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Compound Detail

CHEMBL104233

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N=C(N)SCCCCSC(=N)N
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL104233
Phase Preclinical
Structure Type MOL
InChI Key PTMXPRBEWOQFQC-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

206.3
MW (Da)
1.02
ALogP
4
HBA
4
HBD
99.7
PSA (Ų)
0.31
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 C6H14N4S2
MW 206.34
Aromatic Rings 0
Heavy Atoms 12
NP-Likeness -0.33

Literature References

PubMed DOI Target Context # Activities
7636868 10.1021/jm00016a008 Deoxyhypusine synthase 2

Data from ChEMBL 36 via Core Engine