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ChemSpider 2D Image | [[5-(6-aminopurin-9-yl)-3,4-dihydroxy-tetrahydrofuran-2-yl]methoxy-hydroxy-phosphoryl] [5-[7,8-dimethyl-2,4-dioxo-5-(3-phenylpropanoyl)-1H-benzo[g]pteridin-10-yl]-2,3,4-trihydroxy-pentyl] hydrogen phosphate | C36H43N9O16P2

[[5-(6-aminopurin-9-yl)-3,4-dihydroxy-tetrahydrofuran-2-yl]methoxy-hydroxy-phosphoryl] [5-[7,8-dimethyl-2,4-dioxo-5-(3-phenylpropanoyl)-1H-benzo[g]pteridin-10-yl]-2,3,4-trihydroxy-pentyl] hydrogen phosphate

  • Molecular FormulaC36H43N9O16P2
  • Average mass919.725 Da
  • Monoisotopic mass919.230286 Da
  • ChemSpider ID22377123

More details:






Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.9±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.786
Molar Refractivity: 208.8±0.5 cm3
#H bond acceptors: 25
#H bond donors: 11
#Freely Rotating Bonds: 16
#Rule of 5 Violations: 3
ACD/LogP: -1.14
ACD/LogD (pH 5.5): -6.98
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -7.05
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 384 Å2
Polarizability: 82.8±0.5 10-24cm3
Surface Tension: 94.5±7.0 dyne/cm
Molar Volume: 495.0±7.0 cm3

Click to predict properties on the Chemicalize site






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