COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK152477
Chemical Name: (5Z)-5-{4-[2-nitro-4-(trifluoromethyl)phenoxy]benzylidene}-3-(prop-2-yn-1-yl)-1,3-thiazolidine-2,4-dione
Smiles: C#CCN1C(=O)S/C(=C\c2ccc(cc2)Oc2ccc(cc2[N+](=O)[O-])C(F)(F)F)/C1=O

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Molecular Weight: 448.38
Empirical Formula: C20H11F3N2O5S

Physical State: Dry powder
Available Amount: 150 mg

Lipinsky:
logP: 4.588
Rotatable bonds: 2
H-donors: 0
H-acceptors: 5
PSA: 117
Number of rings: 3

     

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