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82801-73-8

Basic Information
CAS No.: 82801-73-8
Name: ARG-LYS-ARG-ALA-ARG-LYS-GLU
Molecular Structure:
Molecular Structure of 82801-73-8 (ARG-LYS-ARG-ALA-ARG-LYS-GLU)
Formula: C38H74N18O10
Molecular Weight: 943.1088
Synonyms: L-Glutamicacid, N-[N2-[N2-[N-[N2-(N2-L-arginyl-L-lysyl)-L-arginyl]-L-alanyl]-L-arginyl]-L-lysyl]-;6: PN: US20090092566 SEQID: 6 claimed protein;7: PN: US20070122395 PAGE: 23unclaimed sequence;PKG inhibitor;Protein kinase G inhibitor;Arg-Lys-Arg-Ala-Arg-Lys-Glu;L-Glutamic acid, N-(N2-(N2-(N-(N2-(N2-L-arginyl-L-lysyl)-L-arginyl)-L-alanyl)-L-arginyl)-L-lysyl)-;Arg-7-glu;arginyl-lysyl-arginyl-alanyl-arginyl-lysyl-glutamic acid;
Density: 1.5 g/cm3
Solubility: Soluble in water at 1mg/ml
PSA: 512.96000
LogP: 2.25870
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Specification

The L-Glutamic acid,L-arginyl-L-lysyl-L-arginyl-L-alanyl-L-arginyl-L-lysyl-, with the CAS registry number 82801-73-8, is also called Arg-Lys-Arg-Ala-Arg-Lys-Glu. It belongs to the product category of Protein Kinase. And the molecular formula of the chemical is C38H74N18O10. What's more, it should be stored at -20°C.

The characteristics of L-Glutamic acid,L-arginyl-L-lysyl-L-arginyl-L-alanyl-L-arginyl-L-lysyl- are as followings: (1)ACD/LogP: -5.78; (2)# of Rule of 5 Violations: 3; (3)ACD/LogD (pH 5.5): -12.78; (4)ACD/LogD (pH 7.4): -12.01; (5)ACD/BCF (pH 5.5): 1; (6)ACD/BCF (pH 7.4): 1; (7)ACD/KOC (pH 5.5): 1; (8)ACD/KOC (pH 7.4): 1; (9)#H bond acceptors: 28; (10)#H bond donors: 26; (11)#Freely Rotating Bonds: 39; (12)Polar Surface Area: 240.7 Å2; (13)Index of Refraction: 1.657; (14)Molar Refractivity: 230.74 cm3; (15)Molar Volume: 626.7 cm3; (16)Polarizability: 91.47×10-24cm3; (17)Surface Tension: 70 dyne/cm; (18)Density: 1.5 g/cm3.

Addtionally, the following datas could be converted into the molecular structure:
(1)SMILES: O=C(N[C@H](C(=O)O)CCC(=O)O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](N)CCC/N=C(\N)N)CCCCN)CCC/N=C(\N)N)C)CCC/N=C(\N)N)CCCCN
(2)InChI: InChI=1/C38H74N18O10/c1-21(29(59)52-26(13-8-20-50-38(46)47)33(63)54-24(11-3-5-17-40)34(64)56-27(35(65)66)14-15-28(57)58)51-31(61)25(12-7-19-49-37(44)45)55-32(62)23(10-2-4-16-39)53-30(60)22(41)9-6-18-48-36(42)43/h21-27H,2-20,39-41H2,1H3,(H,51,61)(H,52,59)(H,53,60)(H,54,63)(H,55,62)(H,56,64)(H,57,58)(H,65,66)(H4,42,43,48)(H4,44,45,49)(H4,46,47,50)/t21-,22-,23-,24-,25-,26-,27-/m0/s1
(3)InChIKey: OUKSKNTVYYVIMZ-DUJSLOSMBG