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Compound Detail

CHEMBL1191812

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CCOC(=O)C1CCCN(CCOC(c2ccc(Cl)cc2)c2ccc(Cl)cc2)C1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL1191812
Phase Preclinical
Structure Type MOL
InChI Key IONXAOIHSBYWRM-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

436.4
MW (Da)
5.37
ALogP
4
HBA
0
HBD
38.8
PSA (Ų)
0.52
QED
1
Ro5 Violations
8
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C23H27Cl2NO3
MW 436.38
Aromatic Rings 2
Heavy Atoms 29
NP-Likeness -0.94

Data from ChEMBL 36 via Core Engine