ChemSpider 2D Image | L-Histidyl-2-methyl-D-tryptophyl-L-alanyl-L-tryptophylphenylalanyl-L-lysinamide | C47H58N12O6

L-Histidyl-2-methyl-D-tryptophyl-L-alanyl-L-tryptophylphenylalanyl-L-lysinamide

  • Molecular FormulaC47H58N12O6
  • Average mass887.040 Da
  • Monoisotopic mass886.460205 Da
  • ChemSpider ID4576541

  • defined stereocentres - 5 of 6 defined stereocentres

More details:

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

L-Histidyl-2-methyl-D-tryptophyl-L-alanyl-L-tryptophylphenylalanyl-L-lysinamid [German] [ACD/IUPAC Name]
L-Histidyl-2-methyl-D-tryptophyl-L-alanyl-L-tryptophylphenylalanyl-L-lysinamide [ACD/IUPAC Name]
L-Histidyl-2-méthyl-D-tryptophyl-L-alanyl-L-tryptophylphénylalanyl-L-lysinamide [French] [ACD/IUPAC Name]
L-Lysinamide, L-histidyl-2-methyl-D-tryptophyl-L-alanyl-L-tryptophylphenylalanyl- [ACD/Index Name]
(2S)-2-((5S,8S,11R,14S)-5-((1H-indol-3-yl)methyl)-14-amino-2-benzyl-15-(1H-imidazol-5-yl)-8-methyl-11-((2-methyl-1H-indol-3-yl)methyl)-4,7,10,13-tetraoxo-3,6,9,12-tetraazapentadecanamido)-6-aminohexanamide
(2S)-6-AMINO-2-{2-[(2S)-2-[(2S)-2-[(2R)-2-[(2S)-2-AMINO-3-(3H-IMIDAZOL-4-YL)PROPANAMIDO]-3-(2-METHYL-1H-INDOL-3-YL)PROPANAMIDO]PROPANAMIDO]-3-(1H-INDOL-3-YL)PROPANAMIDO]-3-PHENYLPROPANAMIDO}HEXANAMIDE
6-amino-2-[[2-[[2-[[2-[[2-[[2-amino-3-(1H-imidazol-5-yl)-1-oxopropyl]amino]-3-(2-methyl-1H-indol-3-yl)-1-oxopropyl]amino]-1-oxopropyl]amino]-3-(1H-indol-3-yl)-1-oxopropyl]amino]-1-oxo-3-phenylpropyl]a
Examorelin [INN] [Wiki]
Hexarelin

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

Density: 1.3±0.1 g/cm3
Boiling Point: 1403.6±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.3 mmHg at 25°C
Enthalpy of Vaporization: 214.7±3.0 kJ/mol
Flash Point: 802.7±34.3 °C
Index of Refraction: 1.660
Molar Refractivity: 247.7±0.3 cm3
#H bond acceptors: 18
#H bond donors: 14
#Freely Rotating Bonds: 23
#Rule of 5 Violations: 3
ACD/LogP: 1.97
ACD/LogD (pH 5.5): -2.83
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -1.44
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 301 Å2
Polarizability: 98.2±0.5 10-24cm3
Surface Tension: 66.6±3.0 dyne/cm
Molar Volume: 670.8±3.0 cm3

Click to predict properties on the Chemicalize site


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