COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK186511
Chemical Name: (2Z)-N-benzyl-3-[2-bromo-5-methoxy-4-(prop-2-yn-1-yloxy)phenyl]-2-cyanoprop-2-enamide
Smiles: COc1cc(/C=C(\C(=O)NCc2ccccc2)/C#N)c(cc1OCC#C)Br

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Molecular Weight: 425.28
Empirical Formula: C21H17BrN2O3

Physical State: Dry powder
Available Amount: 139 mg

Lipinsky:
logP: 4.114
Rotatable bonds: 6
H-donors: 1
H-acceptors: 3
PSA: 71
Number of rings: 2

     

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