COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL354917
Chemical Name: 4-{[5-(5-bromo-2-hydroxyphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-3-nitrobenzaldehyde
Smiles: O=Cc1ccc(c(c1)[N+](=O)[O-])Sc1nnc([nH]1)c1cc(Br)ccc1O

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Molecular Weight: 421.23
Empirical Formula: C15H9BrN4O4S

Physical State: Dry powder
Available Amount: 340 mg

Lipinsky:
logP: 6.065
Rotatable bonds: 5
H-donors: 2
H-acceptors: 4
PSA: 149
Number of rings: 3

     

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