COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK670883
Chemical Name: N-[5-(2,4-dinitrophenyl)-1,3,5-triazinan-2-ylidene]-4-methyl-3-nitrobenzenesulfonamide
Smiles: [O-][N+](=O)c1cc(ccc1N1CN/C(=N/S(=O)(=O)c2ccc(c(c2)[N+](=O)[O-])C)/NC1)[N+](=O)[O-]

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Molecular Weight: 465.4
Empirical Formula: C16H15N7O8S

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 3.253
Rotatable bonds: 1
H-donors: 2
H-acceptors: 8
PSA: 219
Number of rings: 3

     

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