COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK712211
Chemical Name: 8-[(5-{4-[(4-chlorophenyl)sulfonyl]piperazin-1-yl}-2-nitrophenyl)sulfanyl]quinoline
Smiles: Clc1ccc(cc1)S(=O)(=O)N1CCN(CC1)c1ccc(c(c1)Sc1cccc2c1nccc2)[N+](=O)[O-]

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Molecular Weight: 541.05
Empirical Formula: C25H21ClN4O4S2

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 6.32
Rotatable bonds: 2
H-donors: 0
H-acceptors: 4
PSA: 133
Number of rings: 5

     

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