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Compound Detail

CHEMBL3342267

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O=C(CCC(c1ccccc1)P(=O)(O)O)Nc1ccccc1O
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL3342267
Phase Preclinical
Structure Type MOL
InChI Key SLXJOFHITNWUEB-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
3
Publications
0
Known Names

Molecular Properties

335.3
MW (Da)
3.03
ALogP
3
HBA
4
HBD
106.9
PSA (Ų)
0.48
QED
0
Ro5 Violations
6
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C16H18NO5P
MW 335.30
Aromatic Rings 2
Heavy Atoms 23
NP-Likeness -0.37

Literature References

PubMed DOI Target Context # Activities
25254502 10.1021/jm500850y 1-deoxy-D-xylulose 5-phosphate reductoisomerase 2
25254502 10.1021/jm500850y Unchecked 1
25254502 10.1021/jm500850y Plasmodium falciparum 1

Data from ChEMBL 36 via Core Engine