COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK397220
Chemical Name: (2E)-2-cyano-3-[3,5-dibromo-4-(prop-2-en-1-yloxy)phenyl]-N-(4-methoxy-2-nitrophenyl)prop-2-enamide
Smiles: C=CCOc1c(Br)cc(cc1Br)/C=C(/C(=O)Nc1ccc(cc1[N+](=O)[O-])OC)\C#N

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Molecular Weight: 537.16
Empirical Formula: C20H15Br2N3O5

Physical State: Dry powder
Available Amount: 166 mg

Lipinsky:
logP: 5.859
Rotatable bonds: 4
H-donors: 1
H-acceptors: 5
PSA: 117
Number of rings: 2

     

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