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Compound Detail

CHEMBL3218770

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Cc1cc(NC(=O)Cn2cc(-c3cccc(O)c3)nn2)no1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL3218770
Phase Preclinical
Structure Type MOL
InChI Key DGQOQRYQYXOOOV-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

299.3
MW (Da)
1.59
ALogP
7
HBA
2
HBD
106.1
PSA (Ų)
0.76
QED
0
Ro5 Violations
4
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C14H13N5O3
MW 299.29
Aromatic Rings 3
Heavy Atoms 22
NP-Likeness -2.28

Literature References

PubMed DOI Target Context # Activities
- 10.1039/C1MD00129A Unchecked 1

Data from ChEMBL 36 via Core Engine