COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK083677
Chemical Name: tetra-tert-butyl2,2'-[6-(ethylamino)-1,3,5-triazine-2,4-diyl]bis(nitropropanedioate)
Smiles: CCNc1nc(nc(n1)C(C(=O)OC(C)(C)C)(C(=O)OC(C)(C)C)[N+](=O)[O-])C(C(=O)OC(C)(C)C)(C(=O)OC(C)(C)C)[N+](=O)[O-]

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Molecular Weight: 642.66
Empirical Formula: C27H42N6O12

Available Amount: 0 mg

Lipinsky:
logP: 13.403
Rotatable bonds: 11
H-donors: 1
H-acceptors: 12
PSA: 247
Number of rings: 1

     

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