Skip to main content
Free research Free research Free compound review with research home and workspace preview
Quick search ChEMBL 36
Compound Detail

CHEMBL5075496

Enter ChEMBL ID:
Free Research Context This compound will appear in recent viewed items on the research home for this browser.
Research home View demo workspace
Cc1n[nH]cc1CN1CCN(c2cc(C(=O)O)ccc2F)CC1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL5075496
Phase Preclinical
Structure Type MOL
InChI Key AOTONVGAWKWEEV-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
2
Publications
0
Known Names

Molecular Properties

318.4
MW (Da)
1.88
ALogP
4
HBA
2
HBD
72.5
PSA (Ų)
0.90
QED
0
Ro5 Violations
4
Rot. Bonds

Drug Information

Molecule Type Unknown
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C16H19FN4O2
MW 318.35
Aromatic Rings 2
Heavy Atoms 23
NP-Likeness -1.91

Literature References

PubMed DOI Target Context # Activities
34138572 10.1021/acs.jmedchem.1c00099 Transthyretin 1
34138572 10.1021/acs.jmedchem.1c00099 Retinol-binding protein 4 1

Data from ChEMBL 36 via Core Engine