COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK420501
Chemical Name: dimethyl3,3'-[(1,4-dioxobutane-1,4-diyl)diimino]dithiophene-2-carboxylate
Smiles: COC(=O)c1sccc1NC(=O)CCC(=O)Nc1ccsc1C(=O)OC

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Molecular Weight: 396.44
Empirical Formula: C16H16N2O6S2

Physical State: Dry powder
Available Amount: 711 mg

Lipinsky:
logP: 2.597
Rotatable bonds: 7
H-donors: 2
H-acceptors: 6
PSA: 167
Number of rings: 2

     

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