COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK675932
Chemical Name: 1-(benzylsulfanyl)-2-methyl-3,5-dinitrobenzene
Smiles: [O-][N+](=O)c1cc(SCc2ccccc2)c(c(c1)[N+](=O)[O-])C

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Molecular Weight: 304.33
Empirical Formula: C14H12N2O4S

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 4.054
Rotatable bonds: 2
H-donors: 0
H-acceptors: 4
PSA: 116
Number of rings: 2

     

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