dantrolene (dantrium) Report issue

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

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Chemistry

Mol. Mass

314.26

ALogP

1.74

Rule of 5

Yes

Rule of 3

No
Details
  • SMILES: [O-][N+](=O)c1ccc(cc1)c2oc(\C=N\N3CC(=O)NC3=O)cc2
  • InChIKey: OZOMQRBLCMDCEG-VIZOYTHASA-N
    InChI=1S/C14H10N4O5/c19-13-8-17(14(20)16-13)15-7-11-5-6-12(23-11)9-1-3-10(4-2-9)18(21)22/h1-7H,8H2,(H,16,19,20)/b15-7+
  • Chirality: Achiral Molecule
  • Inorganic: No
  • Polymer: No

Sources

CHEMBL1201288   ChEMBL
dantrolene *

CHEMBL928   ChEMBL
dantrolene sodium

F64QU97QCR   NCATS
dantrolene *

Dantrolene   Wikipedia

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