COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL506424
Chemical Name: (3Z)-2-amino-4-(3-bromo-4-hydroxy-5-methoxyphenyl)but-3-ene-1,1,3-tricarbonitrile
Smiles: N#C/C(=C\c1cc(Br)c(c(c1)OC)O)/C(C(C#N)C#N)N

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Molecular Weight: 347.17
Empirical Formula: C14H11BrN4O2

Physical State: Dry powder
Available Amount: 378 mg

Lipinsky:
logP: 3.625
Rotatable bonds: 5
H-donors: 3
H-acceptors: 2
PSA: 126
Number of rings: 1

     

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