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Compound Detail

CHEMBL112190

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CCCCN(Cc1cn(Cc2ccc(C#N)cc2)cn1)c1ccc(Oc2ccccc2)cc1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL112190
Phase Preclinical
Structure Type MOL
InChI Key IYMLCTXRSPGUAK-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

436.6
MW (Da)
6.40
ALogP
5
HBA
0
HBD
54.1
PSA (Ų)
0.29
QED
1
Ro5 Violations
10
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C28H28N4O
MW 436.56
Aromatic Rings 4
Heavy Atoms 33
NP-Likeness -1.32

Literature References

PubMed DOI Target Context # Activities
10612589 10.1016/s0960-894x(99)00605-8 Protein farnesyltransferase 1

Data from ChEMBL 36 via Core Engine