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Compound Detail

CHEMBL1191966

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c1ccc2c(c1)OCC(CN1CCN(c3cccc4c3OCCO4)CC1)O2
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL1191966
Phase Preclinical
Structure Type MOL
InChI Key OXYYVVAPCYJQBT-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

368.4
MW (Da)
2.42
ALogP
6
HBA
0
HBD
43.4
PSA (Ų)
0.83
QED
0
Ro5 Violations
3
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C21H24N2O4
MW 368.43
Aromatic Rings 2
Heavy Atoms 27
NP-Likeness -0.75

Data from ChEMBL 36 via Core Engine