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Compound Detail

CHEMBL1184168

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OCCCNCC1CCc2ccc(O)cc2O1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL1184168
Phase Preclinical
Structure Type MOL
InChI Key YEENTVNLGWCDRF-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

237.3
MW (Da)
1.06
ALogP
4
HBA
3
HBD
61.7
PSA (Ų)
0.67
QED
0
Ro5 Violations
5
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C13H19NO3
MW 237.30
Aromatic Rings 1
Heavy Atoms 17
NP-Likeness 0.92

Data from ChEMBL 36 via Core Engine