SQ-24,798

Ligand id: 8656

Name: SQ-24,798

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 5
Hydrogen bond donors 3
Rotatable bonds 6
Topological polar surface area 140.5
Molecular weight 205.09
XLogP -0.05
No. Lipinski's rules broken 0

Molecular properties generated using the CDK

Classification
Compound class Synthetic organic
IUPAC Name
5-(diaminomethylideneamino)-2-(sulfanylmethyl)pentanoic acid
Synonyms
compound 4 [1] | SQ 24798 | SQ-24798
Database Links
CAS Registry No. 70873-80-2 (source: Scifinder)
ChEMBL Ligand CHEMBL236822
PubChem CID 194328
Search Google for chemical match using the InChIKey JOVIPJZDTSYNNW-UHFFFAOYSA-N
Search Google for chemicals with the same backbone JOVIPJZDTSYNNW
Search UniChem for chemical match using the InChIKey JOVIPJZDTSYNNW-UHFFFAOYSA-N
Search UniChem for chemicals with the same backbone JOVIPJZDTSYNNW
Comments
The discovery of SQ-24,798 is reported in [1], where it is shown to inhibit both the thrombin-activatable fibrinolysis inhibitor (TAFI, CPB2) and carboxypeptidase N (CPN).