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2D Structure
Also known as:
Molecular Formula
C13H21ClN6O4
Molecular Weight
360.80  g/mol
InChI Key
ZCDDBUOENGJMLV-QRPNPIFTSA-N

1 2D Structure

2D Structure

2 Identification
2.1 Computed Descriptors
2.1.1 IUPAC Name
2-[(2-amino-6-oxo-3H-purin-9-yl)methoxy]ethyl (2S)-2-amino-3-methylbutanoate;hydrochloride
2.1.2 InChI
InChI=1S/C13H20N6O4.ClH/c1-7(2)8(14)12(21)23-4-3-22-6-19-5-16-9-10(19)17-13(15)18-11(9)20;/h5,7-8H,3-4,6,14H2,1-2H3,(H3,15,17,18,20);1H/t8-;/m0./s1
2.1.3 InChI Key
ZCDDBUOENGJMLV-QRPNPIFTSA-N
2.1.4 Canonical SMILES
CC(C)C(C(=O)OCCOCN1C=NC2=C1NC(=NC2=O)N)N.Cl
2.1.5 Isomeric SMILES
CC(C)[C@@H](C(=O)OCCOCN1C=NC2=C1NC(=NC2=O)N)N.Cl
2.2 Create Date
2005-06-24
3 Chemical and Physical Properties
Molecular Weight 360.80 g/mol
Molecular Formula C13H21ClN6O4
Hydrogen Bond Donor Count4
Hydrogen Bond Acceptor Count6
Rotatable Bond Count8
Exact Mass360.1312809 g/mol
Monoisotopic Mass360.1312809 g/mol
Topological Polar Surface Area147 A^2
Heavy Atom Count24
Formal Charge0
Complexity483
Isotope Atom Count0
Defined Atom Stereocenter Count1
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently Bonded Unit Count2
4 Drug and Medication Information
4.1 Drug Information
1 of 2  
Drug NameValacyclovir hydrochloride
Drug LabelVALTREX (valacyclovir hydrochloride) is the hydrochloride salt of the L-valyl ester of the antiviral drug acyclovir.VALTREX Caplets are for oral administration. Each caplet contains valacyclovir hydrochloride equivalent to 500mg or 1gram valacycl...
Active IngredientValacyclovir hydrochloride
Dosage FormTablet
RouteOral
Strengtheq 500mg base; eq 1gm base
Market StatusPrescription
CompanyWockhardt; Mylan Pharms; Ranbaxy; Apotex; Aurobindo Pharma; Sandoz; Cipla; Roxane; Watson Labs; Teva Pharms; Jubilant Generics; Dr Reddys Labs; Mylan

2 of 2  
Drug NameValacyclovir hydrochloride
Drug LabelVALTREX (valacyclovir hydrochloride) is the hydrochloride salt of the L-valyl ester of the antiviral drug acyclovir.VALTREX Caplets are for oral administration. Each caplet contains valacyclovir hydrochloride equivalent to 500mg or 1gram valacycl...
Active IngredientValacyclovir hydrochloride
Dosage FormTablet
RouteOral
Strengtheq 500mg base; eq 1gm base
Market StatusPrescription
CompanyWockhardt; Mylan Pharms; Ranbaxy; Apotex; Aurobindo Pharma; Sandoz; Cipla; Roxane; Watson Labs; Teva Pharms; Jubilant Generics; Dr Reddys Labs; Mylan