EcoDrugPlus


Synonyms	Disalcid Disalicyclic acid NSC-49171 Salicylsalicylic acid Salsalate Sasapyrine
Status
Molecule Category	Free-form
ATC	N02BA06
UNII	V9MO595C9I
EPA CompTox	DTXSID1023572


InChI Key	WVYADZUPLLSGPU-UHFFFAOYSA-N
Smiles	O=C(Oc1ccccc1C(=O)O)c1ccccc1O
InChI	InChI=1S/C14H10O5/c15-11-7-3-1-5-9(11)14(18)19-12-8-4-2-6-10(12)13(16)17/h1-8,15H,(H,16,17)

Property Name	Value
Molecular Formula	C14H10O5
Molecular Weight	258.23
AlogP	2.31
Hydrogen Bond Acceptor	4.0
Hydrogen Bond Donor	2.0
Number of Rotational Bond	3.0
Polar Surface Area	83.83
Molecular species	ACID
Aromatic Rings	2.0
Heavy Atoms	19.0

Resources	Reference
ChEBI	9014
ChEMBL	CHEMBL154111
DrugBank	DB01399
DrugCentral	2420
FDA SRS	V9MO595C9I
Human Metabolome Database	HMDB0015471
PharmGKB	PA164745462
PubChem	5161
SureChEMBL	SCHEMBL15562
ZINC	ZINC000000002062

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

SALSALATE

Structure

Physicochemical Descriptors

Related Entries

Cross References