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Compound Detail

CHEMBL1823510

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C[C@H](Cn1cnc2c(N)nc(F)nc21)OCP(=O)(O)O
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL1823510
Phase Preclinical
Structure Type MOL
InChI Key UPNIDJCZEOITGV-RXMQYKEDSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
2
Publications
0
Known Names

Molecular Properties

305.2
MW (Da)
0.09
ALogP
7
HBA
3
HBD
136.4
PSA (Ų)
0.52
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 C9H13FN5O4P
MW 305.21
Aromatic Rings 2
Heavy Atoms 20
NP-Likeness -0.28

Literature References

PubMed DOI Target Context # Activities
21664011 10.1016/j.ejmech.2011.05.040 Human immunodeficiency virus 1 1
21664011 10.1016/j.ejmech.2011.05.040 MT2 1

Data from ChEMBL 36 via Core Engine