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Compound Detail

CHEMBL3287953

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Cc1ccc(-c2nnc(-c3cccc(NC(=O)C(C)C)c3)o2)cc1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL3287953
Phase Preclinical
Structure Type MOL
InChI Key UWRYCSMMQPGBEE-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

321.4
MW (Da)
4.31
ALogP
4
HBA
1
HBD
68.0
PSA (Ų)
0.78
QED
0
Ro5 Violations
4
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C19H19N3O2
MW 321.38
Aromatic Rings 3
Heavy Atoms 24
NP-Likeness -1.47

Literature References

PubMed DOI Target Context # Activities
24946215 10.1016/j.ejmech.2014.06.011 Unchecked 1

Data from ChEMBL 36 via Core Engine