COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK811566
Chemical Name: ethyl4-[(2-{[4-(ethoxycarbonyl)phenyl]carbamoyl}-3-{3-[2-methyl-4-(prop-2-en-1-yloxy)phenyl]-1-phenyl-1H-pyrazol-4-yl}acryloyl)amino]benzoate
Smiles: C=CCOc1ccc(c(c1)C)c1nn(cc1/C=C(/C(=O)Nc1ccc(cc1)C(=O)OCC)\C(=O)Nc1ccc(cc1)C(=O)OCC)c1ccccc1

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Molecular Weight: 698.78
Empirical Formula: C41H38N4O7

Physical State: Dry powder
Available Amount: 102 mg

Lipinsky:
logP: 9.815
Rotatable bonds: 11
H-donors: 2
H-acceptors: 7
PSA: 137
Number of rings: 5

     

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