COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK026523
Chemical Name: 4-ethoxy-N-{[4-(4-nitrophenyl)piperazin-1-yl]carbonothioyl}benzamide
Smiles: CCOc1ccc(cc1)C(=O)NC(=S)N1CCN(CC1)c1ccc(cc1)[N+](=O)[O-]

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Molecular Weight: 414.49
Empirical Formula: C20H22N4O4S

Physical State: Dry powder
Available Amount: 445 mg

Lipinsky:
logP: 3.14
Rotatable bonds: 1
H-donors: 1
H-acceptors: 4
PSA: 122
Number of rings: 3

     

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