COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL199340
Chemical Name: ethyl(2E)-2-cyano-3-(3,5-dibromo-4-hydroxyphenyl)prop-2-enoate
Smiles: CCOC(=O)/C(=C/c1cc(Br)c(c(c1)Br)O)/C#N

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Molecular Weight: 375.02
Empirical Formula: C12H9Br2NO3

Physical State: Dry powder
Available Amount: 1992 mg

Lipinsky:
logP: 3.875
Rotatable bonds: 4
H-donors: 1
H-acceptors: 3
PSA: 70
Number of rings: 1

     

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