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Compound Detail

CHEMBL1192628

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CC(C)Oc1ccccc1N1CCN(Cc2ccc(CCN3CCCCC3=O)n2C)CC1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL1192628
Phase Preclinical
Structure Type MOL
InChI Key GHSIPNWAVPZPAC-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

438.6
MW (Da)
3.69
ALogP
5
HBA
0
HBD
41.0
PSA (Ų)
0.63
QED
0
Ro5 Violations
8
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C26H38N4O2
MW 438.62
Aromatic Rings 2
Heavy Atoms 32
NP-Likeness -1.21

Data from ChEMBL 36 via Core Engine