Skip to main content
Free research Free research Free compound review with research home and workspace preview
Quick search ChEMBL 36
Compound Detail

CHEMBL444814

L-CITRULLINE
🧪 Phase III
Enter ChEMBL ID:
Free Research Context This compound will appear in recent viewed items on the research home for this browser.
Research home View demo workspace
🧪 Phase III
NC(=O)NCCC[C@H](N)C(=O)O

Basic Information

ChEMBL ID CHEMBL444814
Name L-CITRULLINE
Phase Phase III
Structure Type MOL
InChI Key RHGKLRLOHDJJDR-BYPYZUCNSA-N

Known Names

Citrulline L-citrulline NSC-27425
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
20
Publications
3
Known Names
16
Indications

Molecular Properties

175.2
MW (Da)
-1.15
ALogP
3
HBA
4
HBD
118.4
PSA (Ų)
0.39
QED
0
Ro5 Violations
5
Rot. Bonds

Drug Information

Molecule Type Small molecule
Chirality Single Enantiomer

Flags

Natural Product

Extended Properties

Molecular Formula C6H13N3O3
MW 175.19
Aromatic Rings 0
Heavy Atoms 12
NP-Likeness 0.24

Indications

Acute Lung Injury Postpoliomyelitis Syndrome Asthma Intermittent Claudication Neoplasms Peripheral Arterial Disease Respiratory Insufficiency Aging Anemia, Sickle Cell Bronchopulmonary Dysplasia Diabetes Mellitus, Type 2 Endocardial Cushion Defects Heart Septal Defects, Atrial Heart Septal Defects, Ventricular Hypertension MELAS Syndrome

Activity Summary

Kd 1 meas. best 4.17

Target Activity Profile

Target Type Best pChEMBL Mean pChEMBL Best (nM) # Data
No relevant target
CHEMBL2362975
Kd 4.17 4.17 68000.0 1

Activity Data Samples

Top measurements by pChEMBL value

Target Type Rel. Value Units pChEMBL Assay PubMed
No relevant target Kd = 68000.0 nM 4.17 Dissociation constant of the compound 15293991

Literature References

PubMed DOI Target Context # Activities
19060912 10.1038/nchembio.132 General amino-acid permease GAP1 83
19060912 10.1038/nchembio.132 Unchecked 4
- 10.6019/CHEMBL4495565 SARS-CoV-2 4
- 10.6019/CHEMBL4651402 SARS-CoV-2 2
37468498 10.1038/s41467-023-40064-9 Thromboxane A2 receptor 2
37468498 10.1038/s41467-023-40064-9 Prostaglandin G/H synthase 1 2
37468498 10.1038/s41467-023-40064-9 Alpha-1A adrenergic receptor 2
- 10.6019/CHEMBL4808148 Histone deacetylase 6 2
- 10.6019/CHEMBL4495564 Replicase polyprotein 1ab 2
37468498 10.1038/s41467-023-40064-9 Muscarinic acetylcholine receptor M1 2
- 10.1101/2020.04.21.054387 SARS-CoV-2 1
15293991 10.1021/jm030650o No relevant target 1
37468498 10.1038/s41467-023-40064-9 D(1A) dopamine receptor 1
37468498 10.1038/s41467-023-40064-9 Voltage-gated inwardly rectifying potassium channel KCNH2 1
37468498 10.1038/s41467-023-40064-9 Sodium-dependent dopamine transporter 1
37468498 10.1038/s41467-023-40064-9 Estrogen receptor 1
23571415 10.1124/mol.112.084152 Solute carrier organic anion transporter family member 1B3 1
37468498 10.1038/s41467-023-40064-9 Sodium-dependent noradrenaline transporter 1
37468498 10.1038/s41467-023-40064-9 Sodium-dependent serotonin transporter 1
23571415 10.1124/mol.112.084152 Solute carrier organic anion transporter family member 1B1 1

Data from ChEMBL 36 via Core Engine