COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK822929
Chemical Name: (2Z)-2-cyano-3-[3-(4-ethoxy-3-methylphenyl)-1-phenyl-1H-pyrazol-4-yl]-N-(prop-2-en-1-yl)prop-2-enamide
Smiles: C=CCNC(=O)/C(=C\c1cn(nc1c1ccc(c(c1)C)OCC)c1ccccc1)/C#N

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Molecular Weight: 412.49
Empirical Formula: C25H24N4O2

Physical State: Dry powder
Available Amount: 104 mg

Lipinsky:
logP: 4.86
Rotatable bonds: 7
H-donors: 1
H-acceptors: 2
PSA: 79
Number of rings: 3

     

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