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Compound Detail

CHEMBL5591995

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N=c1oc2cc(Br)ccc2cc1C(N)=S
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL5591995
Phase Preclinical
Structure Type MOL
InChI Key BTSWUCZRGFHIOA-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

283.1
MW (Da)
2.31
ALogP
3
HBA
2
HBD
63.0
PSA (Ų)
0.79
QED
0
Ro5 Violations
1
Rot. Bonds

Drug Information

Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C10H7BrN2OS
MW 283.15
Aromatic Rings 2
Heavy Atoms 15
NP-Likeness -0.72

Literature References

PubMed DOI Target Context # Activities
39145509 10.1021/acs.jmedchem.4c00722 Serine/threonine-protein phosphatase 5 3

Data from ChEMBL 36 via Core Engine