Found 1 result

Search term: IWEGOVKIJZGOSL (Found by InChIKey (skeleton match))
ChemSpider 2D Image | N-{4-[(3R)-6-(2,6-Diamino-4-oxo-1,4-dihydro-5-pyrimidinyl)-1,1,1-trifluoro-2,2-dihydroxy-3-hexanyl]benzoyl}-L-gamma-glutamyl-L-gamma-glutamyl-L-gamma-glutamyl-L-gamma-glutamyl-L-glutamic acid | C42H54F3N9O20

N-{4-[(3R)-6-(2,6-Diamino-4-oxo-1,4-dihydro-5-pyrimidinyl)-1,1,1-trifluoro-2,2-dihydroxy-3-hexanyl]benzoyl}-L-γ-glutamyl-L-γ-glutamyl-L-γ-glutamyl-L-γ-glutamyl-L-glutamic acid

  • Molecular FormulaC42H54F3N9O20
  • Average mass1061.922 Da
  • Monoisotopic mass1061.343750 Da
  • ChemSpider ID3572013

  • defined stereocentres - 6 of 6 defined stereocentres

More details:

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

Acide N-{4-[(3R)-6-(2,6-diamino-4-oxo-1,4-dihydro-5-pyrimidinyl)-1,1,1-trifluoro-2,2-dihydroxy-3-hexanyl]benzoyl}-L-γ-glutamyl-L-γ-glutamyl-L-γ-glutamyl-L-γ-glutamyl-L-glutamique [French] [ACD/IUPAC Name]
L-Glutamic acid, N-[4-[(1R)-4-(2,6-diamino-1,4-dihydro-4-oxo-5-pyrimidinyl)-1-(2,2,2-trifluoro-1,1-dihydroxyethyl)butyl]benzoyl]-L-γ-glutamyl-L-γ-glutamyl-L-γ-glutamyl-L-γ-glutamyl- [ACD/Index Name]
N-{4-[(3R)-6-(2,6-Diamino-4-oxo-1,4-dihydro-5-pyrimidinyl)-1,1,1-trifluor-2,2-dihydroxy-3-hexanyl]benzoyl}-L-γ-glutamyl-L-γ-glutamyl-L-γ-glutamyl-L-γ-glutamyl-L-glutaminsäure [German] [ACD/IUPAC Name]
N-{4-[(3R)-6-(2,6-Diamino-4-oxo-1,4-dihydro-5-pyrimidinyl)-1,1,1-trifluoro-2,2-dihydroxy-3-hexanyl]benzoyl}-L-γ-glutamyl-L-γ-glutamyl-L-γ-glutamyl-L-γ-glutamyl-L-glutamic acid [ACD/IUPAC Name]
KT5
N-{4-4-(2,4-DIAMINO-6-OXO-1,6-DIHYDRO-PYRIMIDIN-5-YL)-1-(2,2,2-TRIFLUORO-1,1-DIHYDROXY-ETHYL)-BUT-2-YL-BENZOYL}-γ-GLUTAMYL-γ-GLUTAMYL-γ-GLUTAMYL-γ-GLUTAMYL-GLUTAMIC ACID

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

Density: 1.7±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.652
Molar Refractivity: 234.0±0.5 cm3
#H bond acceptors: 29
#H bond donors: 18
#Freely Rotating Bonds: 33
#Rule of 5 Violations: 3
ACD/LogP: -4.28
ACD/LogD (pH 5.5): -12.94
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -13.37
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 503 Å2
Polarizability: 92.7±0.5 10-24cm3
Surface Tension: 72.0±7.0 dyne/cm
Molar Volume: 639.5±7.0 cm3

Click to predict properties on the Chemicalize site


Advertisement