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Compound Detail

CHEMBL419358

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COCCN(CCOC)CC(O)(C(=O)OC1CN2CCC1CC2)c1ccccc1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL419358
Phase Preclinical
Structure Type MOL
InChI Key VXUQATLVMBSIEV-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

406.5
MW (Da)
1.11
ALogP
7
HBA
1
HBD
71.5
PSA (Ų)
0.55
QED
0
Ro5 Violations
11
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C22H34N2O5
MW 406.52
Aromatic Rings 1
Heavy Atoms 29
NP-Likeness -0.03

Data from ChEMBL 36 via Core Engine