COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL056521
Chemical Name: [5-(3-nitrophenyl)furan-2-yl]{4-[3-(trifluoromethyl)phenyl]piperazin-1-yl}methanethione
Smiles: S=C(c1ccc(o1)c1cccc(c1)[N+](=O)[O-])N1CCN(CC1)c1cccc(c1)C(F)(F)F

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Molecular Weight: 461.46
Empirical Formula: C22H18F3N3O3S

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 3.988
Rotatable bonds: 2
H-donors: 0
H-acceptors: 3
PSA: 97
Number of rings: 4

     

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