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Compound Detail

CHEMBL230093

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Cc1ccc(-c2nc3ccc(NC(=O)N4CCCC(C(=O)NC5CCCC5)C4)cc3nc2-c2ccc(C)cc2)cc1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL230093
Phase Preclinical
Structure Type MOL
InChI Key TULZJWBTMPBKNM-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

547.7
MW (Da)
6.88
ALogP
4
HBA
2
HBD
87.2
PSA (Ų)
0.29
QED
2
Ro5 Violations
5
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C34H37N5O2
MW 547.70
Aromatic Rings 4
Heavy Atoms 41
NP-Likeness -1.40

Literature References

PubMed DOI Target Context # Activities
17303416 10.1016/j.bmcl.2007.01.094 Dual specificity protein phosphatase 22 1

Data from ChEMBL 36 via Core Engine