ChemSpider 2D Image | L-alpha-Aspartyl-L-methionyl-3-(2H-imidazol-4-yl)-L-alanyl-L-alpha-aspartyl-L-phenylalanyl-L-phenylalanyl-L-valylglycyl-L-leucyl-L-methioninamide | C55H79N13O14S2

L-α-Aspartyl-L-methionyl-3-(2H-imidazol-4-yl)-L-alanyl-L-α-aspartyl-L-phenylalanyl-L-phenylalanyl-L-valylglycyl-L-leucyl-L-methioninamide

  • Molecular FormulaC55H79N13O14S2
  • Average mass1210.425 Da
  • Monoisotopic mass1209.531128 Da
  • ChemSpider ID109486230

  • defined stereocentres - 9 of 9 defined stereocentres

More details:

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

L-Methioninamide, L-α-aspartyl-L-methionyl-3-(2H-imidazol-4-yl)-L-alanyl-L-α-aspartyl-L-phenylalanyl-L-phenylalanyl-L-valylglycyl-L-leucyl- [ACD/Index Name]
L-α-Asparagyl-L-methionyl-3-(2H-imidazol-4-yl)-L-alanyl-L-α-asparagyl-L-phenylalanyl-L-phenylalanyl-L-valylglycyl-L-leucyl-L-methioninamid [German] [ACD/IUPAC Name]
L-α-Aspartyl-L-methionyl-3-(2H-imidazol-4-yl)-L-alanyl-L-α-aspartyl-L-phenylalanyl-L-phenylalanyl-L-valylglycyl-L-leucyl-L-methioninamide [ACD/IUPAC Name]
L-α-Aspartyl-L-méthionyl-3-(2H-imidazol-4-yl)-L-alanyl-L-α-aspartyl-L-phénylalanyl-L-phénylalanyl-L-valylglycyl-L-leucyl-L-méthioninamide [French] [ACD/IUPAC Name]

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

Density: 1.4±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.648
Molar Refractivity: 312.3±0.5 cm3
#H bond acceptors: 27
#H bond donors: 15
#Freely Rotating Bonds: 38
#Rule of 5 Violations: 3
ACD/LogP: 3.01
ACD/LogD (pH 5.5): -1.79
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -2.77
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 481 Å2
Polarizability: 123.8±0.5 10-24cm3
Surface Tension: 58.9±7.0 dyne/cm
Molar Volume: 858.6±7.0 cm3

Click to predict properties on the Chemicalize site


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