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Compound Detail

CHEMBL325339

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O=C1NCCC2=C1C(c1ccc(F)c(Br)c1)C1=C(CCNC1=O)N2
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL325339
Phase Preclinical
Structure Type MOL
InChI Key YNBKPDKDCQJQRM-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

392.2
MW (Da)
1.82
ALogP
3
HBA
3
HBD
70.2
PSA (Ų)
0.68
QED
0
Ro5 Violations
1
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C17H15BrFN3O2
MW 392.23
Aromatic Rings 1
Heavy Atoms 24
NP-Likeness -0.66

Literature References

PubMed DOI Target Context # Activities
15163197 10.1021/jm030357o Sulfonylurea receptors; K-ATP channels 2

Data from ChEMBL 36 via Core Engine