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Compound Detail

CHEMBL4646146

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C/C(=C\c1ccccc1)[C@@H]1C[C@H]1NC1CCNCC1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL4646146
Phase Preclinical
Structure Type MOL
InChI Key RRJQCPJNFDPJGT-KORIGIIASA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

256.4
MW (Da)
2.82
ALogP
2
HBA
2
HBD
24.1
PSA (Ų)
0.87
QED
0
Ro5 Violations
4
Rot. Bonds

Drug Information

Molecule Type Unknown
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C17H24N2
MW 256.39
Aromatic Rings 1
Heavy Atoms 19

Literature References

PubMed DOI Target Context # Activities
32551003 10.1021/acsmedchemlett.0c00060 Lysine-specific histone demethylase 1A 2

Data from ChEMBL 36 via Core Engine