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Compound Detail

CHEMBL68666

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CC(C)=CCCN(C)CCOP(=O)(O)OP(=O)(O)O
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL68666
Phase Preclinical
Structure Type MOL
InChI Key UWHNDWYDKGVRGE-UHFFFAOYSA-N
0
Targets
1
Activities
1
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

317.2
MW (Da)
1.50
ALogP
5
HBA
3
HBD
116.5
PSA (Ų)
0.43
QED
0
Ro5 Violations
9
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

Natural Product First in Class Prodrug

Extended Properties

Molecular Formula C9H21NO7P2
MW 317.22
Aromatic Rings 0
Heavy Atoms 19
NP-Likeness 1.09

Activity Summary

IC50 1 meas.

Literature References

PubMed DOI Target Context # Activities
12014956 10.1021/jm010412y Geranylgeranyl pyrophosphate synthase 1

Data from ChEMBL 36 via Core Engine