DABIGATRAN Next Previous

ChEMBL ID CHEMBL48361
PubChem CID 216210
DrugBank Accession Number
ClinicalTrials DABIGATRAN
Molecular Formula C25H25N7O3
Inchikey YBSJFWOBGCMAKL-UHFFFAOYSA-N

Smiles
Cn1c(CNc2ccc(cc2)C(=N)N)nc3cc(ccc13)C(=O)N(CCC(=O)O)c4ccccn4

Synonyms
BIBR 953 ZW, BIBR-953, DABIGATRAN, Dabigatran, PRADAXA

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 471.51
Rotatable Bonds 9
Acidic pKa (ACD) 4.17
Basic pKa (ACD) 12.62
LogP (ACD) 1.02
LogD (ACD) -1.48
ALogP 2.3
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