N-{4-[1-(2,4-Diamino-5-Methylpyrido[2,3-D]Pyrimidin-6-Yl)-2-Butanyl]Benzoyl}Glutamic Acid

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Formula C24H29N6O5
IUPAC Name (2s)-2-[[4-[(1r)-1-[(2,4-diamino-5-methyl-pyrido[2,3-d]pyrimidine-1,3,8-triium-4a-id-6-yl)methyl]propyl]benzoyl]amino]pentanedioic acid
Molecular Mass 481.524 g·mol−1
Heat of Formation -728.5 ± 16.7 kJ·mol−1
Dipole Moment 6.06 ± 1.08 D
Volume 566.02 Å 3
Surface Area 484.37 Å 2
HOMO Energy -8.79 ± 0.55 eV
LUMO Energy -1.07 ± eV
Point Group Symmetry C1
InChIKey NTDTUJSFGRIWAK-DYVFJYSZSA-N
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