JNJ-42165279

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Search structure


Synonyms	Jnj-42165279
Status
Molecule Category	Free-form
UNII	AH2E5UQ11Y

Structure


InChI Key	YWGYNGCRVZLMCS-UHFFFAOYSA-N
Smiles	O=C(Nc1cnccc1Cl)N1CCN(Cc2ccc3c(c2)OC(F)(F)O3)CC1
InChI	InChI=1S/C18H17ClF2N4O3/c19-13-3-4-22-10-14(13)23-17(26)25-7-5-24(6-8-25)11-12-1-2-15-16(9-12)28-18(20,21)27-15/h1-4,9-10H,5-8,11H2,(H,23,26)

Physicochemical Descriptors

Property Name	Value
Molecular Formula	C18H17ClF2N4O3
Molecular Weight	410.81
AlogP	3.41
Hydrogen Bond Acceptor	5.0
Hydrogen Bond Donor	1.0
Number of Rotational Bond	3.0
Polar Surface Area	66.93
Molecular species	NEUTRAL
Aromatic Rings	2.0
Heavy Atoms	28.0

Pharmacology

Mechanism of Action	Action	Reference
Anandamide amidohydrolase inhibitor	INHIBITOR	PubMed PubMed PubMed

Target Conservation


Protein: Anandamide amidohydrolase Description: Fatty-acid amide hydrolase 1 Organism : Homo sapiens O00519 ENSG00000117480

Cross References

Resources	Reference
ChEMBL	CHEMBL4297294
DrugBank	DB15173
FDA SRS	AH2E5UQ11Y
Guide to Pharmacology	9012
PubChem	54576693
SureChEMBL	SCHEMBL2585102
ZINC	ZINC000168658420

CONTENTS

EcoDrug+ was developed under the PREMIER Innovative Medicines Initiative 2 Joint Undertaking (JU) under grant agreement No 875508. The JU receives support from the EU’s Horizon 2020 research and innovation programme and the European Federation of Pharmaceutical Industries and Associations (EFPIA). The views reflect only the authors’ perspective and the JU is not responsible for any use that may be made of the information EcoDrug+ contains.

Elements of EcoDrug+ were developed under the Biocenter Finland Drug Discovery and Chemical Biology network. CSC-IT Center for Science Ltd is thanked for providing computational resources. Credit is given to Ensembl for collecting species images (provided under public domain licences such as Wikimedia and NHGRI).

Content of EcoDrug+ is provided without guarantee for correctness.

Cite Us:

Ashenafi Legehar, Siobhán Monaghan, Mael Briand, Akseli Niemelä, Leo Ghemtio, Ziaurrehman Tanoli, A Ross Brown, Charles R Tyler, Henri Xhaard, EcoDrug PLUS: an advanced database for drug target conservation analysis and environmental risk assessment, Nucleic Acids Research, 2025, gkaf1251 Read...

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Last update: Monday, 3 November 2025