COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK943367
Chemical Name: (3E)-6-(ethylsulfonyl)-3-[2-(3-methyl-5-phenylthiophen-2-yl)-2-oxoethylidene]-3,4-dihydro-2H-1,4-benzoxazin-2-one
Smiles: CCS(=O)(=O)c1ccc2c(c1)[nH]/c(=C/C(=O)c1sc(cc1C)c1ccccc1)/c(=O)o2

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Molecular Weight: 453.54
Empirical Formula: C23H19NO5S2

Physical State: Dry powder
Available Amount: 310 mg

Lipinsky:
logP: 2.674
Rotatable bonds: 4
H-donors: 1
H-acceptors: 5
PSA: 126
Number of rings: 4

     

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