COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL368070
Chemical Name: (2E)-3-(3-methoxy-4-{2-[(4-methylbenzyl)sulfanyl]ethoxy}phenyl)prop-2-enoicacid
Smiles: COc1cc(/C=C/C(=O)O)ccc1OCCSCc1ccc(cc1)C

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Molecular Weight: 358.46
Empirical Formula: C20H22O4S

Physical State: Dry powder
Available Amount: 2684 mg

Lipinsky:
logP: 5.032
Rotatable bonds: 9
H-donors: 1
H-acceptors: 4
PSA: 81
Number of rings: 2

     

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