COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL169329
Chemical Name: 1-(4-amino-1,2,5-oxadiazol-3-yl)-5-[(1,3-benzothiazol-2-ylsulfanyl)methyl]-N'-[(E)-(6-nitro-1,3-benzodioxol-5-yl)methylidene]-1H-1,2,3-triazole-4-carbohydrazide
Smiles: Nc1nonc1n1nnc(c1CSc1nc2c(s1)cccc2)C(=O)N/N=C/c1cc2OCOc2cc1[N+](=O)[O-]

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Molecular Weight: 566.54
Empirical Formula: C21H14N10O6S2

Physical State: Dry powder
Available Amount: 62 mg

Lipinsky:
logP: 1.98
Rotatable bonds: 6
H-donors: 3
H-acceptors: 6
PSA: 267
Number of rings: 6

     

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