ChemSpider 2D Image | GLYCYL-L-ALPHA-AMINO-EPSILON-PIMELYL-D-ALANYL-D-ALANINE | C15H26N4O7

GLYCYL-L-α-AMINO-ε-PIMELYL-D-ALANYL-D-ALANINE

  • Molecular FormulaC15H26N4O7
  • Average mass374.389 Da
  • Monoisotopic mass374.180145 Da
  • ChemSpider ID16744176

  • defined stereocentres - 3 of 3 defined stereocentres

More details:

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

D-Alanine, N-[(6R)-6-[(2-ammonioacetyl)amino]-6-carboxy-1-oxohexyl]-D-alanyl-, inner salt [ACD/Index Name]
GLYCYL-L-α-AMINO-ε-PIMELYL-D-ALANYL-D-ALANINE
N-{(6R)-6-[(2-Ammonioacétyl)amino]-6-carboxylatohexanoyl}-D-alanyl-D-alanine [French] [ACD/IUPAC Name]
N-{(6R)-6-[(Ammonioacetyl)amino]-6-carboxylatohexanoyl}-D-alanyl-D-alanin [German] [ACD/IUPAC Name]
N-{(6R)-6-[(Ammonioacetyl)amino]-6-carboxylatohexanoyl}-D-alanyl-D-alanine [ACD/IUPAC Name]
(2R)-2-(2-ammonioacetamido)-6-{[(1R)-1-{[(1R)-1-carboxyethyl]carbamoyl}ethyl]carbamoyl}hexanoate
(2R)-2-(2-azaniumylacetamido)-6-{[(1R)-1-{[(1R)-1-carboxyethyl]carbamoyl}ethyl]carbamoyl}hexanoate

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

PH7 [DBID]

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

Density:
Boiling Point: 831.5±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±6.6 mmHg at 25°C
Enthalpy of Vaporization: 131.2±6.0 kJ/mol
Flash Point: 456.7±34.3 °C
Index of Refraction:
Molar Refractivity:
#H bond acceptors: 11
#H bond donors: 7
#Freely Rotating Bonds: 12
#Rule of 5 Violations: 2
ACD/LogP: -2.10
ACD/LogD (pH 5.5): -5.52
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -5.61
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 192 Å2
Polarizability:
Surface Tension:
Molar Volume:

Click to predict properties on the Chemicalize site


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