VU0155094

Ligand id: 10238

Name: VU0155094

Structure and Physico-chemical Properties

2D Structure
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Calculated Physico-chemical Properties
Hydrogen bond acceptors 5
Hydrogen bond donors 1
Rotatable bonds 9
Topological polar surface area 102.18
Molecular weight 436.15
XLogP 4.11
No. Lipinski's rules broken 0

Molecular properties generated using the CDK

Classification
Compound class Synthetic organic
IUPAC Name
methyl 4-[3-[2-(4-acetamidophenyl)sulfanylacetyl]-2,5-dimethylpyrrol-1-yl]benzoate
Synonyms
ML 397 | ML-397 | ML397 | VU 0155094 | VU-0155094
Comments
VU0155094 is a potent, selective pan-Group III mGlu positive allosteric modulator.
Database Links
CAS Registry No. 731006-86-3
GtoPdb PubChem SID 381744920
PubChem CID 4043841
Search Google for chemical match using the InChIKey BCNKQXDDMIBITO-UHFFFAOYSA-N
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Search UniChem for chemical match using the InChIKey BCNKQXDDMIBITO-UHFFFAOYSA-N
Search UniChem for chemicals with the same backbone BCNKQXDDMIBITO