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Compound Detail

CHEMBL194263

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CCN(C)CCc1ccc(CCc2ccc(OC)cc2)nc1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL194263
Phase Preclinical
Structure Type MOL
InChI Key CGPWIWKXIOERQV-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

298.4
MW (Da)
3.37
ALogP
3
HBA
0
HBD
25.4
PSA (Ų)
0.75
QED
0
Ro5 Violations
8
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C19H26N2O
MW 298.43
Aromatic Rings 2
Heavy Atoms 22
NP-Likeness -0.81

Literature References

PubMed DOI Target Context # Activities
16039854 10.1016/j.bmcl.2005.06.053 Neuronal acetylcholine receptor; alpha4/beta2 1

Data from ChEMBL 36 via Core Engine