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Compound Detail

CHEMBL5219610

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CCCc1nnc(NC(=O)c2c(C)noc2C)s1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL5219610
Phase Preclinical
Structure Type MOL
InChI Key FQCLRFJQRPRQNR-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

266.3
MW (Da)
2.35
ALogP
6
HBA
1
HBD
80.9
PSA (Ų)
0.92
QED
0
Ro5 Violations
4
Rot. Bonds

Drug Information

Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C11H14N4O2S
MW 266.33
Aromatic Rings 2
Heavy Atoms 18
NP-Likeness -2.91

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