secobarbital (seconal) Report issue

Small molecule Approved FDA
ChEMBL DrugBank Drug Central Drugs@FDA KEGG MeSH PubChem repoDB

Back

Chemistry

Mol. Mass

238.29

ALogP

1.35

Rule of 5

Yes

Rule of 3

No
Details
  • SMILES: CCCC(C)C1(CC=C)C(=O)NC(=O)NC1=O
  • InChIKey: KQPKPCNLIDLUMF-UHFFFAOYSA-N
    InChI=1S/C12H18N2O3/c1-4-6-8(3)12(7-5-2)9(15)13-11(17)14-10(12)16/h5,8H,2,4,6-7H2,1,3H3,(H2,13,14,15,16,17)
  • Chirality: Racemic Mixture
  • Inorganic: No
  • Polymer: No

Sources

CHEMBL447   ChEMBL
secobarbital *

CHEMBL1200903   ChEMBL
secobarbital sodium

XBP604F6UM   NCATS
secobarbital sodium *

Secobarbital   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