ARGININE

Search structure
Synonyms:
Status: Approved
Entry Type: Small molecule
Molecule Category: Parent
UNII: 94ZLA3W45F
Parent Compound: ARGININE

Structure
InChI Key ODKSFYDXXFIFQN-BYPYZUCNSA-N
Smile N=C(N)NCCC[C@H](N)C(=O)O
InChI
InChI=1S/C6H14N4O2/c7-4(5(11)12)2-1-3-10-6(8)9/h4H,1-3,7H2,(H,11,12)(H4,8,9,10)/t4-/m0/s1

Physicochemical Descriptors

Property Name Value
Molecular Formula C6H14N4O2
Molecular Weight 174.2
AlogP -1.34
Hydrogen Bond Acceptor 3.0
Hydrogen Bond Donor 5.0
Number of Rotational Bond 5.0
Polar Surface Area 125.22
Molecular species ZWITTERION
Aromatic Rings 0.0
Heavy Atoms 12.0

Pharmacology

Targets EC50(nM) IC50(nM) Kd(nM) Ki(nM) Inhibition(%)
Enzyme Protease Serine protease Serine protease PA clan Serine protease S1A subfamily
- - - - 4
Enzyme
- - 7000-7000 - 4
Transporter Electrochemical transporter SLC superfamily of solute carriers SLC03 and SLC07 families of heteromeric amino acid transporters (HATs) SLC07 Cationic amino acid transporter/glycoprotein-associated family
- - - - 49-49

Indications

Mesh Heading Maximum Phase Mesh ID Reference
Anemia, Sickle Cell 3 D000755 ClinicalTrials
Pre-Eclampsia 3 D011225 ClinicalTrials
Carcinoma, Hepatocellular 3 D006528 ClinicalTrials
Cardiovascular Diseases 3 D002318 ClinicalTrials
Tuberculosis, Pulmonary 3 D014397 ClinicalTrials
Hypersensitivity 3 D006967 ClinicalTrials
Glucose Intolerance 3 D018149 ClinicalTrials
Severe Acute Respiratory Syndrome 3 D045169 ClinicalTrials
Small Cell Lung Carcinoma 2 D055752 ClinicalTrials
MELAS Syndrome 2 D017241 ClinicalTrials
beta-Thalassemia 2 D017086 ClinicalTrials
Schizophrenia 2 D012559 ClinicalTrials
Peripheral Arterial Disease 2 D058729 ClinicalTrials
Death, Sudden, Cardiac 2 D016757 ClinicalTrials
Prostatic Neoplasms, Castration-Resistant 2 D064129 ClinicalTrials
Cystic Fibrosis 2 D003550 ClinicalTrials
Pain 2 D010146 ClinicalTrials
Asthma 2 D001249 ClinicalTrials
Galactosemias 2 D005693 ClinicalTrials
Malaria, Falciparum 2 D016778 ClinicalTrials
Hepatitis, Alcoholic 2 D006519 ClinicalTrials
Arthritis, Rheumatoid 2 D001172 ClinicalTrials
Alzheimer Disease 2 D000544 ClinicalTrials
Lymphoma 2 D008223 ClinicalTrials
Dental Caries 2 D003731 ClinicalTrials
Aortic Aneurysm, Abdominal 2 D017544 ClinicalTrials
Hernias, Diaphragmatic, Congenital 2 D065630 ClinicalTrials
Essential Hypertension 2 D000075222 ClinicalTrials
Sepsis 2 D018805 ClinicalTrials
Argininosuccinic Aciduria 2 D056807 ClinicalTrials
Muscular Dystrophy, Duchenne 1 D020388 ClinicalTrials
Neoplasms 1 D009369 ClinicalTrials
Liver Cirrhosis 1 D008103 ClinicalTrials
Diabetes Mellitus, Type 2 1 D003924 ClinicalTrials
Glioblastoma 1 D005909 ClinicalTrials
Hypertension 1 D006973 ClinicalTrials
Coronary Disease 1 D003327 ClinicalTrials
Heart Failure 1 D006333 ClinicalTrials
Kidney Diseases 0 D007674 ClinicalTrials

Related Entries

MCS

Parent
Salt
Parent
Salt
Salt

Cross References

Resources Reference
CAS NUMBER 74-79-3
ChEBI 16467
ChEMBL CHEMBL1485
DrugBank DB00125
DrugCentral 1549
EPA CompTox DTXSID6041056
FDA SRS 94ZLA3W45F
Human Metabolome Database HMDB0000517
Guide to Pharmacology 721
KEGG C00062
PharmGKB PA448478
PubChem 6322
SureChEMBL SCHEMBL1791
ZINC ZINC000001532525
CONTENTS