COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL497504
Chemical Name: (2E)-3-{3-iodo-5-methoxy-4-[(4-methylbenzyl)oxy]phenyl}prop-2-enoicacid
Smiles: COc1cc(/C=C/C(=O)O)cc(c1OCc1ccc(cc1)C)I

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Molecular Weight: 424.24
Empirical Formula: C18H17IO4

Physical State: Dry powder
Available Amount: 2000 mg

Lipinsky:
logP: 5.28
Rotatable bonds: 6
H-donors: 1
H-acceptors: 4
PSA: 55
Number of rings: 2

     

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