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Compound Detail

CHEMBL357463

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NC(CCCCCc1nnn[nH]1)C(=O)O
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL357463
Phase Preclinical
Structure Type MOL
InChI Key KEKVCHQRYGOCRX-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
2
Publications
0
Known Names

Molecular Properties

213.2
MW (Da)
-0.29
ALogP
5
HBA
3
HBD
117.8
PSA (Ų)
0.54
QED
0
Ro5 Violations
7
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C8H15N5O2
MW 213.24
Aromatic Rings 1
Heavy Atoms 15
NP-Likeness -0.47

Literature References

PubMed DOI Target Context # Activities
- 10.1016/S0960-894X(00)80089-X Glutamate [NMDA] receptor 2
- 10.1016/S0960-894X(00)80089-X Mus musculus 1

Data from ChEMBL 36 via Core Engine