General
Preferred name
DABIGATRAN ETEXILATE MESYLATE
Synonyms
Dabigatran etexilate (mesylate) ()
Pradaxa ()
BIBR 1048MS ()
Dabigatran etexilate methanesulfonate ()
Pradaxa, BIBR 1048MS, Dabigatran etexilate methanesulfonate ()
BIBR 1048 MS ()
BIBR-1048-MS ()
Dabigatran etexilate mesilate ()
P&D ID
PD000818
CAS
593282-20-3
872728-81-9
Tags
prodrug
natural product
drug
available
Drug indication
Stroke
Drug Status
approved
Max Phase
Phase 4
First approval
2010
Probe control
Probe control not defined
Orthogonal probes
0
No orthogonal probes found
Similar probes
0
No structurally similar probes found
Structure
P&D probe-likeness score
Structure formats
[[ format ]]
[[ compound[format === 'MOL' ? 'molblock' : format.toLowerCase()] ]]
[[ p.pathway_name ]]
[[ compound.targets[tid].gene_name ]]
Compound Sets
9
AdooQ Bioactive Compound Library
Cayman Chemical Bioactives
ChEMBL Approved Drugs
ChEMBL Drugs
DrugMAP
EU-OPENSCREEN Bioactive Compound Library
MedChem Express Bioactive Compound Library
Selleckchem Bioactive Compound Library
The Spectrum Collection
[[ a.name ]]
[[ ligand_id ]]
free of charge
External IDs
21
Properties
(calculated by RDKit )
Molecular Weight
723.31
Hydrogen Bond Acceptors
11
Hydrogen Bond Donors
3
Rotatable Bonds
15
Ring Count
4
Aromatic Ring Count
4
cLogP
5.11
TPSA
208.4
Fraction CSP3
0.37
Chiral centers
0.0
Largest ring
6.0
QED
0.05
Structural alerts
0
No structural alerts detected
Related compounds
Custom attributes
(extracted from source data)
Pathway
Metabolic Enzyme/Protease
Target
Thrombin
Source data
