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Compound Detail

CHEMBL1802276

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Cc1nc2cccc(O)c2nc1C
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL1802276
Phase Preclinical
Structure Type MOL
InChI Key NHUNVOXWVPUSBS-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
5
Publications
0
Known Names

Molecular Properties

174.2
MW (Da)
1.95
ALogP
3
HBA
1
HBD
46.0
PSA (Ų)
0.66
QED
0
Ro5 Violations
0
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C10H10N2O
MW 174.20
Aromatic Rings 2
Heavy Atoms 13
NP-Likeness -0.24

Literature References

PubMed DOI Target Context # Activities
21105712 10.1021/jm1011066 Ribosyldihydronicotinamide dehydrogenase [quinone] 2
21105712 10.1021/jm1011066 NAD(P)H dehydrogenase [quinone] 1 1
21105712 10.1021/jm1011066 Unchecked 1
21105712 10.1021/jm1011066 RAW264.7 1
21105712 10.1021/jm1011066 ADMET 1

Data from ChEMBL 36 via Core Engine