N-(4-{[(2-Methyl-4-Oxo-1,4-Dihydro-6-Quinazolinyl)Methyl](2-Propyn-1-Yl)Amino}Benzoyl)-D-Glutamic Acid

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Formula C25H24N4O6
IUPAC Name (2r)-2-[[4-[(2-methyl-4-oxo-quinazolin-1-ium-3-id-6-yl)methyl-prop-2-ynyl-amino]benzoyl]amino]pentanedioic acid
Molecular Mass 476.481 g·mol−1
Heat of Formation -630.6 ± 16.7 kJ·mol−1
Dipole Moment 11.43 ± 1.08 D
Volume 527.05 Å 3
Surface Area 435.26 Å 2
HOMO Energy -8.71 ± 0.55 eV
LUMO Energy -1.08 ± eV
Point Group Symmetry C1
InChIKey PMTUUSDTAKQWQJ-OAQYLSRUSA-N
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