VELIFLAPON

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Search structure


Synonyms	BAY X 1005 BAY-X-005 BAY-X-1005 DG-031 Veliflapon
Status
Molecule Category	Free-form
UNII	JXH6X663L0
EPA CompTox	DTXSID60155843

Structure


InChI Key	ZEYYDOLCHFETHQ-JOCHJYFZSA-N
Smiles	O=C(O)[C@@H](c1ccc(OCc2ccc3ccccc3n2)cc1)C1CCCC1
InChI	InChI=1S/C23H23NO3/c25-23(26)22(17-6-1-2-7-17)18-10-13-20(14-11-18)27-15-19-12-9-16-5-3-4-8-21(16)24-19/h3-5,8-14,17,22H,1-2,6-7,15H2,(H,25,26)/t22-/m1/s1

Physicochemical Descriptors

Property Name	Value
Molecular Formula	C23H23NO3
Molecular Weight	361.44
AlogP	5.17
Hydrogen Bond Acceptor	3.0
Hydrogen Bond Donor	1.0
Number of Rotational Bond	6.0
Polar Surface Area	59.42
Molecular species	ACID
Aromatic Rings	3.0
Heavy Atoms	27.0

Pharmacology

Mechanism of Action	Action	Reference
5-lipoxygenase activating protein inhibitor	INHIBITOR	PubMed

Targets	EC50(nM)	IC50(nM)	Kd(nM)	Ki(nM)	Inhibition(%)
Enzyme Oxidoreductase	-	60	-	-	-

	EC50(nM)	IC50(nM)	Kd(nM)	Ki(nM)	Inhibition(%)
Homo sapiens	-	220	-	-	-
Rattus norvegicus	-	26	-	-	-

Target Conservation


Protein: 5-lipoxygenase activating protein Description: Arachidonate 5-lipoxygenase-activating protein Organism : Homo sapiens P20292 ENSG00000132965

Cross References

Resources	Reference
ChEMBL	CHEMBL88712
DrugBank	DB16346
FDA SRS	JXH6X663L0
Guide to Pharmacology	5148
PDB	QY1
PubChem	123723
SureChEMBL	SCHEMBL1004174
ZINC	ZINC000000598193

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