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Compound Detail

CHEMBL317845

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CC(C)C[C@H](C(=O)N1CCC(=C2c3ccc(Cl)cc3CCc3cccnc32)CC1)N1C(=O)c2ccccc2C1=O
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL317845
Phase Preclinical
Structure Type MOL
InChI Key LUSXNRKHDJNPDY-MUUNZHRXSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

554.1
MW (Da)
5.97
ALogP
4
HBA
0
HBD
70.6
PSA (Ų)
0.37
QED
2
Ro5 Violations
4
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C33H32ClN3O3
MW 554.09
Aromatic Rings 3
Heavy Atoms 40
NP-Likeness -0.65

Literature References

PubMed DOI Target Context # Activities
- 10.1016/S0960-894X(96)00558-6 Protein farnesyltransferase 1

Data from ChEMBL 36 via Core Engine