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Compound Detail

CHEMBL318189

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O=C([C@@H](Cc1ccccc1)N1C(=O)c2ccccc2C1=O)N1CCC(=C2c3ccc(Cl)cc3CCc3cccnc32)CC1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL318189
Phase Preclinical
Structure Type MOL
InChI Key QQMJBHMSPUGYNZ-WJOKGBTCSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

588.1
MW (Da)
6.17
ALogP
4
HBA
0
HBD
70.6
PSA (Ų)
0.27
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 C36H30ClN3O3
MW 588.11
Aromatic Rings 4
Heavy Atoms 43
NP-Likeness -0.63

Literature References

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

Data from ChEMBL 36 via Core Engine