(CC(=O)C1=CC=CC=C1)C(=O)O Z1459947400 [1,1,0,0,0,0|1,0,0]=3 280 B14R1.417 CN(CC(=O)O)C(=O)C1=CC=CC=C1 Z85895238 [1,1,0,0,0,0|0,0,0]=2 281 B14R1.417 CN(CC(=O)O)C(=O)C1=CC=NC=C1 Z239131718 [1,1,0,0,0,0|1,0,0]=3 282 B14R1.417 CN(CC(=O)O)C(=O)C1=NC=CC=C1 Z239131712 [1,1,0,0,0,0|1,0,0]=3 283 B14R1.417 O=C(O)CC(Br)C(=O)C1=CC=CC=C1 Z56886358 [1,1,0,0,0,0|1,0,0]=3 284 B14R1.678 CC(O)CNC(=O)C1=CC=C(C=C1)Br Z68385279 [1,1,0,0,0,0|1,0,1]=4 285 B14R1.678 CC(O)CNC(=O)C1=CC=C(C=C1)Cl Z68385286 [1,1,0,0,0,0|1,0,1]=4 286 B14R1.678 CC1=CC=C(C=C1)C(=O)/C=C/C(=O)O Z2768202101 [1,1,0,0,0,0|1,0,1]=4 287 B14R1.678 CC1=CC=C(C=C1)C(=O)CCC(=O)O Z56899081 [1,1,0,0,0,0|1,0,0]=3 288 B14R1.678 CC1=CC=C(C=C1)C(=O)NCC(=O)N Z33547062 [1,1,0,0,0,0|1,0,0]=3 289 B14R1.678 CC1=CC=C(C=C1)C(=O)NCC(=O)O Z56899118 [1,1,0,0,0,0|0,0,0]=2 290 B14R1.678 NC(=O)CNC(=O)C1=CC=C(C=C1)N Z239124972 [1,1,0,0,0,0|1,0,0]=3 291 B14R1.678 NC(=O)CNC(=O)C1=CC=C(C=C1)O Z253842400 [1,1,0,0,0,0|1,0,0]=3 292 B14R1.678 NC(=O)COC(=O)C1=CC=C(C=C1)Br Z19682631 [1,1,0,0,0,0|2,0,0]=4 293 B14R1.678 NC(=O)COC(=O)C1=CC=C(C=C1)Cl Z19702035 [1,1,0,0,0,0|2,0,0]=4 294 B14R1.678 NC(=O)COC(=O)C1=CC=C(C=C1)I Z19776695 [1,1,0,0,0,0|2,0,0]=4 295 B14R1.678 NC(=O)COC(=O)C1=CC=C(C=C1)O Z19674826 [1,1,0,0,0,0|2,0,0]=4 296 B14R1.678 NC1=CC=C(C=C1)C(=O)CCC(=O)O Z1255439771 [1,1,0,0,0,0|1,0,0]=3 297 B14R1.678 NC1=CC=C(C=C1)C(=O)NCC(=O)O Z104484866 [1,1,0,0,0,0|0,0,0]=2 298 B14R1.678 O=C(O)/C=C/C(=O)C1=CC=C(C=C1)F Z3219847233 [1,1,0,0,0,0|1,0,1]=4 299 B14R1.678 O=C(O)CCC(=O)C1=CC=C(C=C1)Br Z56860296 [1,1,0,0,0,0|1,0,0]=3 300 B14R1.678 O=C(O)CCC(=O)C1=CC=C(C=C1)Cl Z56860292 [1,1,0,0,0,0|1,0,0]=3 301 B14R1.678 O=C(O)CCC(=O)C1=CC=C(C=C1)F Z57984615 [1,1,0,0,0,0|1,0,0]=3 302 B14R1.678 O=C(O)CCC(=O)C1=CC=C(C=C1)I Z56899021 [1,1,0,0,0,0|1,0,0]=3 303 B14R1.678 O=C(O)CCC(=O)C1=CC=C(C=C1)O Z1255458188 [1,1,0,0,0,0|1,0,0]=3 304 B14R1.678 O=C(O)CCC(=O)C1=NC=C(C=C1)Cl Z1392165814 [1,1,0,0,0,0|2,0,0]=4 305 B14R1.678 O=C(O)CNC(=O)C1=CC=C(C=C1)Br Z56827662 [1,1,0,0,0,0|0,0,0]=2 306 B14R1.678 O=C(O)CNC(=O)C1=CC=C(C=C1)Cl Z56840113 [1,1,0,0,0,0|0,0,0]=2 307 B14R1.678 O=C(O)CNC(=O)C1=CC=C(C=C1)F Z56896220 [1,1,0,0,0,0|0,0,0]=2 308 B14R1.678 O=C(O)CNC(=O)C1=CC=C(C=C1)O Z285193230 [1,1,0,0,0,0|0,0,0]=2 309 B14R1.678 O=C(O)CNC(=O)C1=CN=C(C=C1)Cl Z85886785 [1,1,0,0,0,0|1,0,0]=3 310 B14R1.813 O=C(O)CCS(=O)(=O)C1=CC=CC=C1 Z56871817 [1,1,0,0,0,0|2,0,0]=4 311 B14R1.813 O=C(O)CNS(=O)(=O)C1=CC=CC=C1 Z45658533 [1,1,0,0,0,0|1,0,0]=3 312 B14R1.813 O=C(O)CNS(=O)(=O)C1=CN=CC=C1 Z223026198 [1,1,0,0,0,0|2,0,0]=4 313 B14R1.76 COC1=CC(=CC=C1)COCC(=O)O Z317026574 [1,1,0,0,0,0|1,0,1]=4 314 B14R1.76 COC1=CC(=CC=C1)NCCC(=O)O Z359506442 [1,1,0,0,0,0|2,0,0]=4 315 B14R1.76 COC1=CC(=CC=C1)OCCC(=O)O Z57772229 [1,1,0,0,0,0|2,0,0]=4 316 B14R1.76 N#CC1=CC=CC(=C1)CNCC(=O)O Z1318147497 [1,1,0,0,0,0|1,0,1]=4 317 B14R1.1025 COC(=O)CNCC1=CC(=CC=C1)Br Z1821397914 [1,1,0,0,0,0|1,0,1]=4 318 B14R1.1025 COC(=O)CNCC1=CC(=CC=C1)F Z763367856 [1,1,0,0,0,0|1,0,1]=4 319 B14R1.5956 CC(NCC1=CC(=CC=C1)F)C(=O)O Z426041634 [1,1,0,0,0,0|1,0,1]=4 320 B14R1.5978 CN(CC(=O)O)CC1=CC(=CC=C1)Cl Z1459897420 [1,1,0,0,0,0|1,0,1]=4 321 B14R1.162 COC(=O)CNC(=O)C1=CC=C(O1)Cl Z225302120 [0,1,0,0,1,0|2,0,0]=4 322 B14R1.162 COC(=O)CNC(=O)C1=CC=C(S1)C Z18893591 [0,1,0,0,1,0|2,0,0]=4 323 B14R1.162 COC(=O)CNC(=O)C1=COC(=C1)Br Z332762484 [0,1,0,0,1,0|2,0,0]=4 324 B14R1.4266 CN(CC(=O)O)C(=O)C1=CC=C(O1)Br Z85895292 [0,1,0,0,1,0|2,0,0]=4 325 B14R1.4266 CN(CC(=O)O)C(=O)C1=CC=C(S1)Br Z85895577 [0,1,0,0,1,0|2,0,0]=4 326 B14R1.4267 CC(NC(=O)C1=CC=C(O1)Br)C(=O)O Z57074586 [0,1,0,0,1,0|2,0,0]=4 327 B14R1.4267 CC(NC(=O)C1=CC=C(S1)Br)C(=O)O Z85890614 [0,1,0,0,1,0|2,0,0]=4 328 B14R1.4267 C[C@@H](NC(=O)C1=CSC(=C1)I)C(=O)O Z1341401912 [0,1,0,0,1,0|2,0,0]=4 329 B14R1.4354 CC1=CC(=C(O1)C)C(=O)NCC(=O)O Z85886894 [0,1,0,0,1,0|2,0,0]=4 330 B14R1.4354 CN1C=C(C=C1C(=O)NCC(=O)O)Br Z336030468 [0,1,0,0,1,0|2,0,0]=4 331 B14R1.74 COC1=CC(=CC=C1)/C(=C/C(=O)O)/C Z352747000 [0,1,0,0,1,0|1,0,1]=4 332 B14R1.74 COC1=CC(=CC=C1)C(C)CC(=O)O Z352782094 [0,1,0,0,1,0|1,0,1]=4 333 B14R1.4403 O=C(O)CS(=O)(=O)C1=CC(=CC=C1)Br Z255149888 [0,1,0,0,1,0|2,0,0]=4 334 B14R1.110 COC1=C(SC=C1)C(=O)NCC(=O)O Z1436233039 [0,1,0,0,1,0|1,0,0]=3 335 B14R1.4486 CN(CC(=O)O)C(=O)C1=CSC=C1Cl Z2738576141 [0,1,0,0,1,0|2,0,0]=4 336 B14R1.4487 C[C@@H](NC(=O)C1=C(C=CS1)Cl)C(=O)O Z1415948658 [0,1,0,0,1,0|2,0,0]=4 337 B16R1.41 COC1=CC(=CC=C1)NC(=O)/C=C/C(=O)O Z56176640 [0,1,0,0,0,1|1,0,1]=4 338 B16R1.41 COC1=CC(=CC=C1)NC(=O)NCC(C)O Z236580838 [0,1,0,0,0,1|1,0,1]=4 339 B16R1.41 N#CC1=CC=CC(=C1)NC(=O)CCC(=O)O Z56968175 [0,1,0,0,0,1|2,0,0]=4 340 B16R1.85 O=C(O)CNC(=O)CC1=C(C(=CC=C1)F)F Z1381137201 [0,1,0,0,0,1|1,0,0]=3 341 B16R1.1036 CC1=C(C=C(C=C1)CC(=O)NCC(=O)N)Br Z1778625285 [0,1,0,0,0,1|2,0,0]=4 342 B16R1.1036 CC1=C(C=C(C=C1)NC(=O)CCC(=O)O)C Z56176907 [0,1,0,0,0,1|2,0,0]=4 343 B16R1.1036 CC1=C(C=CC(=C1)NC(=O)CCC(=O)O)Br Z56176983 [0,1,0,0,0,1|2,0,0]=4 344 B16R1.1036 O=C(O)CNC(=O)CC1=CC(=C(C=C1)F)Br Z1443706882 [0,1,0,0,0,1|1,0,0]=3 345 B16R1.1148 CNC(=O)CNC(=O)NC1=CC(=CC=C1)Br Z409538538 [0,1,0,0,0,1|2,0,0]=4 346 B16R1.1148 CNC(=O)CNC(=O)NC1=CC(=CC=C1)C Z125693470 [0,1,0,0,0,1|2,0,0]=4 347 B16R1.1148 CNC(=O)CNC(=O)NC1=CC(=CC=C1)Cl Z125693456 [0,1,0,0,0,1|2,0,0]=4 348 B16R1.1148 COC(=O)CCC(=O)NC1=CC(=CC=C1)F Z276431334 [0,1,0,0,0,1|2,0,0]=4 349 B16R1.1148 COC(=O)CNC(=O)CC1=CC(=CC=C1)I Z1418977532 [0,1,0,0,0,1|1,0,0]=3 350 B16R1.7488 CC1=C(C=C(C=C1)Cl)NC(=O)CCC(=O)O Z56177036 [0,1,0,0,0,1|2,0,0]=4 351 B16R1.7488 CC1=CC(=C(C=C1)C)NC(=O)CCC(=O)O Z56176891 [0,1,0,0,0,1|2,0,0]=4 352 B16R1.11235 CC(NC(=O)CC1=CC(=CC=C1)Br)C(=O)O Z905183608 [0,1,0,0,0,1|1,0,0]=3 353 B16R1.11235 CC(NC(=O)NC1=CC(=CC=C1)F)C(=O)[O-] Z4525812005 [0,1,0,0,0,1|1,0,1]=4 354 B16R1.11235 C[C@@H](NC(=O)CC1=CC(=CC=C1)I)C(=O)O Z1455345951 [0,1,0,0,0,1|1,0,0]=3 355 B16R1.1091 CN1C=CC(=CC1=O)C(=O)NCCC(=O)O Z398833498 [0,1,0,0,0,1|1,0,1]=4 356 B16R1.1091 CS(=O)CCNC(=O)C1=CC(=C(C=C1)Br)O Z1495352260 [0,1,0,0,0,1|2,0,0]=4 357 B16R1.1091 NC(=O)CCNC(=O)C1=CC(=C(C=C1)F)N Z431594610 [0,1,0,0,0,1|2,0,0]=4 358 B16R1.1091 O=C(O)CCCC(=O)C1=CC(=C(C=C1)Cl)Cl Z389927310 [0,1,0,0,0,1|2,0,0]=4 359 B16R1.1143 COC(=O)CCNC(=O)C1=CC(=CC=C1)F Z31986613 [0,1,0,0,0,1|1,0,0]=3 360 B16R1.1143 COC(=O)CCNC(=O)C1=NC(=CC=C1)C Z286778440 [0,1,0,0,0,1|2,0,0]=4 361 B16R1.6863 CC1=CC(=CC(=C1)C(=O)NOCC(=O)N)C Z1582260676 [0,1,0,0,0,1|2,0,0]=4 362 B16R1.6863 CC1=CC(=CC(=C1)Cl)C(=O)NCCC(=O)O Z1438287275 [0,1,0,0,0,1|1,0,0]=3 363 B16R1.7492 O=C(O)CCNC(=O)C1=C(C=CC(=C1)F)Br Z224131692 [0,1,0,0,0,1|1,0,0]=3 364 B16R1.11195 CC1=CC=CC(=C1)C(=O)NC(C)CC(=O)O Z85971834 [0,1,0,0,0,1|1,0,0]=3 365 B16R1.11195 CC1=CN=CC(=C1)C(=O)N[C@H](C)CC(=O)O Z2752283770 [0,1,0,0,0,1|2,0,0]=4 366 B16R1.11196 CC(CNC(=O)C1=CC(=CC=C1)Br)C(=O)O Z994989580 [0,1,0,0,0,1|1,0,0]=3 367 B16R1.11196 CC1=CC=CC(=N1)C(=O)NCC(C)C(=O)O Z994989446 [0,1,0,0,0,1|2,0,0]=4 368 B16R1.11208 CC1=CC(=CC=C1)S(=O)(=O)NCCC(=O)O Z45532307 [0,1,0,0,0,1|2,0,0]=4 369 B16R1.11208 O=C(O)CCNS(=O)(=O)C1=CC(=CC=C1)Br Z45532350 [0,1,0,0,0,1|2,0,0]=4 370 B16R1.11208 O=C(O)CCNS(=O)(=O)C1=CC(=CC=C1)Cl Z45532312 [0,1,0,0,0,1|2,0,0]=4 371 B16R1.11208 O=C(O)CCNS(=O)(=O)C1=CC(=CC=C1)F Z45532297 [0,1,0,0,0,1|2,0,0]=4 372 B16R1.11264 CC1=C(C(=CC=C1)C(=O)NCCC(=O)O)Br Z1869534157 [0,1,0,0,0,1|1,0,0]=3 373 B16R1.11264 CC1=C(C=CC=C1Cl)C(=O)NCCC(=O)O Z1898640268 [0,1,0,0,0,1|1,0,0]=3 374 B16R1.11264 CC1=C(C=CC=C1I)C(=O)NCCC(=O)N Z1420453867 [0,1,0,0,0,1|2,0,0]=4 375 B16R1.19729 COC1=CC(=CC=C1)C(=O)CCCC(=O)O Z2050010042 [0,1,0,0,0,1|1,0,0]=3 376 B16R1.19729 COC1=CC(=CC=C1)C(=O)NCCC(=O)O Z85914387 [0,1,0,0,0,1|0,0,0]=2 377 B16R1.4544 CN(C)C1=CC(=NC=C1)C(=O)NCC(=O)O Z2295580636 [0,2,0,0,0,0|2,0,0]=4 378 B16R1.4544 O=C(O)CCC(=O)C1=CC(=CC=C1)[N+](=O)[O-] Z275171096 [0,2,0,0,0,0|1,0,1]=4 379 B16R1.4544 O=C(O)CNC(=O)C1=CC(=CC=C1)[N+](=O)[O-] Z56823546 [0,2,0,0,0,0|0,0,1]=3 380 B16R1.5386 COC1=CC(=CN=C1)S(=O)(=O)NCC(=O)O Z1983644598 [0,2,0,0,0,0|2,0,0]=4 381 B16R1.5386 N#CC1=CC=CC(=C1)S(=O)(=O)NCC(=O)O Z45658621 [0,2,0,0,0,0|2,0,0]=4 382 B16R1.19728 COC1=CC(=CC=C1)C(C)NC(C)C(=O)O Z1605251031 [0,2,0,0,0,0|1,0,1]=4 383 B16R1.19728 C[C@H](NC(=O)C1=CC(=CC=C1)C#N)C(=O)N Z1629023698 [0,2,0,0,0,0|2,0,0]=4 384 B16R1.20153 COC1=CC(=C(C=C1)Br)C(=O)OCC(=O)N Z25128127 [0,2,0,0,0,0|2,0,0]=4 385 B16R1.89 CNC(=O)CNC(=O)C1=C(C(=CC=C1)C)C Z52334693 [0,2,0,0,0,0|2,0,0]=4 386 B16R1.89 CNC(=O)CNC(=O)C1=C(C(=CC=C1)C)O Z252986936 [0,2,0,0,0,0|2,0,0]=4 387 B16R1.7308 CC1=C(C=CC=C1Br)S(=O)(=O)NCC(=O)O Z1531956745 [0,2,0,0,0,0|2,0,0]=4 388 B16R1.11263 CC(NC(=O)C1=C(C(=CC=C1)Cl)Cl)C(=O)O Z85890340 [0,2,0,0,0,0|1,0,0]=3 389 B16R1.11263 CC1=C(C=CC=C1Br)C(=O)N[C@H](C)C(=O)O Z1263878918 [0,2,0,0,0,0|1,0,0]=3 390 B16R1.11263 CC1=CC=CC(=C1Br)C(=O)N[C@@H](C)C(=O)N Z1629038978 [0,2,0,0,0,0|2,0,0]=4 391 B16R1.11263 CC1=CC=CC(=C1Br)C(=O)N[C@H](C)C(=O)O Z1869892707 [0,2,0,0,0,0|1,0,0]=3 392 B16R1.11263 CC1=CC=CC(=C1F)C(=O)N[C@H](C)C(=O)O Z1455346586 [0,2,0,0,0,0|1,0,0]=3 393 B16R1.11263 CC1=CC=CC(=C1O)C(=O)N[C@H](C)C(=O)O Z829930930 [0,2,0,0,0,0|1,0,0]=3 394 B16R1.59 CCNC(=O)CNC(=O)C1=CC(=CC=C1)C Z32024153 [0,2,0,0,0,0|2,0,0]=4 395 B16R1.59 CCNC(=O)CNC(=O)C1=CC(=CC=C1)Cl Z32024155 [0,2,0,0,0,0|2,0,0]=4 396 B16R1.59 CCOC(=O)CNC(=O)C1=NC(=CC=C1)C Z594037364 [0,2,0,0,0,0|2,0,0]=4 397 B16R1.59 CCOC(=O)CNC(=O)C1=NC=CC(=C1)Cl Z292725454 [0,2,0,0,0,0|2,0,0]=4 398 B16R1.59 CONC(=O)CNC(=O)C1=CC(=CC=C1)Br Z245507792 [0,2,0,0,0,0|1,0,0]=3 399 B16R1.1125 COC(=O)[C@H](C)NC(=O)C1=CC(=CC=C1)C Z56931844 [0,2,0,0,0,0|1,0,0]=3 400 B16R1.1129 COC(=O)CN(C)C(=O)C1=CC(=CC=C1)O Z236936706 [0,2,0,0,0,0|0,0,0]=2 401 B16R1.1304 COC(=O)CNS(=O)(=O)C1=CC(=CC=C1)N Z1529490729 [0,2,0,0,0,0|2,0,0]=4 402 B16R1.7441 CNC(=O)CNC(=O)C1=C(C=CC(=C1)Br)Cl Z52305564 [0,2,0,0,0,0|2,0,0]=4 403 B16R1.7441 CNC(=O)CNC(=O)C1=C(C=CC(=C1)Br)F Z52304953 [0,2,0,0,0,0|2,0,0]=4 404 B16R1.7441 CNC(=O)CNC(=O)C1=C(C=CC(=C1)Br)O Z52305585 [0,2,0,0,0,0|2,0,0]=4 405 B16R1.7441 CNC(=O)CNC(=O)C1=C(C=CC(=C1)C)O Z247283508 [0,2,0,0,0,0|2,0,0]=4 406 B16R1.7441 COC(=O)CNC(=O)C1=C(C=CC(=C1)Br)F Z32887532 [0,2,0,0,0,0|1,0,0]=3 407 B16R1.7441 COC(=O)CNC(=O)C1=C(C=CC(=C1)Br)O Z68369732 [0,2,0,0,0,0|1,0,0]=3 408 B16R1.7441 COC(=O)CNC(=O)C1=C(C=CC(=C1)C)C Z32888049 [0,2,0,0,0,0|1,0,0]=3 409 B16R1.7441 COC(=O)CNC(=O)C1=C(C=CC(=C1)C)O Z68370617 [0,2,0,0,0,0|1,0,0]=3 410 B16R1.7441 COC(=O)CNC(=O)C1=C(C=CC(=C1)Cl)O Z68369734 [0,2,0,0,0,0|1,0,0]=3 411 B16R1.7441 COC(=O)CNC(=O)C1=C(C=CC(=C1)F)Br Z100752378 [0,2,0,0,0,0|1,0,0]=3 412 B16R1.7445 CNC(=O)CNC(=O)C1=CC(=CC(=C1)F)F Z52332081 [0,2,0,0,0,0|2,0,0]=4 413 B16R1.7445 COC(=O)CNC(=O)C1=CC(=CC(=C1)C)C Z18606531 [0,2,0,0,0,0|1,0,0]=3 414 B16R1.7445 COC(=O)CNC(=O)C1=CC(=CC(=C1)Cl)Cl Z32888041 [0,2,0,0,0,0|1,0,0]=3 415 B16R1.7445 COC(=O)CNC(=O)C1=CC(=CC(=C1)F)Br Z419897414 [0,2,0,0,0,0|1,0,0]=3 416 B16R1.7454 CNC(=O)CNC(=O)C1=CC(=C(C=C1)C)C Z32016181 [0,2,0,0,0,0|2,0,0]=4 417 B16R1.7454 CNC(=O)CNC(=O)C1=CC(=C(C=C1)C)F Z117363746 [0,2,0,0,0,0|2,0,0]=4 418 B16R1.7454 COC(=O)CNC(=O)C1=CC(=C(C=C1)C)C Z20209978 [0,2,0,0,0,0|1,0,0]=3 419 B16R1.7454 COC(=O)CNC(=O)C1=CC(=C(C=C1)C)F Z116534358 [0,2,0,0,0,0|1,0,0]=3 420 B16R1.7454 COC(=O)CNC(=O)C1=CC(=C(C=C1)C)I Z1090882774 [0,2,0,0,0,0|1,0,0]=3 421 B16R1.7454 COC(=O)CNC(=O)C1=CC(=C(C=C1)I)F Z1127723230 [0,2,0,0,0,0|1,0,0]=3 422 B16R1.7454 COC(=O)CNC(=O)C1=CC(=C(N=C1)Cl)Cl Z32888161 [0,2,0,0,0,0|2,0,0]=4 423 B16R1.7454 COC(=O)COC(=O)C1=CC(=C(C=C1)F)Br Z1291197149 [0,2,0,0,0,0|2,0,0]=4 424 B16R1.1063 CC1=C(C=C(C=C1)S(=O)(=O)NCC(=O)O)C Z45658573 [0,2,0,0,0,0|2,0,0]=4 425 B16R1.1063 O=C(O)CNS(=O)(=O)C1=CC(=C(C=C1)Cl)Cl Z45658558 [0,2,0,0,0,0|2,0,0]=4 426 B16R1.1090 CC(NC(=O)C1=CC(=O)N(C=C1)C)C(=O)O Z398841382 [0,2,0,0,0,0|1,0,1]=4 427 B16R1.1090 CC1=C(C=C(C=C1)C(=O)NC(C)C(=O)O)O Z239130614 [0,2,0,0,0,0|0,0,0]=2 428 B16R1.1090 CC1=C(C=CC(=C1)C(=O)N[C@@H](C)C(=O)N)Cl Z1629030795 [0,2,0,0,0,0|2,0,0]=4 429 B16R1.1090 CC1=C(C=CC(=C1)C(=O)N[C@@H](C)C(=O)N)F Z1629036793 [0,2,0,0,0,0|2,0,0]=4 430 B16R1.1090 C[C@@H](NC(=O)C1=CC(=C(C=C1)Br)F)C(=O)O Z851821398 [0,2,0,0,0,0|1,0,0]=3 431 B16R1.4296 COC1=C(C=C(C=C1)C(=O)CCC(=O)O)F Z425469558 [0,2,0,0,0,0|2,0,0]=4 432 B16R1.4296 COC1=C(C=C(C=C1)C(=O)NCC(=O)O)Cl Z85887344 [0,2,0,0,0,0|1,0,0]=3 433 B16R1.11345 CC1=C(C=C(C(=C1)O)C(=O)CCC(=O)O)Br Z3045492290 [0,2,0,0,0,0|2,0,0]=4 434 B16R1.52957 O=C([O-])COC(=O)C1=CC(=C(C(=C1)O)O)O Z2242052799 [0,2,0,0,0,0|1,0,1]=4 435 B16R1.6851 CC(NC(=O)C1=CC(=CC(=C1)Cl)Cl)C(=O)N Z167475948 [0,2,0,0,0,0|2,0,0]=4 436 B16R1.6851 CC1=CC(=CC(=C1)Cl)C(=O)N[C@H](C)C(=O)O Z1438287788 [0,2,0,0,0,0|1,0,0]=3 437 B16R1.37887 CC1=CC(=CC(=C1)Br)S(=O)(=O)NCC(=O)O Z1839616715 [0,2,0,0,0,0|2,0,0]=4 438 B16R1.11207 CC(NS(=O)(=O)C1=CC(=CC=C1)Cl)C(=O)O Z45674809 [0,2,0,0,0,0|2,0,0]=4 439 B16R1.40243 CC1=CC(=C(C=C1)C)S(=O)(=O)NCC(=O)O Z45658572 [0,2,0,0,0,0|2,0,0]=4 440 B16R1.40243 O=C(O)CNS(=O)(=O)C1=C(C=CC(=C1)Cl)F Z2049906506 [0,2,0,0,0,0|2,0,0]=4 441 B16R1.1679 CCN(CC(=O)O)C(=O)C1=CC(=CC=C1)Br Z728838222 [0,2,0,0,0,0|1,0,0]=3 442 B16R1.1679 CCN(CC(=O)O)C(C)C1=CC(=CC=C1)O Z1459978546 [0,2,0,0,0,0|1,0,1]=4 443 B16R1.11399 CC1=C(C=C(C=C1)N)C(=O)N(C)CC(=O)O Z1543178306 [0,2,0,0,0,0|1,0,0]=3 444 B16R1.630 O=C(NC(CO)C(=O)O)C1=CC(=CC=C1)Br Z98648465 [0,2,0,0,0,0|1,0,0]=3 445 B16R1.630 O=C(N[C@@H](CO)C(=O)O)C1=NC(=CC=C1)F Z1504507390 [0,2,0,0,0,0|2,0,0]=4 446 B16R1.11443 CC1=C(C=C(C=C1)F)C(=O)N[C@@H](C)C(=O)N Z1629031977 [0,2,0,0,0,0|2,0,0]=4 447 B16R1.54296 CC(C)(NC(=O)C1=CC(=CN=C1)Br)C(=O)O Z801820942 [0,2,0,0,0,0|2,0,0]=4 448 B16R1.4361 COC1=C(C=C(C=C1)Br)C(=O)CCC(=O)O Z56921793 [0,2,0,0,0,0|2,0,0]=4 449 B16R1.4361 COC1=C(C=C(C=C1)C)C(=O)CCC(=O)O Z56886431 [0,2,0,0,0,0|2,0,0]=4 450 B14R1.4526 O=C(O)CNC(=O)/C=C/C1=CC=CO1 Z85886706 [0,0,1,1,0,0|0,0,0]=2 451 B14R1.4526 O=C(O)CNC(=O)NCC1=CC=CO1 Z278201192 [0,0,1,1,0,0|1,0,1]=4 452 B14R2.685 O=C1NCCCC2=C(C=CC=C12)O Z1509192845 [1,0,0,1,0,0|1,0,1]=4 453 B14R2.5637 NC1=CC2=C(C=C1)OCCNC2=O Z1255366808 [1,0,0,1,0,0|1,0,1]=4 454 B14R2.5637 O=C1NCCOC2=C1C=C(C=C2)Br Z1269206073 [1,0,0,1,0,0|1,0,1]=4 455 B14R2.5637 O=C1NCCOC2=C1C=C(C=C2)F Z1198159494 [1,0,0,1,0,0|1,0,1]=4 456 B14R2.8051 NC1=C2C(=O)NNC(=O)C2=CC=C1 Z56813244 [1,0,0,1,0,0|2,0,0]=4 457 B14R2.8751 O=C1NNC(=O)C2=C1C=CC(=C2)Cl Z1813178453 [1,0,0,1,0,0|2,0,0]=4 458 B14R2.9036 O=C(NC1CC1)C2=CC=CC(=C2)O Z32367764 [1,0,0,1,0,0|1,0,1]=4 459 B14R2.287 O=C1CCC(=O)C2=C(N1)C=CC=C2 Z1198159646 [1,0,0,1,0,0|2,0,0]=4 460 B14R2.287 O=C1CNC(=O)C2=C(N1)C=CC=C2 Z57234677 [1,0,0,1,0,0|1,0,0]=3 461 B14R2.25733 O=C1CC(C2=C1C=CC=C2)C(=O)O Z1079167836 [1,0,0,1,0,0|1,0,0]=3 462 B14R2.25733 O=C1NC(C2=C1C=CC=C2)C(=O)O Z1255419749 [1,0,0,1,0,0|0,0,0]=2 463 B14R2.25733 O=C1OC(C2=C1C=CC=C2)C(=O)O Z1198161402 [1,0,0,1,0,0|1,0,0]=3 464 B14R2.29285 O=C1NCS(=O)(=O)C2=C1C=CC=C2 Z1509188786 [1,0,0,1,0,0|1,0,1]=4 465 B14R2.4476 O=C(O)C1CC1C2=CC(=CC=C2)O Z1216651566 [1,0,0,1,0,0|1,0,1]=4 466 B14R2.4476 O=C(O)[C@H]1C[C@@H]1C2=CC(=CC=C2)O Z1262554401 [1,0,0,1,0,0|1,0,1]=4 467 B14R2.8053 O=C(O)C1CCC2=C1C(=CC=C2)O Z1486018098 [1,0,0,1,0,0|1,0,1]=4 468 B14R2.8045 O=C1NC(=O)C2=CC=CC(=C2N1)F Z1198266470 [0,0,0,1,1,0|2,0,0]=4 469 B14R2.8235 CC1=CC(=O)C2=C(O1)C=CC(=C2)O Z1513597250 [0,0,0,1,1,0|1,0,1]=4 470 B14R2.8235 CC1=CC(=O)OC2=C1C=C(C=C2)O Z1255438517 [0,0,0,1,1,0|1,0,1]=4 471 B14R2.8235 CC1CC(=O)OC2=C1C=C(C=C2)O Z1513898194 [0,0,0,1,1,0|1,0,1]=4 472 B14R2.8235 NC1=CC2=C(C=C1)OC(=O)NC2=O Z1262652219 [0,0,0,1,1,0|1,0,0]=3 473 B14R2.8235 O=C1NC(=O)C2=C(N1)C=CC(=C2)Br Z1269212070 [0,0,0,1,1,0|2,0,0]=4 474 B14R2.8235 O=C1NC(=O)C2=C(N1)C=CC(=C2)Cl Z1201617625 [0,0,0,1,1,0|2,0,0]=4 475 B14R2.8235 O=C1NC(=O)C2=C(N1)C=CC(=C2)F Z1503739886 [0,0,0,1,1,0|2,0,0]=4 476 B14R2.8235 O=C1NC(=O)C2=C(O1)C=CC(=C2)Br Z1269169632 [0,0,0,1,1,0|1,0,0]=3 477 B14R2.8235 O=C1NC(=O)C2=C(O1)C=CC(=C2)Cl Z1262692006 [0,0,0,1,1,0|1,0,0]=3 478 B14R2.8235 O=C1NC(=O)C2=C(O1)C=CC(=C2)F Z1262693326 [0,0,0,1,1,0|1,0,0]=3 479 B14R2.8235 O=C1NC2=C(C=C(C=C2)O)C(=O)O1 Z1201620590 [0,0,0,1,1,0|2,0,0]=4 480 B16R2.2982 CC(=O)CN1C(=O)OC2=C1C=CC(=C2)Br Z402374682 [0,0,0,1,0,1|2,0,0]=4 481 B16R2.2982 NC(=O)CN1C(=O)OC2=C1C=CC(=C2)Br Z397955404 [0,0,0,1,0,1|2,0,0]=4 482 B16R2.2982 NC(=O)CN1C(=O)OC2=C1C=CC(=C2)Cl Z98996956 [0,0,0,1,0,1|2,0,0]=4 483 B16R2.2982 O=C(O)CN1C(=O)CC2=C1C=CC(=C2)F Z1813155410 [0,0,0,1,0,1|1,0,0]=3 484 B16R2.2982 O=C(O)CN1C(=O)OC2=C1C=CC(=C2)Br Z402374770 [0,0,0,1,0,1|1,0,0]=3 485 B16R2.2982 O=C(O)CN1C(=O)SC2=C1C=CC(=C2)Br Z1509669264 [0,0,0,1,0,1|1,0,0]=3 486 B16R2.12541 O=C1CC(C2=C(N1)C=C(C=C2)F)C(=O)O Z223437774 [0,0,0,1,0,1|2,0,0]=4 487 B16R2.22910 O=C(O)CN1C(=O)OC2=C1C(=CC=C2)F Z1813105285 [0,0,0,1,0,1|1,0,0]=3 488 B16R2.24665 NC1=CC2=C(C=C1)C(=CNC2=O)C(=O)O Z1888380267 [0,0,0,1,0,1|1,0,1]=4 489 B16R2.22890 O=C(O)C1=CC2=C(C=CC=C2Br)C(=O)N1 Z1737947953 [0,1,0,1,0,0|1,0,1]=4 490 B16R2.133113 O=C1CNC(=O)C2=CC(=C(C=C2N1)F)F Z5004116160 [0,1,0,1,0,0|2,0,0]=4 491 B16R2.23501 O=C(O)C1=CC(=O)C2=C(O1)C=CC(=C2)O Z1508924489 [0,1,0,1,0,0|1,0,1]=4 492 B16R2.23501 O=C(O)C1=CC2=C(C=C(C=C2)Br)C(=O)N1 Z1737948004 [0,1,0,1,0,0|1,0,1]=4 493 B16R2.23501 O=C(O)C1=CC2=C(C=C(C=C2)Cl)C(=O)N1 Z1737947985 [0,1,0,1,0,0|1,0,1]=4 494 B16R2.23501 O=C1CC(OC2=C1C=C(C=C2)Cl)C(=O)O Z1509523066 [0,1,0,1,0,0|2,0,0]=4 495 B16R2.23501 O=C1CC(OC2=C1C=C(C=C2)F)C(=O)O Z1508922784 [0,1,0,1,0,0|2,0,0]=4 496 B16R2.23501 O=C1OC(CC2=C1C=C(C=C2)Br)C(=O)O Z1737943582 [0,1,0,1,0,0|2,0,0]=4 497 B16R2.23501 O=C1OC(CC2=C1C=C(C=C2)F)C(=O)O Z1737943513 [0,1,0,1,0,0|2,0,0]=4 498 B12R1.54 O=C(O)CCC(=O)C1=CC=CN1 Z1262513633 [1,0,0,0,1,0|2,0,0]=4 499 B12R1.54 O=C(O)CCC(=O)C1=CC=CS1 Z56857914 [1,0,0,0,1,0|2,0,0]=4 500 B12R1.54 O=C(O)CNC(=O)C1=CC=CS1 Z56886259 [1,0,0,0,1,0|1,0,0]=3 501 B12R1.54 O=C(O)CNC(=O)C1=COC=C1 Z239129918 [1,0,0,0,1,0|1,0,0]=3 502 B12R1.54 O=C(O)CNC(=O)C1=CSC=C1 Z224128734 [1,0,0,0,1,0|1,0,0]=3 503 B12R1.54 O=C(O)CNC(=O)C1=CSC=N1 Z1079452368 [1,0,0,0,1,0|2,0,0]=4 504 B12R1.107 C/C(=C\C(=O)O)/C1=CC=CC=C1 Z352748396 [1,0,0,0,1,0|1,0,1]=4 505 B12R1.107 CC(=O)CC(=O)C1=CC=NC=C1 Z359504772 [1,0,0,0,1,0|2,0,0]=4 506 B12R1.107 CC(=O)CC(=O)C1=CN=CC=C1 Z57157128 [1,0,0,0,1,0|2,0,0]=4 507 B12R1.107 CC(CC(=O)O)C1=CC=CC=C1 Z56899204 [1,0,0,0,1,0|1,0,1]=4 508 B12R1.107 CN(CC(=O)O)C1=CC=CC=C1 Z1162448842 [1,0,0,0,1,0|2,0,0]=4 509 B12R1.107 N=C(N)NC(=O)C1=CC=CC=C1 Z1198149259 [1,0,0,0,1,0|2,0,0]=4 510 B12R1.107 NC(CC(=O)O)C1=CC=CC=C1 Z94601171 [1,0,0,0,1,0|1,0,1]=4 511 B12R1.107 N[C@@H](CC(=O)O)C1=CC=CC=C1 Z756925772 [1,0,0,0,1,0|1,0,1]=4 512 B12R1.107 N[C@H](CC(=O)O)C1=CC=CC=C1 Z1696091779 [1,0,0,0,1,0|1,0,1]=4 513 B12R1.107 O=C(O)/C=C(\I)/C1=CC=CC=C1 Z3379426714 [1,0,0,0,1,0|1,0,1]=4 514 B12R1.107 O=C(O)CC(O)C1=CC=CC=C1 Z982132010 [1,0,0,0,1,0|0,0,2]=4 515 B12R1.107 O=C(O)NC(=O)C1=CC=CC=C1 Z56928966 [1,0,0,0,1,0|0,0,0]=2 516 B12R1.226 CC1=CC(=CC=C1)/C=C/C(=O)O Z2942851787 [1,0,0,0,1,0|1,0,1]=4 517 B12R1.226 CC1=CC(=CC=C1)CCC(=O)O Z169993866 [1,0,0,0,1,0|1,0,1]=4 518 B12R1.226 CC1=CC(=CC=C1)NCC(=O)N Z104589324 [1,0,0,0,1,0|2,0,0]=4 519 B12R1.226 CC1=CC(=CC=C1)OCC(=O)O Z56899056 [1,0,0,0,1,0|2,0,0]=4 520 B12R1.226 CC1=CC(=CC=C1)SCC(=O)O Z778642574 [1,0,0,0,1,0|2,0,0]=4 521 B12R1.226 NC(=O)CNC1=CC(=CC=C1)Br Z104587998 [1,0,0,0,1,0|2,0,0]=4 522 B12R1.226 NC(=O)CNC1=CC(=CC=C1)F Z104640682 [1,0,0,0,1,0|2,0,0]=4 523 B12R1.226 NC(=O)COC1=CC(=CC=C1)O Z381415558 [1,0,0,0,1,0|2,0,0]=4 524 B12R1.226 NC1=CC(=CC=C1)/C=C/C(=O)O Z2942853438 [1,0,0,0,1,0|1,0,1]=4 525 B12R1.226 O=C(O)/C=C/C1=CC(=CC=C1)Br Z2312942093 [1,0,0,0,1,0|1,0,1]=4 526 B12R1.226 O=C(O)/C=C/C1=CC(=CC=C1)Cl Z2573655238 [1,0,0,0,1,0|1,0,1]=4 527 B12R1.226 O=C(O)/C=C/C1=CC(=CC=C1)F Z2935925467 [1,0,0,0,1,0|1,0,1]=4 528 B12R1.226 O=C(O)/C=C/C1=CC(=CC=C1)O Z247613734 [1,0,0,0,1,0|0,0,1]=3 529 B12R1.226 O=C(O)/C=C/C1=CC(=CN=C1)O Z1518653071 [1,0,0,0,1,0|1,0,1]=4 530 B12R1.226 O=C(O)/C=C/C1=CC(=NC=C1)O Z2633787192 [1,0,0,0,1,0|1,0,1]=4 531 B12R1.226 O=C(O)CCC1=CC(=CC=C1)Br Z56943439 [1,0,0,0,1,0|1,0,1]=4 532 B12R1.226 O=C(O)CCC1=CC(=CC=C1)F Z185153196 [1,0,0,0,1,0|1,0,1]=4 533 B12R1.226 O=C(O)CCC1=CC(=CC=C1)O Z317038038 [1,0,0,0,1,0|0,0,1]=3 534 B12R1.226 O=C(O)CCC1=CC(=CN=C1)O Z1504676734 [1,0,0,0,1,0|1,0,1]=4 535 B12R1.226 O=C(O)CNC1=CC(=CC=C1)Cl Z274534700 [1,0,0,0,1,0|1,0,0]=3 536 B12R1.226 O=C(O)COC1=CC(=CC=C1)Br Z56812737 [1,0,0,0,1,0|2,0,0]=4 537 B12R1.226 O=C(O)COC1=CC(=CC=C1)Cl Z57008935 [1,0,0,0,1,0|2,0,0]=4 538 B12R1.226 O=C(O)CSC1=CC(=CC=C1)Br Z255149890 [1,0,0,0,1,0|2,0,0]=4 539 B12R1.226 O=C(O)CSC1=CC(=CC=C1)Cl Z994465872 [1,0,0,0,1,0|2,0,0]=4 540 B12R1.226 O=C(O)CSC1=CC(=CC=C1)F Z1198220671 [1,0,0,0,1,0|2,0,0]=4 541 B12R1.226 O=C(O)CSC1=CC(=CC=C1)O Z1262555002 [1,0,0,0,1,0|1,0,0]=3 542 B12R1.225 CC1=CC(=CC=C1)C(=O)C(=O)O Z1255379743 [0,0,0,0,2,0|1,0,0]=3 543 B12R1.225 NC(C(=O)O)C1=CC(=CC=C1)O Z1532541074 [0,0,0,0,2,0|1,0,1]=4 544 B14R1.34 C=CCNC(=O)CC1=CC=CC(=C1)F Z32065255 [1,0,0,0,0,1|2,0,0]=4 545 B14R1.34 C=CCNC(=O)NC1=CC=CC(=C1)Br Z409541702 [1,0,0,0,0,1|2,0,0]=4 546 B14R1.34 C=CCNC(=O)NC1=CC=CC(=C1)C Z55295502 [1,0,0,0,0,1|2,0,0]=4 547 B14R1.34 C=CCNC(=O)NC1=CC=CC(=C1)Cl Z55295478 [1,0,0,0,0,1|2,0,0]=4 548 B14R1.34 C=CCNC(=O)NC1=CC=CC(=C1)I Z410005736 [1,0,0,0,0,1|2,0,0]=4 549 B14R1.34 CCCNC(=O)NC1=CC(=CC=C1)O Z55290397 [1,0,0,0,0,1|1,0,1]=4 550 B14R1.420 C/C(=N\OCC(=O)O)/C1=CC=CC=C1 Z56808172 [1,0,0,0,0,1|1,0,1]=4 551 B14R1.420 O=C(O)CCCC(=O)C1=CC=CC=C1 Z361415342 [1,0,0,0,0,1|1,0,0]=3 552 B14R1.420 O=C(O)CCNC(=O)C1=CC=CC=C1 Z56854345 [1,0,0,0,0,1|0,0,0]=2 553 B14R1.420 O=C(O)CCNC(=O)C1=CC=NC=C1 Z228588434 [1,0,0,0,0,1|1,0,0]=3 554 B14R1.420 O=C(O)CCNC(=O)C1=NC=CN=C1 Z224131372 [1,0,0,0,0,1|2,0,0]=4 555 B14R1.420 O=C(O)CSCC(=O)C1=CC=CC=C1 Z275368768 [1,0,0,0,0,1|1,0,0]=3 556 B14R1.423 CC(CC1=CC=CC=C1)NCC(=O)O Z2235792090 [1,0,0,0,0,1|1,0,1]=4 557 B14R1.423 CC(O)CNC(=O)CC1=CC=CC=C1 Z68385325 [1,0,0,0,0,1|1,0,1]=4 558 B14R1.423 CC(O)CNC(=O)NC1=CC=CC=C1 Z104955688 [1,0,0,0,0,1|1,0,1]=4 559 B14R1.423 C[C@H](O)CNC(=O)NC1=CC=CC=C1 Z1563512128 [1,0,0,0,0,1|1,0,1]=4 560 B14R1.423 NC(CC1=CC=CC=C1)NCC(=O)O Z57032609 [1,0,0,0,0,1|1,0,1]=4 561 B14R1.423 O=C(O)/C=C/C(=O)NC1=CC=CC=C1 Z56176633 [1,0,0,0,0,1|1,0,1]=4 562 B14R1.423 O=C(O)CCC(=O)NC1=CC=CC=C1 Z56176896 [1,0,0,0,0,1|1,0,0]=3 563 B14R1.423 O=C(O)CCC(=O)NC1=CN=CC=C1 Z429593776 [1,0,0,0,0,1|2,0,0]=4 564 B14R1.423 O=C(O)CCC(=O)NC1=NC=CC=C1 Z57103931 [1,0,0,0,0,1|2,0,0]=4 565 B14R1.423 O=C(O)CNC(=O)CC1=CC=CC=C1 Z56963417 [1,0,0,0,0,1|0,0,0]=2 566 B14R1.423 O=C(O)CNC(=O)NC1=CC=CC=C1 Z56760696 [1,0,0,0,0,1|0,0,0]=2 567 B14R1.148 CC1=CC(=CC=C1)CNCCC(=O)O Z415636682 [1,0,0,0,0,1|1,0,1]=4 568 B14R1.148 O=C(O)CCCCC1=CC(=CC=C1)O Z1262513974 [1,0,0,0,0,1|1,0,1]=4 569 B14R1.148 O=C(O)CCNCC1=CC(=CC=C1)Cl Z449369192 [1,0,0,0,0,1|1,0,1]=4 570 B14R1.148 O=C(O)CCNCC1=CC(=CC=C1)F Z1695822100 [1,0,0,0,0,1|1,0,1]=4 571 B14R1.4488 O=C(O)CCNC(=O)C1=C(C=CS1)Br Z1157749168 [0,0,0,0,1,1|2,0,0]=4 572 B16R1.11236 CC1=CC(=CC=C1)NC(=O)CCCC(=O)O Z56755386 [0,0,0,0,0,2|2,0,0]=4 573 B16R1.11236 CC1=CC(=CC=C1)NC(=O)CSCC(=O)O Z19691822 [0,0,0,0,0,2|2,0,0]=4 574 B16R1.11236 NC(=O)CCNC(=O)CC1=CC(=CC=C1)I Z1420453749 [0,0,0,0,0,2|2,0,0]=4 575 B16R1.11236 NC(=O)CCNC(=O)NC1=CC(=CC=C1)N Z431597000 [0,0,0,0,0,2|2,0,0]=4 576 B16R1.11236 O=C(O)CCCC(=O)NC1=CC(=CC=C1)Cl Z57126721 [0,0,0,0,0,2|2,0,0]=4 577 B16R1.11236 O=C(O)CCNC(=O)CC1=CC(=CC=C1)O Z816009638 [0,0,0,0,0,2|0,0,0]=2 578 B16R1.11236 O=C(O)COCC(=O)NC1=CC(=CC=C1)Br Z90492782 [0,0,0,0,0,2|2,0,0]=4 579 B16R1.11236 O=C(O)CSCC(=O)NC1=CC(=CC=C1)Br Z19691833 [0,0,0,0,0,2|2,0,0]=4 580 B16R1.11186 CC(=O)NCCNC(=O)C1=CC(=CC=C1)Br Z27226809 [0,0,0,0,0,2|2,0,0]=4 581 B16R1.11186 CC(=O)NCCNC(=O)C1=CC(=CC=C1)Cl Z32152927 [0,0,0,0,0,2|2,0,0]=4 582 B16R1.11186 CC(=O)NCCNC(=O)C1=CC(=CC=C1)F Z32153277 [0,0,0,0,0,2|2,0,0]=4 583 B16R1.11186 O=C(O)C/C=C/NC(=O)C1=CC(=NC=C1)Br Z5771953311 [0,0,0,0,0,2|2,0,0]=4 584 B16R1.11186 O=C(O)CCCNC(=O)C1=CC(=CN=C1)Br Z362779524 [0,0,0,0,0,2|2,0,0]=4