"4.82" . "57.53" . "8.85" . "[H][C@]1(CF)CC2=CC=C(C=C2CN1)S(=O)(=O)N1CCSCC1" . "91.09" . "331.200825069" . "4-carboxybutan-1-aminium" . "169.04" . "1" . "InChI=1S/C5H7N3O/c1-8-4(6)2-3-7-5(8)9/h2-3H,1H3,(H2,6,7,9)/p+1" . "ChemAxon" . "NC1=NC(CC2=C3C=CNC3=CC=C2Cl)=NC(NC2=CC=C(C=C2)C#N)=N1" . "91.99" . "29.18" . "caprylic acid" . "2-{4-[4-(4-chloro-1H-pyrazol-1-yl)butyl]piperazin-1-yl}pyrimidine" . "3.6" .