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Compound Detail

CHEMBL568659

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O=C(Nc1cc(Cl)cc(Cl)c1)[C@H]1CCCC[C@H]1c1nnn[nH]1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL568659
Phase Preclinical
Structure Type MOL
InChI Key FJGGFYUBHLIODW-NEPJUHHUSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

340.2
MW (Da)
3.42
ALogP
4
HBA
2
HBD
83.6
PSA (Ų)
0.90
QED
0
Ro5 Violations
3
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C14H15Cl2N5O
MW 340.21
Aromatic Rings 2
Heavy Atoms 22
NP-Likeness -1.59

Literature References

PubMed DOI Target Context # Activities
19640716 10.1016/j.bmcl.2009.07.072 Metabotropic glutamate receptor 4 2

Data from ChEMBL 36 via Core Engine