COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK861264
Chemical Name: dimethyl4,4'-[(5-tert-butyl-2-oxocyclohexane-1,3-diylidene)di(E)methylylidene]dibenzoate
Smiles: COC(=O)c1ccc(cc1)/C=C/1\CC(C/C(=C\c2ccc(cc2)C(=O)OC)/C1=O)C(C)(C)C

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Molecular Weight: 446.54
Empirical Formula: C28H30O5

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 7.69
Rotatable bonds: 2
H-donors: 0
H-acceptors: 5
PSA: 69
Number of rings: 3

     

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