Compound Detail

CHEMBL182783

GVNACSSLF

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CC(C)C[C@H](NC(=O)[C@H](CO)NC(=O)[C@H](CO)NC(=O)[C@H](CS)NC(=O)[C@H](C)NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H](NC(=O)CN)C(C)C)C(=O)N[C@@H](Cc1ccccc1)C(=O)O

ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID	CHEMBL182783
Name	GVNACSSLF
Phase	Preclinical
Structure Type	BOTH
InChI Key	QRAZOUJGIUABSI-NWHYMTRRSA-N

Targets

Activities

Assay Types

PK Parameters

Publications

Known Names

897.0

MW (Da)

-5.34

ALogP

HBA

HBD

379.7

PSA (Å²)

0.04

QED

Ro5 Violations

Rot. Bonds

First in Class Prodrug

IC50 3 meas. best 9.0

EC50 1 meas. best 8.44

Target	Type	Best pChEMBL	Mean pChEMBL	Best (nM)	# Data
Receptor-histidine kinase AgrC CHEMBL4726	IC50	9.0	8.2033	1.0	3
Receptor-histidine kinase AgrC CHEMBL4726	EC50	8.44	8.44	3.6	1

Top measurements by pChEMBL value

Target	Type	Rel.	Value	Units	pChEMBL	Assay	PubMed
Receptor-histidine kinase AgrC	IC50	=	1.0	nM	9.0	Concentration required to antagonise accessory gene regulator C3 of Staphylococc...	15341477
Receptor-histidine kinase AgrC	IC50	=	2.9	nM	8.54	Antagonistic concentration for accessory gene regulator C1 of Staphylococcus aur...	15341477
Receptor-histidine kinase AgrC	EC50	=	3.6	nM	8.44	Effective concentration to antagonise accessory gene regulator C2 of Staphylococ...	15341477
Receptor-histidine kinase AgrC	IC50	=	86.0	nM	7.07	Concentration required to antagonise accessory gene regulator C4 of Staphylococc...	15341477

PubMed	DOI	Target Context	# Activities
15341477	10.1021/jm0400754	Receptor-histidine kinase AgrC	4

Data from ChEMBL 36 via Core Engine