COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK199969
Chemical Name: methyl[(5E)-5-{3-ethoxy-4-[2-nitro-4-(trifluoromethyl)phenoxy]benzylidene}-2,4-dioxo-1,3-thiazolidin-3-yl]acetate
Smiles: CCOc1cc(ccc1Oc1ccc(cc1[N+](=O)[O-])C(F)(F)F)/C=C\1/SC(=O)N(C1=O)CC(=O)OC

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Molecular Weight: 526.45
Empirical Formula: C22H17F3N2O8S

Physical State: Dry powder
Available Amount: 148 mg

Lipinsky:
logP: 3.683
Rotatable bonds: 8
H-donors: 0
H-acceptors: 8
PSA: 153
Number of rings: 3

     

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