Skip to main content
Free research Free research Free compound review with research home and workspace preview
Quick search ChEMBL 36
Compound Detail

CHEMBL3272819

Enter ChEMBL ID:
Free Research Context This compound will appear in recent viewed items on the research home for this browser.
Research home View demo workspace
CC(C)Cn1c(=O)n(C)c(=O)c2c1ncn2Cc1ccncc1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL3272819
Phase Preclinical
Structure Type MOL
InChI Key LYPFWXLSKYKCMY-UHFFFAOYSA-N
0
Targets
2
Activities
1
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

313.4
MW (Da)
1.00
ALogP
7
HBA
0
HBD
74.7
PSA (Ų)
0.72
QED
0
Ro5 Violations
4
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C16H19N5O2
MW 313.36
Aromatic Rings 3
Heavy Atoms 23
NP-Likeness -1.43

Activity Summary

IC50 2 meas.

Literature References

PubMed DOI Target Context # Activities
177782 10.1021/jm00226a010 Unchecked 4

Data from ChEMBL 36 via Core Engine