COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL054105
Chemical Name: 1-(4-{[5-(2-chloro-4-nitrophenyl)furan-2-yl]carbonothioyl}piperazin-1-yl)ethanone
Smiles: CC(=O)N1CCN(CC1)C(=S)c1ccc(o1)c1ccc(cc1Cl)[N+](=O)[O-]

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Molecular Weight: 393.85
Empirical Formula: C17H16ClN3O4S

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 1.42
Rotatable bonds: 2
H-donors: 0
H-acceptors: 4
PSA: 114
Number of rings: 3

     

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