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Compound Detail

CHEMBL3770275

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Cc1cc(C)c(CNC(=O)c2cccc3c2ncn3C(C)C)c(=O)[nH]1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL3770275
Phase Preclinical
Structure Type MOL
InChI Key IOHHUSOAOOXLIG-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

338.4
MW (Da)
2.85
ALogP
4
HBA
2
HBD
79.8
PSA (Ų)
0.77
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 C19H22N4O2
MW 338.41
Aromatic Rings 3
Heavy Atoms 25
NP-Likeness -1.37

Literature References

PubMed DOI Target Context # Activities
26769278 10.1021/acs.jmedchem.5b01501 Histone-lysine N-methyltransferase EZH2 1

Data from ChEMBL 36 via Core Engine