General
Preferred name
TENIDAP
Synonyms
5-Chloro-2,3-dihydro-3-(hydroxy-2-thienylmethylene)-2-oxo-1h-indole-1-carboxamide ()
P&D ID
PD014802
CAS
120210-48-2
Tags
drug candidate
Drug indication
Rheumatoid arthritis
Structure
Probe scores
P&D probe-likeness score
[[ v.score ]]%
Structure formats
[[ format ]]
[[ compound[format === 'MOL' ? 'molblock' : format.toLowerCase()] ]]
Description
(extracted from source data)
DESCRIPTION Tenidap is a dual COX/5-LOX inhibitor . It was a clinical candidate with anti-inflammatory/anti-rheumatic potential, but development was terminated due to liver and kidney toxicity .
The INN record for tenidap provides the IUPAC name (Z)-5-chloro-3-(α-hydroxy-2-thenylidene)-2-oxo-1-indolinecarboxamide. The SMILES obtained by coverting this IUPAC using OPSIN match PubChem CID 60712, however this CID does not include the Z configuration that was specified in the INN's IUPAC name. (GtoPdb)
Compound Sets
4
DrugMAP
DMHQRYE
Guide to Pharmacology
2395
Ki Database
Tenidap
NPC Screening Collection
External IDs
13
Properties
(calculated by RDKit )
Molecular Weight
320.0
Hydrogen Bond Acceptors
5
Hydrogen Bond Donors
2
Rotatable Bonds
2
Ring Count
3
Aromatic Ring Count
3
cLogP
3.22
TPSA
85.32
Fraction CSP3
0.0
Chiral centers
0.0
Largest ring
6.0
QED
0.71
Structural alerts
0
No structural alerts detected
Custom attributes
(extracted from source data)
Source data