Compound Detail

CHEMBL5763146

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CN1C(=O)C(NC(=O)c2cc(Cc3ccccc3)on2)CC(F)c2ccccc21

ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID	CHEMBL5763146
Phase	Preclinical
Structure Type	MOL
InChI Key	KUOTXTYJDGYCAZ-UHFFFAOYSA-N

Targets

Activities

Assay Types

PK Parameters

Publications

Known Names

393.4

MW (Da)

3.44

ALogP

HBA

HBD

75.4

PSA (Å²)

0.74

QED

Ro5 Violations

Rot. Bonds

Availability	Unknown
Chirality	Unknown

First in Class Prodrug

IC50 7 meas. best 6.3

Target	Type	Best pChEMBL	Mean pChEMBL	Best (nM)	# Data
Receptor-interacting serine/threonine-protein kinase 1 CHEMBL5464	IC50	6.3	6.3	500.0	7

Top measurements by pChEMBL value

Target	Type	Rel.	Value	Units	pChEMBL	Assay	PubMed
Receptor-interacting serine/threonine-protein kinase 1	IC50	=	500.0	nM	6.3	Fluorescent Polarization Binding (FP Binding) assay: Assay was performed in poly...	-
Receptor-interacting serine/threonine-protein kinase 1	IC50	=	500.0	nM	6.3	FP Binding assay: ollowing this reaction, 10 uL of ADP-Glo reagent (Promega) was...	-
Receptor-interacting serine/threonine-protein kinase 1	IC50	=	500.0	nM	6.3	Fluorescent Polarization Binding (FP Binding) assay: Assay was performed in poly...	-
Receptor-interacting serine/threonine-protein kinase 1	IC50	=	500.0	nM	6.3	Fluorescent Polarization Binding (FP Binding) assay: Assay was performed in poly...	-
Receptor-interacting serine/threonine-protein kinase 1	IC50	=	500.0	nM	6.3	Fluorescent Polarization Binding (FP Binding) assay: Test compounds were diluted...	-
Receptor-interacting serine/threonine-protein kinase 1	IC50	=	500.0	nM	6.3	Fluorescent Polarization Binding (FP Binding) assay: Test compounds were diluted...	-
Receptor-interacting serine/threonine-protein kinase 1	IC50	=	500.0	nM	6.3	Fluorescent Polarization Binding (FP Binding) assay: Test compounds were diluted...	-

Data from ChEMBL 36 via Core Engine