Compound Detail

CHEMBL271674

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O=C1NC(=S)NC(=O)C1=Cc1ccc(O)cc1

ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID	CHEMBL271674
Phase	Preclinical
Structure Type	MOL
InChI Key	DLIHQVDPAHPETM-UHFFFAOYSA-N

Targets

Activities

Assay Types

PK Parameters

Publications

Known Names

248.3

MW (Da)

0.31

ALogP

HBA

HBD

78.4

PSA (Å²)

0.38

QED

Ro5 Violations

Rot. Bonds

First in Class Prodrug

IC50 2 meas. best 4.84

Target	Type	Best pChEMBL	Mean pChEMBL	Best (nM)	# Data
Tyrosinase CHEMBL3318	IC50	4.84	4.84	14490.0	2

Top measurements by pChEMBL value

Target	Type	Rel.	Value	Units	pChEMBL	Assay	PubMed
Tyrosinase	IC50	=	14490.0	nM	4.84	Inhibition of mushroom tyrosinase	19552984
Tyrosinase	IC50	=	14490.0	nM	4.84	Inhibition of mushroom tyrosinase diphenolase activity using L-DOPA as substrate...	24857777

PubMed	DOI	Target Context	# Activities
19552984	10.1016/j.ejmech.2009.05.023	Tyrosinase	2
18343108	10.1016/j.bmcl.2008.02.066	Unchecked	1
18343108	10.1016/j.bmcl.2008.02.066	Methionine aminopeptidase 1	1
19552984	10.1016/j.ejmech.2009.05.023	Staphylococcus aureus	1
19552984	10.1016/j.ejmech.2009.05.023	Staphylococcus epidermidis	1
19552984	10.1016/j.ejmech.2009.05.023	Staphylococcus	1
19552984	10.1016/j.ejmech.2009.05.023	Bacillus cereus	1
19552984	10.1016/j.ejmech.2009.05.023	Escherichia coli	1
19552984	10.1016/j.ejmech.2009.05.023	Pseudomonas aeruginosa	1
19904929	10.1021/jm901183d	RAW264.7	1
24857777	10.1016/j.bmc.2014.04.060	Tyrosinase	1

Data from ChEMBL 36 via Core Engine