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Compound Detail

CHEMBL5571553

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Nc1cc(-c2ccc3[nH]ncc3c2)c2cc[nH]c2n1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL5571553
Phase Preclinical
Structure Type MOL
InChI Key KJZDOUDFODRMSJ-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

249.3
MW (Da)
2.69
ALogP
3
HBA
3
HBD
83.4
PSA (Ų)
0.48
QED
0
Ro5 Violations
1
Rot. Bonds

Drug Information

Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C14H11N5
MW 249.28
Aromatic Rings 4
Heavy Atoms 19
NP-Likeness -0.85

Literature References

PubMed DOI Target Context # Activities
38784459 10.1039/d3md00696d Internal ribosome entry site (IRES) 2

Data from ChEMBL 36 via Core Engine