Chemical Component Summary

Name5-(5-(2,6-DICHLORO-4-(4,5-DIHYDRO-2-OXAZOLY)PHENOXY)PENTYL)-3-METHYL ISOXAZOLE
SynonymsWIN54954
Identifiers5-[5-[2,6-dichloro-4-(4,5-dihydro-1,3-oxazol-2-yl)phenoxy]pentyl]-3-methyl-1,2-oxazole
FormulaC18 H20 Cl2 N2 O3
Molecular Weight383.269
TypeNON-POLYMER
Isomeric SMILESCc1cc(on1)CCCCCOc2c(cc(cc2Cl)C3=NCCO3)Cl
InChIInChI=1S/C18H20Cl2N2O3/c1-12-9-14(25-22-12)5-3-2-4-7-23-17-15(19)10-13(11-16(17)20)18-21-6-8-24-18/h9-11H,2-8H2,1H3
InChIKeyJJDHAOLOHQTGMG-UHFFFAOYSA-N

Chemical Details

Formal Charge0
Atom Count45
Chiral Atom Count0
Bond Count47
Aromatic Bond Count11

Drug Info: DrugBank

DrugBank IDDB08723 
NameWIN-54954
Groups experimental
DescriptionWIN-54954 is a broad-spectrum antipicornavirus drug.
SynonymsWIN-54954
CAS number107355-45-3

Drug Targets

NameTarget SequencePharmacological ActionActions
Genome polyproteinMGAQVSTQKSGSHENQNILTNGSNQTFTVINYYKDAASTSSAGQSLSMDP...unknown
Genome polyproteinMGAQVSRQNVGTHSTQNSVSNGSSLNYFNINYFKDAASSGASRLDFSQDP...unknown
Drug Info/Drug Targets: DrugBank 3.0: a comprehensive resource for 'omics' research on drugs. Knox C, Law V, Jewison T, Liu P, Ly S, Frolkis A, Pon A, Banco K, Mak C, Neveu V, Djoumbou Y, Eisner R, Guo AC, Wishart DS. Nucleic Acids Res. 2011 Jan; 39 (Database issue):D1035-41. | PMID:21059682

Related Resource References

Resource NameReference
PubChem 441048
ChEMBL CHEMBL6594
ChEBI CHEBI:10029