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Compound Detail

CHEMBL2205336

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N#CC(CCN1CCC(N)CC1)(c1ccccc1)c1ccccc1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL2205336
Phase Preclinical
Structure Type MOL
InChI Key MYUNWKYEAPYPNH-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
3
Publications
0
Known Names

Molecular Properties

319.4
MW (Da)
3.31
ALogP
3
HBA
1
HBD
53.0
PSA (Ų)
0.92
QED
0
Ro5 Violations
5
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C21H25N3
MW 319.45
Aromatic Rings 2
Heavy Atoms 24
NP-Likeness -0.68

Literature References

PubMed DOI Target Context # Activities
27173385 10.1016/j.ejmech.2016.04.058 Plasmodium falciparum 9
23084278 10.1016/j.bmcl.2012.09.080 Potassium voltage-gated channel subfamily A member 3 1
27173385 10.1016/j.ejmech.2016.04.058 Unchecked 1

Data from ChEMBL 36 via Core Engine