COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK808992
Chemical Name: diethyl3-methyl-5-[(2,2,2-trichloro-1-{[(4-methylphenyl)carbonyl]amino}ethyl)amino]thiophene-2,4-dicarboxylate
Smiles: CCOC(=O)c1c(NC(C(Cl)(Cl)Cl)NC(=O)c2ccc(cc2)C)sc(c1C)C(=O)OCC

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Molecular Weight: 521.85
Empirical Formula: C21H23Cl3N2O5S

Physical State: Dry powder
Available Amount: 100 mg

Lipinsky:
logP: 8.383
Rotatable bonds: 8
H-donors: 2
H-acceptors: 5
PSA: 121
Number of rings: 2

     

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