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Compound Detail

CHEMBL523110

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CCCNC(=O)[C@@H]1CCCN1C(=O)CC1CCCCC1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL523110
Phase Preclinical
Structure Type MOL
InChI Key ROIYXBXZBVKHRW-AWEZNQCLSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

280.4
MW (Da)
2.47
ALogP
2
HBA
1
HBD
49.4
PSA (Ų)
0.84
QED
0
Ro5 Violations
5
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C16H28N2O2
MW 280.41
Aromatic Rings 0
Heavy Atoms 20
NP-Likeness -1.17

Literature References

PubMed DOI Target Context # Activities
19371038 10.1021/jm8011849 Unchecked 2

Data from ChEMBL 36 via Core Engine