COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK376971
Chemical Name: (5E)-5-{3,5-dibromo-4-[2-nitro-4-(trifluoromethyl)phenoxy]benzylidene}-3-(3-fluorophenyl)-2-thioxo-1,3-thiazolidin-4-one
Smiles: Fc1cccc(c1)N1C(=S)S/C(=C/c2cc(Br)c(c(c2)Br)Oc2ccc(cc2[N+](=O)[O-])C(F)(F)F)/C1=O

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Molecular Weight: 678.28
Empirical Formula: C23H10Br2F4N2O4S2

Physical State: Dry powder
Available Amount: 158 mg

Lipinsky:
logP: 7.765
Rotatable bonds: 1
H-donors: 0
H-acceptors: 4
PSA: 132
Number of rings: 4

     

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