methylphenobarbital Report issue

Small molecule Experimental
ChEMBL DrugBank Drug Central KEGG MeSH PubChem repoDB

Back

Chemistry

Mol. Mass

246.2619

ALogP

1.04

Rule of 5

Yes

Rule of 3

No
Details
  • SMILES: CCC1(C(=O)NC(=O)N(C)C1=O)C2=CC=CC=C2
  • InChIKey: ALARQZQTBTVLJV-UHFFFAOYSA-N
    1S/C13H14N2O3/c1-3-13(9-7-5-4-6-8-9)10(16)14-12(18)15(2)11(13)17/h4-8H,3H2,1-2H3,(H,14,16,18)
  • Chirality: Racemic Mixture
  • Inorganic: No
  • Polymer: No

Sources

CHEMBL45029   ChEMBL
mephobarbital

5NC67NU76B   NCATS
mephobarbital *

Methylphenobarbital   Wikipedia

Feedback

Data collection and curation is an ongoing process for CDEK - if you notice any information here to be missing or incorrect, please let us know! When possible, please include a source URL (we verify all data prior to inclusion).

Report issue