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Compound Detail

CHEMBL5283306

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CCCN(CCC)C(=O)CC1c2nc3ccccc3cc2C(=O)N1c1ccccc1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL5283306
Phase Preclinical
Structure Type MOL
InChI Key KZYDVXHKCLOHFP-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
2
Publications
0
Known Names

Molecular Properties

401.5
MW (Da)
4.98
ALogP
3
HBA
0
HBD
53.5
PSA (Ų)
0.56
QED
0
Ro5 Violations
7
Rot. Bonds

Drug Information

Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C25H27N3O2
MW 401.51
Aromatic Rings 3
Heavy Atoms 30
NP-Likeness -0.93

Literature References

PubMed DOI Target Context # Activities
34254805 10.1021/acs.jmedchem.1c00379 Unchecked 1
34254805 10.1021/acs.jmedchem.1c00379 Translocator protein 1

Data from ChEMBL 36 via Core Engine