COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL440439
Chemical Name: 2-(cyanomethyl)-1,1-dioxido-3-(phenylcarbonyl)-2H-1,2-benzothiazin-4-yl(2,5-dioxopyrrolidin-1-yl)acetate
Smiles: N#CCN1C(=C(OC(=O)CN2C(=O)CCC2=O)c2c(S1(=O)=O)cccc2)C(=O)c1ccccc1

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Molecular Weight: 479.47
Empirical Formula: C23H17N3O7S

Physical State: Dry powder
Available Amount: 8 mg

Lipinsky:
logP: 2.83
Rotatable bonds: 5
H-donors: 0
H-acceptors: 7
PSA: 150
Number of rings: 4

     

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