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Compound Detail

CHEMBL214493

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N=C(NO)c1ccc(-c2ccc(-c3ccc(/C(N)=N\O)cc3)nc2)cc1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL214493
Phase Preclinical
Structure Type MOL
InChI Key YOGNYUSOLBXXLD-UHFFFAOYSA-N
0
Targets
2
Activities
1
Assay Types
0
PK Parameters
4
Publications
0
Known Names

Molecular Properties

347.4
MW (Da)
2.81
ALogP
5
HBA
5
HBD
127.6
PSA (Ų)
0.21
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 C19H17N5O2
MW 347.38
Aromatic Rings 3
Heavy Atoms 26
NP-Likeness -0.72

Activity Summary

IC50 2 meas.

Literature References

PubMed DOI Target Context # Activities
16913722 10.1021/jm060470p Mus musculus 1
16913722 10.1021/jm060470p L6 1
16913722 10.1021/jm060470p Plasmodium falciparum 1
16913722 10.1021/jm060470p Trypanosoma brucei rhodesiense 1

Data from ChEMBL 36 via Core Engine