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

CHEMBL185966

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
C=CCSc1oc2cc(OCc3ccccc3)ccc2c(=O)c1-c1ccc(OC)cc1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL185966
Phase Preclinical
Structure Type MOL
InChI Key UOAKECPKXROSDO-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

430.5
MW (Da)
6.33
ALogP
5
HBA
0
HBD
48.7
PSA (Ų)
0.24
QED
1
Ro5 Violations
8
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C26H22O4S
MW 430.53
Aromatic Rings 4
Heavy Atoms 31
NP-Likeness -0.23

Literature References

PubMed DOI Target Context # Activities
15267241 10.1021/jm0306024 Aromatase 1

Data from ChEMBL 36 via Core Engine