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Compound Detail

CHEMBL4202835

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NC(=O)c1ccnc2[nH]ccc12
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL4202835
Phase Preclinical
Structure Type MOL
InChI Key JLNLMSPUHPBAFQ-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

161.2
MW (Da)
0.66
ALogP
2
HBA
2
HBD
71.8
PSA (Ų)
0.64
QED
0
Ro5 Violations
1
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C8H7N3O
MW 161.16
Aromatic Rings 2
Heavy Atoms 12
NP-Likeness -0.84

Literature References

PubMed DOI Target Context # Activities
29688013 10.1021/acs.jmedchem.8b00060 Protein kinase C iota type 1

Data from ChEMBL 36 via Core Engine