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Compound Detail

CHEMBL1824657

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CCCc1cc(-c2ccc(-c3ccc(C)cc3)cc2)ccn1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL1824657
Phase Preclinical
Structure Type MOL
InChI Key YFSRLIVDAWXGDM-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

287.4
MW (Da)
5.68
ALogP
1
HBA
0
HBD
12.9
PSA (Ų)
0.60
QED
1
Ro5 Violations
4
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C21H21N
MW 287.41
Aromatic Rings 3
Heavy Atoms 22
NP-Likeness -0.63

Literature References

PubMed DOI Target Context # Activities
21561152 10.1021/jm200304y Sterol regulatory element-binding protein 2 1

Data from ChEMBL 36 via Core Engine