1.0 2016-05-22 04:30:15 UTC 2026-08-25 11:44:28 UTC Ganciclovir SmallMolecule Ganciclovir is an organic compound with the formula C9H13N5O4 and an average molecular weight of 255.23 g/mol. Ganciclovir belongs to the purines and purine derivatives, a subclass of imidazopyrimidines within the organic compounds. This substance is identified as an organoheterocyclic compound. The compound is found in or released from five recorded sources, including antennas in electrical and electronic equipment, drinking water in drinking water and water supply, and antivirals, antiinfectives, and antibiotics within healthcare, pharmaceuticals, and veterinary products. Recorded exposure routes for ganciclovir include oral, ophthalmic, intravitreal, intraventricular, intravenous, and inhalation. Regarding its biological activity, two protein targets are recorded: thymidine kinase (TK) and the DNA polymerase catalytic subunit, for which ganciclovir acts as an inhibitor or substrate. Human Neurotoxin 2-amino-9-{[(1,3-dihydroxypropan-2-yl)oxy]methyl}-6,9-dihydro-1H-purin-6-one C9H13N5O4 255.2306 255.096753929 2-amino-9-{[(1,3-dihydroxypropan-2-yl)oxy]methyl}-6,9-dihydro-1H-purin-6-one gancyclovir 82410-32-0 NC1=NC2=C(N=CN2COC(CO)CO)C(=O)N1 InChI=1S/C9H13N5O4/c10-9-12-7-6(8(17)13-9)11-3-14(7)4-18-5(1-15)2-16/h3,5,15-16H,1-2,4H2,(H3,10,12,13,17) IRSCQMHQWWYFCW-UHFFFAOYSA-N Organic compounds Organoheterocyclic compounds Imidazopyrimidines Purines and purine derivatives Hypoxanthines 6-oxopurines Aminopyrimidines and derivatives Azacyclic compounds Glycerolipids 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 Glycerolipid 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 Ganciclovir Action Pathway SMP0125882 Valganciclovir Action Pathway SMP0125898 Ganciclovir Drug Metabolism SMP0130770 Ganciclovir Drug Metabolism Action Pathway SMP0143434 logp -2.2 logp -1.83 ALOGPS logs -1.35 ALOGPS solubility 1.15e+01 g/l ALOGPS logp -2.2 ChemAxon pka_strongest_acidic 10.16 ChemAxon pka_strongest_basic 1.76 ChemAxon iupac 2-amino-9-{[(1,3-dihydroxypropan-2-yl)oxy]methyl}-6,9-dihydro-1H-purin-6-one ChemAxon average_mass 255.2306 ChemAxon mono_mass 255.096753929 ChemAxon smiles NC1=NC2=C(N=CN2COC(CO)CO)C(=O)N1 ChemAxon formula C9H13N5O4 ChemAxon inchi InChI=1S/C9H13N5O4/c10-9-12-7-6(8(17)13-9)11-3-14(7)4-18-5(1-15)2-16/h3,5,15-16H,1-2,4H2,(H3,10,12,13,17) ChemAxon inchikey IRSCQMHQWWYFCW-UHFFFAOYSA-N ChemAxon polar_surface_area 134.99 ChemAxon refractivity 61.03 ChemAxon polarizability 24.15 ChemAxon rotatable_bond_count 5 ChemAxon acceptor_count 7 ChemAxon donor_count 4 ChemAxon physiological_charge 0 ChemAxon formal_charge 0 ChemAxon #<HealthEffect::ActiveRecord_Associations_CollectionProxy:0x00007f72205c44c0> DB01004 3454 3336 BE0000308 BE0000458