0 B17R2.2382 C(C#CC1=CC=CC=C1)#CC2=CC=CC=C2 SBB008711 [0,0,0,0,0,0|2,0,2]=4 1 B17R2.2382 C1=CC=C(CCNCC2=CC=CC=C2)C=C1 SBB000516 [0,0,0,0,0,0|2,0,0]=2 2 B17R2.2382 C1=CC=C(CCNCC2=CC=CC=N2)C=C1 SBB007228 [0,0,0,0,0,0|3,0,0]=3 3 B17R2.2382 C1=CC=C(CCNCC2=CC=CN=C2)C=C1 SBB007263 [0,0,0,0,0,0|3,0,0]=3 4 B17R2.2382 C1=CC=C(CNCCC2=NC=CC=C2)C=C1 SBB016580 [0,0,0,0,0,0|3,0,0]=3 5 B17R2.2382 C1=CC=C(CSSCC2=CC=CC=C2)C=C1 SBB058123 [0,0,0,0,0,0|0,0,0]=0 6 B17R2.2382 C1=CC=C(SCCSC2=CC=CC=C2)C=C1 SBB040938 [0,0,0,0,0,0|4,0,0]=4 7 B17R2.2382 C1=CC=C(\C=N\N=C\C2=CC=CC=C2)C=C1 SBB058879 [0,0,0,0,0,0|2,0,2]=4 8 B17R2.2382 N(CCNC1=CC=CC=C1)C2=CC=CC=C2 SBB003424 [0,0,0,0,0,0|4,0,0]=4 9 B18R2.270 FC1=CC=C(CNCCC2=CC=CC=C2)C=C1 SBB001907 [0,1,0,0,0,0|2,0,0]=3 10 B18R2.270 NC1=CC=C(OCCCC2=CC=CC=C2)C=C1 SBB080156 [0,1,0,0,0,0|3,0,0]=4 11 B18R2.3984 NC1=CC=CC=C1OCCCC2=CC=CC=C2 SBB080158 [0,1,0,0,0,0|3,0,0]=4 12 B18R2.6483 CC1=CC=CC(CNCCC2=CC=CC=C2)=N1 SBB301533 [0,1,0,0,0,0|3,0,0]=4 13 B18R2.6483 NC1=CC=CC(OCCCC2=CC=CC=C2)=C1 SBB080159 [0,1,0,0,0,0|3,0,0]=4 14 B18R2.7189 O=C(CCCC1=CC=CC=C1)C2=CC=CC=C2 SBB005766 [0,1,0,0,0,0|2,0,1]=4 15 B18R3.2098 C1=CC=C(CN2C=NC3=C2C=CC=C3)C=C1 SBB094065 [0,0,0,1,0,0|3,0,0]=4 16 B18R3.2098 C1=CC=C(C[N+]2=CSC3=CC=CC=C32)C=C1 SBB007622 [0,0,0,1,0,0|3,0,0]=4 17 B18R3.2108 C1=CC=C(C2NCCC3=C2C=CC=C3)C=C1 SBB044016 [0,0,0,1,0,0|2,0,0]=3 18 B18R3.2108 C1=CC=C([C@@H]2NCCC3=CC=CC=C32)C=C1 SBB056021 [0,0,0,1,0,0|2,0,0]=3 19 B18R3.2108 C1=CC=C2C(=C1)CCNC2C3=CC=NC=C3 SBB038994 [0,0,0,1,0,0|3,0,0]=4 20 B16R2.2256 C1=CC(CCCC2=CC=NC=C2)=CC=N1 SBB057663 [0,0,0,0,1,0|3,0,0]=4 21 B16R2.2256 C1=CC=C(CCCC2=CC=CC=C2)C=C1 SBB008143 [0,0,0,0,1,0|1,0,0]=2 22 B16R2.2256 C1=CC=C(CCNC2=CC=CC=C2)C=C1 SBB085494 [0,0,0,0,1,0|2,0,0]=3 23 B16R2.2256 C1=CC=C(CCOC2=CC=CC=C2)C=C1 SBB007896 [0,0,0,0,1,0|1,1,0]=3 24 B16R2.2256 C1=CC=C(CNCC2=CC=CC=C2)C=C1 SBB058838 [0,0,0,0,1,0|1,0,0]=2 25 B16R2.2256 C1=CC=C(CNCC2=CC=CC=N2)C=C1 SBB027764 [0,0,0,0,1,0|2,0,0]=3 26 B16R2.2256 C1=CC=C(CNCC2=CC=NC=C2)C=C1 SBB018038 [0,0,0,0,1,0|2,0,0]=3 27 B16R2.2256 C1=CC=C(CNCC2=CN=CC=C2)C=C1 SBB092338 [0,0,0,0,1,0|2,0,0]=3 28 B16R2.2256 C1=CC=C(COCC2=CC=CC=C2)C=C1 SBB060360 [0,0,0,0,1,0|0,1,0]=2 29 B16R2.2256 C1=CC=C(CSCC2=CC=CC=C2)C=C1 SBB058652 [0,0,0,0,1,0|0,0,0]=1 30 B16R2.2256 C1=CC=C(\C=C\NC2=CC=CC=C2)C=C1 SBB059093 [0,0,0,0,1,0|2,0,1]=4 31 B16R2.2256 C1=CC=C(\C=N\NC2=CC=CC=C2)C=C1 SBB058392 [0,0,0,0,1,0|2,0,1]=4 32 B16R2.2256 C1=CC=C(\N=C\NC2=CC=CC=C2)C=C1 SBB058785 [0,0,0,0,1,0|3,0,0]=4 33 B16R2.2256 C1=CC=C(\N=N\NC2=CC=CC=C2)C=C1 SBB047161 [0,0,0,0,1,0|3,0,0]=4 34 B16R2.2256 C1=CN=CC(CNCC2=CN=CC=C2)=C1 SBB014446 [0,0,0,0,1,0|3,0,0]=4 35 B16R2.2257 C1=CC=C(CCNCC2=CC=CO2)C=C1 SBB007234 [0,0,0,0,1,0|3,0,0]=4 36 B16R2.2257 C1=CC=C(CCNCC2=CC=CS2)C=C1 SBB018145 [0,0,0,0,1,0|3,0,0]=4 37 B18R2.2525 C1=CC=C(CCNCCC2=CC=CC=C2)C=C1 SBB059796 [0,0,0,0,0,1|2,0,0]=3 38 B17R2.143 NC(CC1=CC=CC=C1)CC2=CC=CC=C2 SBB011267 [0,1,0,0,1,0|1,0,0]=3 39 B17R2.143 O=C(CC1=CC=CC=C1)CC2=CC=CC=C2 SBB058726 [0,1,0,0,1,0|1,0,0]=3 40 B17R2.143 O=S(CC1=CC=CC=C1)CC2=CC=CC=C2 SBB058830 [0,1,0,0,1,0|0,0,1]=3 41 B17R2.143 ON(CC1=CC=CC=C1)CC2=CC=CC=C2 SBB000533 [0,1,0,0,1,0|1,0,0]=3 42 B17R2.216 BrC1=CC=C(CNCC2=CN=CC=C2)C=C1 SBB018342 [0,1,0,0,1,0|2,0,0]=4 43 B17R2.216 CC1=CC=C(CNCC2=CC=CC=N2)C=C1 SBB301328 [0,1,0,0,1,0|2,0,0]=4 44 B17R2.216 CC1=CC=C(CNCC2=CC=NC=C2)C=C1 SBB301329 [0,1,0,0,1,0|2,0,0]=4 45 B17R2.216 CC1=CC=C(CNCC2=CN=CC=C2)C=C1 SBB018120 [0,1,0,0,1,0|2,0,0]=4 46 B17R2.216 ClC1=CC=C(CNCC2=CN=CC=C2)C=C1 SBB011653 [0,1,0,0,1,0|2,0,0]=4 47 B17R2.216 FC1=CC=C(CNCC2=CC=CC=C2)C=C1 SBB018131 [0,1,0,0,1,0|1,0,0]=3 48 B17R2.216 FC1=CC=C(CNCC2=CC=CN=C2)C=C1 SBB018140 [0,1,0,0,1,0|2,0,0]=4 49 B17R2.2342 CC(NCC1=CC=CN=C1)C2=CC=CC=C2 SBB011275 [0,1,0,0,1,0|2,0,0]=4 50 B17R2.2342 CC(NCC1=CC=NC=C1)C2=CC=CC=C2 SBB011274 [0,1,0,0,1,0|2,0,0]=4 51 B17R2.2342 O=C(NCC1=CC=CC=C1)C2=CC=CC=C2 SBB061810 [0,1,0,0,1,0|1,0,1]=4 52 B17R2.2342 O=C(OCC1=CC=CC=C1)C2=CC=CC=C2 SBB058609 [0,1,0,0,1,0|0,1,1]=4 53 B17R2.3956 CC1=C(CNCC2=CN=CC=C2)C=CC=C1 SBB085476 [0,1,0,0,1,0|2,0,0]=4 54 B17R2.3956 CC1=CC=CN=C1CNCC2=CC=CC=C2 SBB301873 [0,1,0,0,1,0|2,0,0]=4 55 B17R2.3956 ClC1=C(CNCC2=CC=CC=C2)C=CC=C1 SBB027725 [0,1,0,0,1,0|1,0,0]=3 56 B17R2.3956 ClC1=C(CNCC2=CC=CC=N2)C=CC=C1 SBB018229 [0,1,0,0,1,0|2,0,0]=4 57 B17R2.3956 ClC1=CC=CC=C1CNCC2=CC=NC=C2 SBB011652 [0,1,0,0,1,0|2,0,0]=4 58 B17R2.3956 FC1=C(CNCC2=CC=CC=C2)C=CC=C1 SBB085425 [0,1,0,0,1,0|1,0,0]=3 59 B17R2.3956 FC1=CC=CC=C1CNCC2=CN=CC=C2 SBB018139 [0,1,0,0,1,0|2,0,0]=4 60 B17R2.3956 FC1=CC=CC=C1CNCC2=NC=CC=C2 SBB301490 [0,1,0,0,1,0|2,0,0]=4 61 B17R2.5301 BrC1=CC(CNCC2=CC=CN=C2)=CC=C1 SBB018341 [0,1,0,0,1,0|2,0,0]=4 62 B17R2.5301 CC1=CC=CC(CNCC2=CC=CC=C2)=C1 SBB005741 [0,1,0,0,1,0|1,0,0]=3 63 B17R2.5301 CC1=CC=CC(CNCC2=CC=CC=C2)=N1 SBB301872 [0,1,0,0,1,0|2,0,0]=4 64 B17R2.5301 CC1=CC=CC(CNCC2=CN=CC=C2)=C1 SBB301155 [0,1,0,0,1,0|2,0,0]=4 65 B17R2.5301 ClC1=CC=CC(CNCC2=CN=CC=C2)=C1 SBB301147 [0,1,0,0,1,0|2,0,0]=4 66 B17R2.5301 FC1=CC=CC(CNCC2=CC=CC=C2)=C1 SBB301140 [0,1,0,0,1,0|1,0,0]=3 67 B17R2.5301 FC1=CC=CC(CNCC2=CN=CC=C2)=C1 SBB301148 [0,1,0,0,1,0|2,0,0]=4 68 B17R2.5301 NC1=CC(OCCC2=CC=CC=C2)=CC=C1 SBB085462 [0,1,0,0,1,0|1,1,0]=4 69 B17R2.5301 NC1=CC=CC(OCCC2=CC=CC=C2)=C1 SBB080072 [0,1,0,0,1,0|1,1,0]=4 70 B19R2.8900 O=C(CC1=CC=CC=C1)NCCC2=CC=CC=C2 SBB007814 [0,1,0,0,0,1|2,0,0]=4 71 B19R2.16162 O=C(NCC1=CC=CC=C1)NCC2=CC=CC=C2 SBB023417 [0,1,0,0,0,1|2,0,0]=4 72 B19R2.16162 O=C(OCC1=CC=CC=C1)OCC2=CC=CC=C2 SBB068313 [0,1,0,0,0,1|0,2,0]=4 73 B19R2.57 COC1=CC=C(CCNCC2=CC=CC=C2)C=C1 SBB080400 [0,2,0,0,0,0|2,0,0]=4 74 B19R2.57 COC1=CC=C(CNCCC2=CC=CC=C2)C=C1 SBB001906 [0,2,0,0,0,0|2,0,0]=4 75 B19R2.4482 CC(CC1=CC=CC=C1)NCC2=CC=CC=C2Cl SBB071756 [0,2,0,0,0,0|2,0,0]=4 76 B19R2.16158 O=C(OCC1=CC=CC=C1)[C@H](O)C2=CC=CC=C2 SBB068649 [0,2,0,0,0,0|1,1,0]=4 77 B19R2.3387 COC1=CC=CC=C1CNCCC2=CC=CC=C2 SBB007232 [0,2,0,0,0,0|2,0,0]=4 78 B19R2.906 COC1=CC(CNCCC2=CC=CC=C2)=CC=C1 SBB007246 [0,2,0,0,0,0|2,0,0]=4 79 B19R3.19255 C1=CC=C(CSC2=NC3=CC=CC=C3N2)C=C1 SBB005363 [0,1,0,1,0,0|2,0,0]=4 80 B15R2.2195 C(#CC1=CC=CC=C1)C2=CC=CC=C2 SBB060478 [0,0,0,0,2,0|0,0,2]=4 81 B15R2.2195 C1=CC(CCC2=CC=NC=C2)=CC=N1 SBB012385 [0,0,0,0,2,0|2,0,0]=4 82 B15R2.2195 C1=CC=C(CNC2=CC=CC=C2)C=C1 SBB058377 [0,0,0,0,2,0|1,0,0]=3 83 B15R2.2195 C1=CC=C(CNC2=CC=CC=N2)C=C1 SBB039207 [0,0,0,0,2,0|2,0,0]=4 84 B15R2.2195 C1=CC=C(COC2=CC=CC=C2)C=C1 SBB008247 [0,0,0,0,2,0|0,1,0]=3 85 B15R2.2195 C1=CC=C(NCC2=CC=CC=N2)C=C1 SBB301389 [0,0,0,0,2,0|2,0,0]=4 86 B15R2.2195 C1=CC=C(NCC2=CC=CN=C2)C=C1 SBB301390 [0,0,0,0,2,0|2,0,0]=4 87 B15R2.2195 C1=CC=C(NCC2=CC=NC=C2)C=C1 SBB301391 [0,0,0,0,2,0|2,0,0]=4 88 B15R2.2195 C1=CC=C(NNC2=CC=CC=C2)C=C1 SBB058764 [0,0,0,0,2,0|2,0,0]=4 89 B15R2.2195 C1=CC=C(SSC2=CC=CC=C2)C=C1 SBB061102 [0,0,0,0,2,0|0,0,0]=2 90 B15R2.2195 C1=CC=C(SSC2=NC=CC=C2)N=C1 SBB056659 [0,0,0,0,2,0|2,0,0]=4 91 B15R2.2195 C1=CC=C(\C=C\C2=CC=CC=C2)C=C1 SBB060155 [0,0,0,0,2,0|0,0,2]=4 92 B15R2.2195 C1=CC=[N+](CC[N+]2=CC=CC=C2)C=C1 SBB012571 [0,0,0,0,2,0|2,0,0]=4 93 B15R2.2196 C1=CC=C(CNCC2=CC=CO2)C=C1 SBB007172 [0,0,0,0,2,0|2,0,0]=4 94 B19R2.2628 C1=CC=C(CNCCNCC2=CC=CC=C2)C=C1 SBB001289 [0,0,0,0,0,2|2,0,0]=4 95 B19R2.2628 C1=CC=C(CS\C=C\SCC2=CC=CC=C2)C=C1 SBB059101 [0,0,0,0,0,2|0,0,0]=2 96 B19R2.2628 [NH2+](CC[NH2+]CC1=CC=CC=C1)CC2=CC=CC=C2 SBB058904 [0,0,0,0,0,2|2,0,0]=4