COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK040579
Chemical Name: (2E)-2-{3-bromo-4-[2-(3,4-dimethylphenoxy)ethoxy]-5-ethoxybenzylidene}-N-ethylhydrazinecarbothioamide
Smiles: CCNC(=S)N/N=C/c1cc(Br)c(c(c1)OCC)OCCOc1ccc(c(c1)C)C

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Molecular Weight: 494.45
Empirical Formula: C22H28BrN3O3S

Physical State: Dry powder
Available Amount: 423 mg

Lipinsky:
logP: 6.453
Rotatable bonds: 9
H-donors: 2
H-acceptors: 3
PSA: 96
Number of rings: 2

     

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