COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL373970
Chemical Name: N-(2-bromo-4,5-dimethylphenyl)-2-(2-methoxy-4-{(E)-[3-(4-methoxybenzyl)-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene]methyl}phenoxy)acetamide
Smiles: COc1cc(ccc1OCC(=O)Nc1cc(C)c(cc1Br)C)/C=C\1/SC(=S)N(C1=O)Cc1ccc(cc1)OC

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Molecular Weight: 627.58
Empirical Formula: C29H27BrN2O5S2

Physical State: Dry powder
Available Amount: 207 mg

Lipinsky:
logP: 5.208
Rotatable bonds: 6
H-donors: 1
H-acceptors: 5
PSA: 134
Number of rings: 4

     

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