The compound with the SMILES Nc1cc(N)c2c(O)sc(O)c2c1N has an aqueous phase molecular energy at the PBE level of theory of -2103.24996 Hartree.
The {#molecule|compound|chemical|molecular species|chemical compound!} with the {SMILES__description} {#representation of |!}{SMILES#} has an {solutionEnergy__names__noun} of {solutionEnergy#} {solutionEnergy__units}.