ChemSpider 2D Image | L-Histidyl-L-tryptophyl-D-alanyl-D-tryptophyl-L-phenylalanyl-L-lysinamide | C46H56N12O6

L-Histidyl-L-tryptophyl-D-alanyl-D-tryptophyl-L-phenylalanyl-L-lysinamide

  • Molecular FormulaC46H56N12O6
  • Average mass873.014 Da
  • Monoisotopic mass872.444580 Da
  • ChemSpider ID94269966

  • defined stereocentres - 6 of 6 defined stereocentres

More details:

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

L-Histidyl-L-tryptophyl-D-alanyl-D-tryptophyl-L-phenylalanyl-L-lysinamid [German] [ACD/IUPAC Name]
L-Histidyl-L-tryptophyl-D-alanyl-D-tryptophyl-L-phenylalanyl-L-lysinamide [ACD/IUPAC Name]
L-Histidyl-L-tryptophyl-D-alanyl-D-tryptophyl-L-phénylalanyl-L-lysinamide [French] [ACD/IUPAC Name]
L-Lysinamide, L-histidyl-L-tryptophyl-D-alanyl-D-tryptophyl-L-phenylalanyl- [ACD/Index Name]
(s)-6-amino-2-((2r,5s,8s,11r,14s)-5,11-bis((1h-indol-3-yl)methyl)-14-amino-2-benzyl-15-(1h-imidazol-4-yl)-8-methyl-4,7,10,13-tetraoxo-3,6,9,12-tetraazapentadec
87616-84-0 [RN]

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

Density: 1.3±0.1 g/cm3
Boiling Point: 1407.0±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.3 mmHg at 25°C
Enthalpy of Vaporization: 215.3±3.0 kJ/mol
Flash Point: 804.7±34.3 °C
Index of Refraction: 1.664
Molar Refractivity: 242.9±0.3 cm3
#H bond acceptors: 18
#H bond donors: 14
#Freely Rotating Bonds: 23
#Rule of 5 Violations: 3
ACD/LogP: 1.51
ACD/LogD (pH 5.5): -3.08
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -1.62
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 301 Å2
Polarizability: 96.3±0.5 10-24cm3
Surface Tension: 67.8±3.0 dyne/cm
Molar Volume: 654.5±3.0 cm3

Click to predict properties on the Chemicalize site


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