COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL059816
Chemical Name: 2-[(1,3-benzodioxol-5-ylmethyl)amino]-2-oxoethyl4-cyanobenzoate
Smiles: N#Cc1ccc(cc1)C(=O)OCC(=O)NCc1ccc2c(c1)OCO2

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Molecular Weight: 338.32
Empirical Formula: C18H14N2O5

Physical State: Dry powder
Available Amount: 100 mg

Lipinsky:
logP: 2.271
Rotatable bonds: 5
H-donors: 1
H-acceptors: 5
PSA: 97
Number of rings: 3

     

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