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

CHEMBL3819443

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
CCC1CCC(c2cc(C(=O)N3CCN(C(=O)c4cc(F)cc(N5CCNCC5)c4)CC3)ccc2O[C@H]2CCNC2)CC1.Cl.Cl
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL3819443
Phase Preclinical
Structure Type MOL
InChI Key JGTXLGZCZSOYMH-OZSDPRMISA-N
Parent Compound CHEMBL3819658
Active Moiety CHEMBL3819658
0
Targets
1
Activities
1
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

591.8
MW (Da)
4.26
ALogP
6
HBA
2
HBD
77.2
PSA (Ų)
0.50
QED
1
Ro5 Violations
7
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C34H48Cl2FN5O3
MW 664.69
Aromatic Rings 2
Heavy Atoms 43
NP-Likeness -0.80

Activity Summary

Ki 1 meas.

Literature References

PubMed DOI Target Context # Activities
27190602 10.1021/acsmedchemlett.5b00284 beta-catenin-B-cell lymphoma 9 protein complex 1

Data from ChEMBL 36 via Core Engine