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Compound Detail

CHEMBL4160537

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Cc1nnn2c1-c1ccccc1N(c1ccccc1)C(=O)C2
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL4160537
Phase Preclinical
Structure Type MOL
InChI Key GVYLUNMYJIQLNZ-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
3
Publications
0
Known Names

Molecular Properties

290.3
MW (Da)
2.93
ALogP
4
HBA
0
HBD
51.0
PSA (Ų)
0.69
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 C17H14N4O
MW 290.33
Aromatic Rings 3
Heavy Atoms 22
NP-Likeness -1.06

Literature References

PubMed DOI Target Context # Activities
29259751 10.1021/acsmedchemlett.7b00389 Bromodomain-containing protein 2 2
29259751 10.1021/acsmedchemlett.7b00389 Bromodomain-containing protein 4 2
29259751 10.1021/acsmedchemlett.7b00389 Bromodomain-containing protein 3 1

Data from ChEMBL 36 via Core Engine