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Compound Detail

CHEMBL1189211

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c1ccc(CCN2CCN(c3cccc4c3OCCO4)CC2)cc1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL1189211
Phase Preclinical
Structure Type MOL
InChI Key JBMZHGZBDAITFW-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

324.4
MW (Da)
2.82
ALogP
4
HBA
0
HBD
24.9
PSA (Ų)
0.86
QED
0
Ro5 Violations
4
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C20H24N2O2
MW 324.42
Aromatic Rings 2
Heavy Atoms 24
NP-Likeness -0.94

Data from ChEMBL 36 via Core Engine