N-[(Carboxymethyl)Sulfonyl]-D-Tryptophyl-N~1~-(4-Carbamimidoylbenzyl)-L-Glutamamide

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Properties Simple | Detailed

Formula C26H31N7O7S
IUPAC Name 2-[[(1r)-2-[[(1s)-4-amino-1-[(4-carbamimidoylphenyl)methylcarbamoyl]-4-oxo-butyl]amino]-1-(1h-indol-3-ylmethyl)-2-oxo-ethyl]sulfamoyl]acetic acid
Molecular Mass 585.632 g·mol−1
Heat of Formation -1002.1 ± 16.7 kJ·mol−1
Dipole Moment 7.33 ± 1.08 D
Volume 675.14 Å 3
Surface Area 551.06 Å 2
HOMO Energy -8.89 ± 0.55 eV
LUMO Energy -0.55 ± eV
Point Group Symmetry C1
InChIKey NLKRKTGGXZDTOO-LEWJYISDSA-N
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