The chemical with the SMILES NC1=CC(N)=C2NC=CC=C2N1 has a aqueous phase LUMO energy at the PBE level of theory of -0.10399 Hartree.
The {#molecule|compound|chemical|molecular species|chemical compound!} with the {SMILES__description} {#representation of |!}{SMILES#} has a {solutionLumo__names__noun} of {solutionLumo#} {solutionLumo__units}.