COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL419073
Chemical Name: 2-methoxy-4-{(E)-[3-(4-nitrophenyl)-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene]methyl}phenylthiophene-2-carboxylate
Smiles: COc1cc(ccc1OC(=O)c1cccs1)/C=C\1/SC(=S)N(C1=O)c1ccc(cc1)[N+](=O)[O-]

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Molecular Weight: 498.56
Empirical Formula: C22H14N2O6S3

Physical State: Dry powder
Available Amount: 127 mg

Lipinsky:
logP: 5.149
Rotatable bonds: 5
H-donors: 0
H-acceptors: 6
PSA: 187
Number of rings: 4

     

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