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Compound Detail

CHEMBL1207404

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CC(C)COc1ccc(Cl)cc1Cc1ccc(C(=O)O)o1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL1207404
Phase Preclinical
Structure Type MOL
InChI Key ZEHWERAKUBFCFN-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

308.8
MW (Da)
4.26
ALogP
3
HBA
1
HBD
59.7
PSA (Ų)
0.87
QED
0
Ro5 Violations
6
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C16H17ClO4
MW 308.76
Aromatic Rings 2
Heavy Atoms 21
NP-Likeness -0.72

Data from ChEMBL 36 via Core Engine