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0343551367
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note
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Prepared by DCC/HOBT coupling of Boc-L-Leu and L-Phe-OMe followed by acid deprotection.
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20
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0343115342
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note
-
+). Final compounds were purified to homogeneity by HPLC (Vydac SB-C8; linear gradient: water/0.02% TFA to acetonitrile/0.02% TFA). All compounds were homogeneous under a variety of TLC and HPLC conditions and had spectroscopic and mass analysis in agreement with the assigned structures.
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0024716284
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as implemented in ChemPlus (Hypercube Inc., Gainesville, FL)
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Log P values were calculated using the atomic parameters reported by Viswanadhan, V. N.; Ghose, A. K.; Revankar, G. R.; Robins, R. K. J. Chem. Inf. Comput. Sci. 1989, 29, 163 as implemented in ChemPlus (Hypercube Inc., Gainesville, FL).
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84988098098
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Ab initio geometry optimizations and electrostatic potential mapped onto electron density isosurfaces were calculated using the program PC SPARTAN (Wavefunction Inc., Irvine CA). Atomic charges fit to electrostatic potentials were performed in PC SPARTAN and are based on the following methods: Chirlian, L. E.; Francl, M. J. Computational Chem. 1987, 8, 894; Breneman, C. M.; Wiberg, K. B. J. Computational Chem. 1990, 11, 361.
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84986513567
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Ab initio geometry optimizations and electrostatic potential mapped onto electron density isosurfaces were calculated using the program PC SPARTAN (Wavefunction Inc., Irvine CA). Atomic charges fit to electrostatic potentials were performed in PC SPARTAN and are based on the following methods: Chirlian, L. E.; Francl, M. J. Computational Chem. 1987, 8, 894; Breneman, C. M.; Wiberg, K. B. J. Computational Chem. 1990, 11, 361.
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