N-({[3-(2-Aminoethyl)-1H-Indol-5-Yl]Oxy}Acetyl)-L-Tyrosylglycinamide

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Properties Simple | Detailed

Formula C23H27N5O5
IUPAC Name (2r)-2-[[2-[3-(2-aminoethyl)indol-1-ium-5-yl]oxyacetyl]amino]-n-(2-amino-2-oxo-ethyl)-3-(4-hydroxyphenyl)propanamide
Molecular Mass 453.491 g·mol−1
Heat of Formation -621.1 ± 16.7 kJ·mol−1
Dipole Moment 2.81 ± 1.08 D
Volume 544.75 Å 3
Surface Area 480.29 Å 2
HOMO Energy -8.34 ± 0.55 eV
LUMO Energy -0.18 ± eV
Point Group Symmetry C1
InChIKey PBRWGFLPYQYNGI-HXUWFJFHSA-N
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