COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL172824
Chemical Name: (2-oxocyclohexane-1,3-diylidene)bis[(E)methylylidene-2-iodo-6-methoxybenzene-4,1-diyl]diacetate
Smiles: COc1cc(/C=C/2\CCC/C(=C\c3cc(I)c(c(c3)OC)OC(=O)C)/C2=O)cc(c1OC(=O)C)I

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Molecular Weight: 702.28
Empirical Formula: C26H24I2O7

Physical State: Dry powder
Available Amount: 36 mg

Lipinsky:
logP: 6.21
Rotatable bonds: 8
H-donors: 0
H-acceptors: 7
PSA: 88
Number of rings: 3

     

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