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Compound Detail

CHEMBL1618482

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CN1CCC(C(=O)OCc2ccc(Cl)c(Cl)c2)(c2ccc(Cl)c(Cl)c2)CC1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL1618482
Phase Preclinical
Structure Type MOL
InChI Key ZYVIOTLQWPTJJB-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

447.2
MW (Da)
6.01
ALogP
3
HBA
0
HBD
29.5
PSA (Ų)
0.54
QED
1
Ro5 Violations
4
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C20H19Cl4NO2
MW 447.19
Aromatic Rings 2
Heavy Atoms 27
NP-Likeness -0.63

Data from ChEMBL 36 via Core Engine