COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL009803
Chemical Name: ethyl4-{5-cyano-3-[(Z)-(3-cyclohexyl-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene)methyl]-1,4-dimethyl-6-oxo-1,6-dihydropyridin-2-yl}piperazine-1-carboxylate
Smiles: CCOC(=O)N1CCN(CC1)c1c(/C=C/2\SC(=S)N(C2=O)C2CCCCC2)c(C)c(c(=O)n1C)C#N

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Molecular Weight: 529.68
Empirical Formula: C25H31N5O4S2

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 1.661
Rotatable bonds: 4
H-donors: 0
H-acceptors: 4
PSA: 154
Number of rings: 4

     

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