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Compound Detail

CHEMBL4596108

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c1ccc(-c2ccc(OCCCCCN3CCCCCC3)cc2)cc1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL4596108
Phase Preclinical
Structure Type MOL
InChI Key MGNUUPFOORCXCU-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

337.5
MW (Da)
5.78
ALogP
2
HBA
0
HBD
12.5
PSA (Ų)
0.57
QED
1
Ro5 Violations
8
Rot. Bonds

Drug Information

Molecule Type Unknown
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C23H31NO
MW 337.51
Aromatic Rings 2
Heavy Atoms 25
NP-Likeness -0.80

Data from ChEMBL 36 via Core Engine