COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK182970
Chemical Name: (2E)-3-[2-bromo-5-methoxy-4-(prop-2-yn-1-yloxy)phenyl]-2-cyano-N-[2-(1H-indol-3-yl)ethyl]prop-2-enamide
Smiles: C#CCOc1cc(Br)c(cc1OC)/C=C(/C(=O)NCCc1c[nH]c2c1cccc2)\C#N

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Molecular Weight: 478.35
Empirical Formula: C24H20BrN3O3

Physical State: Dry powder
Available Amount: 32 mg

Lipinsky:
logP: 4.107
Rotatable bonds: 8
H-donors: 2
H-acceptors: 3
PSA: 87
Number of rings: 3

     

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