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Compound Detail

CHEMBL168642

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CC(C)N(Cc1ccncc1)C(=O)Cc1cn(Cc2cccc(Br)c2)c2ccccc12

Basic Information

ChEMBL ID CHEMBL168642
Phase Preclinical
Structure Type MOL
InChI Key GICYYXCYLFAMOP-UHFFFAOYSA-N
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

476.4
MW (Da)
5.83
ALogP
3
HBA
0
HBD
38.1
PSA (Ų)
0.34
QED
1
Ro5 Violations
7
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C26H26BrN3O
MW 476.42
Aromatic Rings 4
Heavy Atoms 31
NP-Likeness -1.76

Activity Summary

IC50 1 meas. best 5.67

Target Activity Profile

Target Type Best pChEMBL Mean pChEMBL Best (nM) # Data
Protein farnesyltransferase
CHEMBL2094108
IC50 5.67 5.67 2150.0 1

Activity Data Samples

Top measurements by pChEMBL value

Literature References

PubMed DOI Target Context # Activities
11294379 10.1016/s0960-894x(01)00061-0 Protein farnesyltransferase 1

Data from ChEMBL 36 via Core Engine