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Compound Detail

CHEMBL145286

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Oc1c2nnnc-2c2cccnc2n1-c1ccccc1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL145286
Phase Preclinical
Structure Type MOL
InChI Key MFUYOPWIHJHUQJ-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

263.3
MW (Da)
2.02
ALogP
6
HBA
1
HBD
76.7
PSA (Ų)
0.57
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 C14H9N5O
MW 263.26
Aromatic Rings 2
Heavy Atoms 20
NP-Likeness -1.20

Literature References

PubMed DOI Target Context # Activities
1479586 10.1021/jm00104a013 Cavia porcellus 1

Data from ChEMBL 36 via Core Engine