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Compound Detail

CHEMBL5410379

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O=C1CN(c2nc3cc(Cl)ccc3n2Cc2ccccc2)CCN1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL5410379
Phase Preclinical
Structure Type MOL
InChI Key YHRPRELONFQAKZ-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

340.8
MW (Da)
2.67
ALogP
4
HBA
1
HBD
50.2
PSA (Ų)
0.80
QED
0
Ro5 Violations
3
Rot. Bonds

Drug Information

Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C18H17ClN4O
MW 340.81
Aromatic Rings 3
Heavy Atoms 24
NP-Likeness -1.75

Literature References

PubMed DOI Target Context # Activities
37357390 10.1021/acs.jmedchem.3c00206 Plasmodium falciparum 1

Data from ChEMBL 36 via Core Engine