COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK444880
Chemical Name: diethyl5-{[(2-chloro-5-nitrophenyl)carbonyl]amino}-3-methylthiophene-2,4-dicarboxylate
Smiles: CCOC(=O)c1c(NC(=O)c2cc(ccc2Cl)[N+](=O)[O-])sc(c1C)C(=O)OCC

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Molecular Weight: 440.86
Empirical Formula: C18H17ClN2O7S

Physical State: Dry powder
Available Amount: 458 mg

Lipinsky:
logP: 6.221
Rotatable bonds: 7
H-donors: 1
H-acceptors: 7
PSA: 155
Number of rings: 2

     

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