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Compound Detail

CHEMBL3952410

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O=C(Cc1ccccc1)NC[C@H](O)CN1CCc2ccccc2C1

Basic Information

ChEMBL ID CHEMBL3952410
Phase Preclinical
Structure Type MOL
InChI Key IVYDHNJIVLFCFB-IBGZPJMESA-N
2
Targets
3
Activities
1
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

324.4
MW (Da)
1.76
ALogP
3
HBA
2
HBD
52.6
PSA (Ų)
0.85
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 C20H24N2O2
MW 324.42
Aromatic Rings 2
Heavy Atoms 24
NP-Likeness -1.08

Activity Summary

IC50 3 meas. best 7.0

Target Activity Profile

Target Type Best pChEMBL Mean pChEMBL Best (nM) # Data
PRMT5/MEP50 complex
CHEMBL3137261
IC50 7.0 6.63 101.0 2
Protein arginine N-methyltransferase 5
CHEMBL1795116
IC50 6.26 6.26 550.0 1

Activity Data Samples

Top measurements by pChEMBL value

Data from ChEMBL 36 via Core Engine