COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK438050
Chemical Name: dimethyl3,3'-{sulfanediylbis[(1-oxopropane-3,1-diyl)imino]}dithiophene-2-carboxylate
Smiles: COC(=O)c1sccc1NC(=O)CCSCCC(=O)Nc1ccsc1C(=O)OC

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Molecular Weight: 456.56
Empirical Formula: C18H20N2O6S3

Physical State: Dry powder
Available Amount: 317 mg

Lipinsky:
logP: 3.345
Rotatable bonds: 10
H-donors: 2
H-acceptors: 6
PSA: 192
Number of rings: 2

     

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