× Home About Simple Search Query Builder Structure Search Browse Similarity with FDA Approved Small Molecule Drugs Similarity with COCONUT compounds Similarity with ZINC Lead-like compounds Priority Inhibitors Cluster Visualization Submission Useful Resources Downloads Contact Us
logo
☰
                  
Record - 1 of 1   [TOP]
Compound IDNVIC0040
Compound Structure
DOWNLOAD:
Inhibitor1926-2281
SMILESc1cc(cc2c1cc(/c(=N/c3c(c4c(s3)CCCC4)C(=O)N)/o2)C(=O)N)O
PubChem ID \N
Drug Bank ID\N
ChemSpider ID21538902
Target\N
Assay Type\N
Assay Description\N
Assay SourceChemDiv (San Diego, CA)
Cell Type\N
IC50 (nM)0.0
EC50 (in nM)0.0
Outcome\N
Molecular Weight (in g/mol)383.40
H-bond Acceptor7
H-bond Donor3
No. of Rotatable Bonds3
LogP1.68
Topological Polar Surface Area (Å)156.24
PUBMED ID19264786
Referencehttps://www.ncbi.nlm.nih.gov/pmc/articles/PMC2682105/
Curator Email IDnishisharmacool14@gmail.com