COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK180315
Chemical Name: (2E)-3-{2-bromo-4-[(2-cyanobenzyl)oxy]-5-methoxyphenyl}-2-cyano-N,N-dimethylprop-2-enamide
Smiles: N#C/C(=C\c1cc(OC)c(cc1Br)OCc1ccccc1C#N)/C(=O)N(C)C

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Molecular Weight: 440.3
Empirical Formula: C21H18BrN3O3

Physical State: Dry powder
Available Amount: 40 mg

Lipinsky:
logP: 3.263
Rotatable bonds: 6
H-donors: 0
H-acceptors: 3
PSA: 86
Number of rings: 2

     

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