COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK741161
Chemical Name: ethyl4-[(dimethylamino)methyl]-2-{[(4-ethylphenyl)sulfanyl]methyl}-5-hydroxy-1-benzofuran-3-carboxylate
Smiles: CCOC(=O)c1c(CSc2ccc(cc2)CC)oc2c1c(CN(C)C)c(cc2)O

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Saltdata: HCl
Molecular Weight: 413.54
Empirical Formula: C23H27NO4S

Physical State: Dry powder
Available Amount: 310 mg

Lipinsky:
logP: 4.772
Rotatable bonds: 7
H-donors: 1
H-acceptors: 4
PSA: 88
Number of rings: 3

     

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