COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK164046
Chemical Name: 3-chloro-N-{[4-(2-chloro-4-nitrophenyl)piperazin-1-yl]carbonothioyl}-4-ethoxybenzamide
Smiles: CCOc1ccc(cc1Cl)C(=O)NC(=S)N1CCN(CC1)c1ccc(cc1Cl)[N+](=O)[O-]

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Molecular Weight: 483.37
Empirical Formula: C20H20Cl2N4O4S

Physical State: Dry powder
Available Amount: 447 mg

Lipinsky:
logP: 4.935
Rotatable bonds: 3
H-donors: 1
H-acceptors: 4
PSA: 122
Number of rings: 3

     

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