0 B19R2.16162 O=C(NCC1=CC=CC=C1)NCC2=CC=CC=C2 SBB023417 [0,0,0,0,0,0|2,0,1]=3 1 B19R2.16162 O=C(NNC1=CC=CC=C1)NNC2=CC=CC=C2 SBB008713 [0,0,0,0,0,0|4,0,0]=4 2 B19R2.16162 O=C(OCC1=CC=CC=C1)OCC2=CC=CC=C2 SBB068313 [0,0,0,0,0,0|1,0,1]=2 3 B19R2.16162 O=C(\C=C\C1=CC=CC=C1)OCC2=CC=CC=C2 SBB067602 [0,0,0,0,0,0|0,0,0]=0 4 B19R2.16162 O=C(\C=C\C1=CC=CC=C1)\C=C\C2=CC=CC=C2 SBB055271 [0,0,0,0,0,0|1,0,1]=2 5 B19R2.16162 O=C(\N=N\C1=CC=CC=C1)NNC2=CC=CC=C2 SBB008715 [0,0,0,0,0,0|4,0,0]=4 6 B18R2.2525 C1=CC=C(\N=C\C=C\NC2=CC=CC=C2)C=C1 SBB055226 [1,0,0,0,0,0|3,0,0]=4 7 B20R2.4449 NC1=CC=C(SCC(=O)NCC2=CC=CC=C2)C=C1 SBB049034 [0,1,0,0,0,0|2,0,1]=4 8 B20R2.6651 NC1=C(SCC(=O)NCC2=CC=CC=C2)C=CC=C1 SBB112008 [0,1,0,0,0,0|2,0,1]=4 9 B20R2.21590 N[C@@H](CC1=CC=CC=C1)C(=O)OCC2=CC=CC=C2 SBB058269 [0,1,0,0,0,0|0,0,2]=3 10 B20R2.21590 [NH3+]C(CC1=CC=CC=C1)C(=O)OCC2=CC=CC=C2 SBB056708 [0,1,0,0,0,0|0,0,2]=3 11 B20R3.11933 O=C1NC(C2=CC=CC=C2)=C(C3=CC=CC=C3)N1 SBB059293 [0,0,0,1,0,0|2,0,1]=4 12 B20R3.11933 S=C1NC(C2=CC=CC=C2)=C(C3=CC=CC=C3)O1 SBB049539 [0,0,0,1,0,0|1,1,1]=4 13 B20R3.11933 SC1=NC(C2=CC=CC=C2)=C(C3=CC=CC=C3)O1 SBB007600 [0,0,0,1,0,0|1,1,1]=4 14 B20R3.30190 C1=CC=C(COC2=CC=C3C=CC=CC3=C2)C=C1 SBB067225 [0,0,0,1,0,0|1,0,0]=2 15 B18R2.2429 O=C(\C=C\C1=CC=CC=C1)NC2=CC=CC=C2 SBB096515 [0,0,0,0,1,0|1,0,0]=2 16 B19R2.4485 O=C(\C=C\C1=CC=CC=C1)NC2=C(Br)C=CC=C2 SBB062277 [0,1,0,0,1,0|1,0,0]=3 17 B19R2.4485 O=C(\C=C\C1=CC=CC=C1)NC2=C(O)C=CC=C2 SBB043695 [0,1,0,0,1,0|1,0,0]=3 18 B19R2.8929 O=C(CC(=O)C1=CC=CC=C1)NC2=CC=CC=C2 SBB038527 [0,1,0,0,1,0|1,0,1]=4 19 B19R2.11857 CC1=CC=C(NC(=O)\C=C\C2=CC=CC=C2)C=C1 SBB098820 [0,1,0,0,1,0|1,0,0]=3 20 B19R2.11857 NC1=CC=C(NC(=O)CCC2=CC=CC=C2)C=C1 SBB080259 [0,1,0,0,1,0|2,0,0]=4 21 B19R2.11857 O=C(\C=C\C1=CC=CC=C1)NC2=CC=C(O)C=C2 SBB043725 [0,1,0,0,1,0|1,0,0]=3 22 B19R2.16158 O=C(OCC1=CC=CC=C1)[C@H](O)C2=CC=CC=C2 SBB068649 [0,1,0,0,1,0|0,0,1]=3 23 B21R2.27922 O=C(OCC1=CC=CC=C1)C(=O)OCC2=CC=CC=C2 SBB065116 [0,1,0,0,0,1|0,0,1]=3 24 B21R2.107355 O=C(\C=C/C1=C(Cl)C=CC=C1)\C=C/C2=C(Cl)C=CC=C2 SBB007626 [0,2,0,0,0,0|1,0,1]=4 25 B19R3.28 C1=CC=C(NC2=CC=CC3=C2C=CC=C3)C=C1 SBB000591 [1,0,0,1,0,0|2,0,0]=4 26 B19R3.288 O=C1NC2=C(C=CC=C2)\C1=N/C3=CC=CC=C3 SBB083404 [0,0,0,1,1,0|2,0,0]=4 27 B19R3.19215 C1=CC=C(SC2=NC3=C(C=CC=C3)C=C2)C=C1 SBB116833 [0,0,0,1,1,0|1,1,0]=4 28 B19R3.19255 C1=CC=C(\C=C\C2=NC3=CC=CC=C3N2)C=C1 SBB044971 [0,0,0,1,1,0|2,0,0]=4 29 B19R3.19268 C1=CC=C(COC2=CC3=C(C=CN3)C=C2)C=C1 SBB063801 [0,0,0,1,1,0|2,0,0]=4 30 B19R3.19268 N1C=CC2=C1C=CC(OCC3=CC=CC=C3)=C2 SBB003331 [0,0,0,1,1,0|2,0,0]=4 31 B21R3.2808 O=C(OCC1=CC=CC=C1)N2N=NC3=C2C=CC=C3 SBB058106 [0,0,0,1,0,1|2,0,0]=4 32 B21R3.218733 NC1=C(CCC2=CC=C3C=CC=CC3=N2)C=CC=C1 SBB050348 [0,1,0,1,0,0|2,0,0]=4 33 B21R3.7747 O=C1OC(C2=CC=CC=C2)=N\C1=C\C3=CC=CC=C3 SBB038846 [0,1,0,1,0,0|0,0,1]=3 34 B21R3.24492 O=C(OC1=CC=C2C=CC=CC2=C1)C3=CC=CC=C3 SBB067184 [0,1,0,1,0,0|1,0,1]=4 35 B17R2.143 O=C(CC1=CC=CC=C1)CC2=CC=CC=C2 SBB058726 [0,0,0,0,2,0|0,0,1]=3 36 B17R2.143 O=C(NC1=CC=CC=C1)NC2=CC=CC=C2 SBB058217 [0,0,0,0,2,0|2,0,0]=4 37 B17R2.143 O=C(OC1=CC=CC=C1)OC2=CC=CC=C2 SBB058524 [0,0,0,0,2,0|1,0,0]=3 38 B17R2.143 O=S(CC1=CC=CC=C1)CC2=CC=CC=C2 SBB058830 [0,0,0,0,2,0|1,0,1]=4 39 B17R2.2342 O=C(NCC1=CC=CC=C1)C2=CC=CC=C2 SBB061810 [0,0,0,0,2,0|1,0,0]=3 40 B17R2.2342 O=C(NNC1=CC=CC=C1)C2=CC=CC=C2 SBB055065 [0,0,0,0,2,0|2,0,0]=4 41 B17R2.2342 O=C(OCC1=CC=CC=C1)C2=CC=CC=C2 SBB058609 [0,0,0,0,2,0|0,0,0]=2 42 B17R2.2342 O=C(OCC1=CC=CC=C1)C2=CN=CC=C2 SBB058611 [0,0,0,0,2,0|1,0,0]=3 43 B17R2.2342 O=C(\C=C\C1=CC=CC=C1)C2=CC=CC=C2 SBB058654 [0,0,0,0,2,0|0,0,0]=2 44 B19R2.2628 C1=CC=C(CS\C=C\SCC2=CC=CC=C2)C=C1 SBB059101 [1,0,0,0,0,1|0,1,1]=4