ChemSpider 2D Image | Cyclo(arginylglycyl-alpha-aspartylphenylalanyl-N-methylvalyl) | C27H40N8O7

Cyclo(arginylglycyl-α-aspartylphenylalanyl-N-methylvalyl)

  • Molecular FormulaC27H40N8O7
  • Average mass588.656 Da
  • Monoisotopic mass588.302002 Da
  • ChemSpider ID10702496

More details:

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

Cyclo(arginylglycyl-α-asparagylphenylalanyl-N-methylvalyl) [German] [ACD/IUPAC Name]
Cyclo(arginylglycyl-α-aspartylphenylalanyl-N-methylvalyl) [ACD/Index Name] [ACD/IUPAC Name]
Cyclo(arginylglycyl-α-aspartylphénylalanyl-N-méthylvalyl) [French] [ACD/IUPAC Name]
2-[(2S,5R,8S,11S)-5-benzyl-11-[3-(diaminomethylideneamino)propyl]-7-methyl-3,6,9,12,15-pentaoxo-8-propan-2-yl-1,4,7,10,13-pentazacyclopentadec-2-yl]acetic acid
cilengitide [INN] [USAN] [Wiki]
cyclo-(Arg-Gly-Asp-DPhe-NMeVal)
CYCLO(L-ARGINYLGLYCYL-L-A-ASPARTYL-D-PHENYLALANYL-N-METHYL-L-VALYL)

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: 1.643
Molar Refractivity: 150.4±0.5 cm3
#H bond acceptors: 15
#H bond donors: 9
#Freely Rotating Bonds: 9
#Rule of 5 Violations: 3
ACD/LogP: -2.32
ACD/LogD (pH 5.5): -3.82
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -3.85
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 238 Å2
Polarizability: 59.6±0.5 10-24cm3
Surface Tension: 59.0±7.0 dyne/cm
Molar Volume: 415.6±7.0 cm3

Click to predict properties on the Chemicalize site


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