COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL376671
Chemical Name: 2-{4-[(1E)-3-amino-2-cyano-3-thioxoprop-1-en-1-yl]phenoxy}-N-(2-bromo-4,5-dimethylphenyl)acetamide
Smiles: N#C/C(=C\c1ccc(cc1)OCC(=O)Nc1cc(C)c(cc1Br)C)/C(=S)N

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Molecular Weight: 444.35
Empirical Formula: C20H18BrN3O2S

Physical State: Dry powder
Available Amount: 615 mg

Lipinsky:
logP: 3.635
Rotatable bonds: 3
H-donors: 3
H-acceptors: 2
PSA: 120
Number of rings: 2

     

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