COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK421145
Chemical Name: dimethyl2,2'-[benzene-1,4-diylbis(carbonylimino)]bis[6-(2-methylbutan-2-yl)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate]
Smiles: COC(=O)c1c(NC(=O)c2ccc(cc2)C(=O)Nc2sc3c(c2C(=O)OC)CCC(C3)C(CC)(C)C)sc2c1CCC(C2)C(CC)(C)C

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Molecular Weight: 692.94
Empirical Formula: C38H48N2O6S2

Physical State: Dry powder
Available Amount: 573 mg

Lipinsky:
logP: 14.406
Rotatable bonds: 8
H-donors: 2
H-acceptors: 6
PSA: 167
Number of rings: 5

     

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