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Compound Detail

CHEMBL5632487

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O=C(c1cc(-n2ccc3ccccc32)ccc1O)N1Cc2ccccc2C1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL5632487
Phase Preclinical
Structure Type MOL
InChI Key WNLFFXXRNPJNNR-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
5
Publications
0
Known Names

Molecular Properties

354.4
MW (Da)
4.49
ALogP
3
HBA
1
HBD
45.5
PSA (Ų)
0.58
QED
0
Ro5 Violations
2
Rot. Bonds

Drug Information

Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C23H18N2O2
MW 354.41
Aromatic Rings 4
Heavy Atoms 27
NP-Likeness -1.05

Literature References

PubMed DOI Target Context # Activities
37307624 10.1016/j.ejmech.2023.115531 Heat shock protein 75 kDa, mitochondrial 1
37307624 10.1016/j.ejmech.2023.115531 Endoplasmin 1
37307624 10.1016/j.ejmech.2023.115531 Heat shock protein HSP 90-alpha 1
37307624 10.1016/j.ejmech.2023.115531 Heat shock protein HSP 90-beta 1
37307624 10.1016/j.ejmech.2023.115531 Unchecked 1

Data from ChEMBL 36 via Core Engine