COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK455504
Chemical Name: 4-[(4-chlorophenyl)sulfonyl]-N-(2-methoxy-4-nitrophenyl)piperazine-1-carbothioamide
Smiles: COc1cc(ccc1NC(=S)N1CCN(CC1)S(=O)(=O)c1ccc(cc1)Cl)[N+](=O)[O-]

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Molecular Weight: 470.96
Empirical Formula: C18H19ClN4O5S2

Physical State: Dry powder
Available Amount: 338 mg

Lipinsky:
logP: 3.735
Rotatable bonds: 1
H-donors: 1
H-acceptors: 5
PSA: 148
Number of rings: 3

     

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