Record No. 1 of 1

ID1235
NameAspirin
Pubchem ID2244
KEGG IDD00109
SourceN/A
TypeUnknown
FunctionCyclooxygenase inhibitor
Drug Like PropertiesYes
Molecular Weight180.16
Exact mass180.042259
Molecular formulaC9H8O4
XlogP1.2
Topological Polar Surface Area63.6
H-Bond Donor1
H-Bond Acceptor4
Rotational Bond Count3
IUPAC Name2-acetyloxybenzoic acid
Structure
   
SDF file
MOL file
PDB file
Canonical SMILECC(=O)OC1=CC=CC=C1C(=O)O
Isomeric SMILEN/A
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