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Compound Detail

CHEMBL1199752

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O=c1ccn([C@@H]2O[C@H](COP(=O)(O)OP(=O)(O)O)[C@@H](O)[C@@H]2F)c(=O)[nH]1

Basic Information

ChEMBL ID CHEMBL1199752
Phase Preclinical
Structure Type MOL
InChI Key GPPKODXOVXLGIG-PXBUCIJWSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

406.1
MW (Da)
-1.64
ALogP
9
HBA
5
HBD
197.6
PSA (Ų)
0.34
QED
0
Ro5 Violations
6
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C9H13FN2O11P2
MW 406.15
Aromatic Rings 1
Heavy Atoms 25
NP-Likeness 1.20

Data from ChEMBL 36 via Core Engine