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Details

Stereochemistry ACHIRAL
Molecular Formula C14H12N2O2
Molecular Weight 240.2573
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of ROLAFAGREL

SMILES

OC(=O)C1=CC=C2CCC(=CC2=C1)N3C=CN=C3

InChI

InChIKey=DQEDSIVMYUUZCK-UHFFFAOYSA-N
InChI=1S/C14H12N2O2/c17-14(18)11-2-1-10-3-4-13(8-12(10)7-11)16-6-5-15-9-16/h1-2,5-9H,3-4H2,(H,17,18)

HIDE SMILES / InChI
Rolafagrel (FCE 22178) is a selective thromboxane synthase inhibitor that has been evaluated for use in the treatment of diabetic nephropathy and thrombosis. Rolafagrel inhibits platelet and glomerular thromoxane synthase in animal and human kidney disease. A phase I clinical trial did not report drug-related adverse events. No information is available on current use of rolafagrel.

Approval Year

Targets

Targets

Primary TargetPharmacologyConditionPotency
Target ID: P24557|||Q8IUN1|||Q9HD82
Gene ID: 6916.0
Gene Symbol: TBXAS1
Target Organism: Homo sapiens (Human)
PubMed

PubMed

TitleDatePubMed
Patents
Name Type Language
ROLAFAGREL
INN   WHO-DD  
INN  
Official Name English
rolafagrel [INN]
Common Name English
5,6-DIHYDRO-7-IMIDAZOL-1-YL-2-NAPHTHOIC ACID
Systematic Name English
Rolafagrel [WHO-DD]
Common Name English
Classification Tree Code System Code
NCI_THESAURUS C471
Created by admin on Fri Dec 15 15:33:45 GMT 2023 , Edited by admin on Fri Dec 15 15:33:45 GMT 2023
NCI_THESAURUS C1327
Created by admin on Fri Dec 15 15:33:45 GMT 2023 , Edited by admin on Fri Dec 15 15:33:45 GMT 2023
Code System Code Type Description
NCI_THESAURUS
C96929
Created by admin on Fri Dec 15 15:33:45 GMT 2023 , Edited by admin on Fri Dec 15 15:33:45 GMT 2023
PRIMARY
MESH
C066217
Created by admin on Fri Dec 15 15:33:45 GMT 2023 , Edited by admin on Fri Dec 15 15:33:45 GMT 2023
PRIMARY
CAS
89781-55-5
Created by admin on Fri Dec 15 15:33:45 GMT 2023 , Edited by admin on Fri Dec 15 15:33:45 GMT 2023
PRIMARY
PUBCHEM
56009
Created by admin on Fri Dec 15 15:33:45 GMT 2023 , Edited by admin on Fri Dec 15 15:33:45 GMT 2023
PRIMARY
EVMPD
SUB10362MIG
Created by admin on Fri Dec 15 15:33:45 GMT 2023 , Edited by admin on Fri Dec 15 15:33:45 GMT 2023
PRIMARY
ChEMBL
CHEMBL2107064
Created by admin on Fri Dec 15 15:33:45 GMT 2023 , Edited by admin on Fri Dec 15 15:33:45 GMT 2023
PRIMARY
EPA CompTox
DTXSID30237887
Created by admin on Fri Dec 15 15:33:45 GMT 2023 , Edited by admin on Fri Dec 15 15:33:45 GMT 2023
PRIMARY
SMS_ID
100000084349
Created by admin on Fri Dec 15 15:33:45 GMT 2023 , Edited by admin on Fri Dec 15 15:33:45 GMT 2023
PRIMARY
INN
6769
Created by admin on Fri Dec 15 15:33:45 GMT 2023 , Edited by admin on Fri Dec 15 15:33:45 GMT 2023
PRIMARY
FDA UNII
OAH71568Y4
Created by admin on Fri Dec 15 15:33:45 GMT 2023 , Edited by admin on Fri Dec 15 15:33:45 GMT 2023
PRIMARY