COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK182286
Chemical Name: methyl(4-{(1E)-3-[(3-bromophenyl)amino]-2-cyano-3-oxoprop-1-en-1-yl}-2-methoxyphenoxy)acetate
Smiles: N#C/C(=C\c1ccc(c(c1)OC)OCC(=O)OC)/C(=O)Nc1cccc(c1)Br

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Molecular Weight: 445.27
Empirical Formula: C20H17BrN2O5

Physical State: Dry powder
Available Amount: 150 mg

Lipinsky:
logP: 3.694
Rotatable bonds: 7
H-donors: 1
H-acceptors: 5
PSA: 97
Number of rings: 2

     

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