COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL097160
Chemical Name: {6-methyl-4-[3-(methylsulfanyl)phenyl]-1,1-dioxido-4H-1,4-benzothiazin-2-yl}(pyrrolidin-1-yl)methanone
Smiles: CSc1cccc(c1)N1C=C(C(=O)N2CCCC2)S(=O)(=O)c2c1cc(C)cc2

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Molecular Weight: 414.55
Empirical Formula: C21H22N2O3S2

Physical State: Dry powder
Available Amount: 20 mg

Lipinsky:
logP: 2.81
Rotatable bonds: 2
H-donors: 0
H-acceptors: 3
PSA: 91
Number of rings: 4

     

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