COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL254969
Chemical Name: dimethyl2-({3-[(4-methylphenyl)sulfanyl]propanoyl}amino)benzene-1,4-dicarboxylate
Smiles: COC(=O)c1ccc(cc1NC(=O)CCSc1ccc(cc1)C)C(=O)OC

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Molecular Weight: 387.46
Empirical Formula: C20H21NO5S

Physical State: Dry powder
Available Amount: 70 mg

Lipinsky:
logP: 5.276
Rotatable bonds: 7
H-donors: 1
H-acceptors: 5
PSA: 107
Number of rings: 2

     

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