COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK414188
Chemical Name: methyl(2E)-3-(5-bromo-2-hydroxyphenyl)-2-cyanoprop-2-enoate
Smiles: COC(=O)/C(=C/c1cc(Br)ccc1O)/C#N

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Molecular Weight: 282.09
Empirical Formula: C11H8BrNO3

Physical State: Dry powder
Available Amount: 93 mg

Lipinsky:
logP: 2.914
Rotatable bonds: 4
H-donors: 1
H-acceptors: 3
PSA: 70
Number of rings: 1

     

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