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Compound Detail

CHEMBL471524

FORMYCIN
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Nc1ncnc2c([C@@H]3O[C@H](CO)[C@@H](O)[C@H]3O)[nH]nc12

Basic Information

ChEMBL ID CHEMBL471524
Name FORMYCIN
Phase Preclinical
Structure Type MOL
InChI Key KBHMEHLJSZMEMI-KSYZLYKTSA-N
3
Targets
4
Activities
1
Assay Types
0
PK Parameters
20
Publications
0
Known Names

Molecular Properties

267.2
MW (Da)
-1.91
ALogP
8
HBA
5
HBD
150.4
PSA (Ų)
0.42
QED
0
Ro5 Violations
2
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

Natural Product First in Class Prodrug

Extended Properties

Molecular Formula C10H13N5O4
MW 267.25
Aromatic Rings 2
Heavy Atoms 19
NP-Likeness 0.85

Activity Summary

IC50 4 meas. best 7.54

Target Activity Profile

Target Type Best pChEMBL Mean pChEMBL Best (nM) # Data
Influenza A virus
CHEMBL613740
IC50 7.54 7.54 29.0 1
L1210
CHEMBL386
IC50 6.0 6.0 1000.0 1
Unchecked
CHEMBL612545
IC50 5.64 5.335 2300.0 2

Activity Data Samples

Top measurements by pChEMBL value

Literature References

PubMed DOI Target Context # Activities
3820218 10.1021/jm00386a007 L1210 4
3820218 10.1021/jm00386a007 Coxsackievirus B4 2
6737436 10.1021/jm00373a020 Vesicular stomatitis virus 2
4068000 10.1021/jm00149a033 Adenosine deaminase 2
6737436 10.1021/jm00373a020 Coxsackievirus B4 2
3820218 10.1021/jm00386a007 Vesicular stomatitis virus 2
3874961 10.1021/jm00146a020 Unchecked 2
3820218 10.1021/jm00386a007 Human alphaherpesvirus 2 1
3820218 10.1021/jm00386a007 Vaccinia virus 1
3820218 10.1021/jm00386a007 Human alphaherpesvirus 1 1
3820218 10.1021/jm00386a007 HeLa 1
3783585 10.1021/jm00161a017 L1210 1
3820218 10.1021/jm00386a007 Poliovirus 1 1
3820218 10.1021/jm00386a007 Vero 1
3820218 10.1021/jm00386a007 Mammalian orthoreovirus 1 1
3820218 10.1021/jm00386a007 Human respirovirus 3 1
35092894 10.1016/j.bmc.2022.116613 MDCK 1
3820218 10.1021/jm00386a007 Measles morbillivirus 1
3820218 10.1021/jm00386a007 Oryctolagus cuniculus 1
3783585 10.1021/jm00161a017 CCRF-CEM 1

Data from ChEMBL 36 via Core Engine