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Compound Detail

CHEMBL499820

N4-hydroxycytosine
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O=c1nc(NO)cc[nH]1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL499820
Name N4-hydroxycytosine
Phase Preclinical
Structure Type MOL
InChI Key OSHIQPFXKULOPB-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
5
Publications
0
Known Names

Molecular Properties

127.1
MW (Da)
-0.43
ALogP
4
HBA
3
HBD
78.0
PSA (Ų)
0.45
QED
0
Ro5 Violations
1
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C4H5N3O2
MW 127.10
Aromatic Rings 1
Heavy Atoms 9
NP-Likeness -0.17

Literature References

PubMed DOI Target Context # Activities
18640746 10.1016/j.ejmech.2008.06.002 HeLa 1
18640746 10.1016/j.ejmech.2008.06.002 MIA PaCa-2 1
18640746 10.1016/j.ejmech.2008.06.002 SW-620 1
18640746 10.1016/j.ejmech.2008.06.002 MCF7 1
18640746 10.1016/j.ejmech.2008.06.002 NCI-H460 1

Data from ChEMBL 36 via Core Engine