CYCLOBARBITAL

Search structure
Synonyms:
Status: Approved
Entry Type: Small molecule
Molecule Category: UNKNOWN
ATC: N05CA10
UNII: 0M8A98AD9H

Structure
InChI Key WTYGAUXICFETTC-UHFFFAOYSA-N
Smile CCC1(C2=CCCCC2)C(=O)NC(=O)NC1=O
InChI
InChI=1S/C12H16N2O3/c1-2-12(8-6-4-3-5-7-8)9(15)13-11(17)14-10(12)16/h6H,2-5,7H2,1H3,(H2,13,14,15,16,17)

Physicochemical Descriptors

Property Name Value
Molecular Formula C12H16N2O3
Molecular Weight 236.27
AlogP 1.25
Hydrogen Bond Acceptor 3.0
Hydrogen Bond Donor 2.0
Number of Rotational Bond 2.0
Polar Surface Area 75.27
Molecular species NEUTRAL
Aromatic Rings 0.0
Heavy Atoms 17.0

Related Entries

Scaffolds

Cross References

Resources Reference
ChEBI 134957
ChEMBL CHEMBL268164
DrugBank DB13737
DrugCentral 750
EPA CompTox DTXSID9022865
FDA SRS 0M8A98AD9H
PubChem 5838
SureChEMBL SCHEMBL157224
ZINC ZINC000005651565
CONTENTS