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

CHEMBL3752917

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
COc1cc([C@@H](O)[C@H](CO)Oc2c(OC)cc([C@@H]3OC[C@H]4[C@H](c5ccc(O)c(OC)c5)OC[C@@]34O)cc2OC)ccc1O
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL3752917
Phase Preclinical
Structure Type MOL
InChI Key RFPCHLZTNNYBAH-KTBRTDQUSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
2
Publications
0
Known Names

Molecular Properties

600.6
MW (Da)
2.80
ALogP
12
HBA
5
HBD
165.8
PSA (Ų)
0.22
QED
2
Ro5 Violations
11
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C31H36O12
MW 600.62
Aromatic Rings 3
Heavy Atoms 43
NP-Likeness 1.58

Literature References

PubMed DOI Target Context # Activities
26774654 10.1016/j.bmcl.2016.01.008 ADMET 1
26774654 10.1016/j.bmcl.2016.01.008 NON-PROTEIN TARGET 1

Data from ChEMBL 36 via Core Engine