EcoDrugPlus


Synonyms	2-fluorofucose Sgn-2ff
Status
Molecule Category	Free-form
UNII	W39886N0ZG
EPA CompTox	DTXSID60991021

Synonyms

2-fluorofucose

Sgn-2ff

Status

Molecule Category

Free-form

UNII

W39886N0ZG

EPA CompTox

DTXSID60991021


InChI Key	SQTFKIKSQNCWGJ-KCDKBNATSA-N
Smiles	C[C@H](O)[C@@H](O)[C@@H](O)[C@H](F)C=O
InChI	InChI=1S/C6H11FO4/c1-3(9)5(10)6(11)4(7)2-8/h2-6,9-11H,1H3/t3-,4+,5+,6-/m0/s1

InChI Key

SQTFKIKSQNCWGJ-KCDKBNATSA-N

Smiles

C[C@H](O)[C@@H](O)[C@@H](O)[C@H](F)C=O

InChI

InChI=1S/C6H11FO4/c1-3(9)5(10)6(11)4(7)2-8/h2-6,9-11H,1H3/t3-,4+,5+,6-/m0/s1

Property Name	Value
Molecular Formula	C6H11FO4
Molecular Weight	166.15
AlogP	-1.37
Hydrogen Bond Acceptor	4.0
Hydrogen Bond Donor	3.0
Number of Rotational Bond	4.0
Polar Surface Area	77.76
Molecular species	NEUTRAL
Aromatic Rings	0.0
Heavy Atoms	11.0

Property Name

Value

Molecular Formula

C6H11FO4

Molecular Weight

166.15

AlogP

-1.37

Hydrogen Bond Acceptor

4.0

Hydrogen Bond Donor

3.0

Number of Rotational Bond

4.0

Polar Surface Area

77.76

Molecular species

NEUTRAL

Aromatic Rings

0.0

Heavy Atoms

11.0

Resources	Reference
CAS NUMBER	70763-62-1
ChEMBL	CHEMBL4297429
DrugBank	DB15302
FDA SRS	W39886N0ZG
PubChem	125766
SureChEMBL	SCHEMBL8578272
ZINC	ZINC000006030222

Resources

Reference

CAS NUMBER

ChEMBL

DrugBank

FDA SRS

PubChem

SureChEMBL

ZINC

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, Volume 54, Issue D1, 6 January 2026, Pages D1397–D1404, https://doi.org/10.1093/nar/gkaf1251

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

Last update: Monday, 27^th July 2026

2-FLUOROFUCOSE

Structure

Physicochemical Descriptors

Cross References