COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK435542
Chemical Name: diethyl3-methyl-5-{[(2E)-3-(4-nitrophenyl)prop-2-enoyl]amino}thiophene-2,4-dicarboxylate
Smiles: CCOC(=O)c1c(NC(=O)/C=C/c2ccc(cc2)[N+](=O)[O-])sc(c1C)C(=O)OCC

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Molecular Weight: 432.45
Empirical Formula: C20H20N2O7S

Physical State: Dry powder
Available Amount: 436 mg

Lipinsky:
logP: 6.972
Rotatable bonds: 7
H-donors: 1
H-acceptors: 7
PSA: 155
Number of rings: 2

     

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