COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL099876
Chemical Name: 2-(1,3-benzodioxol-5-ylamino)-2-oxoethyl4-cyanobenzoate
Smiles: N#Cc1ccc(cc1)C(=O)OCC(=O)Nc1ccc2c(c1)OCO2

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Molecular Weight: 324.29
Empirical Formula: C17H12N2O5

Physical State: Dry powder
Available Amount: 150 mg

Lipinsky:
logP: 3.061
Rotatable bonds: 3
H-donors: 1
H-acceptors: 5
PSA: 97
Number of rings: 3

     

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