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Compound Detail

CHEMBL5561994

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Cc1nc2ccccc2cc1C(=O)N/N=C/c1cccc(Cl)c1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL5561994
Phase Preclinical
Structure Type MOL
InChI Key IHUOVSIGQDWEFD-RGVLZGJSSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
4
Publications
0
Known Names

Molecular Properties

323.8
MW (Da)
3.96
ALogP
3
HBA
1
HBD
54.4
PSA (Ų)
0.59
QED
0
Ro5 Violations
3
Rot. Bonds

Drug Information

Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C18H14ClN3O
MW 323.78
Aromatic Rings 3
Heavy Atoms 23
NP-Likeness -2.02

Literature References

PubMed DOI Target Context # Activities
38795517 10.1016/j.ejmech.2024.116524 U-266 1
38795517 10.1016/j.ejmech.2024.116524 U-937 1
38795517 10.1016/j.ejmech.2024.116524 K562 1
38795517 10.1016/j.ejmech.2024.116524 OCI-AML2 1

Data from ChEMBL 36 via Core Engine