COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK018412
Chemical Name: bis[4-({3-[(1E)-3-oxo-3-phenylprop-1-en-1-yl]phenyl}carbamoyl)phenyl]benzene-1,4-dicarboxylate
Smiles: O=C(c1ccc(cc1)C(=O)Oc1ccc(cc1)C(=O)Nc1cccc(c1)/C=C/C(=O)c1ccccc1)Oc1ccc(cc1)C(=O)Nc1cccc(c1)/C=C/C(=O)c1ccccc1

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Molecular Weight: 816.87
Empirical Formula: C52H36N2O8

Physical State: Dry powder
Available Amount: 108 mg

Lipinsky:
logP: 10.286
Rotatable bonds: 6
H-donors: 2
H-acceptors: 8
PSA: 144
Number of rings: 7

     

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