COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK060591
Chemical Name: hexamethyl2,2',2''-(1,3,5-triazine-2,4,6-triyl)tris(nitropropanedioate)
Smiles: COC(=O)C(c1nc(nc(n1)C(C(=O)OC)(C(=O)OC)[N+](=O)[O-])C(C(=O)OC)(C(=O)OC)[N+](=O)[O-])(C(=O)OC)[N+](=O)[O-]

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Molecular Weight: 606.37
Empirical Formula: C18H18N6O18

Physical State: Dry powder
Available Amount: 7 mg

Lipinsky:
logP: 11.754
Rotatable bonds: 12
H-donors: 0
H-acceptors: 18
PSA: 333
Number of rings: 1

     

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