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Compound Detail

CHEMBL306700

VILOXAZINE
💊 Approved Drug
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💊 Approved Drug
CCOc1ccccc1OCC1CNCCO1

Basic Information

ChEMBL ID CHEMBL306700
Name VILOXAZINE
Phase Approved
Structure Type MOL
InChI Key YWPHCCPCQOJSGZ-UHFFFAOYSA-N
Therapeutic ✓ Yes

Known Names

Viloxazin Viloxazina Viloxazine
7
Targets
9
Activities
3
Assay Types
3
PK Parameters
20
Publications
3
Known Names
1
Indications

Molecular Properties

237.3
MW (Da)
1.45
ALogP
4
HBA
1
HBD
39.7
PSA (Ų)
0.84
QED
0
Ro5 Violations
5
Rot. Bonds

Drug Information

Molecule Type Small molecule
First Approval 2021
Availability Prescription
Chirality Racemic

Routes of Administration

Oral

Flags

Black Box Warning Natural Product
USAN Stem -
USAN Year 1976

Extended Properties

Molecular Formula C13H19NO3
MW 237.30
Aromatic Rings 1
Heavy Atoms 17
NP-Likeness -0.37

Indications

Depressive Disorder

ATC Classification

N06AX09
viloxazine
Level 1: NERVOUS SYSTEM
Level 2: PSYCHOANALEPTICS

Activity Summary

IC50 3 meas. best 6.66
Kd 3 meas. best 6.81
Ki 3 meas. best 6.77

Target Activity Profile

Target Type Best pChEMBL Mean pChEMBL Best (nM) # Data
Sodium-dependent noradrenaline transporter
CHEMBL222
Kd 6.81 6.81 155.0 1
Sodium-dependent dopamine transporter
CHEMBL238
Kd 6.81 6.81 155.0 1
Norepinephrine transporter
CHEMBL304
Ki 6.77 6.77 170.0 1
Sus scrofa
CHEMBL613488
IC50 6.66 5.26 220.0 3
Sodium-dependent serotonin transporter
CHEMBL313
Ki 4.78 4.78 16500.0 1
Sodium-dependent serotonin transporter
CHEMBL228
Kd 4.76 4.76 17300.0 1
Sodium-dependent dopamine transporter
CHEMBL338
Ki 4.32 4.32 48000.0 1

Pharmacokinetic Data

Parameter Value Units Species
CL 2.1 mL.min-1.kg-1 Homo sapiens
MRT 5.8 hr Homo sapiens
T1/2 4.1 hr Homo sapiens

Activity Data Samples

Top measurements by pChEMBL value

Literature References

PubMed DOI Target Context # Activities
15646539 10.1016/s0399-8320(04)95062-2 Unchecked 11
15646539 10.1016/s0399-8320(04)95062-2 NON-PROTEIN TARGET 8
37468498 10.1038/s41467-023-40064-9 Alpha-1A adrenergic receptor 6
37468498 10.1038/s41467-023-40064-9 Thromboxane A2 receptor 5
6716399 10.1021/jm00371a011 Mus musculus 5
3806599 10.1021/jm00384a040 Mus musculus 5
37468498 10.1038/s41467-023-40064-9 Muscarinic acetylcholine receptor M2 4
37468498 10.1038/s41467-023-40064-9 Alpha-2A adrenergic receptor 4
37468498 10.1038/s41467-023-40064-9 Cannabinoid receptor 1 4
18426954 10.1124/dmd.108.020479 ADMET 4
37468498 10.1038/s41467-023-40064-9 5-hydroxytryptamine receptor 1A 4
37468498 10.1038/s41467-023-40064-9 5-hydroxytryptamine receptor 2B 4
37468498 10.1038/s41467-023-40064-9 Muscarinic acetylcholine receptor M1 3
3806599 10.1021/jm00384a040 Sus scrofa 3
37468498 10.1038/s41467-023-40064-9 Histamine H1 receptor 3
- 10.6019/CHEMBL3988442 Unchecked 3
37468498 10.1038/s41467-023-40064-9 Prostaglandin G/H synthase 1 3
37468498 10.1038/s41467-023-40064-9 D(1A) dopamine receptor 3
966254 10.1021/jm00230a021 Mus musculus 2
- 10.6019/CHEMBL4513160 Pseudomonas aeruginosa 2

Data from ChEMBL 36 via Core Engine