COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL122251
Chemical Name: N-(1-{4-ethyl-5-[(4-nitrobenzyl)sulfanyl]-4H-1,2,4-triazol-3-yl}-2-hydroxyethyl)benzamide
Smiles: CCn1c(SCc2ccc(cc2)[N+](=O)[O-])nnc1C(NC(=O)c1ccccc1)CO

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Molecular Weight: 427.48
Empirical Formula: C20H21N5O4S

Physical State: Dry powder
Available Amount: 53 mg

Lipinsky:
logP: 3.669
Rotatable bonds: 7
H-donors: 2
H-acceptors: 4
PSA: 151
Number of rings: 3

     

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