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

CHEMBL197710

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
CN1C2CCC1[C@@H](Cc1ccccc1)C(=O)[C@H]2Cc1ccccc1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL197710
Phase Preclinical
Structure Type MOL
InChI Key AIZSASCLTDQWPG-WHSGIHJSSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

319.4
MW (Da)
3.75
ALogP
2
HBA
0
HBD
20.3
PSA (Ų)
0.86
QED
0
Ro5 Violations
4
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C22H25NO
MW 319.45
Aromatic Rings 2
Heavy Atoms 24
NP-Likeness 0.46

Literature References

PubMed DOI Target Context # Activities
16112864 10.1016/j.bmcl.2005.07.032 Synaptic vesicular amine transporter 3

Data from ChEMBL 36 via Core Engine