COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL120094
Chemical Name: dimethyl2-{[(2E)-3-(5-chloro-7-methoxy-1-benzofuran-2-yl)prop-2-enoyl]amino}benzene-1,4-dicarboxylate
Smiles: COC(=O)c1ccc(cc1NC(=O)/C=C/c1oc2c(c1)cc(cc2OC)Cl)C(=O)OC

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Molecular Weight: 443.84
Empirical Formula: C22H18ClNO7

Physical State: Dry powder
Available Amount: 60 mg

Lipinsky:
logP: 6.552
Rotatable bonds: 7
H-donors: 1
H-acceptors: 7
PSA: 104
Number of rings: 3

     

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