Compound Detail

CHEMBL3617114

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Cc1ccc(NC(=S)Nc2cccc(C(F)(F)F)c2)cc1Cl

ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID	CHEMBL3617114
Phase	Preclinical
Structure Type	MOL
InChI Key	JZPDSBSQQOXEIK-UHFFFAOYSA-N

Targets

Activities

Assay Types

PK Parameters

Publications

Known Names

344.8

MW (Da)

5.48

ALogP

HBA

HBD

24.1

PSA (Å²)

0.71

QED

Ro5 Violations

Rot. Bonds

First in Class Prodrug

PubMed	DOI	Target Context	# Activities
26119992	10.1016/j.ejmech.2015.06.027	Pseudomonas aeruginosa	3
26119992	10.1016/j.ejmech.2015.06.027	Escherichia coli	3
26119992	10.1016/j.ejmech.2015.06.027	Mycobacterium tuberculosis	3
26119992	10.1016/j.ejmech.2015.06.027	ADMET	3
26119992	10.1016/j.ejmech.2015.06.027	Candida albicans	2
26119992	10.1016/j.ejmech.2015.06.027	NON-PROTEIN TARGET	2
26119992	10.1016/j.ejmech.2015.06.027	Human alphaherpesvirus 1	1
26119992	10.1016/j.ejmech.2015.06.027	Vaccinia virus	1
26119992	10.1016/j.ejmech.2015.06.027	Vesicular stomatitis virus	1
26119992	10.1016/j.ejmech.2015.06.027	Rice stripe virus	1
26119992	10.1016/j.ejmech.2015.06.027	Poliovirus 1	1
26119992	10.1016/j.ejmech.2015.06.027	Coxsackievirus B5	1
26119992	10.1016/j.ejmech.2015.06.027	Yellow fever virus	1
26119992	10.1016/j.ejmech.2015.06.027	Human immunodeficiency virus 1	1
26119992	10.1016/j.ejmech.2015.06.027	MT4	1
26119992	10.1016/j.ejmech.2015.06.027	Candida parapsilosis	1
26119992	10.1016/j.ejmech.2015.06.027	Bordetella bronchiseptica	1

Data from ChEMBL 36 via Core Engine