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Compound Detail

CHEMBL498980

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NC(=O)c1nc[nH]c1C(N)=O
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL498980
Phase Preclinical
Structure Type MOL
InChI Key NNWAARLSYSBVPB-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
2
Publications
0
Known Names

Molecular Properties

154.1
MW (Da)
-1.39
ALogP
3
HBA
3
HBD
114.9
PSA (Ų)
0.49
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 C5H6N4O2
MW 154.13
Aromatic Rings 1
Heavy Atoms 11
NP-Likeness -0.85

Literature References

PubMed DOI Target Context # Activities
19899766 10.1021/jm900861d Dihydropteroate synthase 2
18182301 10.1016/j.bmc.2007.12.040 Unchecked 1

Data from ChEMBL 36 via Core Engine