COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK183191
Chemical Name: (2E)-2-cyano-3-(2,3-dibromo-5-ethoxy-4-hydroxyphenyl)-N-[2-(1H-indol-3-yl)ethyl]prop-2-enamide
Smiles: CCOc1cc(/C=C(/C(=O)NCCc2c[nH]c3c2cccc3)\C#N)c(c(c1O)Br)Br

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Molecular Weight: 533.22
Empirical Formula: C22H19Br2N3O3

Physical State: Dry powder
Available Amount: 140 mg

Lipinsky:
logP: 5.294
Rotatable bonds: 8
H-donors: 3
H-acceptors: 3
PSA: 98
Number of rings: 3

     

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