COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL418633
Chemical Name: (5E)-5-{[2,5-dimethyl-1-(4-methylphenyl)-1H-pyrrol-3-yl]methylidene}-3-(3-nitrophenyl)-2-thioxo-1,3-thiazolidin-4-one
Smiles: Cc1ccc(cc1)n1c(C)cc(c1C)/C=C\1/SC(=S)N(C1=O)c1cccc(c1)[N+](=O)[O-]

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Molecular Weight: 449.55
Empirical Formula: C23H19N3O3S2

Physical State: Dry powder
Available Amount: 137 mg

Lipinsky:
logP: 6.428
Rotatable bonds: 1
H-donors: 0
H-acceptors: 3
PSA: 128
Number of rings: 4

     

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