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Compound Detail

CHEMBL353854

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CC(=O)N1CCC(CC(=O)N2CCN(C3c4ccc(Cl)cc4CCc4cccnc43)CC2)CC1

Basic Information

ChEMBL ID CHEMBL353854
Phase Preclinical
Structure Type MOL
InChI Key JXNIGCDETYLKAE-UHFFFAOYSA-N
1
Targets
2
Activities
1
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

481.0
MW (Da)
3.72
ALogP
4
HBA
0
HBD
56.8
PSA (Ų)
0.67
QED
0
Ro5 Violations
3
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C27H33ClN4O2
MW 481.04
Aromatic Rings 2
Heavy Atoms 34
NP-Likeness -0.99

Activity Summary

IC50 2 meas. best 6.06

Target Activity Profile

Target Type Best pChEMBL Mean pChEMBL Best (nM) # Data
Protein farnesyltransferase
CHEMBL2094108
IC50 6.06 5.815 870.0 2

Activity Data Samples

Top measurements by pChEMBL value

Literature References

PubMed DOI Target Context # Activities
9526562 10.1021/jm970462w Protein farnesyltransferase 2

Data from ChEMBL 36 via Core Engine