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Compound Detail

CHEMBL37429

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CCOC(=O)CCN1CCN(CCOC(c2ccccc2)c2ccccc2Cl)CC1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL37429
Phase Preclinical
Structure Type MOL
InChI Key AFJWSUJZMSSOSI-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

431.0
MW (Da)
4.02
ALogP
5
HBA
0
HBD
42.0
PSA (Ų)
0.53
QED
0
Ro5 Violations
10
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C24H31ClN2O3
MW 430.98
Aromatic Rings 2
Heavy Atoms 30
NP-Likeness -0.90

Data from ChEMBL 36 via Core Engine