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Compound Detail

CHEMBL218256

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Nc1ncnc2c1ncn2CCOC[PH](=O)O

Basic Information

ChEMBL ID CHEMBL218256
Phase Preclinical
Structure Type MOL
InChI Key UFBOSGWODVUGOR-UHFFFAOYSA-N
0
Targets
2
Activities
1
Assay Types
3
PK Parameters
17
Publications
0
Known Names

Molecular Properties

257.2
MW (Da)
-0.15
ALogP
7
HBA
2
HBD
116.2
PSA (Ų)
0.56
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 C8H12N5O3P
MW 257.19
Aromatic Rings 2
Heavy Atoms 17
NP-Likeness -0.86

Activity Summary

EC50 2 meas.

Pharmacokinetic Data

Parameter Value Units Species
T1/2 72.0 hr -
T1/2 72.0 hr -
T1/2 72.0 hr -

Literature References

PubMed DOI Target Context # Activities
17181162 10.1021/jm060030y No relevant target 8
17181162 10.1021/jm060030y ADMET 3
17181162 10.1021/jm060030y Human alphaherpesvirus 1 2
17181162 10.1021/jm060030y Sindbis virus 1
17181162 10.1021/jm060030y Hepatitis C virus 1
17181162 10.1021/jm060030y Human immunodeficiency virus 1 1
17181162 10.1021/jm060030y Vero 1
17181162 10.1021/jm060030y Punta Toro virus 1
17181162 10.1021/jm060030y Mammalian orthoreovirus 1 1
17181162 10.1021/jm060030y Human respirovirus 3 1
17181162 10.1021/jm060030y HeLa 1
17181162 10.1021/jm060030y Respiratory syncytial virus 1
17181162 10.1021/jm060030y Coxsackievirus B4 1
17181162 10.1021/jm060030y HEL 1
17181162 10.1021/jm060030y Vesicular stomatitis virus 1
17181162 10.1021/jm060030y Vaccinia virus 1
17181162 10.1021/jm060030y Human alphaherpesvirus 2 1

Data from ChEMBL 36 via Core Engine