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Compound Detail

CHEMBL483222

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CN1C(=O)C2C(N=C(/C=C/c3ccccc3)N2C)N(C)C1=O
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL483222
Phase Preclinical
Structure Type MOL
InChI Key MYLQBFVRHQKMRF-MDZDMXLPSA-N
0
Targets
1
Activities
1
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

298.4
MW (Da)
1.26
ALogP
4
HBA
0
HBD
56.2
PSA (Ų)
0.83
QED
0
Ro5 Violations
2
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C16H18N4O2
MW 298.35
Aromatic Rings 1
Heavy Atoms 22
NP-Likeness -0.06

Activity Summary

Ki 1 meas.

Literature References

PubMed DOI Target Context # Activities
18723354 10.1016/j.bmc.2008.07.088 Unchecked 2

Data from ChEMBL 36 via Core Engine