The chemical compound with the SMILES Nc1cc2c(c(N)c1N)C(=O)CC2=O has an aqueous phase molecular energy at the PBE level of theory of -999.25058 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}.