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

CHEMBL375776

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(N[C@H]1CN2CCC1CC2)c1cnc2occc2c1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL375776
Phase Preclinical
Structure Type MOL
InChI Key RWXZHWOFGKDGIU-ZDUSSCGKSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
3
Publications
0
Known Names

Molecular Properties

271.3
MW (Da)
1.65
ALogP
4
HBA
1
HBD
58.4
PSA (Ų)
0.90
QED
0
Ro5 Violations
2
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C15H17N3O2
MW 271.32
Aromatic Rings 2
Heavy Atoms 20
NP-Likeness -0.25

Literature References

PubMed DOI Target Context # Activities
16821801 10.1021/jm0602413 Liver microsomes 1
16821801 10.1021/jm0602413 Neuronal acetylcholine receptor subunit alpha-7 1
16821801 10.1021/jm0602413 Unchecked 1

Data from ChEMBL 36 via Core Engine