COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL032728
Chemical Name: 3-(azepan-1-ylcarbonyl)-7,8-dimethoxy-1H-isothiochromen-1-one
Smiles: COc1c(OC)ccc2c1c(=O)sc(c2)C(=O)N1CCCCCC1

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Molecular Weight: 347.44
Empirical Formula: C18H21NO4S

Physical State: Dry powder
Available Amount: 183 mg

Lipinsky:
logP: 2.964
Rotatable bonds: 3
H-donors: 0
H-acceptors: 4
PSA: 81
Number of rings: 3

     

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