COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK374532
Chemical Name: 5-amino-3-{(Z)-2-[4-(benzyloxy)-3-bromo-5-methoxyphenyl]-1-cyanoethenyl}-1-(2-hydroxyethyl)-1H-pyrazole-4-carbonitrile
Smiles: OCCn1nc(c(c1N)C#N)/C(=C/c1cc(Br)c(c(c1)OC)OCc1ccccc1)/C#N

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Molecular Weight: 494.35
Empirical Formula: C23H20BrN5O3

Physical State: Dry powder
Available Amount: 152 mg

Lipinsky:
logP: 4.382
Rotatable bonds: 8
H-donors: 3
H-acceptors: 3
PSA: 130
Number of rings: 3

     

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