ChemSpider 2D Image | 4-Fluoro-L-phenylalanyl-(3S)-3-hydroxy-L-prolyl-N~5~-(diaminomethylene)-L-ornithylglycyl-L-tryptophanamide | C33H43FN10O6

4-Fluoro-L-phenylalanyl-(3S)-3-hydroxy-L-prolyl-N5-(diaminomethylene)-L-ornithylglycyl-L-tryptophanamide

  • Molecular FormulaC33H43FN10O6
  • Average mass694.756 Da
  • Monoisotopic mass694.335083 Da
  • ChemSpider ID8592706
  • defined stereocentres - 5 of 5 defined stereocentres


More details:






Validated by Experts, Validated by Users, Non-Validated, Removed by Users

4-Fluor-L-phenylalanyl-(3S)-3-hydroxy-L-prolyl-N5-(diaminomethylen)-L-ornithylglycyl-L-tryptophanamid [German] [ACD/IUPAC Name]
4-Fluoro-L-phenylalanyl-(3S)-3-hydroxy-L-prolyl-N5-(diaminomethylene)-L-ornithylglycyl-L-tryptophanamide [ACD/IUPAC Name]
4-Fluoro-L-phénylalanyl-(3S)-3-hydroxy-L-prolyl-N5-(diaminométhylène)-L-ornithylglycyl-L-tryptophaneamide [French] [ACD/IUPAC Name]
L-Tryptophanamide, 4-fluoro-L-phenylalanyl-(3S)-3-hydroxy-L-prolyl-N5-(diaminomethylene)-L-ornithylglycyl- [ACD/Index Name]

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.5±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.700
Molar Refractivity: 176.3±0.5 cm3
#H bond acceptors: 16
#H bond donors: 13
#Freely Rotating Bonds: 16
#Rule of 5 Violations: 3
ACD/LogP: -0.78
ACD/LogD (pH 5.5): -4.75
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -3.41
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 277 Å2
Polarizability: 69.9±0.5 10-24cm3
Surface Tension: 66.9±7.0 dyne/cm
Molar Volume: 456.3±7.0 cm3

Click to predict properties on the Chemicalize site






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