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Compound Detail

CHEMBL314735

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COP(=O)(OC)C(=O)Oc1ccc([N+](=O)[O-])cc1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL314735
Phase Preclinical
Structure Type MOL
InChI Key LENOEKSPZDHTDQ-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
2
Publications
0
Known Names

Molecular Properties

275.1
MW (Da)
2.58
ALogP
7
HBA
0
HBD
105.0
PSA (Ų)
0.46
QED
0
Ro5 Violations
5
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C9H10NO7P
MW 275.15
Aromatic Rings 1
Heavy Atoms 18
NP-Likeness -0.75

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