MINAPRINE

Search structure
Synonyms:
Status: Approved
Entry Type: Small molecule
Molecule Category: UNKNOWN
ATC: N06AX07
UNII: 00U7GX0NLM

Structure
InChI Key LDMWSLGGVTVJPG-UHFFFAOYSA-N
Smile Cc1cc(-c2ccccc2)nnc1NCCN1CCOCC1
InChI
InChI=1S/C17H22N4O/c1-14-13-16(15-5-3-2-4-6-15)19-20-17(14)18-7-8-21-9-11-22-12-10-21/h2-6,13H,7-12H2,1H3,(H,18,20)

Physicochemical Descriptors

Property Name Value
Molecular Formula C17H22N4O
Molecular Weight 298.39
AlogP 2.2
Hydrogen Bond Acceptor 5.0
Hydrogen Bond Donor 1.0
Number of Rotational Bond 5.0
Polar Surface Area 50.28
Molecular species NEUTRAL
Aromatic Rings 2.0
Heavy Atoms 22.0

Pharmacology

Action Mechanism of Action Reference
INHIBITOR Acetylcholinesterase inhibitor PubMed PubMed PubMed PubMed PubMed PubMed PubMed PubMed PubMed PubMed
Targets EC50(nM) IC50(nM) Kd(nM) Ki(nM) Inhibition(%)
Enzyme Hydrolase
- 85000 - - -
Enzyme Oxidoreductase
- - - - 12-18
Membrane receptor Family A G protein-coupled receptor Small molecule receptor (family A GPCR) Monoamine receptor Acetylcholine receptor
- 17000 - 17000 -

Indications

Mesh Heading Maximum Phase Mesh ID Reference

Related Entries

Scaffolds

Cross References

Resources Reference
ChEBI 51038
ChEMBL CHEMBL278819
DrugBank DB00805
DrugCentral 1812
EPA CompTox DTXSID5048477
FDA SRS 00U7GX0NLM
Human Metabolome Database HMDB0014943
PharmGKB PA164748351
PubChem 4199
SureChEMBL SCHEMBL49371
ZINC ZINC000019796082
CONTENTS