COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK440927
Chemical Name: methyl4,5-dimethyl-2-{[(2E)-3-(3-nitrophenyl)prop-2-enoyl]amino}thiophene-3-carboxylate
Smiles: COC(=O)c1c(NC(=O)/C=C/c2cccc(c2)[N+](=O)[O-])sc(c1C)C

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Molecular Weight: 360.39
Empirical Formula: C17H16N2O5S

Physical State: Dry powder
Available Amount: 64 mg

Lipinsky:
logP: 5.964
Rotatable bonds: 4
H-donors: 1
H-acceptors: 5
PSA: 129
Number of rings: 2

     

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