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Compound Detail

CHEMBL2220148

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C[C@@H](N)[C@H]1O[C@@H](O[C@@H]2[C@@H](O)[C@H](NC(=O)[C@@H](O)CCN)C[C@H](N)[C@H]2O[C@H]2O[C@H]([C@@H](C)O)[C@@H](O)[C@H](O)[C@H]2N)[C@H](O)[C@@H]1O

Basic Information

ChEMBL ID CHEMBL2220148
Phase Preclinical
Structure Type MOL
InChI Key NNXUZMHYTAUGFA-WKDOJIPSSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

583.6
MW (Da)
-7.01
ALogP
16
HBA
12
HBD
311.7
PSA (Ų)
0.11
QED
3
Ro5 Violations
10
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C23H45N5O12
MW 583.64
Aromatic Rings 0
Heavy Atoms 40
NP-Likeness 1.41

Data from ChEMBL 36 via Core Engine