COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK435544
Chemical Name: dimethyl3-methyl-5-{[(2E)-3-(4-nitrophenyl)prop-2-enoyl]amino}thiophene-2,4-dicarboxylate
Smiles: COC(=O)c1c(NC(=O)/C=C/c2ccc(cc2)[N+](=O)[O-])sc(c1C)C(=O)OC

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Molecular Weight: 404.4
Empirical Formula: C18H16N2O7S

Physical State: Dry powder
Available Amount: 177 mg

Lipinsky:
logP: 5.909
Rotatable bonds: 5
H-donors: 1
H-acceptors: 7
PSA: 155
Number of rings: 2

     

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