COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK446055
Chemical Name: 5,5'-{sulfanediylbis[(1-oxopropane-3,1-diyl)imino]}bis(4-cyano-N,N-diethyl-3-methylthiophene-2-carboxamide)
Smiles: CCN(C(=O)c1sc(c(c1C)C#N)NC(=O)CCSCCC(=O)Nc1sc(c(c1C#N)C)C(=O)N(CC)CC)CC

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Molecular Weight: 616.83
Empirical Formula: C28H36N6O4S3

Physical State: Dry powder
Available Amount: 571 mg

Lipinsky:
logP: 3.438
Rotatable bonds: 12
H-donors: 2
H-acceptors: 4
PSA: 228
Number of rings: 2

     

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