Skip to main content
Free research Free research Free compound review with research home and workspace preview
Quick search ChEMBL 36
Compound Detail

CHEMBL5076808

Enter ChEMBL ID:
Free Research Context This compound will appear in recent viewed items on the research home for this browser.
Research home View demo workspace
O=C(C1=C(O)C(=O)N(c2nnc(SCc3ccccc3)s2)C1c1ccccc1F)c1cc2ccccc2o1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL5076808
Phase Preclinical
Structure Type MOL
InChI Key XEOVDIIBNWMQMX-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
3
Publications
0
Known Names

Molecular Properties

543.6
MW (Da)
6.50
ALogP
8
HBA
1
HBD
96.5
PSA (Ų)
0.14
QED
2
Ro5 Violations
7
Rot. Bonds

Drug Information

Molecule Type Unknown
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C28H18FN3O4S2
MW 543.60
Aromatic Rings 5
Heavy Atoms 38
NP-Likeness -1.67

Literature References

PubMed DOI Target Context # Activities
34657423 10.1021/acs.jmedchem.1c00939 Enterococcus faecalis 6
34657423 10.1021/acs.jmedchem.1c00939 Unchecked 4
34657423 10.1021/acs.jmedchem.1c00939 Vero 1

Data from ChEMBL 36 via Core Engine