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Compound Detail

CHEMBL103275

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CC(C)(C)c1cc(NC(=O)Cc2ccc(Cl)cc2)n(-c2ccccc2)n1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL103275
Phase Preclinical
Structure Type MOL
InChI Key UECNUHPELBKGGN-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

367.9
MW (Da)
5.00
ALogP
3
HBA
1
HBD
46.9
PSA (Ų)
0.70
QED
1
Ro5 Violations
4
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C21H22ClN3O
MW 367.88
Aromatic Rings 3
Heavy Atoms 26
NP-Likeness -1.92

Literature References

PubMed DOI Target Context # Activities
12086485 10.1021/jm020057r MAP kinase p38 1

Data from ChEMBL 36 via Core Engine