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Compound Detail

CHEMBL3577799

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CC1=CC(c2ccccc2)n2nc(NC(=O)c3ccc(F)cc3)nc2N1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL3577799
Phase Preclinical
Structure Type MOL
InChI Key AMAXJBPBVFMBHG-UHFFFAOYSA-N
0
Targets
1
Activities
1
Assay Types
0
PK Parameters
5
Publications
0
Known Names

Molecular Properties

349.4
MW (Da)
3.59
ALogP
5
HBA
2
HBD
71.8
PSA (Ų)
0.76
QED
0
Ro5 Violations
3
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C19H16FN5O
MW 349.37
Aromatic Rings 3
Heavy Atoms 26
NP-Likeness -1.48

Activity Summary

IC50 1 meas.

Literature References

PubMed DOI Target Context # Activities
25856229 10.1021/acs.jmedchem.5b00012 Influenza A virus 1
25856229 10.1021/acs.jmedchem.5b00012 PA/PB1 1
25856229 10.1021/acs.jmedchem.5b00012 HEK-293T 1
25856229 10.1021/acs.jmedchem.5b00012 MDCK 1
25856229 10.1021/acs.jmedchem.5b00012 Liver microsome 1

Data from ChEMBL 36 via Core Engine