COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK330229
Chemical Name: 5-amino-3-[(Z)-1-cyano-2-(3,5-diiodo-2-propoxyphenyl)ethenyl]-1-(2-hydroxyethyl)-1H-pyrazole-4-carbonitrile
Smiles: CCCOc1c(cc(cc1I)I)/C=C(/c1nn(c(c1C#N)N)CCO)\C#N

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Molecular Weight: 589.17
Empirical Formula: C18H17I2N5O2

Physical State: Dry powder
Available Amount: 50 mg

Lipinsky:
logP: 5.159
Rotatable bonds: 8
H-donors: 3
H-acceptors: 2
PSA: 120
Number of rings: 2

     

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