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Compound Detail

CHEMBL1191655

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CCCNCCc1ccc(OC)c(OCCc2ccccc2)c1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL1191655
Phase Preclinical
Structure Type MOL
InChI Key AEQMNSOSQSZZIB-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

313.4
MW (Da)
3.86
ALogP
3
HBA
1
HBD
30.5
PSA (Ų)
0.68
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 C20H27NO2
MW 313.44
Aromatic Rings 2
Heavy Atoms 23
NP-Likeness -0.25

Data from ChEMBL 36 via Core Engine