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Compound Detail

CHEMBL218684

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N#Cc1cncc(NC2CCCCC2)n1

Basic Information

ChEMBL ID CHEMBL218684
Phase Preclinical
Structure Type MOL
InChI Key PMZPBAKZCBFXTK-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

202.3
MW (Da)
2.09
ALogP
4
HBA
1
HBD
61.6
PSA (Ų)
0.80
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 C11H14N4
MW 202.26
Aromatic Rings 1
Heavy Atoms 15
NP-Likeness -1.23

Literature References

PubMed DOI Target Context # Activities
17256925 10.1021/jm0613525 Cathepsin K 1

Data from ChEMBL 36 via Core Engine