COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK843250
Chemical Name: (3E)-3-[2-(3,4-dimethoxyphenyl)-2-oxoethylidene]-6-(ethylsulfonyl)-3,4-dihydro-2H-1,4-benzoxazin-2-one
Smiles: COc1cc(ccc1OC)C(=O)/C=c\1/[nH]c2cc(ccc2oc1=O)S(=O)(=O)CC

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Molecular Weight: 417.44
Empirical Formula: C20H19NO7S

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 0.965
Rotatable bonds: 6
H-donors: 1
H-acceptors: 7
PSA: 116
Number of rings: 3

     

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