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Compound Detail

CHEMBL59876

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CC(=O)Nc1cccc(-n2nc(C(C)(C)C)cc2NC(=O)Nc2cccc(Cl)c2Cl)c1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL59876
Phase Preclinical
Structure Type MOL
InChI Key VLLPZZWVGHILFD-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

460.4
MW (Da)
6.08
ALogP
4
HBA
3
HBD
88.0
PSA (Ų)
0.44
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 C22H23Cl2N5O2
MW 460.37
Aromatic Rings 3
Heavy Atoms 31
NP-Likeness -2.19

Literature References

PubMed DOI Target Context # Activities
10999468 10.1016/s0960-894x(00)00272-9 Mitogen-activated protein kinase 14 1

Data from ChEMBL 36 via Core Engine