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Compound Detail

CHEMBL243932

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O=C(O)Cc1[nH]cnc1-c1ccccc1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL243932
Phase Preclinical
Structure Type MOL
InChI Key POQNAJFZBBTTAJ-UHFFFAOYSA-N
0
Targets
4
Activities
1
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

202.2
MW (Da)
1.70
ALogP
2
HBA
2
HBD
66.0
PSA (Ų)
0.80
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 C11H10N2O2
MW 202.21
Aromatic Rings 2
Heavy Atoms 15
NP-Likeness -0.40

Activity Summary

EC50 4 meas.

Literature References

PubMed DOI Target Context # Activities
17655213 10.1021/jm070447j Unchecked 10

Data from ChEMBL 36 via Core Engine