CARBARIL

Search structure
Synonyms:
Status: Approved
Entry Type: Small molecule
Molecule Category: UNKNOWN
UNII: R890C8J3N1

Structure
InChI Key CVXBEEMKQHEXEN-UHFFFAOYSA-N
Smile CNC(=O)Oc1cccc2ccccc12
InChI
InChI=1S/C12H11NO2/c1-13-12(14)15-11-8-4-6-9-5-2-3-7-10(9)11/h2-8H,1H3,(H,13,14)

Physicochemical Descriptors

Property Name Value
Molecular Formula C12H11NO2
Molecular Weight 201.22
AlogP 2.56
Hydrogen Bond Acceptor 2.0
Hydrogen Bond Donor 1.0
Number of Rotational Bond 1.0
Polar Surface Area 38.33
Molecular species NEUTRAL
Aromatic Rings 2.0
Heavy Atoms 15.0

Pharmacology

Action Mechanism of Action Reference
INHIBITOR Acetylcholinesterase inhibitor PubMed PubMed
Targets EC50(nM) IC50(nM) Kd(nM) Ki(nM) Inhibition(%)
Enzyme Hydrolase
- 48-310 - - 49
Enzyme
- 48-310 - - 49

Related Entries

Scaffolds

Cross References

Resources Reference
ChEBI 3390
ChEMBL CHEMBL46917
DrugBank DB15930
DrugCentral 3066
EPA CompTox DTXSID9020247
FDA SRS R890C8J3N1
KEGG C07491
PubChem 6129
SureChEMBL SCHEMBL26737
ZINC ZINC000000001090
CONTENTS