COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL379057
Chemical Name: (5E)-3-(2-chloro-6-fluorobenzyl)-5-{3-methoxy-4-[2-nitro-4-(trifluoromethyl)phenoxy]benzylidene}-1,3-thiazolidine-2,4-dione
Smiles: COc1cc(ccc1Oc1ccc(cc1[N+](=O)[O-])C(F)(F)F)/C=C\1/SC(=O)N(C1=O)Cc1c(F)cccc1Cl

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Molecular Weight: 582.92
Empirical Formula: C25H15ClF4N2O6S

Physical State: Dry powder
Available Amount: 1131 mg

Lipinsky:
logP: 4.918
Rotatable bonds: 6
H-donors: 0
H-acceptors: 6
PSA: 126
Number of rings: 4

     

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