COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK161382
Chemical Name: methyl4-{2,5-dimethyl-3-[(E)-(4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene)methyl]-1H-pyrrol-1-yl}benzoate
Smiles: COC(=O)c1ccc(cc1)n1c(C)cc(c1C)/C=C\1/SC(=S)NC1=O

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Molecular Weight: 372.47
Empirical Formula: C18H16N2O3S2

Physical State: Dry powder
Available Amount: 19 mg

Lipinsky:
logP: 3.506
Rotatable bonds: 2
H-donors: 1
H-acceptors: 3
PSA: 117
Number of rings: 3

     

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