COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK171924
Chemical Name: 1-[(3,4-dimethoxyphenyl)sulfonyl]-4-(2-nitrophenyl)piperazine
Smiles: COc1cc(ccc1OC)S(=O)(=O)N1CCN(CC1)c1ccccc1[N+](=O)[O-]

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Molecular Weight: 407.45
Empirical Formula: C18H21N3O6S

Physical State: Dry powder
Available Amount: 122 mg

Lipinsky:
logP: 4.426
Rotatable bonds: 3
H-donors: 0
H-acceptors: 6
PSA: 113
Number of rings: 3

     

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