COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL431830
Chemical Name: 5-amino-3-[(E)-2-(1,3-benzodioxol-5-yl)-1-cyanoethenyl]-1H-pyrazole-4-carbonitrile
Smiles: N#C/C(=C/c1ccc2c(c1)OCO2)/c1n[nH]c(c1C#N)N

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Molecular Weight: 279.26
Empirical Formula: C14H9N5O2

Physical State: Dry powder
Available Amount: 889 mg

Lipinsky:
logP: 3.046
Rotatable bonds: 2
H-donors: 3
H-acceptors: 2
PSA: 120
Number of rings: 3

     

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