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Compound Detail

CHEMBL2163665

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CCC(C(=O)Nc1cccc(N2CCCC2)c1)c1ccccc1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL2163665
Phase Preclinical
Structure Type MOL
InChI Key IYXGTCQIDUPPCC-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

308.4
MW (Da)
4.42
ALogP
2
HBA
1
HBD
32.3
PSA (Ų)
0.89
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 C20H24N2O
MW 308.42
Aromatic Rings 2
Heavy Atoms 23
NP-Likeness -1.51

Literature References

PubMed DOI Target Context # Activities
22793372 10.1021/jm300700v Potassium voltage-gated channel subfamily KQT member 2 1

Data from ChEMBL 36 via Core Engine