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Compound Detail

CHEMBL1199582

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CCCCNCc1ccc(CN2CCN(c3ccccc3OC(C)C)CC2)cc1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL1199582
Phase Preclinical
Structure Type MOL
InChI Key KHNQSFSBOKQODI-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

395.6
MW (Da)
4.69
ALogP
4
HBA
1
HBD
27.7
PSA (Ų)
0.59
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 C25H37N3O
MW 395.59
Aromatic Rings 2
Heavy Atoms 29
NP-Likeness -1.26

Data from ChEMBL 36 via Core Engine