EcoDrugPlus


Synonyms	Fluindione Previscan Previsccan
Status
Molecule Category	Free-form
ATC	B01AA12
UNII	EQ35YMS20Q
EPA CompTox	DTXSID1046211


InChI Key	NASXCEITKQITLD-UHFFFAOYSA-N
Smiles	O=C1c2ccccc2C(=O)C1c1ccc(F)cc1
InChI	InChI=1S/C15H9FO2/c16-10-7-5-9(6-8-10)13-14(17)11-3-1-2-4-12(11)15(13)18/h1-8,13H

Property Name	Value
Molecular Formula	C15H9FO2
Molecular Weight	240.23
AlogP	2.99
Hydrogen Bond Acceptor	2.0
Number of Rotational Bond	1.0
Polar Surface Area	34.14
Molecular species	ACID
Aromatic Rings	2.0
Heavy Atoms	18.0

Resources	Reference
ChEBI	134975
ChEMBL	CHEMBL24924
DrugBank	DB13136
DrugCentral	1194
FDA SRS	EQ35YMS20Q
PubChem	68942
SureChEMBL	SCHEMBL309362
ZINC	ZINC000100091724

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...

This work is licensed under Creative Commons Attribution-ShareAlike 4.0 International License

Last update: Monday, 3 November 2025

FLUINDIONE

Structure

Physicochemical Descriptors

Related Entries

Cross References