COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK003378
Chemical Name: 2-[(4-{(Z)-[1-(4-bromophenyl)-2,4,6-trioxotetrahydropyrimidin-5(2H)-ylidene]methyl}-2-ethoxyphenoxy)methyl]benzonitrile
Smiles: CCOc1cc(ccc1OCc1ccccc1C#N)/C=C\1/C(=O)NC(=O)N(C1=O)c1ccc(cc1)Br

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Molecular Weight: 546.38
Empirical Formula: C27H20BrN3O5

Physical State: Dry powder
Available Amount: 96 mg

Lipinsky:
logP: 4.875
Rotatable bonds: 6
H-donors: 1
H-acceptors: 5
PSA: 108
Number of rings: 4

     

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