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Compound Detail

CHEMBL358448

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N#CN/C(=N/c1ccncc1)N1CCC(=C2c3ccc(Cl)cc3CCc3cc(Br)cnc32)CC1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL358448
Phase Preclinical
Structure Type MOL
InChI Key RLOIBKDTMWTLDZ-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

533.9
MW (Da)
5.65
ALogP
4
HBA
1
HBD
77.2
PSA (Ų)
0.19
QED
2
Ro5 Violations
1
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C26H22BrClN6
MW 533.86
Aromatic Rings 3
Heavy Atoms 34
NP-Likeness -0.86

Literature References

PubMed DOI Target Context # Activities
11844681 10.1016/s0960-894x(01)00826-5 Protein farnesyltransferase 1

Data from ChEMBL 36 via Core Engine