COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK712883
Chemical Name: 5-amino-3-[(Z)-1-cyano-2-(4-ethoxy-3-iodo-5-methoxyphenyl)ethenyl]-1-phenyl-1H-pyrazole-4-carbonitrile
Smiles: CCOc1c(I)cc(cc1OC)/C=C(/c1nn(c(c1C#N)N)c1ccccc1)\C#N

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Molecular Weight: 511.32
Empirical Formula: C22H18IN5O2

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 6.006
Rotatable bonds: 5
H-donors: 2
H-acceptors: 2
PSA: 109
Number of rings: 3

     

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