COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK779993
Chemical Name: 2-(3-chloro-2-methylphenyl)-6-nitro-4-(2,2,2-trifluoroethoxy)-1,2-benzothiazol-3(2H)-one
Smiles: [O-][N+](=O)c1cc(OCC(F)(F)F)c2c(c1)sn(c2=O)c1cccc(c1C)Cl

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Molecular Weight: 418.78
Empirical Formula: C16H10ClF3N2O4S

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 5.243
Rotatable bonds: 2
H-donors: 0
H-acceptors: 4
PSA: 100
Number of rings: 3

     

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