COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK766655
Chemical Name: methyl3-amino-6-nitro-4-(2,2,2-trifluoroethoxy)-1-benzothiophene-2-carboxylate
Smiles: COC(=O)c1sc2c(c1N)c(OCC(F)(F)F)cc(c2)[N+](=O)[O-]

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Molecular Weight: 350.28
Empirical Formula: C12H9F3N2O5S

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 5.039
Rotatable bonds: 4
H-donors: 2
H-acceptors: 5
PSA: 135
Number of rings: 2

     

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