COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK020622
Chemical Name: 4-[(E)-{2-[(5-amino-1,3,4-thiadiazol-2-yl)acetyl]hydrazinylidene}methyl]-2-ethoxyphenyl3-nitrobenzoate
Smiles: CCOc1cc(/C=N/NC(=O)Cc2nnc(s2)N)ccc1OC(=O)c1cccc(c1)[N+](=O)[O-]

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Molecular Weight: 470.47
Empirical Formula: C20H18N6O6S

Physical State: Dry powder
Available Amount: 177 mg

Lipinsky:
logP: 3.863
Rotatable bonds: 9
H-donors: 3
H-acceptors: 6
PSA: 202
Number of rings: 3

     

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