COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL268228
Chemical Name: 1,1'-[3-(4-methylphenyl)-6-(3-nitrophenyl)-5H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine-5,7-diyl]diethanone
Smiles: Cc1ccc(cc1)c1nnc2n1n(C(=O)C)c(c(s2)C(=O)C)c1cccc(c1)[N+](=O)[O-]

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Molecular Weight: 435.46
Empirical Formula: C21H17N5O4S

Available Amount: 0 mg

Lipinsky:
logP: 3.996
Rotatable bonds: 2
H-donors: 0
H-acceptors: 4
PSA: 139
Number of rings: 4

     

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