COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL506426
Chemical Name: (3Z)-2-amino-4-(5-bromo-2-hydroxy-3-methoxyphenyl)but-3-ene-1,1,3-tricarbonitrile
Smiles: N#CC(C(/C(=C/c1cc(Br)cc(c1O)OC)/C#N)N)C#N

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Molecular Weight: 347.17
Empirical Formula: C14H11BrN4O2

Physical State: Dry powder
Available Amount: 214 mg

Lipinsky:
logP: 4.198
Rotatable bonds: 5
H-donors: 3
H-acceptors: 2
PSA: 126
Number of rings: 1

     

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