0 B8R1.8 BrCCN1C=NC=N1 BBS-00032679 [0,0,0,0,0,0|2,0,1]=3 1 B8R1.8 ClCCC1=CC=CS1 BBS-00032937 [0,0,0,0,0,0|3,0,0]=3 2 B8R1.8 N#CCC1=CC=CS1 BBS-00028312 [0,0,0,0,0,0|2,0,2]=4 3 B8R1.8 N#CCC1=CC=NN1 BBS-00021198 [0,0,0,0,0,0|2,0,2]=4 4 B8R1.8 NCCC1=CC=NN1 BBS-00021147 [0,0,0,0,0,0|2,0,0]=2 5 B8R1.8 NCCC1=CN=CN1 BBS-00029290 [0,0,0,0,0,0|0,0,0]=0 6 B8R1.8 NCCC1=CNC=N1 BBS-00027670 [0,0,0,0,0,0|0,0,2]=2 7 B8R1.8 NCCC1=NC=CN1 BBS-00019936 [0,0,0,0,0,0|2,0,0]=2 8 B8R1.8 NCCC1=NC=CS1 BBS-00011996 [0,0,0,0,0,0|2,0,1]=3 9 B8R1.8 NCCC1=NC=NN1 BBS-00018766 [0,0,0,0,0,0|1,0,1]=2 10 B8R1.8 NCCC1=NN=NN1 BBS-00021024 [0,0,0,0,0,0|2,0,0]=2 11 B8R1.8 NCCC1=NNC=C1 BBS-00025306 [0,0,0,0,0,0|2,0,1]=3 12 B8R1.8 NCCN1C=CC=C1 BBS-00027433 [0,0,0,0,0,0|3,0,0]=3 13 B8R1.8 NCCN1C=CC=N1 BBS-00030821 [0,0,0,0,0,0|2,0,1]=3 14 B8R1.8 NCCN1C=CN=C1 BBS-00023839 [0,0,0,0,0,0|2,0,0]=2 15 B8R1.8 NCCN1C=CN=C1 BBS-00038221 [0,0,0,0,0,0|2,0,0]=2 16 B8R1.8 OCCC1=CON=C1 BBS-00010744 [0,0,0,0,0,0|3,0,0]=3 17 B7R1.1 CCC1=NC=NN1 BBS-00035787 [1,0,0,0,0,0|1,0,1]=3 18 B7R1.1 CCN1C=CN=N1 BBS-00036375 [1,0,0,0,0,0|3,0,0]=4 19 B7R1.1 CNC1=NNN=C1 BBS-00025954 [1,0,0,0,0,0|2,0,1]=4 20 B7R1.1 CSC1=CNN=C1 BBS-00037384 [1,0,0,0,0,0|3,0,0]=4 21 B7R1.1 ClCC1=CC=NN1 BBS-00025302 [1,0,0,0,0,0|3,0,0]=4 22 B7R1.1 ClCC1=CN=CN1 BBS-00029874 [1,0,0,0,0,0|1,0,0]=2 23 B7R1.1 NCC1=CC=CO1 BBS-00003604 [1,0,0,0,0,0|2,0,0]=3 24 B7R1.1 NCC1=CC=CS1 BBS-00003607 [1,0,0,0,0,0|2,0,0]=3 25 B7R1.1 NCC1=CNN=C1 BBS-00027352 [1,0,0,0,0,0|2,0,0]=3 26 B7R1.1 NCC1=CNN=N1 BBS-00024533 [1,0,0,0,0,0|1,0,2]=4 27 B7R1.1 NCC1=NC=NN1 BBS-00018755 [1,0,0,0,0,0|1,0,1]=3 28 B7R1.1 NCC1=NOC=N1 BBS-00032917 [1,0,0,0,0,0|2,0,1]=4 29 B7R1.1 OCC1=CC=CO1 BBS-00004319 [1,0,0,0,0,0|3,0,0]=4 30 B7R1.1 OCC1=CN=CN1 BBS-00029424 [1,0,0,0,0,0|1,0,0]=2 31 B7R1.1 OCC1=CNC=N1 BBS-00019934 [1,0,0,0,0,0|1,0,2]=4 32 B7R1.1 OCC1=NNN=C1 BBS-00032469 [1,0,0,0,0,0|2,0,1]=4 33 B7R1.1 SCC1=CC=CO1 BBS-00028712 [1,0,0,0,0,0|3,0,0]=4 34 B9R1.7 CC1=CSC(CCN)=N1 BBS-00008550 [0,1,0,0,0,0|2,0,1]=4 35 B9R1.7 CC1=CSC(CCN)=N1 BBS-00034704 [0,1,0,0,0,0|2,0,1]=4 36 B9R1.7 CC1=NC(CCN)=CS1 BBS-00008541 [0,1,0,0,0,0|1,0,1]=3 37 B9R1.7 CC1=NNC(CCN)=C1 BBS-00037294 [0,1,0,0,0,0|2,0,0]=3 38 B9R1.7 CC1=NNC(CCN)=N1 BBS-00018667 [0,1,0,0,0,0|1,0,1]=3 39 B9R1.7 CC1=NOC(CCN)=N1 BBS-00013455 [0,1,0,0,0,0|1,0,1]=3 40 B9R1.7 CC1=NOC(CCN)=N1 BBS-00034698 [0,1,0,0,0,0|1,0,1]=3 41 B9R1.7 CCCC1=NC(N)=NN1 BBS-00038750 [0,1,0,0,0,0|2,0,1]=4 42 B9R1.7 CCCC1=NN=C(N)S1 BBS-00008374 [0,1,0,0,0,0|3,0,0]=4 43 B9R1.7 CCSC1=NN=C(N)N1 BBS-00023733 [0,1,0,0,0,0|3,0,0]=4 44 B9R1.7 CN1C=C(CCO)C=N1 BBS-00010743 [0,1,0,0,0,0|3,0,0]=4 45 B9R1.7 CN1C=NC(CCN)=N1 BBS-00024343 [0,1,0,0,0,0|1,0,2]=4 46 B9R1.7 NCCC1=CC(Cl)=CS1 BBS-00035995 [0,1,0,0,0,0|2,0,0]=3 47 B9R1.7 NCCC1=NC(N)=NN1 BBS-00018764 [0,1,0,0,0,0|1,0,1]=3 48 B9R1.7 NCCC1=NN=C(S)O1 BBS-00029085 [0,1,0,0,0,0|2,0,0]=3 49 B9R1.7 NCCC1=NNC(=O)N1 BBS-00024286 [0,1,0,0,0,0|1,0,1]=3 50 B9R1.7 NCCC1=NNC(=S)N1 BBS-00024453 [0,1,0,0,0,0|1,0,1]=3 51 B9R1.11 CC(CN)C1=CC=CS1 BBS-00017188 [0,1,0,0,0,0|2,0,0]=3 52 B9R1.11 CC(CN)N1C=NC=N1 BBS-00005907 [0,1,0,0,0,0|1,0,1]=3 53 B9R1.11 NCC(=O)C1=CC=CS1 BBS-00025037 [0,1,0,0,0,0|2,0,1]=4 54 B9R1.11 O=C(CCl)C1=CC=CN1 BBS-00025366 [0,1,0,0,0,0|2,0,1]=4 55 B9R1.12 NCCCC1=NN=NN1 BBS-00021025 [0,1,0,0,0,0|2,0,0]=3 56 B9R1.12 NCCCN1C=CN=C1 BBS-00012077 [0,1,0,0,0,0|2,0,0]=3 57 B9R1.12 NC\C=C\C1=CC=CO1 BBS-00017223 [0,1,0,0,0,0|2,0,1]=4 58 B9R1.33 CC1=NC=CN1CCN BBS-00030822 [0,1,0,0,0,0|2,0,0]=3 59 B9R1.33 CN1N=CN=C1CCN BBS-00024344 [0,1,0,0,0,0|1,0,1]=3 60 B7R0.7 CCNC(=O)CCN BBS-00032030 [0,0,1,0,0,0|2,0,1]=4 61 B9R2.2 C1=CNC(C2CC2)=N1 BBS-00037320 [0,0,0,1,0,0|3,0,0]=4 62 B9R2.2 C1=NC(C2CC2)=CS1 BBS-00029177 [0,0,0,1,0,0|2,0,1]=4 63 B9R2.3 C1=C2CCCC2=NN1 BBS-00015521 [0,0,0,1,0,0|3,0,0]=4 64 B9R2.3 C1=NC2=C(CCC2)N1 BBS-00021801 [0,0,0,1,0,0|1,0,0]=2 65 B9R2.3 C1=NNC2=C1CCC2 BBS-00015073 [0,0,0,1,0,0|3,0,0]=4 66 B9R1.8 BrCCC1=CC=CC=C1 BBS-00028228 [0,0,0,0,0,1|3,0,0]=4 67 B9R1.8 CNCC1=CC=NC=C1 BBS-00028317 [0,0,0,0,0,1|3,0,0]=4 68 B9R1.8 CNCC1=NC=CN=C1 BBS-00032926 [0,0,0,0,0,1|2,0,1]=4 69 B9R1.8 ClCCC1=CC=CC=C1 BBS-00027739 [0,0,0,0,0,1|3,0,0]=4 70 B9R1.8 N#CCC1=CC=NC=C1 BBS-00036923 [0,0,0,0,0,1|1,0,2]=4 71 B9R1.8 NOCC1=CC=CC=C1 BBS-00029336 [0,0,0,0,0,1|3,0,0]=4 72 B9R1.8 OCCC1=CC=CC=C1 BBS-00004355 [0,0,0,0,0,1|3,0,0]=4 73 B9R1.8 OCCC1=NC=CC=C1 BBS-00028971 [0,0,0,0,0,1|2,0,1]=4 74 B6R0.6 C(CCN)=CCN BBS-00026110 [1,0,1,0,0,0|0,0,1]=3 75 B6R0.1 CCC\C(N)=N\O BBS-00019744 [1,0,1,0,0,0|2,0,0]=4 76 B6R1.2 BrC1=NN=CN1 BBS-00015773 [2,0,0,0,0,0|2,0,0]=4 77 B6R1.2 CC1=NN=CN1 BBS-00024130 [2,0,0,0,0,0|1,0,0]=3 78 B6R1.2 NC1=CC=NN1 BBS-00020486 [2,0,0,0,0,0|2,0,0]=4 79 B6R1.2 NC1=CNN=C1 BBS-00038255 [2,0,0,0,0,0|2,0,0]=4 80 B6R1.2 NC1=CON=C1 BBS-00025072 [2,0,0,0,0,0|2,0,0]=4 81 B6R1.2 NC1=NC=CN1 BBS-00036978 [2,0,0,0,0,0|2,0,0]=4 82 B6R1.2 NC1=NC=NN1 BBS-00028951 [2,0,0,0,0,0|1,0,1]=4 83 B6R1.2 NC1=NN=CN1 BBS-00028670 [2,0,0,0,0,0|1,0,0]=3 84 B6R1.2 NC1=NN=CS1 BBS-00025590 [2,0,0,0,0,0|2,0,0]=4 85 B6R1.2 S=C1NC=NN1 BBS-00002897 [2,0,0,0,0,0|2,0,0]=4 86 B6R1.2 SC1=NN=CN1 BBS-00002902 [2,0,0,0,0,0|2,0,0]=4 87 B8R1.1 CC1=NC(CN)=CS1 BBS-00015630 [1,1,0,0,0,0|1,0,1]=4 88 B8R1.1 CC1=NC(CN)=CS1 BBS-00029933 [1,1,0,0,0,0|1,0,1]=4 89 B8R1.1 CC1=NNC(CN)=N1 BBS-00024297 [1,1,0,0,0,0|1,0,1]=4 90 B8R1.1 CC1=NOC(CN)=N1 BBS-00012270 [1,1,0,0,0,0|1,0,1]=4 91 B8R1.1 CCC1=CN=C(N)S1 BBS-00029175 [1,1,0,0,0,0|1,0,0]=3 92 B8R1.1 CCC1=CN=C(S)N1 BBS-00029038 [1,1,0,0,0,0|0,0,0]=2 93 B8R1.1 CCC1=CSC(N)=N1 BBS-00029174 [1,1,0,0,0,0|1,0,1]=4 94 B8R1.1 CCC1=NC(Br)=NN1 BBS-00035797 [1,1,0,0,0,0|1,0,1]=4 95 B8R1.1 CCC1=NC(N)=NN1 BBS-00038272 [1,1,0,0,0,0|1,0,1]=4 96 B8R1.1 CCC1=NC=C(C)N1 BBS-00023652 [1,1,0,0,0,0|2,0,0]=4 97 B8R1.1 CCC1=NN=C(N)S1 BBS-00004451 [1,1,0,0,0,0|2,0,0]=4 98 B8R1.1 CCC1=NNC(=S)N1 BBS-00013058 [1,1,0,0,0,0|1,0,1]=4 99 B8R1.1 NCC1=CC(Cl)=CO1 BBS-00036625 [1,1,0,0,0,0|2,0,0]=4 100 B8R1.1 NCC1=CC(Cl)=CO1 BBS-00036641 [1,1,0,0,0,0|2,0,0]=4 101 B8R1.1 NCC1=CC(Cl)=CS1 BBS-00036287 [1,1,0,0,0,0|2,0,0]=4 102 B8R1.1 NCC1=NC(N)=NN1 BBS-00024312 [1,1,0,0,0,0|1,0,1]=4 103 B8R1.1 NCC1=NN=C(S)O1 BBS-00029067 [1,1,0,0,0,0|2,0,0]=4 104 B8R1.1 NCC1=NNC(=O)N1 BBS-00024318 [1,1,0,0,0,0|1,0,1]=4 105 B8R1.1 SCC1=NN=C(S)N1 BBS-00002272 [1,1,0,0,0,0|2,0,0]=4 106 B8R1.7 CC(=O)C1=CN=CS1 BBS-00029168 [1,1,0,0,0,0|1,0,1]=4 107 B8R1.7 CC(N)C1=CSC=C1 BBS-00020656 [1,1,0,0,0,0|2,0,0]=4 108 B8R1.7 CC(N)C1=NC=NN1 BBS-00024403 [1,1,0,0,0,0|1,0,1]=4 109 B8R1.7 NC(=S)C1=NN=CN1 BBS-00024182 [1,1,0,0,0,0|1,0,1]=4 110 B8R1.7 O=C(O)C1=CN=CN1 BBS-00025657 [1,1,0,0,0,0|1,0,1]=4 111 B8R1.11 CC1=C(CN)C=NN1 BBS-00034769 [1,1,0,0,0,0|2,0,0]=4 112 B8R1.11 CC1=NON=C1CN BBS-00021471 [1,1,0,0,0,0|1,0,1]=4 113 B8R1.11 CC1=NSN=C1CN BBS-00036038 [1,1,0,0,0,0|1,0,1]=4 114 B8R1.11 CN1C=CN=C1CN BBS-00005325 [1,1,0,0,0,0|2,0,0]=4 115 B8R1.11 CN1C=CN=C1CN BBS-00032537 [1,1,0,0,0,0|2,0,0]=4 116 B8R1.11 CN1C=NC=C1CN BBS-00032625 [1,1,0,0,0,0|0,0,0]=2 117 B8R1.11 CN1N=CC=C1CN BBS-00032641 [1,1,0,0,0,0|2,0,0]=4 118 B8R1.11 CN1N=CN=C1CN BBS-00024405 [1,1,0,0,0,0|1,0,1]=4 119 B10R1.1 NCCC1=CC=C(Cl)C=C1 BBS-00003605 [0,1,0,0,0,1|2,0,0]=4 120 B10R1.10 CC1=CC=CC(CCN)=C1 BBS-00016386 [0,1,0,0,0,1|2,0,0]=4 121 B10R1.10 NCCC1=CC(Br)=CC=C1 BBS-00025843 [0,1,0,0,0,1|2,0,0]=4 122 B10R1.10 NCCC1=CC(F)=CC=C1 BBS-00017096 [0,1,0,0,0,1|2,0,0]=4 123 B10R1.15 CC(CN)C1=CC=CC=C1 BBS-00006774 [0,1,0,0,0,1|2,0,0]=4 124 B10R1.15 NCC(O)C1=CC=CN=C1 BBS-00021915 [0,1,0,0,0,1|1,0,0]=3 125 B10R1.15 NCC(O)C1=CC=NC=C1 BBS-00021917 [0,1,0,0,0,1|1,0,0]=3 126 B10R1.15 NCC(O)C1=NC=CC=C1 BBS-00021918 [0,1,0,0,0,1|1,0,1]=4 127 B10R1.17 CNCCC1=NC=CC=C1 BBS-00002883 [0,1,0,0,0,1|1,0,1]=4 128 B10R1.17 NCCCC1=CC=CC=C1 BBS-00017110 [0,1,0,0,0,1|2,0,0]=4 129 B10R1.17 NCCCC1=NC=CC=C1 BBS-00021922 [0,1,0,0,0,1|1,0,1]=4 130 B10R1.17 NCCNC1=CC=CC=C1 BBS-00013712 [0,1,0,0,0,1|2,0,0]=4 131 B10R1.17 NCCNC1=NC=CC=N1 BBS-00034774 [0,1,0,0,0,1|1,0,1]=4 132 B10R1.17 NCCOC1=CC=CC=C1 BBS-00026030 [0,1,0,0,0,1|2,0,0]=4 133 B10R1.17 NCCSC1=CC=CC=C1 BBS-00030833 [0,1,0,0,0,1|2,0,0]=4 134 B10R1.17 NCCSC1=CC=CC=C1 BBS-00034697 [0,1,0,0,0,1|2,0,0]=4 135 B10R1.16 CC1=NNC(CCCN)=N1 BBS-00024293 [0,2,0,0,0,0|1,0,1]=4 136 B10R1.16 CC1=NOC(CCCN)=N1 BBS-00022561 [0,2,0,0,0,0|1,0,1]=4 137 B10R1.16 CC1=NOC(CCCN)=N1 BBS-00034786 [0,2,0,0,0,0|1,0,1]=4 138 B10R1.16 CCCSC1=NN=C(N)N1 BBS-00008020 [0,2,0,0,0,0|2,0,0]=4 139 B10R1.16 NC1=NN=C(CCCO)N1 BBS-00001110 [0,2,0,0,0,0|2,0,0]=4 140 B10R1.16 NCCCC1=NC(N)=NN1 BBS-00024313 [0,2,0,0,0,0|1,0,1]=4 141 B10R1.94 CCCC1=NN=C(S)N1N BBS-00008741 [0,2,0,0,0,0|2,0,0]=4 142 B10R1.6 CC(O)(CN)C1=CC=CO1 BBS-00032610 [0,2,0,0,0,0|2,0,0]=4 143 B10R1.6 CC(O)(CN)C1=CC=CS1 BBS-00032663 [0,2,0,0,0,0|2,0,0]=4 144 B10R1.11 CC(CCN)C1=CC=CS1 BBS-00017186 [0,2,0,0,0,0|2,0,0]=4 145 B10R1.11 NCCC(O)C1=CC=CO1 BBS-00025151 [0,2,0,0,0,0|2,0,0]=4 146 B10R1.27 NCC(O)CN1C=CN=C1 BBS-00010654 [0,2,0,0,0,0|2,0,0]=4 147 B10R1.29 NN1C=NN=C1SCCO BBS-00008428 [0,2,0,0,0,0|2,0,0]=4 148 B10R1.187 CC1=NOC(C)=C1CCN BBS-00024971 [0,2,0,0,0,0|2,0,0]=4 149 B8R1.2 NCC1=CC=CN=C1 BBS-00003679 [0,0,1,1,0,0|1,0,1]=4 150 B8R1.2 NCC1=CC=CN=C1 BBS-00007983 [0,0,1,1,0,0|1,0,1]=4 151 B10R2.7 C1=CC=C2NCCC2=C1 BBS-00020855 [0,0,0,1,0,1|2,0,0]=4 152 B10R2.2 NC1=NC2=C(CCC2)S1 BBS-00002729 [0,1,0,1,0,0|2,0,0]=4 153 B10R2.2 NC1=NC2=C(CCC2)S1 BBS-00032607 [0,1,0,1,0,0|2,0,0]=4 154 B10R2.2 NC1=NC2=C(CCC2)S1 BBS-00038360 [0,1,0,1,0,0|2,0,0]=4 155 B10R2.14 NC1=NN=C(C2CC2)N1 BBS-00006896 [0,1,0,1,0,0|2,0,0]=4 156 B10R2.21 CN1C=NN=C1C2CC2 BBS-00029142 [0,1,0,1,0,0|2,0,0]=4