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Compound Detail

CHEMBL306840

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FC(F)(F)CNCCCNCCCCNCCCNCC(F)(F)F
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL306840
Phase Preclinical
Structure Type MOL
InChI Key BWFFJKUUEUOBNI-UHFFFAOYSA-N
0
Targets
4
Activities
1
Assay Types
0
PK Parameters
13
Publications
0
Known Names

Molecular Properties

366.4
MW (Da)
2.03
ALogP
4
HBA
4
HBD
48.1
PSA (Ų)
0.26
QED
0
Ro5 Violations
15
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C14H28F6N4
MW 366.39
Aromatic Rings 0
Heavy Atoms 24
NP-Likeness -0.53

Activity Summary

Ki 4 meas.

Literature References

PubMed DOI Target Context # Activities
11170633 10.1021/jm000277+ Rattus norvegicus 12
15857111 10.1021/jm050024m L1210 7
7608892 10.1021/jm00013a003 L1210 6
7608892 10.1021/jm00013a003 No relevant target 4
8978854 10.1021/jm960545x ADMET 4
15943485 10.1021/jm048974f L1210 4
7608892 10.1021/jm00013a003 Ornithine decarboxylase 1
7608892 10.1021/jm00013a003 Unchecked 1
7608892 10.1021/jm00013a003 Spermidine/spermine N(1)-acetyltransferase (SAT) 1
8691443 10.1021/jm950827h L1210 1
15857111 10.1021/jm050024m Spermidine/spermine N(1)-acetyltransferase (SAT) 1
15857111 10.1021/jm050024m Ornithine decarboxylase 1
15857111 10.1021/jm050024m Unchecked 1

Data from ChEMBL 36 via Core Engine