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Search term: ATQZLXCPGRCBSZ-RZKYVOMISA-N (Found by InChIKey (full match))
ChemSpider 2D Image | N~2~-{[4-(2-Naphthoylamino)phenyl]acetyl}-L-arginyl-L-isoleucyl-L-alpha-aspartyl-L-argininamide | C41H56N12O8

N2-{[4-(2-Naphthoylamino)phenyl]acetyl}-L-arginyl-L-isoleucyl-L-α-aspartyl-L-argininamide

  • Molecular FormulaC41H56N12O8
  • Average mass844.959 Da
  • Monoisotopic mass844.434387 Da
  • ChemSpider ID23152388

  • defined stereocentres - 5 of 5 defined stereocentres

More details:

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

L-Argininamide, N2-[2-[4-[(2-naphthalenylcarbonyl)amino]phenyl]acetyl]-L-arginyl-L-isoleucyl-L-α-aspartyl- [ACD/Index Name]
N2-{[4-(2-Naphthoylamino)phenyl]acetyl}-L-arginyl-L-isoleucyl-L-α-asparagyl-L-argininamid [German] [ACD/IUPAC Name]
N2-{[4-(2-Naphthoylamino)phenyl]acetyl}-L-arginyl-L-isoleucyl-L-α-aspartyl-L-argininamide [ACD/IUPAC Name]
N2-{2-[4-(2-Naphtoylamino)phényl]acétyl}-L-arginyl-L-isoleucyl-L-α-aspartyl-L-argininamide [French] [ACD/IUPAC Name]
N5-(diaminomethylidene)-N2-({4-[(naphthalen-2-ylcarbonyl)amino]phenyl}acetyl)-L-ornithyl-L-isoleucyl-L-α-aspartyl-N5-(diaminomethylidene)-L-ornithinamide
(S)-N-((S)-1-Carbamoyl-4-guanidino-butyl)-3-{2-[(S)-5-guanidino-2-(2-{4-[(naphthalene-2-carbonyl)-amino]-phenyl}-acetylamino)-pentanoylamino]-3-methyl-pentanoylamino}-succinamic acid
CHEMBL434023

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: 1.662
Molar Refractivity: 221.3±0.5 cm3
#H bond acceptors: 20
#H bond donors: 16
#Freely Rotating Bonds: 24
#Rule of 5 Violations: 3
ACD/LogP: 1.08
ACD/LogD (pH 5.5): -3.67
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -3.71
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 355 Å2
Polarizability: 87.7±0.5 10-24cm3
Surface Tension: 62.0±7.0 dyne/cm
Molar Volume: 597.9±7.0 cm3

Click to predict properties on the Chemicalize site


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