COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL000153
Chemical Name: (2E)-2-{3-[(2,3-dimethylphenoxy)methyl]-4-methoxybenzylidene}-3,4-dihydronaphthalen-1(2H)-one
Smiles: COc1ccc(cc1COc1cccc(c1C)C)/C=C/1\CCc2c(C1=O)cccc2

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Molecular Weight: 398.5
Empirical Formula: C27H26O3

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 7.287
Rotatable bonds: 5
H-donors: 0
H-acceptors: 3
PSA: 35
Number of rings: 4

     

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