COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK679327
Chemical Name: ethyl4-[(dimethylamino)methyl]-5-hydroxy-2-[(pyridin-2-ylsulfanyl)methyl]-1-benzofuran-3-carboxylate
Smiles: CCOC(=O)c1c(CSc2ccccn2)oc2c1c(CN(C)C)c(cc2)O

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Saltdata: HCl
Molecular Weight: 386.47
Empirical Formula: C20H22N2O4S

Physical State: Dry powder
Available Amount: 35 mg

Lipinsky:
logP: 2.789
Rotatable bonds: 8
H-donors: 1
H-acceptors: 4
PSA: 101
Number of rings: 3

     

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