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Compound Detail

CHEMBL3039864

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O=C1NNC(=O)c2c(ncn2[C@H]2O[C@@H](COP(=O)(O)OP(=O)(O)OP(=O)(O)O)[C@H](O)[C@@H]2O)N1

Basic Information

ChEMBL ID CHEMBL3039864
Phase Preclinical
Structure Type MOL
InChI Key RIIAYTHWCIBBHI-GIMIYPNGSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

539.2
MW (Da)
-2.37
ALogP
13
HBA
9
HBD
297.6
PSA (Ų)
0.16
QED
3
Ro5 Violations
8
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C10H16N5O15P3
MW 539.18
Aromatic Rings 1
Heavy Atoms 33
NP-Likeness 1.26

Data from ChEMBL 36 via Core Engine