COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK317622
Chemical Name: 4-[(4-bromo-1H-pyrazol-1-yl)methyl]-N-[(4-ethoxy-2-nitrophenyl)carbamothioyl]benzamide
Smiles: CCOc1ccc(c(c1)[N+](=O)[O-])NC(=S)NC(=O)c1ccc(cc1)Cn1ncc(c1)Br

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Molecular Weight: 504.36
Empirical Formula: C20H18BrN5O4S

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 4.535
Rotatable bonds: 3
H-donors: 2
H-acceptors: 4
PSA: 146
Number of rings: 3

     

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