SITAXENTAN SODIUM Next Previous

ChEMBL ID CHEMBL2105740
PubChem CID 101185768
DrugBank Accession Number
ClinicalTrials SITAXENTAN SODIUM
Molecular Formula C18H14ClN2NaO6S2
Inchikey MDTNUYUCUYPIHE-UHFFFAOYSA-N

Smiles
[Na+].Cc1cc2OCOc2cc1CC(=O)c3sccc3S(=O)(=O)[N-]c4onc(C)c4Cl

Synonyms
SITAXENTAN SODIUM, SITAXSENTAN SODIUM, TBC-11251NA, TBC-11251Z, THELIN

Compound Properties
Drug/Drug-like Properties
Known Drug
Medchem Alerts None
Passes of Rule of 3
Rule of 5 Violations 0
Molecular Species ACID
Molecular Properties
Molecular Weight 476.9
Rotatable Bonds 6
Acidic pKa (ACD) 4.96
Basic pKa (ACD) -
LogP (ACD) 3.11
LogD (ACD) 1.25
ALogP 3.96
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