camostat

Ligand id: 6432

Name: camostat

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 8
Hydrogen bond donors 2
Rotatable bonds 10
Topological polar surface area 137.31
Molecular weight 398.16
XLogP 2.41
No. Lipinski's rules broken 0

Molecular properties generated using the CDK

Classification
Compound class Synthetic organic
Approved drug? Yes
IUPAC Name
[4-[2-(2-dimethylamino-2-oxoethoxy)-2-oxoethyl]phenyl] 4-(diaminomethylideneamino)benzoate
International Nonproprietary Names
INN number INN
5068 camostat
Synonyms
ONO-3403
Database Links
CAS Registry No. 59721-28-7
ChEMBL Ligand CHEMBL590799
PubChem CID 2536
Search Google for chemical match using the InChIKey XASIMHXSUQUHLV-UHFFFAOYSA-N
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Wikipedia Camostat
Comments
Publications and data are also linked to the camostat mesilate salt (PubChem CID 5284360). There is an active metabolite reported as FOY 251 but this also mapped to the mesylate salt , PubChem CID 130394., with the parent compound being PubChem CID 130395