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Compound Detail

CHEMBL25212

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NC1=Nc2ccccc2CN1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL25212
Phase Preclinical
Structure Type MOL
InChI Key GQRRWNLARRRPRY-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

147.2
MW (Da)
0.74
ALogP
3
HBA
2
HBD
50.4
PSA (Ų)
0.57
QED
0
Ro5 Violations
0
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C8H9N3
MW 147.18
Aromatic Rings 1
Heavy Atoms 11
NP-Likeness 0.24

Literature References

PubMed DOI Target Context # Activities
7452680 10.1021/jm00185a026 Rattus norvegicus 7

Data from ChEMBL 36 via Core Engine