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Compound Detail

CHEMBL3335094

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N/C(=N\N=C\c1ccccc1)C(O)c1ccc2ccccc2c1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL3335094
Phase Preclinical
Structure Type MOL
InChI Key NDVQWRNVGIJXPF-FYJGNVAPSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
3
Publications
0
Known Names

Molecular Properties

303.4
MW (Da)
3.26
ALogP
3
HBA
2
HBD
71.0
PSA (Ų)
0.44
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 C19H17N3O
MW 303.37
Aromatic Rings 3
Heavy Atoms 23
NP-Likeness -0.51

Literature References

PubMed DOI Target Context # Activities
25195945 10.1021/jm500811p Plasmodium falciparum 3
25195945 10.1021/jm500811p L6 1
25195945 10.1021/jm500811p Unchecked 1

Data from ChEMBL 36 via Core Engine