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Compound Detail

CHEMBL233574

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CC(C)Oc1ccc(C(=O)N(Cc2ccccc2Cl)C2CCNC2)cc1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL233574
Phase Preclinical
Structure Type MOL
InChI Key PXWUXUQDTWMHMK-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

372.9
MW (Da)
4.13
ALogP
3
HBA
1
HBD
41.6
PSA (Ų)
0.83
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 C21H25ClN2O2
MW 372.90
Aromatic Rings 2
Heavy Atoms 26
NP-Likeness -1.50

Literature References

PubMed DOI Target Context # Activities
17583500 10.1016/j.bmcl.2007.06.031 Membrane-bound transcription factor site-1 protease 1

Data from ChEMBL 36 via Core Engine