COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK795180
Chemical Name: (2E,6E)-2,6-bis(3,4,5-trimethoxybenzylidene)cyclohexanone
Smiles: COc1cc(/C=C/2\CCC/C(=C\c3cc(OC)c(c(c3)OC)OC)/C2=O)cc(c1OC)OC

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Molecular Weight: 454.52
Empirical Formula: C26H30O7

Physical State: Dry powder
Available Amount: 80 mg

Lipinsky:
logP: 5.193
Rotatable bonds: 4
H-donors: 0
H-acceptors: 7
PSA: 72
Number of rings: 3

     

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