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Compound Detail

CHEMBL52408

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Nc1nc(O)cc(Nc2cc(F)cc(Cl)c2)n1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL52408
Phase Preclinical
Structure Type MOL
InChI Key XLBQLHSDXCLIDP-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

254.7
MW (Da)
2.30
ALogP
5
HBA
3
HBD
84.1
PSA (Ų)
0.77
QED
0
Ro5 Violations
2
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C10H8ClFN4O
MW 254.65
Aromatic Rings 2
Heavy Atoms 17
NP-Likeness -1.79

Literature References

PubMed DOI Target Context # Activities
7752205 10.1021/jm00010a026 HEL 2

Data from ChEMBL 36 via Core Engine