COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK183604
Chemical Name: (2E)-3-[2-bromo-5-ethoxy-4-(prop-2-yn-1-yloxy)phenyl]-2-[(4-phenylpiperazin-1-yl)carbonyl]prop-2-enenitrile
Smiles: CCOc1cc(/C=C(/C(=O)N2CCN(CC2)c2ccccc2)\C#N)c(cc1OCC#C)Br

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Molecular Weight: 494.39
Empirical Formula: C25H24BrN3O3

Physical State: Dry powder
Available Amount: 138 mg

Lipinsky:
logP: 4.137
Rotatable bonds: 6
H-donors: 0
H-acceptors: 3
PSA: 65
Number of rings: 3

     

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