COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK012599
Chemical Name: 3,4,5-triethoxy-N-[(4-nitrophenyl)carbamothioyl]benzamide
Smiles: CCOc1cc(cc(c1OCC)OCC)C(=O)NC(=S)Nc1ccc(cc1)[N+](=O)[O-]

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Molecular Weight: 433.49
Empirical Formula: C20H23N3O6S

Physical State: Dry powder
Available Amount: 504 mg

Lipinsky:
logP: 5.057
Rotatable bonds: 5
H-donors: 2
H-acceptors: 6
PSA: 146
Number of rings: 2

     

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