EcoDrugPlus


Synonyms	Bbske Compound eb Ethaselen Ethaselen-1 Shuang-xi-zuo-wan-1
Status
Molecule Category	Free-form
UNII	4Q2EZS1IWG

Synonyms

Bbske

Compound eb

Ethaselen

Ethaselen-1

Shuang-xi-zuo-wan-1

Status

Molecule Category

Free-form

UNII

4Q2EZS1IWG


InChI Key	SFFSGPCYJCMDJM-UHFFFAOYSA-N
Smiles	O=c1c2ccccc2[se]n1CCn1[se]c2ccccc2c1=O
InChI	InChI=1S/C16H12N2O2Se2/c19-15-11-5-1-3-7-13(11)21-17(15)9-10-18-16(20)12-6-2-4-8-14(12)22-18/h1-8H,9-10H2

InChI Key

SFFSGPCYJCMDJM-UHFFFAOYSA-N

Smiles

O=c1c2ccccc2[se]n1CCn1[se]c2ccccc2c1=O

InChI

InChI=1S/C16H12N2O2Se2/c19-15-11-5-1-3-7-13(11)21-17(15)9-10-18-16(20)12-6-2-4-8-14(12)22-18/h1-8H,9-10H2

Property Name	Value
Molecular Formula	C16H12N2O2Se2
Molecular Weight	422.2

Property Name

Value

Molecular Formula

C16H12N2O2Se2

Molecular Weight

422.2

Targets	EC50(nM)	IC50(nM)	Kd(nM)	Ki(nM)	Inhibition(%)
Enzyme Oxidoreductase	-	350	-	-	-

Targets

EC50(nM)

IC50(nM)

Kd(nM)

Ki(nM)

Inhibition(%)

Enzyme Oxidoreductase

350

	EC50(nM)	IC50(nM)	Kd(nM)	Ki(nM)	Inhibition(%)
Rattus norvegicus	-	350	-	-	-

EC50(nM)

IC50(nM)

Kd(nM)

Ki(nM)

Inhibition(%)

Rattus norvegicus

350

Resources	Reference
ChEMBL	CHEMBL2035460
DrugBank	DB15051
FDA SRS	4Q2EZS1IWG
PubChem	10387485
SureChEMBL	SCHEMBL3561403

Resources

Reference

ChEMBL

DrugBank

FDA SRS

PubChem

SureChEMBL

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

ETHASELEN

Structure

Physicochemical Descriptors

Pharmacology

Cross References