COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK902262
Chemical Name: dimethyl2-{[(1E)-3-(1,3-benzodioxol-5-yl)-3-oxoprop-1-en-1-yl]amino}benzene-1,4-dicarboxylate
Smiles: COC(=O)c1ccc(cc1N/C=C/C(=O)c1ccc2c(c1)OCO2)C(=O)OC

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Molecular Weight: 383.36
Empirical Formula: C20H17NO7

Physical State: Dry powder
Available Amount: 60 mg

Lipinsky:
logP: 4.05
Rotatable bonds: 6
H-donors: 1
H-acceptors: 7
PSA: 100
Number of rings: 3

     

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