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Compound Detail

CHEMBL330012

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CCOC(=O)c1ccc(OC(=O)P(=O)(OCC)OCC)cc1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL330012
Phase Preclinical
Structure Type MOL
InChI Key HCCIYAQAHHSQLD-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
2
Publications
0
Known Names

Molecular Properties

330.3
MW (Da)
3.63
ALogP
7
HBA
0
HBD
88.1
PSA (Ų)
0.53
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 C14H19O7P
MW 330.27
Aromatic Rings 1
Heavy Atoms 22
NP-Likeness -0.29

Literature References

PubMed DOI Target Context # Activities
6298425 10.1021/jm00356a028 DNA polymerase catalytic subunit 1
6298425 10.1021/jm00356a028 Human alphaherpesvirus 1 1

Data from ChEMBL 36 via Core Engine