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Compound Detail

CHEMBL1199753

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

Basic Information

ChEMBL ID CHEMBL1199753
Phase Preclinical
Structure Type MOL
InChI Key NTWBENDTKLFVBT-JANFQQFMSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

478.2
MW (Da)
-3.24
ALogP
13
HBA
7
HBD
247.3
PSA (Ų)
0.16
QED
2
Ro5 Violations
10
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C12H20N2O14P2
MW 478.24
Aromatic Rings 1
Heavy Atoms 30
NP-Likeness 1.55

Data from ChEMBL 36 via Core Engine