COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL097163
Chemical Name: 3-[6-chloro-1,1-dioxido-2-(pyrrolidin-1-ylcarbonyl)-4H-1,4-benzothiazin-4-yl]benzonitrile
Smiles: N#Cc1cccc(c1)N1C=C(C(=O)N2CCCC2)S(=O)(=O)c2c1cc(Cl)cc2

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Molecular Weight: 413.88
Empirical Formula: C20H16ClN3O3S

Physical State: Dry powder
Available Amount: 20 mg

Lipinsky:
logP: 1.896
Rotatable bonds: 1
H-donors: 0
H-acceptors: 3
PSA: 89
Number of rings: 4

     

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