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Compound Detail

CHEMBL1789344

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NCCCCNCCCNC(=O)C(=O)c1c[nH]c2ccccc12
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL1789344
Phase Preclinical
Structure Type MOL
InChI Key TUOXXENDICUNMW-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
3
Publications
0
Known Names

Molecular Properties

316.4
MW (Da)
1.19
ALogP
4
HBA
4
HBD
100.0
PSA (Ų)
0.30
QED
0
Ro5 Violations
10
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

Natural Product First in Class Prodrug

Extended Properties

Molecular Formula C17H24N4O2
MW 316.41
Aromatic Rings 2
Heavy Atoms 23
NP-Likeness -0.31

Literature References

PubMed DOI Target Context # Activities
28886510 10.1016/j.ejmech.2017.08.014 Trypanosoma cruzi 1
28886510 10.1016/j.ejmech.2017.08.014 Leishmania donovani 1
28886510 10.1016/j.ejmech.2017.08.014 Trypanosoma brucei rhodesiense 1

Data from ChEMBL 36 via Core Engine