COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK441139
Chemical Name: dimethyl2-{[(2E)-3-(2-chloro-6-fluorophenyl)prop-2-enoyl]amino}benzene-1,4-dicarboxylate
Smiles: COC(=O)c1ccc(cc1NC(=O)/C=C/c1c(F)cccc1Cl)C(=O)OC

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Molecular Weight: 391.78
Empirical Formula: C19H15ClFNO5

Physical State: Dry powder
Available Amount: 737 mg

Lipinsky:
logP: 5.451
Rotatable bonds: 6
H-donors: 1
H-acceptors: 5
PSA: 81
Number of rings: 2

     

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