COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK396802
Chemical Name: 2-({4-[(1,3-dioxo-1,3-dihydro-2H-inden-2-ylidene)methyl]-2-methoxyphenoxy}methyl)benzonitrile
Smiles: COc1cc(ccc1OCc1ccccc1C#N)/C=C/1\C(=O)c2c(C1=O)cccc2

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Molecular Weight: 395.41
Empirical Formula: C25H17NO4

Physical State: Dry powder
Available Amount: 15 mg

Lipinsky:
logP: 4.862
Rotatable bonds: 5
H-donors: 0
H-acceptors: 4
PSA: 76
Number of rings: 4

     

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