COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK949827
Chemical Name: ethyl2-{[(2E)-2-cyano-3-(4-{[(4-methylphenyl)carbonyl]oxy}phenyl)prop-2-enoyl]amino}benzoate
Smiles: CCOC(=O)c1ccccc1NC(=O)/C(=C/c1ccc(cc1)OC(=O)c1ccc(cc1)C)/C#N

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Molecular Weight: 454.48
Empirical Formula: C27H22N2O5

Physical State: Dry powder
Available Amount: 53 mg

Lipinsky:
logP: 6.845
Rotatable bonds: 5
H-donors: 1
H-acceptors: 5
PSA: 105
Number of rings: 3

     

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