Indomethacin

Structure Molecule image
Relationships Total Number of functionally related protein(s) : 1626
Total Number of Articles : 4545
PubChem 3715
Molecular Formula

C19H16ClNO4

SMILES

CC1=C(C2=C(N1C(=O)C3=CC=C(C=C3)Cl)C=CC(=C2)OC)CC(=O)O

InChI

InChI=1S/C19H16ClNO4/c1-11-15(10-18(22)23)16-9-14(25-2)7-8-17(16)21(11)19(24)12-3-5-13(20)6-4-12/h3-9H,10H2,1-2H3,(H,22,23)

synonyms
  • indomethacin
  • 53-86-1
  • indometacin
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Properties
Property Value
MW 357.8 g/mol
HBD 1
HBA 4
Rotatable Bond Count 4
Exact Mass 357.0767857 g/mol
Monoisotopic Mass 357.0767857 g/mol
Heavy Atom Count 25
Isotope Atom Count 0
Atom Stereo Count 0
Covalent Unit Count 1
Complexity 506
xlogp 4.3
Topological Polar Surface Area 68.5