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Details

Stereochemistry ACHIRAL
Molecular Formula C30H37N3O7S
Molecular Weight 583.696
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of ITX-5061 FREE BASE

SMILES

COC1=C(NS(C)(=O)=O)C=C(C=C1NC(=O)C(=O)C2=C3C=CC=CC3=C(OCCN4CCOCC4)C=C2)C(C)(C)C

InChI

InChIKey=UUROSJLZNDSXRF-UHFFFAOYSA-N
InChI=1S/C30H37N3O7S/c1-30(2,3)20-18-24(28(38-4)25(19-20)32-41(5,36)37)31-29(35)27(34)23-10-11-26(22-9-7-6-8-21(22)23)40-17-14-33-12-15-39-16-13-33/h6-11,18-19,32H,12-17H2,1-5H3,(H,31,35)

HIDE SMILES / InChI

Molecular Formula C30H37N3O7S
Molecular Weight 583.696
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

ITX-5061, an arylketoamide derivative, is a scavenger receptor B1 antagonist and a potent hepatitis C virus (HCV) entry inhibitor. It entered phase I clinical trial in liver transplant recipients with HCV but the trial was terminated.

Approval Year

PubMed

PubMed

TitleDatePubMed
Increased HDL cholesterol and apoA-I in humans and mice treated with a novel SR-BI inhibitor.
2009 Dec
Targeting HCV entry for development of therapeutics.
2010 Aug
Small molecule scavenger receptor BI antagonists are potent HCV entry inhibitors.
2011 Jan
Evaluation of ITX 5061, a scavenger receptor B1 antagonist: resistance selection and activity in combination with other hepatitis C virus antivirals.
2012 Feb 15

Sample Use Guides

150 mg/day by mouth for 3, 14, or 28 days.
Route of Administration: Oral
Substance Class Chemical
Created
by admin
on Sat Dec 16 03:22:54 GMT 2023
Edited
by admin
on Sat Dec 16 03:22:54 GMT 2023
Record UNII
RDD1D7O9YX
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
ITX-5061 FREE BASE
Common Name English
ITX 5061 FREE BASE
Code English
1-NAPHTHALENEACETAMIDE, N-(5-(1,1-DIMETHYLETHYL)-2-METHOXY-3-((METHYLSULFONYL)AMINO)PHENYL)-4-(2-(4-MORPHOLINYL)ETHOXY)-.ALPHA.-OXO-
Systematic Name English
KC-706 FREE BASE
Code English
Code System Code Type Description
CAS
848144-15-0
Created by admin on Sat Dec 16 03:22:54 GMT 2023 , Edited by admin on Sat Dec 16 03:22:54 GMT 2023
PRIMARY
PUBCHEM
11786594
Created by admin on Sat Dec 16 03:22:54 GMT 2023 , Edited by admin on Sat Dec 16 03:22:54 GMT 2023
PRIMARY
FDA UNII
RDD1D7O9YX
Created by admin on Sat Dec 16 03:22:54 GMT 2023 , Edited by admin on Sat Dec 16 03:22:54 GMT 2023
PRIMARY
EPA CompTox
DTXSID00233876
Created by admin on Sat Dec 16 03:22:54 GMT 2023 , Edited by admin on Sat Dec 16 03:22:54 GMT 2023
PRIMARY
Related Record Type Details
SALT/SOLVATE -> PARENT
TARGET -> INHIBITOR
Related Record Type Details
ACTIVE MOIETY