EcoDrugPlus


Synonyms	Ticarcillin
Status
Molecule Category	Free-form
ATC	J01CA13
UNII	F93UJX4SWT
EPA CompTox	DTXSID0023668


InChI Key	OHKOGUYZJXTSFX-KZFFXBSXSA-N
Smiles	CC1(C)S[C@@H]2[C@H](NC(=O)[C@H](C(=O)O)c3ccsc3)C(=O)N2[C@H]1C(=O)O
InChI	InChI=1S/C15H16N2O6S2/c1-15(2)9(14(22)23)17-11(19)8(12(17)25-15)16-10(18)7(13(20)21)6-3-4-24-5-6/h3-5,7-9,12H,1-2H3,(H,16,18)(H,20,21)(H,22,23)/t7-,8-,9+,12-/m1/s1

Property Name	Value
Molecular Formula	C15H16N2O6S2
Molecular Weight	384.44
AlogP	0.55
Hydrogen Bond Acceptor	6.0
Hydrogen Bond Donor	3.0
Number of Rotational Bond	5.0
Polar Surface Area	124.01
Molecular species	ACID
Aromatic Rings	1.0
Heavy Atoms	25.0

Resources	Reference
ChEBI	9587
ChEMBL	CHEMBL1449
DrugBank	DB01607
DrugCentral	2656
FDA SRS	F93UJX4SWT
Human Metabolome Database	HMDB0015545
Guide to Pharmacology	10928
KEGG	C07139
PharmGKB	PA451684
PubChem	36921
SureChEMBL	SCHEMBL34025
ZINC	ZINC000003831540

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

TICARCILLIN

Structure

Physicochemical Descriptors

Related Entries

Cross References