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Compound Detail

CHEMBL1616834

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CN1CCN(CC(=O)NN(Cc2ccccc2)c2ccccc2)CC1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL1616834
Phase Preclinical
Structure Type MOL
InChI Key QNTQDUREXIEJQC-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
4
Publications
0
Known Names

Molecular Properties

338.5
MW (Da)
1.97
ALogP
4
HBA
1
HBD
38.8
PSA (Ų)
0.82
QED
0
Ro5 Violations
6
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

Natural Product First in Class Prodrug

Extended Properties

Molecular Formula C20H26N4O
MW 338.46
Aromatic Rings 2
Heavy Atoms 25
NP-Likeness -1.38

Literature References

PubMed DOI Target Context # Activities
37021830 10.1021/acs.jmedchem.2c01785 Ebolavirus 1
37021830 10.1021/acs.jmedchem.2c01785 HeLa 1
37021830 10.1021/acs.jmedchem.2c01785 Zaire ebolavirus 1
37021830 10.1021/acs.jmedchem.2c01785 Vero C1008 1

Data from ChEMBL 36 via Core Engine