COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK757552
Chemical Name: 5-amino-3-[(Z)-2-(6-chloro-1,3-benzodioxol-5-yl)-1-cyanoethenyl]-1-(2-hydroxyethyl)-1H-pyrazole-4-carbonitrile
Smiles: OCCn1nc(c(c1N)C#N)/C(=C/c1cc2OCOc2cc1Cl)/C#N

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Molecular Weight: 357.76
Empirical Formula: C16H12ClN5O3

Physical State: Dry powder
Available Amount: 27 mg

Lipinsky:
logP: 2.78
Rotatable bonds: 5
H-donors: 3
H-acceptors: 3
PSA: 130
Number of rings: 3

     

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