ChemSpider 2D Image | N-{[15-(3-Carbamimidamidopropyl)-9-(carboxymethyl)-12,25-bis(4-hydroxybenzyl)-3,6-bis(1H-indol-3-ylmethyl)-1,4,7,10,13,16,20,23,26-nonaoxotriacontahydropyrrolo[1,2-g][1,4,7,10,13,16,19,22,25]nonaazacy clooctacosin-18-yl]carbonyl}leucylphenylalanylglycylglycylhistidylthreonylphenylalanylisoleucylserylproline | C113H142N26O27

N-{[15-(3-Carbamimidamidopropyl)-9-(carboxymethyl)-12,25-bis(4-hydroxybenzyl)-3,6-bis(1H-indol-3-ylmethyl)-1,4,7,10,13,16,20,23,26-nonaoxotriacontahydropyrrolo[1,2-g][1,4,7,10,13,16,19,22,25]nonaazacy clooctacosin-18-yl]carbonyl}leucylphenylalanylglycylglycylhistidylthreonylphenylalanylisoleucylserylproline

  • Molecular FormulaC113H142N26O27
  • Average mass2296.495 Da
  • Monoisotopic mass2295.053711 Da
  • ChemSpider ID78444106

More details:

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

N-{[15-(3-Carbamimidamidopropyl)-9-(carboxymethyl)-12,25-bis(4-hydroxybenzyl)-3,6-bis(1H-indol-3-ylmethyl)-1,4,7,10,13,16,20,23,26-nonaoxotriacontahydropyrrolo[1,2-g][1,4,7,10,13,16,19,22,25]nonaazacy clooctacosin-18-yl]carbonyl}leucylphenylalanylglycylglycylhistidylthreonylphenylalanylisoleucylserylprolin [German] [ACD/IUPAC Name]
N-{[15-(3-Carbamimidamidopropyl)-9-(carboxymethyl)-12,25-bis(4-hydroxybenzyl)-3,6-bis(1H-indol-3-ylmethyl)-1,4,7,10,13,16,20,23,26-nonaoxotriacontahydropyrrolo[1,2-g][1,4,7,10,13,16,19,22,25]nonaazacy clooctacosin-18-yl]carbonyl}leucylphenylalanylglycylglycylhistidylthreonylphenylalanylisoleucylserylproline [ACD/IUPAC Name]
N-{[15-(3-Carbamimidamidopropyl)-9-(carboxyméthyl)-12,25-bis(4-hydroxybenzyl)-3,6-bis(1H-indol-3-ylméthyl)-1,4,7,10,13,16,20,23,26-nonaoxotriacontahydropyrrolo[1,2-g][1,4,7,10,13,16,19,22,25]nonaazacy clooctacosin-18-yl]carbonyl}leucylphénylalanylglycylglycylhistidylthréonylphénylalanylisoleucylsérylproline [French] [ACD/IUPAC Name]
Proline, N-[[15-[3-[(aminoiminomethyl)amino]propyl]-9-(carboxymethyl)triacontahydro-12,25-bis[(4-hydroxyphenyl)methyl]-3,6-bis(1H-indol-3-ylmethyl)-1,4,7,10,13,16,20,23,26-nonaoxopyrrolo[1,2-g][1,4,7, 10,13,16,19,22,25]nonaazacyclooctacosin-18-yl]carbonyl]leucylphenylalanylglycylglycylhistidylthreonylphenylalanylisoleucylseryl- [ACD/Index Name]
Propeptin

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

Density: 1.5±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.701
Molar Refractivity: 593.8±0.5 cm3
#H bond acceptors: 53
#H bond donors: 30
#Freely Rotating Bonds: 47
#Rule of 5 Violations: 3
ACD/LogP: -0.51
ACD/LogD (pH 5.5):
ACD/BCF (pH 5.5):
ACD/KOC (pH 5.5):
ACD/LogD (pH 7.4):
ACD/BCF (pH 7.4):
ACD/KOC (pH 7.4):
Polar Surface Area: 813 Å2
Polarizability: 235.4±0.5 10-24cm3
Surface Tension: 67.1±7.0 dyne/cm
Molar Volume: 1534.6±7.0 cm3

Click to predict properties on the Chemicalize site


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