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Compound Detail

CHEMBL4632911

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CCCNC(=O)C1(c2ccc(NC(=O)c3cnoc3C)cc2)CCC1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL4632911
Phase Preclinical
Structure Type MOL
InChI Key UIIKXYNEUUSFJG-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
2
Publications
0
Known Names

Molecular Properties

341.4
MW (Da)
3.18
ALogP
4
HBA
2
HBD
84.2
PSA (Ų)
0.84
QED
0
Ro5 Violations
6
Rot. Bonds

Drug Information

Molecule Type Unknown
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C19H23N3O3
MW 341.41
Aromatic Rings 2
Heavy Atoms 25
NP-Likeness -1.63

Literature References

PubMed DOI Target Context # Activities
32292563 10.1021/acsmedchemlett.0c00010 Indoleamine 2,3-dioxygenase 1 1
32292563 10.1021/acsmedchemlett.0c00010 No relevant target 1

Data from ChEMBL 36 via Core Engine