ChemSpider 2D Image | Tyrosylmethionyl-alpha-aspartylglycylthreonylmethionylserylglutaminylvaline | C42H66N10O16S2

Tyrosylmethionyl-α-aspartylglycylthreonylmethionylserylglutaminylvaline

  • Molecular FormulaC42H66N10O16S2
  • Average mass1031.161 Da
  • Monoisotopic mass1030.409912 Da
  • ChemSpider ID350072

More details:

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

Tyrosylmethionyl-α-asparagylglycylthreonylmethionylserylglutaminylvalin [German] [ACD/IUPAC Name]
Tyrosylmethionyl-α-aspartylglycylthreonylmethionylserylglutaminylvaline [ACD/IUPAC Name]
Tyrosylméthionyl-α-aspartylglycylthréonylméthionylsérylglutaminylvaline [French] [ACD/IUPAC Name]
Valine, tyrosylmethionyl-α-aspartylglycylthreonylmethionylserylglutaminyl- [ACD/Index Name]
(2S)-2-[[(2S)-5-amino-2-[[(2S)-2-[[(2S)-2-[[(2S,3R)-2-[[2-[[(2S)-2-[[(2S)-2-[[(2S)-2-amino-3-(4-hydroxyphenyl)propanoyl]amino]-4-methylsulfanylbutanoyl]amino]-3-carboxypropanoyl]amino]acetyl]amino]-3-hydroxybutanoyl]amino]-4-methylsulfanylbutanoyl]amino]-3-hydroxypropanoyl]amino]-5-oxopentanoyl]amino]-3-methylbutanoic acid
168650-46-2 [RN]
TY9-386 (YMDGTMSQV)

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

NSC699048 [DBID]

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

Density: 1.4±0.1 g/cm3
Boiling Point: 1578.2±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.3 mmHg at 25°C
Enthalpy of Vaporization: 257.6±3.0 kJ/mol
Flash Point: 908.2±34.3 °C
Index of Refraction: 1.590
Molar Refractivity: 253.1±0.3 cm3
#H bond acceptors: 26
#H bond donors: 17
#Freely Rotating Bonds: 33
#Rule of 5 Violations: 3
ACD/LogP: -1.38
ACD/LogD (pH 5.5): -6.08
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -6.62
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 488 Å2
Polarizability: 100.3±0.5 10-24cm3
Surface Tension: 65.2±3.0 dyne/cm
Molar Volume: 749.8±3.0 cm3

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