COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK172360
Chemical Name: 1-[(4-chlorophenyl)sulfonyl]-4-{3-[(4-methyl-4H-1,2,4-triazol-3-yl)sulfanyl]-4-nitrophenyl}piperazine
Smiles: Clc1ccc(cc1)S(=O)(=O)N1CCN(CC1)c1ccc(c(c1)Sc1nncn1C)[N+](=O)[O-]

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Molecular Weight: 494.98
Empirical Formula: C19H19ClN6O4S2

Physical State: Dry powder
Available Amount: 100 mg

Lipinsky:
logP: 4.179
Rotatable bonds: 2
H-donors: 0
H-acceptors: 4
PSA: 150
Number of rings: 4

     

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