DANTROLENE Next Previous

ChEMBL ID CHEMBL1201288
PubChem CID 6914273
DrugBank Accession Number
ClinicalTrials DANTROLENE
Molecular Formula C14H10N4O5
Inchikey OZOMQRBLCMDCEG-VIZOYTHASA-N

Smiles
[O-][N+](=O)c1ccc(cc1)c2oc(\C=N\N3CC(=O)NC3=O)cc2

Synonyms
F-368, SID26756482, Dantrolene, Dantamacrin, SID26756773, Dantrium, DantroleneNa

Libraries
O'Brien, ScreenWell

Compound Properties
Drug/Drug-like Properties
Known Drug
Medchem Alerts
Passes of Rule of 3
Rule of 5 Violations 0
Molecular Species ZWITTERION
Molecular Properties
Molecular Weight 314.25
Rotatable Bonds 4
Acidic pKa (ACD) 4.24
Basic pKa (ACD) 9.91
LogP (ACD) 0.71
LogD (ACD) -1.79
ALogP 1.79
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