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

CHEMBL1201236

CARBIDOPA ANHYDROUS
💊 Approved Drug
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
💊 Approved Drug
C[C@@](Cc1ccc(O)c(O)c1)(NN)C(=O)O

Basic Information

ChEMBL ID CHEMBL1201236
Name CARBIDOPA ANHYDROUS
Phase Approved
Structure Type MOL
InChI Key TZFNLOMSOLWIDK-JTQLQIEISA-N
Therapeutic ✓ Yes

Known Names

Carbidopa anhydrous Carbidopa, l- anhydrous
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
17
Publications
2
Known Names

Molecular Properties

226.2
MW (Da)
-0.05
ALogP
5
HBA
5
HBD
115.8
PSA (Ų)
0.28
QED
0
Ro5 Violations
4
Rot. Bonds

Drug Information

Molecule Type Small molecule
First Approval 1975
Availability Prescription
Chirality Single Enantiomer

Routes of Administration

Oral

Flags

Natural Product
USAN Stem -dopa
USAN Year 1972

Extended Properties

Molecular Formula C10H14N2O4
MW 226.23
Aromatic Rings 1
Heavy Atoms 16
NP-Likeness 0.66

Activity Summary

IC50 1 meas. best 5.45

Target Activity Profile

Target Type Best pChEMBL Mean pChEMBL Best (nM) # Data
Replicase polyprotein 1ab
CHEMBL4523582
IC50 5.45 5.45 3550.0 1

Activity Data Samples

Top measurements by pChEMBL value

Target Type Rel. Value Units pChEMBL Assay PubMed
Replicase polyprotein 1ab IC50 = 3550.0 nM 5.45 SARS-CoV-2 3CL-Pro protease inhibition IC50 determined by FRET kind of response ... -

Literature References

PubMed DOI Target Context # Activities
- 10.6019/CHEMBL4495564 Replicase polyprotein 1ab 4
- 10.6019/CHEMBL4808148 Histone deacetylase 6 2
- 10.6019/CHEMBL4651402 SARS-CoV-2 2
- 10.6019/CHEMBL4495565 SARS-CoV-2 2
26948801 10.1016/j.drudis.2016.02.015 Homo sapiens 2
- 10.21203/rs.3.rs-23951/v1 SARS-CoV-2 1
38318365 10.1016/j.isci.2024.108907 Deoxynucleoside triphosphate triphosphohydrolase SAMHD1 1
27397500 10.1016/j.bmcl.2016.06.088 Cytochrome P450 2C9 1
27397500 10.1016/j.bmcl.2016.06.088 Cytochrome P450 2D6 1
27397500 10.1016/j.bmcl.2016.06.088 Cytochrome P450 3A4 1
- 10.6019/CHEMBL3301361 No relevant target 1
- 10.1101/2020.04.03.023846 SARS-CoV-2 1
23956101 10.1093/toxsci/kft176 ATP-binding cassette sub-family C member 4 1
23956101 10.1093/toxsci/kft176 ATP-binding cassette sub-family C member 3 1
23956101 10.1093/toxsci/kft176 ATP-binding cassette sub-family C member 2 1
23956101 10.1093/toxsci/kft176 Bile salt export pump 1
22961681 10.1124/dmd.112.047068 Bile salt export pump 1

Data from ChEMBL 36 via Core Engine