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Compound Detail

CHEMBL476186

ERIBAXABAN
🧪 Phase II
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🧪 Phase II
CO[C@@H]1C[C@H](C(=O)Nc2ccc(-n3ccccc3=O)cc2F)N(C(=O)Nc2ccc(Cl)cc2)C1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL476186
Name ERIBAXABAN
Phase Phase II
Structure Type MOL
InChI Key QQBKAVAGLMGMHI-WIYYLYMNSA-N

Known Names

292 Eribaxaban PD 348 PD 348,292 PD-0348292 PD-348 PD-348292
1
Targets
2
Activities
1
Assay Types
8
PK Parameters
9
Publications
7
Known Names

Molecular Properties

484.9
MW (Da)
3.89
ALogP
5
HBA
2
HBD
92.7
PSA (Ų)
0.57
QED
0
Ro5 Violations
5
Rot. Bonds

Drug Information

Molecule Type Small molecule
Chirality Single Enantiomer
USAN Stem -xaban
USAN Year 2007

Extended Properties

Molecular Formula C24H22ClFN4O4
MW 484.92
Aromatic Rings 3
Heavy Atoms 34
NP-Likeness -1.71

Activity Summary

IC50 2 meas. best 9.49

Target Activity Profile

Target Type Best pChEMBL Mean pChEMBL Best (nM) # Data
Coagulation factor X
CHEMBL244
 IC50 9.49 9.365 0.3 2

Pharmacokinetic Data

Parameter Value Units Species
CL 12.0 mL.min-1.kg-1 Rattus norvegicus
CL 2.5 mL.min-1.kg-1 Canis lupus familiaris
F 41.0 % Canis lupus familiaris
F 82.0 % Rattus norvegicus
T1/2 2.0 hr Rattus norvegicus
T1/2 2.6 hr Rattus norvegicus
T1/2 4.9 hr Canis lupus familiaris
T1/2 4.9 hr Canis lupus familiaris

Activity Data Samples

Top measurements by pChEMBL value

Target Type Rel. Value Units pChEMBL Assay PubMed
Coagulation factor X IC50 = 0.32 nM 9.49 Inhibition of factor 10a 20503967
Coagulation factor X IC50 = 0.57 nM 9.24 Inhibition of human Factor-10a 19231206

Literature References

PubMed DOI Target Context # Activities
19231206 10.1016/j.bmc.2009.01.063 Rattus norvegicus 4
20503967 10.1021/jm100146h Canis familiaris 4
20503967 10.1021/jm100146h Oryctolagus cuniculus 2
19231206 10.1016/j.bmc.2009.01.063 Coagulation factor X 1
19231206 10.1016/j.bmc.2009.01.063 Plasma 1
19231206 10.1016/j.bmc.2009.01.063 Canis familiaris 1
20503967 10.1021/jm100146h Coagulation factor X 1
20503967 10.1021/jm100146h NON-PROTEIN TARGET 1
20503967 10.1021/jm100146h Rattus norvegicus 1

Data from ChEMBL 36 via Core Engine