NEFIRACETAM

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Synonyms
Status
Molecule Category Free-form
UNII 1JK12GX30N
EPA CompTox DTXSID2020923

Structure

InChI Key NGHTXZCKLWZPGK-UHFFFAOYSA-N
Smiles Cc1cccc(C)c1NC(=O)CN1CCCC1=O
InChI
InChI=1S/C14H18N2O2/c1-10-5-3-6-11(2)14(10)15-12(17)9-16-8-4-7-13(16)18/h3,5-6H,4,7-9H2,1-2H3,(H,15,17)

Physicochemical Descriptors

Property Name Value
Molecular Formula C14H18N2O2
Molecular Weight 246.31
AlogP 1.86
Hydrogen Bond Acceptor 2.0
Hydrogen Bond Donor 1.0
Number of Rotational Bond 3.0
Polar Surface Area 49.41
Molecular species NEUTRAL
Aromatic Rings 1.0
Heavy Atoms 18.0

Pharmacology

Targets EC50(nM) IC50(nM) Kd(nM) Ki(nM) Inhibition(%)
Enzyme Hydrolase
- - - -
EC50(nM) IC50(nM) Kd(nM) Ki(nM) Inhibition(%)
Homo sapiens
- - - -

Related Entries

Cross References

Resources Reference
ChEBI 135004
ChEMBL CHEMBL260829
DrugBank DB13082
DrugCentral 3376
FDA SRS 1JK12GX30N
PubChem 71157
SureChEMBL SCHEMBL135856
ZINC ZINC000000003788
CONTENTS