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Compound Detail

CHEMBL1795983

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Cl.N[C@@H]1C[C@H]1c1cccc(-c2ccccc2)c1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL1795983
Phase Preclinical
Structure Type MOL
InChI Key OUXPWENZZJMYFX-LDXVYITESA-N
Parent Compound CHEMBL1852768
Active Moiety CHEMBL1852768
0
Targets
1
Activities
1
Assay Types
0
PK Parameters
2
Publications
0
Known Names

Molecular Properties

209.3
MW (Da)
3.17
ALogP
1
HBA
1
HBD
26.0
PSA (Ų)
0.81
QED
0
Ro5 Violations
2
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C15H16ClN
MW 245.75
Aromatic Rings 2
Heavy Atoms 16
NP-Likeness 0.08

Activity Summary

IC50 1 meas.

Literature References

PubMed DOI Target Context # Activities
21382717 10.1016/j.bmc.2011.02.017 Lysine-specific histone demethylase 1A 1
21382717 10.1016/j.bmc.2011.02.017 LNCaP 1

Data from ChEMBL 36 via Core Engine