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Compound Detail

CHEMBL1390274

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CCOc1ccc2nc(O)c(CN(CC3COCCO3)C(=O)C3CC3)cc2c1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL1390274
Phase Preclinical
Structure Type MOL
InChI Key HPLSDZDHRCCDEF-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

386.4
MW (Da)
2.49
ALogP
6
HBA
1
HBD
81.1
PSA (Ų)
0.79
QED
0
Ro5 Violations
7
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C21H26N2O5
MW 386.45
Aromatic Rings 2
Heavy Atoms 28
NP-Likeness -1.32

Data from ChEMBL 36 via Core Engine