COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL559599
Chemical Name: (5Z)-5-{3-chloro-4-[2-nitro-4-(trifluoromethyl)phenoxy]benzylidene}-4-hydroxy-1,3-thiazole-2(5H)-thione
Smiles: S=C1N=C(/C(=C/c2ccc(c(c2)Cl)Oc2ccc(cc2[N+](=O)[O-])C(F)(F)F)/S1)O

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Molecular Weight: 460.84
Empirical Formula: C17H8ClF3N2O4S2

Physical State: Dry powder
Available Amount: 100 mg

Lipinsky:
logP: 5.054
Rotatable bonds: 4
H-donors: 1
H-acceptors: 4
PSA: 145
Number of rings: 3

     

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