COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK152472
Chemical Name: ethyl4-(3-{(E)-[2,4-dioxo-3-(prop-2-yn-1-yl)-1,3-thiazolidin-5-ylidene]methyl}-2,5-dimethyl-1H-pyrrol-1-yl)benzoate
Smiles: C#CCN1C(=O)S/C(=C/c2cc(n(c2C)c2ccc(cc2)C(=O)OCC)C)/C1=O

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Molecular Weight: 408.48
Empirical Formula: C22H20N2O4S

Physical State: Dry powder
Available Amount: 148 mg

Lipinsky:
logP: 5.167
Rotatable bonds: 4
H-donors: 0
H-acceptors: 4
PSA: 93
Number of rings: 3

     

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