COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK205948
Chemical Name: 5-{4-[(3,4-dimethoxyphenyl)sulfonyl]piperazin-1-yl}-N-(2,2-dimethylpropyl)-2-nitroaniline
Smiles: COc1ccc(cc1OC)S(=O)(=O)N1CCN(CC1)c1ccc(c(c1)NCC(C)(C)C)[N+](=O)[O-]

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Molecular Weight: 492.6
Empirical Formula: C23H32N4O6S

Physical State: Dry powder
Available Amount: 116 mg

Lipinsky:
logP: 6.544
Rotatable bonds: 4
H-donors: 1
H-acceptors: 6
PSA: 125
Number of rings: 3

     

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