COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK153962
Chemical Name: ethyl(2E)-3-{5-bromo-2-[2-(4-tert-butylphenoxy)ethoxy]phenyl}-2-cyanoprop-2-enoate
Smiles: CCOC(=O)/C(=C/c1cc(Br)ccc1OCCOc1ccc(cc1)C(C)(C)C)/C#N

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Molecular Weight: 472.38
Empirical Formula: C24H26BrNO4

Physical State: Dry powder
Available Amount: 171 mg

Lipinsky:
logP: 6.822
Rotatable bonds: 8
H-donors: 0
H-acceptors: 4
PSA: 68
Number of rings: 2

     

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