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Compound IDNVIC0047
Compound Structure
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InhibitorClemastine
SMILESCC(C1=CC=CC=C1)(C2=CC=C(C=C2)Cl)OCCC3CCCN3C.C(=CC(=O)O)C(=O)O
PubChem ID 23724780
Drug Bank ID\N
ChemSpider ID58178872
Target\N
Assay Type\N
Assay Description\N
Assay SourceMicroSource Spectrum Collection
Cell Type\N
IC50 (nM)0.0
EC50 (in nM)0.0
Outcome\N
Molecular Weight (in g/mol)459.97
H-bond Acceptor3
H-bond Donor0
No. of Rotatable Bonds6
LogP6.50
Topological Polar Surface Area (Å)12.47
PUBMED ID19264786
Referencehttps://www.ncbi.nlm.nih.gov/pmc/articles/PMC2682105/
Curator Email IDnishisharmacool14@gmail.com