0 B12R1.194 CCS(=O)(=O)CC1=CC=CC=C1 PH000278 [0,0,0,0,0,0|1,0,2]=3 1 B12R1.194 CNS(=O)(=O)CC1=CC=CC=C1 PH011278 [0,0,0,0,0,0|2,0,1]=3 2 B12R1.194 O=S(=O)(CCl)CC1=CC=CC=C1 T163902 [0,0,0,0,0,0|2,0,1]=3 3 B11R1.40 C=CC(=C)SC1=CC=CC=C1 S767840 [1,0,0,0,0,0|2,1,0]=4 4 B11R1.40 CCC(=O)OC1=CC=CC=C1 CDS000560 [1,0,0,0,0,0|1,0,2]=4 5 B11R1.40 NNC(=O)OC1=CC=CC=C1 PH009655 [1,0,0,0,0,0|3,0,0]=4 6 B11R1.509 CS(=O)(=O)CC1=CC=CC=C1 PH011646 [1,0,0,0,0,0|1,0,1]=3 7 B11R1.509 CS(=O)(=O)NC1=CC=CC=N1 T326070 [1,0,0,0,0,0|2,0,1]=4 8 B11R1.509 CS(=O)(=O)OC1=CN=CC=C1 PH009192 [1,0,0,0,0,0|1,0,1]=3 9 B11R1.509 NS(=O)(=O)OC1=CC=CC=C1 PH008054 [1,0,0,0,0,0|1,0,0]=2 10 B11R1.509 O=P(O)(O)OC1=CC=CC=C1 CDS010546 [1,0,0,0,0,0|2,0,1]=4 11 B11R1.509 O=S(=O)(Cl)CC1=CC=CN=C1 CDS010417 [1,0,0,0,0,0|3,0,0]=4 12 B11R1.509 O=S(=O)(Cl)CC1=CC=NC=C1 CDS007189 [1,0,0,0,0,0|3,0,0]=4 13 B11R1.509 O=S(=O)([O-])CC1=CC=CC=C1 S808962 [1,0,0,0,0,0|2,0,0]=3 14 B13R1.249 CNS(=O)(=O)OC1=CC=C(C=C1)Cl PH008057 [0,1,0,0,0,0|1,0,1]=3 15 B13R1.249 O=S(=O)(CCl)CC1=CC=C(C=C1)Cl T164216 [0,1,0,0,0,0|2,0,1]=4 16 B13R1.249 O=S(=O)(CCl)CC1=CC=C(C=C1)F T164194 [0,1,0,0,0,0|2,0,1]=4 17 B13R1.263 CN(C1=CC=CC=C1)S(=O)(=O)CBr T275689 [0,1,0,0,0,0|2,0,1]=4 18 B13R1.263 COS(=O)(=O)C(C)C1=CC=CC=C1 S486043 [0,1,0,0,0,0|2,0,1]=4 19 B13R1.1073 CN(C)S(=O)(=O)CC1=CC=CC=C1 T299715 [0,1,0,0,0,0|2,0,1]=4 20 B13R1.1073 CN(C)S(=O)(=O)NC1=CC=CC=C1 PH010688 [0,1,0,0,0,0|2,0,1]=4 21 B13R1.1073 O=S(=O)(CC1=CC=CC=C1)C(Br)Br T169161 [0,1,0,0,0,0|2,0,1]=4 22 B13R1.1073 O=S(=O)(CC1=CC=CC=C1)C(Cl)Cl T164038 [0,1,0,0,0,0|2,0,1]=4 23 B13R1.1327 C(=C/S(=O)(=O)CC1=CC=CC=C1)\C T299219 [0,1,0,0,0,0|1,0,0]=2 24 B13R1.1327 NCCS(=O)(=O)CC1=CC=CC=C1 T299170 [0,1,0,0,0,0|1,0,2]=4 25 B13R1.1327 O=S(=O)(CCCl)CC1=CC=CC=C1 S614416 [0,1,0,0,0,0|1,0,2]=4 26 B13R1.1327 O=S(=O)(CCO)CC1=CC=CC=C1 T299723 [0,1,0,0,0,0|1,0,2]=4 27 B13R2.222 O=S1(=O)CCC2=C(C1)C=CC=C2 T163694 [0,0,0,1,0,0|1,0,2]=4 28 B11R1.7 CNS(=O)(=O)C1=CC=CC=C1 PH010973 [0,0,0,0,1,0|1,0,1]=3 29 B11R1.7 COS(=O)(=O)C1=CC=CC=C1 S544795 [0,0,0,0,1,0|1,0,1]=3 30 B11R1.7 O=S(=O)(N[Na])C1=CC=CC=C1 T283754 [0,0,0,0,1,0|2,0,0]=3 31 B13R1.254 O=S(=O)(CBr)NCC1=CC=CC=C1 T274798 [0,0,0,0,0,1|2,0,1]=4 32 B10R1.17 C=CCSC1=CC=CC=C1 S614246 [2,0,0,0,0,0|1,1,0]=4 33 B10R1.18 O=N(=O)CC1=CC=CC=C1 MNO000012 [2,0,0,0,0,0|2,0,0]=4 34 B12R1.106 CC1=CC=C(C=C1)NS(=O)(=O)C T100080 [1,1,0,0,0,0|1,0,1]=4 35 B12R1.106 CC1=CC=C(C=C1)OS(=O)(=O)N PH008060 [1,1,0,0,0,0|1,0,0]=3 36 B12R1.106 CS(=O)(=O)CC1=CC=C(C=C1)Cl PH009147 [1,1,0,0,0,0|1,0,1]=4 37 B12R1.106 CS(=O)(=O)NC1=CC=C(C=C1)Cl T100153 [1,1,0,0,0,0|1,0,1]=4 38 B12R1.106 NS(=O)(=O)OC1=CC=C(C=C1)Cl PH008055 [1,1,0,0,0,0|1,0,0]=3 39 B12R1.106 O=S(=O)(Cl)CC1=CC=C(C=C1)Br CDS006543 [1,1,0,0,0,0|2,0,0]=4 40 B12R1.119 CC1=CC(=CC=C1)OS(=O)(=O)N PH008063 [1,1,0,0,0,0|1,0,0]=3 41 B12R1.119 CS(=O)(=O)NC1=CC(=CC=C1)Cl T100072 [1,1,0,0,0,0|1,0,1]=4 42 B12R1.119 NS(=O)(=O)OC1=CC=CC(=C1)Cl PH008056 [1,1,0,0,0,0|1,0,0]=3 43 B12R1.151 CS(=O)(=O)NC1=C(C=CC=C1)Cl T100056 [1,1,0,0,0,0|1,0,1]=4 44 B12R1.151 CS(=O)(=O)NC1=CC=CC=C1O T312002 [1,1,0,0,0,0|1,0,1]=4 45 B12R1.151 NS(=O)(=O)CC1=C(C=CC=C1)Cl T281255 [1,1,0,0,0,0|2,0,0]=4 46 B12R1.151 O=S(=O)([O-])CC1=CC=CC=C1O S775932 [1,1,0,0,0,0|2,0,0]=4 47 B12R1.564 NC(C1=CC=CC=C1)S(=O)(=O)O PH008647 [1,1,0,0,0,0|2,0,0]=4 48 B12R1.564 O=S(=O)([O-])C(Cl)C1=CC=CC=C1 T169153 [1,1,0,0,0,0|2,0,0]=4 49 B12R1.564 O=S(=O)([O-])C(O)C1=CC=CC=C1 S512184 [1,1,0,0,0,0|2,0,0]=4 50 B12R1.9 C=CS(=O)(=O)C1=CC=C(C=C1)C S778230 [0,1,0,0,1,0|0,0,0]=2 51 B12R1.9 CC1=CC=C(C=C1)S(=O)(=O)CBr S799475 [0,1,0,0,1,0|1,0,1]=4 52 B12R1.9 CC1=CC=C(C=C1)S(=O)(=O)CO PH009052 [0,1,0,0,1,0|1,0,1]=4 53 B12R1.9 CC1=CC=C(C=C1)S(=O)(=O)O[TlH2] S826154 [0,1,0,0,1,0|2,0,0]=4 54 B12R1.9 CCS(=O)(=O)C1=CC=C(C=C1)Cl TMT00215 [0,1,0,0,1,0|0,0,2]=4 55 B12R1.9 CCS(=O)(=O)C1=CC=C(C=C1)F PH003114 [0,1,0,0,1,0|0,0,2]=4 56 B12R1.9 CSS(=O)(=O)C1=CC=C(C=C1)C S765090 [0,1,0,0,1,0|1,0,1]=4 57 B12R1.9 NC1=CC=C(C=C1)S(=O)(=O)CCl T163201 [0,1,0,0,1,0|1,0,1]=4 58 B12R1.9 NC1=CC=C(C=C1)S(=O)(=O)O[TlH2] S826138 [0,1,0,0,1,0|2,0,0]=4 59 B12R1.9 NNS(=O)(=O)C1=CC=C(C=C1)Br S953105 [0,1,0,0,1,0|2,0,0]=4 60 B12R1.9 NNS(=O)(=O)C1=CC=C(C=C1)Cl S841382 [0,1,0,0,1,0|2,0,0]=4 61 B12R1.9 NNS(=O)(=O)C1=CC=C(C=C1)I S944998 [0,1,0,0,1,0|2,0,0]=4 62 B12R1.10 CNS(=O)(=O)C1=CC=CC(=C1)Cl T322571 [0,1,0,0,1,0|1,0,1]=4 63 B12R1.39 CCCS(=O)(=O)C1=CC=CC=C1 PH006990 [0,1,0,0,1,0|0,0,2]=4 64 B12R1.39 CCNS(=O)(=O)C1=CC=CC=C1 PH009839 [0,1,0,0,1,0|0,0,2]=4 65 B12R1.39 NCCS(=O)(=O)C1=CC=CC=C1 CDS008511 [0,1,0,0,1,0|0,0,2]=4 66 B12R1.39 O=S(=O)(CCCl)C1=CC=CC=C1 PH011695 [0,1,0,0,1,0|0,0,2]=4 67 B12R1.195 CNS(=O)(=O)C1=C(C=CC=C1)C PH000617 [0,1,0,0,1,0|1,0,1]=4 68 B12R1.253 O=S(=O)(C1=CC=CC=C1)C(Cl)Cl T163848 [0,1,0,0,1,0|1,0,1]=4 69 B14R1.215 CNS(=O)(=O)OC1=CC=C(C=C1)OC PH008070 [0,2,0,0,0,0|1,0,1]=4 70 B14R1.7626 CC1=CC=C(C=C1)OS(=O)(=O)N(C)C PH011007 [0,2,0,0,0,0|1,0,1]=4 71 B14R1.4404 CN(C)S(=O)(=O)OC1=CC=CC(=C1)Cl PH008066 [0,2,0,0,0,0|1,0,1]=4 72 B14R1.2000 CNS(=O)(=O)OC1=C(C=CC=C1)OC PH008064 [0,2,0,0,0,0|1,0,1]=4 73 B14R1.4528 N#CCCS(=O)(=O)OC1=CC=CC=C1 S44688 [0,2,0,0,0,0|0,0,2]=4 74 B12R2.95 O=S1(=O)CC2=C(C1)C=CC=C2 T163449 [1,0,0,1,0,0|1,0,1]=4 75 B12R2.2403 O=S1(=O)C=CC2=C1C=CC=C2 S852414 [0,0,0,1,1,0|0,0,0]=2 76 B12R2.2403 O=S1(=O)C=CC2=C1C=CC=C2 S984302 [0,0,0,1,1,0|0,0,0]=2 77 B12R2.2403 O=S1(=O)OCC2=C1C=CC=C2 S438103 [0,0,0,1,1,0|1,0,1]=4 78 B14R2.441 CC1C=C(S1(=O)=O)C2=CC=CC=C2 T162469 [0,1,0,1,0,0|1,0,1]=4 79 B14R2.412 O=S1(=O)C=CCC2=CC=CC=C2C1 T176079 [0,1,0,1,0,0|1,0,0]=3 80 B10R1.28 O=S(=O)(Cl)C1=CN=CC=C1 CDS013908 [1,0,0,0,1,0|2,0,0]=4 81 B10R1.28 O=S(=O)([O-])C1=CC=CC=C1 S828335 [1,0,0,0,1,0|1,0,0]=3 82 B10R1.28 O=S(=O)([O-])C1=CN=CC=C1 S370525 [1,0,0,0,1,0|2,0,0]=4 83 B12R1.891 C(=C/S(=O)(=O)O)\C1=CC=CC=C1 T164135 [1,0,0,0,0,1|2,0,0]=4 84 B12R1.891 C(=C/S(=O)(=O)O)\C1=CC=CC=C1 T164143 [1,0,0,0,0,1|2,0,0]=4 85 B12R1.891 CS(=O)(=O)/C=C/C1=CC=CC=C1 S778249 [1,0,0,0,0,1|1,0,1]=4 86 B12R1.891 O=S(=O)([O-])CNC1=CC=CC=C1 S505595 [1,0,0,0,0,1|2,0,0]=4