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Compound Detail

CHEMBL435624

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CCCN(CCC)C(=O)/C(=C\C1CCCN1)c1ccc(OC)cc1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL435624
Phase Preclinical
Structure Type MOL
InChI Key GSGJEFRVMPMJPF-CYVLTUHYSA-N
0
Targets
1
Activities
1
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

330.5
MW (Da)
3.48
ALogP
3
HBA
1
HBD
41.6
PSA (Ų)
0.74
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 C20H30N2O2
MW 330.47
Aromatic Rings 1
Heavy Atoms 24
NP-Likeness -0.28

Activity Summary

IC50 1 meas.

Literature References

PubMed DOI Target Context # Activities
14640541 10.1021/jm030226n Glutamate NMDA receptor 1

Data from ChEMBL 36 via Core Engine