General
Preferred name
ARGATROBAN
Synonyms
MCI-9038 ()
MD-805 ()
Argipidine ()
ARGATROBAN ANHYDROUS ()
(3R/S)Argatroban H2O ()
Argatroban (monohydrate) ()
MD-805 (monohydrate) ()
MCI-9038 (monohydrate) ()
Argipidine (monohydrate) ()
Argatroban hydrate, Argipidine,MCI-9038 Monohydrate ()
(2R,4R)-4-methyl-1-[N2-(3-methyl-1,2,3,4-tetrahydro-8-quinolinesulfonyl)-L-arginyl]-2-piperidinecarb ()
Argatroban (MCI-9038) ()
Argatroban Monohydrate ()
GN-1600 ()
Argatroban monohydrate ()
Argatroban In Sodium Chloride ()
Gn1600 ()
Acova ()
Novastan ()
DK-7419 ()
Argatroban hydrate ()
Argatroban in dextrose ()
Argatroban-d3 (hydrochloride) ()
P&D ID
PD003142
CAS
74863-84-6
141396-28-3
121785-71-5
1356847-56-7
Tags
available
drug
Approved by
FDA
First approval
2000
Drug indication
Recurrent thrombophlebitis
Thrombosis
Drug Status
approved
investigational
Max Phase
4.0
Structure
Probe scores
P&D probe-likeness score
[[ v.score ]]%
Structure formats
[[ format ]]
[[ compound[format === 'MOL' ? 'molblock' : format.toLowerCase()] ]]
Description
(extracted from source data)
DESCRIPTION Argatroban (monohydrate) (MD-805 (monohydrate)) is a direct, selective thrombin inhibitor.
PRICE 45
DESCRIPTION Prescription is by the INN argatroban as there are no brand names. The INN-assigned compound consists of two epimers, and the version we show here matches the structure and stereochemistry in the INN document but does not specify the epimer. One of the epimers is listed on PubChem as CID 152951. (GtoPdb)
PHARMACODYNAMICS Argatroban is a synthetic direct thrombin inhibitor derived from L-arginine indicated as an anticoagulant for prophylaxis or treatment of thrombosis in patients with heparin-induced thrombocytopenia. Argatroban is a direct thrombin inhibitor that reversibly binds to the thrombin active site. Argatroban does not require the co-factor antithrombin III for antithrombotic activity. Argatroban exerts its anticoagulant effects by inhibiting thrombin-catalyzed or -induced reactions, including fibrin formation; activation of coagulation factors V, VIII, and XIII; protein C; and platelet aggregation. Argatroban is highly selective for thrombin with an inhibitory constant (Ki) of 0.04 µM. At therapeutic concentrations, Argatroban has little or no effect on related serine proteases (trypsin, factor Xa, plasmin, and kallikrein).; Argatroban is capable of inhibiting the action of both free and clot-associated thrombin.
DESCRIPTION Argatroban (MD-805) is a direct, selective thrombin inhibitor.
PRICE 54
DESCRIPTION Argatroban is a synthetic direct thrombin inhibitor. (Enamine Bioactive Compounds)
DESCRIPTION Argatroban Monohydrate is a specific thrombin inhibitor, which is a non-heparin anticoagulant, prevents the formation of thrombi. (TargetMol Bioactive Compound Library)
DESCRIPTION Mitochondrial hexokinase inhibitor (Tocris Bioactive Compound Library)
DESCRIPTION Potent thrombin inhibitor (Tocriscreen Plus)
DESCRIPTION Argatroban (MCI-9038), a specific thrombin inhibitor, which is a non-heparin anticoagulant, prevents the formation of thrombi. (TargetMol Bioactive Compound Library)
Compound Sets
31
AdooQ Bioactive Compound Library
A11774
Cayman Chemical Bioactives
19639
25757
CeMM library of unique drugs (CLOUD)
ChEMBL Approved Drugs
CHEMBL1166
ChEMBL Drugs
CHEMBL1166
Concise Guide to Pharmacology 2017/18
6385
Concise Guide to Pharmacology 2019/20
6385
Concise Guide to Pharmacology 2021/22
6385
CZ-OPENSCREEN Bioactive Library
DrugBank
DB00278
DrugBank Approved Drugs
DB00278
DrugCentral
239
DrugCentral Approved Drugs
239
DrugMAP
DMFI46A
DrugMAP Approved Drugs
DMFI46A
Enamine Bioactive Compounds
EBC-28059
Enamine BioReference Compounds
EU-OPENSCREEN Bioactive Compound Library
EOS101382
Guide to Pharmacology
6385
LSP-MoA library (Laboratory of Systems Pharmacology)
CHEMBL1166
MedChem Express Bioactive Compound Library
HY-B0375A
HY-B0375
NCATS Inxight Approved Drugs
OCY3U280Y3
NIH Clinical Collections (NCC)
Novartis Chemogenetic Library (NIBR MoA Box)
NPC Screening Collection
Prestwick Chemical Library
ReFrame library
Selleckchem Bioactive Compound Library
argatroban-monohydrate
argatroban
TargetMol Bioactive Compound Library
T22246
T0155
Tocris Bioactive Compound Library
1637
Tocriscreen Plus
1637
External IDs
57
Properties
(calculated by RDKit )
Molecular Weight
508.25
Hydrogen Bond Acceptors
6
Hydrogen Bond Donors
6
Rotatable Bonds
9
Ring Count
3
Aromatic Ring Count
1
cLogP
0.91
TPSA
177.71
Fraction CSP3
0.61
Chiral centers
4.0
Largest ring
6.0
QED
0.16
Structural alerts
0
No structural alerts detected
Related compounds
Custom attributes
(extracted from source data)
MOA
Thrombin inhibitor
Inhibitor
Inhibitors of Blood Coagulation Pathways
thrombin inhibitors
Target Type
Enzymes
Target
Thrombin
Primary Target
Other Proteases
Member status
member
Therapeutic Class
Anticoagulants
Pathway
Metabolic Enzyme/Protease
Proteases/Proteasome
Source data