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Compound Detail

CHEMBL4595195

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CCN(CCCCNC(=O)c1ccc2ccccc2c1)CC1CC1c1cc(Cl)ccc1OC

Basic Information

ChEMBL ID CHEMBL4595195
Phase Preclinical
Structure Type MOL
InChI Key ZDSNNBAEOSSBQF-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

465.0
MW (Da)
6.14
ALogP
3
HBA
1
HBD
41.6
PSA (Ų)
0.35
QED
1
Ro5 Violations
11
Rot. Bonds

Drug Information

Molecule Type Unknown
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C28H33ClN2O2
MW 465.04
Aromatic Rings 3
Heavy Atoms 33
NP-Likeness -0.71

Data from ChEMBL 36 via Core Engine