COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK150225
Chemical Name: 5-{4-[(4-bromophenyl)sulfonyl]piperazin-1-yl}-2-nitro-N-(pyridin-3-ylmethyl)aniline
Smiles: Brc1ccc(cc1)S(=O)(=O)N1CCN(CC1)c1ccc(c(c1)NCc1cccnc1)[N+](=O)[O-]

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Molecular Weight: 532.42
Empirical Formula: C22H22BrN5O4S

Physical State: Dry powder
Available Amount: 166 mg

Lipinsky:
logP: 5.08
Rotatable bonds: 2
H-donors: 1
H-acceptors: 4
PSA: 119
Number of rings: 4

     

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