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

CHEMBL3787199

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
Cl.O=C(N[C@H]1CN2CCC1CC2)c1cc(C(=O)c2ccc(-c3ccccc3)cc2)n2ccccc12
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL3787199
Phase Preclinical
Structure Type MOL
InChI Key KKOPGHAQGGSEOH-UQIIZPHYSA-N
Parent Compound CHEMBL3787795
Active Moiety CHEMBL3787795
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

449.6
MW (Da)
4.66
ALogP
4
HBA
1
HBD
53.8
PSA (Ų)
0.45
QED
0
Ro5 Violations
5
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C29H28ClN3O2
MW 486.02
Aromatic Rings 4
Heavy Atoms 34
NP-Likeness -0.69

Literature References

PubMed DOI Target Context # Activities
26994846 10.1016/j.ejmech.2016.03.016 Neuronal acetylcholine receptor subunit alpha-7 2

Data from ChEMBL 36 via Core Engine