COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK172046
Chemical Name: 5-{4-[(3,4-dimethoxyphenyl)sulfonyl]piperazin-1-yl}-N-(furan-2-ylmethyl)-2-nitroaniline
Smiles: COc1cc(ccc1OC)S(=O)(=O)N1CCN(CC1)c1ccc(c(c1)NCc1ccco1)[N+](=O)[O-]

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Molecular Weight: 502.55
Empirical Formula: C23H26N4O7S

Physical State: Dry powder
Available Amount: 240 mg

Lipinsky:
logP: 5.479
Rotatable bonds: 5
H-donors: 1
H-acceptors: 7
PSA: 138
Number of rings: 4

     

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