COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK194916
Chemical Name: 1-[(4-nitrophenyl)sulfonyl]-4-(2,3,4-trimethoxybenzyl)piperazine
Smiles: COc1ccc(c(c1OC)OC)CN1CCN(CC1)S(=O)(=O)c1ccc(cc1)[N+](=O)[O-]

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Saltdata: C2H2O4
Molecular Weight: 451.5
Empirical Formula: C20H25N3O7S

Physical State: Dry powder
Available Amount: 95 mg

Lipinsky:
logP: 2.706
Rotatable bonds: 4
H-donors: 0
H-acceptors: 7
PSA: 122
Number of rings: 3

     

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