COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL178373
Chemical Name: methyl3-{[(2E)-3-(1,3-benzodioxol-5-yl)prop-2-enoyl]amino}thiophene-2-carboxylate
Smiles: COC(=O)c1sccc1NC(=O)/C=C/c1ccc2c(c1)OCO2

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Molecular Weight: 331.35
Empirical Formula: C16H13NO5S

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 4.555
Rotatable bonds: 4
H-donors: 1
H-acceptors: 5
PSA: 102
Number of rings: 3

     

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