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Compound Detail

CHEMBL37125

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NC(=O)Cn1nnc2c(C(N)=O)cccc2c1=O
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL37125
Phase Preclinical
Structure Type MOL
InChI Key AFILZTHUOPLZOF-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

247.2
MW (Da)
-1.62
ALogP
6
HBA
2
HBD
134.0
PSA (Ų)
0.67
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 C10H9N5O3
MW 247.21
Aromatic Rings 2
Heavy Atoms 18
NP-Likeness -1.75

Literature References

PubMed DOI Target Context # Activities
7739008 10.1021/jm00009a010 TLX-5 1

Data from ChEMBL 36 via Core Engine