COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK381906
Chemical Name: N-benzyl-5-{4-[(2-methyl-1,3-benzothiazol-6-yl)sulfonyl]piperazin-1-yl}-2-nitroaniline
Smiles: Cc1nc2c(s1)cc(cc2)S(=O)(=O)N1CCN(CC1)c1ccc(c(c1)NCc1ccccc1)[N+](=O)[O-]

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Molecular Weight: 523.64
Empirical Formula: C25H25N5O4S2

Physical State: Dry powder
Available Amount: 489 mg

Lipinsky:
logP: 5.726
Rotatable bonds: 2
H-donors: 1
H-acceptors: 4
PSA: 147
Number of rings: 5

     

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