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Compound Detail

CHEMBL3356799

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CSc1cccc(N(C)C(=N)Nc2cncc3ccccc23)c1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL3356799
Phase Preclinical
Structure Type MOL
InChI Key XXXWCZVAMDAEGY-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

322.4
MW (Da)
4.44
ALogP
3
HBA
2
HBD
52.0
PSA (Ų)
0.43
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 C18H18N4S
MW 322.44
Aromatic Rings 3
Heavy Atoms 23
NP-Likeness -1.29

Literature References

PubMed DOI Target Context # Activities
25499436 10.1016/j.bmcl.2014.11.066 Glutamate NMDA receptor 2

Data from ChEMBL 36 via Core Engine