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Compound Detail

CHEMBL5555383

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CCN(CC)CCn1cnc2ccc(NC(=O)NC3CCCCC3)cc21
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL5555383
Phase Preclinical
Structure Type MOL
InChI Key BOZOUSFYCLQAQA-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

357.5
MW (Da)
3.83
ALogP
4
HBA
2
HBD
62.2
PSA (Ų)
0.79
QED
0
Ro5 Violations
7
Rot. Bonds

Drug Information

Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C20H31N5O
MW 357.50
Aromatic Rings 2
Heavy Atoms 26
NP-Likeness -2.01

Literature References

PubMed DOI Target Context # Activities
39012838 10.1021/acs.jmedchem.4c00780 Unchecked 3

Data from ChEMBL 36 via Core Engine