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Compound Detail

CHEMBL1196278

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c1ccc(C2CCCNC2)cc1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL1196278
Phase Preclinical
Structure Type MOL
InChI Key NZYBILDYPCVNMU-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

161.2
MW (Da)
2.15
ALogP
1
HBA
1
HBD
12.0
PSA (Ų)
0.67
QED
0
Ro5 Violations
1
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

Natural Product First in Class Prodrug

Extended Properties

Molecular Formula C11H15N
MW 161.25
Aromatic Rings 1
Heavy Atoms 12
NP-Likeness -0.05

Literature References

PubMed DOI Target Context # Activities
38318365 10.1016/j.isci.2024.108907 Deoxynucleoside triphosphate triphosphohydrolase SAMHD1 1

Data from ChEMBL 36 via Core Engine