COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK808757
Chemical Name: diethyl3-methyl-5-({2,2,2-trichloro-1-[(3-methylbutanoyl)amino]ethyl}amino)thiophene-2,4-dicarboxylate
Smiles: CCOC(=O)c1c(sc(c1C)C(=O)OCC)NC(C(Cl)(Cl)Cl)NC(=O)CC(C)C

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Molecular Weight: 487.83
Empirical Formula: C18H25Cl3N2O5S

Physical State: Dry powder
Available Amount: 99 mg

Lipinsky:
logP: 7.423
Rotatable bonds: 10
H-donors: 2
H-acceptors: 5
PSA: 121
Number of rings: 1

     

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