COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL020071
Chemical Name: methyl4,5-dimethyl-2-({[3-oxo-6-(trifluoromethyl)-3,4-dihydro-2H-1,4-benzothiazin-2-yl]acetyl}amino)thiophene-3-carboxylate
Smiles: COC(=O)c1c(NC(=O)CC2Sc3ccc(cc3NC2=O)C(F)(F)F)sc(c1C)C

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Molecular Weight: 458.48
Empirical Formula: C19H17F3N2O4S2

Physical State: Dry powder
Available Amount: 110 mg

Lipinsky:
logP: 4.684
Rotatable bonds: 4
H-donors: 2
H-acceptors: 4
PSA: 138
Number of rings: 3

     

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