COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK733782
Chemical Name: ethyl(2E)-{[5-(4-methoxyphenyl)-4-methyl-4H-1,2,4-triazol-3-yl]sulfanyl}[2-(4-nitrophenyl)hydrazinylidene]ethanoate
Smiles: CCOC(=O)/C(=N\Nc1ccc(cc1)[N+](=O)[O-])/Sc1nnc(n1C)c1ccc(cc1)OC

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Molecular Weight: 456.48
Empirical Formula: C20H20N6O5S

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 5.867
Rotatable bonds: 5
H-donors: 1
H-acceptors: 5
PSA: 161
Number of rings: 3

     

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