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Compound Detail

CHEMBL14964

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NCC1CCC1C(=O)O
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL14964
Phase Preclinical
Structure Type MOL
InChI Key PXJMGVYQAJBQJF-UHFFFAOYSA-N
0
Targets
1
Activities
1
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

129.2
MW (Da)
0.06
ALogP
2
HBA
2
HBD
63.3
PSA (Ų)
0.55
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 C6H11NO2
MW 129.16
Aromatic Rings 0
Heavy Atoms 9
NP-Likeness 1.25

Activity Summary

IC50 1 meas.

Literature References

PubMed DOI Target Context # Activities
7420361 10.1021/jm00184a017 GABA-A receptor; anion channel 2

Data from ChEMBL 36 via Core Engine