You are looking to Heptanedioic Acid
General Information
Pubchem ID: 385
IUPAC Name: heptanedioic acid
Synonym/s: pimelic acid, pimeric acid
Molecular Formula: C7H12O4
SMILES:
Known Interaction/s
Structural Values
Molecular Weight (Da): 160.1700
Number of Atoms: 23
Rotatable Bonds: 6
Molecular Refractivity (m³ • mol-1 ): 37.340
Physico-chemical Properties
Volume (cm³ • mol-1 ): 613.26
Solvent Accessible Surface Area (Ų): 395.12
Hydrogen Bond Donor: 0
Hydrogen Bond Acceptor: 0
Total Charge: 0
pKa: 5.22
AlogP: 0.95
Polar Surface Area (Å): 103.32
Pharmacological Analysis
Rule of Five or Lipinsky Rule: Satisfied
Rule of Three: Unsatisfied
Ghose Filter: Unsatisfied
Functional Group/s
Carbonyl
Carboxylic Acid