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Compound Detail

CHEMBL5879441

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CCCN1CCC[C@@H]2CC3=C(CCCC3=O)C[C@H]21
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL5879441
Phase Preclinical
Structure Type MOL
InChI Key QLIKRYHBUISCTR-UKRRQHHQSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

247.4
MW (Da)
3.32
ALogP
2
HBA
0
HBD
20.3
PSA (Ų)
0.75
QED
0
Ro5 Violations
2
Rot. Bonds

Drug Information

Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C16H25NO
MW 247.38
Aromatic Rings 0
Heavy Atoms 18
NP-Likeness 0.40

Data from ChEMBL 36 via Core Engine