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Compound Detail

CHEMBL1536867

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Cn1c2ccccc2c2nnc(NN)nc21
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL1536867
Phase Preclinical
Structure Type MOL
InChI Key HIEGIMRDXIGOAG-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

214.2
MW (Da)
0.80
ALogP
6
HBA
2
HBD
81.7
PSA (Ų)
0.46
QED
0
Ro5 Violations
1
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C10H10N6
MW 214.23
Aromatic Rings 3
Heavy Atoms 16
NP-Likeness -1.47

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