COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK001769
Chemical Name: (2E)-3-(4-{2-[4-(butan-2-yl)phenoxy]ethoxy}-3-ethoxyphenyl)-2-phenylprop-2-enenitrile
Smiles: CCOc1cc(ccc1OCCOc1ccc(cc1)C(CC)C)/C=C(\c1ccccc1)/C#N

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Molecular Weight: 441.57
Empirical Formula: C29H31NO3

Physical State: Dry powder
Available Amount: 291 mg

Lipinsky:
logP: 8.389
Rotatable bonds: 8
H-donors: 0
H-acceptors: 3
PSA: 51
Number of rings: 3

     

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