COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK735843
Chemical Name: 3-{[4-(ethylsulfonyl)-2-nitrophenyl]sulfanyl}-4-methyl-5-(phenoxymethyl)-4H-1,2,4-triazole
Smiles: CCS(=O)(=O)c1ccc(c(c1)[N+](=O)[O-])Sc1nnc(n1C)COc1ccccc1

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Molecular Weight: 434.5
Empirical Formula: C18H18N4O5S2

Physical State: Dry powder
Available Amount: 57 mg

Lipinsky:
logP: 3.417
Rotatable bonds: 6
H-donors: 0
H-acceptors: 5
PSA: 153
Number of rings: 3

     

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