aciclovir

Ligand id: 4829

Name: aciclovir

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 8
Hydrogen bond donors 4
Rotatable bonds 4
Topological polar surface area 114.43
Molecular weight 226.09
XLogP -1.83
No. Lipinski's rules broken 0

Molecular properties generated using the CDK

References
1. Allaudeen HS, Descamps J, Sehgal RK. (1982)
Mode of action of acyclovir triphosphate on herpesviral and cellular DNA polymerases.
Antiviral Res.2 (3): 123-33. [PMID:6291456]
2. Datta AK, Colby BM, Shaw JE, Pagano JS. (1980)
Acyclovir inhibition of Epstein-Barr virus replication.
Proc. Natl. Acad. Sci. U.S.A.77 (9): 5163-6. [PMID:6254061]
3. Gnann Jr JW, Barton NH, Whitley RJ. (1983)
Acyclovir: mechanism of action, pharmacokinetics, safety and clinical applications.
Pharmacotherapy3 (5): 275-83. [PMID:6359082]
4. Tanihara Y, Masuda S, Sato T, Katsura T, Ogawa O, Inui K. (2007)
Substrate specificity of MATE1 and MATE2-K, human multidrug and toxin extrusions/H(+)-organic cation antiporters.
Biochem. Pharmacol.74 (2): 359-71. [PMID:17509534]