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Compound Detail

CHEMBL2221147

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COc1cccc(OC)c1OCCNC[C@H]1COc2cccc(OC)c2O1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL2221147
Phase Preclinical
Structure Type MOL
InChI Key UIFMGKZUSHZGFQ-AWEZNQCLSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

375.4
MW (Da)
2.52
ALogP
7
HBA
1
HBD
67.4
PSA (Ų)
0.68
QED
0
Ro5 Violations
9
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C20H25NO6
MW 375.42
Aromatic Rings 2
Heavy Atoms 27
NP-Likeness 0.05

Data from ChEMBL 36 via Core Engine