0 B14R1.694 C=C(C)CS(=O)(=O)C1=CC=C(C=C1)C S771120 [0,0,0,0,0,0|3,0,0]=3 1 B14R1.694 CC(=O)CS(=O)(=O)C1=CC=C(C=C1)C S454745 [0,0,0,0,0,0|2,0,0]=2 2 B14R1.694 CC(=O)NS(=O)(=O)C1=CC=C(C=C1)C S914762 [0,0,0,0,0,0|1,0,0]=1 3 B14R1.694 CC(=O)NS(=O)(=O)C1=CC=C(C=C1)Cl PH010664 [0,0,0,0,0,0|1,0,0]=1 4 B14R1.694 CC(C)NS(=O)(=O)C1=CC=C(C=C1)Br PH011645 [0,0,0,0,0,0|2,0,1]=3 5 B14R1.694 CC(C)NS(=O)(=O)C1=CC=C(C=C1)Cl PH004502 [0,0,0,0,0,0|2,0,1]=3 6 B14R1.694 CC1=CC=C(C=C1)S(=O)(=O)/C=C(\C)/I S779105 [0,0,0,0,0,0|3,0,0]=3 7 B14R1.694 CC1=CC=C(C=C1)S(=O)(=O)/N=C(/C)\N R333360 [0,0,0,0,0,0|2,0,1]=3 8 B14R1.694 CC1=CC=C(C=C1)S(=O)(=O)CC(=O)Cl S531111 [0,0,0,0,0,0|3,0,0]=3 9 B14R1.694 CC1=CC=C(C=C1)S(=O)(=O)CC(=O)N S400106 [0,0,0,0,0,0|3,0,0]=3 10 B14R1.694 CC1=CC=C(C=C1)S(=O)(=O)CC(=O)O PH010925 [0,0,0,0,0,0|3,0,0]=3 11 B14R1.694 CC1=CC=C(C=C1)S(=O)(=O)N=C([S-])[S-] S44750 [0,0,0,0,0,0|2,1,1]=4 12 B14R1.694 CC1=CC=C(C=C1)S(=O)(=O)NC(=N)N PH009832 [0,0,0,0,0,0|3,0,0]=3 13 B14R1.694 CC1=CC=C(C=C1)S(=O)(=O)NC(=O)N CDS003387 [0,0,0,0,0,0|2,0,0]=2 14 B14R1.694 CC1=CC=C(C=C1)S(=O)(=O)NC(C)C PH004084 [0,0,0,0,0,0|2,0,1]=3 15 B14R1.694 CC1=CC=C(C=C1)S(=O)(=O)NN(C)C PH010567 [0,0,0,0,0,0|3,0,0]=3 16 B14R1.694 NC(=O)CS(=O)(=O)C1=CC=C(C=C1)Cl S614467 [0,0,0,0,0,0|3,0,0]=3 17 B14R1.694 NC(=O)CS(=O)(=O)C1=CC=C(C=C1)N R993239 [0,0,0,0,0,0|2,0,0]=2 18 B14R1.694 NC(=O)NS(=O)(=O)C1=CC=C(C=C1)Cl L259063 [0,0,0,0,0,0|2,0,0]=2 19 B14R1.694 NC(=O)NS(=O)(=O)C1=CC=C(C=C1)N S441104 [0,0,0,0,0,0|1,0,0]=1 20 B13R1.29 C=CCS(=O)(=O)C1=CC=C(C=C1)C S863211 [1,0,0,0,0,0|2,0,1]=4 21 B13R1.132 CC(=O)CC(=O)C1=CC=C(C=C1)Cl JRD0754 [1,0,0,0,0,0|3,0,0]=4 22 B13R1.132 CC(=O)NC(=O)C1=CC=C(C=C1)Cl PH009070 [1,0,0,0,0,0|2,0,0]=3 23 B13R1.132 CC(C)NC(=O)C1=CC=C(C=C1)N CBR01240 [1,0,0,0,0,0|2,0,1]=4 24 B13R1.132 NC(=O)NC(=O)C1=CC=C(C=C1)N PH007186 [1,0,0,0,0,0|2,0,0]=3 25 B13R1.347 C/C(=C\S(=O)(=O)C1=CC=CC=C1)/I S778966 [1,0,0,0,0,0|2,0,0]=3 26 B13R1.347 CC(=O)NS(=O)(=O)C1=CC=CC=C1 PH008266 [1,0,0,0,0,0|0,0,0]=1 27 B13R1.347 CN(C)NS(=O)(=O)C1=CC=CC=C1 PH008170 [1,0,0,0,0,0|2,0,0]=3 28 B13R1.347 NC(=O)NS(=O)(=O)C1=CC=CC=C1 S756342 [1,0,0,0,0,0|1,0,0]=2 29 B15R1.904 CC(C)(C)NS(=O)(=O)C1=CC=C(C=C1)Br PH011216 [0,1,0,0,0,0|2,0,1]=4 30 B15R1.904 CC(C)(C)NS(=O)(=O)C1=CC=C(C=C1)Cl PH011215 [0,1,0,0,0,0|2,0,1]=4 31 B15R1.904 CC(C)(C)NS(=O)(=O)C1=CC=C(C=C1)F PH010387 [0,1,0,0,0,0|2,0,1]=4 32 B15R1.904 CC1=CC=C(C=C1)S(=O)(=O)NC(C)(C)C PH003323 [0,1,0,0,0,0|2,0,1]=4 33 B15R1.904 CC1=CC=C(C=C1)S(=O)(=O)NS(=O)(=O)C S27023 [0,1,0,0,0,0|2,0,0]=3 34 B15R1.904 CS(=O)(=O)CS(=O)(=O)C1=CC=C(C=C1)Cl S588342 [0,1,0,0,0,0|3,0,0]=4 35 B15R1.979 CC1=CC=C(C=C1)S(=O)(=O)NC(=O)CCl PH009037 [0,1,0,0,0,0|1,0,0]=2 36 B15R1.979 CC1=CC=C(C=C1)S(=O)(=O)NC(=O)NN PH009016 [0,1,0,0,0,0|2,0,0]=3 37 B15R1.979 CNC(=O)NS(=O)(=O)C1=CC=C(C=C1)Cl PH008158 [0,1,0,0,0,0|1,0,0]=2 38 B15R1.979 CNC(=S)NS(=O)(=O)C1=CC=C(C=C1)C PH009200 [0,1,0,0,0,0|1,1,0]=3 39 B15R1.979 COC(=O)NS(=O)(=O)C1=CC=C(C=C1)C R746495 [0,1,0,0,0,0|1,0,0]=2 40 B15R1.11348 CC(C(=O)O)S(=O)(=O)C1=CC=C(C=C1)F CDS023283 [0,1,0,0,0,0|3,0,0]=4 41 B13R1.522 CC1=CC=C(C=C1)S(=O)(=O)C(C)C S799254 [0,0,0,0,1,0|2,0,1]=4 42 B13R1.522 CC1=CC=C(C=C1)S(=O)(=O)N(C)C PH009895 [0,0,0,0,1,0|3,0,0]=4 43 B13R1.522 CN(C)S(=O)(=O)C1=CC=C(C=C1)N CDS014211 [0,0,0,0,1,0|2,0,0]=3 44 B15R1.903 CC(=O)CCS(=O)(=O)C1=CC=C(C=C1)C S287997 [0,0,0,0,0,1|2,0,0]=3 45 B15R1.903 CC(=O)NCS(=O)(=O)C1=CC=C(C=C1)C S28720 [0,0,0,0,0,1|1,0,0]=2 46 B15R1.903 CC1=CC=C(C=C1)S(=O)(=O)CCC(=O)O S195006 [0,0,0,0,0,1|3,0,0]=4 47 B15R1.903 CC1=CC=C(C=C1)S(=O)(=O)CCC(=O)O S271373 [0,0,0,0,0,1|3,0,0]=4 48 B15R1.903 CC1=CC=C(C=C1)S(=O)(=O)NCC(=O)N PH000314 [0,0,0,0,0,1|2,0,0]=3 49 B15R1.903 CC1=CC=C(C=C1)S(=O)(=O)NCC(=O)O R993182 [0,0,0,0,0,1|2,0,0]=3 50 B15R1.903 CC1=CC=C(C=C1)S(=O)(=O)NN=C(C)C T284165 [0,0,0,0,0,1|2,0,0]=3 51 B15R1.903 CC1=CC=C(C=C1)S(=O)(=O)OCC(=O)O PH010932 [0,0,0,0,0,1|3,0,0]=4 52 B15R1.903 NC(=O)CNS(=O)(=O)C1=CC=C(C=C1)N L100838 [0,0,0,0,0,1|1,0,0]=2 53 B15R1.903 NC1=CC=C(C=C1)S(=O)(=O)NCC(=O)O PH011545 [0,0,0,0,0,1|1,0,0]=2 54 B15R1.903 O=C(O)CNS(=O)(=O)C1=CC=C(C=C1)Cl R992984 [0,0,0,0,0,1|2,0,0]=3 55 B12R1.9 C=CS(=O)(=O)C1=CC=C(C=C1)C S778230 [2,0,0,0,0,0|1,0,1]=4 56 B12R1.9 CCS(=O)(=O)C1=CC=C(C=C1)Cl TMT00215 [2,0,0,0,0,0|1,0,1]=4 57 B12R1.9 CCS(=O)(=O)C1=CC=C(C=C1)F PH003114 [2,0,0,0,0,0|1,0,1]=4 58 B12R1.9 CSS(=O)(=O)C1=CC=C(C=C1)C S765090 [2,0,0,0,0,0|2,0,0]=4 59 B12R1.9 NC1=CC=C(C=C1)S(=O)(=O)CCl T163201 [2,0,0,0,0,0|1,0,1]=4 60 B12R1.9 NC1=CC=C(C=C1)S(=O)(=O)O[TlH2] S826138 [2,0,0,0,0,0|2,0,0]=4 61 B12R1.9 NNS(=O)(=O)C1=CC=C(C=C1)Br S953105 [2,0,0,0,0,0|2,0,0]=4 62 B12R1.9 NNS(=O)(=O)C1=CC=C(C=C1)Cl S841382 [2,0,0,0,0,0|2,0,0]=4 63 B12R1.9 NNS(=O)(=O)C1=CC=C(C=C1)I S944998 [2,0,0,0,0,0|2,0,0]=4 64 B12R1.16 CCNC(=O)C1=CC=C(C=C1)N CBR02271 [2,0,0,0,0,0|1,0,1]=4 65 B12R1.39 CCCS(=O)(=O)C1=CC=CC=C1 PH006990 [2,0,0,0,0,0|1,0,1]=4 66 B12R1.39 CCNS(=O)(=O)C1=CC=CC=C1 PH009839 [2,0,0,0,0,0|0,0,1]=3 67 B12R1.21 CC(=O)NCC1=CC=C(C=C1)Cl PH009464 [2,0,0,0,0,0|2,0,0]=4 68 B12R1.107 CC(=O)NN(C)C1=CC=CC=C1 PH007050 [2,0,0,0,0,0|2,0,0]=4 69 B12R1.107 NC(=O)NC(=O)C1=CC=CC=C1 S450545 [2,0,0,0,0,0|2,0,0]=4 70 B14R1.125 C(=O)NCS(=O)(=O)C1=CC=C(C=C1)C S697435 [1,1,0,0,0,0|1,0,0]=3 71 B14R1.125 C=CCNS(=O)(=O)C1=CC=C(C=C1)Br PH010690 [1,1,0,0,0,0|1,0,1]=4 72 B14R1.125 C=CCNS(=O)(=O)C1=CC=C(C=C1)C S38734 [1,1,0,0,0,0|1,0,1]=4 73 B14R1.125 CC1=CC=C(C=C1)S(=O)(=O)/C=C/CCl S759554 [1,1,0,0,0,0|2,0,0]=4 74 B14R1.125 CC1=CC=C(C=C1)S(=O)(=O)NCCBr PH010820 [1,1,0,0,0,0|1,0,1]=4 75 B14R1.125 CC1=CC=C(C=C1)S(=O)(=O)NCCCl TMT00093 [1,1,0,0,0,0|1,0,1]=4 76 B14R1.125 CCONS(=O)(=O)C1=CC=C(C=C1)C R270954 [1,1,0,0,0,0|1,0,1]=4 77 B14R1.125 NC1=CC=C(C=C1)S(=O)(=O)NCCO S671754 [1,1,0,0,0,0|0,0,1]=3 78 B14R1.125 O=S(=O)(NCCBr)C1=CC=C(C=C1)Cl PH015510 [1,1,0,0,0,0|1,0,1]=4 79 B14R1.125 O=S(=O)(NCCO)C1=CC=C(C=C1)Br PH010866 [1,1,0,0,0,0|1,0,1]=4 80 B14R1.10 CCC(=O)NC(=O)C1=CC=C(C=C1)Cl PH009104 [1,1,0,0,0,0|2,0,0]=4 81 B14R1.741 COC(=O)NS(=O)(=O)C1=CC=CC=C1 R466158 [1,1,0,0,0,0|0,0,0]=2 82 B14R1.3335 CC(C)(C)NS(=O)(=O)C1=CC=CC=C1 R344877 [1,1,0,0,0,0|1,0,1]=4 83 B16R1.1048 CC1=CC=C(C=C1)S(=O)(=O)N(C)CC(=O)O PH010831 [0,1,0,0,0,1|2,0,0]=4 84 B16R1.1049 CC(NS(=O)(=O)C1=CC=C(C=C1)Cl)C(=O)O R993107 [0,1,0,0,0,1|2,0,0]=4 85 B16R1.1049 CC1=CC=C(C=C1)S(=O)(=O)N[C@@H](C)C(=O)O CDS004033 [0,1,0,0,0,1|2,0,0]=4 86 B16R1.1063 CC1=C(C=C(C=C1)S(=O)(=O)NCC(=O)O)Cl R992887 [0,1,0,0,0,1|2,0,0]=4 87 B16R1.1303 COC(=O)/C=C\S(=O)(=O)C1=CC=C(C=C1)F T247693 [0,1,0,0,0,1|2,0,0]=4 88 B16R1.1303 COC(=O)CNS(=O)(=O)C1=CC=C(C=C1)Br EME00175 [0,1,0,0,0,1|1,0,0]=3 89 B16R1.953 CCNC(=O)NS(=O)(=O)C1=CC=C(C=C1)C S380628 [0,2,0,0,0,0|1,0,0]=3 90 B16R1.953 CCOC(=O)CS(=O)(=O)C1=CC=C(C=C1)C S531138 [0,2,0,0,0,0|2,0,0]=4 91 B16R1.953 CCOC(=O)NS(=O)(=O)C1=CC=C(C=C1)Cl PH006333 [0,2,0,0,0,0|1,0,0]=3 92 B14R2.4643 CC1=CS(=O)(=O)C2=CC=C(C=C12)Cl CDS004539 [1,0,0,1,0,0|2,0,0]=4 93 B14R2.4643 CC1=CS(=O)(=O)C2=CC=C(C=C12)F T313335 [1,0,0,1,0,0|2,0,0]=4 94 B14R2.8189 O=C1CS(=O)(=O)C2=C(N1)C=CC=C2 PH000428 [1,0,0,1,0,0|2,0,0]=4 95 B12R1.20 CC(=O)N(C)C1=CC=C(C=C1)N R750425 [1,0,0,0,1,0|2,0,0]=4 96 B14R1.678 CC(=O)NCC(=O)C1=CC=C(C=C1)Br PH005212 [1,0,0,0,0,1|2,0,0]=4 97 B14R1.678 CC(=O)NCC(=O)C1=CC=C(C=C1)Cl PH000535 [1,0,0,0,0,1|2,0,0]=4 98 B14R1.678 NC(=O)CNC(=O)C1=CC=C(C=C1)N PH010085 [1,0,0,0,0,1|2,0,0]=4 99 B14R1.813 CC(=CCS(=O)(=O)C1=CC=CC=C1)C T203556 [1,0,0,0,0,1|2,0,0]=4 100 B14R1.813 CC(=NNS(=O)(=O)C1=CC=CC=C1)C S870544 [1,0,0,0,0,1|1,0,0]=3 101 B14R1.813 CC(=O)CCS(=O)(=O)C1=CC=CC=C1 T223158 [1,0,0,0,0,1|1,0,0]=3 102 B14R1.813 NC(=O)CCS(=O)(=O)C1=CC=CC=C1 S194832 [1,0,0,0,0,1|2,0,0]=4 103 B14R1.813 O=C(O)CNS(=O)(=O)C1=CC=CC=C1 OTV000052 [1,0,0,0,0,1|1,0,0]=3 104 B16R1.1050 CC1=CC=C(C=C1)S(=O)(=O)N/N=C/C(=O)O T294179 [0,0,0,0,0,2|2,0,0]=4