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Compound Detail

CHEMBL5175723

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Cc1ccc(COc2cncc3nnc(-c4ccc(C(C)C)cc4)n23)cn1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL5175723
Phase Preclinical
Structure Type MOL
InChI Key SDIDAZZAIJNBKW-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
2
Publications
0
Known Names

Molecular Properties

359.4
MW (Da)
4.20
ALogP
6
HBA
0
HBD
65.2
PSA (Ų)
0.53
QED
0
Ro5 Violations
5
Rot. Bonds

Drug Information

Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C21H21N5O
MW 359.43
Aromatic Rings 4
Heavy Atoms 27
NP-Likeness -1.34

Literature References

PubMed DOI Target Context # Activities
34748707 10.1021/acs.jmedchem.1c00313 Unchecked 2
34748707 10.1021/acs.jmedchem.1c00313 Plasmodium falciparum 1

Data from ChEMBL 36 via Core Engine