1.0 2016-05-20 16:18:07 UTC 2026-08-24 12:22:18 UTC Aciclovir SmallMolecule Aciclovir is an organic compound with the chemical formula C8H11N5O3 and an average molecular weight of 225.20 g/mol. Aciclovir belongs to the purines and purine derivatives, a subclass of imidazopyrimidines within the organic compounds. In terms of biological activity, it acts as an inhibitor of the DNA polymerase catalytic subunit. The substance is found in or released from eight recorded sources. These include drinking water and water supply (drinking water), electrical and electronic equipment (antennas), building and construction (tents or canopies, floors), and healthcare, pharmaceuticals and veterinary products, specifically including antivirals, antiinfectives, antibiotics, and chemotherapeutics. Recorded exposure routes for the compound include oral, intravenous, inhalation, buccal, cutaneous, topical, and ophthalmic pathways. Human Neurotoxin Acyclovir C8H11N5O3 225.2046 225.086189243 2-amino-9-[(2-hydroxyethoxy)methyl]-6,9-dihydro-3H-purin-6-one zovirax 59277-89-3 NC1=NC(=O)C2=C(N1)N(COCCO)C=N2 InChI=1S/C8H11N5O3/c9-8-11-6-5(7(15)12-8)10-3-13(6)4-16-2-1-14/h3,14H,1-2,4H2,(H3,9,11,12,15) MKUXAQIIEYXACX-UHFFFAOYSA-N Organic compounds Organoheterocyclic compounds Imidazopyrimidines Purines and purine derivatives Hypoxanthines 6-oxopurines Aminopyrimidines and derivatives Azacyclic compounds Heteroaromatic compounds Hydrocarbon derivatives N-substituted imidazoles Organic oxides Organopnictogen compounds Primary alcohols Primary amines Pyrimidones Vinylogous amides 6-oxopurine Alcohol Amine Aminopyrimidine Aromatic heteropolycyclic compound Azacycle Azole Heteroaromatic compound Hydrocarbon derivative Hypoxanthine Imidazole N-substituted imidazole Organic nitrogen compound Organic oxide Organic oxygen compound Organonitrogen compound Organooxygen compound Organopnictogen compound Primary alcohol Primary amine Pyrimidine Pyrimidone Vinylogous amide Aromatic heteropolycyclic compounds 2-aminopurines oxopurine Detected and Not Quantified Acyclovir Action Pathway (New) SMP0125063 Valacyclovir Action Pathway SMP0125888 logp -1 logp -0.95 ALOGPS logs -1.39 ALOGPS solubility 9.08e+00 g/l ALOGPS logp -1 ChemAxon pka_strongest_acidic 7.99 ChemAxon pka_strongest_basic 2.63 ChemAxon iupac 2-amino-9-[(2-hydroxyethoxy)methyl]-6,9-dihydro-3H-purin-6-one ChemAxon average_mass 225.2046 ChemAxon mono_mass 225.086189243 ChemAxon smiles NC1=NC(=O)C2=C(N1)N(COCCO)C=N2 ChemAxon formula C8H11N5O3 ChemAxon inchi InChI=1S/C8H11N5O3/c9-8-11-6-5(7(15)12-8)10-3-13(6)4-16-2-1-14/h3,14H,1-2,4H2,(H3,9,11,12,15) ChemAxon inchikey MKUXAQIIEYXACX-UHFFFAOYSA-N ChemAxon polar_surface_area 114.76 ChemAxon refractivity 54.63 ChemAxon polarizability 21.51 ChemAxon rotatable_bond_count 4 ChemAxon acceptor_count 7 ChemAxon donor_count 3 ChemAxon physiological_charge 0 ChemAxon formal_charge 0 ChemAxon #<HealthEffect::ActiveRecord_Associations_CollectionProxy:0x00007f7263d01e20> DB00787 2022 1945 BE0000308 BE0000633