COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL171284
Chemical Name: 1,1'-(5,5'-dinitro-2H,2'H-3,3'-bi-1,2,4-triazole-2,2'-diyl)dipropan-2-one
Smiles: CC(=O)Cn1nc(nc1c1nc(nn1CC(=O)C)[N+](=O)[O-])[N+](=O)[O-]

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Molecular Weight: 338.24
Empirical Formula: C10H10N8O6

Physical State: Dry powder
Available Amount: 21 mg

Lipinsky:
logP: -0.245
Rotatable bonds: 5
H-donors: 0
H-acceptors: 6
PSA: 187
Number of rings: 2

     

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