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Compound Detail

CHEMBL1208085

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O=C(CP(=O)(O)O)NCCCc1cccc(Oc2ccccc2)c1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL1208085
Phase Preclinical
Structure Type MOL
InChI Key GNETVUVZFYJATO-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

349.3
MW (Da)
2.71
ALogP
3
HBA
3
HBD
95.9
PSA (Ų)
0.50
QED
0
Ro5 Violations
8
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C17H20NO5P
MW 349.32
Aromatic Rings 2
Heavy Atoms 24
NP-Likeness -0.45

Literature References

PubMed DOI Target Context # Activities
22662288 10.1021/ml300038t Farnesyl pyrophosphate synthase 1

Data from ChEMBL 36 via Core Engine