e-Drug3D

1708

M SULINDAC

INN
SULINDAC

cas 49627-27-2

CLASS

MUSCULO-SKELETAL
ANTIINFLAMMATORY
NSAID
CYCLOOXYGENASE INHIBITORS (EC50 OF 0.02 MICROMOLAR)

ROUTE (list)

ATC code

M01AB02

PK parameters

Tmax 4.96 HOUR
PPB 97.9 PERCENT
t1/2 16.4 HOUR

Target

TARGET PROSTAGLANDIN G/H SYNTHASE 1
PROSTAGLANDIN G/H SYNTHASE 2

PDB
4XUH (PPARGAMMA LIGAND BINDING DOMAIN IN COMPLEX WITH SULINDAC SULFIDE)

Download experimental 3D coordinates of SFI with added hydrogens

Prostaglandin G,H synthase 2 UNIPROT P35354 PTGS2

Download SDF file

1H-Indene-3-acetic acid, 5-fluoro-2-methyl-1-[[4-(methylthio)phenyl]methylene]-, (1Z)-

Formula:
C20H17FO2S

Calculated chemical properties:

MW 339.40
NB_atoms 24
XLogP 4.02
PSA 35.69
NB_HD 0
NB_HA 2
fsp3 0.15
Lipinski(0=no;1=yes) 1

FDA
-