COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK046963
Chemical Name: 1,3,5-triazinane-1,3,5-triyltris[(4-nitrophenyl)methanone]
Smiles: O=C(c1ccc(cc1)[N+](=O)[O-])N1CN(CN(C1)C(=O)c1ccc(cc1)[N+](=O)[O-])C(=O)c1ccc(cc1)[N+](=O)[O-]

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Molecular Weight: 534.44
Empirical Formula: C24H18N6O9

Physical State: Dry powder
Available Amount: 388 mg

Lipinsky:
logP: 0.354
Rotatable bonds: 0
H-donors: 0
H-acceptors: 9
PSA: 198
Number of rings: 4

     

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