COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL378869
Chemical Name: N-(3,4-dimethylphenyl)-2-(3-{(Z)-[3-(2,5-dimethyl-1H-pyrrol-1-yl)-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene]methyl}phenoxy)acetamide
Smiles: O=C(Nc1ccc(c(c1)C)C)COc1cccc(c1)/C=C/1\SC(=S)N(C1=O)n1c(C)ccc1C

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Molecular Weight: 491.63
Empirical Formula: C26H25N3O3S2

Physical State: Dry powder
Available Amount: 688 mg

Lipinsky:
logP: 6.407
Rotatable bonds: 4
H-donors: 1
H-acceptors: 3
PSA: 120
Number of rings: 4

     

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