COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL266631
Chemical Name: 6-(3-nitrophenyl)-3-pentyl-7H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine
Smiles: CCCCCc1nnc2n1N=C(CS2)c1cccc(c1)[N+](=O)[O-]

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Saltdata: HBr
Molecular Weight: 331.4
Empirical Formula: C15H17N5O2S

Available Amount: 0 mg

Lipinsky:
logP: 3.539
Rotatable bonds: 5
H-donors: 0
H-acceptors: 2
PSA: 114
Number of rings: 3

     

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