COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK809571
Chemical Name: (2E)-2-cyano-3-[3-(4-ethoxy-3-nitrophenyl)-1-phenyl-1H-pyrazol-4-yl]-N-(1-phenylethyl)prop-2-enamide
Smiles: CCOc1ccc(cc1[N+](=O)[O-])c1nn(cc1/C=C(/C(=O)NC(c1ccccc1)C)\C#N)c1ccccc1

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Molecular Weight: 507.55
Empirical Formula: C29H25N5O4

Physical State: Dry powder
Available Amount: 105 mg

Lipinsky:
logP: 5.243
Rotatable bonds: 6
H-donors: 1
H-acceptors: 4
PSA: 125
Number of rings: 4

     

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