Skip to main content
Free research Free research Free compound review with research home and workspace preview
Quick search ChEMBL 36
Compound Detail

CHEMBL2206424

Enter ChEMBL ID:
Free Research Context This compound will appear in recent viewed items on the research home for this browser.
Research home View demo workspace
C/C1=C\CC[C@@]2(C)O[C@@H]2[C@H]2OC(=O)[C@@H](Cn3cc(CCCCO)nn3)[C@@H]2CC1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL2206424
Phase Preclinical
Structure Type MOL
InChI Key SLZDIOMHJBBUNS-MEIYGFOISA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
3
Publications
0
Known Names

Molecular Properties

389.5
MW (Da)
2.43
ALogP
7
HBA
1
HBD
89.8
PSA (Ų)
0.35
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 C21H31N3O4
MW 389.50
Aromatic Rings 1
Heavy Atoms 28
NP-Likeness 1.62

Literature References

PubMed DOI Target Context # Activities
22985027 10.1021/jm301064b No relevant target 1
22985027 10.1021/jm301064b NON-PROTEIN TARGET 1
22985027 10.1021/jm301064b HL-60 1

Data from ChEMBL 36 via Core Engine