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Compound Detail

CHEMBL5220065

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Cc1nonc1-c1cc2ccccc2[nH]1

Basic Information

ChEMBL ID CHEMBL5220065
Phase Preclinical
Structure Type MOL
InChI Key QDSCGWAUHTUMSL-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

199.2
MW (Da)
2.53
ALogP
3
HBA
1
HBD
54.7
PSA (Ų)
0.65
QED
0
Ro5 Violations
1
Rot. Bonds

Drug Information

Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C11H9N3O
MW 199.21
Aromatic Rings 3
Heavy Atoms 15
NP-Likeness -1.27

Literature References

PubMed DOI Target Context # Activities
34898210 10.1021/acs.jmedchem.1c01108 Bromodomain-containing protein 4 2

Data from ChEMBL 36 via Core Engine