COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL416013
Chemical Name: methyl(2E)-2-cyano-3-[3-ethoxy-5-iodo-4-(prop-2-en-1-yloxy)phenyl]prop-2-enoate
Smiles: C=CCOc1c(I)cc(cc1OCC)/C=C(/C(=O)OC)\C#N

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Molecular Weight: 413.21
Empirical Formula: C16H16INO4

Physical State: Dry powder
Available Amount: 262 mg

Lipinsky:
logP: 3.918
Rotatable bonds: 8
H-donors: 0
H-acceptors: 4
PSA: 68
Number of rings: 1

     

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