ZINC4215639

Added Availability Since Mwt logP Download
2005-11-15 In-Stock 2015-08-07 327.424 2.806
Mol Formula Rings Heavy Atoms Hetero Atoms Fraction sp3 Tranche
C20H25NO3 2 24 4 0.35 EFAB
ZINC4215639
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Available 3D Representations

pH range Net
charge		 H-bond
donors		 H-bond
acceptors		 tPSA Ų Rotatable
bonds		 Apolar
desolvationkcal/mol		 Polar
desolvationkcal/mol		 Download
Reference 1 2 3 50 6 9.69 -36.71
High pH (8.4) 0 1 4 49 6 7.35 -6.91
4 Items Total

Vendors (3 Total)

Building Blocks Tetrahedron Building Blocks
Compound Cloud
  • 165124
Building Blocks R.R Scientific
1 Items Total

Annotated Catalogs (1 Total)

In Man KEGG-D via PubChem

Activities based on ChEMBL 20

Run SEA

SEA Predictions based on ChEMBL 20

Gene Description Target Class P-Value Max Tc
CHRM3 Muscarinic acetylcholine receptor M3 membrane receptor / GPCR-A 15 52
CHRM4 Muscarinic acetylcholine receptor M4 membrane receptor / GPCR-A 15 47
CHRM2 Muscarinic acetylcholine receptor M2 membrane receptor / GPCR-A 17 40
AMY2 Pancreatic alpha-amylase enzyme / enzyme-other 67 43
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Interesting Analogs

Framework of this compound

ZINC4215639

ZINC4215639

Nothing else with this framework

Sources of Ambiguity Find More Google

Scaffold of this Compound

CZZYITDELCSZES-UHFFFAOYSA-N

Substance Rings

benzene

Molecular Patterns (Warnings, etc.)

alcohol-tertiary
reagent

References

This substance is not reported in any publications per ChEMBL.

Clinical Trials

This substance has not been detected to have been used in any clinical trials.

Additional Identifiers (Synonyms/CAS Numbers/etc.)