0 B11R1.180 C/C=C/CCN1C=CN=C1C m_34__15541204__23858410 [0,0,0,0,0,0|4,0,0]=4 1 B11R1.180 C=CCCCN1C=CN=C1C m_34__15541204__16929010 [0,0,0,0,0,0|4,0,0]=4 2 B11R1.180 C=CCCSC1=C(C=CS1)C m_7__14781726__8929468 [0,0,0,0,0,0|4,0,0]=4 3 B11R1.180 C=CCNCC1=C(C=CS1)C m_207__109489__121220 [0,0,0,0,0,0|4,0,0]=4 4 B11R1.180 C=CCNCC1=C(N=CO1)C m_270004__9143632__12331216 [0,0,0,0,0,0|3,1,0]=4 5 B11R1.180 C=CCNCC1=C(N=CS1)C m_207__109489__6175032 [0,0,0,0,0,0|3,0,0]=3 6 B11R1.180 C=CCNCC1=C(N=NS1)C m_207__109489__10463840 [0,0,0,0,0,0|4,0,0]=4 7 B11R1.180 C=CCSCC1=C(N=CO1)C m_7__22987946__12202242 [0,0,0,0,0,0|3,1,0]=4 8 B11R1.180 C=CCSCC1=C(N=CS1)C m_62__8363994__10346966 [0,0,0,0,0,0|3,0,0]=3 9 B11R1.180 C=CCSCC1=C(N=CS1)Cl m_62__8363994__12860302 [0,0,0,0,0,0|4,0,0]=4 10 B11R1.180 C=CCSCC1=C(N=NS1)C m_7__22987946__10427488 [0,0,0,0,0,0|4,0,0]=4 11 B11R1.180 CC1=C(SC=C1)SCC=CCl m_7__14781726__5103 [0,0,0,0,0,0|4,0,0]=4 12 B11R1.180 CC1=C(SC=N1)CNCCF m_207__18491578__6175032 [0,0,0,0,0,0|3,0,1]=4 13 B11R1.180 CC1=C(SC=N1)CNCCO m_207__121484__6175032 [0,0,0,0,0,0|2,0,2]=4 14 B11R1.180 CC1=C(SC=N1)CSCCN m_7__20871276__10346958 [0,0,0,0,0,0|3,0,1]=4 15 B11R1.180 CC1=C(SC=N1)CSCCO m_62__10346964__10178562 [0,0,0,0,0,0|2,0,2]=4 16 B11R1.180 CCCNCC1=C(N=CS1)C m_207__109413__6175032 [0,0,0,0,0,0|3,0,1]=4 17 B11R1.180 CCCSCC1=C(N=CS1)C m_62__875778__10346966 [0,0,0,0,0,0|3,0,1]=4 18 B11R1.180 CCNCCC1=C(N=CS1)C m_270004__10719606__24715004 [0,0,0,0,0,0|2,0,1]=3 19 B11R1.180 CCOCCN1C=CN=C1C m_34__15541204__8157270 [0,0,0,0,0,0|3,0,1]=4 20 B11R1.180 CCOCSC1=C(C=CS1)C m_7__14781726__10176980 [0,0,0,0,0,0|3,0,1]=4 21 B11R1.180 CCON=CC1=C(N=CS1)C m_4__158181__6175020 [0,0,0,0,0,0|2,0,2]=4 22 B11R1.180 CCSCCC1=C(N=CS1)C m_62__875846__9273978 [0,0,0,0,0,0|1,1,1]=3 23 B11R1.180 CSCCCC1=C(N=CS1)C m_62__875850__24459368 [0,0,0,0,0,0|3,0,0]=3 24 B10R1.21 C=CCNCC1=CN=CS1 m_207__109489__7345342 [1,0,0,0,0,0|3,0,0]=4 25 B10R1.21 C=CCSCC1=CN=CS1 m_62__8363994__11986600 [1,0,0,0,0,0|3,0,0]=4 26 B10R1.21 CCNCCC1=CN=CS1 m_270004__12321962__24715004 [1,0,0,0,0,0|2,0,1]=4 27 B10R1.21 CCSCCC1=CN=CS1 m_62__875846__18239688 [1,0,0,0,0,0|1,1,1]=4 28 B10R1.29 C=CCCN1C=CN=C1C m_34__15541204__9875956 [1,0,0,0,0,0|3,0,0]=4 29 B10R1.29 C=CCSC1=C(C=CS1)C m_7__14781726__3427024 [1,0,0,0,0,0|3,0,0]=4 30 B10R1.29 CCNCC1=C(N=CS1)C m_207__121480__6175032 [1,0,0,0,0,0|2,0,1]=4 31 B10R1.29 CCSCC1=C(N=CS1)C m_62__875846__10346966 [1,0,0,0,0,0|1,1,1]=4 32 B10R1.29 COCCN1C=CN=C1C m_34__15541204__323278 [1,0,0,0,0,0|2,0,1]=4 33 B10R1.29 COCSC1=C(C=CS1)C m_7__14781726__6762 [1,0,0,0,0,0|2,0,1]=4 34 B10R1.29 CON=CC1=C(N=CS1)C m_4__461206__6175020 [1,0,0,0,0,0|1,0,2]=4 35 B10R1.29 CSCCC1=C(N=CS1)C m_62__875850__9273978 [1,0,0,0,0,0|0,1,1]=3 36 B12R1.130 C=C(Br)CNCC1=C(N=CS1)C m_207__3377576__6175032 [0,1,0,0,0,0|3,0,0]=4 37 B12R1.130 C=C(Br)CSCC1=C(N=CS1)C m_7__22602174__10346958 [0,1,0,0,0,0|3,0,0]=4 38 B12R1.130 C=C(C)CNCC1=C(N=CS1)C m_207__9910176__6175032 [0,1,0,0,0,0|3,0,0]=4 39 B12R1.130 C=C(C)CSCC1=C(N=CS1)C m_62__6464432__10346966 [0,1,0,0,0,0|3,0,0]=4 40 B12R1.130 C=C(Cl)CNCC1=C(N=CS1)C m_207__5137868__6175032 [0,1,0,0,0,0|3,0,0]=4 41 B12R1.130 C=C(Cl)CSCC1=C(N=CS1)C m_62__11986394__10346966 [0,1,0,0,0,0|3,0,0]=4 42 B12R1.130 C=C(F)CNCC1=C(N=CS1)C m_207__18716716__6175032 [0,1,0,0,0,0|3,0,0]=4 43 B12R1.130 C=C(F)CSCC1=C(N=CS1)C m_62__17849116__10346966 [0,1,0,0,0,0|3,0,0]=4 44 B12R1.130 C=C(I)CSCC1=C(N=CS1)C m_62__18682538__10346966 [0,1,0,0,0,0|3,0,0]=4 45 B12R1.130 CC(=O)CCCN1C=CN=C1C m_7__7838062__322712 [0,1,0,0,0,0|3,0,0]=4 46 B12R1.130 CC(=O)CCSC1=C(C=CS1)C m_7__14781726__107330 [0,1,0,0,0,0|3,0,0]=4 47 B12R1.130 CC(=O)NCCC1=C(C=CS1)Br m_270062__16420558__15585492 [0,1,0,0,0,0|3,0,0]=4 48 B12R1.130 CC(=O)NCCC1=C(C=CS1)Cl m_22__24036410__58844 [0,1,0,0,0,0|3,0,0]=4 49 B12R1.130 CC(=O)NCCC1=C(C=CS1)F m_22__24034500__58844 [0,1,0,0,0,0|3,0,0]=4 50 B12R1.130 CC(=O)NCCC1=C(N=CS1)C m_270062__12127676__15585492 [0,1,0,0,0,0|1,0,0]=2 51 B12R1.130 CC(=O)NCCC1=C(NC=N1)C m_270062__21882530__15585492 [0,1,0,0,0,0|2,0,1]=4 52 B12R1.130 CC(=O)NCCC1=C(OC=N1)C m_270062__17612780__15585492 [0,1,0,0,0,0|3,0,0]=4 53 B12R1.130 CC(=O)NCCC1=CC=NN1C m_270062__16419226__15585492 [0,1,0,0,0,0|3,0,0]=4 54 B12R1.130 CC(=O)NCCC1=CNN=C1C m_270062__21887128__15585492 [0,1,0,0,0,0|3,0,0]=4 55 B12R1.130 CC(=O)NCCC1=NC=NN1C m_270062__7623848__15585492 [0,1,0,0,0,0|3,0,0]=4 56 B12R1.130 CC(=O)NCCC1=NNN=C1C m_270062__21878866__15585492 [0,1,0,0,0,0|3,0,0]=4 57 B12R1.130 CC(=O)NCCN1C=CN=C1C m_270062__21863444__15585492 [0,1,0,0,0,0|3,0,0]=4 58 B12R1.130 CC(=O)NOCC1=C(N=CO1)C m_34__2463346__12915372 [0,1,0,0,0,0|2,1,0]=4 59 B12R1.130 CC(=O)NOCC1=C(N=CS1)C m_34__2463346__10346960 [0,1,0,0,0,0|2,0,0]=3 60 B12R1.130 CC(=O)NOCC1=C(N=CS1)Cl m_34__2463346__12860296 [0,1,0,0,0,0|3,0,0]=4 61 B12R1.130 CC(=O)NOCC1=C(N=NS1)C m_34__2463346__11676188 [0,1,0,0,0,0|3,0,0]=4 62 B12R1.130 CC(=O)OCCC1=C(C=CS1)Br m_276436__14084444__14088324 [0,1,0,0,0,0|2,0,0]=3 63 B12R1.130 CC(=O)OCCC1=C(C=CS1)C m_276436__14085228__14088324 [0,1,0,0,0,0|1,0,0]=2 64 B12R1.130 CC(=O)OCCC1=C(N=CS1)C m_276436__14076586__14088324 [0,1,0,0,0,0|0,0,0]=1 65 B12R1.130 CC(=O)OCCC1=CC=NN1C m_276436__14079002__14088324 [0,1,0,0,0,0|2,0,0]=3 66 B12R1.130 CC(=O)OCCC1=CN=NN1C m_276436__14084776__14088324 [0,1,0,0,0,0|3,0,0]=4 67 B12R1.130 CC(=O)OCCC1=NC=NN1C m_276436__14081876__14088324 [0,1,0,0,0,0|2,0,0]=3 68 B12R1.130 CC(=O)OCCC1=NN=NN1C m_1458__473186__12642250 [0,1,0,0,0,0|3,0,0]=4 69 B12R1.130 CC(=O)OCCN1C=CN=C1Br m_7__24373642__22601252 [0,1,0,0,0,0|3,0,0]=4 70 B12R1.130 CC(=O)OCCN1C=CN=C1C m_7__7838062__22601252 [0,1,0,0,0,0|2,0,0]=3 71 B12R1.130 CC(=O)OCCN1N=CC=C1C m_1458__473186__17843770 [0,1,0,0,0,0|3,0,0]=4 72 B12R1.130 CC(=O)OCOC1=C(SC=C1)C m_7__22986706__20618926 [0,1,0,0,0,0|3,0,0]=4 73 B12R1.130 CC(=O)OCSC1=C(C=CS1)C m_7__14781726__20618926 [0,1,0,0,0,0|2,0,0]=3 74 B12R1.130 CC(=O)OCSC1=C(OC=C1)C m_7__8592942__20618926 [0,1,0,0,0,0|3,0,0]=4 75 B12R1.130 CC(=O)OCSC1=CNN=C1C m_7__23915254__20618926 [0,1,0,0,0,0|3,0,0]=4 76 B12R1.130 CC(=O)OCSC1=NC=NN1C m_7__8750426__20618926 [0,1,0,0,0,0|3,0,0]=4 77 B12R1.130 CC1=C(N=CO1)CCNC(=O)N m_2554__17612764__788524 [0,1,0,0,0,0|3,0,0]=4 78 B12R1.130 CC1=C(OC=N1)CNCC(=O)O m_271304__8910650__16776056 [0,1,0,0,0,0|2,1,0]=4 79 B12R1.130 CC1=C(OC=N1)CSCC(=O)N m_7__10975714__12202242 [0,1,0,0,0,0|2,1,0]=4 80 B12R1.130 CC1=C(OC=N1)CSCC(=O)O m_7__26823__12202242 [0,1,0,0,0,0|2,1,0]=4 81 B12R1.130 CC1=C(SC=C1)CCCC(=O)N m_22__58357__7640678 [0,1,0,0,0,0|2,0,0]=3 82 B12R1.130 CC1=C(SC=C1)CNCC(=O)O m_271304__8910650__9304598 [0,1,0,0,0,0|3,0,0]=4 83 B12R1.130 CC1=C(SC=C1)SCCC(=O)N m_7__14781726__217435 [0,1,0,0,0,0|3,0,0]=4 84 B12R1.130 CC1=C(SC=N1)CCCN(C)C m_2230__22405248__2463448 [0,1,0,0,0,0|3,0,0]=4 85 B12R1.130 CC1=C(SC=N1)CCNC(=N)N m_58668__10719596__2227896 [0,1,0,0,0,0|2,0,0]=3 86 B12R1.130 CC1=C(SC=N1)CCNC(=O)N m_2554__10719588__788524 [0,1,0,0,0,0|1,0,0]=2 87 B12R1.130 CC1=C(SC=N1)CCNC(C)C m_269862__10719604__7204804 [0,1,0,0,0,0|2,0,1]=4 88 B12R1.130 CC1=C(SC=N1)CCSC(C)C m_62__2390328__9273978 [0,1,0,0,0,0|1,1,1]=4 89 B12R1.130 CC1=C(SC=N1)CSCC(=O)N m_7__10975714__10346958 [0,1,0,0,0,0|2,0,0]=3 90 B12R1.130 CC1=C(SC=N1)CSCC(=O)O m_7__26823__10346958 [0,1,0,0,0,0|2,0,0]=3 91 B12R1.130 CC1=C(SN=N1)CNCC(=O)O m_271304__8910650__16775800 [0,1,0,0,0,0|3,0,0]=4 92 B12R1.130 CC1=C(SN=N1)CSCC(=O)N m_7__10975714__10427488 [0,1,0,0,0,0|3,0,0]=4 93 B12R1.130 CC1=C(SN=N1)CSCC(=O)O m_7__26823__10427488 [0,1,0,0,0,0|3,0,0]=4 94 B12R1.130 CC1=NC=CN1CCCC(=O)N m_7__7838062__22787802 [0,1,0,0,0,0|3,0,0]=4 95 B12R1.130 CC1=NC=CN1CCNC(=O)N m_2554__24487278__788524 [0,1,0,0,0,0|3,0,0]=4 96 B12R1.130 CN1N=CC=C1CCNC(=O)N m_2554__8795486__788524 [0,1,0,0,0,0|3,0,0]=4 97 B12R1.130 CN1N=CN=C1CCNC(=O)N m_2554__6953528__788524 [0,1,0,0,0,0|3,0,0]=4 98 B12R1.130 NC(=O)CSCC1=C(N=CS1)Cl m_7__10975714__12860294 [0,1,0,0,0,0|3,0,0]=4 99 B12R1.130 NC(=O)NCCC1=C(C=CS1)Br m_2554__12902778__788524 [0,1,0,0,0,0|3,0,0]=4 100 B12R1.130 O=C(O)CSCC1=C(N=CS1)Cl m_7__26823__12860294 [0,1,0,0,0,0|3,0,0]=4 101 B12R1.318 C=CCN(C)CC1=C(N=CS1)C m_2230__9044904__10346978 [0,1,0,0,0,0|3,0,0]=4 102 B12R1.318 C=CCS(=O)CC1=C(N=CS1)C m_1498__10346970__13192714 [0,1,0,0,0,0|3,0,0]=4 103 B12R1.318 CCOC(=O)CC1=C(N=CS1)C m_1458__17755654__1327610 [0,1,0,0,0,0|1,0,2]=4 104 B12R1.353 C=CC(C)NCC1=C(N=CS1)C m_207__7346456__6175032 [0,1,0,0,0,0|3,0,0]=4 105 B12R1.353 CC1=C(SC=N1)CCC(=O)NN m_240690__7868478__17033586 [0,1,0,0,0,0|3,0,0]=4 106 B12R1.353 CC1=C(SC=N1)CCC(=O)NO m_527__388132__10965210 [0,1,0,0,0,0|2,0,1]=4 107 B12R1.353 CNC(=O)CCC1=C(N=CS1)C m_22__387492__10965208 [0,1,0,0,0,0|3,0,0]=4 108 B12R1.353 COC(=O)CCC1=C(N=CS1)C m_43__14773936__21466932 [0,1,0,0,0,0|3,0,0]=4 109 B12R1.353 CON(C)CCC1=C(N=CS1)C m_2230__679026__5337466 [0,1,0,0,0,0|3,0,0]=4 110 B12R1.372 C#CCCSCC1=C(N=CS1)C m_62__10346964__18060662 [0,1,0,0,0,0|2,0,1]=4 111 B12R1.372 C/C=C/CCSC1=C(C=CS1)C m_7__14781726__23858408 [0,1,0,0,0,0|3,0,0]=4 112 B12R1.372 C=CCCCSC1=C(C=CS1)C m_7__14781726__16929008 [0,1,0,0,0,0|3,0,0]=4 113 B12R1.372 C=CCCNCC1=C(C=CS1)C m_207__11969928__121220 [0,1,0,0,0,0|3,0,0]=4 114 B12R1.372 C=CCCNCC1=C(N=CO1)C m_270004__11969962__12331216 [0,1,0,0,0,0|2,1,0]=4 115 B12R1.372 C=CCCNCC1=C(N=CS1)C m_207__11969928__6175032 [0,1,0,0,0,0|2,0,0]=3 116 B12R1.372 C=CCCNCC1=C(N=NS1)C m_207__11969928__10463840 [0,1,0,0,0,0|3,0,0]=4 117 B12R1.372 C=CCCSCC1=C(N=CS1)C m_62__9875552__10346966 [0,1,0,0,0,0|2,0,0]=3 118 B12R1.372 C=CCCSCC1=C(N=CS1)Cl m_62__9875552__12860302 [0,1,0,0,0,0|3,0,0]=4 119 B12R1.372 C=CCOCCN1C=CN=C1C m_34__15541204__10550170 [0,1,0,0,0,0|3,0,0]=4 120 B12R1.372 C=CCOCSC1=C(C=CS1)C m_7__14781726__12361584 [0,1,0,0,0,0|3,0,0]=4 121 B12R1.372 C=CCON=CC1=C(N=CS1)C m_4__10814764__6175020 [0,1,0,0,0,0|2,0,1]=4 122 B12R1.372 C=CCSCCC1=C(N=CS1)C m_62__8363994__9273978 [0,1,0,0,0,0|1,1,0]=3 123 B12R1.372 CC#CCSCC1=C(N=CS1)C m_62__10346964__8844818 [0,1,0,0,0,0|2,0,1]=4 124 B12R1.372 CC1=C(OC=N1)CSC/C=C\Br m_7__22544354__12202242 [0,1,0,0,0,0|2,1,0]=4 125 B12R1.372 CC1=C(SC=C1)CNCC=CBr m_207__15075148__121220 [0,1,0,0,0,0|3,0,0]=4 126 B12R1.372 CC1=C(SC=C1)CNCC=CCl m_207__13447998__121220 [0,1,0,0,0,0|3,0,0]=4 127 B12R1.372 CC1=C(SC=N1)CCSCCN m_7__20871276__4913806 [0,1,0,0,0,0|1,1,1]=4 128 B12R1.372 CC1=C(SC=N1)CCSCCO m_62__10125438__10178562 [0,1,0,0,0,0|0,1,2]=4 129 B12R1.372 CC1=C(SC=N1)CNCC=CBr m_207__15075148__6175032 [0,1,0,0,0,0|2,0,0]=3 130 B12R1.372 CC1=C(SC=N1)CNCC=CCl m_207__13447998__6175032 [0,1,0,0,0,0|2,0,0]=3 131 B12R1.372 CC1=C(SC=N1)CNCCC#N m_273610__11521878__11515974 [0,1,0,0,0,0|2,0,1]=4 132 B12R1.372 CC1=C(SC=N1)CNCCCF m_207__17065564__6175032 [0,1,0,0,0,0|2,0,1]=4 133 B12R1.372 CC1=C(SC=N1)CNCCCO m_207__109475__6175032 [0,1,0,0,0,0|1,0,2]=4 134 B12R1.372 CC1=C(SC=N1)CSC/C=C\Br m_7__22544354__10346958 [0,1,0,0,0,0|2,0,0]=3 135 B12R1.372 CC1=C(SC=N1)CSCCC#N m_7__10953802__10346958 [0,1,0,0,0,0|2,0,1]=4 136 B12R1.372 CC1=C(SC=N1)CSCCCN m_7__20871288__10346958 [0,1,0,0,0,0|2,0,1]=4 137 B12R1.372 CC1=C(SC=N1)CSCCCO m_7__10972294__10346958 [0,1,0,0,0,0|1,0,2]=4 138 B12R1.372 CC1=C(SN=N1)CNCC=CBr m_207__15075148__10463840 [0,1,0,0,0,0|3,0,0]=4 139 B12R1.372 CC1=C(SN=N1)CNCC=CCl m_207__13447998__10463840 [0,1,0,0,0,0|3,0,0]=4 140 B12R1.372 CC1=C(SN=N1)CSC/C=C\Br m_7__22544354__10427488 [0,1,0,0,0,0|3,0,0]=4 141 B12R1.372 CC=CCNCC1=C(C=CS1)C m_207__14317866__121220 [0,1,0,0,0,0|3,0,0]=4 142 B12R1.372 CC=CCNCC1=C(N=CS1)C m_207__14317866__6175032 [0,1,0,0,0,0|2,0,0]=3 143 B12R1.372 CC=CCNCC1=C(N=NS1)C m_207__14317866__10463840 [0,1,0,0,0,0|3,0,0]=4 144 B12R1.372 CC=CCSCC1=C(N=CS1)C m_62__4275932__10346966 [0,1,0,0,0,0|2,0,0]=3 145 B12R1.372 CC=CCSCC1=C(N=CS1)Cl m_62__4275932__12860302 [0,1,0,0,0,0|3,0,0]=4 146 B12R1.372 CCC=NOCC1=C(N=CS1)C m_34__17309904__10346960 [0,1,0,0,0,0|3,0,0]=4 147 B12R1.372 CCCCNCC1=C(N=CS1)C m_207__109452__6175032 [0,1,0,0,0,0|2,0,1]=4 148 B12R1.372 CCCCSCC1=C(N=CS1)C m_62__875776__10346966 [0,1,0,0,0,0|2,0,1]=4 149 B12R1.372 CCCSCCC1=C(N=CS1)C m_62__875778__9273978 [0,1,0,0,0,0|1,1,1]=4 150 B12R1.372 CCNCCCC1=C(N=CS1)C m_270004__15358714__24715004 [0,1,0,0,0,0|2,0,1]=4 151 B12R1.372 CCOCCSC1=C(C=CS1)C m_7__14781726__5044 [0,1,0,0,0,0|2,0,1]=4 152 B12R1.372 CCSCCCC1=C(N=CS1)C m_62__875846__24459368 [0,1,0,0,0,0|1,1,1]=4 153 B12R1.372 CNCCSCC1=C(N=CS1)C m_7__22986920__10346958 [0,1,0,0,0,0|3,0,0]=4 154 B12R1.372 COCCNCC1=C(N=CS1)C m_207__109486__6175032 [0,1,0,0,0,0|3,0,0]=4 155 B12R1.372 COCCSCC1=C(N=CS1)C m_62__524272__10346966 [0,1,0,0,0,0|3,0,0]=4 156 B12R1.372 CSCCNCC1=C(N=CS1)C m_207__11946676__6175032 [0,1,0,0,0,0|3,0,0]=4 157 B12R1.372 CSCCSCC1=C(N=CS1)C m_62__10346964__8268572 [0,1,0,0,0,0|3,0,0]=4 158 B12R1.372 ClC1=C(SC=N1)CSC/C=C\Br m_7__22544354__12860294 [0,1,0,0,0,0|3,0,0]=4 159 B12R1.456 C=CCNCC1=C(N=C(S1)Br)C m_270004__9143632__15765766 [0,1,0,0,0,0|3,0,0]=4 160 B12R1.456 C=CCNCC1=C(N=C(S1)C)C m_207__109489__5182702 [0,1,0,0,0,0|3,0,0]=4 161 B12R1.456 C=CCSCC1=C(N=C(S1)Br)C m_7__22987946__17314186 [0,1,0,0,0,0|3,0,0]=4 162 B12R1.456 CCNCCC1=C(N=C(S1)C)C m_270004__8295442__24715004 [0,1,0,0,0,0|2,0,1]=4 163 B12R1.456 CCNCCC1=C(N=C(S1)N)C m_270004__23844058__24715004 [0,1,0,0,0,0|2,0,1]=4 164 B12R1.460 C=CCNC(C)C1=C(N=CS1)C m_2230__20860188__680312 [0,1,0,0,0,0|3,0,0]=4 165 B12R1.460 CC1=C(SC=N1)C(=O)NNC=O m_22__9864706__769828 [0,1,0,0,0,0|2,0,1]=4 166 B12R2.10 CC1=C(SC=N1)C2=COC=C2 m_271570__10145058__15064092 [0,0,0,1,0,0|1,0,2]=4 167 B12R2.39 C=CCN1CC2=C(C1)SC=N2 m_2230__22406278__680312 [0,0,0,1,0,0|3,0,0]=4 168 B12R2.110 CC1=NC=CN1C2CCC2=O m_7__7838062__20026952 [0,0,0,1,0,0|3,0,0]=4 169 B12R2.305 CC1=C(SC=N1)[C@@H]2C[C@H]2CO m_271570__24800714__15064092 [0,0,0,1,0,0|1,0,2]=4 170 B12R2.305 CC[C@H]1C[C@@H]1C2=C(N=CS2)C m_271570__24798044__15064092 [0,0,0,1,0,0|2,0,1]=4 171 B9R1.12 CSCCC1=CN=CS1 m_62__875850__18239688 [2,0,0,0,0,0|0,1,1]=4 172 B9R1.33 CC1=C(SC=N1)C=NO m_4__388124__6175020 [2,0,0,0,0,0|1,0,1]=4 173 B9R1.33 CC1=C(SC=N1)CCCl m_43__14773936__13287988 [2,0,0,0,0,0|1,0,0]=3 174 B9R1.33 CC1=NC=CN1CCO m_7__7838062__102708 [2,0,0,0,0,0|2,0,0]=4 175 B9R1.33 CC=CC1=C(N=CS1)C m_271570__16945674__15064092 [2,0,0,0,0,0|1,0,1]=4 176 B9R1.33 CCCC1=C(N=CS1)C m_43__14773936__15356320 [2,0,0,0,0,0|0,0,1]=3 177 B9R1.33 CNCC1=C(N=CS1)C m_207__134027__6175032 [2,0,0,0,0,0|1,0,1]=4 178 B9R1.33 CSCC1=C(N=CS1)C m_62__875850__10346966 [2,0,0,0,0,0|0,1,1]=4 179 B11R1.4 Br/C=C\CSCC1=CN=CS1 m_7__22544354__11986592 [1,1,0,0,0,0|2,0,0]=4 180 B11R1.4 BrC=CCNCC1=CN=CS1 m_207__15075148__7345342 [1,1,0,0,0,0|2,0,0]=4 181 B11R1.4 C=CCCNCC1=CN=CS1 m_207__11969928__7345342 [1,1,0,0,0,0|2,0,0]=4 182 B11R1.4 C=CCCSCC1=CN=CS1 m_62__9875552__11986600 [1,1,0,0,0,0|2,0,0]=4 183 B11R1.4 C=CCSCCC1=CN=CS1 m_62__8363994__18239688 [1,1,0,0,0,0|1,1,0]=4 184 B11R1.4 CC=CCNCC1=CN=CS1 m_207__14317866__7345342 [1,1,0,0,0,0|2,0,0]=4 185 B11R1.4 CC=CCSCC1=CN=CS1 m_62__4275932__11986600 [1,1,0,0,0,0|2,0,0]=4 186 B11R1.4 CCOCSCC1=CN=CS1 m_7__22987662__10176980 [1,1,0,0,0,0|1,0,1]=4 187 B11R1.4 ClC=CCNCC1=CN=CS1 m_207__13447998__7345342 [1,1,0,0,0,0|2,0,0]=4 188 B11R1.4 ClC=CCSCC1=CN=CS1 m_7__22987662__5103 [1,1,0,0,0,0|2,0,0]=4 189 B11R1.172 CC(=O)CSCC1=CN=CS1 m_7__22987662__5065 [1,1,0,0,0,0|2,0,0]=4 190 B11R1.172 CC(=O)NCCC1=CC=CS1 m_270062__7595838__15585492 [1,1,0,0,0,0|2,0,0]=4 191 B11R1.172 CC(=O)NCCC1=CN=CO1 m_270062__17832040__15585492 [1,1,0,0,0,0|1,1,0]=4 192 B11R1.172 CC(=O)NCCC1=CN=CS1 m_270062__14402918__15585492 [1,1,0,0,0,0|1,0,0]=3 193 B11R1.172 CC(=O)NCCC1=NN=CS1 m_270062__16428714__15585492 [1,1,0,0,0,0|2,0,0]=4 194 B11R1.172 CC(=O)NOCC1=CN=CS1 m_34__2463346__11986594 [1,1,0,0,0,0|2,0,0]=4 195 B11R1.172 CC(=O)OCCC1=CC=CO1 m_276436__14083066__14088324 [1,1,0,0,0,0|1,1,0]=4 196 B11R1.172 CC(=O)OCCC1=CC=CS1 m_276436__14077244__14088324 [1,1,0,0,0,0|1,0,0]=3 197 B11R1.172 CC(=O)OCCC1=CC=NS1 m_276436__14084624__14088324 [1,1,0,0,0,0|2,0,0]=4 198 B11R1.172 CC(=O)OCCC1=CN=CS1 m_276436__14082154__14088324 [1,1,0,0,0,0|0,0,0]=2 199 B11R1.172 CC(=O)OCCC1=CNN=C1 m_276436__14078696__14088324 [1,1,0,0,0,0|2,0,0]=4 200 B11R1.172 CC(=O)OCCC1=COC=C1 m_276436__14080604__14088324 [1,1,0,0,0,0|2,0,0]=4 201 B11R1.172 CC(=O)OCCC1=CON=C1 m_276436__14082544__14088324 [1,1,0,0,0,0|2,0,0]=4 202 B11R1.172 CC(=O)OCCC1=CSC=C1 m_276436__14077406__14088324 [1,1,0,0,0,0|2,0,0]=4 203 B11R1.172 CC(=O)OCCC1=CSC=N1 m_276436__24529192__14088324 [1,1,0,0,0,0|2,0,0]=4 204 B11R1.172 CC(=O)OCCC1=NC=CS1 m_276436__14081372__14088324 [1,1,0,0,0,0|2,0,0]=4 205 B11R1.172 CC(=O)OCCN1C=CN=C1 m_7__7838064__22601252 [1,1,0,0,0,0|2,0,0]=4 206 B11R1.172 CC(=O)OCCN1C=NC=N1 m_276436__14077164__14088324 [1,1,0,0,0,0|2,0,0]=4 207 B11R1.172 CC(=O)OCSC1=NN=CS1 m_7__29396__20618926 [1,1,0,0,0,0|2,0,0]=4 208 B11R1.172 N=C(N)NCCC1=CN=CS1 m_58668__12321956__2227896 [1,1,0,0,0,0|2,0,0]=4 209 B11R1.172 NC(=O)CCCC1=CC=CS1 m_22__58357__60275 [1,1,0,0,0,0|2,0,0]=4 210 B11R1.172 NC(=O)CSCC1=CN=CS1 m_7__10975714__11986592 [1,1,0,0,0,0|2,0,0]=4 211 B11R1.172 NC(=O)NCCC1=CC=CS1 m_2554__827102__788524 [1,1,0,0,0,0|2,0,0]=4 212 B11R1.172 NC(=O)NCCC1=CN=CO1 m_2554__17832024__788524 [1,1,0,0,0,0|1,1,0]=4 213 B11R1.172 NC(=O)NCCC1=CN=CS1 m_2554__12321948__788524 [1,1,0,0,0,0|1,0,0]=3 214 B11R1.172 O=C(O)CNCC1=CN=CS1 m_271304__8910650__10972726 [1,1,0,0,0,0|2,0,0]=4 215 B11R1.172 O=C(O)CSCC1=CN=CS1 m_7__26823__11986592 [1,1,0,0,0,0|2,0,0]=4 216 B11R1.90 CC(=O)CCN1C=CN=C1C m_7__7838062__107330 [1,1,0,0,0,0|2,0,0]=4 217 B11R1.90 CC(=O)CSC1=C(C=CS1)C m_7__14781726__5065 [1,1,0,0,0,0|2,0,0]=4 218 B11R1.90 CC(=O)NCC1=C(C=CS1)C m_270062__7606114__15585492 [1,1,0,0,0,0|2,0,0]=4 219 B11R1.90 CC(=O)NCC1=C(N=CO1)C m_270062__16435374__15585492 [1,1,0,0,0,0|1,1,0]=4 220 B11R1.90 CC(=O)NCC1=C(N=CS1)C m_270062__7613798__15585492 [1,1,0,0,0,0|1,0,0]=3 221 B11R1.90 CC(=O)NCC1=C(N=NS1)C m_270062__16414142__15585492 [1,1,0,0,0,0|2,0,0]=4 222 B11R1.90 CC(=O)OCC1=C(C=CO1)C m_276436__14082324__14088324 [1,1,0,0,0,0|1,1,0]=4 223 B11R1.90 CC(=O)OCC1=C(C=CS1)Br m_276436__14085090__14088324 [1,1,0,0,0,0|2,0,0]=4 224 B11R1.90 CC(=O)OCC1=C(C=CS1)C m_276436__14079952__14088324 [1,1,0,0,0,0|1,0,0]=3 225 B11R1.90 CC(=O)OCC1=C(C=CS1)Cl m_276436__14081258__14088324 [1,1,0,0,0,0|2,0,0]=4 226 B11R1.90 CC(=O)OCC1=C(N=CO1)C m_276436__14082316__14088324 [1,1,0,0,0,0|0,1,0]=3 227 B11R1.90 CC(=O)OCC1=C(N=CS1)C m_276436__14077550__14088324 [1,1,0,0,0,0|0,0,0]=2 228 B11R1.90 CC(=O)OCC1=C(N=CS1)Cl m_276436__14083950__14088324 [1,1,0,0,0,0|1,0,0]=3 229 B11R1.90 CC(=O)OCC1=C(N=NS1)C m_276436__14082262__14088324 [1,1,0,0,0,0|1,0,0]=3 230 B11R1.90 CC(=O)OCC1=C(OC=C1)C m_276436__14077994__14088324 [1,1,0,0,0,0|2,0,0]=4 231 B11R1.90 CC(=O)OCC1=C(OC=N1)C m_276436__14085678__14088324 [1,1,0,0,0,0|2,0,0]=4 232 B11R1.90 CC(=O)OCC1=C(SC=C1)C m_1458__473186__23857300 [1,1,0,0,0,0|2,0,0]=4 233 B11R1.90 CC(=O)OCC1=C(SC=N1)C m_1458__473186__18242480 [1,1,0,0,0,0|2,0,0]=4 234 B11R1.90 CC(=O)OCC1=CC=NN1C m_276436__14079274__14088324 [1,1,0,0,0,0|2,0,0]=4 235 B11R1.90 CC(=O)OCC1=CON=C1C m_276436__17843190__14088324 [1,1,0,0,0,0|2,0,0]=4 236 B11R1.90 CC(=O)OCC1=CSN=C1C m_276436__14772692__14088324 [1,1,0,0,0,0|2,0,0]=4 237 B11R1.90 CC(=O)OCC1=NC=NN1C m_276436__14084700__14088324 [1,1,0,0,0,0|2,0,0]=4 238 B11R1.90 CC(=O)OCC1=NON=C1C m_276436__14078116__14088324 [1,1,0,0,0,0|2,0,0]=4 239 B11R1.90 CC(=O)OCN1C=CN=C1C m_7__7838062__20618926 [1,1,0,0,0,0|2,0,0]=4 240 B11R1.90 CC1=C(OC=N1)CNC(=O)N m_2554__15524132__788524 [1,1,0,0,0,0|1,1,0]=4 241 B11R1.90 CC1=C(SC=C1)CNC(=O)N m_2554__2013792__788524 [1,1,0,0,0,0|2,0,0]=4 242 B11R1.90 CC1=C(SC=C1)SCC(=O)N m_7__14781726__5054 [1,1,0,0,0,0|2,0,0]=4 243 B11R1.90 CC1=C(SC=N1)C=CC(=O)N m_22__58357__13219536 [1,1,0,0,0,0|0,0,2]=4 244 B11R1.90 CC1=C(SC=N1)CCC(=O)N m_22__58357__10965208 [1,1,0,0,0,0|0,0,0]=2 245 B11R1.90 CC1=C(SC=N1)CNC(=N)N m_58668__3391514__2227896 [1,1,0,0,0,0|2,0,0]=4 246 B11R1.90 CC1=C(SC=N1)CNC(=O)N m_2554__3391506__788524 [1,1,0,0,0,0|1,0,0]=3 247 B11R1.90 CC1=C(SN=N1)CNC(=O)N m_2554__10434790__788524 [1,1,0,0,0,0|2,0,0]=4 248 B11R1.90 CC1=NC=CN1CCC(=O)N m_63__7825836__91176 [1,1,0,0,0,0|2,0,0]=4 249 B11R1.90 CC1=NOC=C1CCC(=O)N m_22__58357__24596808 [1,1,0,0,0,0|2,0,0]=4 250 B11R1.90 CN1N=CC=C1CCC(=O)N m_22__58357__8989844 [1,1,0,0,0,0|2,0,0]=4 251 B11R1.90 CN1N=CN=C1CCC(=O)N m_22__58357__24597314 [1,1,0,0,0,0|2,0,0]=4 252 B11R1.90 NC(=O)CCC1=C(C=CS1)Br m_22__58357__15158748 [1,1,0,0,0,0|2,0,0]=4 253 B11R1.90 NC(=O)CCC1=C(C=CS1)Cl m_22__58357__24531326 [1,1,0,0,0,0|2,0,0]=4 254 B11R1.199 C=C(COC)C1=C(N=CS1)C m_271570__15607592__15064092 [1,1,0,0,0,0|0,0,2]=4 255 B11R1.228 COC(=O)CC1=C(N=CS1)C m_276436__14076652__17755664 [1,1,0,0,0,0|0,0,2]=4 256 B11R1.228 CON(C)CC1=C(N=CS1)C m_2230__679026__10346978 [1,1,0,0,0,0|1,0,1]=4 257 B13R1.149 CC(=O)NCCC1=CC=NC(=C1)C m_270062__21885880__15585492 [0,1,0,0,0,1|2,0,0]=4 258 B13R1.149 CC(=O)NCCC1=NC(=NC=C1)C m_270062__21662802__15585492 [0,1,0,0,0,1|2,0,0]=4 259 B13R1.149 CC(=O)OCCC1=CC(=CC=C1)C m_276436__14083396__14088324 [0,1,0,0,0,1|2,0,0]=4 260 B13R1.149 CC(=O)OCCC1=CC=NC(=C1)Br m_276436__18312416__14088324 [0,1,0,0,0,1|2,0,0]=4 261 B13R1.149 CC(=O)OCCC1=NC(=CC=C1)C m_276436__14083176__14088324 [0,1,0,0,0,1|2,0,0]=4 262 B13R1.149 CC(=O)OCCC1=NC(=CC=N1)C m_276436__14082656__14088324 [0,1,0,0,0,1|2,0,0]=4 263 B13R1.149 CC(=O)OCSC1=CC=NC(=C1)C m_7__13652028__20618926 [0,1,0,0,0,1|2,0,0]=4 264 B13R1.149 CC(=O)OCSC1=NC=NC(=C1)C m_7__14788710__20618926 [0,1,0,0,0,1|2,0,0]=4 265 B13R1.149 CC1=NC=CC(=N1)CCNC(=O)N m_2554__21662786__788524 [0,1,0,0,0,1|2,0,0]=4 266 B13R1.158 CC(=O)NCCC1=CC=CN=C1C m_270062__13443226__15585492 [0,1,0,0,0,1|2,0,0]=4 267 B13R1.158 CC(=O)NCCC1=CC=NC=C1C m_270062__16413854__15585492 [0,1,0,0,0,1|2,0,0]=4 268 B13R1.158 CC(=O)NCCC1=NC=CN=C1C m_270062__12127570__15585492 [0,1,0,0,0,1|2,0,0]=4 269 B13R1.158 CC(=O)OCCC1=CC=CC=C1C m_276436__17063384__14088324 [0,1,0,0,0,1|2,0,0]=4 270 B13R1.158 CC(=O)OCCC1=CC=CN=C1Cl m_276436__14772700__14088324 [0,1,0,0,0,1|2,0,0]=4 271 B13R1.158 CC(=O)OCCC1=CC=CN=C1F m_276436__14772690__14088324 [0,1,0,0,0,1|2,0,0]=4 272 B13R1.158 CC(=O)OCCC1=CC=NC=C1Br m_276436__14685982__14088324 [0,1,0,0,0,1|2,0,0]=4 273 B13R1.158 CC(=O)OCCC1=CC=NC=C1C m_276436__14082996__14088324 [0,1,0,0,0,1|1,0,0]=3 274 B13R1.158 CC(=O)OCCC1=CC=NC=C1F m_276436__15491910__14088324 [0,1,0,0,0,1|2,0,0]=4 275 B13R1.158 CC(=O)OCCC1=NC=CC=C1C m_276436__14082548__14088324 [0,1,0,0,0,1|2,0,0]=4 276 B13R1.158 CC(=O)OCCC1=NC=CN=C1C m_276436__14082388__14088324 [0,1,0,0,0,1|1,0,0]=3 277 B13R1.158 CC(=O)OCOC1=CC=CN=C1C m_7__22985646__20618926 [0,1,0,0,0,1|2,0,0]=4 278 B13R1.158 CC(=O)OCOC1=CN=CN=C1C m_7__22986672__20618926 [0,1,0,0,0,1|2,0,0]=4 279 B13R1.158 CC(=O)OCSC1=CC=NC=C1C m_7__10566236__20618926 [0,1,0,0,0,1|2,0,0]=4 280 B13R1.158 CC1=CN=CC=C1CCNC(=O)N m_2554__7794690__788524 [0,1,0,0,0,1|2,0,0]=4 281 B13R1.158 CC1=NC=CC=C1CCNC(=O)N m_2554__13443210__788524 [0,1,0,0,0,1|2,0,0]=4 282 B13R1.158 CC1=NC=CN=C1CCNC(=O)N m_2554__10547848__788524 [0,1,0,0,0,1|2,0,0]=4 283 B13R1.103 CC(=O)NCCC1=C(N=CO1)CO m_270062__21886786__15585492 [0,2,0,0,0,0|1,1,0]=4 284 B13R1.103 CCC1=NC=CN1CCOC(=O)C m_7__7838068__22601252 [0,2,0,0,0,0|2,0,0]=4 285 B13R1.103 CCN1N=CC=C1CCOC(=O)C m_276436__14080878__14088324 [0,2,0,0,0,0|2,0,0]=4 286 B13R1.168 CC(=O)CNC(C)C1=C(N=CS1)C m_2230__20860188__12369270 [0,2,0,0,0,0|2,0,0]=4 287 B13R1.168 CC(=O)NCC(=O)C1=C(N=CS1)C m_270062__21877168__15585492 [0,2,0,0,0,0|1,0,1]=4 288 B13R1.168 CC(=O)OCC(=O)C1=C(C=CS1)C m_1458__473186__14423114 [0,2,0,0,0,0|1,0,1]=4 289 B13R1.168 CC(=O)OCC(=O)C1=C(N=CO1)C m_1458__473186__14263558 [0,2,0,0,0,0|0,1,1]=4 290 B13R1.168 CC(=O)OCC(=O)C1=C(N=NS1)C m_1458__473186__14263538 [0,2,0,0,0,0|1,0,1]=4 291 B13R1.168 CC1=C(SC=N1)C(C)NCC(=O)N m_2230__20860188__680278 [0,2,0,0,0,0|2,0,0]=4 292 B13R1.169 CC(=O)C(C)SCC1=C(N=CS1)C m_7__6506312__10346958 [0,2,0,0,0,0|2,0,0]=4 293 B13R1.169 CC1=C(SC=N1)CNC(=O)C(=O)N m_22__3391474__12053348 [0,2,0,0,0,0|2,0,0]=4 294 B13R1.169 CC1=C(SC=N1)CNC(C)C(=O)N m_44__3391480__8799282 [0,2,0,0,0,0|2,0,0]=4 295 B13R1.169 CC1=C(SC=N1)CNC(C)C(=O)O m_273456__11067662__13259262 [0,2,0,0,0,0|2,0,0]=4 296 B13R1.169 CC1=C(SC=N1)CN[C@H](C)C(=O)N m_2230__22395940__10346978 [0,2,0,0,0,0|2,0,0]=4 297 B13R1.169 CC1=C(SC=N1)CSC(C)C(=O)N m_62__10346964__875894 [0,2,0,0,0,0|2,0,0]=4 298 B13R1.195 CC1=C(SC=N1)CCCS(=O)(=O)C m_1500__766206__24459358 [0,2,0,0,0,0|2,0,0]=4 299 B13R1.195 CC1=C(SC=N1)CCNS(=O)(=O)C m_40__10719564__124042 [0,2,0,0,0,0|2,0,0]=4 300 B13R1.195 CC1=C(SC=N1)CCNS(=O)(=O)N m_40__10719564__23157582 [0,2,0,0,0,0|2,0,0]=4 301 B13R1.282 CC(=O)CN(C)CC1=C(N=CS1)C m_2230__4357242__12369270 [0,2,0,0,0,0|2,0,0]=4 302 B13R1.282 CC(=O)OC(C)CN1C=CN=C1C m_276436__14078870__14088324 [0,2,0,0,0,0|2,0,0]=4 303 B13R1.282 CC(=O)OC(C)SC1=C(C=CS1)C m_7__14781726__16945796 [0,2,0,0,0,0|2,0,0]=4 304 B13R1.282 CC1=C(SC=N1)CN(C)CC(=O)N m_2230__751802__10346978 [0,2,0,0,0,0|2,0,0]=4 305 B13R1.282 CC1=C(SC=N1)CN(C)CC(=O)O m_274370__13075198__13088828 [0,2,0,0,0,0|2,0,0]=4 306 B13R1.282 CC1=C(SC=N1)CS(=O)CC(=O)N m_265282__10975722__10346984 [0,2,0,0,0,0|2,0,0]=4 307 B13R1.599 C=CC(C)CNCC1=C(N=CS1)C m_207__17762540__6175032 [0,2,0,0,0,0|2,0,0]=4 308 B13R1.599 C=CC(C)CSCC1=C(N=CS1)C m_62__23815404__10346966 [0,2,0,0,0,0|2,0,0]=4 309 B13R1.599 C=CC(C)NCCC1=C(N=CS1)C m_2230__22399842__5337466 [0,2,0,0,0,0|2,0,0]=4 310 B13R1.599 C=CC(O)CNCC1=C(N=CS1)C m_207__23410964__6175032 [0,2,0,0,0,0|2,0,0]=4 311 B13R1.599 CC(=CCl)CSCC1=C(N=CS1)C m_7__9703826__10346958 [0,2,0,0,0,0|2,0,0]=4 312 B13R1.599 CC1=C(SC=C1)CCCC(=O)NN m_240690__7868478__17025092 [0,2,0,0,0,0|2,0,0]=4 313 B13R1.599 CC1=C(SC=C1)CCCC(=O)NO m_527__388132__7640680 [0,2,0,0,0,0|2,0,0]=4 314 B13R1.599 CC1=C(SC=N1)CCNC(=O)CN m_240690__17032548__3025698 [0,2,0,0,0,0|1,0,0]=3 315 B13R1.599 CC1=C(SC=N1)CCNC(=O)CO m_22__10719560__7941800 [0,2,0,0,0,0|1,0,0]=3 316 B13R1.599 CC1=C(SC=N1)CCNC(=O)NN m_273464__11207426__11234894 [0,2,0,0,0,0|1,0,0]=3 317 B13R1.599 CC=C(C)CNCC1=C(N=CS1)C m_270004__8294684__16464078 [0,2,0,0,0,0|2,0,0]=4 318 B13R1.599 CCC(=O)NCCC1=C(N=CS1)C m_270062__12127676__22005658 [0,2,0,0,0,0|1,0,0]=3 319 B13R1.599 CCC(=O)OCCC1=C(C=CS1)Br m_276436__14084444__14101862 [0,2,0,0,0,0|2,0,0]=4 320 B13R1.599 CCC(=O)OCCC1=C(C=CS1)C m_276436__14085228__14101862 [0,2,0,0,0,0|1,0,0]=3 321 B13R1.599 CCC(=O)OCCC1=C(N=CS1)C m_276436__14076586__14101862 [0,2,0,0,0,0|0,0,0]=2 322 B13R1.599 CCC(=O)OCCC1=CC=NN1C m_276436__14079002__14101862 [0,2,0,0,0,0|2,0,0]=4 323 B13R1.599 CCC(=O)OCCC1=NC=NN1C m_276436__14081876__14101862 [0,2,0,0,0,0|2,0,0]=4 324 B13R1.599 CCC(=O)OCCN1C=CN=C1C m_276436__14080684__14101862 [0,2,0,0,0,0|2,0,0]=4 325 B13R1.599 CCS(=O)CCCC1=C(N=CS1)C m_1498__7021596__24459356 [0,2,0,0,0,0|2,0,0]=4 326 B13R1.599 CNC(=NCCC1=C(N=CS1)C)N m_264822__10719602__3499590 [0,2,0,0,0,0|2,0,0]=4 327 B13R1.599 CNC(=O)CCCC1=C(C=CS1)C m_22__387492__7640678 [0,2,0,0,0,0|2,0,0]=4 328 B13R1.599 CNC(=O)CSCC1=C(N=CS1)C m_62__10346964__81300 [0,2,0,0,0,0|2,0,0]=4 329 B13R1.599 CNC(=O)NCCC1=C(N=CS1)C m_2554__10719588__788506 [0,2,0,0,0,0|1,0,0]=3 330 B13R1.599 CNC(=S)NCCC1=C(N=CS1)C m_8__10719558__83693 [0,2,0,0,0,0|1,1,0]=4 331 B13R1.599 COC(=O)CCCC1=C(C=CS1)C m_276436__14076652__14097764 [0,2,0,0,0,0|2,0,0]=4 332 B13R1.599 COC(=O)CNCC1=C(N=CS1)C m_270004__24790270__7549218 [0,2,0,0,0,0|2,0,0]=4 333 B13R1.599 COC(=O)CSCC1=C(N=CS1)C m_7__29561__10346958 [0,2,0,0,0,0|2,0,0]=4 334 B13R1.599 COC(=O)NCCC1=C(N=CS1)C m_282070__22223162__22151046 [0,2,0,0,0,0|1,0,0]=3 335 B13R1.599 COC(=O)OCSC1=C(C=CS1)C m_7__14781726__16604542 [0,2,0,0,0,0|2,0,0]=4 336 B13R1.3485 CC(=O)NCCC1=C(N=C(S1)C)C m_270062__7615004__15585492 [0,2,0,0,0,0|1,0,0]=3 337 B13R1.3485 CC(=O)NCCC1=C(N=C(S1)N)C m_270062__21864172__15585492 [0,2,0,0,0,0|1,0,0]=3 338 B13R1.3485 CC(=O)NOCC1=C(N=C(S1)Br)C m_34__2463346__17314188 [0,2,0,0,0,0|2,0,0]=4 339 B13R1.3485 CC(=O)OCCC1=C(N=C(S1)C)C m_276436__14084976__14088324 [0,2,0,0,0,0|0,0,0]=2 340 B13R1.3485 CC(=O)OCCC1=C(SC(=C1)C)C m_276436__14083826__14088324 [0,2,0,0,0,0|2,0,0]=4 341 B13R1.3485 CC(=O)OCCC1=CC(=NN1C)Br m_276436__14085430__14088324 [0,2,0,0,0,0|2,0,0]=4 342 B13R1.3485 CC(=O)OCCC1=CN(N=C1C)C m_276436__14082730__14088324 [0,2,0,0,0,0|2,0,0]=4 343 B13R1.3485 CC(=O)OCCN1C=C(N=C1C)C m_7__7838066__22601252 [0,2,0,0,0,0|2,0,0]=4 344 B13R1.3485 CC(=O)OCCN1N=C(N=C1C)Cl m_7__12621754__11982590 [0,2,0,0,0,0|2,0,0]=4 345 B13R1.3485 CC1=C(SC(=N1)Br)CSCC(=O)N m_7__10975714__17314186 [0,2,0,0,0,0|2,0,0]=4 346 B13R1.3485 CC1=C(SC(=N1)Br)CSCC(=O)O m_7__26823__17314186 [0,2,0,0,0,0|2,0,0]=4 347 B13R1.3485 CC1=NC(=C(S1)CCNC(=N)N)C m_58668__4279234__2227896 [0,2,0,0,0,0|2,0,0]=4 348 B13R1.3485 CC1=NC(=C(S1)CCNC(=O)N)C m_2554__4279226__788524 [0,2,0,0,0,0|1,0,0]=3 349 B13R1.686 C=CCCN(C)CC1=C(N=CS1)C m_2230__4357242__8929530 [0,2,0,0,0,0|2,0,0]=4 350 B13R1.686 C=CCOC(=O)CC1=C(N=CS1)C m_1458__17755654__489874 [0,2,0,0,0,0|1,0,1]=4 351 B13R1.686 CC1=C(SC=N1)CC(=O)NNC=O m_22__9864706__17755650 [0,2,0,0,0,0|1,0,1]=4 352 B13R1.686 CC1=C(SC=N1)CN(C)C/C=C\Br m_2230__4357242__22384838 [0,2,0,0,0,0|2,0,0]=4 353 B13R1.686 CC1=C(SC=N1)CN(C)CC=CCl m_2230__4357242__667198 [0,2,0,0,0,0|2,0,0]=4 354 B13R1.686 CC1=C(SC=N1)CS(=O)CC=CCl m_1498__13192736__10346972 [0,2,0,0,0,0|2,0,0]=4 355 B13R1.686 CC1=C(SC=N1)NC(=O)CNC=O m_22__9208350__21204898 [0,2,0,0,0,0|1,0,1]=4 356 B13R1.686 CC=CCN(C)CC1=C(N=CS1)C m_2230__4357242__681024 [0,2,0,0,0,0|2,0,0]=4 357 B13R1.686 CC=CCS(=O)CC1=C(N=CS1)C m_1498__3114452__10346972 [0,2,0,0,0,0|2,0,0]=4 358 B13R1.444 C=CCC(C)NCC1=C(N=CS1)C m_207__5002580__6175032 [0,2,0,0,0,0|2,0,0]=4 359 B13R1.444 C=CCN(C)CCC1=C(N=CS1)C m_2230__9044904__5337466 [0,2,0,0,0,0|2,0,0]=4 360 B13R1.444 CCOC(=O)CCC1=C(N=CS1)C m_1458__10965216__1327610 [0,2,0,0,0,0|1,0,1]=4 361 B13R1.167 C=C(Br)CCSCC1=C(N=CS1)C m_62__15782476__10346966 [0,2,0,0,0,0|2,0,0]=4 362 B13R1.167 C=C(Br)CSCCC1=C(N=CS1)C m_7__22602174__4913806 [0,2,0,0,0,0|1,1,0]=4 363 B13R1.167 C=C(C)CCNCC1=C(N=CS1)C m_207__10740042__6175032 [0,2,0,0,0,0|2,0,0]=4 364 B13R1.167 C=C(C)CCSCC1=C(N=CS1)C m_62__10158742__10346966 [0,2,0,0,0,0|2,0,0]=4 365 B13R1.167 C=C(C)CSCCC1=C(N=CS1)C m_62__6464432__9273978 [0,2,0,0,0,0|1,1,0]=4 366 B13R1.167 C=C(Cl)CSCCC1=C(N=CS1)C m_62__11986394__9273978 [0,2,0,0,0,0|1,1,0]=4 367 B13R1.167 C=C(F)CSCCC1=C(N=CS1)C m_62__17849116__9273978 [0,2,0,0,0,0|1,1,0]=4 368 B13R1.167 C=C(I)CSCCC1=C(N=CS1)C m_62__18682538__9273978 [0,2,0,0,0,0|1,1,0]=4 369 B13R1.167 CC(=CCNCC1=C(N=CS1)C)C m_207__9277650__6175032 [0,2,0,0,0,0|2,0,0]=4 370 B13R1.167 CC(=CCSCC1=C(N=CS1)C)C m_62__12201838__10346966 [0,2,0,0,0,0|2,0,0]=4 371 B13R1.167 CC(=O)CCCSC1=C(C=CS1)C m_7__14781726__322712 [0,2,0,0,0,0|2,0,0]=4 372 B13R1.167 CC(=O)NCCCC1=C(N=CS1)C m_270062__15358716__15585492 [0,2,0,0,0,0|1,0,0]=3 373 B13R1.167 CC(=O)NOCCC1=C(N=CS1)C m_34__2463346__10125434 [0,2,0,0,0,0|0,0,0]=2 374 B13R1.167 CC(=O)NOCCC1=CC=NN1C m_34__2463346__12860244 [0,2,0,0,0,0|2,0,0]=4 375 B13R1.167 CC(=O)OCCCC1=C(N=CS1)C m_276436__14085568__14088324 [0,2,0,0,0,0|0,0,0]=2 376 B13R1.167 CC(=O)OCCCN1C=CN=C1C m_1458__473186__8164358 [0,2,0,0,0,0|2,0,0]=4 377 B13R1.167 CC(=O)OCCOC1=C(SC=C1)C m_7__22986706__22601252 [0,2,0,0,0,0|2,0,0]=4 378 B13R1.167 CC(=O)OCCSC1=C(C=CS1)C m_7__14781726__22601252 [0,2,0,0,0,0|1,0,0]=3 379 B13R1.167 CC(=O)OCCSC1=C(OC=C1)C m_7__8592942__22601252 [0,2,0,0,0,0|2,0,0]=4 380 B13R1.167 CC(=O)OCCSC1=CNN=C1C m_7__23915254__22601252 [0,2,0,0,0,0|2,0,0]=4 381 B13R1.167 CC(=O)OCCSC1=NC=NN1C m_7__8750426__22601252 [0,2,0,0,0,0|2,0,0]=4 382 B13R1.167 CC(=O)OCSCC1=CC=NN1C m_7__22987414__20618926 [0,2,0,0,0,0|2,0,0]=4 383 B13R1.167 CC(=O)OCSCC1=NON=C1C m_7__22986926__20618926 [0,2,0,0,0,0|2,0,0]=4 384 B13R1.167 CC1=C(OC=N1)CNCCC(=O)N m_273610__13859696__11515976 [0,2,0,0,0,0|1,1,0]=4 385 B13R1.167 CC1=C(OC=N1)CNCCC(=O)O m_271304__8910652__16776056 [0,2,0,0,0,0|1,1,0]=4 386 B13R1.167 CC1=C(SC=C1)CNCCC(=O)N m_273610__11519942__11515976 [0,2,0,0,0,0|2,0,0]=4 387 B13R1.167 CC1=C(SC=C1)CNCCC(=O)O m_271304__8910652__9304598 [0,2,0,0,0,0|2,0,0]=4 388 B13R1.167 CC1=C(SC=C1)SCCCC(=O)N m_7__14781726__22787802 [0,2,0,0,0,0|2,0,0]=4 389 B13R1.167 CC1=C(SC=N1)C=NOCC(=O)N m_4__24403962__6175020 [0,2,0,0,0,0|1,0,1]=4 390 B13R1.167 CC1=C(SC=N1)CCCNC(=N)N m_58668__15358708__2227896 [0,2,0,0,0,0|2,0,0]=4 391 B13R1.167 CC1=C(SC=N1)CCCNC(=O)N m_2554__15358700__788524 [0,2,0,0,0,0|1,0,0]=3 392 B13R1.167 CC1=C(SC=N1)CCSCC(=O)N m_7__10975714__4913806 [0,2,0,0,0,0|0,1,0]=3 393 B13R1.167 CC1=C(SC=N1)CCSCC(=O)O m_7__26823__4913806 [0,2,0,0,0,0|0,1,0]=3 394 B13R1.167 CC1=C(SC=N1)CNCCC(=O)N m_273610__11521878__11515976 [0,2,0,0,0,0|1,0,0]=3 395 B13R1.167 CC1=C(SC=N1)CNCCS(=O)C m_207__4999584__6175032 [0,2,0,0,0,0|2,0,0]=4 396 B13R1.167 CC1=C(SC=N1)CSCC=C(Cl)Cl m_62__11985916__10346966 [0,2,0,0,0,0|2,0,0]=4 397 B13R1.167 CC1=C(SC=N1)CSCCC(=O)N m_62__10346964__593690 [0,2,0,0,0,0|1,0,0]=3 398 B13R1.167 CC1=C(SN=N1)CNCCC(=O)N m_273610__11529546__11515976 [0,2,0,0,0,0|2,0,0]=4 399 B13R1.167 CC1=C(SN=N1)CNCCC(=O)O m_271304__8910652__16775800 [0,2,0,0,0,0|2,0,0]=4 400 B13R1.167 CC1=NC=CN1CCOCC(=O)N m_7__7838062__22786946 [0,2,0,0,0,0|2,0,0]=4 401 B13R1.167 NC(=O)CCSCC1=C(N=CS1)Cl m_62__12860300__593690 [0,2,0,0,0,0|2,0,0]=4 402 B13R1.190 C=CCCNCC1=C(N=C(S1)Br)C m_270004__11969962__15765766 [0,2,0,0,0,0|2,0,0]=4 403 B13R1.190 C=CCCNCC1=C(N=C(S1)C)C m_207__11969928__5182702 [0,2,0,0,0,0|2,0,0]=4 404 B13R1.190 CC1=C(SC(=N1)Br)CSC/C=C\Br m_7__22544354__17314186 [0,2,0,0,0,0|2,0,0]=4 405 B13R1.190 CC1=NC(=C(S1)CNCC=CBr)C m_207__15075148__5182702 [0,2,0,0,0,0|2,0,0]=4 406 B13R1.190 CC1=NC(=C(S1)CNCC=CCl)C m_207__13447998__5182702 [0,2,0,0,0,0|2,0,0]=4 407 B13R1.190 CC=CCNCC1=C(N=C(S1)C)C m_207__14317866__5182702 [0,2,0,0,0,0|2,0,0]=4 408 B13R1.654 C/C=C/CCNCC1=C(N=CS1)C m_270004__23849830__7549218 [0,2,0,0,0,0|2,0,0]=4 409 B13R1.654 C/C=C/CCSCC1=C(N=CS1)C m_62__23858414__10346966 [0,2,0,0,0,0|2,0,0]=4 410 B13R1.654 C=C=CCCNCC1=C(N=CS1)C m_207__23465992__6175032 [0,2,0,0,0,0|2,0,0]=4 411 B13R1.654 C=CCCCNCC1=C(N=CS1)C m_207__16486362__6175032 [0,2,0,0,0,0|2,0,0]=4 412 B13R1.654 C=CCCCSCC1=C(N=CS1)C m_62__5064068__10346966 [0,2,0,0,0,0|2,0,0]=4 413 B13R1.654 C=CCCSCCC1=C(N=CS1)C m_62__9875552__9273978 [0,2,0,0,0,0|1,1,0]=4 414 B13R1.654 C=CCOCCSC1=C(C=CS1)C m_7__14781726__13774594 [0,2,0,0,0,0|2,0,0]=4 415 B13R1.654 C=CCSCCCC1=C(N=CS1)C m_62__8363994__24459368 [0,2,0,0,0,0|1,1,0]=4 416 B13R1.654 CC1=C(SC=N1)CCSC/C=C\Br m_7__22544354__4913806 [0,2,0,0,0,0|1,1,0]=4 417 B13R1.654 CC1=C(SC=N1)CNCC=CCO m_207__11971532__6175032 [0,2,0,0,0,0|1,0,1]=4 418 B13R1.654 CC1=C(SC=N1)CNCCC=CBr m_207__16490010__6175032 [0,2,0,0,0,0|2,0,0]=4 419 B13R1.654 CC=CCSCCC1=C(N=CS1)C m_62__4275932__9273978 [0,2,0,0,0,0|1,1,0]=4 420 B13R1.654 CCC=CCNCC1=C(N=CS1)C m_207__17312546__6175032 [0,2,0,0,0,0|2,0,0]=4 421 B13R1.654 CCC=NOCCC1=C(N=CS1)C m_34__17309904__10125434 [0,2,0,0,0,0|1,0,0]=3 422 B13R1.654 CCOCCNCC1=C(N=CS1)C m_207__872232__6175032 [0,2,0,0,0,0|1,0,1]=4 423 B13R1.654 CCOCCSCC1=C(N=CS1)C m_62__204255__10346966 [0,2,0,0,0,0|1,0,1]=4 424 B13R1.725 C=CCCNC(C)C1=C(N=CS1)C m_2230__20860188__8929530 [0,2,0,0,0,0|2,0,0]=4 425 B13R1.725 CC1=C(SC=N1)C(C)NC/C=C\Br m_2230__20860188__22384838 [0,2,0,0,0,0|2,0,0]=4 426 B13R1.725 CC1=C(SC=N1)C(C)NCC=CCl m_2230__20860188__667198 [0,2,0,0,0,0|2,0,0]=4 427 B13R1.725 CC=CCNC(C)C1=C(N=CS1)C m_2230__20860188__681024 [0,2,0,0,0,0|2,0,0]=4 428 B11R2.51 C=C1CC1C2=C(C=CS2)C m_271570__24797904__11652204 [1,0,0,1,0,0|2,0,0]=4 429 B11R2.51 C=C1CC1C2=C(N=CO2)C m_271570__24797904__23409840 [1,0,0,1,0,0|1,1,0]=4 430 B11R2.51 C=C1CC1C2=C(N=CS2)C m_271570__24797904__15064092 [1,0,0,1,0,0|1,0,0]=3 431 B11R2.51 CC1=C(SC=N1)[C@@H]2C[C@H]2C m_271570__24798142__15064092 [1,0,0,1,0,0|1,0,1]=4 432 B13R2.144 CC1=NC=CN1C2COC(=O)O2 m_7__7838062__10115988 [0,1,0,1,0,0|2,0,0]=4 433 B13R2.430 CC(=O)N1CCC2=C(C1)C=CS2 m_270062__7597212__15585492 [0,1,0,1,0,0|2,0,0]=4 434 B13R2.430 CC(=O)N1CCC2=C(C1)N=CO2 m_270062__17649332__15585492 [0,1,0,1,0,0|1,1,0]=4 435 B13R2.430 NC(=O)C1CCC2=C(C1)N=CN2 m_22__58357__10706258 [0,1,0,1,0,0|2,0,0]=4 436 B13R2.543 CC(=O)CN1CC2=C(C1)SC=N2 m_2230__22406278__12369270 [0,1,0,1,0,0|2,0,0]=4 437 B13R2.543 NC(=O)CN1CC2=C(C1)SC=N2 m_2230__22406278__680278 [0,1,0,1,0,0|2,0,0]=4 438 B13R2.543 O=C(O)CN1CC2=C(C1)SC=N2 m_270122__22552610__22563622 [0,1,0,1,0,0|2,0,0]=4 439 B13R2.3437 CC1=C(SC=C1)[C@@H]2C[C@H]2C(=O)N m_22__58357__18984736 [0,1,0,1,0,0|2,0,0]=4 440 B13R2.29 CC1=C(SC=N1)CN2CC=CC2 m_270004__24150350__7549218 [0,1,0,1,0,0|2,0,0]=4 441 B13R2.181 CC1=NC=CN1C2CCOC2=O m_7__7838062__5073 [0,1,0,1,0,0|2,0,0]=4 442 B13R2.360 CC1=C(SC=C1)SC2CCC2=O m_7__14781726__20026952 [0,1,0,1,0,0|2,0,0]=4 443 B13R2.15 CC1=C(SC=N1)C2=CCOCC2 m_271570__10145250__15064092 [0,1,0,1,0,0|1,0,1]=4 444 B13R2.164 Br/C=C\CN1CC2=C(C1)SC=N2 m_2230__22406278__22384838 [0,1,0,1,0,0|2,0,0]=4 445 B13R2.164 C=CCCN1CC2=C(C1)SC=N2 m_2230__22406278__8929530 [0,1,0,1,0,0|2,0,0]=4 446 B13R2.164 CC=CCN1CC2=C(C1)SC=N2 m_2230__22406278__681024 [0,1,0,1,0,0|2,0,0]=4 447 B13R2.164 ClC=CCN1CC2=C(C1)SC=N2 m_2230__22406278__667198 [0,1,0,1,0,0|2,0,0]=4