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Compound Detail

CHEMBL1188544

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COc1ccc(/C=C\c2cc(OC)c(OC)c(OC)c2)cc1OCCn1cccc1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL1188544
Phase Preclinical
Structure Type MOL
InChI Key HAIBARXXXCWHDY-FPLPWBNLSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

409.5
MW (Da)
4.77
ALogP
6
HBA
0
HBD
51.1
PSA (Ų)
0.45
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 C24H27NO5
MW 409.48
Aromatic Rings 3
Heavy Atoms 30
NP-Likeness -0.23

Data from ChEMBL 36 via Core Engine