COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK097115
Chemical Name: 3,4,5-triethoxy-N-[(2-methyl-4-nitrophenyl)carbamothioyl]benzamide
Smiles: CCOc1cc(cc(c1OCC)OCC)C(=O)NC(=S)Nc1ccc(cc1C)[N+](=O)[O-]

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Molecular Weight: 447.51
Empirical Formula: C21H25N3O6S

Physical State: Dry powder
Available Amount: 445 mg

Lipinsky:
logP: 5.517
Rotatable bonds: 5
H-donors: 2
H-acceptors: 6
PSA: 146
Number of rings: 2

     

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