COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK434613
Chemical Name: (2E)-3-(1-benzyl-3-phenyl-1H-pyrazol-4-yl)-2-cyano-N-(2,5-dimethoxyphenyl)prop-2-enamide
Smiles: COc1ccc(c(c1)NC(=O)/C(=C/c1cn(nc1c1ccccc1)Cc1ccccc1)/C#N)OC

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Molecular Weight: 464.52
Empirical Formula: C28H24N4O3

Physical State: Dry powder
Available Amount: 727 mg

Lipinsky:
logP: 5.06
Rotatable bonds: 5
H-donors: 1
H-acceptors: 3
PSA: 89
Number of rings: 4

     

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