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Compound Detail

CHEMBL4598147

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O=C(CCN1CCOCC1)c1cc2ccc(O)cc2oc1=O
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL4598147
Phase Preclinical
Structure Type MOL
InChI Key HPCMVHHTNGJDDZ-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

303.3
MW (Da)
1.40
ALogP
6
HBA
1
HBD
80.0
PSA (Ų)
0.68
QED
0
Ro5 Violations
4
Rot. Bonds

Drug Information

Molecule Type Unknown
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C16H17NO5
MW 303.31
Aromatic Rings 2
Heavy Atoms 22
NP-Likeness -0.54

Data from ChEMBL 36 via Core Engine