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Compound Detail

CHEMBL134021

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Nc1ccc2ncnc3c2c1C(=O)c1ccccc1-3

Basic Information

ChEMBL ID CHEMBL134021
Phase Preclinical
Structure Type MOL
InChI Key UAWKAJMVJJHNNE-UHFFFAOYSA-N
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
5
Publications
0
Known Names

Molecular Properties

247.3
MW (Da)
2.42
ALogP
4
HBA
1
HBD
68.9
PSA (Ų)
0.48
QED
0
Ro5 Violations
0
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

Natural Product First in Class Prodrug

Extended Properties

Molecular Formula C15H9N3O
MW 247.26
Aromatic Rings 3
Heavy Atoms 19
NP-Likeness 0.08

Activity Summary

EC50 1 meas. best 6.03

Target Activity Profile

Target Type Best pChEMBL Mean pChEMBL Best (nM) # Data
L1210
CHEMBL386
EC50 6.03 6.03 945.0 1

Activity Data Samples

Top measurements by pChEMBL value

Target Type Rel. Value Units pChEMBL Assay PubMed
L1210 EC50 = 945.0 nM 6.03 Concentration of compound required to inhibit the cellular protein biosynthesis ... 8421288

Literature References

PubMed DOI Target Context # Activities
8421288 10.1021/jm00053a005 Mus musculus 2
8421288 10.1021/jm00053a005 ADMET 2
- 10.6019/CHEMBL4888484 Plasmodium falciparum 2
8421288 10.1021/jm00053a005 L1210 1
38318365 10.1016/j.isci.2024.108907 Deoxynucleoside triphosphate triphosphohydrolase SAMHD1 1

Data from ChEMBL 36 via Core Engine