COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK003634
Chemical Name: 5-[4-(benzylsulfonyl)piperazin-1-yl]-N-(4-chlorobenzyl)-2-nitroaniline
Smiles: Clc1ccc(cc1)CNc1cc(ccc1[N+](=O)[O-])N1CCN(CC1)S(=O)(=O)Cc1ccccc1

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Molecular Weight: 501.01
Empirical Formula: C24H25ClN4O4S

Physical State: Dry powder
Available Amount: 303 mg

Lipinsky:
logP: 6.222
Rotatable bonds: 2
H-donors: 1
H-acceptors: 4
PSA: 106
Number of rings: 4

     

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